*HEADER    TOXIN                                   27-JAN-09   2W9O
*TITLE     SOLUTION STRUCTURE OF JERDOSTATIN FROM TRIMERESURUS
*TITLE    2 JERDONII
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: SHORT DISINTEGRIN JERDOSTATIN;
*COMPND   3 CHAIN: A;
*COMPND   4 FRAGMENT: RESIDUES 68-110;
*COMPND   5 SYNONYM: JERDOSTATIN;
*COMPND   6 ENGINEERED: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: TRIMERESURUS JERDONII;
*SOURCE   3 ORGANISM_COMMON: JERDON'S PIT-VIPER;
*SOURCE   4 ORGANISM_TAXID: 135726;
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 469008;
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET-32A
*KEYWDS    VIPER, VENOM, TOXIN, SECRETED, DISINTEGRINS, CELL ADHESION,
*KEYWDS   2 BLOOD COAGULATION
*EXPDTA    SOLUTION NMR
*AUTHOR    R.J.CARBAJO,L.SANZ,S.MOSULEN,J.J.CALVETE,A.PINEDA-LUCENA
*REVDAT   1   28-JAN-09 2W9O    0




! 
! RTS-jerdostatin
!

! UNAMBIGUOUS CONSTRAINTS


!A1   residue processed in j-RTS

!M2   residue processed in j-RTS


!D3

assign (residue 3 and name HN) (residue 3 and name HA) 5.0 5.0 0.0 ! 040407

assign (residue 3 and name HN) (residue 3 and name HB#) 5.0 5.0 0.0 ! 040407

assign (residue 3 and name HA) (residue 4 and name HN) 5.0 5.0 0.0 ! 131107


!C4

assign (residue 4 and name HN) (residue 4 and name HA) 5.0 5.0 0.0 ! 131107

assign (residue 4 and name HN) (residue 4 and name HB#) 5.0 5.0 0.0 ! 131107

assign (residue 4 and name HA) (residue 5 and name HN) 3.5 3.5 0.0 ! 131107

assign (residue 4 and name HB#) (residue 5 and name HN) 5.0 5.0 0.0 ! 131107


!T5

assign (residue 5 and name HN) (residue 5 and name HA) 5.0 5.0 0.0 ! 100407

assign (residue 5 and name HN) (residue 5 and name HB) 5.0 5.0 0.0 ! 100407

assign (residue 5 and name HN) (residue 5 and name HG2#) 5.0 5.0 0.0 ! 100407

assign (residue 5 and name HA) (residue 6 and name HN) 2.5 2.5 0.0 ! 100407 ! changed 140208

assign (residue 5 and name HB) (residue 6 and name HN) 5.0 5.0 0.0 ! 100407

assign (residue 5 and name HG2#) (residue 6 and name HN) 5.0 5.0 0.0 ! 100407

assign (residue 5 and name HN) (residue 13 and name HA) 6.0 6.0 0.0 ! 140508

assign (residue 5 and name HA) (residue 37 and name HN) 5.0 5.0 0.0 ! 100407 ! changed 140508

assign (residue 5 and name HG2#) (residue 37 and name HN) 6.0 6.0 0.0 ! 100407

assign (residue 5 and name HG2#) (residue 37 and name HB#) 5.0 5.0 0.0 ! 100407


!T6

assign (residue 6 and name HN) (residue 6 and name HA) 5.0 5.0 0.0 ! 100407

assign (residue 6 and name HN) (residue 6 and name HB) 5.0 5.0 0.0 ! 100407

assign (residue 6 and name HN) (residue 6 and name HG2#) 5.0 5.0 0.0 ! 100407

assign (residue 6 and name HA) (residue 7 and name HN) 2.5 2.5 0.0 ! 100407

assign (residue 6 and name HB) (residue 7 and name HN) 5.0 5.0 0.0 ! 100407

assign (residue 6 and name HG2#) (residue 7 and name HN) 5.0 5.0 0.0 ! 100407

assign (residue 6 and name HA) (residue 10 and name HB#) 6.0 6.0 0.0 ! 141107

assign (residue 6 and name HG2#) (residue 14 and name HN) 6.0 6.0 0.0 ! 240906 ! removed 130207 ! 140508


!G7

assign (residue 7 and name HN) (residue 7 and name HA#) 5.0 5.0 0.0 ! 100407

assign (residue 7 and name HN) (residue 8 and name HD#) 6.0 6.0 0.0 ! 100407

assign (residue 7 and name HA#) (residue 8 and name HD#) 3.5 3.5 0.0 ! 100407

assign (residue 7 and name HN) (residue 10 and name HB#) 5.0 5.0 0.0 ! 100407

assign (residue 7 and name HN) (residue 37 and name HB#) 6.0 6.0 0.0 ! 100407

assign (residue 7 and name HA#) (residue 37 and name HB#) 6.0 6.0 0.0 ! 100407


!P8

assign (residue 8 and name HA) (residue 9 and name HN) 6.0 6.0 0.0 ! 100407

assign (residue 8 and name HB#) (residue 9 and name HN) 5.0 5.0 0.0 ! 100407

assign (residue 8 and name HG#) (residue 9 and name HN) 5.0 5.0 0.0 ! 100407

assign (residue 8 and name HD#) (residue 9 and name HN) 6.0 6.0 0.0 ! 100407

assign (residue 8 and name HB#) (residue 22 and name HB#) 5.0 5.0 0.0 ! 100407

assign (residue 8 and name HD#) (residue 37 and name HB#) 5.0 5.0 0.0 ! 110407

assign (residue 8 and name HD#) (residue 38 and name HA) 5.0 5.0 0.0 ! 110407

assign (residue 8 and name HG#) (residue 39 and name HN) 5.0 5.0 0.0 ! 110407

assign (residue 8 and name HD#) (residue 39 and name HN) 5.0 5.0 0.0 ! 110407

assign (residue 8 and name HB#) (residue 39 and name HB#) 5.0 5.0 0.0 ! 050906

assign (residue 8 and name HG#) (residue 39 and name HB#) 5.0 5.0 0.0 ! 050906


!C9

assign (residue 9 and name HN) (residue 9 and name HA) 5.0 5.0 0.0 ! 110407

assign (residue 9 and name HN) (residue 9 and name HB#) 5.0 5.0 0.0 ! 110407

assign (residue 9 and name HN) (residue 10 and name HN) 3.5 3.5 0.0 ! 110407

assign (residue 9 and name HA) (residue 10 and name HN) 5.0 5.0 0.0 ! 110407

assign (residue 9 and name HB#) (residue 15 and name HD#) 6.0 6.0 0.0 ! 141107 ! changed 200208

assign (residue 9 and name HA) (residue 16 and name HB#) 5.0 5.0 0.0 ! 110407

assign (residue 9 and name HA) (residue 16 and name HG#) 5.0 5.0 0.0 ! 110407

assign (residue 9 and name HA) (residue 16 and name HD#) 5.0 5.0 0.0 ! 110407

assign (residue 9 and name HN) (residue 37 and name HA) 5.0 5.0 0.0 ! 110407

assign (residue 9 and name HN) (residue 37 and name HB#) 5.0 5.0 0.0 ! 110407

assign (residue 9 and name HB#) (residue 37 and name HA) 3.5 3.5 0.0 ! 110407

assign (residue 9 and name HB#) (residue 39 and name HA) 6.0 6.0 0.0 ! 110407



!C10

assign (residue 10 and name HN) (residue 10 and name HA) 5.0 5.0 0.0 ! 110407

assign (residue 10 and name HN) (residue 10 and name HB#) 5.0 5.0 0.0 ! 110407

assign (residue 10 and name HN) (residue 11 and name HN) 5.0 5.0 0.0 ! 110407

assign (residue 10 and name HA) (residue 11 and name HN) 3.5 3.5 0.0 ! 110407

assign (residue 10 and name HB#) (residue 11 and name HN) 5.0 5.0 0.0 ! 110407 ! changed 140208

assign (residue 10 and name HB#) (residue 13 and name HN) 6.0 6.0 0.0 ! 141107

assign (residue 10 and name HB#) (residue 14 and name HN) 6.0 6.0 0.0 ! 141107

assign (residue 10 and name HA) (residue 15 and name HA) 5.0 5.0 0.0 ! 141107

assign (residue 10 and name HA) (residue 15 and name HD#) 6.0 6.0 0.0 ! 141107 ! changed 200208

assign (residue 10 and name HN) (residue 16 and name HB#) 5.0 5.0 0.0 ! 110407

assign (residue 10 and name HN) (residue 16 and name HE#) 5.0 5.0 0.0 ! 110407

assign (residue 10 and name HA) (residue 16 and name HN) 3.5 3.5 0.0 ! 170806 ! changed 080906

assign (residue 10 and name HA) (residue 16 and name HG#) 5.0 5.0 0.0 ! 110407

assign (residue 10 and name HA) (residue 16 and name HD#) 6.0 6.0 0.0 ! 110407

assign (residue 10 and name HN) (residue 37 and name HA) 5.0 5.0 0.0 ! 110407

assign (residue 10 and name HN) (residue 37 and name HB#) 5.0 5.0 0.0 ! 110407

assign (residue 10 and name HB#) (residue 37 and name HB#) 6.0 6.0 0.0 ! 110407


!R11

assign (residue 11 and name HN) (residue 11 and name HA) 5.0 5.0 0.0 ! 230407

assign (residue 11 and name HN) (residue 11 and name HB#) 5.0 5.0 0.0 ! 230407

assign (residue 11 and name HN) (residue 11 and name HG#) 5.0 5.0 0.0 ! 230407

assign (residue 11 and name HN) (residue 11 and name HD#) 5.0 5.0 0.0 ! 230407

assign (residue 11 and name HA) (residue 12 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 11 and name HA) (residue 13 and name HN) 5.0 5.0 0.0 ! 230407

assign (residue 11 and name HN) (residue 14 and name HN) 3.5 3.5 0.0 ! 120407

assign (residue 11 and name HN) (residue 14 and name HB#) 5.0 5.0 0.0 ! 031207

assign (residue 11 and name HN) (residue 15 and name HA) 5.0 5.0 0.0 ! 230407

assign (residue 11 and name HN) (residue 15 and name HD#) 6.0 6.0 0.0 ! 230407

assign (residue 11 and name HN) (residue 16 and name HN) 5.0 5.0 0.0 ! 230407

assign (residue 11 and name HN) (residue 16 and name HG#) 5.0 5.0 0.0 ! 191107

assign (residue 11 and name HN) (residue 16 and name HD#) 5.0 5.0 0.0 ! 140508

assign (residue 11 and name HN) (residue 16 and name HE#) 5.0 5.0 0.0 ! 230407


!Q12

assign (residue 12 and name HN) (residue 12 and name HA) 5.0 5.0 0.0 ! 170806

assign (residue 12 and name HN) (residue 13 and name HN) 5.0 5.0 0.0 ! 230407

assign (residue 12 and name HA) (residue 13 and name HN) 3.5 3.5 0.0 ! 120407

assign (residue 12 and name HB#) (residue 13 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 12 and name HG#) (residue 13 and name HN) 5.0 5.0 0.0 ! 230407

assign (residue 12 and name HB#) (residue 14 and name HN) 6.0 6.0 0.0 ! 230407



!C13

assign (residue 13 and name HN) (residue 13 and name HA) 5.0 5.0 0.0 ! 240407

assign (residue 13 and name HN) (residue 13 and name HB#) 5.0 5.0 0.0 ! 240407

assign (residue 13 and name HN) (residue 14 and name HN) 3.5 3.5 0.0 ! 120407 ! changed 140208

assign (residue 13 and name HA) (residue 14 and name HN) 5.0 5.0 0.0 ! 240407

assign (residue 13 and name HB#) (residue 14 and name HN) 5.0 5.0 0.0 ! 240407



!K14

assign (residue 14 and name HN) (residue 14 and name HA) 5.0 5.0 0.0 ! 240407

assign (residue 14 and name HN) (residue 14 and name HB#) 5.0 5.0 0.0 ! 240407

assign (residue 14 and name HN) (residue 14 and name HG#) 5.0 5.0 0.0 ! 240407

assign (residue 14 and name HN) (residue 15 and name HA) 5.0 5.0 0.0 ! 240407

assign (residue 14 and name HN) (residue 15 and name HN) 5.0 5.0 0.0 ! 240407

assign (residue 14 and name HA) (residue 15 and name HN) 2.5 2.5 0.0 ! 120407

assign (residue 14 and name HB#) (residue 15 and name HN) 5.0 5.0 0.0 ! 120407 ! changed 140208

assign (residue 14 and name HG#) (residue 15 and name HN) 5.0 5.0 0.0 ! 240407


!L15

assign (residue 15 and name HN) (residue 15 and name HA) 5.0 5.0 0.0 ! 240407

assign (residue 15 and name HN) (residue 15 and name HB#) 5.0 5.0 0.0 ! 240407

assign (residue 15 and name HN) (residue 15 and name HG) 5.0 5.0 0.0 ! 240407

assign (residue 15 and name HN) (residue 15 and name HD#) 5.0 5.0 0.0 ! 240407

assign (residue 15 and name HA) (residue 16 and name HN) 2.5 2.5 0.0 ! 120407

assign (residue 15 and name HA) (residue 16 and name HG#) 6.0 6.0 0.0 ! 240407

assign (residue 15 and name HB#) (residue 16 and name HN) 5.0 5.0 0.0 ! 240407

assign (residue 15 and name HG) (residue 16 and name HN) 5.0 5.0 0.0 ! 140508

assign (residue 15 and name HD#) (residue 16 and name HN) 5.0 5.0 0.0 ! 240407

assign (residue 15 and name HD#) (residue 18 and name HN) 6.0 6.0 0.0 ! 240407

assign (residue 15 and name HD#) (residue 33 and name HN) 6.0 6.0 0.0 ! 240407

assign (residue 15 and name HD#) (residue 34 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 15 and name HB#) (residue 34 and name HN) 6.0 6.0 0.0 ! 240407

assign (residue 15 and name HD#) (residue 35 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 15 and name HD#) (residue 35 and name HA) 5.0 5.0 0.0 ! 191107

assign (residue 15 and name HB#) (residue 36 and name HN) 6.0 6.0 0.0 ! 240407

assign (residue 15 and name HD#) (residue 36 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 15 and name HD#) (residue 36 and name HA) 5.0 5.0 0.0 ! 120407

assign (residue 15 and name HD#) (residue 36 and name HB#) 5.0 5.0 0.0 ! 240407

assign (residue 15 and name HB#) (residue 37 and name HN) 6.0 6.0 0.0 ! 240407

assign (residue 15 and name HD#) (residue 37 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 15 and name HD#) (residue 37 and name HA) 5.0 5.0 0.0 ! 191107

assign (residue 15 and name HD#) (residue 38 and name HN) 6.0 6.0 0.0 ! 290806 ! changed 201207




!K16

assign (residue 16 and name HN) (residue 16 and name HA) 5.0 5.0 0.0 ! 240407

assign (residue 16 and name HN) (residue 16 and name HB#) 5.0 5.0 0.0 ! 240407

assign (residue 16 and name HN) (residue 16 and name HG#) 5.0 5.0 0.0 ! 240407

assign (residue 16 and name HN) (residue 16 and name HD#) 5.0 5.0 0.0 ! 240407

assign (residue 16 and name HA) (residue 17 and name HD#) 2.5 2.5 0.0 ! 120407

assign (residue 16 and name HG#) (residue 17 and name HD#) 6.0 6.0 0.0 ! 240407

assign (residue 16 and name HA) (residue 20 and name HG2#) 5.0 5.0 0.0 ! 240407

assign (residue 16 and name HB#) (residue 20 and name HB) 6.0 6.0 0.0 ! 191107

assign (residue 16 and name HB#) (residue 20 and name HG2#) 5.0 5.0 0.0 ! 191107

assign (residue 16 and name HD#) (residue 20 and name HG2#) 5.0 5.0 0.0 ! 240407

assign (residue 16 and name HE#) (residue 20 and name HG2#) 6.0 6.0 0.0 ! 240407



!P17

assign (residue 17 and name HA) (residue 18 and name HN) 2.2 2.2 0.0 ! 120407

assign (residue 17 and name HB#) (residue 18 and name HN) 3.5 3.5 0.0 ! 120407

assign (residue 17 and name HA) (residue 18 and name HB#) 5.0 5.0 0.0 ! 191107

assign (residue 17 and name HB#) (residue 18 and name HB#) 5.0 5.0 0.0 ! 240407

assign (residue 17 and name HB#) (residue 20 and name HN) 5.0 5.0 0.0 ! 240407

assign (residue 17 and name HD#) (residue 20 and name HG2#) 5.0 5.0 0.0 ! 240407



!A18

assign (residue 18 and name HN) (residue 18 and name HA) 5.0 5.0 0.0 ! 240407

assign (residue 18 and name HN) (residue 18 and name HB#) 5.0 5.0 0.0 ! 240407

assign (residue 18 and name HN) (residue 19 and name HN) 6.0 6.0 0.0 ! 191107

assign (residue 18 and name HA) (residue 19 and name HN) 2.5 2.5 0.0 ! 120407

assign (residue 18 and name HB#) (residue 19 and name HN) 5.0 5.0 0.0 ! 240407

assign (residue 18 and name HB#) (residue 19 and name HA#) 5.0 5.0 0.0 ! 240407

assign (residue 18 and name HN) (residue 20 and name HN) 6.0 6.0 0.0 ! 240407

assign (residue 18 and name HB#) (residue 20 and name HN) 5.0 5.0 0.0 ! 240407

assign (residue 18 and name HA) (residue 20 and name HN) 5.0 5.0 0.0 ! 240407

assign (residue 18 and name HN) (residue 32 and name HB#) 6.0 6.0 0.0 !

assign (residue 18 and name HA) (residue 32 and name HN) 6.0 6.0 0.0 ! 240407

assign (residue 18 and name HA) (residue 33 and name HA) 6.0 6.0 0.0 ! 191107

assign (residue 18 and name HB#) (residue 33 and name HA) 5.0 5.0 0.0 ! 240407

assign (residue 18 and name HA) (residue 34 and name HN) 6.0 6.0 0.0 ! 140508

assign (residue 18 and name HN) (residue 34 and name HA#) 3.5 3.5 0.0 ! 120407

assign (residue 18 and name HB#) (residue 34 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 18 and name HB#) (residue 34 and name HA#) 5.0 5.0 0.0 ! 240407



!G19

assign (residue 19 and name HN) (residue 19 and name HA#) 5.0 5.0 0.0 ! 250407

assign (residue 19 and name HN) (residue 20 and name HN) 3.5 3.5 0.0 ! 250407

assign (residue 19 and name HA#) (residue 20 and name HN) 3.5 3.5 0.0 ! 250407

assign (residue 19 and name HN) (residue 31 and name HB#) 5.0 5.0 0.0 ! 120407

assign (residue 19 and name HA#) (residue 31 and name HA) 6.0 6.0 0.0 ! 191107

assign (residue 19 and name HA#) (residue 31 and name HB#) 5.0 5.0 0.0 ! 120407

assign (residue 19 and name HA#) (residue 31 and name HD#) 5.0 5.0 0.0 ! 120407

assign (residue 19 and name HA#) (residue 31 and name HE#) 6.0 6.0 0.0 ! 120407 ! changed 080208

assign (residue 19 and name HN) (residue 32 and name HN) 5.0 5.0 0.0 ! 140508

assign (residue 19 and name HN) (residue 32 and name HB#) 6.0 6.0 0.0 ! 191107

assign (residue 19 and name HN) (residue 33 and name HA) 5.0 5.0 0.0 ! 120407


!T20

assign (residue 20 and name HN) (residue 20 and name HA) 5.0 5.0 0.0 ! 120407

assign (residue 20 and name HN) (residue 20 and name HB) 5.0 5.0 0.0 ! 120407

assign (residue 20 and name HN) (residue 20 and name HG2#) 5.0 5.0 0.0 ! 120407

assign (residue 20 and name HN) (residue 21 and name HN) 5.0 5.0 0.0 ! 250407

assign (residue 20 and name HN) (residue 21 and name HG2#) 6.0 6.0 0.0 ! 250407

assign (residue 20 and name HA) (residue 21 and name HN) 2.5 2.5 0.0 ! 120407

assign (residue 20 and name HB) (residue 21 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 20 and name HG2#) (residue 21 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 20 and name HG2#) (residue 21 and name HA) 5.0 5.0 0.0 ! 030507

assign (residue 20 and name HG2#) (residue 21 and name HB) 5.0 5.0 0.0 ! 140208

assign (residue 20 and name HG2#) (residue 22 and name HB#) 6.0 6.0 0.0 ! 191107

assign (residue 20 and name HN) (residue 31 and name HB#) 6.0 6.0 0.0 ! 191107

assign (residue 20 and name HA) (residue 31 and name HD#) 5.0 5.0 0.0 ! 030507

assign (residue 20 and name HN) (residue 32 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 20 and name HN) (residue 32 and name HB#) 5.0 5.0 0.0 ! 120407

assign (residue 20 and name HB) (residue 32 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 20 and name HB) (residue 32 and name HB#) 5.0 5.0 0.0 ! 030507

assign (residue 20 and name HG2#) (residue 32 and name HN) 6.0 6.0 0.0 ! 030507

assign (residue 20 and name HG2#) (residue 32 and name HB#) 6.0 6.0 0.0 ! 191107



!T21

assign (residue 21 and name HN) (residue 21 and name HA) 5.0 5.0 0.0 ! 030507

assign (residue 21 and name HN) (residue 21 and name HB) 5.0 5.0 0.0 ! 030507

assign (residue 21 and name HN) (residue 21 and name HG2#) 5.0 5.0 0.0 ! 030507

assign (residue 21 and name HA) (residue 22 and name HN) 3.5 3.5 0.0 ! 120407

assign (residue 21 and name HB) (residue 22 and name HN) 5.0 5.0 0.0 ! 030507

assign (residue 21 and name HG2#) (residue 22 and name HN) 5.0 5.0 0.0 ! 030507

assign (residue 21 and name HG2#) (residue 23 and name HN) 5.0 5.0 0.0 ! 140508

assign (residue 21 and name HA) (residue 30 and name HN) 6.0 6.0 0.0 ! 030507 ! changed 080208

assign (residue 21 and name HG2#) (residue 30 and name HN) 5.0 5.0 0.0 ! 030507 ! changed 080208 ! changed 140508

assign (residue 21 and name HN) (residue 31 and name HD#) 5.0 5.0 0.0 ! 050507 ! changed 080208 ! changed 140508

assign (residue 21 and name HA) (residue 31 and name HA) 5.0 5.0 0.0 ! 050507

assign (residue 21 and name HA) (residue 31 and name HD#) 3.5 3.5 0.0 ! 050507 ! changed 080208

assign (residue 21 and name HA) (residue 31 and name HE#) 5.0 5.0 0.0 ! 050507

assign (residue 21 and name HB) (residue 31 and name HE#) 6.0 6.0 0.0 ! 140508

assign (residue 21 and name HG2#) (residue 31 and name HD#) 5.0 5.0 0.0 ! 120407

assign (residue 21 and name HG2#) (residue 31 and name HE#) 3.5 3.5 0.0 ! 050507 ! changed 080208

assign (residue 21 and name HA) (residue 32 and name HN) 5.0 5.0 0.0 ! 050507



!C22

assign (residue 22 and name HN) (residue 22 and name HA) 5.0 5.0 0.0 ! 070507

assign (residue 22 and name HN) (residue 22 and name HB#) 5.0 5.0 0.0 ! 070507

assign (residue 22 and name HN) (residue 23 and name HN) 5.0 5.0 0.0 ! 140508

assign (residue 22 and name HB#) (residue 23 and name HN) 5.0 5.0 0.0 ! 140508

assign (residue 22 and name HN) (residue 30 and name HN) 6.0 6.0 0.0 ! 201107

assign (residue 22 and name HN) (residue 31 and name HA) 5.0 5.0 0.0 ! 120407

assign (residue 22 and name HN) (residue 31 and name HD#) 5.0 5.0 0.0 ! 140508

assign (residue 22 and name HN) (residue 32 and name HN) 5.0 5.0 0.0 ! 070507

assign (residue 22 and name HB#) (residue 32 and name HN) 6.0 6.0 0.0 ! 070507 ! changed 140208

assign (residue 22 and name HB#) (residue 39 and name HB#) 6.0 6.0 0.0 ! 070507 ! changed 140208



!W23

assign (residue 23 and name HA) (residue 24 and name HN) 3.5 3.5 0.0 ! 201107

assign (residue 23 and name HD1) (residue 25 and name HG2#) 5.0 5.0 0.0 ! 140508

assign (residue 23 and name HE1) (residue 25 and name HG2#) 5.0 5.0 0.0 ! 120407

assign (residue 23 and name HZ2) (residue 25 and name HG2#) 5.0 5.0 0.0 ! 201107 ! changed 201207 ! changed 080208 ! changed 140508

assign (residue 23 and name HH2) (residue 25 and name HG2#) 6.0 6.0 0.0 ! changed 201207

assign (residue 23 and name HZ3) (residue 25 and name HG2#) 6.0 6.0 0.0 ! 140508

assign (residue 23 and name HZ3) (residue 28 and name HB#) 5.0 5.0 0.0 ! 201107 ! changed 140508

assign (residue 23 and name HB#) (residue 30 and name HB#) 6.0 6.0 0.0 ! 201107




!R24

assign (residue 24 and name HA) (residue 25 and name HN) 3.5 3.5 0.0 ! 221107

assign (residue 24 and name HB#) (residue 25 and name HN) 5.0 5.0 0.0 ! 221107

assign (residue 24 and name HG#) (residue 25 and name HN) 5.0 5.0 0.0 ! 140508

assign (residue 24 and name HA) (residue 28 and name HN) 6.0 6.0 0.0 ! 221107





!T25

assign (residue 25 and name HN) (residue 25 and name HA) 5.0 5.0 0.0 ! 080507

assign (residue 25 and name HN) (residue 25 and name HB) 5.0 5.0 0.0 ! 080507

assign (residue 25 and name HN) (residue 25 and name HG2#) 5.0 5.0 0.0 ! 080507

assign (residue 25 and name HN) (residue 26 and name HN) 5.0 5.0 0.0 ! 221107

assign (residue 25 and name HA) (residue 26 and name HN) 3.5 3.5 0.0 ! 120407

assign (residue 25 and name HG2#) (residue 26 and name HN) 5.0 5.0 0.0 ! 080507

assign (residue 25 and name HN) (residue 28 and name HN) 5.0 5.0 0.0 ! 080507 ! changed 201207 ! changed 140208



!S26

assign (residue 26 and name HN) (residue 26 and name HA) 5.0 5.0 0.0 ! 080507

assign (residue 26 and name HN) (residue 26 and name HB#) 5.0 5.0 0.0 ! 080507

assign (residue 26 and name HN) (residue 27 and name HN) 3.5 3.5 0.0 ! 120407 ! changed 201207

assign (residue 26 and name HA) (residue 27 and name HN) 3.5 3.5 0.0 ! 080507 ! changed 140508

assign (residue 26 and name HB#) (residue 27 and name HN) 5.0 5.0 0.0 ! 080507

assign (residue 26 and name HN) (residue 27 and name HB) 6.0 6.0 0.0 ! 140508

assign (residue 26 and name HB#) (residue 27 and name HG1#) 6.0 6.0 0.0 ! 221107 ! changed 201207

assign (residue 26 and name HB#) (residue 27 and name HG2#) 6.0 6.0 0.0 ! 221107 ! changed 201207

assign (residue 26 and name HN) (residue 28 and name HN)  5.0 5.0 0.0 ! 080507



!V27

assign (residue 27 and name HN) (residue 27 and name HA) 5.0 5.0 0.0 ! 080507

assign (residue 27 and name HN) (residue 27 and name HB) 5.0 5.0 0.0 ! 080507

assign (residue 27 and name HN) (residue 27 and name HG#) 5.0 5.0 0.0 ! 080507

assign (residue 27 and name HN) (residue 28 and name HN) 2.5 2.5 0.0 ! 120407 ! changed 140208

assign (residue 27 and name HA) (residue 28 and name HN) 3.5 3.5 0.0 ! 080507 ! changed 201207

assign (residue 27 and name HB) (residue 28 and name HN) 5.0 5.0 0.0 ! 080507

assign (residue 27 and name HG#) (residue 28 and name HN) 5.0 5.0 0.0 ! 080507

assign (residue 27 and name HG1#) (residue 28 and name HB#) 5.0 5.0 0.0 ! 080507! changed 201207

assign (residue 27 and name HG2#) (residue 28 and name HB#) 5.0 5.0 0.0 ! 080507! changed 201207



!S28

assign (residue 28 and name HN) (residue 28 and name HA) 5.0 5.0 0.0 ! 080507

assign (residue 28 and name HN) (residue 28 and name HB#) 5.0 5.0 0.0 ! 080507

assign (residue 28 and name HA) (residue 29 and name HN) 3.5 3.5 0.0 ! 080507 ! changed 140208

assign (residue 28 and name HB#) (residue 29 and name HN) 5.0 5.0 0.0 ! 080507




!S29

assign (residue 29 and name HN) (residue 29 and name HA) 5.0 5.0 0.0 ! 080507

assign (residue 29 and name HN) (residue 29 and name HB#) 5.0 5.0 0.0 ! 080507

assign (residue 29 and name HA) (residue 30 and name HN) 3.5 3.5 0.0 ! 080507 ! changed 080208

assign (residue 29 and name HB#) (residue 30 and name HN) 5.0 5.0 0.0 ! 281107

assign (residue 29 and name HB#) (residue 31 and name HE#) 5.0 5.0 0.0 ! 140508




!H30

assign (residue 30 and name HN) (residue 30 and name HA) 5.0 5.0 0.0 ! 090507

assign (residue 30 and name HN) (residue 30 and name HB#) 5.0 5.0 0.0 ! 090507

assign (residue 30 and name HN) (residue 30 and name HD2) 5.0 5.0 0.0 ! 281107

assign (residue 30 and name HA) (residue 31 and name HN) 5.0 5.0 0.0 ! 090507

assign (residue 30 and name HB#) (residue 31 and name HN) 5.0 5.0 0.0 ! 140508

assign (residue 30 and name HE1) (residue 41 and name HA) 5.0 5.0 0.0 ! 120407

assign (residue 30 and name HE1) (residue 41 and name HB#) 6.0 6.0 0.0 ! 140508

assign (residue 30 and name HD2) (residue 43 and name HA) 5.0 5.0 0.0 ! 140508

assign (residue 30 and name HD2) (residue 43 and name HB#) 5.0 5.0 0.0 ! 140508



!Y31

assign (residue 31 and name HN) (residue 31 and name HA) 5.0 5.0 0.0 ! 090507

assign (residue 31 and name HN) (residue 31 and name HB#) 5.0 5.0 0.0 ! 090507

assign (residue 31 and name HN) (residue 31 and name HD#) 5.0 5.0 0.0 ! 090507

assign (residue 31 and name HA) (residue 32 and name HN) 2.5 2.5 0.0 ! 120407 ! changed 080208

assign (residue 31 and name HB#) (residue 32 and name HN) 5.0 5.0 0.0 ! 090507

assign (residue 31 and name HD#) (residue 32 and name HN) 6.0 6.0 0.0 ! 090507 ! changed 080208

assign (residue 31 and name HD#) (residue 44 and name HA#) 6.0 6.0 0.0 ! 291107 ! changed 080208

assign (residue 31 and name HE#) (residue 44 and name HA#) 6.0 6.0 0.0 ! 291107 ! changed 080208



!C32

assign (residue 32 and name HN) (residue 32 and name HA) 5.0 5.0 0.0 ! 090507

assign (residue 32 and name HN) (residue 32 and name HB#) 5.0 5.0 0.0 ! 090507

assign (residue 32 and name HN) (residue 33 and name HN) 5.0 5.0 0.0 ! 090507

assign (residue 32 and name HA) (residue 33 and name HN) 2.5 2.5 0.0 ! 120407 ! changed 140208

assign (residue 32 and name HA) (residue 33 and name HG2#) 5.0 5.0 0.0 ! 090507

assign (residue 32 and name HB#) (residue 33 and name HN) 5.0 5.0 0.0 ! 090507

assign (residue 32 and name HA) (residue 34 and name HN) 5.0 5.0 0.0 ! 090507

assign (residue 32 and name HB#) (residue 34 and name HN) 5.0 5.0 0.0 ! 090507

assign (residue 32 and name HA) (residue 39 and name HA) 6.0 6.0 0.0 ! changed 140208



!T33

assign (residue 33 and name HN) (residue 33 and name HA) 5.0 5.0 0.0 ! 090507

assign (residue 33 and name HN) (residue 33 and name HB) 5.0 5.0 0.0 ! 090507

assign (residue 33 and name HN) (residue 33 and name HG2#) 5.0 5.0 0.0 ! 090507

assign (residue 33 and name HN) (residue 34 and name HN) 3.5 3.5 0.0 ! 120407

assign (residue 33 and name HA) (residue 34 and name HN) 5.0 5.0 0.0 ! 170806

assign (residue 33 and name HG2#) (residue 34 and name HN) 5.0 5.0 0.0 ! 170806

assign (residue 33 and name HN) (residue 35 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 33 and name HB) (residue 35 and name HN) 5.0 5.0 0.0 ! 291107

assign (residue 33 and name HG1) (residue 35 and name HN) 6.0 6.0 0.0 ! 291107

assign (residue 33 and name HG1) (residue 35 and name HB#) 6.0 6.0 0.0 ! 291107

assign (residue 33 and name HG2#) (residue 35 and name HN) 5.0 5.0 0.0 ! 090507

assign (residue 33 and name HN) (residue 36 and name HN) 5.0 5.0 0.0 ! 090507

assign (residue 33 and name HG2#) (residue 40 and name HG#) 5.0 5.0 0.0 ! 120407

assign (residue 33 and name HG2#) (residue 40 and name HD#) 5.0 5.0 0.0 ! 120407



!G34

assign (residue 34 and name HN) (residue 34 and name HA#) 5.0 5.0 0.0 ! 100507

assign (residue 34 and name HN) (residue 35 and name HN) 3.5 3.5 0.0 ! 120407

assign (residue 34 and name HA#) (residue 35 and name HN) 5.0 5.0 0.0 ! 100507

assign (residue 34 and name HN) (residue 36 and name HN) 5.0 5.0 0.0 ! 120407

assign (residue 34 and name HA#) (residue 36 and name HN) 5.0 5.0 0.0 ! 100507



!R35

assign (residue 35 and name HN) (residue 35 and name HA) 5.0 5.0 0.0 ! 100507

assign (residue 35 and name HN) (residue 35 and name HB#) 5.0 5.0 0.0 ! 100507

assign (residue 35 and name HN) (residue 35 and name HG#) 5.0 5.0 0.0 ! 100507

assign (residue 35 and name HN) (residue 36 and name HN) 2.5 2.5 0.0 ! 120407 ! changed 140208

assign (residue 35 and name HA) (residue 36 and name HN) 3.5 3.5 0.0 ! 120407

assign (residue 35 and name HB#) (residue 36 and name HN) 5.0 5.0 0.0 ! 100507

assign (residue 35 and name HG#) (residue 36 and name HN) 5.0 5.0 0.0 ! 291107 ! changed 140508



!S36

assign (residue 36 and name HN) (residue 36 and name HA) 5.0 5.0 0.0 ! 100507

assign (residue 36 and name HN) (residue 36 and name HB#) 5.0 5.0 0.0 ! 100507

assign (residue 36 and name HN) (residue 37 and name HN) 5.0 5.0 0.0 ! 100507

assign (residue 36 and name HA) (residue 37 and name HN) 2.5 2.5 0.0 ! 120407 ! changed 140208

assign (residue 36 and name HB#) (residue 37 and name HN) 5.0 5.0 0.0 ! 100507

assign (residue 36 and name HN) (residue 38 and name HN) 5.0 5.0 0.0 ! 100507

assign (residue 36 and name HA) (residue 38 and name HN) 5.0 5.0 0.0 ! 100507

assign (residue 36 and name HB#) (residue 38 and name HN) 5.0 5.0 0.0 ! 100507



!C37

assign (residue 37 and name HN) (residue 37 and name HA) 5.0 5.0 0.0 ! 100507

assign (residue 37 and name HN) (residue 37 and name HB#) 5.0 5.0 0.0 ! 100507

assign (residue 37 and name HN) (residue 38 and name HN) 2.5 2.5 0.0 ! 120407 ! changed 140208

assign (residue 37 and name HA) (residue 38 and name HN) 5.0 5.0 0.0 ! 100507

assign (residue 37 and name HB#) (residue 38 and name HN) 5.0 5.0 0.0 ! 100507




!E38

assign (residue 38 and name HN) (residue 38 and name HA) 5.0 5.0 0.0 ! 100507

assign (residue 38 and name HN) (residue 38 and name HB#) 5.0 5.0 0.0 ! 100507

assign (residue 38 and name HN) (residue 38 and name HG#) 5.0 5.0 0.0 ! 100507

assign (residue 38 and name HN) (residue 39 and name HN) 5.0 5.0 0.0 ! 291107

assign (residue 38 and name HA) (residue 39 and name HN) 2.5 2.5 0.0 ! 120407

assign (residue 38 and name HB#) (residue 39 and name HN) 5.0 5.0 0.0 ! 100507

assign (residue 38 and name HG#) (residue 39 and name HN) 5.0 5.0 0.0 ! 100507




!C39

assign (residue 39 and name HN) (residue 39 and name HA) 5.0 5.0 0.0 ! 100507

assign (residue 39 and name HN) (residue 39 and name HB#) 5.0 5.0 0.0 ! 100507

assign (residue 39 and name HA) (residue 40 and name HB#) 6.0 6.0 0.0 ! 301107

assign (residue 39 and name HA) (residue 40 and name HG#) 6.0 6.0 0.0 ! 301107

assign (residue 39 and name HA) (residue 40 and name HD#) 3.5 3.5 0.0 ! 120407



!P40

assign (residue 40 and name HA) (residue 41 and name HN) 2.5 2.5 0.0 ! 120407 ! changed 140208

assign (residue 40 and name HB#) (residue 41 and name HN) 5.0 5.0 0.0 ! 100507

assign (residue 40 and name HA) (residue 42 and name HN) 5.0 5.0 0.0 ! 100507 ! removed 080208 ! added 140508

assign (residue 40 and name HB#) (residue 42 and name HN) 5.0 5.0 0.0 ! 100507



!S41

assign (residue 41 and name HN) (residue 41 and name HA) 5.0 5.0 0.0 ! 100507

assign (residue 41 and name HN) (residue 41 and name HB#) 5.0 5.0 0.0 ! 100507

assign (residue 41 and name HN) (residue 42 and name HN) 3.5 3.5 0.0 ! 100507

assign (residue 41 and name HA) (residue 42 and name HN) 3.5 3.5 0.0 ! 100507

assign (residue 41 and name HB#) (residue 42 and name HN) 5.0 5.0 0.0 ! 140508



!Y42

assign (residue 42 and name HN) (residue 42 and name HA) 5.0 5.0 0.0 ! 100507

assign (residue 42 and name HN) (residue 42 and name HB#) 5.0 5.0 0.0 ! 100507

assign (residue 42 and name HN) (residue 42 and name HD#) 5.0 5.0 0.0 ! 100507

assign (residue 42 and name HA) (residue 43 and name HD#) 3.5 3.5 0.0 ! 120407

assign (residue 42 and name HD#) (residue 44 and name HA#) 6.0 6.0 0.0 ! 140508



!P43

assign (residue 43 and name HA) (residue 44 and name HN) 3.5 3.5 0.0 ! 120407

assign (residue 43 and name HB#) (residue 44 and name HN) 5.0 5.0 0.0 ! 301107



!G44

assign (residue 44 and name HN) (residue 44 and name HA#) 5.0 5.0 0.0 ! 100507

assign (residue 44 and name HN) (residue 45 and name HN) 6.0 6.0 0.0 ! 301107

assign (residue 44 and name HA#) (residue 45 and name HN) 5.0 5.0 0.0 ! 



!N45

assign (residue 45 and name HN) (residue 45 and name HA) 5.0 5.0 0.0 ! 100507

assign (residue 45 and name HN) (residue 45 and name HB#) 5.0 5.0 0.0 ! 100507



!G46

assign (residue 46 and name HN) (residue 46 and name HA#) 5.0 5.0 0.0 ! 100507




! AMBIGUOUS CONSTRAINTS





assign (residue 27 and name HN) ((residue 25 and name HA) or (residue 25 and name HB)) 5.0 5.0 0.0 ! 221107 ! changed 201207 ! changed 070208

assign (residue 28 and name HN) ((residue 25 and name HA) or (residue 25 and name HB)) 5.0 5.0 0.0 ! 221107









  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           HT1      ALA   1  16.078  10.741   1.764
    2    H2   ALA   1           HT3      ALA   1  17.410  11.805   1.587
    3    H3   ALA   1           HT2      ALA   1  16.235  12.098   2.803
    4    HA   ALA   1           HA       ALA   1  14.621  12.660   1.282
    5    HB1  ALA   1           HB1      ALA   1  16.957  13.933  -0.043
    6    HB2  ALA   1           HB2      ALA   1  16.729  14.196   1.686
    7    HB3  ALA   1           HB3      ALA   1  15.460  14.652   0.549

  No H/Q in entry =           7
  In of MODEL    1
    1    HA   MET   2           HA       MET   2  15.308  10.423  -2.495
    2    HB2  MET   2           HB2      MET   2  14.429   8.146  -2.544
    3    H    MET   2           HN       MET   2  14.106  10.648   0.179
    4    HG2  MET   2           HG2      MET   2  12.998   9.012  -0.128
    5    HE3  MET   2           HE1      MET   2  14.620   8.046   2.340
    6    HB3  MET   2           HB1      MET   2  15.432   8.394  -1.121
    7    HE2  MET   2           HE2      MET   2  13.270   6.977   2.719
    8    HE1  MET   2           HE3      MET   2  12.977   8.507   1.893
    9    HG3  MET   2           HG1      MET   2  12.564   7.807  -1.339

  No H/Q in entry =           9
  In of MODEL    1
    1    HA   ASP   3           HA       ASP   3  10.238  11.544  -1.420
    2    HB2  ASP   3           HB2      ASP   3  11.790  12.395  -3.870
    3    H    ASP   3           HN       ASP   3  12.315  10.898  -0.759
    4    HB3  ASP   3           HB1      ASP   3  10.086  12.766  -3.621

  No H/Q in entry =           4
  In of MODEL    1
    1    HA   CYS   4           HA       CYS   4   8.884   8.075  -3.664
    2    HB2  CYS   4           HB2      CYS   4  11.339   8.220  -4.740
    3    H    CYS   4           HN       CYS   4  10.901   8.835  -1.750
    4    HB3  CYS   4           HB1      CYS   4  11.428   6.596  -4.067

  No H/Q in entry =           4
  In of MODEL    1
    1    HA   THR   5           HA       THR   5   8.835   5.546   0.041
    2    HB   THR   5           HB       THR   5   6.031   5.311  -1.046
    3    HG1  THR   5           HG1      THR   5   5.566   7.193  -0.227
    4   HG21  THR   5          HG21      THR   5   7.244   4.065   1.103
    5   HG23  THR   5          HG22      THR   5   5.512   4.221   0.808
    6   HG22  THR   5          HG23      THR   5   6.344   5.401   1.820
    7    H    THR   5           HN       THR   5   7.762   7.175  -1.967

  No H/Q in entry =           7
  In of MODEL    1
    1    HA   THR   6           HA       THR   6   8.753   1.756  -2.188
    2    HB   THR   6           HB       THR   6  10.441   0.256  -0.785
    3    HG1  THR   6           HG1      THR   6  10.973   2.873   0.165
    4   HG22  THR   6          HG21      THR   6  11.752   2.677  -1.862
    5   HG21  THR   6          HG22      THR   6  10.767   1.718  -2.967
    6   HG23  THR   6          HG23      THR   6  12.121   0.972  -2.119
    7    H    THR   6           HN       THR   6   8.922   3.313   0.309

  No H/Q in entry =           7
  In of MODEL    1
    1    HA3  GLY   7           HA2      GLY   7   7.617  -2.434  -0.438
    2    H    GLY   7           HN       GLY   7   8.578  -0.686  -1.683
    3    HA2  GLY   7           HA1      GLY   7   6.991  -1.251   0.700

  No H/Q in entry =           3
  In of MODEL    1
    1    HA   PRO   8           HA       PRO   8   3.420  -2.977  -1.794
    2    HB2  PRO   8           HB2      PRO   8   2.144  -2.104   0.756
    3    HG2  PRO   8           HG2      PRO   8   3.288  -3.655   2.062
    4    HD2  PRO   8           HD2      PRO   8   4.960  -2.103   1.719
    5    HB3  PRO   8           HB1      PRO   8   1.877  -3.572  -0.192
    6    HG3  PRO   8           HG1      PRO   8   3.765  -4.622   0.654
    7    HD3  PRO   8           HD1      PRO   8   5.753  -3.496   0.956

  No H/Q in entry =           7
  In of MODEL    1
    1    HA   CYS   9           HA       CYS   9   0.254  -0.063  -3.176
    2    HB2  CYS   9           HB2      CYS   9   1.451   1.205  -0.709
    3    H    CYS   9           HN       CYS   9   1.378  -1.863  -2.360
    4    HB3  CYS   9           HB1      CYS   9   0.288   2.019  -1.749

  No H/Q in entry =           4
  In of MODEL    1
    1    HA   CYS  10           HA       CYS  10   3.508   2.023  -5.262
    2    HB2  CYS  10           HB2      CYS  10   5.142   0.836  -3.314
    3    H    CYS  10           HN       CYS  10   2.936  -0.611  -4.123
    4    HB3  CYS  10           HB1      CYS  10   5.975   0.571  -4.841

  No H/Q in entry =           4
  In of MODEL    1
    1    HA   ARG  11           HA       ARG  11   5.390  -0.812  -8.373
    2    HB2  ARG  11           HB2      ARG  11   3.028  -0.203  -8.840
    3    HG2  ARG  11           HG2      ARG  11   3.388  -0.023 -11.473
    4    HD2  ARG  11           HD2      ARG  11   3.846  -2.365  -9.652
    5    HE   ARG  11           HE       ARG  11   4.660  -2.457 -12.244
    6   HH11  ARG  11          HH11      ARG  11   2.066  -3.964 -10.460
    7   HH12  ARG  11          HH12      ARG  11   2.043  -5.384 -11.450
    8   HH21  ARG  11          HH21      ARG  11   4.631  -4.324 -13.547
    9   HH22  ARG  11          HH22      ARG  11   3.499  -5.589 -13.202
   10    H    ARG  11           HN       ARG  11   5.282   1.699  -7.055
   11    HB3  ARG  11           HB1      ARG  11   3.588   1.262  -9.634
   12    HG3  ARG  11           HG1      ARG  11   5.011  -0.538 -11.007
   13    HD3  ARG  11           HD1      ARG  11   2.396  -1.950 -10.566

  No H/Q in entry =          13
  In of MODEL    1
    1    HA   GLN  12           HA       GLN  12   9.504   0.491  -9.368
    2    HB2  GLN  12           HB2      GLN  12   7.980  -0.002 -11.460
    3    HG2  GLN  12           HG2      GLN  12  10.104   1.801 -12.339
    4   HE21  GLN  12          HE21      GLN  12  11.300  -1.236 -12.113
    5   HE22  GLN  12          HE22      GLN  12  10.777  -1.874 -13.632
    6    H    GLN  12           HN       GLN  12   7.582  -0.307  -8.454
    7    HB3  GLN  12           HB1      GLN  12   7.988   1.749 -11.617
    8    HG3  GLN  12           HG1      GLN  12  10.630   0.559 -11.205

  No H/Q in entry =           8
  In of MODEL    1
    1    HA   CYS  13           HA       CYS  13   9.220   4.063  -6.455
    2    HB2  CYS  13           HB2      CYS  13  11.039   3.969  -8.465
    3    H    CYS  13           HN       CYS  13   8.972   2.007  -7.394
    4    HB3  CYS  13           HB1      CYS  13  10.101   5.376  -8.953

  No H/Q in entry =           4
  In of MODEL    1
    1    HA   LYS  14           HA       LYS  14   5.608   6.059  -7.927
    2    HB2  LYS  14           HB2      LYS  14   6.158   4.868 -10.254
    3    HG2  LYS  14           HG2      LYS  14   4.724   7.047  -9.603
    4    HD2  LYS  14           HD2      LYS  14   2.797   5.400 -11.212
    5    HE2  LYS  14           HE2      LYS  14   1.232   7.177 -10.326
    6    HZ2  LYS  14           HZ1      LYS  14   1.677   7.649 -12.475
    7    HZ1  LYS  14           HZ2      LYS  14   3.356   7.596 -12.276
    8    HZ3  LYS  14           HZ3      LYS  14   2.491   8.968 -11.795
    9    H    LYS  14           HN       LYS  14   6.708   3.366  -7.739
   10    HB3  LYS  14           HB1      LYS  14   4.596   4.122  -9.945
   11    HG3  LYS  14           HG1      LYS  14   4.905   6.441 -11.251
   12    HD3  LYS  14           HD1      LYS  14   2.676   5.524  -9.456
   13    HE3  LYS  14           HE1      LYS  14   2.667   8.032  -9.763

  No H/Q in entry =          13
  In of MODEL    1
    1    HA   LEU  15           HA       LEU  15   2.889   3.924  -5.226
    2    HB2  LEU  15           HB2      LEU  15   1.197   5.535  -4.371
    3    HG   LEU  15           HG       LEU  15   2.389   7.313  -6.439
    4   HD13  LEU  15          HD11      LEU  15   0.242   7.763  -6.947
    5   HD12  LEU  15          HD12      LEU  15  -0.269   7.778  -5.259
    6   HD11  LEU  15          HD13      LEU  15  -0.058   6.244  -6.103
    7   HD21  LEU  15          HD21      LEU  15   2.002   8.041  -3.601
    8   HD23  LEU  15          HD22      LEU  15   1.378   9.172  -4.802
    9   HD22  LEU  15          HD23      LEU  15   3.084   8.726  -4.813
   10    H    LEU  15           HN       LEU  15   4.014   6.147  -6.503
   11    HB3  LEU  15           HB1      LEU  15   2.857   6.050  -4.140

  No H/Q in entry =          11
  In of MODEL    1
    1    HA   LYS  16           HA       LYS  16  -0.255   2.894  -8.031
    2    HB2  LYS  16           HB2      LYS  16  -1.185   1.429  -5.556
    3    HG2  LYS  16           HG2      LYS  16   1.275   1.096  -6.592
    4    HD2  LYS  16           HD2      LYS  16  -0.613  -0.287  -8.379
    5    HE2  LYS  16           HE2      LYS  16   1.488  -1.962  -8.629
    6    HZ2  LYS  16           HZ1      LYS  16  -0.803  -2.663  -8.543
    7    HZ1  LYS  16           HZ2      LYS  16  -0.874  -2.374  -6.878
    8    HZ3  LYS  16           HZ3      LYS  16   0.115  -3.607  -7.480
    9    H    LYS  16           HN       LYS  16   0.783   3.033  -5.327
   10    HB3  LYS  16           HB1      LYS  16  -1.604   1.045  -7.220
   11    HG3  LYS  16           HG1      LYS  16   0.333  -0.197  -5.846
   12    HD3  LYS  16           HD1      LYS  16   1.045   0.245  -8.670
   13    HE3  LYS  16           HE1      LYS  16   1.474  -1.728  -6.882

  No H/Q in entry =          13
  In of MODEL    1
    1    HA   PRO  17           HA       PRO  17  -3.790   5.493  -7.808
    2    HB2  PRO  17           HB2      PRO  17  -5.496   3.096  -8.290
    3    HG2  PRO  17           HG2      PRO  17  -4.354   2.455 -10.215
    4    HD2  PRO  17           HD2      PRO  17  -2.858   1.755  -8.605
    5    HB3  PRO  17           HB1      PRO  17  -5.449   4.636  -9.156
    6    HG3  PRO  17           HG1      PRO  17  -3.575   4.039 -10.386
    7    HD3  PRO  17           HD1      PRO  17  -1.802   2.914  -9.437

  No H/Q in entry =           7
  In of MODEL    1
    1    HA   ALA  18           HA       ALA  18  -5.214   5.128  -3.727
    2    HB1  ALA  18           HB1      ALA  18  -5.691   7.521  -4.379
    3    HB2  ALA  18           HB2      ALA  18  -6.731   6.842  -3.127
    4    HB3  ALA  18           HB3      ALA  18  -7.326   6.994  -4.780
    5    H    ALA  18           HN       ALA  18  -5.219   6.224  -6.301

  No H/Q in entry =           5
  In of MODEL    1
    1    HA3  GLY  19           HA2      GLY  19  -8.411   2.427  -2.330
    2    H    GLY  19           HN       GLY  19  -6.354   3.553  -2.801
    3    HA2  GLY  19           HA1      GLY  19  -8.953   2.809  -3.957

  No H/Q in entry =           3
  In of MODEL    1
    1    HA   THR  20           HA       THR  20  -6.440  -0.827  -4.869
    2    HB   THR  20           HB       THR  20  -3.727   0.230  -4.051
    3    HG1  THR  20           HG1      THR  20  -4.027   1.560  -5.627
    4   HG23  THR  20          HG21      THR  20  -3.429  -2.048  -4.522
    5   HG22  THR  20          HG22      THR  20  -2.972  -1.193  -5.995
    6   HG21  THR  20          HG23      THR  20  -4.540  -1.993  -5.891
    7    H    THR  20           HN       THR  20  -5.752   1.571  -3.344

  No H/Q in entry =           7
  In of MODEL    1
    1    HA   THR  21           HA       THR  21  -5.939  -3.318  -1.359
    2    HB   THR  21           HB       THR  21  -5.366  -5.785  -2.259
    3    HG1  THR  21           HG1      THR  21  -5.163  -5.744  -4.335
    4   HG23  THR  21          HG21      THR  21  -7.460  -5.505  -1.307
    5   HG22  THR  21          HG22      THR  21  -7.819  -5.944  -2.977
    6   HG21  THR  21          HG23      THR  21  -7.928  -4.260  -2.464
    7    H    THR  21           HN       THR  21  -5.500  -2.907  -4.197

  No H/Q in entry =           7
  In of MODEL    1
    1    HA   CYS  22           HA       CYS  22  -1.643  -3.851  -0.745
    2    HB2  CYS  22           HB2      CYS  22  -2.520  -2.388   1.119
    3    H    CYS  22           HN       CYS  22  -4.446  -4.067   0.102
    4    HB3  CYS  22           HB1      CYS  22  -2.709  -3.849   2.082

  No H/Q in entry =           4
  In of MODEL    1
    1    HA   TRP  23           HA       TRP  23  -1.375  -8.261  -1.649
    2    HB2  TRP  23           HB2      TRP  23   0.509  -7.401  -0.184
    3    HD1  TRP  23           HD1      TRP  23  -0.044  -9.967  -2.011
    4    HE1  TRP  23           HE1      TRP  23   1.028 -12.216  -1.365
    5    HE3  TRP  23           HE3      TRP  23   0.841  -9.052   2.941
    6    HZ2  TRP  23           HZ2      TRP  23   2.107 -13.440   0.939
    7    HZ3  TRP  23           HZ3      TRP  23   1.896 -10.815   4.296
    8    HH2  TRP  23           HH2      TRP  23   2.515 -12.963   3.314
    9    H    TRP  23           HN       TRP  23  -1.835  -6.034  -1.676
   10    HB3  TRP  23           HB1      TRP  23  -0.468  -7.870   1.204

  No H/Q in entry =          10
  In of MODEL    1
    1    HA   ARG  24           HA       ARG  24  -5.292  -9.029   0.524
    2    HB2  ARG  24           HB2      ARG  24  -5.801  -8.881  -2.110
    3    HG2  ARG  24           HG2      ARG  24  -7.414  -9.935   0.140
    4    HD2  ARG  24           HD2      ARG  24  -9.355 -10.234  -1.327
    5    HE   ARG  24           HE       ARG  24  -7.668 -12.180  -2.537
    6   HH11  ARG  24          HH11      ARG  24  -8.963 -11.141   0.533
    7   HH12  ARG  24          HH12      ARG  24  -8.856 -12.713   1.252
    8   HH21  ARG  24          HH21      ARG  24  -7.528 -14.248  -1.594
    9   HH22  ARG  24          HH22      ARG  24  -8.041 -14.477   0.045
   10    H    ARG  24           HN       ARG  24  -3.680  -8.632  -1.748
   11    HB3  ARG  24           HB1      ARG  24  -5.866 -10.627  -1.909
   12    HG3  ARG  24           HG1      ARG  24  -7.683  -8.527  -0.889
   13    HD3  ARG  24           HD1      ARG  24  -8.320 -10.006  -2.735

  No H/Q in entry =          13
  In of MODEL    1
    1    HA   THR  25           HA       THR  25  -5.085 -13.390   1.281
    2    HB   THR  25           HB       THR  25  -2.727 -12.773   1.154
    3    HG1  THR  25           HG1      THR  25  -2.744 -14.738   1.955
    4   HG23  THR  25          HG21      THR  25  -1.588 -11.533   2.623
    5   HG22  THR  25          HG22      THR  25  -2.426 -12.221   4.014
    6   HG21  THR  25          HG23      THR  25  -3.183 -10.932   3.077
    7    H    THR  25           HN       THR  25  -5.511 -10.686   1.894

  No H/Q in entry =           7
  In of MODEL    1
    1    HA   SER  26           HA       SER  26  -6.665 -13.556   5.348
    2    HB2  SER  26           HB2      SER  26  -5.707 -16.325   4.715
    3    HG   SER  26           HG       SER  26  -7.963 -16.665   4.655
    4    H    SER  26           HN       SER  26  -4.680 -14.655   3.496
    5    HB3  SER  26           HB1      SER  26  -6.457 -16.003   6.278

  No H/Q in entry =           5
  In of MODEL    1
    1    HA   VAL  27           HA       VAL  27  -2.985 -13.546   7.940
    2    HB   VAL  27           HB       VAL  27  -1.334 -12.091   5.875
    3    H    VAL  27           HN       VAL  27  -3.906 -12.613   5.302

  No H/Q in entry =           3
  In of MODEL    1
    1    HA   SER  28           HA       SER  28  -4.490  -9.161   8.188
    2    HB2  SER  28           HB2      SER  28  -2.041  -9.097   8.568
    3    HG   SER  28           HG       SER  28  -1.937  -6.897   8.806
    4    H    SER  28           HN       SER  28  -3.777 -10.747   5.987
    5    HB3  SER  28           HB1      SER  28  -1.826  -8.406   6.960

  No H/Q in entry =           5
  In of MODEL    1
    1    HA   SER  29           HA       SER  29  -6.119  -7.715   4.292
    2    HB2  SER  29           HB2      SER  29  -8.258  -7.856   6.379
    3    HG   SER  29           HG       SER  29  -8.425  -8.639   3.683
    4    H    SER  29           HN       SER  29  -6.261  -8.610   6.992
    5    HB3  SER  29           HB1      SER  29  -8.532  -6.866   4.945

  No H/Q in entry =           5
  In of MODEL    1
    1    HA   HIS  30           HA       HIS  30  -6.016  -3.416   5.192
    2    HB2  HIS  30           HB2      HIS  30  -3.294  -4.268   4.211
    3    HD1  HIS  30           HD1      HIS  30  -1.580  -4.435   6.136
    4    HD2  HIS  30           HD2      HIS  30  -5.452  -3.581   7.377
    5    HE1  HIS  30           HE1      HIS  30  -1.580  -4.786   8.626
    6    HE2  HIS  30           HE2      HIS  30  -3.911  -4.178   9.366
    7    H    HIS  30           HN       HIS  30  -5.449  -5.804   3.598
    8    HB3  HIS  30           HB1      HIS  30  -3.667  -2.596   4.617

  No H/Q in entry =           8
  In of MODEL    1
    1    HA   TYR  31           HA       TYR  31  -5.603  -1.864   0.944
    2    HB2  TYR  31           HB2      TYR  31  -7.288  -0.182   2.773
    3    HD1  TYR  31           HD1      TYR  31  -8.061  -1.176  -0.670
    4    HD2  TYR  31           HD2      TYR  31  -8.530  -2.146   3.446
    5    HE1  TYR  31           HE1      TYR  31  -9.834  -2.776  -1.255
    6    HE2  TYR  31           HE2      TYR  31 -10.303  -3.749   2.872
    7    HH   TYR  31           HH       TYR  31 -12.003  -3.959   0.821
    8    H    TYR  31           HN       TYR  31  -5.066  -1.439   3.777
    9    HB3  TYR  31           HB1      TYR  31  -7.121   0.250   1.075

  No H/Q in entry =           9
  In of MODEL    1
    1    HA   CYS  32           HA       CYS  32  -2.840   1.488   0.710
    2    HB2  CYS  32           HB2      CYS  32  -4.219   1.517  -1.974
    3    H    CYS  32           HN       CYS  32  -5.330   0.311  -0.258
    4    HB3  CYS  32           HB1      CYS  32  -2.801   2.500  -1.625

  No H/Q in entry =           4
  In of MODEL    1
    1    HA   THR  33           HA       THR  33  -4.779   5.286   1.489
    2    HB   THR  33           HB       THR  33  -3.055   7.173   1.612
    3    HG1  THR  33           HG1      THR  33  -1.214   6.813   0.713
    4   HG22  THR  33          HG21      THR  33  -1.630   5.391   3.226
    5   HG21  THR  33          HG22      THR  33  -3.302   4.830   3.234
    6   HG23  THR  33          HG23      THR  33  -2.926   6.487   3.706
    7    H    THR  33           HN       THR  33  -2.508   3.841   0.403

  No H/Q in entry =           7
  In of MODEL    1
    1    HA3  GLY  34           HA2      GLY  34  -3.784   6.437  -3.241
    2    H    GLY  34           HN       GLY  34  -2.373   6.165  -0.996
    3    HA2  GLY  34           HA1      GLY  34  -4.375   7.812  -2.321

  No H/Q in entry =           3
  In of MODEL    1
    1    HA   ARG  35           HA       ARG  35  -0.134   9.086  -3.313
    2    HB2  ARG  35           HB2      ARG  35  -0.659  10.783  -0.870
    3    HG2  ARG  35           HG2      ARG  35  -1.734  11.297  -3.627
    4    HD2  ARG  35           HD2      ARG  35  -2.150  12.530  -0.916
    5    HE   ARG  35           HE       ARG  35  -3.683  13.651  -3.058
    6   HH11  ARG  35          HH11      ARG  35  -3.691  11.247  -0.528
    7   HH12  ARG  35          HH12      ARG  35  -5.417  11.206  -0.400
    8   HH21  ARG  35          HH21      ARG  35  -5.954  13.599  -2.892
    9   HH22  ARG  35          HH22      ARG  35  -6.702  12.541  -1.742
   10    H    ARG  35           HN       ARG  35  -1.729   8.174  -1.023
   11    HB3  ARG  35           HB1      ARG  35   0.236  11.246  -2.311
   12    HG3  ARG  35           HG1      ARG  35  -2.680  10.519  -2.356
   13    HD3  ARG  35           HD1      ARG  35  -1.530  13.300  -2.376

  No H/Q in entry =          13
  In of MODEL    1
    1    HA   SER  36           HA       SER  36   2.960   7.251  -0.867
    2    HB2  SER  36           HB2      SER  36   0.805   7.020   1.174
    3    HG   SER  36           HG       SER  36   2.186   8.381   2.270
    4    H    SER  36           HN       SER  36   0.243   6.796  -1.664
    5    HB3  SER  36           HB1      SER  36   2.306   6.146   1.481

  No H/Q in entry =           5
  In of MODEL    1
    1    HA   CYS  37           HA       CYS  37   2.561   2.826  -1.085
    2    HB2  CYS  37           HB2      CYS  37   5.535   3.373  -1.004
    3    H    CYS  37           HN       CYS  37   3.871   5.156   0.151
    4    HB3  CYS  37           HB1      CYS  37   4.761   1.955  -1.704

  No H/Q in entry =           4
  In of MODEL    1
    1    HA   GLU  38           HA       GLU  38   3.930   1.679   3.070
    2    HB2  GLU  38           HB2      GLU  38   2.558   4.133   4.184
    3    HG2  GLU  38           HG2      GLU  38   4.864   4.220   2.820
    4    H    GLU  38           HN       GLU  38   2.429   3.776   1.658
    5    HB3  GLU  38           HB1      GLU  38   3.492   2.968   5.113
    6    HG3  GLU  38           HG1      GLU  38   4.494   5.267   4.189

  No H/Q in entry =           6
  In of MODEL    1
    1    HA   CYS  39           HA       CYS  39  -0.036   0.118   4.131
    2    HB2  CYS  39           HB2      CYS  39   1.553  -1.722   3.107
    3    H    CYS  39           HN       CYS  39   2.896   0.219   4.406
    4    HB3  CYS  39           HB1      CYS  39   1.577  -2.320   4.762

  No H/Q in entry =           4
  In of MODEL    1
    1    HA   PRO  40           HA       PRO  40   0.699   1.040   8.606
    2    HB2  PRO  40           HB2      PRO  40  -2.229   1.484   8.270
    3    HG2  PRO  40           HG2      PRO  40  -1.967   3.227   6.749
    4    HD2  PRO  40           HD2      PRO  40  -1.520   1.426   5.380
    5    HB3  PRO  40           HB1      PRO  40  -1.032   2.467   9.121
    6    HG3  PRO  40           HG1      PRO  40  -0.259   3.454   7.169
    7    HD3  PRO  40           HD1      PRO  40   0.048   2.245   5.232

  No H/Q in entry =           7
  In of MODEL    1
    1    HA   SER  41           HA       SER  41  -1.422  -2.540  10.008
    2    HB2  SER  41           HB2      SER  41   0.433  -1.762  11.709
    3    HG   SER  41           HG       SER  41  -1.465  -3.612  12.677
    4    H    SER  41           HN       SER  41  -0.705   0.264  10.523
    5    HB3  SER  41           HB1      SER  41  -0.948  -1.473  12.766

  No H/Q in entry =           5
  In of MODEL    1
    1    HA   TYR  42           HA       TYR  42  -5.167  -0.508  11.712
    2    HB2  TYR  42           HB2      TYR  42  -5.192   1.131   9.169
    3    HD1  TYR  42           HD1      TYR  42  -5.315   1.549  12.887
    4    HD2  TYR  42           HD2      TYR  42  -3.657   2.841   9.189
    5    HE1  TYR  42           HE1      TYR  42  -4.015   3.264  14.077
    6    HE2  TYR  42           HE2      TYR  42  -2.351   4.560  10.368
    7    HH   TYR  42           HH       TYR  42  -1.439   4.796  12.853
    8    H    TYR  42           HN       TYR  42  -3.228  -0.312   9.543
    9    HB3  TYR  42           HB1      TYR  42  -6.425   1.199  10.424

  No H/Q in entry =           9
  In of MODEL    1
    1    HA   PRO  43           HA       PRO  43  -7.655  -3.565   9.734
    2    HB2  PRO  43           HB2      PRO  43 -10.123  -2.899  10.645
    3    HG2  PRO  43           HG2      PRO  43  -9.672  -0.766  11.445
    4    HD2  PRO  43           HD2      PRO  43  -7.518  -0.033  11.808
    5    HB3  PRO  43           HB1      PRO  43  -8.893  -3.649  11.669
    6    HG3  PRO  43           HG1      PRO  43  -9.330  -1.723  12.899
    7    HD3  PRO  43           HD1      PRO  43  -7.048  -1.526  12.644

  No H/Q in entry =           7
  In of MODEL    1
    1    HA3  GLY  44           HA2      GLY  44  -9.537  -0.823   6.669
    2    H    GLY  44           HN       GLY  44  -8.474  -0.180   9.340
    3    HA2  GLY  44           HA1      GLY  44 -10.435   0.249   7.733

  No H/Q in entry =           3
  In of MODEL    1
    1    HA   ASN  45           HA       ASN  45  -8.041   3.243   5.626
    2    HB2  ASN  45           HB2      ASN  45  -6.107   1.567   5.932
    3   HD21  ASN  45          HD21      ASN  45  -5.574   3.619   6.788
    4   HD22  ASN  45          HD22      ASN  45  -4.683   4.764   5.851
    5    H    ASN  45           HN       ASN  45  -9.114   0.641   5.063
    6    HB3  ASN  45           HB1      ASN  45  -6.177   1.369   4.184

  No H/Q in entry =           6
  In of MODEL    1
    1    HA3  GLY  46           HA2      GLY  46  -8.913   5.350   1.839
    2    H    GLY  46           HN       GLY  46  -8.266   4.605   3.912
    3    HA2  GLY  46           HA1      GLY  46  -8.308   3.828   1.203

  No H/Q in entry =           3
  In of MODEL    2
    1    H1   ALA   1           HT3      ALA   1  17.655  16.414  -6.406
    2    H2   ALA   1           HT2      ALA   1  17.800  17.427  -5.028
    3    H3   ALA   1           HT1      ALA   1  18.922  16.153  -5.282
    4    HA   ALA   1           HA       ALA   1  17.482  15.432  -3.646
    5    HB1  ALA   1           HB1      ALA   1  15.169  15.678  -3.657
    6    HB3  ALA   1           HB2      ALA   1  15.107  15.944  -5.400
    7    HB2  ALA   1           HB3      ALA   1  15.743  17.200  -4.338

  No H/Q in entry =           7
  In of MODEL    2
    1    HA   MET   2           HA       MET   2  16.224  11.898  -6.151
    2    HB2  MET   2           HB2      MET   2  18.476  11.729  -4.738
    3    H    MET   2           HN       MET   2  16.189  13.383  -3.652
    4    HG2  MET   2           HG2      MET   2  17.408   9.103  -5.647
    5    HE1  MET   2           HE1      MET   2  19.635  11.724  -6.981
    6    HB3  MET   2           HB1      MET   2  17.538  10.534  -3.853
    7    HE3  MET   2           HE2      MET   2  20.456  10.529  -7.986
    8    HE2  MET   2           HE3      MET   2  21.290  11.245  -6.608
    9    HG3  MET   2           HG1      MET   2  17.665  10.389  -6.826

  No H/Q in entry =           9
  In of MODEL    2
    1    HA   ASP   3           HA       ASP   3  12.924  10.504  -3.471
    2    HB2  ASP   3           HB2      ASP   3  11.898  12.703  -4.028
    3    H    ASP   3           HN       ASP   3  13.930  12.049  -5.735
    4    HB3  ASP   3           HB1      ASP   3  11.381  12.036  -5.574

  No H/Q in entry =           4
  In of MODEL    2
    1    HA   CYS   4           HA       CYS   4  10.670   7.740  -6.315
    2    HB2  CYS   4           HB2      CYS   4  13.057   7.157  -6.339
    3    H    CYS   4           HN       CYS   4  11.248   8.876  -3.822
    4    HB3  CYS   4           HB1      CYS   4  12.872   6.320  -4.802

  No H/Q in entry =           4
  In of MODEL    2
    1    HA   THR   5           HA       THR   5   9.991   6.056  -1.306
    2    HB   THR   5           HB       THR   5   7.563   5.987  -3.025
    3    HG1  THR   5           HG1      THR   5   8.822   8.372  -2.158
    4   HG21  THR   5          HG21      THR   5   7.866   5.636  -0.401
    5   HG23  THR   5          HG22      THR   5   6.408   6.320  -1.120
    6   HG22  THR   5          HG23      THR   5   7.634   7.383  -0.430
    7    H    THR   5           HN       THR   5  11.222   7.125  -2.891

  No H/Q in entry =           7
  In of MODEL    2
    1    HA   THR   6           HA       THR   6   9.684   1.988  -2.946
    2    HB   THR   6           HB       THR   6  11.610   0.655  -1.693
    3    HG1  THR   6           HG1      THR   6  12.987   1.859  -0.667
    4   HG22  THR   6          HG21      THR   6  12.956   2.497  -3.455
    5   HG21  THR   6          HG22      THR   6  11.438   1.924  -4.145
    6   HG23  THR   6          HG23      THR   6  12.667   0.767  -3.633
    7    H    THR   6           HN       THR   6  10.588   4.011  -1.004

  No H/Q in entry =           7
  In of MODEL    2
    1    HA3  GLY   7           HA2      GLY   7   9.036  -1.490   0.158
    2    H    GLY   7           HN       GLY   7   9.542  -0.266  -1.873
    3    HA2  GLY   7           HA1      GLY   7   8.328  -0.017   0.804

  No H/Q in entry =           3
  In of MODEL    2
    1    HA   PRO   8           HA       PRO   8   4.815  -2.601  -0.706
    2    HB2  PRO   8           HB2      PRO   8   3.116  -1.905   1.293
    3    HG2  PRO   8           HG2      PRO   8   4.461  -0.392   2.430
    4    HD2  PRO   8           HD2      PRO   8   6.734  -0.273   2.068
    5    HB3  PRO   8           HB1      PRO   8   4.293  -3.214   1.446
    6    HG3  PRO   8           HG1      PRO   8   4.917  -1.893   3.255
    7    HD3  PRO   8           HD1      PRO   8   6.937  -2.034   2.153

  No H/Q in entry =           7
  In of MODEL    2
    1    HA   CYS   9           HA       CYS   9   1.392  -0.578  -2.721
    2    HB2  CYS   9           HB2      CYS   9   1.019   0.289  -0.392
    3    H    CYS   9           HN       CYS   9   2.838  -1.961  -1.640
    4    HB3  CYS   9           HB1      CYS   9   2.219   1.533  -0.721

  No H/Q in entry =           4
  In of MODEL    2
    1    HA   CYS  10           HA       CYS  10   4.206   1.198  -5.537
    2    HB2  CYS  10           HB2      CYS  10   6.081   2.587  -4.838
    3    H    CYS  10           HN       CYS  10   4.163  -0.764  -3.536
    4    HB3  CYS  10           HB1      CYS  10   4.773   2.707  -3.666

  No H/Q in entry =           4
  In of MODEL    2
    1    HA   ARG  11           HA       ARG  11   7.603  -1.390  -6.579
    2    HB2  ARG  11           HB2      ARG  11   5.496  -2.232  -8.567
    3    HG2  ARG  11           HG2      ARG  11   5.777  -2.973  -5.681
    4    HD2  ARG  11           HD2      ARG  11   3.976  -4.758  -6.615
    5    HE   ARG  11           HE       ARG  11   6.721  -5.007  -5.805
    6   HH11  ARG  11          HH11      ARG  11   3.905  -6.735  -6.929
    7   HH12  ARG  11          HH12      ARG  11   4.405  -8.246  -6.247
    8   HH21  ARG  11          HH21      ARG  11   7.381  -6.993  -4.907
    9   HH22  ARG  11          HH22      ARG  11   6.378  -8.393  -5.098
   10    H    ARG  11           HN       ARG  11   5.218   0.226  -7.155
   11    HB3  ARG  11           HB1      ARG  11   6.877  -3.163  -8.004
   12    HG3  ARG  11           HG1      ARG  11   4.324  -2.534  -6.581
   13    HD3  ARG  11           HD1      ARG  11   5.115  -4.716  -7.960

  No H/Q in entry =          13
  In of MODEL    2
    1    HA   GLN  12           HA       GLN  12  10.506  -0.334  -9.704
    2    HB2  GLN  12           HB2      GLN  12   8.431  -1.526 -10.938
    3    HG2  GLN  12           HG2      GLN  12   9.528  -0.600 -13.150
    4   HE21  GLN  12          HE21      GLN  12  12.321  -1.427 -11.556
    5   HE22  GLN  12          HE22      GLN  12  12.261  -3.140 -11.770
    6    H    GLN  12           HN       GLN  12   9.243  -1.204  -8.025
    7    HB3  GLN  12           HB1      GLN  12   8.181   0.126 -11.486
    8    HG3  GLN  12           HG1      GLN  12  10.765  -0.050 -12.021

  No H/Q in entry =           8
  In of MODEL    2
    1    HA   CYS  13           HA       CYS  13   9.470   3.685  -7.309
    2    HB2  CYS  13           HB2      CYS  13  11.347   3.492  -9.188
    3    H    CYS  13           HN       CYS  13   9.573   1.458  -7.755
    4    HB3  CYS  13           HB1      CYS  13  10.170   4.420 -10.111

  No H/Q in entry =           4
  In of MODEL    2
    1    HA   LYS  14           HA       LYS  14   5.637   4.663  -9.244
    2    HB2  LYS  14           HB2      LYS  14   5.235   1.852 -10.282
    3    HG2  LYS  14           HG2      LYS  14   7.274   3.275 -11.115
    4    HD2  LYS  14           HD2      LYS  14   4.911   4.701 -12.164
    5    HE2  LYS  14           HE2      LYS  14   7.261   4.807 -13.935
    6    HZ2  LYS  14           HZ1      LYS  14   5.618   6.065 -14.800
    7    HZ1  LYS  14           HZ2      LYS  14   4.375   5.156 -14.101
    8    HZ3  LYS  14           HZ3      LYS  14   5.146   4.598 -15.499
    9    H    LYS  14           HN       LYS  14   7.118   2.322  -8.277
   10    HB3  LYS  14           HB1      LYS  14   4.318   3.275 -10.756
   11    HG3  LYS  14           HG1      LYS  14   6.263   2.376 -12.249
   12    HD3  LYS  14           HD1      LYS  14   6.545   5.289 -11.849
   13    HE3  LYS  14           HE1      LYS  14   6.293   3.338 -14.041

  No H/Q in entry =          13
  In of MODEL    2
    1    HA   LEU  15           HA       LEU  15   3.532   3.373  -5.570
    2    HB2  LEU  15           HB2      LEU  15   3.534   6.048  -5.812
    3    HG   LEU  15           HG       LEU  15   2.057   4.291  -3.919
    4   HD13  LEU  15          HD11      LEU  15   4.159   4.530  -3.128
    5   HD12  LEU  15          HD12      LEU  15   3.483   6.007  -2.440
    6   HD11  LEU  15          HD13      LEU  15   4.408   6.076  -3.940
    7   HD23  LEU  15          HD21      LEU  15   1.800   7.290  -3.831
    8   HD22  LEU  15          HD22      LEU  15   1.064   6.112  -2.745
    9   HD21  LEU  15          HD23      LEU  15   0.534   6.214  -4.424
   10    H    LEU  15           HN       LEU  15   4.387   5.151  -7.557
   11    HB3  LEU  15           HB1      LEU  15   1.841   5.737  -6.147

  No H/Q in entry =          11
  In of MODEL    2
    1    HA   LYS  16           HA       LYS  16   0.016   1.669  -7.453
    2    HB2  LYS  16           HB2      LYS  16  -0.378   1.088  -4.515
    3    HG2  LYS  16           HG2      LYS  16   1.640   0.141  -5.854
    4    HD2  LYS  16           HD2      LYS  16  -0.683  -1.460  -6.888
    5    HE2  LYS  16           HE2      LYS  16   2.132  -2.323  -7.327
    6    HZ2  LYS  16           HZ1      LYS  16   0.712  -3.595  -8.567
    7    HZ1  LYS  16           HZ2      LYS  16  -0.543  -3.528  -7.435
    8    HZ3  LYS  16           HZ3      LYS  16   0.793  -4.527  -7.158
    9    H    LYS  16           HN       LYS  16   1.370   2.644  -5.076
   10    HB3  LYS  16           HB1      LYS  16  -1.337   0.358  -5.795
   11    HG3  LYS  16           HG1      LYS  16   0.691  -0.919  -4.811
   12    HD3  LYS  16           HD1      LYS  16   0.605  -0.678  -7.807
   13    HE3  LYS  16           HE1      LYS  16   1.335  -2.772  -5.819

  No H/Q in entry =          13
  In of MODEL    2
    1    HA   PRO  17           HA       PRO  17  -3.281   4.581  -7.666
    2    HB2  PRO  17           HB2      PRO  17  -5.083   2.213  -7.817
    3    HG2  PRO  17           HG2      PRO  17  -3.953   1.240  -9.605
    4    HD2  PRO  17           HD2      PRO  17  -2.507   0.730  -7.881
    5    HB3  PRO  17           HB1      PRO  17  -4.957   3.602  -8.902
    6    HG3  PRO  17           HG1      PRO  17  -3.102   2.746 -10.000
    7    HD3  PRO  17           HD1      PRO  17  -1.391   1.696  -8.867

  No H/Q in entry =           7
  In of MODEL    2
    1    HA   ALA  18           HA       ALA  18  -4.683   4.819  -3.556
    2    HB1  ALA  18           HB1      ALA  18  -4.858   7.152  -4.278
    3    HB2  ALA  18           HB2      ALA  18  -6.203   6.694  -3.233
    4    HB3  ALA  18           HB3      ALA  18  -6.442   6.816  -4.977
    5    H    ALA  18           HN       ALA  18  -4.566   5.616  -6.236

  No H/Q in entry =           5
  In of MODEL    2
    1    HA3  GLY  19           HA2      GLY  19  -8.120   2.369  -2.690
    2    H    GLY  19           HN       GLY  19  -5.530   2.732  -3.399
    3    HA2  GLY  19           HA1      GLY  19  -8.159   2.131  -4.431

  No H/Q in entry =           3
  In of MODEL    2
    1    HA   THR  20           HA       THR  20  -6.073  -1.713  -4.251
    2    HB   THR  20           HB       THR  20  -3.235  -0.864  -3.879
    3    HG1  THR  20           HG1      THR  20  -4.792  -0.361  -6.190
    4   HG22  THR  20          HG21      THR  20  -2.963  -2.455  -5.829
    5   HG21  THR  20          HG22      THR  20  -4.645  -2.907  -5.556
    6   HG23  THR  20          HG23      THR  20  -3.448  -3.158  -4.286
    7    H    THR  20           HN       THR  20  -5.407   1.000  -4.396

  No H/Q in entry =           7
  In of MODEL    2
    1    HA   THR  21           HA       THR  21  -4.998  -2.423  -0.059
    2    HB   THR  21           HB       THR  21  -6.676  -4.059  -0.365
    3    HG1  THR  21           HG1      THR  21  -5.496  -4.529   1.465
    4   HG21  THR  21          HG21      THR  21  -4.802  -5.256  -2.243
    5   HG23  THR  21          HG22      THR  21  -6.562  -5.342  -2.177
    6   HG22  THR  21          HG23      THR  21  -5.588  -6.425  -1.183
    7    H    THR  21           HN       THR  21  -4.935  -3.341  -2.854

  No H/Q in entry =           7
  In of MODEL    2
    1    HA   CYS  22           HA       CYS  22  -0.691  -3.182  -0.132
    2    HB2  CYS  22           HB2      CYS  22  -1.144  -2.569   2.787
    3    H    CYS  22           HN       CYS  22  -3.141  -2.341   1.003
    4    HB3  CYS  22           HB1      CYS  22   0.340  -2.380   1.860

  No H/Q in entry =           4
  In of MODEL    2
    1    HA   TRP  23           HA       TRP  23  -0.384  -7.585  -0.177
    2    HB2  TRP  23           HB2      TRP  23   1.423  -6.752   1.296
    3    HD1  TRP  23           HD1      TRP  23   1.400  -9.446   0.123
    4    HE1  TRP  23           HE1      TRP  23   1.729 -11.625   1.452
    5    HE3  TRP  23           HE3      TRP  23   0.133  -7.757   4.780
    6    HZ2  TRP  23           HZ2      TRP  23   1.483 -12.512   4.121
    7    HZ3  TRP  23           HZ3      TRP  23   0.206  -9.335   6.666
    8    HH2  TRP  23           HH2      TRP  23   0.866 -11.663   6.342
    9    H    TRP  23           HN       TRP  23  -0.689  -5.365  -0.564
   10    HB3  TRP  23           HB1      TRP  23   0.282  -6.687   2.635

  No H/Q in entry =          10
  In of MODEL    2
    1    HA   ARG  24           HA       ARG  24  -4.141  -8.578   1.887
    2    HB2  ARG  24           HB2      ARG  24  -5.640  -9.771   0.192
    3    HG2  ARG  24           HG2      ARG  24  -3.828  -8.646  -1.891
    4    HD2  ARG  24           HD2      ARG  24  -6.355  -9.589  -1.993
    5    HE   ARG  24           HE       ARG  24  -5.071 -11.939  -1.640
    6   HH11  ARG  24          HH11      ARG  24  -6.713 -10.508  -4.366
    7   HH12  ARG  24          HH12      ARG  24  -7.205 -12.031  -5.029
    8   HH21  ARG  24          HH21      ARG  24  -5.717 -13.943  -2.510
    9   HH22  ARG  24          HH22      ARG  24  -6.641 -13.981  -3.974
   10    H    ARG  24           HN       ARG  24  -2.182  -8.756  -0.297
   11    HB3  ARG  24           HB1      ARG  24  -5.228  -8.095  -0.141
   12    HG3  ARG  24           HG1      ARG  24  -3.579 -10.293  -1.308
   13    HD3  ARG  24           HD1      ARG  24  -5.227  -9.634  -3.347

  No H/Q in entry =          13
  In of MODEL    2
    1    HA   THR  25           HA       THR  25  -3.560 -12.948   2.277
    2    HB   THR  25           HB       THR  25  -3.047 -13.385   4.575
    3    HG1  THR  25           HG1      THR  25  -4.455 -10.987   5.108
    4   HG22  THR  25          HG21      THR  25  -2.100 -10.708   4.896
    5   HG21  THR  25          HG22      THR  25  -1.875 -11.232   3.227
    6   HG23  THR  25          HG23      THR  25  -1.198 -12.182   4.549
    7    H    THR  25           HN       THR  25  -4.881 -10.406   2.934

  No H/Q in entry =           7
  In of MODEL    2
    1    HA   SER  26           HA       SER  26  -8.383 -12.732   1.731
    2    HB2  SER  26           HB2      SER  26  -6.882 -14.975   1.732
    3    HG   SER  26           HG       SER  26  -8.981 -14.632   0.759
    4    H    SER  26           HN       SER  26  -6.233 -11.992   1.698
    5    HB3  SER  26           HB1      SER  26  -7.748 -15.198   3.252

  No H/Q in entry =           5
  In of MODEL    2
    1    HA   VAL  27           HA       VAL  27  -9.675 -11.232   5.606
    2    HB   VAL  27           HB       VAL  27  -8.545 -13.204   6.536
    3    H    VAL  27           HN       VAL  27  -7.477 -11.085   3.883

  No H/Q in entry =           3
  In of MODEL    2
    1    HA   SER  28           HA       SER  28  -6.674  -7.899   6.895
    2    HB2  SER  28           HB2      SER  28  -4.353  -8.997   5.311
    3    HG   SER  28           HG       SER  28  -4.966  -9.752   7.503
    4    H    SER  28           HN       SER  28  -6.310 -10.254   5.254
    5    HB3  SER  28           HB1      SER  28  -4.295  -7.406   6.071

  No H/Q in entry =           5
  In of MODEL    2
    1    HA   SER  29           HA       SER  29  -7.053  -5.298   3.375
    2    HB2  SER  29           HB2      SER  29  -9.444  -6.331   4.047
    3    HG   SER  29           HG       SER  29  -8.667  -5.401   1.981
    4    H    SER  29           HN       SER  29  -7.532  -6.081   6.163
    5    HB3  SER  29           HB1      SER  29  -9.727  -4.649   4.494

  No H/Q in entry =           5
  In of MODEL    2
    1    HA   HIS  30           HA       HIS  30  -6.529  -1.602   5.728
    2    HB2  HIS  30           HB2      HIS  30  -3.890  -1.810   4.270
    3    HD1  HIS  30           HD1      HIS  30  -1.954  -2.916   5.638
    4    HD2  HIS  30           HD2      HIS  30  -5.762  -3.561   7.170
    5    HE1  HIS  30           HE1      HIS  30  -1.702  -4.787   7.299
    6    HE2  HIS  30           HE2      HIS  30  -4.003  -5.100   8.276
    7    H    HIS  30           HN       HIS  30  -5.734  -3.602   3.731
    8    HB3  HIS  30           HB1      HIS  30  -4.255  -0.809   5.671

  No H/Q in entry =           8
  In of MODEL    2
    1    HA   TYR  31           HA       TYR  31  -6.317  -0.796   0.487
    2    HB2  TYR  31           HB2      TYR  31  -8.133   0.648   2.427
    3    HD1  TYR  31           HD1      TYR  31  -7.855  -1.836  -0.331
    4    HD2  TYR  31           HD2      TYR  31 -10.239  -0.273   2.827
    5    HE1  TYR  31           HE1      TYR  31  -9.466  -3.666  -0.650
    6    HE2  TYR  31           HE2      TYR  31 -11.857  -2.099   2.517
    7    HH   TYR  31           HH       TYR  31 -12.255  -3.799   0.015
    8    H    TYR  31           HN       TYR  31  -5.911  -2.079   2.320
    9    HB3  TYR  31           HB1      TYR  31  -8.112   0.931   0.689

  No H/Q in entry =           9
  In of MODEL    2
    1    HA   CYS  32           HA       CYS  32  -3.130   2.151   1.413
    2    HB2  CYS  32           HB2      CYS  32  -2.471   0.732  -0.742
    3    H    CYS  32           HN       CYS  32  -4.496   0.223  -0.091
    4    HB3  CYS  32           HB1      CYS  32  -2.926   2.223  -1.559

  No H/Q in entry =           4
  In of MODEL    2
    1    HA   THR  33           HA       THR  33  -5.249   5.707  -0.043
    2    HB   THR  33           HB       THR  33  -4.026   7.771   0.909
    3    HG1  THR  33           HG1      THR  33  -1.964   7.135   1.095
    4   HG22  THR  33          HG21      THR  33  -4.177   6.120   3.244
    5   HG21  THR  33          HG22      THR  33  -5.536   5.791   2.169
    6   HG23  THR  33          HG23      THR  33  -5.231   7.436   2.728
    7    H    THR  33           HN       THR  33  -2.676   4.419   0.570

  No H/Q in entry =           7
  In of MODEL    2
    1    HA3  GLY  34           HA2      GLY  34  -1.152   5.789  -3.201
    2    H    GLY  34           HN       GLY  34  -1.892   5.448  -0.978
    3    HA2  GLY  34           HA1      GLY  34  -2.538   6.832  -3.476

  No H/Q in entry =           3
  In of MODEL    2
    1    HA   ARG  35           HA       ARG  35   0.463   9.719  -1.730
    2    HB2  ARG  35           HB2      ARG  35  -0.526   8.924   0.962
    3    HG2  ARG  35           HG2      ARG  35  -1.614  10.532  -0.818
    4    HD2  ARG  35           HD2      ARG  35   0.176  12.366   0.771
    5    HE   ARG  35           HE       ARG  35  -2.245  12.925  -0.639
    6   HH11  ARG  35          HH11      ARG  35   0.900  14.199   0.175
    7   HH12  ARG  35          HH12      ARG  35   0.411  15.852   0.012
    8   HH21  ARG  35          HH21      ARG  35  -2.891  15.099  -0.854
    9   HH22  ARG  35          HH22      ARG  35  -1.741  16.363  -0.571
   10    H    ARG  35           HN       ARG  35  -0.549   7.178  -0.637
   11    HB3  ARG  35           HB1      ARG  35   0.780  10.099   0.892
   12    HG3  ARG  35           HG1      ARG  35  -1.734  10.849   0.914
   13    HD3  ARG  35           HD1      ARG  35   0.312  12.040  -0.956

  No H/Q in entry =          13
  In of MODEL    2
    1    HA   SER  36           HA       SER  36   4.055   7.075  -0.757
    2    HB2  SER  36           HB2      SER  36   3.574   6.771   2.195
    3    HG   SER  36           HG       SER  36   4.149   9.240   0.938
    4    H    SER  36           HN       SER  36   1.293   6.790   0.005
    5    HB3  SER  36           HB1      SER  36   5.049   7.251   1.356

  No H/Q in entry =           5
  In of MODEL    2
    1    HA   CYS  37           HA       CYS  37   3.990   2.774  -0.505
    2    HB2  CYS  37           HB2      CYS  37   6.705   3.125   0.783
    3    H    CYS  37           HN       CYS  37   5.357   5.170   0.214
    4    HB3  CYS  37           HB1      CYS  37   6.109   1.653   0.025

  No H/Q in entry =           4
  In of MODEL    2
    1    HA   GLU  38           HA       GLU  38   4.482   2.195   4.270
    2    HB2  GLU  38           HB2      GLU  38   5.291   4.621   4.704
    3    HG2  GLU  38           HG2      GLU  38   3.467   3.644   6.858
    4    H    GLU  38           HN       GLU  38   4.793   4.342   2.509
    5    HB3  GLU  38           HB1      GLU  38   3.589   4.977   4.964
    6    HG3  GLU  38           HG1      GLU  38   4.917   2.737   6.431

  No H/Q in entry =           6
  In of MODEL    2
    1    HA   CYS  39           HA       CYS  39   0.082   2.214   4.522
    2    HB2  CYS  39           HB2      CYS  39   1.076  -0.623   4.227
    3    H    CYS  39           HN       CYS  39   2.766   1.170   5.131
    4    HB3  CYS  39           HB1      CYS  39  -0.632  -0.198   4.249

  No H/Q in entry =           4
  In of MODEL    2
    1    HA   PRO  40           HA       PRO  40   0.441   1.804   9.109
    2    HB2  PRO  40           HB2      PRO  40  -2.093   3.331   8.735
    3    HG2  PRO  40           HG2      PRO  40  -1.048   5.147   7.719
    4    HD2  PRO  40           HD2      PRO  40  -1.042   3.649   5.966
    5    HB3  PRO  40           HB1      PRO  40  -0.769   3.609   9.872
    6    HG3  PRO  40           HG1      PRO  40   0.559   4.647   8.278
    7    HD3  PRO  40           HD1      PRO  40   0.715   3.854   6.120

  No H/Q in entry =           7
  In of MODEL    2
    1    HA   SER  41           HA       SER  41  -2.567  -1.324   9.378
    2    HB2  SER  41           HB2      SER  41  -0.716  -1.562  11.323
    3    HG   SER  41           HG       SER  41  -1.376  -3.503  10.906
    4    H    SER  41           HN       SER  41  -0.815   0.634  10.597
    5    HB3  SER  41           HB1      SER  41  -2.155  -1.328  12.317

  No H/Q in entry =           5
  In of MODEL    2
    1    HA   TYR  42           HA       TYR  42  -5.800   1.116  11.289
    2    HB2  TYR  42           HB2      TYR  42  -4.569   3.124  10.078
    3    HD1  TYR  42           HD1      TYR  42  -8.262   2.551  10.307
    4    HD2  TYR  42           HD2      TYR  42  -4.897   4.807  11.606
    5    HE1  TYR  42           HE1      TYR  42  -9.724   3.875  11.775
    6    HE2  TYR  42           HE2      TYR  42  -6.350   6.136  13.079
    7    HH   TYR  42           HH       TYR  42  -9.153   5.319  14.124
    8    H    TYR  42           HN       TYR  42  -3.938   0.840   9.029
    9    HB3  TYR  42           HB1      TYR  42  -5.890   2.944   8.928

  No H/Q in entry =           9
  In of MODEL    2
    1    HA   PRO  43           HA       PRO  43  -8.119  -1.420   8.181
    2    HB2  PRO  43           HB2      PRO  43  -9.365  -2.984  10.016
    3    HG2  PRO  43           HG2      PRO  43  -8.542  -2.020  11.961
    4    HD2  PRO  43           HD2      PRO  43  -6.710  -0.621  11.947
    5    HB3  PRO  43           HB1      PRO  43  -7.749  -3.338   9.393
    6    HG3  PRO  43           HG1      PRO  43  -7.297  -3.250  11.673
    7    HD3  PRO  43           HD1      PRO  43  -5.770  -1.705  10.902

  No H/Q in entry =           7
  In of MODEL    2
    1    HA3  GLY  44           HA2      GLY  44 -12.187  -0.268  10.136
    2    H    GLY  44           HN       GLY  44 -10.635  -2.177   8.698
    3    HA2  GLY  44           HA1      GLY  44 -12.167   0.106   8.420

  No H/Q in entry =           3
  In of MODEL    2
    1    HA   ASN  45           HA       ASN  45 -14.922  -3.162   7.667
    2    HB2  ASN  45           HB2      ASN  45 -13.742  -3.295   5.498
    3   HD21  ASN  45          HD21      ASN  45 -13.766  -5.516   4.090
    4   HD22  ASN  45          HD22      ASN  45 -15.236  -6.398   4.303
    5    H    ASN  45           HN       ASN  45 -12.129  -2.531   7.416
    6    HB3  ASN  45           HB1      ASN  45 -12.748  -4.603   6.133

  No H/Q in entry =           6
  In of MODEL    2
    1    HA3  GLY  46           HA2      GLY  46 -14.314  -7.127   9.630
    2    H    GLY  46           HN       GLY  46 -15.859  -4.943   8.595
    3    HA2  GLY  46           HA1      GLY  46 -14.849  -6.031  10.895

  No H/Q in entry =           3
  In of MODEL    3
    1    H1   ALA   1           HT1      ALA   1  11.701  13.444  -8.837
    2    H2   ALA   1           HT3      ALA   1  10.216  12.925  -9.516
    3    H3   ALA   1           HT2      ALA   1  10.415  12.957  -7.812
    4    HA   ALA   1           HA       ALA   1  10.633  10.771  -8.329
    5    HB3  ALA   1           HB1      ALA   1  10.705  10.560 -10.600
    6    HB2  ALA   1           HB2      ALA   1  12.392  10.215 -10.221
    7    HB1  ALA   1           HB3      ALA   1  11.926  11.818 -10.791

  No H/Q in entry =           7
  In of MODEL    3
    1    HA   MET   2           HA       MET   2  14.752  11.551  -6.570
    2    HB2  MET   2           HB2      MET   2  13.468  14.023  -5.491
    3    H    MET   2           HN       MET   2  12.033  12.647  -6.646
    4    HG2  MET   2           HG2      MET   2  15.117  13.630  -7.590
    5    HE1  MET   2           HE1      MET   2  16.901  11.731  -6.863
    6    HB3  MET   2           HB1      MET   2  14.885  13.382  -4.670
    7    HE3  MET   2           HE2      MET   2  16.582  11.918  -5.139
    8    HE2  MET   2           HE3      MET   2  18.234  12.024  -5.746
    9    HG3  MET   2           HG1      MET   2  14.973  15.146  -6.702

  No H/Q in entry =           9
  In of MODEL    3
    1    HA   ASP   3           HA       ASP   3  12.761  10.669  -2.325
    2    HB2  ASP   3           HB2      ASP   3  10.040  11.027  -3.521
    3    H    ASP   3           HN       ASP   3  11.763  11.725  -4.760
    4    HB3  ASP   3           HB1      ASP   3  10.221  10.028  -2.082

  No H/Q in entry =           4
  In of MODEL    3
    1    HA   CYS   4           HA       CYS   4  11.089   7.044  -5.878
    2    HB2  CYS   4           HB2      CYS   4  13.586   7.267  -5.605
    3    H    CYS   4           HN       CYS   4  11.199   9.193  -5.143
    4    HB3  CYS   4           HB1      CYS   4  13.416   6.510  -4.025

  No H/Q in entry =           4
  In of MODEL    3
    1    HA   THR   5           HA       THR   5   8.729   5.876  -2.194
    2    HB   THR   5           HB       THR   5   6.562   4.811  -3.339
    3    HG1  THR   5           HG1      THR   5   7.219   5.114  -5.456
    4   HG21  THR   5          HG21      THR   5   7.133   7.259  -2.133
    5   HG23  THR   5          HG22      THR   5   5.547   6.542  -2.419
    6   HG22  THR   5          HG23      THR   5   6.242   7.647  -3.605
    7    H    THR   5           HN       THR   5   9.061   6.745  -4.841

  No H/Q in entry =           7
  In of MODEL    3
    1    HA   THR   6           HA       THR   6   8.963   1.500  -2.771
    2    HB   THR   6           HB       THR   6  11.360   2.302  -1.109
    3    HG1  THR   6           HG1      THR   6  12.260   2.897  -2.906
    4   HG22  THR   6          HG21      THR   6  12.351   0.271  -2.309
    5   HG21  THR   6          HG22      THR   6  10.675  -0.215  -2.569
    6   HG23  THR   6          HG23      THR   6  11.289  -0.008  -0.929
    7    H    THR   6           HN       THR   6   8.957   3.957  -1.224

  No H/Q in entry =           7
  In of MODEL    3
    1    HA3  GLY   7           HA2      GLY   7   8.454  -0.787   1.025
    2    H    GLY   7           HN       GLY   7   8.169  -0.183  -1.635
    3    HA2  GLY   7           HA1      GLY   7   7.091   0.321   0.972

  No H/Q in entry =           3
  In of MODEL    3
    1    HA   PRO   8           HA       PRO   8   5.606  -4.140   0.552
    2    HB2  PRO   8           HB2      PRO   8   3.390  -2.801   2.029
    3    HG2  PRO   8           HG2      PRO   8   4.664  -2.401   3.935
    4    HD2  PRO   8           HD2      PRO   8   5.486  -0.752   2.548
    5    HB3  PRO   8           HB1      PRO   8   4.100  -4.401   2.273
    6    HG3  PRO   8           HG1      PRO   8   5.913  -3.564   3.452
    7    HD3  PRO   8           HD1      PRO   8   7.003  -1.639   2.806

  No H/Q in entry =           7
  In of MODEL    3
    1    HA   CYS   9           HA       CYS   9   1.882  -2.299  -1.595
    2    HB2  CYS   9           HB2      CYS   9   1.033  -0.762   0.181
    3    H    CYS   9           HN       CYS   9   3.520  -1.240   0.508
    4    HB3  CYS   9           HB1      CYS   9   1.991   0.531  -0.533

  No H/Q in entry =           4
  In of MODEL    3
    1    HA   CYS  10           HA       CYS  10   4.036   1.251  -4.035
    2    HB2  CYS  10           HB2      CYS  10   6.359   1.362  -2.102
    3    H    CYS  10           HN       CYS  10   4.140   0.451  -1.380
    4    HB3  CYS  10           HB1      CYS  10   6.295   2.229  -3.633

  No H/Q in entry =           4
  In of MODEL    3
    1    HA   ARG  11           HA       ARG  11   6.762  -1.732  -5.779
    2    HB2  ARG  11           HB2      ARG  11   5.136  -0.268  -7.624
    3    HG2  ARG  11           HG2      ARG  11   4.832  -2.636  -7.106
    4    HD2  ARG  11           HD2      ARG  11   7.149  -3.273  -8.886
    5    HE   ARG  11           HE       ARG  11   6.470  -5.086  -6.795
    6   HH11  ARG  11          HH11      ARG  11   5.512  -3.992  -9.968
    7   HH12  ARG  11          HH12      ARG  11   4.736  -5.483 -10.385
    8   HH21  ARG  11          HH21      ARG  11   5.450  -7.048  -7.342
    9   HH22  ARG  11          HH22      ARG  11   4.701  -7.218  -8.894
   10    H    ARG  11           HN       ARG  11   5.738   1.029  -5.697
   11    HB3  ARG  11           HB1      ARG  11   6.672  -0.632  -8.397
   12    HG3  ARG  11           HG1      ARG  11   5.017  -2.360  -8.839
   13    HD3  ARG  11           HD1      ARG  11   7.396  -3.035  -7.157

  No H/Q in entry =          13
  In of MODEL    3
    1    HA   GLN  12           HA       GLN  12  10.789  -0.567  -6.873
    2    HB2  GLN  12           HB2      GLN  12   9.970  -1.356  -9.648
    3    HG2  GLN  12           HG2      GLN  12  11.792  -3.027  -9.320
    4   HE21  GLN  12          HE21      GLN  12  10.802  -3.555  -6.216
    5   HE22  GLN  12          HE22      GLN  12   9.394  -4.508  -6.527
    6    H    GLN  12           HN       GLN  12   8.409  -1.516  -7.982
    7    HB3  GLN  12           HB1      GLN  12  11.566  -0.676  -9.362
    8    HG3  GLN  12           HG1      GLN  12  11.925  -2.467  -7.653

  No H/Q in entry =           8
  In of MODEL    3
    1    HA   CYS  13           HA       CYS  13  10.641   3.827  -6.303
    2    HB2  CYS  13           HB2      CYS  13  12.399   2.925  -8.137
    3    H    CYS  13           HN       CYS  13  10.502   1.562  -6.171
    4    HB3  CYS  13           HB1      CYS  13  11.322   3.836  -9.189

  No H/Q in entry =           4
  In of MODEL    3
    1    HA   LYS  14           HA       LYS  14   6.747   5.041  -7.719
    2    HB2  LYS  14           HB2      LYS  14   7.251   2.724  -9.432
    3    HG2  LYS  14           HG2      LYS  14   7.319   5.410  -9.779
    4    HD2  LYS  14           HD2      LYS  14   4.615   4.471 -10.476
    5    HE2  LYS  14           HE2      LYS  14   5.631   6.609 -12.237
    6    HZ1  LYS  14           HZ1      LYS  14   3.823   4.294 -12.680
    7    HZ3  LYS  14           HZ2      LYS  14   4.110   5.544 -13.782
    8    HZ2  LYS  14           HZ3      LYS  14   3.335   5.873 -12.315
    9    H    LYS  14           HN       LYS  14   8.120   2.924  -6.503
   10    HB3  LYS  14           HB1      LYS  14   5.543   3.121  -9.300
   11    HG3  LYS  14           HG1      LYS  14   7.236   4.227 -11.086
   12    HD3  LYS  14           HD1      LYS  14   5.188   6.092 -10.080
   13    HE3  LYS  14           HE1      LYS  14   6.147   4.970 -12.633

  No H/Q in entry =          13
  In of MODEL    3
    1    HA   LEU  15           HA       LEU  15   4.273   3.137  -4.605
    2    HB2  LEU  15           HB2      LEU  15   2.648   4.804  -3.763
    3    HG   LEU  15           HG       LEU  15   3.624   6.405  -6.073
    4   HD12  LEU  15          HD11      LEU  15   1.067   6.934  -4.705
    5   HD11  LEU  15          HD12      LEU  15   1.239   5.340  -5.440
    6   HD13  LEU  15          HD13      LEU  15   1.431   6.791  -6.425
    7   HD22  LEU  15          HD21      LEU  15   4.427   7.968  -4.647
    8   HD21  LEU  15          HD22      LEU  15   3.469   7.381  -3.287
    9   HD23  LEU  15          HD23      LEU  15   2.720   8.391  -4.524
   10    H    LEU  15           HN       LEU  15   5.250   5.262  -6.195
   11    HB3  LEU  15           HB1      LEU  15   4.309   5.363  -3.715

  No H/Q in entry =          11
  In of MODEL    3
    1    HA   LYS  16           HA       LYS  16   0.822   1.986  -6.967
    2    HB2  LYS  16           HB2      LYS  16  -0.133   1.357  -4.170
    3    HG2  LYS  16           HG2      LYS  16   2.006   0.264  -4.989
    4    HD2  LYS  16           HD2      LYS  16   0.269  -1.572  -6.554
    5    HE2  LYS  16           HE2      LYS  16   2.627  -1.287  -7.870
    6    HZ1  LYS  16           HZ1      LYS  16   1.403  -3.281  -6.643
    7    HZ3  LYS  16           HZ2      LYS  16   2.708  -3.086  -5.585
    8    HZ2  LYS  16           HZ3      LYS  16   2.988  -3.402  -7.222
    9    H    LYS  16           HN       LYS  16   1.845   2.758  -4.356
   10    HB3  LYS  16           HB1      LYS  16  -0.886   0.744  -5.636
   11    HG3  LYS  16           HG1      LYS  16   0.714  -0.806  -4.442
   12    HD3  LYS  16           HD1      LYS  16   0.813  -0.081  -7.325
   13    HE3  LYS  16           HE1      LYS  16   3.122  -0.970  -6.208

  No H/Q in entry =          13
  In of MODEL    3
    1    HA   PRO  17           HA       PRO  17  -2.076   5.265  -7.517
    2    HB2  PRO  17           HB2      PRO  17  -4.026   3.132  -8.228
    3    HG2  PRO  17           HG2      PRO  17  -2.664   2.151  -9.839
    4    HD2  PRO  17           HD2      PRO  17  -1.657   1.372  -7.912
    5    HB3  PRO  17           HB1      PRO  17  -3.543   4.565  -9.141
    6    HG3  PRO  17           HG1      PRO  17  -1.604   3.570  -9.934
    7    HD3  PRO  17           HD1      PRO  17  -0.271   2.251  -8.591

  No H/Q in entry =           7
  In of MODEL    3
    1    HA   ALA  18           HA       ALA  18  -4.316   5.442  -3.816
    2    HB1  ALA  18           HB1      ALA  18  -4.531   7.781  -5.132
    3    HB2  ALA  18           HB2      ALA  18  -5.316   7.452  -3.587
    4    HB3  ALA  18           HB3      ALA  18  -6.225   7.293  -5.089
    5    H    ALA  18           HN       ALA  18  -3.699   6.280  -6.410

  No H/Q in entry =           5
  In of MODEL    3
    1    HA3  GLY  19           HA2      GLY  19  -7.919   3.081  -3.116
    2    H    GLY  19           HN       GLY  19  -5.502   3.736  -3.268
    3    HA2  GLY  19           HA1      GLY  19  -7.914   3.145  -4.872

  No H/Q in entry =           3
  In of MODEL    3
    1    HA   THR  20           HA       THR  20  -5.887  -0.713  -5.300
    2    HB   THR  20           HB       THR  20  -3.073   0.203  -4.739
    3    HG1  THR  20           HG1      THR  20  -4.453   0.443  -7.202
    4   HG21  THR  20          HG21      THR  20  -4.308  -2.041  -6.240
    5   HG23  THR  20          HG22      THR  20  -2.890  -2.022  -5.191
    6   HG22  THR  20          HG23      THR  20  -2.789  -1.360  -6.822
    7    H    THR  20           HN       THR  20  -5.175   1.970  -4.952

  No H/Q in entry =           7
  In of MODEL    3
    1    HA   THR  21           HA       THR  21  -5.386  -2.414  -1.362
    2    HB   THR  21           HB       THR  21  -4.892  -4.823  -1.344
    3    HG1  THR  21           HG1      THR  21  -4.266  -4.515  -4.090
    4   HG23  THR  21          HG21      THR  21  -7.107  -4.429  -1.980
    5   HG22  THR  21          HG22      THR  21  -6.477  -5.556  -3.182
    6   HG21  THR  21          HG23      THR  21  -6.636  -3.844  -3.575
    7    H    THR  21           HN       THR  21  -4.794  -2.576  -4.174

  No H/Q in entry =           7
  In of MODEL    3
    1    HA   CYS  22           HA       CYS  22  -1.166  -2.261  -0.227
    2    HB2  CYS  22           HB2      CYS  22  -2.677  -1.324   1.661
    3    H    CYS  22           HN       CYS  22  -3.887  -3.236   0.294
    4    HB3  CYS  22           HB1      CYS  22  -2.288  -2.819   2.505

  No H/Q in entry =           4
  In of MODEL    3
    1    HA   TRP  23           HA       TRP  23  -0.762  -6.728   0.690
    2    HB2  TRP  23           HB2      TRP  23  -0.261  -5.701   2.987
    3    HD1  TRP  23           HD1      TRP  23   0.986  -7.944   1.080
    4    HE1  TRP  23           HE1      TRP  23   2.125  -9.995   2.139
    5    HE3  TRP  23           HE3      TRP  23  -1.203  -7.793   5.698
    6    HZ2  TRP  23           HZ2      TRP  23   2.098 -11.367   4.606
    7    HZ3  TRP  23           HZ3      TRP  23  -0.592  -9.512   7.349
    8    HH2  TRP  23           HH2      TRP  23   1.024 -11.262   6.813
    9    H    TRP  23           HN       TRP  23  -2.899  -4.895   1.418
   10    HB3  TRP  23           HB1      TRP  23  -1.650  -6.614   3.568

  No H/Q in entry =          10
  In of MODEL    3
    1    HA   ARG  24           HA       ARG  24  -4.159  -9.510   1.310
    2    HB2  ARG  24           HB2      ARG  24  -3.069  -9.800  -1.493
    3    HG2  ARG  24           HG2      ARG  24  -5.724  -8.627  -0.959
    4    HD2  ARG  24           HD2      ARG  24  -4.614  -8.968  -3.219
    5    HE   ARG  24           HE       ARG  24  -2.684  -7.153  -2.109
    6   HH11  ARG  24          HH11      ARG  24  -4.207  -8.259  -5.048
    7   HH12  ARG  24          HH12      ARG  24  -2.891  -7.770  -6.062
    8   HH21  ARG  24          HH21      ARG  24  -0.953  -6.508  -3.441
    9   HH22  ARG  24          HH22      ARG  24  -1.043  -6.777  -5.150
   10    H    ARG  24           HN       ARG  24  -1.428  -8.841   0.494
   11    HB3  ARG  24           HB1      ARG  24  -4.550 -10.562  -0.931
   12    HG3  ARG  24           HG1      ARG  24  -4.323  -7.641  -0.536
   13    HD3  ARG  24           HD1      ARG  24  -5.265  -7.364  -2.884

  No H/Q in entry =          13
  In of MODEL    3
    1    HA   THR  25           HA       THR  25  -1.837 -13.202   1.911
    2    HB   THR  25           HB       THR  25  -2.420 -13.881   4.424
    3    HG1  THR  25           HG1      THR  25  -3.982 -12.116   4.516
    4   HG23  THR  25          HG21      THR  25  -0.187 -13.295   3.743
    5   HG22  THR  25          HG22      THR  25  -0.602 -12.444   5.231
    6   HG21  THR  25          HG23      THR  25  -0.620 -11.586   3.690
    7    H    THR  25           HN       THR  25  -3.820 -11.164   2.650

  No H/Q in entry =           7
  In of MODEL    3
    1    HA   SER  26           HA       SER  26  -6.119 -14.927   1.341
    2    HB2  SER  26           HB2      SER  26  -5.461 -15.408   4.199
    3    HG   SER  26           HG       SER  26  -5.822 -17.171   2.007
    4    H    SER  26           HN       SER  26  -5.201 -12.701   2.764
    5    HB3  SER  26           HB1      SER  26  -6.983 -16.074   3.609

  No H/Q in entry =           5
  In of MODEL    3
    1    HA   VAL  27           HA       VAL  27  -9.421 -12.385   3.120
    2    HB   VAL  27           HB       VAL  27  -9.487 -13.742   5.171
    3    H    VAL  27           HN       VAL  27  -6.677 -12.803   4.094

  No H/Q in entry =           3
  In of MODEL    3
    1    HA   SER  28           HA       SER  28  -7.809  -8.395   5.007
    2    HB2  SER  28           HB2      SER  28  -6.162  -9.494   6.702
    3    HG   SER  28           HG       SER  28  -6.824  -7.204   6.558
    4    H    SER  28           HN       SER  28  -6.745 -11.058   5.008
    5    HB3  SER  28           HB1      SER  28  -4.921  -9.034   5.537

  No H/Q in entry =           5
  In of MODEL    3
    1    HA   SER  29           HA       SER  29  -5.911  -7.714   1.071
    2    HB2  SER  29           HB2      SER  29  -8.519  -7.824   0.667
    3    HG   SER  29           HG       SER  29  -8.094  -6.868  -1.455
    4    H    SER  29           HN       SER  29  -8.034  -7.465   3.054
    5    HB3  SER  29           HB1      SER  29  -8.367  -6.068   0.613

  No H/Q in entry =           5
  In of MODEL    3
    1    HA   HIS  30           HA       HIS  30  -6.742  -3.250   3.817
    2    HB2  HIS  30           HB2      HIS  30  -4.194  -4.468   2.881
    3    HD1  HIS  30           HD1      HIS  30  -2.850  -5.189   4.863
    4    HD2  HIS  30           HD2      HIS  30  -5.948  -2.617   5.892
    5    HE1  HIS  30           HE1      HIS  30  -2.898  -5.166   7.377
    6    HE2  HIS  30           HE2      HIS  30  -4.836  -3.671   7.976
    7    H    HIS  30           HN       HIS  30  -7.352  -5.356   3.212
    8    HB3  HIS  30           HB1      HIS  30  -4.218  -2.722   3.104

  No H/Q in entry =           8
  In of MODEL    3
    1    HA   TYR  31           HA       TYR  31  -5.884  -0.974  -0.069
    2    HB2  TYR  31           HB2      TYR  31  -7.503   0.771   1.796
    3    HD1  TYR  31           HD1      TYR  31  -8.384  -1.221  -1.210
    4    HD2  TYR  31           HD2      TYR  31  -8.949  -0.659   2.969
    5    HE1  TYR  31           HE1      TYR  31 -10.223  -2.853  -1.245
    6    HE2  TYR  31           HE2      TYR  31 -10.789  -2.290   2.946
    7    HH   TYR  31           HH       TYR  31 -12.484  -3.125   0.940
    8    H    TYR  31           HN       TYR  31  -5.467  -1.193   2.782
    9    HB3  TYR  31           HB1      TYR  31  -7.515   0.818   0.036

  No H/Q in entry =           9
  In of MODEL    3
    1    HA   CYS  32           HA       CYS  32  -2.432   1.570   0.732
    2    HB2  CYS  32           HB2      CYS  32  -2.600   0.857  -1.916
    3    H    CYS  32           HN       CYS  32  -4.328   0.269  -0.867
    4    HB3  CYS  32           HB1      CYS  32  -2.664   2.613  -2.003

  No H/Q in entry =           4
  In of MODEL    3
    1    HA   THR  33           HA       THR  33  -4.198   5.489   1.230
    2    HB   THR  33           HB       THR  33  -2.339   5.751   2.704
    3    HG1  THR  33           HG1      THR  33  -2.906   7.761   2.705
    4   HG23  THR  33          HG21      THR  33  -0.466   5.051   1.458
    5   HG22  THR  33          HG22      THR  33  -0.185   6.741   1.878
    6   HG21  THR  33          HG23      THR  33  -0.708   6.312   0.249
    7    H    THR  33           HN       THR  33  -1.860   3.908   0.595

  No H/Q in entry =           7
  In of MODEL    3
    1    HA3  GLY  34           HA2      GLY  34  -1.948   6.117  -3.461
    2    H    GLY  34           HN       GLY  34  -1.679   5.405  -1.241
    3    HA2  GLY  34           HA1      GLY  34  -3.389   6.999  -2.981

  No H/Q in entry =           3
  In of MODEL    3
    1    HA   ARG  35           HA       ARG  35   0.667   9.520  -2.868
    2    HB2  ARG  35           HB2      ARG  35   0.437  11.060  -0.860
    3    HG2  ARG  35           HG2      ARG  35  -1.300   8.812   0.034
    4    HD2  ARG  35           HD2      ARG  35  -1.905  11.720   0.230
    5    HE   ARG  35           HE       ARG  35  -1.765  10.173   2.552
    6   HH11  ARG  35          HH11      ARG  35  -4.053  12.191   0.857
    7   HH12  ARG  35          HH12      ARG  35  -4.893  12.662   2.296
    8   HH21  ARG  35          HH21      ARG  35  -2.869  10.792   4.446
    9   HH22  ARG  35          HH22      ARG  35  -4.221  11.868   4.333
   10    H    ARG  35           HN       ARG  35  -0.150   7.166  -1.565
   11    HB3  ARG  35           HB1      ARG  35  -1.040  10.715  -1.750
   12    HG3  ARG  35           HG1      ARG  35  -0.215   9.842   0.971
   13    HD3  ARG  35           HD1      ARG  35  -3.001  10.351   0.046

  No H/Q in entry =          13
  In of MODEL    3
    1    HA   SER  36           HA       SER  36   3.693   7.891   0.085
    2    HB2  SER  36           HB2      SER  36   2.247   9.155   1.963
    3    HG   SER  36           HG       SER  36   4.257   9.495   2.438
    4    H    SER  36           HN       SER  36   0.761   7.659   0.122
    5    HB3  SER  36           HB1      SER  36   2.369   7.570   2.725

  No H/Q in entry =           5
  In of MODEL    3
    1    HA   CYS  37           HA       CYS  37   3.622   3.584   0.338
    2    HB2  CYS  37           HB2      CYS  37   6.299   4.252   1.573
    3    H    CYS  37           HN       CYS  37   4.841   6.091   0.943
    4    HB3  CYS  37           HB1      CYS  37   5.805   2.632   1.092

  No H/Q in entry =           4
  In of MODEL    3
    1    HA   GLU  38           HA       GLU  38   3.972   3.475   5.179
    2    HB2  GLU  38           HB2      GLU  38   2.681   6.207   5.272
    3    HG2  GLU  38           HG2      GLU  38   5.468   5.314   5.952
    4    H    GLU  38           HN       GLU  38   4.012   5.449   3.215
    5    HB3  GLU  38           HB1      GLU  38   3.060   5.204   6.666
    6    HG3  GLU  38           HG1      GLU  38   4.980   6.535   4.778

  No H/Q in entry =           6
  In of MODEL    3
    1    HA   CYS  39           HA       CYS  39  -0.276   2.409   4.851
    2    HB2  CYS  39           HB2      CYS  39   1.314   0.426   3.942
    3    H    CYS  39           HN       CYS  39   2.530   1.959   5.629
    4    HB3  CYS  39           HB1      CYS  39   0.654  -0.354   5.376

  No H/Q in entry =           4
  In of MODEL    3
    1    HA   PRO  40           HA       PRO  40  -0.381   2.611   9.462
    2    HB2  PRO  40           HB2      PRO  40  -3.134   3.430   8.660
    3    HG2  PRO  40           HG2      PRO  40  -2.417   5.317   7.500
    4    HD2  PRO  40           HD2      PRO  40  -1.861   3.679   5.977
    5    HB3  PRO  40           HB1      PRO  40  -2.052   4.145   9.861
    6    HG3  PRO  40           HG1      PRO  40  -0.816   5.285   8.263
    7    HD3  PRO  40           HD1      PRO  40  -0.228   4.315   6.258

  No H/Q in entry =           7
  In of MODEL    3
    1    HA   SER  41           HA       SER  41  -2.548  -1.180   9.691
    2    HB2  SER  41           HB2      SER  41  -0.485  -1.514  11.086
    3    HG   SER  41           HG       SER  41  -1.347  -3.255  12.194
    4    H    SER  41           HN       SER  41  -1.033   1.027  10.798
    5    HB3  SER  41           HB1      SER  41  -1.391  -0.912  12.474

  No H/Q in entry =           5
  In of MODEL    3
    1    HA   TYR  42           HA       TYR  42  -6.269  -0.113  11.609
    2    HB2  TYR  42           HB2      TYR  42  -4.763   1.925  12.488
    3    HD1  TYR  42           HD1      TYR  42  -5.236   1.453  14.700
    4    HD2  TYR  42           HD2      TYR  42  -8.461   2.191  12.025
    5    HE1  TYR  42           HE1      TYR  42  -6.817   1.320  16.578
    6    HE2  TYR  42           HE2      TYR  42 -10.051   2.061  13.896
    7    HH   TYR  42           HH       TYR  42 -10.090   2.285  16.299
    8    H    TYR  42           HN       TYR  42  -4.325   0.698   9.656
    9    HB3  TYR  42           HB1      TYR  42  -5.941   2.841  11.554

  No H/Q in entry =           9
  In of MODEL    3
    1    HA   PRO  43           HA       PRO  43  -7.935   1.015   7.433
    2    HB2  PRO  43           HB2      PRO  43  -9.520  -1.173   7.193
    3    HG2  PRO  43           HG2      PRO  43  -9.099  -2.178   9.244
    4    HD2  PRO  43           HD2      PRO  43  -7.301  -1.571  10.550
    5    HB3  PRO  43           HB1      PRO  43  -7.813  -1.172   6.734
    6    HG3  PRO  43           HG1      PRO  43  -7.824  -2.925   8.264
    7    HD3  PRO  43           HD1      PRO  43  -6.172  -1.606   9.181

  No H/Q in entry =           7
  In of MODEL    3
    1    HA3  GLY  44           HA2      GLY  44 -11.927   1.888   9.064
    2    H    GLY  44           HN       GLY  44 -10.488   0.592   6.840
    3    HA2  GLY  44           HA1      GLY  44 -12.308   2.098   7.362

  No H/Q in entry =           3
  In of MODEL    3
    1    HA   ASN  45           HA       ASN  45 -14.672  -1.450   9.156
    2    HB2  ASN  45           HB2      ASN  45 -12.955  -2.415   7.327
    3   HD21  ASN  45          HD21      ASN  45 -15.500  -1.817   7.284
    4   HD22  ASN  45          HD22      ASN  45 -16.493  -3.203   7.006
    5    H    ASN  45           HN       ASN  45 -11.938  -0.644   9.616
    6    HB3  ASN  45           HB1      ASN  45 -12.736  -3.628   8.585

  No H/Q in entry =           6
  In of MODEL    3
    1    HA3  GLY  46           HA2      GLY  46 -11.022  -3.183  12.570
    2    H    GLY  46           HN       GLY  46 -11.558  -2.768  10.309
    3    HA2  GLY  46           HA1      GLY  46 -12.728  -3.065  12.973

  No H/Q in entry =           3
  In of MODEL    4
    1    H1   ALA   1           HT3      ALA   1  17.325  15.189  -7.682
    2    H2   ALA   1           HT2      ALA   1  16.723  15.049  -9.283
    3    H3   ALA   1           HT1      ALA   1  15.648  15.368  -7.983
    4    HA   ALA   1           HA       ALA   1  15.385  13.150  -8.510
    5    HB1  ALA   1           HB1      ALA   1  17.267  12.697  -9.852
    6    HB2  ALA   1           HB2      ALA   1  17.409  11.623  -8.461
    7    HB3  ALA   1           HB3      ALA   1  18.390  13.087  -8.549

  No H/Q in entry =           7
  In of MODEL    4
    1    HA   MET   2           HA       MET   2  15.710  12.138  -4.300
    2    HB2  MET   2           HB2      MET   2  15.080  13.921  -2.673
    3    H    MET   2           HN       MET   2  14.366  13.517  -6.480
    4    HG2  MET   2           HG2      MET   2  14.657  15.610  -5.127
    5    HE3  MET   2           HE1      MET   2  13.321  18.453  -3.969
    6    HB3  MET   2           HB1      MET   2  16.320  14.412  -3.818
    7    HE2  MET   2           HE2      MET   2  12.970  18.134  -2.271
    8    HE1  MET   2           HE3      MET   2  12.440  16.996  -3.510
    9    HG3  MET   2           HG1      MET   2  13.395  15.094  -4.009

  No H/Q in entry =           9
  In of MODEL    4
    1    HA   ASP   3           HA       ASP   3  12.197  10.995  -1.616
    2    HB2  ASP   3           HB2      ASP   3  11.241  13.101  -3.514
    3    H    ASP   3           HN       ASP   3  14.144  11.862  -2.407
    4    HB3  ASP   3           HB1      ASP   3  10.068  11.997  -2.802

  No H/Q in entry =           4
  In of MODEL    4
    1    HA   CYS   4           HA       CYS   4  10.742   8.076  -4.531
    2    HB2  CYS   4           HB2      CYS   4  13.297   7.887  -4.720
    3    H    CYS   4           HN       CYS   4  12.092   8.882  -2.062
    4    HB3  CYS   4           HB1      CYS   4  13.164   6.574  -3.555

  No H/Q in entry =           4
  In of MODEL    4
    1    HA   THR   5           HA       THR   5   8.623   6.023  -1.233
    2    HB   THR   5           HB       THR   5   6.709   6.805  -2.476
    3    HG1  THR   5           HG1      THR   5   5.638   5.327  -1.478
    4   HG21  THR   5          HG21      THR   5   7.445   4.706  -4.488
    5   HG23  THR   5          HG22      THR   5   7.230   6.439  -4.739
    6   HG22  THR   5          HG23      THR   5   5.835   5.420  -4.387
    7    H    THR   5           HN       THR   5   8.941   7.177  -3.763

  No H/Q in entry =           7
  In of MODEL    4
    1    HA   THR   6           HA       THR   6   9.166   1.731  -2.389
    2    HB   THR   6           HB       THR   6  10.960   0.974  -0.704
    3    HG1  THR   6           HG1      THR   6  10.938   3.738  -0.088
    4   HG23  THR   6          HG21      THR   6  11.565   1.770  -2.921
    5   HG22  THR   6          HG22      THR   6  12.718   2.317  -1.704
    6   HG21  THR   6          HG23      THR   6  11.513   3.435  -2.343
    7    H    THR   6           HN       THR   6   8.392   3.852  -0.577

  No H/Q in entry =           7
  In of MODEL    4
    1    HA3  GLY   7           HA2      GLY   7   7.971  -1.567   0.453
    2    H    GLY   7           HN       GLY   7   8.492  -0.285  -1.720
    3    HA2  GLY   7           HA1      GLY   7   6.799  -0.279   0.689

  No H/Q in entry =           3
  In of MODEL    4
    1    HA   PRO   8           HA       PRO   8   4.887  -3.721  -1.857
    2    HB2  PRO   8           HB2      PRO   8   3.206  -4.777  -0.058
    3    HG2  PRO   8           HG2      PRO   8   3.548  -3.352   1.740
    4    HD2  PRO   8           HD2      PRO   8   5.319  -1.906   1.779
    5    HB3  PRO   8           HB1      PRO   8   4.906  -5.257  -0.126
    6    HG3  PRO   8           HG1      PRO   8   4.774  -4.583   2.094
    7    HD3  PRO   8           HD1      PRO   8   6.499  -3.202   1.502

  No H/Q in entry =           7
  In of MODEL    4
    1    HA   CYS   9           HA       CYS   9   1.581  -1.094  -2.846
    2    HB2  CYS   9           HB2      CYS   9   1.856  -0.712  -0.101
    3    H    CYS   9           HN       CYS   9   4.276  -1.083  -2.132
    4    HB3  CYS   9           HB1      CYS   9   1.614   0.912  -0.737

  No H/Q in entry =           4
  In of MODEL    4
    1    HA   CYS  10           HA       CYS  10   3.369   2.181  -5.070
    2    HB2  CYS  10           HB2      CYS  10   5.342   3.487  -4.246
    3    H    CYS  10           HN       CYS  10   4.081  -0.305  -3.925
    4    HB3  CYS  10           HB1      CYS  10   4.126   3.168  -3.014

  No H/Q in entry =           4
  In of MODEL    4
    1    HA   ARG  11           HA       ARG  11   5.889   0.464  -8.128
    2    HB2  ARG  11           HB2      ARG  11   5.249   3.257  -8.815
    3    HG2  ARG  11           HG2      ARG  11   5.320   0.710 -10.418
    4    HD2  ARG  11           HD2      ARG  11   3.688   2.294 -11.798
    5    HE   ARG  11           HE       ARG  11   6.400   2.829 -12.540
    6   HH11  ARG  11          HH11      ARG  11   3.954   0.346 -12.358
    7   HH12  ARG  11          HH12      ARG  11   4.658  -0.615 -13.614
    8   HH21  ARG  11          HH21      ARG  11   7.327   1.566 -14.193
    9   HH22  ARG  11          HH22      ARG  11   6.574   0.077 -14.656
   10    H    ARG  11           HN       ARG  11   4.514   2.590  -6.928
   11    HB3  ARG  11           HB1      ARG  11   6.676   2.613  -9.614
   12    HG3  ARG  11           HG1      ARG  11   3.896   1.461  -9.695
   13    HD3  ARG  11           HD1      ARG  11   4.748   3.533 -11.126

  No H/Q in entry =          13
  In of MODEL    4
    1    HA   GLN  12           HA       GLN  12  10.129   0.916  -7.448
    2    HB2  GLN  12           HB2      GLN  12  10.063   1.784 -10.295
    3    HG2  GLN  12           HG2      GLN  12  10.236  -0.639  -9.323
    4   HE21  GLN  12          HE21      GLN  12  11.369  -1.803  -7.964
    5   HE22  GLN  12          HE22      GLN  12  13.061  -1.654  -7.648
    6    H    GLN  12           HN       GLN  12   8.123   1.285  -9.340
    7    HB3  GLN  12           HB1      GLN  12  11.557   2.029  -9.403
    8    HG3  GLN  12           HG1      GLN  12  11.150  -0.165 -10.754

  No H/Q in entry =           8
  In of MODEL    4
    1    HA   CYS  13           HA       CYS  13   9.793   5.349  -6.450
    2    HB2  CYS  13           HB2      CYS  13  11.322   5.316  -8.682
    3    H    CYS  13           HN       CYS  13   8.617   3.841  -8.595
    4    HB3  CYS  13           HB1      CYS  13  10.271   6.679  -9.051

  No H/Q in entry =           4
  In of MODEL    4
    1    HA   LYS  14           HA       LYS  14   5.965   7.245  -7.475
    2    HB2  LYS  14           HB2      LYS  14   6.111   5.880  -9.767
    3    HG2  LYS  14           HG2      LYS  14   3.973   7.666  -8.735
    4    HD2  LYS  14           HD2      LYS  14   3.328   7.555 -11.347
    5    HE2  LYS  14           HE2      LYS  14   1.361   6.246 -10.691
    6    HZ3  LYS  14           HZ1      LYS  14   1.964   7.955  -8.372
    7    HZ2  LYS  14           HZ2      LYS  14   0.513   7.783  -9.224
    8    HZ1  LYS  14           HZ3      LYS  14   1.795   8.649  -9.906
    9    H    LYS  14           HN       LYS  14   7.149   4.571  -7.367
   10    HB3  LYS  14           HB1      LYS  14   4.651   5.145  -9.121
   11    HG3  LYS  14           HG1      LYS  14   5.133   7.925 -10.039
   12    HD3  LYS  14           HD1      LYS  14   3.731   5.862 -11.057
   13    HE3  LYS  14           HE1      LYS  14   2.157   5.819  -9.178

  No H/Q in entry =          13
  In of MODEL    4
    1    HA   LEU  15           HA       LEU  15   3.273   5.318  -4.667
    2    HB2  LEU  15           HB2      LEU  15   3.085   8.017  -4.596
    3    HG   LEU  15           HG       LEU  15   1.624   7.829  -2.595
    4   HD12  LEU  15          HD11      LEU  15   1.669   4.872  -2.802
    5   HD11  LEU  15          HD12      LEU  15   0.462   5.743  -3.748
    6   HD13  LEU  15          HD13      LEU  15   0.518   5.936  -1.996
    7   HD22  LEU  15          HD21      LEU  15   3.809   7.602  -1.969
    8   HD21  LEU  15          HD22      LEU  15   4.073   6.192  -2.994
    9   HD23  LEU  15          HD23      LEU  15   3.191   6.025  -1.476
   10    H    LEU  15           HN       LEU  15   3.801   7.350  -6.678
   11    HB3  LEU  15           HB1      LEU  15   1.423   7.600  -4.968

  No H/Q in entry =          11
  In of MODEL    4
    1    HA   LYS  16           HA       LYS  16   0.176   3.499  -7.106
    2    HB2  LYS  16           HB2      LYS  16   0.615   2.088  -4.617
    3    HG2  LYS  16           HG2      LYS  16  -0.139   0.135  -6.135
    4    HD2  LYS  16           HD2      LYS  16   2.274   1.839  -6.736
    5    HE2  LYS  16           HE2      LYS  16   1.352  -0.729  -7.856
    6    HZ1  LYS  16           HZ1      LYS  16   3.262  -1.293  -6.336
    7    HZ3  LYS  16           HZ2      LYS  16   4.239  -0.340  -7.335
    8    HZ2  LYS  16           HZ3      LYS  16   3.466  -1.707  -7.964
    9    H    LYS  16           HN       LYS  16   1.540   3.970  -4.628
   10    HB3  LYS  16           HB1      LYS  16  -1.068   1.970  -5.113
   11    HG3  LYS  16           HG1      LYS  16  -0.072   1.338  -7.425
   12    HD3  LYS  16           HD1      LYS  16   2.177   0.489  -5.603
   13    HE3  LYS  16           HE1      LYS  16   2.421   0.491  -8.545

  No H/Q in entry =          13
  In of MODEL    4
    1    HA   PRO  17           HA       PRO  17  -3.631   5.618  -6.472
    2    HB2  PRO  17           HB2      PRO  17  -5.541   3.795  -7.111
    3    HG2  PRO  17           HG2      PRO  17  -4.259   1.861  -7.047
    4    HD2  PRO  17           HD2      PRO  17  -1.955   1.925  -7.065
    5    HB3  PRO  17           HB1      PRO  17  -4.500   4.561  -8.317
    6    HG3  PRO  17           HG1      PRO  17  -4.038   2.322  -8.745
    7    HD3  PRO  17           HD1      PRO  17  -1.902   3.114  -8.382

  No H/Q in entry =           7
  In of MODEL    4
    1    HA   ALA  18           HA       ALA  18  -4.946   4.638  -2.443
    2    HB1  ALA  18           HB1      ALA  18  -5.167   7.111  -2.580
    3    HB2  ALA  18           HB2      ALA  18  -6.366   6.348  -1.534
    4    HB3  ALA  18           HB3      ALA  18  -6.822   6.890  -3.149
    5    H    ALA  18           HN       ALA  18  -5.078   6.103  -4.889

  No H/Q in entry =           5
  In of MODEL    4
    1    HA3  GLY  19           HA2      GLY  19  -8.160   1.790  -1.716
    2    H    GLY  19           HN       GLY  19  -5.945   2.733  -2.252
    3    HA2  GLY  19           HA1      GLY  19  -8.746   2.560  -3.182

  No H/Q in entry =           3
  In of MODEL    4
    1    HA   THR  20           HA       THR  20  -6.750  -1.236  -4.659
    2    HB   THR  20           HB       THR  20  -5.174   0.310  -5.796
    3    HG1  THR  20           HG1      THR  20  -4.851  -1.465  -6.849
    4   HG21  THR  20          HG21      THR  20  -3.736   0.783  -3.814
    5   HG23  THR  20          HG22      THR  20  -2.858   0.369  -5.287
    6   HG22  THR  20          HG23      THR  20  -3.047  -0.829  -4.007
    7    H    THR  20           HN       THR  20  -5.685   0.852  -2.871

  No H/Q in entry =           7
  In of MODEL    4
    1    HA   THR  21           HA       THR  21  -5.257  -4.295  -2.033
    2    HB   THR  21           HB       THR  21  -3.710  -6.066  -3.298
    3    HG1  THR  21           HG1      THR  21  -3.327  -5.237  -5.212
    4   HG21  THR  21          HG21      THR  21  -6.633  -5.604  -3.460
    5   HG23  THR  21          HG22      THR  21  -5.732  -6.947  -2.756
    6   HG22  THR  21          HG23      THR  21  -5.916  -6.829  -4.506
    7    H    THR  21           HN       THR  21  -5.208  -3.213  -4.643

  No H/Q in entry =           7
  In of MODEL    4
    1    HA   CYS  22           HA       CYS  22  -0.862  -3.854  -1.340
    2    HB2  CYS  22           HB2      CYS  22  -2.125  -2.399   0.221
    3    H    CYS  22           HN       CYS  22  -3.428  -5.165  -0.837
    4    HB3  CYS  22           HB1      CYS  22  -2.271  -3.753   1.336

  No H/Q in entry =           4
  In of MODEL    4
    1    HA   TRP  23           HA       TRP  23  -0.666  -8.142   0.351
    2    HB2  TRP  23           HB2      TRP  23   0.322  -6.731   2.172
    3    HD1  TRP  23           HD1      TRP  23   1.692  -9.085   1.282
    4    HE1  TRP  23           HE1      TRP  23   2.312 -11.130   2.716
    5    HE3  TRP  23           HE3      TRP  23  -1.653  -8.448   5.096
    6    HZ2  TRP  23           HZ2      TRP  23   1.492 -12.317   5.143
    7    HZ3  TRP  23           HZ3      TRP  23  -1.670 -10.083   6.935
    8    HH2  TRP  23           HH2      TRP  23  -0.130 -11.977   6.956
    9    H    TRP  23           HN       TRP  23  -2.652  -6.103   0.749
   10    HB3  TRP  23           HB1      TRP  23  -1.081  -7.114   3.165

  No H/Q in entry =          10
  In of MODEL    4
    1    HA   ARG  24           HA       ARG  24  -4.771  -9.716   1.305
    2    HB2  ARG  24           HB2      ARG  24  -5.700 -10.951  -0.666
    3    HG2  ARG  24           HG2      ARG  24  -3.630  -9.656  -2.371
    4    HD2  ARG  24           HD2      ARG  24  -4.334 -11.230  -3.987
    5    HE   ARG  24           HE       ARG  24  -6.197  -9.532  -3.014
    6   HH11  ARG  24          HH11      ARG  24  -6.364 -12.779  -4.282
    7   HH12  ARG  24          HH12      ARG  24  -7.970 -12.589  -4.900
    8   HH21  ARG  24          HH21      ARG  24  -8.309  -9.280  -3.827
    9   HH22  ARG  24          HH22      ARG  24  -9.075 -10.602  -4.643
   10    H    ARG  24           HN       ARG  24  -2.616  -9.082  -0.519
   11    HB3  ARG  24           HB1      ARG  24  -5.398  -9.243  -0.957
   12    HG3  ARG  24           HG1      ARG  24  -3.311 -11.248  -1.679
   13    HD3  ARG  24           HD1      ARG  24  -5.170 -12.205  -2.780

  No H/Q in entry =          13
  In of MODEL    4
    1    HA   THR  25           HA       THR  25  -3.678 -14.009   1.561
    2    HB   THR  25           HB       THR  25  -2.590 -14.343   3.674
    3    HG1  THR  25           HG1      THR  25  -2.959 -13.129   5.408
    4   HG21  THR  25          HG21      THR  25  -1.383 -12.875   2.094
    5   HG23  THR  25          HG22      THR  25  -0.992 -12.568   3.786
    6   HG22  THR  25          HG23      THR  25  -2.075 -11.479   2.919
    7    H    THR  25           HN       THR  25  -5.144 -11.626   2.297

  No H/Q in entry =           7
  In of MODEL    4
    1    HA   SER  26           HA       SER  26  -7.066 -15.721   3.738
    2    HB2  SER  26           HB2      SER  26  -6.713 -18.066   4.522
    3    HG   SER  26           HG       SER  26  -4.010 -17.836   3.841
    4    H    SER  26           HN       SER  26  -4.141 -15.592   3.718
    5    HB3  SER  26           HB1      SER  26  -5.971 -17.735   2.957

  No H/Q in entry =           5
  In of MODEL    4
    1    HA   VAL  27           HA       VAL  27  -6.404 -14.898   8.068
    2    HB   VAL  27           HB       VAL  27  -4.170 -12.921   7.618
    3    H    VAL  27           HN       VAL  27  -5.559 -13.870   5.438

  No H/Q in entry =           3
  In of MODEL    4
    1    HA   SER  28           HA       SER  28  -8.449 -10.904   7.010
    2    HB2  SER  28           HB2      SER  28  -7.634  -9.019   8.153
    3    HG   SER  28           HG       SER  28  -4.992  -9.669   7.363
    4    H    SER  28           HN       SER  28  -6.024 -12.051   6.019
    5    HB3  SER  28           HB1      SER  28  -6.624 -10.334   8.752

  No H/Q in entry =           5
  In of MODEL    4
    1    HA   SER  29           HA       SER  29  -7.167  -8.377   3.492
    2    HB2  SER  29           HB2      SER  29  -9.983  -7.724   4.346
    3    HG   SER  29           HG       SER  29  -9.274  -9.860   3.516
    4    H    SER  29           HN       SER  29  -8.204  -8.313   6.237
    5    HB3  SER  29           HB1      SER  29  -9.311  -7.115   2.834

  No H/Q in entry =           5
  In of MODEL    4
    1    HA   HIS  30           HA       HIS  30  -6.979  -3.961   4.226
    2    HB2  HIS  30           HB2      HIS  30  -4.246  -5.111   3.630
    3    HD1  HIS  30           HD1      HIS  30  -3.562  -6.629   5.440
    4    HD2  HIS  30           HD2      HIS  30  -6.203  -3.721   6.795
    5    HE1  HIS  30           HE1      HIS  30  -3.866  -7.088   7.894
    6    HE2  HIS  30           HE2      HIS  30  -5.535  -5.368   8.674
    7    H    HIS  30           HN       HIS  30  -6.667  -6.336   2.601
    8    HB3  HIS  30           HB1      HIS  30  -4.527  -3.478   4.224

  No H/Q in entry =           8
  In of MODEL    4
    1    HA   TYR  31           HA       TYR  31  -5.727  -2.366   0.216
    2    HB2  TYR  31           HB2      TYR  31  -7.680  -0.432   1.481
    3    HD1  TYR  31           HD1      TYR  31  -9.727  -1.292   2.074
    4    HD2  TYR  31           HD2      TYR  31  -7.496  -3.257  -0.970
    5    HE1  TYR  31           HE1      TYR  31 -11.503  -2.980   1.870
    6    HE2  TYR  31           HE2      TYR  31  -9.266  -4.950  -1.182
    7    HH   TYR  31           HH       TYR  31 -11.995  -4.846  -0.580
    8    H    TYR  31           HN       TYR  31  -5.991  -2.028   3.107
    9    HB3  TYR  31           HB1      TYR  31  -7.339  -0.576  -0.240

  No H/Q in entry =           9
  In of MODEL    4
    1    HA   CYS  32           HA       CYS  32  -2.838   0.804   0.711
    2    HB2  CYS  32           HB2      CYS  32  -3.064   0.155  -1.925
    3    H    CYS  32           HN       CYS  32  -4.928  -0.395  -0.857
    4    HB3  CYS  32           HB1      CYS  32  -3.359   1.889  -1.982

  No H/Q in entry =           4
  In of MODEL    4
    1    HA   THR  33           HA       THR  33  -4.999   4.522   1.369
    2    HB   THR  33           HB       THR  33  -3.542   4.477   3.280
    3    HG1  THR  33           HG1      THR  33  -3.295   7.027   2.070
    4   HG23  THR  33          HG21      THR  33  -1.385   4.075   2.543
    5   HG22  THR  33          HG22      THR  33  -1.322   5.747   3.103
    6   HG21  THR  33          HG23      THR  33  -1.430   5.398   1.378
    7    H    THR  33           HN       THR  33  -2.496   3.072   0.975

  No H/Q in entry =           7
  In of MODEL    4
    1    HA3  GLY  34           HA2      GLY  34  -1.830   5.762  -2.555
    2    H    GLY  34           HN       GLY  34  -1.987   4.718  -0.433
    3    HA2  GLY  34           HA1      GLY  34  -3.216   6.758  -2.139

  No H/Q in entry =           3
  In of MODEL    4
    1    HA   ARG  35           HA       ARG  35  -0.543   9.694  -0.322
    2    HB2  ARG  35           HB2      ARG  35  -2.226   9.267   1.738
    3    HG2  ARG  35           HG2      ARG  35  -0.128  11.291   1.275
    4    HD2  ARG  35           HD2      ARG  35  -1.059  12.418   3.429
    5    HE   ARG  35           HE       ARG  35   1.276  10.980   3.018
    6   HH11  ARG  35          HH11      ARG  35  -0.747  11.910   5.706
    7   HH12  ARG  35          HH12      ARG  35   0.560  11.939   6.841
    8   HH21  ARG  35          HH21      ARG  35   2.997  11.018   4.510
    9   HH22  ARG  35          HH22      ARG  35   2.686  11.433   6.163
   10    H    ARG  35           HN       ARG  35  -2.044   7.391   0.519
   11    HB3  ARG  35           HB1      ARG  35  -0.692   9.004   2.557
   12    HG3  ARG  35           HG1      ARG  35  -1.870  11.483   1.484
   13    HD3  ARG  35           HD1      ARG  35  -1.380  10.760   3.936

  No H/Q in entry =          13
  In of MODEL    4
    1    HA   SER  36           HA       SER  36   2.988   7.034   0.703
    2    HB2  SER  36           HB2      SER  36   1.916   6.321   3.444
    3    HG   SER  36           HG       SER  36   1.856   8.562   2.971
    4    H    SER  36           HN       SER  36   0.152   6.604   1.168
    5    HB3  SER  36           HB1      SER  36   3.619   6.336   2.986

  No H/Q in entry =           5
  In of MODEL    4
    1    HA   CYS  37           HA       CYS  37   2.883   2.825  -0.211
    2    HB2  CYS  37           HB2      CYS  37   5.391   3.596  -0.401
    3    H    CYS  37           HN       CYS  37   4.250   5.027   0.979
    4    HB3  CYS  37           HB1      CYS  37   5.608   2.546   0.995

  No H/Q in entry =           4
  In of MODEL    4
    1    HA   GLU  38           HA       GLU  38   3.748   1.202   4.282
    2    HB2  GLU  38           HB2      GLU  38   4.167   3.689   5.160
    3    HG2  GLU  38           HG2      GLU  38   3.496   2.666   7.545
    4    H    GLU  38           HN       GLU  38   3.763   3.692   3.037
    5    HB3  GLU  38           HB1      GLU  38   2.509   3.497   5.714
    6    HG3  GLU  38           HG1      GLU  38   3.564   1.185   6.590

  No H/Q in entry =           6
  In of MODEL    4
    1    HA   CYS  39           HA       CYS  39  -0.607   0.605   4.488
    2    HB2  CYS  39           HB2      CYS  39   0.911  -1.920   4.017
    3    H    CYS  39           HN       CYS  39   2.186  -0.124   5.088
    4    HB3  CYS  39           HB1      CYS  39  -0.795  -2.043   4.431

  No H/Q in entry =           4
  In of MODEL    4
    1    HA   PRO  40           HA       PRO  40  -0.352   0.268   9.091
    2    HB2  PRO  40           HB2      PRO  40  -3.034   1.484   8.625
    3    HG2  PRO  40           HG2      PRO  40  -2.180   3.406   7.625
    4    HD2  PRO  40           HD2      PRO  40  -1.942   1.908   5.888
    5    HB3  PRO  40           HB1      PRO  40  -1.788   1.922   9.799
    6    HG3  PRO  40           HG1      PRO  40  -0.543   3.103   8.237
    7    HD3  PRO  40           HD1      PRO  40  -0.229   2.325   6.091

  No H/Q in entry =           7
  In of MODEL    4
    1    HA   SER  41           HA       SER  41  -2.949  -3.240   9.128
    2    HB2  SER  41           HB2      SER  41  -2.416  -4.666  10.987
    3    HG   SER  41           HG       SER  41  -0.809  -3.210  12.477
    4    H    SER  41           HN       SER  41  -1.213  -1.287  10.378
    5    HB3  SER  41           HB1      SER  41  -0.924  -3.866  10.494

  No H/Q in entry =           5
  In of MODEL    4
    1    HA   TYR  42           HA       TYR  42  -6.295  -1.715  11.521
    2    HB2  TYR  42           HB2      TYR  42  -5.162   0.427  11.911
    3    HD1  TYR  42           HD1      TYR  42  -8.052   1.574   9.957
    4    HD2  TYR  42           HD2      TYR  42  -6.668   0.350  13.789
    5    HE1  TYR  42           HE1      TYR  42 -10.116   2.443  10.973
    6    HE2  TYR  42           HE2      TYR  42  -8.728   1.215  14.816
    7    HH   TYR  42           HH       TYR  42 -10.488   2.805  14.356
    8    H    TYR  42           HN       TYR  42  -4.521  -1.190   9.238
    9    HB3  TYR  42           HB1      TYR  42  -5.697   1.004  10.337

  No H/Q in entry =           9
  In of MODEL    4
    1    HA   PRO  43           HA       PRO  43  -9.283  -2.363   8.308
    2    HB2  PRO  43           HB2      PRO  43 -11.552  -2.209   9.780
    3    HG2  PRO  43           HG2      PRO  43 -10.690  -1.267  11.720
    4    HD2  PRO  43           HD2      PRO  43  -8.430  -1.245  12.159
    5    HB3  PRO  43           HB1      PRO  43 -10.460  -3.597   9.853
    6    HG3  PRO  43           HG1      PRO  43 -10.502  -2.989  12.098
    7    HD3  PRO  43           HD1      PRO  43  -8.230  -2.953  11.723

  No H/Q in entry =           7
  In of MODEL    4
    1    HA3  GLY  44           HA2      GLY  44 -11.887   0.932   6.937
    2    H    GLY  44           HN       GLY  44 -10.036  -0.993   6.822
    3    HA2  GLY  44           HA1      GLY  44 -10.475   1.792   7.534

  No H/Q in entry =           3
  In of MODEL    4
    1    HA   ASN  45           HA       ASN  45 -10.427   1.981   3.002
    2    HB2  ASN  45           HB2      ASN  45 -12.018   4.033   3.736
    3   HD21  ASN  45          HD21      ASN  45 -13.294   3.292   2.158
    4   HD22  ASN  45          HD22      ASN  45 -12.949   3.418   0.470
    5    H    ASN  45           HN       ASN  45 -11.074   3.109   5.572
    6    HB3  ASN  45           HB1      ASN  45 -10.557   4.925   3.319

  No H/Q in entry =           6
  In of MODEL    4
    1    HA3  GLY  46           HA2      GLY  46  -6.406   3.918   4.974
    2    H    GLY  46           HN       GLY  46  -9.019   4.618   4.958
    3    HA2  GLY  46           HA1      GLY  46  -6.606   4.599   3.367

  No H/Q in entry =           3
  In of MODEL    5
    1    H1   ALA   1           HT3      ALA   1  20.355  14.169  -7.405
    2    H2   ALA   1           HT2      ALA   1  21.213  13.035  -6.444
    3    H3   ALA   1           HT1      ALA   1  21.229  12.900  -8.155
    4    HA   ALA   1           HA       ALA   1  19.118  12.157  -8.275
    5    HB3  ALA   1           HB1      ALA   1  20.856  10.739  -6.868
    6    HB1  ALA   1           HB2      ALA   1  19.193  10.203  -7.108
    7    HB2  ALA   1           HB3      ALA   1  19.656  10.990  -5.599

  No H/Q in entry =           7
  In of MODEL    5
    1    HA   MET   2           HA       MET   2  16.403  13.679  -5.069
    2    HB2  MET   2           HB2      MET   2  14.122  13.679  -6.081
    3    H    MET   2           HN       MET   2  17.109  11.478  -6.887
    4    HG2  MET   2           HG2      MET   2  15.410  12.052  -8.261
    5    HE3  MET   2           HE1      MET   2  13.716  15.285  -9.114
    6    HB3  MET   2           HB1      MET   2  15.385  14.231  -7.174
    7    HE2  MET   2           HE2      MET   2  13.987  14.354 -10.587
    8    HE1  MET   2           HE3      MET   2  15.177  14.313  -9.286
    9    HG3  MET   2           HG1      MET   2  14.164  11.480  -7.154

  No H/Q in entry =           9
  In of MODEL    5
    1    HA   ASP   3           HA       ASP   3  14.452  10.524  -2.803
    2    HB2  ASP   3           HB2      ASP   3  12.809  12.961  -2.302
    3    H    ASP   3           HN       ASP   3  14.028  13.058  -4.171
    4    HB3  ASP   3           HB1      ASP   3  12.255  11.439  -1.612

  No H/Q in entry =           4
  In of MODEL    5
    1    HA   CYS   4           HA       CYS   4  10.530   9.035  -4.380
    2    HB2  CYS   4           HB2      CYS   4  12.690   8.192  -5.652
    3    H    CYS   4           HN       CYS   4  12.843   8.902  -2.641
    4    HB3  CYS   4           HB1      CYS   4  12.311   6.679  -4.836

  No H/Q in entry =           4
  In of MODEL    5
    1    HA   THR   5           HA       THR   5   9.189   6.804  -0.863
    2    HB   THR   5           HB       THR   5   6.716   6.352  -2.448
    3    HG1  THR   5           HG1      THR   5   6.922   8.384  -3.101
    4   HG23  THR   5          HG21      THR   5   6.627   5.753  -0.148
    5   HG22  THR   5          HG22      THR   5   5.662   7.213  -0.368
    6   HG21  THR   5          HG23      THR   5   7.273   7.320   0.342
    7    H    THR   5           HN       THR   5   8.903   8.167  -3.292

  No H/Q in entry =           7
  In of MODEL    5
    1    HA   THR   6           HA       THR   6   8.761   2.669  -2.479
    2    HB   THR   6           HB       THR   6  10.439   1.408  -0.829
    3    HG1  THR   6           HG1      THR   6  11.919   2.928   0.010
    4   HG21  THR   6          HG21      THR   6  10.873   1.946  -3.206
    5   HG23  THR   6          HG22      THR   6  12.294   2.084  -2.171
    6   HG22  THR   6          HG23      THR   6  11.444   3.535  -2.699
    7    H    THR   6           HN       THR   6   8.700   4.623  -0.303

  No H/Q in entry =           7
  In of MODEL    5
    1    HA3  GLY   7           HA2      GLY   7   7.679  -0.590   0.737
    2    H    GLY   7           HN       GLY   7   8.519   0.377  -1.512
    3    HA2  GLY   7           HA1      GLY   7   6.355   0.534   0.473

  No H/Q in entry =           3
  In of MODEL    5
    1    HA   PRO   8           HA       PRO   8   5.372  -3.609  -1.507
    2    HB2  PRO   8           HB2      PRO   8   3.002  -3.995  -0.241
    3    HG2  PRO   8           HG2      PRO   8   2.954  -2.081   1.073
    4    HD2  PRO   8           HD2      PRO   8   4.840  -0.808   1.438
    5    HB3  PRO   8           HB1      PRO   8   4.547  -4.533   0.428
    6    HG3  PRO   8           HG1      PRO   8   3.792  -3.193   2.172
    7    HD3  PRO   8           HD1      PRO   8   5.849  -2.227   1.784

  No H/Q in entry =           7
  In of MODEL    5
    1    HA   CYS   9           HA       CYS   9   1.787  -1.245  -3.181
    2    HB2  CYS   9           HB2      CYS   9   0.740  -0.640  -0.943
    3    H    CYS   9           HN       CYS   9   3.402  -0.769  -0.786
    4    HB3  CYS   9           HB1      CYS   9   1.426   0.967  -1.159

  No H/Q in entry =           4
  In of MODEL    5
    1    HA   CYS  10           HA       CYS  10   4.260   2.182  -4.640
    2    HB2  CYS  10           HB2      CYS  10   6.102   1.358  -2.816
    3    H    CYS  10           HN       CYS  10   4.508  -0.542  -3.543
    4    HB3  CYS  10           HB1      CYS  10   6.972   1.061  -4.317

  No H/Q in entry =           4
  In of MODEL    5
    1    HA   ARG  11           HA       ARG  11   5.111   0.108  -8.392
    2    HB2  ARG  11           HB2      ARG  11   3.712   2.697  -8.833
    3    HG2  ARG  11           HG2      ARG  11   2.408   0.678  -8.418
    4    HD2  ARG  11           HD2      ARG  11   4.114  -0.364 -10.600
    5    HE   ARG  11           HE       ARG  11   1.271  -0.668 -10.730
    6   HH11  ARG  11          HH11      ARG  11   4.317  -2.273 -11.297
    7   HH12  ARG  11          HH12      ARG  11   3.667  -3.356 -12.483
    8   HH21  ARG  11          HH21      ARG  11   0.415  -2.091 -12.288
    9   HH22  ARG  11          HH22      ARG  11   1.453  -3.253 -13.046
   10    H    ARG  11           HN       ARG  11   4.607   2.491  -6.768
   11    HB3  ARG  11           HB1      ARG  11   4.461   1.934 -10.229
   12    HG3  ARG  11           HG1      ARG  11   2.118   1.320 -10.036
   13    HD3  ARG  11           HD1      ARG  11   3.449  -1.187  -9.189

  No H/Q in entry =          13
  In of MODEL    5
    1    HA   GLN  12           HA       GLN  12   9.536   0.362  -8.684
    2    HB2  GLN  12           HB2      GLN  12   8.004   1.666 -10.853
    3    HG2  GLN  12           HG2      GLN  12  10.440  -0.065 -11.085
    4   HE21  GLN  12          HE21      GLN  12  11.021  -0.176 -13.119
    5   HE22  GLN  12          HE22      GLN  12   9.996   0.046 -14.492
    6    H    GLN  12           HN       GLN  12   7.374   0.015  -8.080
    7    HB3  GLN  12           HB1      GLN  12   9.693   2.132 -10.716
    8    HG3  GLN  12           HG1      GLN  12   8.832  -0.739 -10.822

  No H/Q in entry =           8
  In of MODEL    5
    1    HA   CYS  13           HA       CYS  13   9.665   4.703  -7.182
    2    HB2  CYS  13           HB2      CYS  13  11.043   4.674  -9.517
    3    H    CYS  13           HN       CYS  13   8.385   3.585  -9.564
    4    HB3  CYS  13           HB1      CYS  13  10.181   6.200  -9.678

  No H/Q in entry =           4
  In of MODEL    5
    1    HA   LYS  14           HA       LYS  14   6.078   7.163  -7.809
    2    HB2  LYS  14           HB2      LYS  14   5.937   6.214 -10.214
    3    HG2  LYS  14           HG2      LYS  14   4.515   8.170  -9.017
    4    HD2  LYS  14           HD2      LYS  14   2.666   5.953  -9.571
    5    HE2  LYS  14           HE2      LYS  14   2.309   8.656 -10.762
    6    HZ2  LYS  14           HZ1      LYS  14   0.106   8.801 -10.354
    7    HZ1  LYS  14           HZ2      LYS  14   0.538   8.010  -8.923
    8    HZ3  LYS  14           HZ3      LYS  14  -0.111   7.129 -10.212
    9    H    LYS  14           HN       LYS  14   6.894   4.359  -7.998
   10    HB3  LYS  14           HB1      LYS  14   4.570   5.288  -9.610
   11    HG3  LYS  14           HG1      LYS  14   4.366   7.728 -10.719
   12    HD3  LYS  14           HD1      LYS  14   2.491   7.334  -8.487
   13    HE3  LYS  14           HE1      LYS  14   1.813   7.079 -11.376

  No H/Q in entry =          13
  In of MODEL    5
    1    HA   LEU  15           HA       LEU  15   3.285   5.508  -4.954
    2    HB2  LEU  15           HB2      LEU  15   2.369   8.235  -5.674
    3    HG   LEU  15           HG       LEU  15   3.420   6.886  -3.242
    4   HD12  LEU  15          HD11      LEU  15   3.815   9.745  -3.964
    5   HD11  LEU  15          HD12      LEU  15   4.581   8.504  -4.957
    6   HD13  LEU  15          HD13      LEU  15   4.936   8.597  -3.232
    7   HD21  LEU  15          HD21      LEU  15   1.037   8.097  -2.942
    8   HD23  LEU  15          HD22      LEU  15   2.111   9.485  -2.770
    9   HD22  LEU  15          HD23      LEU  15   2.292   8.092  -1.704
   10    H    LEU  15           HN       LEU  15   3.858   7.425  -7.032
   11    HB3  LEU  15           HB1      LEU  15   1.250   7.244  -4.759

  No H/Q in entry =          11
  In of MODEL    5
    1    HA   LYS  16           HA       LYS  16   0.158   3.530  -7.228
    2    HB2  LYS  16           HB2      LYS  16   0.386   2.345  -4.510
    3    HG2  LYS  16           HG2      LYS  16   0.555   1.268  -7.310
    4    HD2  LYS  16           HD2      LYS  16   1.123  -0.346  -4.857
    5    HE2  LYS  16           HE2      LYS  16   0.105  -1.292  -7.511
    6    HZ1  LYS  16           HZ1      LYS  16   1.853  -2.536  -5.457
    7    HZ3  LYS  16           HZ2      LYS  16   1.346  -3.270  -6.894
    8    HZ2  LYS  16           HZ3      LYS  16   0.214  -2.882  -5.699
    9    H    LYS  16           HN       LYS  16   1.444   4.258  -4.736
   10    HB3  LYS  16           HB1      LYS  16  -1.030   1.914  -5.459
   11    HG3  LYS  16           HG1      LYS  16   1.859   1.448  -6.135
   12    HD3  LYS  16           HD1      LYS  16  -0.514  -0.267  -5.510
   13    HE3  LYS  16           HE1      LYS  16   1.816  -0.936  -7.272

  No H/Q in entry =          13
  In of MODEL    5
    1    HA   PRO  17           HA       PRO  17  -3.686   5.601  -6.676
    2    HB2  PRO  17           HB2      PRO  17  -5.533   3.697  -7.301
    3    HG2  PRO  17           HG2      PRO  17  -4.172   1.819  -7.241
    4    HD2  PRO  17           HD2      PRO  17  -1.869   1.977  -7.268
    5    HB3  PRO  17           HB1      PRO  17  -4.528   4.507  -8.508
    6    HG3  PRO  17           HG1      PRO  17  -3.967   2.293  -8.938
    7    HD3  PRO  17           HD1      PRO  17  -1.871   3.188  -8.566

  No H/Q in entry =           7
  In of MODEL    5
    1    HA   ALA  18           HA       ALA  18  -4.839   4.814  -2.550
    2    HB1  ALA  18           HB1      ALA  18  -5.693   7.243  -3.333
    3    HB2  ALA  18           HB2      ALA  18  -6.036   6.550  -1.747
    4    HB3  ALA  18           HB3      ALA  18  -7.241   6.454  -3.032
    5    H    ALA  18           HN       ALA  18  -4.973   6.130  -5.009

  No H/Q in entry =           5
  In of MODEL    5
    1    HA3  GLY  19           HA2      GLY  19  -7.627   1.610  -1.548
    2    H    GLY  19           HN       GLY  19  -5.594   2.850  -2.108
    3    HA2  GLY  19           HA1      GLY  19  -8.301   2.163  -3.073

  No H/Q in entry =           3
  In of MODEL    5
    1    HA   THR  20           HA       THR  20  -5.592  -1.069  -4.696
    2    HB   THR  20           HB       THR  20  -2.903  -0.138  -3.677
    3    HG1  THR  20           HG1      THR  20  -3.594   1.572  -4.775
    4   HG23  THR  20          HG21      THR  20  -2.423  -2.145  -4.668
    5   HG22  THR  20          HG22      THR  20  -2.285  -1.042  -6.037
    6   HG21  THR  20          HG23      THR  20  -3.743  -2.012  -5.830
    7    H    THR  20           HN       THR  20  -4.991   1.103  -2.854

  No H/Q in entry =           7
  In of MODEL    5
    1    HA   THR  21           HA       THR  21  -4.776  -4.006  -1.570
    2    HB   THR  21           HB       THR  21  -4.666  -6.352  -2.847
    3    HG1  THR  21           HG1      THR  21  -5.707  -6.142  -4.858
    4   HG23  THR  21          HG21      THR  21  -7.022  -6.477  -2.851
    5   HG22  THR  21          HG22      THR  21  -7.184  -4.726  -2.985
    6   HG21  THR  21          HG23      THR  21  -6.571  -5.444  -1.495
    7    H    THR  21           HN       THR  21  -4.517  -3.189  -4.375

  No H/Q in entry =           7
  In of MODEL    5
    1    HA   CYS  22           HA       CYS  22  -0.401  -4.581  -2.070
    2    HB2  CYS  22           HB2      CYS  22   0.825  -3.473  -0.217
    3    H    CYS  22           HN       CYS  22  -2.779  -3.590  -0.711
    4    HB3  CYS  22           HB1      CYS  22  -0.245  -2.374  -1.082

  No H/Q in entry =           4
  In of MODEL    5
    1    HA   TRP  23           HA       TRP  23  -0.973  -7.822   1.033
    2    HB2  TRP  23           HB2      TRP  23  -0.324  -5.929   2.734
    3    HD1  TRP  23           HD1      TRP  23   0.588  -8.904   1.954
    4    HE1  TRP  23           HE1      TRP  23   1.357 -10.498   3.823
    5    HE3  TRP  23           HE3      TRP  23  -1.645  -6.615   5.942
    6    HZ2  TRP  23           HZ2      TRP  23   1.056 -10.750   6.619
    7    HZ3  TRP  23           HZ3      TRP  23  -1.356  -7.596   8.180
    8    HH2  TRP  23           HH2      TRP  23  -0.033  -9.622   8.509
    9    H    TRP  23           HN       TRP  23  -2.425  -5.306   0.683
   10    HB3  TRP  23           HB1      TRP  23  -1.861  -6.346   3.484

  No H/Q in entry =          10
  In of MODEL    5
    1    HA   ARG  24           HA       ARG  24  -4.892  -9.177   2.830
    2    HB2  ARG  24           HB2      ARG  24  -4.840  -8.854   0.197
    3    HG2  ARG  24           HG2      ARG  24  -6.884 -10.614   1.536
    4    HD2  ARG  24           HD2      ARG  24  -7.079  -8.887  -0.929
    5    HE   ARG  24           HE       ARG  24  -9.140  -9.764   0.718
    6   HH11  ARG  24          HH11      ARG  24  -8.237  -9.959  -2.647
    7   HH12  ARG  24          HH12      ARG  24  -9.871 -10.058  -3.210
    8   HH21  ARG  24          HH21      ARG  24 -11.290  -9.893  -0.020
    9   HH22  ARG  24          HH22      ARG  24 -11.605 -10.020  -1.718
   10    H    ARG  24           HN       ARG  24  -2.214  -9.504   1.984
   11    HB3  ARG  24           HB1      ARG  24  -4.825 -10.612   0.216
   12    HG3  ARG  24           HG1      ARG  24  -6.900  -8.849   1.503
   13    HD3  ARG  24           HD1      ARG  24  -7.026 -10.649  -0.915

  No H/Q in entry =          13
  In of MODEL    5
    1    HA   THR  25           HA       THR  25  -3.766 -13.315   3.747
    2    HB   THR  25           HB       THR  25  -4.447 -13.657   6.232
    3    HG1  THR  25           HG1      THR  25  -4.655 -10.838   6.058
    4   HG23  THR  25          HG21      THR  25  -2.346 -13.161   6.702
    5   HG22  THR  25          HG22      THR  25  -2.621 -11.445   6.398
    6   HG21  THR  25          HG23      THR  25  -2.196 -12.520   5.066
    7    H    THR  25           HN       THR  25  -5.272 -10.823   4.151

  No H/Q in entry =           7
  In of MODEL    5
    1    HA   SER  26           HA       SER  26  -8.528 -13.880   3.892
    2    HB2  SER  26           HB2      SER  26  -7.095 -15.688   5.787
    3    HG   SER  26           HG       SER  26  -8.306 -16.014   3.241
    4    H    SER  26           HN       SER  26  -6.696 -12.644   5.610
    5    HB3  SER  26           HB1      SER  26  -8.816 -15.957   5.516

  No H/Q in entry =           5
  In of MODEL    5
    1    HA   VAL  27           HA       VAL  27 -10.373 -13.049   8.079
    2    HB   VAL  27           HB       VAL  27  -8.739 -14.095   9.595
    3    H    VAL  27           HN       VAL  27  -7.606 -13.311   7.242

  No H/Q in entry =           3
  In of MODEL    5
    1    HA   SER  28           HA       SER  28  -9.390  -8.666   7.534
    2    HB2  SER  28           HB2      SER  28  -6.485  -8.638   8.373
    3    HG   SER  28           HG       SER  28  -7.183  -8.749  10.451
    4    H    SER  28           HN       SER  28  -7.632 -11.009   7.316
    5    HB3  SER  28           HB1      SER  28  -7.664  -7.339   8.552

  No H/Q in entry =           5
  In of MODEL    5
    1    HA   SER  29           HA       SER  29  -6.977  -7.581   3.979
    2    HB2  SER  29           HB2      SER  29  -9.819  -6.609   3.605
    3    HG   SER  29           HG       SER  29 -10.216  -8.589   3.018
    4    H    SER  29           HN       SER  29  -8.907  -6.949   6.105
    5    HB3  SER  29           HB1      SER  29  -8.615  -6.687   2.319

  No H/Q in entry =           5
  In of MODEL    5
    1    HA   HIS  30           HA       HIS  30  -6.235  -3.316   4.684
    2    HB2  HIS  30           HB2      HIS  30  -3.616  -4.722   4.195
    3    HD1  HIS  30           HD1      HIS  30  -2.167  -4.741   6.420
    4    HD2  HIS  30           HD2      HIS  30  -6.150  -3.649   6.878
    5    HE1  HIS  30           HE1      HIS  30  -2.638  -4.931   8.883
    6    HE2  HIS  30           HE2      HIS  30  -5.077  -4.349   9.125
    7    H    HIS  30           HN       HIS  30  -5.566  -5.996   3.691
    8    HB3  HIS  30           HB1      HIS  30  -3.701  -2.980   4.433

  No H/Q in entry =           8
  In of MODEL    5
    1    HA   TYR  31           HA       TYR  31  -5.331  -1.943   0.567
    2    HB2  TYR  31           HB2      TYR  31  -7.369  -0.071   1.788
    3    HD1  TYR  31           HD1      TYR  31  -7.429  -2.402  -1.103
    4    HD2  TYR  31           HD2      TYR  31  -8.954  -1.497   2.764
    5    HE1  TYR  31           HE1      TYR  31  -9.106  -4.182  -1.355
    6    HE2  TYR  31           HE2      TYR  31 -10.635  -3.275   2.524
    7    HH   TYR  31           HH       TYR  31 -10.929  -5.369   1.227
    8    H    TYR  31           HN       TYR  31  -5.738  -1.457   3.438
    9    HB3  TYR  31           HB1      TYR  31  -6.999  -0.180   0.071

  No H/Q in entry =           9
  In of MODEL    5
    1    HA   CYS  32           HA       CYS  32  -2.379   1.179   0.645
    2    HB2  CYS  32           HB2      CYS  32  -3.100   0.821  -1.935
    3    H    CYS  32           HN       CYS  32  -4.541  -0.072  -0.621
    4    HB3  CYS  32           HB1      CYS  32  -3.508   2.522  -1.741

  No H/Q in entry =           4
  In of MODEL    5
    1    HA   THR  33           HA       THR  33  -4.347   4.624   2.392
    2    HB   THR  33           HB       THR  33  -2.750   6.114   3.474
    3    HG1  THR  33           HG1      THR  33  -0.792   4.775   1.921
    4   HG23  THR  33          HG21      THR  33  -2.805   4.321   4.854
    5   HG22  THR  33          HG22      THR  33  -1.109   4.251   4.378
    6   HG21  THR  33          HG23      THR  33  -2.287   3.195   3.599
    7    H    THR  33           HN       THR  33  -2.020   3.321   1.279

  No H/Q in entry =           7
  In of MODEL    5
    1    HA3  GLY  34           HA2      GLY  34  -2.541   6.429  -2.131
    2    H    GLY  34           HN       GLY  34  -2.017   5.191  -0.179
    3    HA2  GLY  34           HA1      GLY  34  -3.779   7.285  -1.225

  No H/Q in entry =           3
  In of MODEL    5
    1    HA   ARG  35           HA       ARG  35  -0.747  10.196  -0.027
    2    HB2  ARG  35           HB2      ARG  35  -1.890   9.626   2.345
    3    HG2  ARG  35           HG2      ARG  35  -0.007  11.739   1.506
    4    HD2  ARG  35           HD2      ARG  35  -0.924  11.514   4.365
    5    HE   ARG  35           HE       ARG  35  -0.352  13.715   4.293
    6   HH11  ARG  35          HH11      ARG  35   1.845  11.953   2.232
    7   HH12  ARG  35          HH12      ARG  35   2.826  13.336   1.884
    8   HH21  ARG  35          HH21      ARG  35   0.937  15.536   3.836
    9   HH22  ARG  35          HH22      ARG  35   2.312  15.371   2.795
   10    H    ARG  35           HN       ARG  35  -1.900   7.764   1.026
   11    HB3  ARG  35           HB1      ARG  35  -0.201   9.384   2.770
   12    HG3  ARG  35           HG1      ARG  35  -1.658  11.861   2.117
   13    HD3  ARG  35           HD1      ARG  35   0.708  11.122   3.828

  No H/Q in entry =          13
  In of MODEL    5
    1    HA   SER  36           HA       SER  36   3.023   7.692   0.113
    2    HB2  SER  36           HB2      SER  36   3.932   6.436   2.191
    3    HG   SER  36           HG       SER  36   1.694   5.966   2.903
    4    H    SER  36           HN       SER  36   0.352   7.077   1.125
    5    HB3  SER  36           HB1      SER  36   3.450   8.122   2.378

  No H/Q in entry =           5
  In of MODEL    5
    1    HA   CYS  37           HA       CYS  37   2.862   3.654  -1.379
    2    HB2  CYS  37           HB2      CYS  37   5.786   4.060  -0.806
    3    H    CYS  37           HN       CYS  37   4.369   5.710  -0.103
    4    HB3  CYS  37           HB1      CYS  37   5.200   2.546  -1.486

  No H/Q in entry =           4
  In of MODEL    5
    1    HA   GLU  38           HA       GLU  38   4.427   1.384   2.588
    2    HB2  GLU  38           HB2      GLU  38   5.281   3.538   3.751
    3    HG2  GLU  38           HG2      GLU  38   4.546   2.356   6.088
    4    H    GLU  38           HN       GLU  38   4.287   4.058   1.772
    5    HB3  GLU  38           HB1      GLU  38   3.676   3.606   4.466
    6    HG3  GLU  38           HG1      GLU  38   4.396   1.021   4.947

  No H/Q in entry =           6
  In of MODEL    5
    1    HA   CYS  39           HA       CYS  39   0.176   0.873   3.616
    2    HB2  CYS  39           HB2      CYS  39   1.591  -1.650   2.968
    3    H    CYS  39           HN       CYS  39   3.013   0.103   3.830
    4    HB3  CYS  39           HB1      CYS  39   0.027  -1.815   3.759

  No H/Q in entry =           4
  In of MODEL    5
    1    HA   PRO  40           HA       PRO  40   1.062   0.749   8.149
    2    HB2  PRO  40           HB2      PRO  40  -1.653   1.973   7.998
    3    HG2  PRO  40           HG2      PRO  40  -0.935   3.834   6.798
    4    HD2  PRO  40           HD2      PRO  40  -0.946   2.254   5.119
    5    HB3  PRO  40           HB1      PRO  40  -0.255   2.451   8.967
    6    HG3  PRO  40           HG1      PRO  40   0.769   3.541   7.194
    7    HD3  PRO  40           HD1      PRO  40   0.782   2.658   5.066

  No H/Q in entry =           7
  In of MODEL    5
    1    HA   SER  41           HA       SER  41  -1.767  -2.476   8.970
    2    HB2  SER  41           HB2      SER  41  -0.363  -1.846  11.559
    3    HG   SER  41           HG       SER  41  -0.145  -4.265  10.206
    4    H    SER  41           HN       SER  41  -0.277  -0.148   9.938
    5    HB3  SER  41           HB1      SER  41  -1.508  -3.182  11.441

  No H/Q in entry =           5
  In of MODEL    5
    1    HA   TYR  42           HA       TYR  42  -4.875   0.081  11.176
    2    HB2  TYR  42           HB2      TYR  42  -4.185   1.976   8.994
    3    HD1  TYR  42           HD1      TYR  42  -2.356   1.792  10.995
    4    HD2  TYR  42           HD2      TYR  42  -6.203   3.586  11.284
    5    HE1  TYR  42           HE1      TYR  42  -1.572   3.155  12.886
    6    HE2  TYR  42           HE2      TYR  42  -5.430   4.954  13.175
    7    HH   TYR  42           HH       TYR  42  -3.275   4.482  15.029
    8    H    TYR  42           HN       TYR  42  -3.033   0.080   8.920
    9    HB3  TYR  42           HB1      TYR  42  -5.829   2.044   9.619

  No H/Q in entry =           9
  In of MODEL    5
    1    HA   PRO  43           HA       PRO  43  -8.055  -2.173   9.108
    2    HB2  PRO  43           HB2      PRO  43 -10.268  -1.123  10.273
    3    HG2  PRO  43           HG2      PRO  43  -9.332   0.771  11.238
    4    HD2  PRO  43           HD2      PRO  43  -7.055   1.005  11.497
    5    HB3  PRO  43           HB1      PRO  43  -9.167  -2.216  11.120
    6    HG3  PRO  43           HG1      PRO  43  -9.117  -0.391  12.560
    7    HD3  PRO  43           HD1      PRO  43  -6.863  -0.635  12.148

  No H/Q in entry =           7
  In of MODEL    5
    1    HA3  GLY  44           HA2      GLY  44  -8.929   0.884   5.987
    2    H    GLY  44           HN       GLY  44  -8.228  -1.692   6.979
    3    HA2  GLY  44           HA1      GLY  44  -8.836  -0.598   5.048

  No H/Q in entry =           3
  In of MODEL    5
    1    HA   ASN  45           HA       ASN  45 -13.193  -0.423   5.377
    2    HB2  ASN  45           HB2      ASN  45 -12.272  -1.776   2.895
    3   HD21  ASN  45          HD21      ASN  45 -15.320  -0.180   3.362
    4   HD22  ASN  45          HD22      ASN  45 -14.894   1.300   2.579
    5    H    ASN  45           HN       ASN  45 -10.679  -1.732   4.589
    6    HB3  ASN  45           HB1      ASN  45 -13.967  -1.975   3.333

  No H/Q in entry =           6
  In of MODEL    5
    1    HA3  GLY  46           HA2      GLY  46 -12.417  -5.714   5.543
    2    H    GLY  46           HN       GLY  46 -12.094  -3.697   4.457
    3    HA2  GLY  46           HA1      GLY  46 -13.128  -4.833   6.887

  No H/Q in entry =           3
  In of MODEL    6
    1    H1   ALA   1           HT2      ALA   1  13.448  11.526  -9.334
    2    H2   ALA   1           HT1      ALA   1  12.819  12.767 -10.339
    3    H3   ALA   1           HT3      ALA   1  14.374  12.939  -9.639
    4    HA   ALA   1           HA       ALA   1  12.851  14.274  -8.472
    5    HB2  ALA   1           HB1      ALA   1  10.851  13.474  -7.513
    6    HB1  ALA   1           HB2      ALA   1  11.287  11.792  -7.815
    7    HB3  ALA   1           HB3      ALA   1  10.872  12.851  -9.163

  No H/Q in entry =           7
  In of MODEL    6
    1    HA   MET   2           HA       MET   2  15.255  13.286  -5.035
    2    HB2  MET   2           HB2      MET   2  13.165  15.140  -3.892
    3    H    MET   2           HN       MET   2  13.034  14.578  -6.214
    4    HG2  MET   2           HG2      MET   2  15.387  16.538  -3.702
    5    HE1  MET   2           HE1      MET   2  14.128  18.334  -3.695
    6    HB3  MET   2           HB1      MET   2  14.549  14.566  -2.972
    7    HE3  MET   2           HE2      MET   2  12.489  17.878  -4.159
    8    HE2  MET   2           HE3      MET   2  13.332  19.151  -5.040
    9    HG3  MET   2           HG1      MET   2  15.874  15.511  -5.049

  No H/Q in entry =           9
  In of MODEL    6
    1    HA   ASP   3           HA       ASP   3  12.125  11.211  -2.172
    2    HB2  ASP   3           HB2      ASP   3   9.567  11.934  -3.609
    3    H    ASP   3           HN       ASP   3  11.807  13.250  -4.119
    4    HB3  ASP   3           HB1      ASP   3   9.733  11.206  -2.014

  No H/Q in entry =           4
  In of MODEL    6
    1    HA   CYS   4           HA       CYS   4  10.173   8.139  -5.137
    2    HB2  CYS   4           HB2      CYS   4  12.626   7.874  -4.517
    3    H    CYS   4           HN       CYS   4  10.199   9.349  -2.607
    4    HB3  CYS   4           HB1      CYS   4  12.092   6.773  -3.252

  No H/Q in entry =           4
  In of MODEL    6
    1    HA   THR   5           HA       THR   5   8.804   6.435  -0.277
    2    HB   THR   5           HB       THR   5   6.703   6.062  -2.331
    3    HG1  THR   5           HG1      THR   5   7.659   8.607  -1.552
    4   HG21  THR   5          HG21      THR   5   6.514   5.828   0.240
    5   HG23  THR   5          HG22      THR   5   5.224   6.621  -0.664
    6   HG22  THR   5          HG23      THR   5   6.410   7.589   0.211
    7    H    THR   5           HN       THR   5  10.182   7.609  -1.654

  No H/Q in entry =           7
  In of MODEL    6
    1    HA   THR   6           HA       THR   6   9.327   2.370  -1.887
    2    HB   THR   6           HB       THR   6  11.082   1.181  -0.708
    3    HG1  THR   6           HG1      THR   6  10.996   3.326   1.144
    4   HG22  THR   6          HG21      THR   6  12.233   3.902  -0.640
    5   HG21  THR   6          HG22      THR   6  11.583   3.329  -2.176
    6   HG23  THR   6          HG23      THR   6  12.856   2.419  -1.363
    7    H    THR   6           HN       THR   6   9.589   4.473   0.150

  No H/Q in entry =           7
  In of MODEL    6
    1    HA3  GLY   7           HA2      GLY   7   7.772  -0.835   0.955
    2    H    GLY   7           HN       GLY   7   8.532   0.307  -1.308
    3    HA2  GLY   7           HA1      GLY   7   6.554   0.426   0.837

  No H/Q in entry =           3
  In of MODEL    6
    1    HA   PRO   8           HA       PRO   8   5.482  -3.646  -1.526
    2    HB2  PRO   8           HB2      PRO   8   3.235  -3.537   0.418
    3    HG2  PRO   8           HG2      PRO   8   4.553  -3.982   2.282
    4    HD2  PRO   8           HD2      PRO   8   5.080  -1.763   1.902
    5    HB3  PRO   8           HB1      PRO   8   4.146  -4.930  -0.173
    6    HG3  PRO   8           HG1      PRO   8   5.904  -4.571   1.296
    7    HD3  PRO   8           HD1      PRO   8   6.709  -2.453   1.748

  No H/Q in entry =           7
  In of MODEL    6
    1    HA   CYS   9           HA       CYS   9   1.851  -0.974  -2.534
    2    HB2  CYS   9           HB2      CYS   9   2.262   0.900  -0.220
    3    H    CYS   9           HN       CYS   9   3.927  -0.710  -0.492
    4    HB3  CYS   9           HB1      CYS   9   1.111   1.277  -1.497

  No H/Q in entry =           4
  In of MODEL    6
    1    HA   CYS  10           HA       CYS  10   4.302   1.317  -5.316
    2    HB2  CYS  10           HB2      CYS  10   6.027   2.963  -4.535
    3    H    CYS  10           HN       CYS  10   4.613  -0.620  -3.319
    4    HB3  CYS  10           HB1      CYS  10   4.524   2.999  -3.619

  No H/Q in entry =           4
  In of MODEL    6
    1    HA   ARG  11           HA       ARG  11   8.342  -0.266  -6.246
    2    HB2  ARG  11           HB2      ARG  11   6.242  -1.312  -8.136
    3    HG2  ARG  11           HG2      ARG  11   7.871  -2.676  -6.002
    4    HD2  ARG  11           HD2      ARG  11   5.856  -4.355  -6.538
    5    HE   ARG  11           HE       ARG  11   8.591  -4.325  -7.322
    6   HH11  ARG  11          HH11      ARG  11   5.579  -6.022  -7.795
    7   HH12  ARG  11          HH12      ARG  11   6.344  -7.520  -8.208
    8   HH21  ARG  11          HH21      ARG  11   9.599  -6.293  -7.866
    9   HH22  ARG  11          HH22      ARG  11   8.626  -7.674  -8.248
   10    H    ARG  11           HN       ARG  11   5.853   1.116  -6.874
   11    HB3  ARG  11           HB1      ARG  11   7.933  -1.776  -8.274
   12    HG3  ARG  11           HG1      ARG  11   6.172  -2.217  -5.871
   13    HD3  ARG  11           HD1      ARG  11   6.064  -3.639  -8.136

  No H/Q in entry =          13
  In of MODEL    6
    1    HA   GLN  12           HA       GLN  12  11.088   0.975  -9.561
    2    HB2  GLN  12           HB2      GLN  12  10.107   1.322 -11.722
    3    HG2  GLN  12           HG2      GLN  12   7.887   2.263 -10.618
    4   HE21  GLN  12          HE21      GLN  12   5.558   1.495 -11.499
    5   HE22  GLN  12          HE22      GLN  12   5.055  -0.011 -10.820
    6    H    GLN  12           HN       GLN  12   9.821  -0.311  -8.159
    7    HB3  GLN  12           HB1      GLN  12   9.490  -0.191 -11.076
    8    HG3  GLN  12           HG1      GLN  12   7.929   1.591 -12.246

  No H/Q in entry =           8
  In of MODEL    6
    1    HA   CYS  13           HA       CYS  13   9.769   4.587  -6.612
    2    HB2  CYS  13           HB2      CYS  13  11.751   4.674  -8.409
    3    H    CYS  13           HN       CYS  13   9.890   2.444  -7.360
    4    HB3  CYS  13           HB1      CYS  13  10.617   5.754  -9.212

  No H/Q in entry =           4
  In of MODEL    6
    1    HA   LYS  14           HA       LYS  14   6.061   6.387  -7.820
    2    HB2  LYS  14           HB2      LYS  14   4.699   5.310  -9.501
    3    HG2  LYS  14           HG2      LYS  14   6.097   2.908 -10.021
    4    HD2  LYS  14           HD2      LYS  14   3.322   3.750  -9.379
    5    HE2  LYS  14           HE2      LYS  14   4.388   0.978  -9.096
    6    HZ1  LYS  14           HZ1      LYS  14   2.752   0.983 -10.957
    7    HZ3  LYS  14           HZ2      LYS  14   1.586   1.554  -9.873
    8    HZ2  LYS  14           HZ3      LYS  14   2.296   0.039  -9.629
    9    H    LYS  14           HN       LYS  14   7.437   4.231  -6.674
   10    HB3  LYS  14           HB1      LYS  14   6.395   5.095  -9.910
   11    HG3  LYS  14           HG1      LYS  14   5.599   2.881  -8.329
   12    HD3  LYS  14           HD1      LYS  14   3.950   2.914 -10.801
   13    HE3  LYS  14           HE1      LYS  14   3.165   1.813  -8.139

  No H/Q in entry =          13
  In of MODEL    6
    1    HA   LEU  15           HA       LEU  15   3.457   4.783  -4.724
    2    HB2  LEU  15           HB2      LEU  15   2.896   7.616  -5.305
    3    HG   LEU  15           HG       LEU  15   3.641   5.995  -2.947
    4   HD13  LEU  15          HD11      LEU  15   5.394   7.241  -3.776
    5   HD12  LEU  15          HD12      LEU  15   4.779   8.289  -2.497
    6   HD11  LEU  15          HD13      LEU  15   4.365   8.616  -4.180
    7   HD23  LEU  15          HD21      LEU  15   2.362   8.630  -2.397
    8   HD22  LEU  15          HD22      LEU  15   2.622   7.255  -1.323
    9   HD21  LEU  15          HD23      LEU  15   1.346   7.195  -2.539
   10    H    LEU  15           HN       LEU  15   4.160   6.691  -6.785
   11    HB3  LEU  15           HB1      LEU  15   1.583   6.746  -4.533

  No H/Q in entry =          11
  In of MODEL    6
    1    HA   LYS  16           HA       LYS  16   0.353   3.034  -7.247
    2    HB2  LYS  16           HB2      LYS  16   0.567   1.543  -4.662
    3    HG2  LYS  16           HG2      LYS  16   0.673   0.558  -7.503
    4    HD2  LYS  16           HD2      LYS  16   1.669  -0.687  -4.945
    5    HE2  LYS  16           HE2      LYS  16   1.398  -2.689  -6.734
    6    HZ1  LYS  16           HZ1      LYS  16   3.418  -1.726  -5.368
    7    HZ3  LYS  16           HZ2      LYS  16   3.908  -1.204  -6.900
    8    HZ2  LYS  16           HZ3      LYS  16   3.642  -2.850  -6.613
    9    H    LYS  16           HN       LYS  16   1.888   3.322  -4.854
   10    HB3  LYS  16           HB1      LYS  16  -0.796   1.220  -5.726
   11    HG3  LYS  16           HG1      LYS  16   2.089   1.043  -6.567
   12    HD3  LYS  16           HD1      LYS  16   0.146  -1.108  -5.730
   13    HE3  LYS  16           HE1      LYS  16   1.848  -1.364  -7.807

  No H/Q in entry =          13
  In of MODEL    6
    1    HA   PRO  17           HA       PRO  17  -3.358   5.174  -6.230
    2    HB2  PRO  17           HB2      PRO  17  -5.301   3.504  -7.139
    3    HG2  PRO  17           HG2      PRO  17  -4.044   1.570  -7.406
    4    HD2  PRO  17           HD2      PRO  17  -1.738   1.609  -7.444
    5    HB3  PRO  17           HB1      PRO  17  -4.260   4.445  -8.213
    6    HG3  PRO  17           HG1      PRO  17  -3.833   2.302  -9.008
    7    HD3  PRO  17           HD1      PRO  17  -1.684   3.003  -8.543

  No H/Q in entry =           7
  In of MODEL    6
    1    HA   ALA  18           HA       ALA  18  -4.560   3.799  -2.290
    2    HB3  ALA  18           HB1      ALA  18  -6.965   5.513  -2.763
    3    HB1  ALA  18           HB2      ALA  18  -5.376   6.249  -2.553
    4    HB2  ALA  18           HB3      ALA  18  -6.058   5.242  -1.276
    5    H    ALA  18           HN       ALA  18  -4.736   5.426  -4.546

  No H/Q in entry =           5
  In of MODEL    6
    1    HA3  GLY  19           HA2      GLY  19  -7.464   0.597  -2.066
    2    H    GLY  19           HN       GLY  19  -5.066   1.676  -2.476
    3    HA2  GLY  19           HA1      GLY  19  -7.535   0.874  -3.800

  No H/Q in entry =           3
  In of MODEL    6
    1    HA   THR  20           HA       THR  20  -4.697  -2.337  -4.732
    2    HB   THR  20           HB       THR  20  -2.055  -1.219  -3.973
    3    HG1  THR  20           HG1      THR  20  -3.556  -0.136  -6.119
    4   HG23  THR  20          HG21      THR  20  -1.923  -3.165  -5.259
    5   HG22  THR  20          HG22      THR  20  -1.594  -1.848  -6.386
    6   HG21  THR  20          HG23      THR  20  -3.180  -2.620  -6.370
    7    H    THR  20           HN       THR  20  -4.593   0.359  -4.014

  No H/Q in entry =           7
  In of MODEL    6
    1    HA   THR  21           HA       THR  21  -3.809  -4.212  -0.913
    2    HB   THR  21           HB       THR  21  -3.291  -6.774  -1.521
    3    HG1  THR  21           HG1      THR  21  -3.483  -7.163  -3.557
    4   HG22  THR  21          HG21      THR  21  -5.900  -6.843  -2.114
    5   HG21  THR  21          HG22      THR  21  -5.798  -5.239  -1.388
    6   HG23  THR  21          HG23      THR  21  -5.275  -6.656  -0.476
    7    H    THR  21           HN       THR  21  -3.659  -4.184  -3.823

  No H/Q in entry =           7
  In of MODEL    6
    1    HA   CYS  22           HA       CYS  22   0.538  -4.655  -0.755
    2    HB2  CYS  22           HB2      CYS  22   1.271  -4.189   1.603
    3    H    CYS  22           HN       CYS  22  -2.138  -4.860   0.437
    4    HB3  CYS  22           HB1      CYS  22   0.177  -2.987   0.926

  No H/Q in entry =           4
  In of MODEL    6
    1    HA   TRP  23           HA       TRP  23   0.665  -8.663   1.435
    2    HB2  TRP  23           HB2      TRP  23  -0.469  -7.701   3.586
    3    HD1  TRP  23           HD1      TRP  23   0.527 -11.003   2.035
    4    HE1  TRP  23           HE1      TRP  23   1.587 -12.502   3.839
    5    HE3  TRP  23           HE3      TRP  23  -0.598  -8.215   6.170
    6    HZ2  TRP  23           HZ2      TRP  23   1.904 -12.502   6.644
    7    HZ3  TRP  23           HZ3      TRP  23   0.120  -9.035   8.376
    8    HH2  TRP  23           HH2      TRP  23   1.344 -11.135   8.607
    9    H    TRP  23           HN       TRP  23  -1.452  -6.625   1.384
   10    HB3  TRP  23           HB1      TRP  23  -1.786  -8.786   3.155

  No H/Q in entry =          10
  In of MODEL    6
    1    HA   ARG  24           HA       ARG  24  -4.379  -9.494  -0.131
    2    HB2  ARG  24           HB2      ARG  24  -2.366  -9.069  -1.870
    3    HG2  ARG  24           HG2      ARG  24  -4.954  -9.430  -2.212
    4    HD2  ARG  24           HD2      ARG  24  -4.249 -12.036  -2.140
    5    HE   ARG  24           HE       ARG  24  -3.232 -11.412  -4.567
    6   HH11  ARG  24          HH11      ARG  24  -5.968 -13.322  -3.544
    7   HH12  ARG  24          HH12      ARG  24  -5.886 -14.394  -4.902
    8   HH21  ARG  24          HH21      ARG  24  -3.123 -12.820  -6.354
    9   HH22  ARG  24          HH22      ARG  24  -4.271 -14.109  -6.497
   10    H    ARG  24           HN       ARG  24  -2.826  -8.273   0.999
   11    HB3  ARG  24           HB1      ARG  24  -2.357 -10.827  -1.839
   12    HG3  ARG  24           HG1      ARG  24  -3.821  -9.494  -3.563
   13    HD3  ARG  24           HD1      ARG  24  -5.648 -11.413  -3.013

  No H/Q in entry =          13
  In of MODEL    6
    1    HA   THR  25           HA       THR  25  -4.304 -13.724   0.910
    2    HB   THR  25           HB       THR  25  -4.176 -14.038   3.416
    3    HG1  THR  25           HG1      THR  25  -3.914 -12.242   4.676
    4   HG22  THR  25          HG21      THR  25  -2.065 -12.110   2.542
    5   HG21  THR  25          HG22      THR  25  -2.159 -13.738   1.872
    6   HG23  THR  25          HG23      THR  25  -1.926 -13.510   3.605
    7    H    THR  25           HN       THR  25  -5.236 -11.011   1.153

  No H/Q in entry =           7
  In of MODEL    6
    1    HA   SER  26           HA       SER  26  -8.499 -14.354   1.790
    2    HB2  SER  26           HB2      SER  26  -7.163 -17.021   2.107
    3    HG   SER  26           HG       SER  26  -7.686 -17.116   0.085
    4    H    SER  26           HN       SER  26  -5.758 -15.251   2.097
    5    HB3  SER  26           HB1      SER  26  -8.894 -16.871   2.412

  No H/Q in entry =           5
  In of MODEL    6
    1    HA   VAL  27           HA       VAL  27  -9.342 -13.642   5.953
    2    HB   VAL  27           HB       VAL  27  -7.641 -15.345   6.438
    3    H    VAL  27           HN       VAL  27  -7.683 -12.939   3.814

  No H/Q in entry =           3
  In of MODEL    6
    1    HA   SER  28           HA       SER  28  -7.186  -9.671   6.694
    2    HB2  SER  28           HB2      SER  28  -4.591 -10.372   5.319
    3    HG   SER  28           HG       SER  28  -3.850 -10.415   7.466
    4    H    SER  28           HN       SER  28  -6.438 -11.916   4.959
    5    HB3  SER  28           HB1      SER  28  -4.868  -8.823   6.116

  No H/Q in entry =           5
  In of MODEL    6
    1    HA   SER  29           HA       SER  29  -5.675  -8.522   1.705
    2    HB2  SER  29           HB2      SER  29  -7.842  -9.833   1.691
    3    HG   SER  29           HG       SER  29  -7.664  -7.288   0.472
    4    H    SER  29           HN       SER  29  -5.428  -9.714   3.626
    5    HB3  SER  29           HB1      SER  29  -8.621  -8.404   2.370

  No H/Q in entry =           5
  In of MODEL    6
    1    HA   HIS  30           HA       HIS  30  -6.051  -4.592   3.880
    2    HB2  HIS  30           HB2      HIS  30  -3.145  -5.233   3.620
    3    HD1  HIS  30           HD1      HIS  30  -2.399  -6.105   5.801
    4    HD2  HIS  30           HD2      HIS  30  -5.725  -3.644   6.182
    5    HE1  HIS  30           HE1      HIS  30  -2.993  -6.153   8.244
    6    HE2  HIS  30           HE2      HIS  30  -5.063  -4.729   8.435
    7    H    HIS  30           HN       HIS  30  -4.510  -6.801   2.824
    8    HB3  HIS  30           HB1      HIS  30  -3.620  -3.552   3.836

  No H/Q in entry =           8
  In of MODEL    6
    1    HA   TYR  31           HA       TYR  31  -5.086  -2.293   0.152
    2    HB2  TYR  31           HB2      TYR  31  -6.947  -0.454   1.652
    3    HD1  TYR  31           HD1      TYR  31  -9.002  -1.157   2.429
    4    HD2  TYR  31           HD2      TYR  31  -6.945  -3.576  -0.402
    5    HE1  TYR  31           HE1      TYR  31 -10.762  -2.864   2.618
    6    HE2  TYR  31           HE2      TYR  31  -8.699  -5.290  -0.222
    7    HH   TYR  31           HH       TYR  31 -10.498  -5.872   1.841
    8    H    TYR  31           HN       TYR  31  -5.272  -2.323   3.082
    9    HB3  TYR  31           HB1      TYR  31  -6.858  -0.729  -0.085

  No H/Q in entry =           9
  In of MODEL    6
    1    HA   CYS  32           HA       CYS  32  -2.260   0.872   1.028
    2    HB2  CYS  32           HB2      CYS  32  -2.678   1.264  -1.942
    3    H    CYS  32           HN       CYS  32  -4.133  -0.433  -0.741
    4    HB3  CYS  32           HB1      CYS  32  -1.292   1.807  -1.002

  No H/Q in entry =           4
  In of MODEL    6
    1    HA   THR  33           HA       THR  33  -4.711   4.379   1.715
    2    HB   THR  33           HB       THR  33  -3.498   6.126   2.853
    3    HG1  THR  33           HG1      THR  33  -1.397   6.413   2.656
    4   HG23  THR  33          HG21      THR  33  -2.989   4.998   4.715
    5   HG22  THR  33          HG22      THR  33  -1.876   3.914   3.881
    6   HG21  THR  33          HG23      THR  33  -3.612   3.612   3.821
    7    H    THR  33           HN       THR  33  -2.276   2.958   1.688

  No H/Q in entry =           7
  In of MODEL    6
    1    HA3  GLY  34           HA2      GLY  34  -2.065   5.285  -2.629
    2    H    GLY  34           HN       GLY  34  -1.938   4.475  -0.404
    3    HA2  GLY  34           HA1      GLY  34  -3.408   6.312  -2.152

  No H/Q in entry =           3
  In of MODEL    6
    1    HA   ARG  35           HA       ARG  35  -0.389   9.309  -1.083
    2    HB2  ARG  35           HB2      ARG  35  -1.262   9.027   1.797
    3    HG2  ARG  35           HG2      ARG  35  -2.486  11.244   0.915
    4    HD2  ARG  35           HD2      ARG  35  -3.345   8.389   1.019
    5    HE   ARG  35           HE       ARG  35  -4.712  10.083  -0.630
    6   HH11  ARG  35          HH11      ARG  35  -5.422   8.473   2.384
    7   HH12  ARG  35          HH12      ARG  35  -7.120   8.355   2.065
    8   HH21  ARG  35          HH21      ARG  35  -6.944   9.929  -1.051
    9   HH22  ARG  35          HH22      ARG  35  -7.985   9.181   0.115
   10    H    ARG  35           HN       ARG  35  -1.900   7.212   0.265
   11    HB3  ARG  35           HB1      ARG  35  -0.412  10.417   1.137
   12    HG3  ARG  35           HG1      ARG  35  -2.490  10.286  -0.567
   13    HD3  ARG  35           HD1      ARG  35  -3.808   9.738   2.055

  No H/Q in entry =          13
  In of MODEL    6
    1    HA   SER  36           HA       SER  36   2.978   6.984   0.836
    2    HB2  SER  36           HB2      SER  36   1.957   7.767   3.107
    3    HG   SER  36           HG       SER  36   4.021   5.847   3.287
    4    H    SER  36           HN       SER  36   0.081   6.603   1.072
    5    HB3  SER  36           HB1      SER  36   1.826   6.040   3.444

  No H/Q in entry =           5
  In of MODEL    6
    1    HA   CYS  37           HA       CYS  37   2.959   2.757  -0.018
    2    HB2  CYS  37           HB2      CYS  37   5.712   3.026   1.208
    3    H    CYS  37           HN       CYS  37   4.217   5.038   1.144
    4    HB3  CYS  37           HB1      CYS  37   5.165   1.697   0.192

  No H/Q in entry =           4
  In of MODEL    6
    1    HA   GLU  38           HA       GLU  38   3.706   1.369   4.588
    2    HB2  GLU  38           HB2      GLU  38   3.824   3.930   5.356
    3    HG2  GLU  38           HG2      GLU  38   3.259   3.067   7.750
    4    H    GLU  38           HN       GLU  38   3.609   3.785   3.222
    5    HB3  GLU  38           HB1      GLU  38   2.162   3.590   5.821
    6    HG3  GLU  38           HG1      GLU  38   3.226   1.491   6.959

  No H/Q in entry =           6
  In of MODEL    6
    1    HA   CYS  39           HA       CYS  39  -0.511   0.244   4.192
    2    HB2  CYS  39           HB2      CYS  39   1.036  -1.649   3.224
    3    H    CYS  39           HN       CYS  39   2.289  -0.203   4.956
    4    HB3  CYS  39           HB1      CYS  39   0.625  -2.474   4.724

  No H/Q in entry =           4
  In of MODEL    6
    1    HA   PRO  40           HA       PRO  40  -0.905   0.160   8.754
    2    HB2  PRO  40           HB2      PRO  40  -3.308   1.440   8.791
    3    HG2  PRO  40           HG2      PRO  40  -3.673   1.621   6.506
    4    HD2  PRO  40           HD2      PRO  40  -1.981   1.305   4.970
    5    HB3  PRO  40           HB1      PRO  40  -1.760   2.288   8.710
    6    HG3  PRO  40           HG1      PRO  40  -2.781   3.126   6.797
    7    HD3  PRO  40           HD1      PRO  40  -0.828   2.291   5.892

  No H/Q in entry =           7
  In of MODEL    6
    1    HA   SER  41           HA       SER  41  -3.385  -3.368   9.025
    2    HB2  SER  41           HB2      SER  41  -4.109  -2.342  11.758
    3    HG   SER  41           HG       SER  41  -2.044  -2.167  12.121
    4    H    SER  41           HN       SER  41  -2.220  -1.064  10.114
    5    HB3  SER  41           HB1      SER  41  -3.869  -4.007  11.229

  No H/Q in entry =           5
  In of MODEL    6
    1    HA   TYR  42           HA       TYR  42  -7.404  -1.243   9.074
    2    HB2  TYR  42           HB2      TYR  42  -6.759   1.201  10.735
    3    HD1  TYR  42           HD1      TYR  42  -5.164  -0.178  12.132
    4    HD2  TYR  42           HD2      TYR  42  -9.295  -1.125  11.762
    5    HE1  TYR  42           HE1      TYR  42  -5.023  -1.561  14.161
    6    HE2  TYR  42           HE2      TYR  42  -9.166  -2.510  13.790
    7    HH   TYR  42           HH       TYR  42  -6.726  -3.780  14.998
    8    H    TYR  42           HN       TYR  42  -4.734  -0.256   9.837
    9    HB3  TYR  42           HB1      TYR  42  -8.360   0.552  10.397

  No H/Q in entry =           9
  In of MODEL    6
    1    HA   PRO  43           HA       PRO  43  -6.023   1.295   5.464
    2    HB2  PRO  43           HB2      PRO  43  -8.442  -0.107   4.434
    3    HG2  PRO  43           HG2      PRO  43  -7.537  -2.236   4.687
    4    HD2  PRO  43           HD2      PRO  43  -8.064  -1.754   6.881
    5    HB3  PRO  43           HB1      PRO  43  -6.867   0.129   3.669
    6    HG3  PRO  43           HG1      PRO  43  -5.885  -1.611   4.847
    7    HD3  PRO  43           HD1      PRO  43  -6.313  -1.963   7.084

  No H/Q in entry =           7
  In of MODEL    6
    1    HA3  GLY  44           HA2      GLY  44  -9.754   3.693   6.351
    2    H    GLY  44           HN       GLY  44  -9.130   0.897   7.040
    3    HA2  GLY  44           HA1      GLY  44 -10.973   2.445   6.136

  No H/Q in entry =           3
  In of MODEL    6
    1    HA   ASN  45           HA       ASN  45 -13.447   3.392   9.640
    2    HB2  ASN  45           HB2      ASN  45 -12.487   1.145  10.062
    3   HD21  ASN  45          HD21      ASN  45 -13.559   0.297  11.689
    4   HD22  ASN  45          HD22      ASN  45 -13.902   1.072  13.194
    5    H    ASN  45           HN       ASN  45 -12.456   3.097   7.615
    6    HB3  ASN  45           HB1      ASN  45 -11.032   1.906  10.699

  No H/Q in entry =           6
  In of MODEL    6
    1    HA3  GLY  46           HA2      GLY  46 -10.837   6.717  11.050
    2    H    GLY  46           HN       GLY  46 -13.052   5.683   9.415
    3    HA2  GLY  46           HA1      GLY  46 -11.746   7.639   9.862

  No H/Q in entry =           3
  In of MODEL    7
    1    H1   ALA   1           HT3      ALA   1  11.993   6.765  -1.096
    2    H2   ALA   1           HT2      ALA   1  11.004   5.602  -0.310
    3    H3   ALA   1           HT1      ALA   1  10.720   7.278  -0.068
    4    HA   ALA   1           HA       ALA   1  11.787   6.417   1.816
    5    HB1  ALA   1           HB1      ALA   1  14.065   5.561   0.050
    6    HB3  ALA   1           HB2      ALA   1  12.773   4.468   0.547
    7    HB2  ALA   1           HB3      ALA   1  13.817   5.209   1.760

  No H/Q in entry =           7
  In of MODEL    7
    1    HA   MET   2           HA       MET   2  14.707   9.794   0.877
    2    HB2  MET   2           HB2      MET   2  16.587  10.050  -0.684
    3    H    MET   2           HN       MET   2  13.809   7.609  -0.873
    4    HG2  MET   2           HG2      MET   2  15.387   7.688  -2.110
    5    HE1  MET   2           HE1      MET   2  16.821   6.110  -1.674
    6    HB3  MET   2           HB1      MET   2  16.508   8.420  -0.030
    7    HE3  MET   2           HE2      MET   2  18.582   6.097  -1.770
    8    HE2  MET   2           HE3      MET   2  17.617   5.794  -3.215
    9    HG3  MET   2           HG1      MET   2  15.614   9.311  -2.761

  No H/Q in entry =           9
  In of MODEL    7
    1    HA   ASP   3           HA       ASP   3  12.356  11.787  -2.476
    2    HB2  ASP   3           HB2      ASP   3  14.715  11.452  -3.706
    3    H    ASP   3           HN       ASP   3  13.503   9.104  -2.383
    4    HB3  ASP   3           HB1      ASP   3  13.655  10.873  -4.988

  No H/Q in entry =           4
  In of MODEL    7
    1    HA   CYS   4           HA       CYS   4  10.132   9.188  -5.632
    2    HB2  CYS   4           HB2      CYS   4  12.484   7.441  -6.140
    3    H    CYS   4           HN       CYS   4  12.811   8.971  -4.624
    4    HB3  CYS   4           HB1      CYS   4  10.900   6.793  -6.553

  No H/Q in entry =           4
  In of MODEL    7
    1    HA   THR   5           HA       THR   5   8.177   6.885  -2.524
    2    HB   THR   5           HB       THR   5   5.913   6.320  -3.100
    3    HG1  THR   5           HG1      THR   5   5.342   5.815  -5.052
    4   HG22  THR   5          HG21      THR   5   5.603   8.552  -4.753
    5   HG21  THR   5          HG22      THR   5   6.960   8.916  -3.687
    6   HG23  THR   5          HG23      THR   5   5.398   8.463  -3.004
    7    H    THR   5           HN       THR   5   8.351   8.075  -5.052

  No H/Q in entry =           7
  In of MODEL    7
    1    HA   THR   6           HA       THR   6   8.926   2.735  -3.740
    2    HB   THR   6           HB       THR   6  11.145   1.998  -2.770
    3    HG1  THR   6           HG1      THR   6  11.991   3.195  -1.294
    4   HG22  THR   6          HG21      THR   6  11.534   4.603  -4.171
    5   HG21  THR   6          HG22      THR   6  10.814   3.230  -5.012
    6   HG23  THR   6          HG23      THR   6  12.436   3.096  -4.331
    7    H    THR   6           HN       THR   6   9.112   5.047  -1.927

  No H/Q in entry =           7
  In of MODEL    7
    1    HA3  GLY   7           HA2      GLY   7   8.473   0.049  -0.227
    2    H    GLY   7           HN       GLY   7   8.143   0.913  -2.858
    3    HA2  GLY   7           HA1      GLY   7   6.972   0.962  -0.285

  No H/Q in entry =           3
  In of MODEL    7
    1    HA   PRO   8           HA       PRO   8   5.908  -3.406  -1.351
    2    HB2  PRO   8           HB2      PRO   8   3.541  -3.418  -0.025
    3    HG2  PRO   8           HG2      PRO   8   3.508  -1.219   0.720
    4    HD2  PRO   8           HD2      PRO   8   5.403   0.093   0.724
    5    HB3  PRO   8           HB1      PRO   8   5.084  -3.765   0.764
    6    HG3  PRO   8           HG1      PRO   8   4.341  -1.997   2.080
    7    HD3  PRO   8           HD1      PRO   8   6.403  -1.185   1.444

  No H/Q in entry =           7
  In of MODEL    7
    1    HA   CYS   9           HA       CYS   9   2.200  -1.546  -3.464
    2    HB2  CYS   9           HB2      CYS   9   2.214   0.838  -1.708
    3    H    CYS   9           HN       CYS   9   3.941  -0.471  -1.404
    4    HB3  CYS   9           HB1      CYS   9   1.479   1.055  -3.293

  No H/Q in entry =           4
  In of MODEL    7
    1    HA   CYS  10           HA       CYS  10   4.344   2.056  -5.787
    2    HB2  CYS  10           HB2      CYS  10   6.786   2.218  -4.019
    3    H    CYS  10           HN       CYS  10   4.463   1.184  -3.133
    4    HB3  CYS  10           HB1      CYS  10   6.334   3.305  -5.328

  No H/Q in entry =           4
  In of MODEL    7
    1    HA   ARG  11           HA       ARG  11   7.290  -0.760  -7.473
    2    HB2  ARG  11           HB2      ARG  11   4.900  -0.855  -8.633
    3    HG2  ARG  11           HG2      ARG  11   6.145  -2.295 -10.520
    4    HD2  ARG  11           HD2      ARG  11   6.155  -3.212  -7.660
    5    HE   ARG  11           HE       ARG  11   6.554  -5.137  -8.823
    6   HH11  ARG  11          HH11      ARG  11   4.153  -3.276 -10.540
    7   HH12  ARG  11          HH12      ARG  11   3.825  -4.528 -11.691
    8   HH21  ARG  11          HH21      ARG  11   6.125  -6.784 -10.336
    9   HH22  ARG  11          HH22      ARG  11   4.944  -6.519 -11.575
   10    H    ARG  11           HN       ARG  11   5.566   1.625  -7.602
   11    HB3  ARG  11           HB1      ARG  11   5.789  -0.148  -9.975
   12    HG3  ARG  11           HG1      ARG  11   7.444  -2.170  -9.332
   13    HD3  ARG  11           HD1      ARG  11   4.660  -3.007  -8.573

  No H/Q in entry =          13
  In of MODEL    7
    1    HA   GLN  12           HA       GLN  12  10.908   1.758  -8.120
    2    HB2  GLN  12           HB2      GLN  12  10.845   0.016  -9.862
    3    HG2  GLN  12           HG2      GLN  12  11.616   1.664 -11.839
    4   HE21  GLN  12          HE21      GLN  12  13.896   1.781 -12.070
    5   HE22  GLN  12          HE22      GLN  12  14.932   0.837 -11.060
    6    H    GLN  12           HN       GLN  12   9.113   0.625  -7.305
    7    HB3  GLN  12           HB1      GLN  12   9.742   1.007 -10.808
    8    HG3  GLN  12           HG1      GLN  12  11.770   2.746 -10.456

  No H/Q in entry =           8
  In of MODEL    7
    1    HA   CYS  13           HA       CYS  13   8.916   5.765  -7.269
    2    HB2  CYS  13           HB2      CYS  13  11.074   5.913  -8.577
    3    H    CYS  13           HN       CYS  13   9.579   3.592  -7.188
    4    HB3  CYS  13           HB1      CYS  13  10.107   5.821 -10.045

  No H/Q in entry =           4
  In of MODEL    7
    1    HA   LYS  14           HA       LYS  14   5.122   6.000  -9.283
    2    HB2  LYS  14           HB2      LYS  14   5.939   3.228  -9.958
    3    HG2  LYS  14           HG2      LYS  14   5.303   5.733 -11.404
    4    HD2  LYS  14           HD2      LYS  14   4.766   2.973 -12.436
    5    HE2  LYS  14           HE2      LYS  14   4.979   3.705 -14.687
    6    HZ2  LYS  14           HZ1      LYS  14   7.257   3.886 -14.884
    7    HZ1  LYS  14           HZ2      LYS  14   7.097   3.182 -13.355
    8    HZ3  LYS  14           HZ3      LYS  14   7.423   4.836 -13.494
    9    H    LYS  14           HN       LYS  14   6.754   4.607  -7.435
   10    HB3  LYS  14           HB1      LYS  14   4.241   3.624 -10.179
   11    HG3  LYS  14           HG1      LYS  14   6.623   4.587 -11.643
   12    HD3  LYS  14           HD1      LYS  14   3.788   4.432 -12.602
   13    HE3  LYS  14           HE1      LYS  14   5.296   5.364 -14.184

  No H/Q in entry =          13
  In of MODEL    7
    1    HA   LEU  15           HA       LEU  15   2.851   4.804  -5.676
    2    HB2  LEU  15           HB2      LEU  15   2.058   7.499  -6.655
    3    HG   LEU  15           HG       LEU  15   3.812   7.083  -4.836
    4   HD13  LEU  15          HD11      LEU  15   3.016   9.281  -5.175
    5   HD12  LEU  15          HD12      LEU  15   2.895   8.976  -3.443
    6   HD11  LEU  15          HD13      LEU  15   1.452   8.906  -4.453
    7   HD22  LEU  15          HD21      LEU  15   2.907   5.471  -3.440
    8   HD21  LEU  15          HD22      LEU  15   1.307   6.213  -3.451
    9   HD23  LEU  15          HD23      LEU  15   2.619   6.961  -2.540
   10    H    LEU  15           HN       LEU  15   3.644   6.533  -7.800
   11    HB3  LEU  15           HB1      LEU  15   0.936   6.652  -5.608

  No H/Q in entry =          11
  In of MODEL    7
    1    HA   LYS  16           HA       LYS  16  -0.206   2.738  -8.008
    2    HB2  LYS  16           HB2      LYS  16  -0.242   1.441  -5.277
    3    HG2  LYS  16           HG2      LYS  16   1.892   1.219  -6.573
    4    HD2  LYS  16           HD2      LYS  16   0.415  -0.660  -8.365
    5    HE2  LYS  16           HE2      LYS  16   2.730   0.918  -9.268
    6    HZ3  LYS  16           HZ1      LYS  16   3.318  -1.634  -9.677
    7    HZ2  LYS  16           HZ2      LYS  16   2.360  -0.729 -10.738
    8    HZ1  LYS  16           HZ3      LYS  16   1.631  -1.752  -9.605
    9    H    LYS  16           HN       LYS  16   1.297   3.315  -5.622
   10    HB3  LYS  16           HB1      LYS  16  -1.087   0.828  -6.692
   11    HG3  LYS  16           HG1      LYS  16   1.081  -0.299  -6.179
   12    HD3  LYS  16           HD1      LYS  16   0.528   1.049  -8.790
   13    HE3  LYS  16           HE1      LYS  16   3.051  -0.223  -7.962

  No H/Q in entry =          13
  In of MODEL    7
    1    HA   PRO  17           HA       PRO  17  -4.029   4.798  -7.319
    2    HB2  PRO  17           HB2      PRO  17  -5.347   2.138  -7.591
    3    HG2  PRO  17           HG2      PRO  17  -4.362   1.663  -9.646
    4    HD2  PRO  17           HD2      PRO  17  -2.581   1.257  -8.238
    5    HB3  PRO  17           HB1      PRO  17  -5.671   3.648  -8.451
    6    HG3  PRO  17           HG1      PRO  17  -3.892   3.352  -9.910
    7    HD3  PRO  17           HD1      PRO  17  -1.849   2.560  -9.197

  No H/Q in entry =           7
  In of MODEL    7
    1    HA   ALA  18           HA       ALA  18  -4.803   4.249  -3.081
    2    HB1  ALA  18           HB1      ALA  18  -5.597   6.519  -3.369
    3    HB2  ALA  18           HB2      ALA  18  -6.702   5.624  -2.326
    4    HB3  ALA  18           HB3      ALA  18  -7.130   5.928  -4.009
    5    H    ALA  18           HN       ALA  18  -5.301   5.328  -5.614

  No H/Q in entry =           5
  In of MODEL    7
    1    HA3  GLY  19           HA2      GLY  19  -7.191   0.916  -1.596
    2    H    GLY  19           HN       GLY  19  -5.304   2.250  -2.457
    3    HA2  GLY  19           HA1      GLY  19  -7.999   1.234  -3.124

  No H/Q in entry =           3
  In of MODEL    7
    1    HA   THR  20           HA       THR  20  -5.071  -1.967  -4.411
    2    HB   THR  20           HB       THR  20  -2.436  -0.676  -3.689
    3    HG1  THR  20           HG1      THR  20  -4.153  -0.275  -5.901
    4   HG23  THR  20          HG21      THR  20  -1.840  -2.747  -4.481
    5   HG22  THR  20          HG22      THR  20  -1.851  -1.783  -5.958
    6   HG21  THR  20          HG23      THR  20  -3.213  -2.840  -5.584
    7    H    THR  20           HN       THR  20  -4.597   0.412  -2.771

  No H/Q in entry =           7
  In of MODEL    7
    1    HA   THR  21           HA       THR  21  -4.349  -4.615  -1.079
    2    HB   THR  21           HB       THR  21  -3.731  -6.923  -1.828
    3    HG1  THR  21           HG1      THR  21  -2.997  -7.245  -3.765
    4   HG21  THR  21          HG21      THR  21  -6.051  -5.426  -2.736
    5   HG23  THR  21          HG22      THR  21  -5.942  -7.028  -2.005
    6   HG22  THR  21          HG23      THR  21  -5.685  -6.829  -3.739
    7    H    THR  21           HN       THR  21  -4.219  -4.001  -3.856

  No H/Q in entry =           7
  In of MODEL    7
    1    HA   CYS  22           HA       CYS  22  -0.042  -3.990  -0.501
    2    HB2  CYS  22           HB2      CYS  22  -1.605  -3.472   1.954
    3    H    CYS  22           HN       CYS  22  -2.784  -4.360   0.358
    4    HB3  CYS  22           HB1      CYS  22   0.084  -3.896   2.209

  No H/Q in entry =           4
  In of MODEL    7
    1    HA   TRP  23           HA       TRP  23   0.286  -8.242   1.010
    2    HB2  TRP  23           HB2      TRP  23  -0.072  -7.241   3.360
    3    HD1  TRP  23           HD1      TRP  23   1.656  -9.574   1.784
    4    HE1  TRP  23           HE1      TRP  23   2.535 -11.535   3.200
    5    HE3  TRP  23           HE3      TRP  23  -1.508  -9.175   5.780
    6    HZ2  TRP  23           HZ2      TRP  23   1.963 -12.753   5.681
    7    HZ3  TRP  23           HZ3      TRP  23  -1.276 -10.777   7.633
    8    HH2  TRP  23           HH2      TRP  23   0.424 -12.529   7.583
    9    H    TRP  23           HN       TRP  23  -1.981  -6.387   1.158
   10    HB3  TRP  23           HB1      TRP  23  -1.531  -8.225   3.410

  No H/Q in entry =          10
  In of MODEL    7
    1    HA   ARG  24           HA       ARG  24  -3.276 -10.394  -0.515
    2    HB2  ARG  24           HB2      ARG  24  -1.096 -10.374  -2.518
    3    HG2  ARG  24           HG2      ARG  24  -3.460  -9.068  -2.324
    4    HD2  ARG  24           HD2      ARG  24  -3.948 -11.096  -4.472
    5    HE   ARG  24           HE       ARG  24  -5.577  -9.512  -4.758
    6   HH11  ARG  24          HH11      ARG  24  -5.295 -10.252  -1.359
    7   HH12  ARG  24          HH12      ARG  24  -6.707  -9.352  -0.918
    8   HH21  ARG  24          HH21      ARG  24  -7.435  -8.327  -4.179
    9   HH22  ARG  24          HH22      ARG  24  -7.922  -8.260  -2.519
   10    H    ARG  24           HN       ARG  24  -0.509  -9.503  -0.591
   11    HB3  ARG  24           HB1      ARG  24  -2.225 -11.717  -2.622
   12    HG3  ARG  24           HG1      ARG  24  -2.576  -9.330  -3.829
   13    HD3  ARG  24           HD1      ARG  24  -4.529 -11.368  -2.829

  No H/Q in entry =          13
  In of MODEL    7
    1    HA   THR  25           HA       THR  25  -1.602 -14.167   1.108
    2    HB   THR  25           HB       THR  25  -1.904 -14.089   3.783
    3    HG1  THR  25           HG1      THR  25  -1.457 -11.986   4.487
    4   HG22  THR  25          HG21      THR  25   0.387 -12.601   2.559
    5   HG21  THR  25          HG22      THR  25   0.219 -14.350   2.409
    6   HG23  THR  25          HG23      THR  25   0.367 -13.612   4.003
    7    H    THR  25           HN       THR  25  -2.882 -11.551   1.542

  No H/Q in entry =           7
  In of MODEL    7
    1    HA   SER  26           HA       SER  26  -6.714 -13.413   1.547
    2    HB2  SER  26           HB2      SER  26  -5.379 -15.487   0.428
    3    HG   SER  26           HG       SER  26  -7.318 -15.963  -0.259
    4    H    SER  26           HN       SER  26  -4.584 -12.598   1.551
    5    HB3  SER  26           HB1      SER  26  -5.973 -16.260   1.898

  No H/Q in entry =           5
  In of MODEL    7
    1    HA   VAL  27           HA       VAL  27  -6.525 -14.433   5.918
    2    HB   VAL  27           HB       VAL  27  -4.818 -13.378   7.512
    3    H    VAL  27           HN       VAL  27  -5.181 -12.743   3.913

  No H/Q in entry =           3
  In of MODEL    7
    1    HA   SER  28           HA       SER  28  -8.320 -10.226   6.120
    2    HB2  SER  28           HB2      SER  28  -7.404  -8.740   7.694
    3    HG   SER  28           HG       SER  28  -4.816  -9.259   6.660
    4    H    SER  28           HN       SER  28  -5.972 -11.169   4.793
    5    HB3  SER  28           HB1      SER  28  -6.444 -10.204   7.900

  No H/Q in entry =           5
  In of MODEL    7
    1    HA   SER  29           HA       SER  29  -7.032  -6.945   3.320
    2    HB2  SER  29           HB2      SER  29  -9.694  -6.174   4.531
    3    HG   SER  29           HG       SER  29  -9.695  -8.175   3.488
    4    H    SER  29           HN       SER  29  -7.965  -7.533   6.045
    5    HB3  SER  29           HB1      SER  29  -9.044  -5.447   3.061

  No H/Q in entry =           5
  In of MODEL    7
    1    HA   HIS  30           HA       HIS  30  -5.764  -3.336   5.479
    2    HB2  HIS  30           HB2      HIS  30  -3.542  -4.648   4.011
    3    HD1  HIS  30           HD1      HIS  30  -1.556  -5.117   5.736
    4    HD2  HIS  30           HD2      HIS  30  -5.128  -3.789   7.392
    5    HE1  HIS  30           HE1      HIS  30  -1.400  -5.651   8.188
    6    HE2  HIS  30           HE2      HIS  30  -3.535  -4.759   9.184
    7    H    HIS  30           HN       HIS  30  -5.732  -5.235   3.225
    8    HB3  HIS  30           HB1      HIS  30  -3.301  -2.966   4.470

  No H/Q in entry =           8
  In of MODEL    7
    1    HA   TYR  31           HA       TYR  31  -5.663  -2.262   0.259
    2    HB2  TYR  31           HB2      TYR  31  -7.180  -0.669   2.335
    3    HD1  TYR  31           HD1      TYR  31  -9.364  -1.313   2.839
    4    HD2  TYR  31           HD2      TYR  31  -7.392  -3.087  -0.487
    5    HE1  TYR  31           HE1      TYR  31 -11.232  -2.891   2.580
    6    HE2  TYR  31           HE2      TYR  31  -9.255  -4.669  -0.756
    7    HH   TYR  31           HH       TYR  31 -11.055  -5.649   0.638
    8    H    TYR  31           HN       TYR  31  -5.370  -3.704   1.992
    9    HB3  TYR  31           HB1      TYR  31  -7.205  -0.348   0.604

  No H/Q in entry =           9
  In of MODEL    7
    1    HA   CYS  32           HA       CYS  32  -2.713   0.881   0.950
    2    HB2  CYS  32           HB2      CYS  32  -2.587  -0.230  -1.532
    3    H    CYS  32           HN       CYS  32  -4.849  -0.314  -0.667
    4    HB3  CYS  32           HB1      CYS  32  -2.806   1.468  -1.940

  No H/Q in entry =           4
  In of MODEL    7
    1    HA   THR  33           HA       THR  33  -4.881   4.611   1.241
    2    HB   THR  33           HB       THR  33  -3.357   6.513   1.783
    3    HG1  THR  33           HG1      THR  33  -1.296   4.585   1.552
    4   HG22  THR  33          HG21      THR  33  -2.249   4.358   3.449
    5   HG21  THR  33          HG22      THR  33  -4.007   4.485   3.409
    6   HG23  THR  33          HG23      THR  33  -3.035   5.868   3.909
    7    H    THR  33           HN       THR  33  -2.551   3.053   1.281

  No H/Q in entry =           7
  In of MODEL    7
    1    HA3  GLY  34           HA2      GLY  34  -2.206   5.048  -3.232
    2    H    GLY  34           HN       GLY  34  -2.029   4.677  -0.882
    3    HA2  GLY  34           HA1      GLY  34  -3.708   5.916  -2.950

  No H/Q in entry =           3
  In of MODEL    7
    1    HA   ARG  35           HA       ARG  35  -1.554   9.647  -2.405
    2    HB2  ARG  35           HB2      ARG  35  -3.163   9.672  -0.245
    3    HG2  ARG  35           HG2      ARG  35  -2.310  12.071   0.168
    4    HD2  ARG  35           HD2      ARG  35  -2.990  11.827  -2.686
    5    HE   ARG  35           HE       ARG  35  -3.457  13.725  -0.813
    6   HH11  ARG  35          HH11      ARG  35  -5.541  11.742  -2.789
    7   HH12  ARG  35          HH12      ARG  35  -6.806  12.922  -2.859
    8   HH21  ARG  35          HH21      ARG  35  -5.121  15.278  -0.903
    9   HH22  ARG  35          HH22      ARG  35  -6.568  14.930  -1.789
   10    H    ARG  35           HN       ARG  35  -2.749   7.580  -0.835
   11    HB3  ARG  35           HB1      ARG  35  -1.612   9.911   0.547
   12    HG3  ARG  35           HG1      ARG  35  -1.270  11.768  -1.226
   13    HD3  ARG  35           HD1      ARG  35  -4.100  11.033  -1.571

  No H/Q in entry =          13
  In of MODEL    7
    1    HA   SER  36           HA       SER  36   2.336   8.200  -0.605
    2    HB2  SER  36           HB2      SER  36   1.032   7.961   2.077
    3    HG   SER  36           HG       SER  36   2.953   9.672   0.889
    4    H    SER  36           HN       SER  36  -0.411   7.346  -0.027
    5    HB3  SER  36           HB1      SER  36   2.739   7.544   1.920

  No H/Q in entry =           5
  In of MODEL    7
    1    HA   CYS  37           HA       CYS  37   3.182   3.991  -0.953
    2    HB2  CYS  37           HB2      CYS  37   5.545   5.299  -0.753
    3    H    CYS  37           HN       CYS  37   3.947   6.520   0.119
    4    HB3  CYS  37           HB1      CYS  37   5.705   4.163   0.582

  No H/Q in entry =           4
  In of MODEL    7
    1    HA   GLU  38           HA       GLU  38   3.663   2.887   3.703
    2    HB2  GLU  38           HB2      GLU  38   2.397   5.465   4.638
    3    HG2  GLU  38           HG2      GLU  38   5.298   4.670   4.630
    4    H    GLU  38           HN       GLU  38   3.536   5.299   2.263
    5    HB3  GLU  38           HB1      GLU  38   3.071   4.188   5.641
    6    HG3  GLU  38           HG1      GLU  38   4.568   6.056   3.822

  No H/Q in entry =           6
  In of MODEL    7
    1    HA   CYS  39           HA       CYS  39  -0.568   1.850   3.350
    2    HB2  CYS  39           HB2      CYS  39   1.109  -0.317   3.191
    3    H    CYS  39           HN       CYS  39   2.159   1.452   4.332
    4    HB3  CYS  39           HB1      CYS  39   0.088  -0.747   4.558

  No H/Q in entry =           4
  In of MODEL    7
    1    HA   PRO  40           HA       PRO  40  -2.379   2.713   7.276
    2    HB2  PRO  40           HB2      PRO  40  -4.425   0.684   6.516
    3    HG2  PRO  40           HG2      PRO  40  -4.941   1.702   4.487
    4    HD2  PRO  40           HD2      PRO  40  -2.937   0.696   3.945
    5    HB3  PRO  40           HB1      PRO  40  -4.641   2.355   7.049
    6    HG3  PRO  40           HG1      PRO  40  -4.161   3.225   4.953
    7    HD3  PRO  40           HD1      PRO  40  -2.464   2.380   3.641

  No H/Q in entry =           7
  In of MODEL    7
    1    HA   SER  41           HA       SER  41  -2.328  -1.225   9.506
    2    HB2  SER  41           HB2      SER  41  -0.510   0.277  10.258
    3    HG   SER  41           HG       SER  41  -0.528  -1.583  11.399
    4    H    SER  41           HN       SER  41  -3.393   1.470   9.193
    5    HB3  SER  41           HB1      SER  41  -1.616   1.014  11.417

  No H/Q in entry =           5
  In of MODEL    7
    1    HA   TYR  42           HA       TYR  42  -6.135  -1.357  11.631
    2    HB2  TYR  42           HB2      TYR  42  -5.583   1.135  12.222
    3    HD1  TYR  42           HD1      TYR  42  -5.850  -0.481  14.187
    4    HD2  TYR  42           HD2      TYR  42  -9.150   1.307  12.183
    5    HE1  TYR  42           HE1      TYR  42  -7.279  -0.955  16.130
    6    HE2  TYR  42           HE2      TYR  42 -10.588   0.839  14.122
    7    HH   TYR  42           HH       TYR  42  -9.653   0.297  17.019
    8    H    TYR  42           HN       TYR  42  -4.991  -0.075   9.327
    9    HB3  TYR  42           HB1      TYR  42  -7.009   1.485  11.251

  No H/Q in entry =           9
  In of MODEL    7
    1    HA   PRO  43           HA       PRO  43  -8.488  -2.048   7.716
    2    HB2  PRO  43           HB2      PRO  43  -9.519  -4.168   9.544
    3    HG2  PRO  43           HG2      PRO  43  -7.452  -5.215   9.768
    4    HD2  PRO  43           HD2      PRO  43  -7.130  -3.401  11.152
    5    HB3  PRO  43           HB1      PRO  43  -9.039  -4.281   7.847
    6    HG3  PRO  43           HG1      PRO  43  -6.777  -4.380   8.356
    7    HD3  PRO  43           HD1      PRO  43  -5.838  -3.050   9.986

  No H/Q in entry =           7
  In of MODEL    7
    1    HA3  GLY  44           HA2      GLY  44 -12.538  -0.628   8.320
    2    H    GLY  44           HN       GLY  44  -9.917  -0.367   7.687
    3    HA2  GLY  44           HA1      GLY  44 -11.846   0.012   9.803

  No H/Q in entry =           3
  In of MODEL    7
    1    HA   ASN  45           HA       ASN  45 -10.916   3.778   7.519
    2    HB2  ASN  45           HB2      ASN  45 -13.413   3.699   9.121
    3   HD21  ASN  45          HD21      ASN  45 -11.839   4.991   6.216
    4   HD22  ASN  45          HD22      ASN  45 -13.054   4.452   5.112
    5    H    ASN  45           HN       ASN  45 -10.982   2.119   9.817
    6    HB3  ASN  45           HB1      ASN  45 -12.821   5.293   8.664

  No H/Q in entry =           6
  In of MODEL    7
    1    HA3  GLY  46           HA2      GLY  46  -9.417   6.481  10.696
    2    H    GLY  46           HN       GLY  46  -9.809   5.647   7.912
    3    HA2  GLY  46           HA1      GLY  46  -7.997   6.050   9.755

  No H/Q in entry =           3
  In of MODEL    8
    1    H1   ALA   1           HT3      ALA   1  20.204  12.102  -2.286
    2    H2   ALA   1           HT2      ALA   1  20.769  10.509  -1.988
    3    H3   ALA   1           HT1      ALA   1  21.879  11.816  -2.063
    4    HA   ALA   1           HA       ALA   1  21.488  12.132  -4.331
    5    HB3  ALA   1           HB1      ALA   1  23.171  10.538  -3.947
    6    HB1  ALA   1           HB2      ALA   1  22.131   9.825  -5.180
    7    HB2  ALA   1           HB3      ALA   1  22.005   9.291  -3.504

  No H/Q in entry =           7
  In of MODEL    8
    1    HA   MET   2           HA       MET   2  17.319  12.548  -5.807
    2    HB2  MET   2           HB2      MET   2  18.133   9.758  -6.609
    3    H    MET   2           HN       MET   2  19.357  12.747  -4.818
    4    HG2  MET   2           HG2      MET   2  18.769  12.240  -8.173
    5    HE3  MET   2           HE1      MET   2  21.082  11.029 -10.591
    6    HB3  MET   2           HB1      MET   2  17.013  10.837  -7.430
    7    HE2  MET   2           HE2      MET   2  21.825   9.975  -9.387
    8    HE1  MET   2           HE3      MET   2  21.346  11.615  -8.949
    9    HG3  MET   2           HG1      MET   2  19.939  11.440  -7.126

  No H/Q in entry =           9
  In of MODEL    8
    1    HA   ASP   3           HA       ASP   3  15.027   9.218  -3.730
    2    HB2  ASP   3           HB2      ASP   3  14.824  11.647  -2.774
    3    H    ASP   3           HN       ASP   3  15.275  11.153  -5.860
    4    HB3  ASP   3           HB1      ASP   3  13.223  11.604  -3.507

  No H/Q in entry =           4
  In of MODEL    8
    1    HA   CYS   4           HA       CYS   4  10.999   8.796  -5.716
    2    HB2  CYS   4           HB2      CYS   4  12.798   7.613  -7.005
    3    H    CYS   4           HN       CYS   4  12.948   8.167  -3.702
    4    HB3  CYS   4           HB1      CYS   4  12.515   6.196  -6.001

  No H/Q in entry =           4
  In of MODEL    8
    1    HA   THR   5           HA       THR   5   8.541   6.728  -2.835
    2    HB   THR   5           HB       THR   5   6.281   6.181  -3.725
    3    HG1  THR   5           HG1      THR   5   5.886   6.711  -5.920
    4   HG22  THR   5          HG21      THR   5   7.003   8.823  -4.900
    5   HG21  THR   5          HG22      THR   5   7.076   8.577  -3.155
    6   HG23  THR   5          HG23      THR   5   5.555   8.341  -4.016
    7    H    THR   5           HN       THR   5   9.065   7.620  -5.480

  No H/Q in entry =           7
  In of MODEL    8
    1    HA   THR   6           HA       THR   6   8.879   2.447  -3.718
    2    HB   THR   6           HB       THR   6  11.030   1.584  -2.611
    3    HG1  THR   6           HG1      THR   6  11.104   3.462  -1.160
    4   HG21  THR   6          HG21      THR   6  10.768   3.391  -4.887
    5   HG23  THR   6          HG22      THR   6  11.604   1.844  -4.748
    6   HG22  THR   6          HG23      THR   6  12.390   3.323  -4.197
    7    H    THR   6           HN       THR   6   9.280   4.855  -2.081

  No H/Q in entry =           7
  In of MODEL    8
    1    HA3  GLY   7           HA2      GLY   7   8.207  -0.157  -0.158
    2    H    GLY   7           HN       GLY   7   7.979   0.757  -2.679
    3    HA2  GLY   7           HA1      GLY   7   7.085   1.180   0.045

  No H/Q in entry =           3
  In of MODEL    8
    1    HA   PRO   8           HA       PRO   8   4.833  -2.909  -0.869
    2    HB2  PRO   8           HB2      PRO   8   3.114  -1.617   1.196
    3    HG2  PRO   8           HG2      PRO   8   4.693  -1.829   2.894
    4    HD2  PRO   8           HD2      PRO   8   5.590  -0.052   1.728
    5    HB3  PRO   8           HB1      PRO   8   3.556  -3.317   1.003
    6    HG3  PRO   8           HG1      PRO   8   5.637  -3.025   1.986
    7    HD3  PRO   8           HD1      PRO   8   6.947  -1.181   1.542

  No H/Q in entry =           7
  In of MODEL    8
    1    HA   CYS   9           HA       CYS   9   1.551  -0.009  -2.278
    2    HB2  CYS   9           HB2      CYS   9   1.115   1.045   0.006
    3    H    CYS   9           HN       CYS   9   3.679   0.401  -0.307
    4    HB3  CYS   9           HB1      CYS   9   1.985   2.454  -0.592

  No H/Q in entry =           4
  In of MODEL    8
    1    HA   CYS  10           HA       CYS  10   4.041   2.296  -5.035
    2    HB2  CYS  10           HB2      CYS  10   6.407   2.191  -3.152
    3    H    CYS  10           HN       CYS  10   4.336   0.177  -3.075
    4    HB3  CYS  10           HB1      CYS  10   6.305   3.210  -4.585

  No H/Q in entry =           4
  In of MODEL    8
    1    HA   ARG  11           HA       ARG  11   6.842  -0.383  -7.132
    2    HB2  ARG  11           HB2      ARG  11   4.321  -1.294  -7.188
    3    HG2  ARG  11           HG2      ARG  11   6.672  -2.453  -7.666
    4    HD2  ARG  11           HD2      ARG  11   5.271  -3.060 -10.222
    5    HE   ARG  11           HE       ARG  11   7.841  -3.636  -9.121
    6   HH11  ARG  11          HH11      ARG  11   6.114  -3.138 -12.113
    7   HH12  ARG  11          HH12      ARG  11   7.217  -4.086 -13.053
    8   HH21  ARG  11          HH21      ARG  11   9.293  -4.882 -10.356
    9   HH22  ARG  11          HH22      ARG  11   9.022  -5.077 -12.055
   10    H    ARG  11           HN       ARG  11   4.698   1.598  -6.961
   11    HB3  ARG  11           HB1      ARG  11   4.493  -0.863  -8.884
   12    HG3  ARG  11           HG1      ARG  11   5.128  -3.262  -7.940
   13    HD3  ARG  11           HD1      ARG  11   6.296  -1.628 -10.138

  No H/Q in entry =          13
  In of MODEL    8
    1    HA   GLN  12           HA       GLN  12   8.791   0.433 -11.049
    2    HB2  GLN  12           HB2      GLN  12   5.886   1.047 -11.341
    3    HG2  GLN  12           HG2      GLN  12   7.848  -0.769 -12.554
    4   HE21  GLN  12          HE21      GLN  12   4.814   0.712 -13.660
    5   HE22  GLN  12          HE22      GLN  12   5.222   0.698 -15.339
    6    H    GLN  12           HN       GLN  12   7.889  -0.465  -9.164
    7    HB3  GLN  12           HB1      GLN  12   7.013   1.803 -12.458
    8    HG3  GLN  12           HG1      GLN  12   6.122  -0.983 -12.267

  No H/Q in entry =           8
  In of MODEL    8
    1    HA   CYS  13           HA       CYS  13   9.749   3.903  -7.835
    2    HB2  CYS  13           HB2      CYS  13  10.895   3.635 -10.264
    3    H    CYS  13           HN       CYS  13   9.014   1.896  -8.609
    4    HB3  CYS  13           HB1      CYS  13   9.979   5.114 -10.529

  No H/Q in entry =           4
  In of MODEL    8
    1    HA   LYS  14           HA       LYS  14   6.116   6.306  -8.118
    2    HB2  LYS  14           HB2      LYS  14   5.809   5.492 -10.479
    3    HG2  LYS  14           HG2      LYS  14   3.123   5.985  -9.247
    4    HD2  LYS  14           HD2      LYS  14   4.407   6.996 -11.782
    5    HE2  LYS  14           HE2      LYS  14   1.483   6.943 -11.424
    6    HZ1  LYS  14           HZ1      LYS  14   3.497   8.587 -12.756
    7    HZ3  LYS  14           HZ2      LYS  14   2.051   9.342 -12.309
    8    HZ2  LYS  14           HZ3      LYS  14   2.021   8.001 -13.340
    9    H    LYS  14           HN       LYS  14   6.943   3.523  -8.151
   10    HB3  LYS  14           HB1      LYS  14   4.653   4.320  -9.862
   11    HG3  LYS  14           HG1      LYS  14   4.333   7.263  -9.378
   12    HD3  LYS  14           HD1      LYS  14   3.299   5.626 -11.692
   13    HE3  LYS  14           HE1      LYS  14   2.353   8.120 -10.441

  No H/Q in entry =          13
  In of MODEL    8
    1    HA   LEU  15           HA       LEU  15   3.441   4.683  -5.125
    2    HB2  LEU  15           HB2      LEU  15   3.205   7.348  -5.251
    3    HG   LEU  15           HG       LEU  15   2.855   5.705  -3.224
    4   HD11  LEU  15          HD11      LEU  15   1.695   8.483  -3.358
    5   HD13  LEU  15          HD12      LEU  15   3.367   8.056  -2.995
    6   HD12  LEU  15          HD13      LEU  15   2.080   7.612  -1.874
    7   HD21  LEU  15          HD21      LEU  15   0.120   6.194  -4.254
    8   HD23  LEU  15          HD22      LEU  15   0.354   6.255  -2.507
    9   HD22  LEU  15          HD23      LEU  15   0.780   4.797  -3.402
   10    H    LEU  15           HN       LEU  15   3.861   6.541  -7.308
   11    HB3  LEU  15           HB1      LEU  15   1.548   6.912  -5.624

  No H/Q in entry =          11
  In of MODEL    8
    1    HA   LYS  16           HA       LYS  16   0.224   2.579  -7.117
    2    HB2  LYS  16           HB2      LYS  16   0.280   1.807  -4.244
    3    HG2  LYS  16           HG2      LYS  16   0.175   0.018  -6.648
    4    HD2  LYS  16           HD2      LYS  16   1.756  -0.532  -4.199
    5    HE2  LYS  16           HE2      LYS  16  -0.096  -2.299  -5.780
    6    HZ2  LYS  16           HZ1      LYS  16   0.901  -4.037  -4.718
    7    HZ1  LYS  16           HZ2      LYS  16   0.956  -2.885  -3.481
    8    HZ3  LYS  16           HZ3      LYS  16   2.336  -3.195  -4.409
    9    H    LYS  16           HN       LYS  16   1.542   3.520  -4.740
   10    HB3  LYS  16           HB1      LYS  16  -1.124   1.321  -5.185
   11    HG3  LYS  16           HG1      LYS  16   1.681   0.747  -6.085
   12    HD3  LYS  16           HD1      LYS  16  -0.001  -0.646  -4.076
   13    HE3  LYS  16           HE1      LYS  16   1.592  -2.038  -6.217

  No H/Q in entry =          13
  In of MODEL    8
    1    HA   PRO  17           HA       PRO  17  -3.395   5.092  -7.001
    2    HB2  PRO  17           HB2      PRO  17  -5.290   3.376  -7.912
    3    HG2  PRO  17           HG2      PRO  17  -4.143   1.373  -7.666
    4    HD2  PRO  17           HD2      PRO  17  -1.860   1.307  -7.356
    5    HB3  PRO  17           HB1      PRO  17  -4.046   4.073  -8.956
    6    HG3  PRO  17           HG1      PRO  17  -3.659   1.808  -9.316
    7    HD3  PRO  17           HD1      PRO  17  -1.553   2.475  -8.657

  No H/Q in entry =           7
  In of MODEL    8
    1    HA   ALA  18           HA       ALA  18  -5.250   4.411  -3.138
    2    HB3  ALA  18           HB1      ALA  18  -5.780   6.732  -3.371
    3    HB2  ALA  18           HB2      ALA  18  -7.231   5.895  -2.821
    4    HB1  ALA  18           HB3      ALA  18  -7.077   6.375  -4.511
    5    H    ALA  18           HN       ALA  18  -5.029   5.650  -5.636

  No H/Q in entry =           5
  In of MODEL    8
    1    HA3  GLY  19           HA2      GLY  19  -8.306   1.369  -3.030
    2    H    GLY  19           HN       GLY  19  -5.752   2.237  -3.301
    3    HA2  GLY  19           HA1      GLY  19  -8.074   1.353  -4.772

  No H/Q in entry =           3
  In of MODEL    8
    1    HA   THR  20           HA       THR  20  -5.392  -2.100  -4.670
    2    HB   THR  20           HB       THR  20  -2.789  -0.918  -3.854
    3    HG1  THR  20           HG1      THR  20  -4.087  -0.265  -6.288
    4   HG22  THR  20          HG21      THR  20  -2.091  -2.089  -5.989
    5   HG21  THR  20          HG22      THR  20  -3.707  -2.797  -6.000
    6   HG23  THR  20          HG23      THR  20  -2.616  -3.110  -4.650
    7    H    THR  20           HN       THR  20  -5.198   0.687  -4.459

  No H/Q in entry =           7
  In of MODEL    8
    1    HA   THR  21           HA       THR  21  -4.727  -3.108  -0.462
    2    HB   THR  21           HB       THR  21  -4.614  -5.762  -0.426
    3    HG1  THR  21           HG1      THR  21  -5.358  -6.653  -2.311
    4   HG23  THR  21          HG21      THR  21  -6.599  -4.896   0.345
    5   HG22  THR  21          HG22      THR  21  -7.112  -5.767  -1.100
    6   HG21  THR  21          HG23      THR  21  -6.918  -4.015  -1.149
    7    H    THR  21           HN       THR  21  -4.297  -3.714  -3.306

  No H/Q in entry =           7
  In of MODEL    8
    1    HA   CYS  22           HA       CYS  22  -0.386  -3.474  -0.120
    2    HB2  CYS  22           HB2      CYS  22  -1.603  -2.455   2.392
    3    H    CYS  22           HN       CYS  22  -3.030  -2.996   0.847
    4    HB3  CYS  22           HB1      CYS  22   0.027  -3.109   2.503

  No H/Q in entry =           4
  In of MODEL    8
    1    HA   TRP  23           HA       TRP  23  -1.101  -7.633   1.612
    2    HB2  TRP  23           HB2      TRP  23  -0.205  -6.322   3.665
    3    HD1  TRP  23           HD1      TRP  23   0.458  -9.031   2.130
    4    HE1  TRP  23           HE1      TRP  23   1.211 -11.092   3.476
    5    HE3  TRP  23           HE3      TRP  23  -1.413  -7.739   6.709
    6    HZ2  TRP  23           HZ2      TRP  23   1.035 -12.043   6.127
    7    HZ3  TRP  23           HZ3      TRP  23  -1.078  -9.280   8.597
    8    HH2  TRP  23           HH2      TRP  23   0.120 -11.387   8.311
    9    H    TRP  23           HN       TRP  23  -2.652  -5.223   1.893
   10    HB3  TRP  23           HB1      TRP  23  -1.707  -6.815   4.441

  No H/Q in entry =          10
  In of MODEL    8
    1    HA   ARG  24           HA       ARG  24  -4.902  -9.515   2.722
    2    HB2  ARG  24           HB2      ARG  24  -5.703  -7.736   1.230
    3    HG2  ARG  24           HG2      ARG  24  -6.852 -10.451   1.065
    4    HD2  ARG  24           HD2      ARG  24  -6.924  -9.157  -1.257
    5    HE   ARG  24           HE       ARG  24  -8.425  -7.403   0.223
    6   HH11  ARG  24          HH11      ARG  24  -8.992  -9.459  -2.539
    7   HH12  ARG  24          HH12      ARG  24 -10.197  -8.419  -3.223
    8   HH21  ARG  24          HH21      ARG  24 -10.009  -6.035  -0.674
    9   HH22  ARG  24          HH22      ARG  24 -10.774  -6.475  -2.164
   10    H    ARG  24           HN       ARG  24  -2.576  -9.088   1.077
   11    HB3  ARG  24           HB1      ARG  24  -5.248  -8.698  -0.169
   12    HG3  ARG  24           HG1      ARG  24  -7.572  -8.942   1.629
   13    HD3  ARG  24           HD1      ARG  24  -8.286 -10.105  -0.659

  No H/Q in entry =          13
  In of MODEL    8
    1    HA   THR  25           HA       THR  25  -5.206 -13.458   0.828
    2    HB   THR  25           HB       THR  25  -2.830 -13.013   0.483
    3    HG1  THR  25           HG1      THR  25  -3.275 -15.545   1.679
    4   HG22  THR  25          HG21      THR  25  -1.862 -14.318   2.889
    5   HG21  THR  25          HG22      THR  25  -2.621 -12.757   3.201
    6   HG23  THR  25          HG23      THR  25  -1.278 -12.873   2.064
    7    H    THR  25           HN       THR  25  -4.990 -11.640   2.953

  No H/Q in entry =           7
  In of MODEL    8
    1    HA   SER  26           HA       SER  26  -8.014 -14.933   4.048
    2    HB2  SER  26           HB2      SER  26  -5.549 -16.687   3.906
    3    HG   SER  26           HG       SER  26  -7.976 -16.706   2.442
    4    H    SER  26           HN       SER  26  -6.955 -13.727   2.437
    5    HB3  SER  26           HB1      SER  26  -7.106 -17.140   4.597

  No H/Q in entry =           5
  In of MODEL    8
    1    HA   VAL  27           HA       VAL  27  -5.833 -13.525   7.614
    2    HB   VAL  27           HB       VAL  27  -3.627 -13.509   6.536
    3    H    VAL  27           HN       VAL  27  -6.238 -12.745   4.814

  No H/Q in entry =           3
  In of MODEL    8
    1    HA   SER  28           HA       SER  28  -8.036  -9.502   6.917
    2    HB2  SER  28           HB2      SER  28  -5.764  -9.003   8.044
    3    HG   SER  28           HG       SER  28  -6.608  -6.530   7.594
    4    H    SER  28           HN       SER  28  -6.112 -10.852   5.315
    5    HB3  SER  28           HB1      SER  28  -5.450  -7.984   6.640

  No H/Q in entry =           5
  In of MODEL    8
    1    HA   SER  29           HA       SER  29  -7.584  -7.070   3.100
    2    HB2  SER  29           HB2      SER  29 -10.207  -6.769   4.516
    3    HG   SER  29           HG       SER  29 -10.085  -7.742   1.958
    4    H    SER  29           HN       SER  29  -7.942  -6.974   5.996
    5    HB3  SER  29           HB1      SER  29  -9.946  -5.916   2.995

  No H/Q in entry =           5
  In of MODEL    8
    1    HA   HIS  30           HA       HIS  30  -6.476  -3.052   4.768
    2    HB2  HIS  30           HB2      HIS  30  -4.026  -4.092   3.337
    3    HD1  HIS  30           HD1      HIS  30  -2.073  -4.621   5.014
    4    HD2  HIS  30           HD2      HIS  30  -5.773  -3.945   6.779
    5    HE1  HIS  30           HE1      HIS  30  -1.857  -5.467   7.372
    6    HE2  HIS  30           HE2      HIS  30  -4.135  -5.126   8.394
    7    H    HIS  30           HN       HIS  30  -5.888  -5.583   3.512
    8    HB3  HIS  30           HB1      HIS  30  -4.125  -2.493   4.065

  No H/Q in entry =           8
  In of MODEL    8
    1    HA   TYR  31           HA       TYR  31  -6.075  -1.141   0.605
    2    HB2  TYR  31           HB2      TYR  31  -7.871   0.166   2.614
    3    HD1  TYR  31           HD1      TYR  31  -7.540  -1.422  -0.744
    4    HD2  TYR  31           HD2      TYR  31 -10.001  -0.755   2.661
    5    HE1  TYR  31           HE1      TYR  31  -9.216  -2.971  -1.659
    6    HE2  TYR  31           HE2      TYR  31 -11.683  -2.303   1.757
    7    HH   TYR  31           HH       TYR  31 -11.049  -4.345  -0.925
    8    H    TYR  31           HN       TYR  31  -5.400  -1.101   3.399
    9    HB3  TYR  31           HB1      TYR  31  -7.680   0.896   1.024

  No H/Q in entry =           9
  In of MODEL    8
    1    HA   CYS  32           HA       CYS  32  -3.377   2.264   0.984
    2    HB2  CYS  32           HB2      CYS  32  -3.699   1.453  -1.864
    3    H    CYS  32           HN       CYS  32  -5.376   0.732  -0.511
    4    HB3  CYS  32           HB1      CYS  32  -2.858   2.964  -1.537

  No H/Q in entry =           4
  In of MODEL    8
    1    HA   THR  33           HA       THR  33  -5.772   5.830   0.177
    2    HB   THR  33           HB       THR  33  -4.447   7.792   1.367
    3    HG1  THR  33           HG1      THR  33  -2.822   7.145   2.611
    4   HG23  THR  33          HG21      THR  33  -5.704   7.400   3.166
    5   HG22  THR  33          HG22      THR  33  -5.070   5.768   3.378
    6   HG21  THR  33          HG23      THR  33  -6.363   6.068   2.216
    7    H    THR  33           HN       THR  33  -3.182   4.546   0.695

  No H/Q in entry =           7
  In of MODEL    8
    1    HA3  GLY  34           HA2      GLY  34  -1.602   6.501  -2.858
    2    H    GLY  34           HN       GLY  34  -2.405   5.812  -0.761
    3    HA2  GLY  34           HA1      GLY  34  -3.083   7.415  -3.100

  No H/Q in entry =           3
  In of MODEL    8
    1    HA   ARG  35           HA       ARG  35  -0.503  10.424  -0.939
    2    HB2  ARG  35           HB2      ARG  35  -2.042   9.735   1.151
    3    HG2  ARG  35           HG2      ARG  35  -1.199  11.803   2.344
    4    HD2  ARG  35           HD2      ARG  35  -1.636  12.525  -0.498
    5    HE   ARG  35           HE       ARG  35  -2.404  14.327   0.652
    6   HH11  ARG  35          HH11      ARG  35  -3.241  11.463   2.461
    7   HH12  ARG  35          HH12      ARG  35  -4.096  12.336   3.688
    8   HH21  ARG  35          HH21      ARG  35  -3.528  15.477   2.265
    9   HH22  ARG  35          HH22      ARG  35  -4.259  14.615   3.577
   10    H    ARG  35           HN       ARG  35  -1.233   7.680  -0.157
   11    HB3  ARG  35           HB1      ARG  35  -0.464   9.626   1.920
   12    HG3  ARG  35           HG1      ARG  35  -0.037  11.966   1.026
   13    HD3  ARG  35           HD1      ARG  35  -2.884  11.569   0.299

  No H/Q in entry =          13
  In of MODEL    8
    1    HA   SER  36           HA       SER  36   3.366   8.096  -0.240
    2    HB2  SER  36           HB2      SER  36   2.718   9.031   2.178
    3    HG   SER  36           HG       SER  36   4.804   9.273   2.309
    4    H    SER  36           HN       SER  36   0.659   7.422   0.437
    5    HB3  SER  36           HB1      SER  36   3.094   7.370   2.635

  No H/Q in entry =           5
  In of MODEL    8
    1    HA   CYS  37           HA       CYS  37   3.773   3.810  -0.406
    2    HB2  CYS  37           HB2      CYS  37   6.460   4.404   0.851
    3    H    CYS  37           HN       CYS  37   4.879   6.263   0.537
    4    HB3  CYS  37           HB1      CYS  37   6.027   2.886   0.072

  No H/Q in entry =           4
  In of MODEL    8
    1    HA   GLU  38           HA       GLU  38   4.316   2.754   4.227
    2    HB2  GLU  38           HB2      GLU  38   3.633   5.527   5.207
    3    HG2  GLU  38           HG2      GLU  38   5.995   5.000   4.040
    4    H    GLU  38           HN       GLU  38   4.469   5.157   2.742
    5    HB3  GLU  38           HB1      GLU  38   4.152   4.154   6.176
    6    HG3  GLU  38           HG1      GLU  38   5.784   6.126   5.380

  No H/Q in entry =           6
  In of MODEL    8
    1    HA   CYS  39           HA       CYS  39  -0.064   2.496   3.812
    2    HB2  CYS  39           HB2      CYS  39   1.238  -0.016   3.544
    3    H    CYS  39           HN       CYS  39   2.595   1.470   4.254
    4    HB3  CYS  39           HB1      CYS  39  -0.100  -0.235   4.666

  No H/Q in entry =           4
  In of MODEL    8
    1    HA   PRO  40           HA       PRO  40  -1.240   3.005   8.035
    2    HB2  PRO  40           HB2      PRO  40  -3.906   2.530   7.884
    3    HG2  PRO  40           HG2      PRO  40  -4.000   1.532   5.790
    4    HD2  PRO  40           HD2      PRO  40  -2.258   1.685   4.290
    5    HB3  PRO  40           HB1      PRO  40  -3.159   4.003   7.256
    6    HG3  PRO  40           HG1      PRO  40  -4.220   3.233   5.335
    7    HD3  PRO  40           HD1      PRO  40  -2.063   3.431   4.547

  No H/Q in entry =           7
  In of MODEL    8
    1    HA   SER  41           HA       SER  41  -1.853  -1.060   9.559
    2    HB2  SER  41           HB2      SER  41  -1.090  -1.013  12.026
    3    HG   SER  41           HG       SER  41   0.252   1.138  12.074
    4    H    SER  41           HN       SER  41  -1.736   1.856   9.905
    5    HB3  SER  41           HB1      SER  41   0.082  -0.546  10.795

  No H/Q in entry =           5
  In of MODEL    8
    1    HA   TYR  42           HA       TYR  42  -5.715  -0.537  11.620
    2    HB2  TYR  42           HB2      TYR  42  -5.197   2.098  11.568
    3    HD1  TYR  42           HD1      TYR  42  -5.561   2.533  13.794
    4    HD2  TYR  42           HD2      TYR  42  -8.567   0.468  11.604
    5    HE1  TYR  42           HE1      TYR  42  -6.974   2.468  15.806
    6    HE2  TYR  42           HE2      TYR  42  -9.989   0.398  13.609
    7    HH   TYR  42           HH       TYR  42  -9.289   2.224  16.424
    8    H    TYR  42           HN       TYR  42  -4.200   0.597   9.374
    9    HB3  TYR  42           HB1      TYR  42  -6.634   2.077  10.551

  No H/Q in entry =           9
  In of MODEL    8
    1    HA   PRO  43           HA       PRO  43  -7.480  -2.082   7.636
    2    HB2  PRO  43           HB2      PRO  43  -8.741  -3.839   9.687
    3    HG2  PRO  43           HG2      PRO  43  -6.721  -4.745  10.406
    4    HD2  PRO  43           HD2      PRO  43  -6.625  -2.680  11.429
    5    HB3  PRO  43           HB1      PRO  43  -8.017  -4.265   8.132
    6    HG3  PRO  43           HG1      PRO  43  -5.853  -4.178   8.966
    7    HD3  PRO  43           HD1      PRO  43  -5.173  -2.524  10.419

  No H/Q in entry =           7
  In of MODEL    8
    1    HA3  GLY  44           HA2      GLY  44 -11.110   0.257   8.542
    2    H    GLY  44           HN       GLY  44  -9.119  -0.925   6.848
    3    HA2  GLY  44           HA1      GLY  44 -11.041   0.356   6.789

  No H/Q in entry =           3
  In of MODEL    8
    1    HA   ASN  45           HA       ASN  45 -15.198  -1.411   8.692
    2    HB2  ASN  45           HB2      ASN  45 -14.044  -2.043   6.018
    3   HD21  ASN  45          HD21      ASN  45 -14.426   0.146   5.627
    4   HD22  ASN  45          HD22      ASN  45 -16.026   0.767   5.429
    5    H    ASN  45           HN       ASN  45 -13.309  -0.146   8.626
    6    HB3  ASN  45           HB1      ASN  45 -15.357  -3.060   6.603

  No H/Q in entry =           6
  In of MODEL    8
    1    HA3  GLY  46           HA2      GLY  46 -13.903  -5.305  10.162
    2    H    GLY  46           HN       GLY  46 -16.025  -3.596   9.065
    3    HA2  GLY  46           HA1      GLY  46 -15.595  -5.340  10.634

  No H/Q in entry =           3
  In of MODEL    9
    1    H1   ALA   1           HT1      ALA   1  17.314   6.518   3.267
    2    H2   ALA   1           HT3      ALA   1  16.159   5.393   3.849
    3    H3   ALA   1           HT2      ALA   1  16.814   5.210   2.273
    4    HA   ALA   1           HA       ALA   1  14.624   6.072   2.162
    5    HB3  ALA   1           HB1      ALA   1  15.728   8.240   3.939
    6    HB1  ALA   1           HB2      ALA   1  14.430   7.104   4.310
    7    HB2  ALA   1           HB3      ALA   1  14.189   8.348   3.083

  No H/Q in entry =           7
  In of MODEL    9
    1    HA   MET   2           HA       MET   2  16.122   8.944  -0.826
    2    HB2  MET   2           HB2      MET   2  16.781   6.423  -1.429
    3    H    MET   2           HN       MET   2  14.356   6.838   0.170
    4    HG2  MET   2           HG2      MET   2  16.878   8.202  -3.788
    5    HE2  MET   2           HE1      MET   2  19.398   6.047  -5.359
    6    HB3  MET   2           HB1      MET   2  15.588   6.692  -2.692
    7    HE1  MET   2           HE2      MET   2  18.498   7.559  -5.477
    8    HE3  MET   2           HE3      MET   2  17.646   6.049  -5.154
    9    HG3  MET   2           HG1      MET   2  17.659   8.772  -2.314

  No H/Q in entry =           9
  In of MODEL    9
    1    HA   ASP   3           HA       ASP   3  12.678  10.338  -3.016
    2    HB2  ASP   3           HB2      ASP   3  14.423  10.234  -5.485
    3    H    ASP   3           HN       ASP   3  15.353   9.389  -3.261
    4    HB3  ASP   3           HB1      ASP   3  12.990  11.232  -5.260

  No H/Q in entry =           4
  In of MODEL    9
    1    HA   CYS   4           HA       CYS   4   9.994   8.635  -6.463
    2    HB2  CYS   4           HB2      CYS   4  12.551   7.113  -6.366
    3    H    CYS   4           HN       CYS   4  11.388  10.020  -5.317
    4    HB3  CYS   4           HB1      CYS   4  11.108   6.244  -6.876

  No H/Q in entry =           4
  In of MODEL    9
    1    HA   THR   5           HA       THR   5   8.373   6.762  -2.756
    2    HB   THR   5           HB       THR   5   5.764   6.707  -3.319
    3    HG1  THR   5           HG1      THR   5   5.814   7.497  -5.366
    4   HG23  THR   5          HG21      THR   5   5.495   8.497  -1.968
    5   HG22  THR   5          HG22      THR   5   6.731   9.448  -2.791
    6   HG21  THR   5          HG23      THR   5   7.202   8.186  -1.653
    7    H    THR   5           HN       THR   5   8.307   8.314  -5.104

  No H/Q in entry =           7
  In of MODEL    9
    1    HA   THR   6           HA       THR   6   7.756   2.989  -4.999
    2    HB   THR   6           HB       THR   6  10.653   2.538  -4.312
    3    HG1  THR   6           HG1      THR   6  11.252   3.690  -6.025
    4   HG22  THR   6          HG21      THR   6  10.054   1.621  -6.874
    5   HG21  THR   6          HG22      THR   6   8.703   1.117  -5.859
    6   HG23  THR   6          HG23      THR   6  10.350   0.657  -5.427
    7    H    THR   6           HN       THR   6   9.433   4.816  -3.415

  No H/Q in entry =           7
  In of MODEL    9
    1    HA3  GLY   7           HA2      GLY   7   8.402  -0.453  -2.073
    2    H    GLY   7           HN       GLY   7   7.483   0.818  -4.276
    3    HA2  GLY   7           HA1      GLY   7   7.202   0.643  -1.405

  No H/Q in entry =           3
  In of MODEL    9
    1    HA   PRO   8           HA       PRO   8   4.910  -3.206  -2.436
    2    HB2  PRO   8           HB2      PRO   8   3.155  -3.013  -0.378
    3    HG2  PRO   8           HG2      PRO   8   3.818  -0.969   0.503
    4    HD2  PRO   8           HD2      PRO   8   5.836  -0.004  -0.048
    5    HB3  PRO   8           HB1      PRO   8   4.764  -3.721  -0.199
    6    HG3  PRO   8           HG1      PRO   8   4.866  -2.060   1.427
    7    HD3  PRO   8           HD1      PRO   8   6.733  -1.517   0.191

  No H/Q in entry =           7
  In of MODEL    9
    1    HA   CYS   9           HA       CYS   9   1.278  -0.487  -3.176
    2    HB2  CYS   9           HB2      CYS   9   1.041   0.325  -0.779
    3    H    CYS   9           HN       CYS   9   3.624  -0.044  -1.473
    4    HB3  CYS   9           HB1      CYS   9   1.754   1.842  -1.316

  No H/Q in entry =           4
  In of MODEL    9
    1    HA   CYS  10           HA       CYS  10   3.220   2.312  -5.932
    2    HB2  CYS  10           HB2      CYS  10   5.986   2.095  -4.744
    3    H    CYS  10           HN       CYS  10   3.928   0.021  -4.274
    4    HB3  CYS  10           HB1      CYS  10   5.320   3.424  -5.686

  No H/Q in entry =           4
  In of MODEL    9
    1    HA   ARG  11           HA       ARG  11   6.277   0.043  -8.464
    2    HB2  ARG  11           HB2      ARG  11   3.758   1.000  -9.731
    3    HG2  ARG  11           HG2      ARG  11   4.996  -1.719  -9.361
    4    HD2  ARG  11           HD2      ARG  11   2.170  -1.287 -10.194
    5    HE   ARG  11           HE       ARG  11   2.400  -3.549 -10.208
    6   HH11  ARG  11          HH11      ARG  11   5.380  -2.154 -11.372
    7   HH12  ARG  11          HH12      ARG  11   6.106  -3.686 -11.722
    8   HH21  ARG  11          HH21      ARG  11   3.354  -5.565 -10.668
    9   HH22  ARG  11          HH22      ARG  11   4.956  -5.623 -11.323
   10    H    ARG  11           HN       ARG  11   5.038   2.533  -7.707
   11    HB3  ARG  11           HB1      ARG  11   4.991   0.317 -10.782
   12    HG3  ARG  11           HG1      ARG  11   3.646  -1.034  -8.454
   13    HD3  ARG  11           HD1      ARG  11   3.436  -1.209 -11.419

  No H/Q in entry =          13
  In of MODEL    9
    1    HA   GLN  12           HA       GLN  12   9.698   1.517 -10.754
    2    HB2  GLN  12           HB2      GLN  12   7.292   2.932 -11.893
    3    HG2  GLN  12           HG2      GLN  12   9.173   1.070 -13.299
    4   HE21  GLN  12          HE21      GLN  12   6.721  -0.246 -14.276
    5   HE22  GLN  12          HE22      GLN  12   6.087   0.806 -15.491
    6    H    GLN  12           HN       GLN  12   8.069   0.427  -9.609
    7    HB3  GLN  12           HB1      GLN  12   8.931   3.247 -12.445
    8    HG3  GLN  12           HG1      GLN  12   7.741   0.493 -12.448

  No H/Q in entry =           8
  In of MODEL    9
    1    HA   CYS  13           HA       CYS  13   9.083   5.425  -8.292
    2    HB2  CYS  13           HB2      CYS  13   9.403   6.331 -11.104
    3    H    CYS  13           HN       CYS  13   7.551   4.311 -10.476
    4    HB3  CYS  13           HB1      CYS  13   9.300   7.582  -9.871

  No H/Q in entry =           4
  In of MODEL    9
    1    HA   LYS  14           HA       LYS  14   5.077   7.159  -7.977
    2    HB2  LYS  14           HB2      LYS  14   4.883   6.617 -10.578
    3    HG2  LYS  14           HG2      LYS  14   2.271   7.354  -9.392
    4    HD2  LYS  14           HD2      LYS  14   2.990   9.384 -10.975
    5    HE2  LYS  14           HE2      LYS  14   2.111   7.747 -12.899
    6    HZ2  LYS  14           HZ1      LYS  14   0.863   9.599 -12.004
    7    HZ1  LYS  14           HZ2      LYS  14   0.463   8.708 -10.624
    8    HZ3  LYS  14           HZ3      LYS  14  -0.134   8.238 -12.135
    9    H    LYS  14           HN       LYS  14   6.324   4.660  -8.789
   10    HB3  LYS  14           HB1      LYS  14   3.571   5.592 -10.013
   11    HG3  LYS  14           HG1      LYS  14   3.653   8.395  -9.044
   12    HD3  LYS  14           HD1      LYS  14   3.986   8.110 -11.683
   13    HE3  LYS  14           HE1      LYS  14   1.670   6.787 -11.487

  No H/Q in entry =          13
  In of MODEL    9
    1    HA   LEU  15           HA       LEU  15   2.898   4.263  -5.583
    2    HB2  LEU  15           HB2      LEU  15   1.243   5.487  -4.096
    3    HG   LEU  15           HG       LEU  15   1.190   7.480  -5.913
    4   HD11  LEU  15          HD11      LEU  15   0.800   7.527  -2.941
    5   HD13  LEU  15          HD12      LEU  15  -0.413   7.429  -4.217
    6   HD12  LEU  15          HD13      LEU  15   0.458   8.938  -3.942
    7   HD23  LEU  15          HD21      LEU  15   2.919   8.729  -3.847
    8   HD22  LEU  15          HD22      LEU  15   2.655   9.183  -5.531
    9   HD21  LEU  15          HD23      LEU  15   3.698   7.816  -5.139
   10    H    LEU  15           HN       LEU  15   3.103   6.878  -6.845
   11    HB3  LEU  15           HB1      LEU  15   2.917   6.005  -4.014

  No H/Q in entry =          11
  In of MODEL    9
    1    HA   LYS  16           HA       LYS  16  -0.711   3.206  -7.715
    2    HB2  LYS  16           HB2      LYS  16  -0.634   1.509  -5.246
    3    HG2  LYS  16           HG2      LYS  16  -0.837   0.354  -7.949
    4    HD2  LYS  16           HD2      LYS  16   1.142  -0.208  -5.757
    5    HE2  LYS  16           HE2      LYS  16   1.441  -1.210  -8.038
    6    HZ2  LYS  16           HZ1      LYS  16  -0.103  -2.526  -8.975
    7    HZ1  LYS  16           HZ2      LYS  16  -1.184  -1.612  -8.050
    8    HZ3  LYS  16           HZ3      LYS  16  -0.672  -3.127  -7.499
    9    H    LYS  16           HN       LYS  16   0.874   3.171  -5.316
   10    HB3  LYS  16           HB1      LYS  16  -2.012   1.406  -6.333
   11    HG3  LYS  16           HG1      LYS  16   0.658   1.216  -7.577
   12    HD3  LYS  16           HD1      LYS  16  -0.491  -0.880  -5.751
   13    HE3  LYS  16           HE1      LYS  16   1.286  -2.371  -6.721

  No H/Q in entry =          13
  In of MODEL    9
    1    HA   PRO  17           HA       PRO  17  -4.206   5.662  -6.686
    2    HB2  PRO  17           HB2      PRO  17  -5.912   3.236  -6.987
    3    HG2  PRO  17           HG2      PRO  17  -5.132   2.739  -9.123
    4    HD2  PRO  17           HD2      PRO  17  -3.346   2.007  -7.861
    5    HB3  PRO  17           HB1      PRO  17  -6.064   4.821  -7.754
    6    HG3  PRO  17           HG1      PRO  17  -4.438   4.356  -9.342
    7    HD3  PRO  17           HD1      PRO  17  -2.492   3.245  -8.805

  No H/Q in entry =           7
  In of MODEL    9
    1    HA   ALA  18           HA       ALA  18  -4.835   5.038  -2.441
    2    HB1  ALA  18           HB1      ALA  18  -5.553   7.440  -2.917
    3    HB2  ALA  18           HB2      ALA  18  -6.213   6.670  -1.474
    4    HB3  ALA  18           HB3      ALA  18  -7.203   6.818  -2.926
    5    H    ALA  18           HN       ALA  18  -5.353   6.257  -4.902

  No H/Q in entry =           5
  In of MODEL    9
    1    HA3  GLY  19           HA2      GLY  19  -7.549   2.018  -0.796
    2    H    GLY  19           HN       GLY  19  -5.582   3.186  -1.658
    3    HA2  GLY  19           HA1      GLY  19  -8.361   2.419  -2.302

  No H/Q in entry =           3
  In of MODEL    9
    1    HA   THR  20           HA       THR  20  -5.796  -0.985  -3.808
    2    HB   THR  20           HB       THR  20  -3.005  -0.062  -3.125
    3    HG1  THR  20           HG1      THR  20  -4.740   0.779  -5.192
    4   HG22  THR  20          HG21      THR  20  -2.721  -1.032  -5.539
    5   HG21  THR  20          HG22      THR  20  -4.152  -1.963  -5.097
    6   HG23  THR  20          HG23      THR  20  -2.686  -2.084  -4.125
    7    H    THR  20           HN       THR  20  -5.041   1.352  -2.241

  No H/Q in entry =           7
  In of MODEL    9
    1    HA   THR  21           HA       THR  21  -5.037  -3.808  -0.634
    2    HB   THR  21           HB       THR  21  -3.971  -6.026  -1.677
    3    HG1  THR  21           HG1      THR  21  -3.844  -6.007  -3.767
    4   HG23  THR  21          HG21      THR  21  -6.097  -6.466  -1.121
    5   HG22  THR  21          HG22      THR  21  -6.376  -6.265  -2.851
    6   HG21  THR  21          HG23      THR  21  -6.693  -4.928  -1.746
    7    H    THR  21           HN       THR  21  -4.632  -3.057  -3.374

  No H/Q in entry =           7
  In of MODEL    9
    1    HA   CYS  22           HA       CYS  22  -0.688  -4.054   0.130
    2    HB2  CYS  22           HB2      CYS  22  -2.339  -3.299   2.480
    3    H    CYS  22           HN       CYS  22  -3.482  -4.728   0.772
    4    HB3  CYS  22           HB1      CYS  22  -0.671  -3.764   2.801

  No H/Q in entry =           4
  In of MODEL    9
    1    HA   TRP  23           HA       TRP  23   0.079  -8.468  -0.169
    2    HB2  TRP  23           HB2      TRP  23   1.710  -7.280   1.367
    3    HD1  TRP  23           HD1      TRP  23   2.403  -9.666  -0.140
    4    HE1  TRP  23           HE1      TRP  23   3.249 -11.877   0.870
    5    HE3  TRP  23           HE3      TRP  23   0.667  -9.097   4.636
    6    HZ2  TRP  23           HZ2      TRP  23   3.189 -13.205   3.360
    7    HZ3  TRP  23           HZ3      TRP  23   1.103 -10.884   6.270
    8    HH2  TRP  23           HH2      TRP  23   2.338 -12.895   5.643
    9    H    TRP  23           HN       TRP  23  -0.555  -6.310  -0.508
   10    HB3  TRP  23           HB1      TRP  23   0.623  -7.676   2.694

  No H/Q in entry =          10
  In of MODEL    9
    1    HA   ARG  24           HA       ARG  24  -3.243 -10.242   2.085
    2    HB2  ARG  24           HB2      ARG  24  -4.086  -9.903  -0.768
    3    HG2  ARG  24           HG2      ARG  24  -4.353  -8.248   1.326
    4    HD2  ARG  24           HD2      ARG  24  -6.506 -10.255   1.536
    5    HE   ARG  24           HE       ARG  24  -7.537  -7.796   2.445
    6   HH11  ARG  24          HH11      ARG  24  -7.066  -9.610  -0.499
    7   HH12  ARG  24          HH12      ARG  24  -8.412  -8.883  -1.310
    8   HH21  ARG  24          HH21      ARG  24  -9.308  -6.839   1.380
    9   HH22  ARG  24          HH22      ARG  24  -9.685  -7.309  -0.244
   10    H    ARG  24           HN       ARG  24  -1.617  -9.795  -0.331
   11    HB3  ARG  24           HB1      ARG  24  -5.038 -10.929   0.297
   12    HG3  ARG  24           HG1      ARG  24  -5.490  -8.314  -0.022
   13    HD3  ARG  24           HD1      ARG  24  -5.796  -9.219   2.773

  No H/Q in entry =          13
  In of MODEL    9
    1    HA   THR  25           HA       THR  25  -2.867 -14.473   0.824
    2    HB   THR  25           HB       THR  25  -1.852 -15.495   3.097
    3    HG1  THR  25           HG1      THR  25  -1.784 -13.907   4.484
    4   HG23  THR  25          HG21      THR  25   0.271 -15.200   2.248
    5   HG22  THR  25          HG22      THR  25  -0.107 -13.615   1.574
    6   HG21  THR  25          HG23      THR  25  -0.743 -15.072   0.810
    7    H    THR  25           HN       THR  25  -3.666 -12.331   2.645

  No H/Q in entry =           7
  In of MODEL    9
    1    HA   SER  26           HA       SER  26  -7.410 -14.273   2.586
    2    HB2  SER  26           HB2      SER  26  -6.368 -17.071   2.673
    3    HG   SER  26           HG       SER  26  -6.818 -15.637   0.266
    4    H    SER  26           HN       SER  26  -5.425 -13.482   1.809
    5    HB3  SER  26           HB1      SER  26  -7.915 -16.468   2.080

  No H/Q in entry =           5
  In of MODEL    9
    1    HA   VAL  27           HA       VAL  27  -6.175 -15.185   6.781
    2    HB   VAL  27           HB       VAL  27  -3.492 -13.821   6.575
    3    H    VAL  27           HN       VAL  27  -5.240 -13.601   4.478

  No H/Q in entry =           3
  In of MODEL    9
    1    HA   SER  28           HA       SER  28  -6.826 -10.784   7.693
    2    HB2  SER  28           HB2      SER  28  -4.435 -10.818   8.492
    3    HG   SER  28           HG       SER  28  -4.728  -8.910   9.379
    4    H    SER  28           HN       SER  28  -5.148 -12.014   5.636
    5    HB3  SER  28           HB1      SER  28  -4.028  -9.792   7.116

  No H/Q in entry =           5
  In of MODEL    9
    1    HA   SER  29           HA       SER  29  -6.737  -7.786   4.308
    2    HB2  SER  29           HB2      SER  29  -8.644  -6.092   5.134
    3    HG   SER  29           HG       SER  29  -9.217  -8.265   6.793
    4    H    SER  29           HN       SER  29  -6.425  -8.164   7.198
    5    HB3  SER  29           HB1      SER  29  -8.989  -7.770   4.715

  No H/Q in entry =           5
  In of MODEL    9
    1    HA   HIS  30           HA       HIS  30  -5.686  -3.509   5.346
    2    HB2  HIS  30           HB2      HIS  30  -3.694  -5.261   5.327
    3    HD1  HIS  30           HD1      HIS  30  -1.132  -3.946   5.549
    4    HD2  HIS  30           HD2      HIS  30  -4.648  -1.800   6.093
    5    HE1  HIS  30           HE1      HIS  30  -0.480  -1.913   6.877
    6    HE2  HIS  30           HE2      HIS  30  -2.639  -0.675   7.269
    7    H    HIS  30           HN       HIS  30  -6.410  -5.612   3.591
    8    HB3  HIS  30           HB1      HIS  30  -3.293  -4.438   3.823

  No H/Q in entry =           8
  In of MODEL    9
    1    HA   TYR  31           HA       TYR  31  -5.437  -1.625   1.343
    2    HB2  TYR  31           HB2      TYR  31  -7.388  -0.010   3.000
    3    HD1  TYR  31           HD1      TYR  31  -8.702  -1.631   4.094
    4    HD2  TYR  31           HD2      TYR  31  -7.806  -2.091  -0.039
    5    HE1  TYR  31           HE1      TYR  31 -10.325  -3.473   3.953
    6    HE2  TYR  31           HE2      TYR  31  -9.427  -3.934  -0.192
    7    HH   TYR  31           HH       TYR  31 -11.653  -4.638   2.321
    8    H    TYR  31           HN       TYR  31  -5.459  -1.562   4.276
    9    HB3  TYR  31           HB1      TYR  31  -7.254   0.014   1.245

  No H/Q in entry =           9
  In of MODEL    9
    1    HA   CYS  32           HA       CYS  32  -2.525   1.527   1.808
    2    HB2  CYS  32           HB2      CYS  32  -3.669   2.021  -0.946
    3    H    CYS  32           HN       CYS  32  -4.499   0.146   0.353
    4    HB3  CYS  32           HB1      CYS  32  -2.275   2.879  -0.300

  No H/Q in entry =           4
  In of MODEL    9
    1    HA   THR  33           HA       THR  33  -4.745   5.110   2.872
    2    HB   THR  33           HB       THR  33  -2.626   5.338   4.101
    3    HG1  THR  33           HG1      THR  33  -3.542   7.087   4.763
    4   HG23  THR  33          HG21      THR  33  -0.868   6.797   3.356
    5   HG22  THR  33          HG22      THR  33  -1.721   7.105   1.843
    6   HG21  THR  33          HG23      THR  33  -1.091   5.494   2.189
    7    H    THR  33           HN       THR  33  -2.321   3.983   1.704

  No H/Q in entry =           7
  In of MODEL    9
    1    HA3  GLY  34           HA2      GLY  34  -3.237   6.605  -1.841
    2    H    GLY  34           HN       GLY  34  -2.407   5.808   0.295
    3    HA2  GLY  34           HA1      GLY  34  -4.468   7.502  -0.966

  No H/Q in entry =           3
  In of MODEL    9
    1    HA   ARG  35           HA       ARG  35  -0.459   9.904  -1.327
    2    HB2  ARG  35           HB2      ARG  35  -1.664  10.118   1.042
    3    HG2  ARG  35           HG2      ARG  35  -0.424  12.197   1.490
    4    HD2  ARG  35           HD2      ARG  35  -1.073  13.353  -0.469
    5    HE   ARG  35           HE       ARG  35  -3.008  11.295  -0.876
    6   HH11  ARG  35          HH11      ARG  35  -1.863  13.657   1.424
    7   HH12  ARG  35          HH12      ARG  35  -3.386  13.788   2.237
    8   HH21  ARG  35          HH21      ARG  35  -5.013  11.466   0.192
    9   HH22  ARG  35          HH22      ARG  35  -5.174  12.544   1.538
   10    H    ARG  35           HN       ARG  35  -1.025   7.324  -0.200
   11    HB3  ARG  35           HB1      ARG  35  -0.025   9.839   1.615
   12    HG3  ARG  35           HG1      ARG  35   0.738  11.747   0.240
   13    HD3  ARG  35           HD1      ARG  35  -0.892  11.909  -1.466

  No H/Q in entry =          13
  In of MODEL    9
    1    HA   SER  36           HA       SER  36   3.259   7.573  -0.179
    2    HB2  SER  36           HB2      SER  36   4.035   6.864   2.186
    3    HG   SER  36           HG       SER  36   2.349   8.182   3.591
    4    H    SER  36           HN       SER  36   0.558   7.426   0.979
    5    HB3  SER  36           HB1      SER  36   3.596   8.552   1.929

  No H/Q in entry =           5
  In of MODEL    9
    1    HA   CYS  37           HA       CYS  37   3.016   3.294  -0.605
    2    HB2  CYS  37           HB2      CYS  37   5.713   4.068  -0.686
    3    H    CYS  37           HN       CYS  37   4.538   5.560   0.220
    4    HB3  CYS  37           HB1      CYS  37   5.678   2.610   0.298

  No H/Q in entry =           4
  In of MODEL    9
    1    HA   GLU  38           HA       GLU  38   4.162   2.008   3.876
    2    HB2  GLU  38           HB2      GLU  38   4.019   4.892   4.745
    3    HG2  GLU  38           HG2      GLU  38   6.185   2.900   5.315
    4    H    GLU  38           HN       GLU  38   4.288   4.428   2.436
    5    HB3  GLU  38           HB1      GLU  38   4.002   3.556   5.888
    6    HG3  GLU  38           HG1      GLU  38   6.189   3.903   3.865

  No H/Q in entry =           6
  In of MODEL    9
    1    HA   CYS  39           HA       CYS  39  -0.275   1.848   3.653
    2    HB2  CYS  39           HB2      CYS  39   0.880  -0.655   3.572
    3    H    CYS  39           HN       CYS  39   2.331   0.838   3.818
    4    HB3  CYS  39           HB1      CYS  39  -0.066  -0.715   5.055

  No H/Q in entry =           4
  In of MODEL    9
    1    HA   PRO  40           HA       PRO  40  -1.335   3.402   7.637
    2    HB2  PRO  40           HB2      PRO  40  -3.812   1.764   7.372
    3    HG2  PRO  40           HG2      PRO  40  -4.407   2.679   5.315
    4    HD2  PRO  40           HD2      PRO  40  -2.724   1.246   4.654
    5    HB3  PRO  40           HB1      PRO  40  -3.634   3.486   7.730
    6    HG3  PRO  40           HG1      PRO  40  -3.297   4.049   5.504
    7    HD3  PRO  40           HD1      PRO  40  -1.989   2.767   4.106

  No H/Q in entry =           7
  In of MODEL    9
    1    HA   SER  41           HA       SER  41  -0.926  -0.006  10.355
    2    HB2  SER  41           HB2      SER  41  -1.238   2.411  12.148
    3    HG   SER  41           HG       SER  41   1.076   1.011  11.292
    4    H    SER  41           HN       SER  41  -2.008   2.672   9.831
    5    HB3  SER  41           HB1      SER  41  -0.684   0.835  12.712

  No H/Q in entry =           5
  In of MODEL    9
    1    HA   TYR  42           HA       TYR  42  -5.120  -0.241  12.100
    2    HB2  TYR  42           HB2      TYR  42  -4.921   1.902  13.423
    3    HD1  TYR  42           HD1      TYR  42  -5.838   0.447  15.084
    4    HD2  TYR  42           HD2      TYR  42  -8.305   1.960  11.965
    5    HE1  TYR  42           HE1      TYR  42  -7.834  -0.323  16.297
    6    HE2  TYR  42           HE2      TYR  42 -10.307   1.194  13.170
    7    HH   TYR  42           HH       TYR  42 -10.170  -0.938  15.796
    8    H    TYR  42           HN       TYR  42  -3.741   2.016  10.800
    9    HB3  TYR  42           HB1      TYR  42  -5.945   2.664  12.210

  No H/Q in entry =           9
  In of MODEL    9
    1    HA   PRO  43           HA       PRO  43  -6.849  -0.150   7.813
    2    HB2  PRO  43           HB2      PRO  43  -7.885  -2.712   8.932
    3    HG2  PRO  43           HG2      PRO  43  -5.769  -3.637   9.233
    4    HD2  PRO  43           HD2      PRO  43  -5.832  -2.185  11.023
    5    HB3  PRO  43           HB1      PRO  43  -7.170  -2.382   7.350
    6    HG3  PRO  43           HG1      PRO  43  -5.000  -2.444   8.169
    7    HD3  PRO  43           HD1      PRO  43  -4.432  -1.484  10.186

  No H/Q in entry =           7
  In of MODEL    9
    1    HA3  GLY  44           HA2      GLY  44 -11.149   0.163   8.727
    2    H    GLY  44           HN       GLY  44  -8.686   0.903   7.421
    3    HA2  GLY  44           HA1      GLY  44 -10.555   1.747   9.201

  No H/Q in entry =           3
  In of MODEL    9
    1    HA   ASN  45           HA       ASN  45 -12.017   2.389   4.961
    2    HB2  ASN  45           HB2      ASN  45  -9.305   1.658   3.844
    3   HD21  ASN  45          HD21      ASN  45  -9.197   4.391   2.829
    4   HD22  ASN  45          HD22      ASN  45  -8.859   5.392   4.196
    5    H    ASN  45           HN       ASN  45 -10.036   0.468   5.996
    6    HB3  ASN  45           HB1      ASN  45 -10.509   2.589   2.957

  No H/Q in entry =           6
  In of MODEL    9
    1    HA3  GLY  46           HA2      GLY  46 -12.681  -1.111   2.220
    2    H    GLY  46           HN       GLY  46 -12.265   1.798   2.419
    3    HA2  GLY  46           HA1      GLY  46 -14.014  -0.014   1.891

  No H/Q in entry =           3
  In of MODEL   10
    1    H1   ALA   1           HT1      ALA   1  15.242  11.528  -7.594
    2    H2   ALA   1           HT3      ALA   1  13.810  11.080  -8.422
    3    H3   ALA   1           HT2      ALA   1  15.293  11.194  -9.277
    4    HA   ALA   1           HA       ALA   1  15.358  13.461  -9.137
    5    HB2  ALA   1           HB1      ALA   1  13.114  14.156 -10.000
    6    HB3  ALA   1           HB2      ALA   1  12.536  12.532  -9.630
    7    HB1  ALA   1           HB3      ALA   1  13.820  12.762 -10.818

  No H/Q in entry =           7
  In of MODEL   10
    1    HA   MET   2           HA       MET   2  12.814  14.923  -5.665
    2    HB2  MET   2           HB2      MET   2  10.770  15.057  -7.227
    3    H    MET   2           HN       MET   2  12.204  12.814  -7.621
    4    HG2  MET   2           HG2      MET   2   9.223  15.766  -5.332
    5    HE2  MET   2           HE1      MET   2  11.333  18.604  -3.596
    6    HB3  MET   2           HB1      MET   2  10.077  13.799  -6.213
    7    HE1  MET   2           HE2      MET   2   9.938  17.534  -3.461
    8    HE3  MET   2           HE3      MET   2   9.829  19.008  -4.423
    9    HG3  MET   2           HG1      MET   2  10.559  15.365  -4.254

  No H/Q in entry =           9
  In of MODEL   10
    1    HA   ASP   3           HA       ASP   3  12.146  10.856  -3.473
    2    HB2  ASP   3           HB2      ASP   3   9.437  12.122  -3.164
    3    H    ASP   3           HN       ASP   3  10.790  11.984  -5.738
    4    HB3  ASP   3           HB1      ASP   3   9.913  10.760  -2.155

  No H/Q in entry =           4
  In of MODEL   10
    1    HA   CYS   4           HA       CYS   4   9.723   7.485  -4.963
    2    HB2  CYS   4           HB2      CYS   4  12.264   7.617  -5.984
    3    H    CYS   4           HN       CYS   4  11.945   8.691  -3.466
    4    HB3  CYS   4           HB1      CYS   4  12.277   6.046  -5.189

  No H/Q in entry =           4
  In of MODEL   10
    1    HA   THR   5           HA       THR   5  10.003   5.054  -1.307
    2    HB   THR   5           HB       THR   5   7.792   4.706  -0.361
    3    HG1  THR   5           HG1      THR   5   6.665   4.282  -2.292
    4   HG23  THR   5          HG21      THR   5   8.384   6.826   0.259
    5   HG22  THR   5          HG22      THR   5   6.869   7.131  -0.591
    6   HG21  THR   5          HG23      THR   5   8.409   7.424  -1.399
    7    H    THR   5           HN       THR   5   8.620   6.293  -3.565

  No H/Q in entry =           7
  In of MODEL   10
    1    HA   THR   6           HA       THR   6   8.872   1.129  -2.994
    2    HB   THR   6           HB       THR   6  10.848  -0.211  -3.063
    3    HG1  THR   6           HG1      THR   6  11.523  -0.192  -0.960
    4   HG22  THR   6          HG21      THR   6  12.127   2.471  -2.974
    5   HG21  THR   6          HG22      THR   6  10.886   2.146  -4.184
    6   HG23  THR   6          HG23      THR   6  12.342   1.152  -4.125
    7    H    THR   6           HN       THR   6  10.002   2.865  -0.906

  No H/Q in entry =           7
  In of MODEL   10
    1    HA3  GLY   7           HA2      GLY   7   8.282  -1.831   0.245
    2    H    GLY   7           HN       GLY   7   7.706  -0.533  -2.242
    3    HA2  GLY   7           HA1      GLY   7   6.876  -0.785   0.361

  No H/Q in entry =           3
  In of MODEL   10
    1    HA   PRO   8           HA       PRO   8   5.299  -4.867  -1.057
    2    HB2  PRO   8           HB2      PRO   8   3.074  -4.872   0.465
    3    HG2  PRO   8           HG2      PRO   8   3.209  -2.742   1.379
    4    HD2  PRO   8           HD2      PRO   8   5.149  -1.517   1.299
    5    HB3  PRO   8           HB1      PRO   8   4.652  -5.351   1.103
    6    HG3  PRO   8           HG1      PRO   8   4.098  -3.664   2.606
    7    HD3  PRO   8           HD1      PRO   8   6.134  -2.860   1.912

  No H/Q in entry =           7
  In of MODEL   10
    1    HA   CYS   9           HA       CYS   9   1.510  -2.566  -2.542
    2    HB2  CYS   9           HB2      CYS   9   0.848  -1.252  -0.586
    3    H    CYS   9           HN       CYS   9   3.470  -1.863  -0.544
    4    HB3  CYS   9           HB1      CYS   9   1.962   0.029  -1.052

  No H/Q in entry =           4
  In of MODEL   10
    1    HA   CYS  10           HA       CYS  10   3.285   1.120  -4.958
    2    HB2  CYS  10           HB2      CYS  10   5.055   2.676  -4.531
    3    H    CYS  10           HN       CYS  10   3.427   0.420  -2.286
    4    HB3  CYS  10           HB1      CYS  10   4.080   2.573  -3.070

  No H/Q in entry =           4
  In of MODEL   10
    1    HA   ARG  11           HA       ARG  11   5.895  -1.614  -7.035
    2    HB2  ARG  11           HB2      ARG  11   5.003   0.287  -8.749
    3    HG2  ARG  11           HG2      ARG  11   7.074  -1.414  -9.958
    4    HD2  ARG  11           HD2      ARG  11   4.181  -1.707 -10.501
    5    HE   ARG  11           HE       ARG  11   5.185  -2.551 -12.355
    6   HH11  ARG  11          HH11      ARG  11   7.053   0.193 -11.280
    7   HH12  ARG  11          HH12      ARG  11   8.175   0.104 -12.596
    8   HH21  ARG  11          HH21      ARG  11   6.659  -2.671 -14.087
    9   HH22  ARG  11          HH22      ARG  11   7.951  -1.522 -14.190
   10    H    ARG  11           HN       ARG  11   4.705   0.932  -6.717
   11    HB3  ARG  11           HB1      ARG  11   6.739   0.535  -8.880
   12    HG3  ARG  11           HG1      ARG  11   5.827  -2.261  -9.040
   13    HD3  ARG  11           HD1      ARG  11   4.910  -0.152 -10.900

  No H/Q in entry =          13
  In of MODEL   10
    1    HA   GLN  12           HA       GLN  12  10.133  -1.157  -6.292
    2    HB2  GLN  12           HB2      GLN  12  10.298  -2.187  -8.667
    3    HG2  GLN  12           HG2      GLN  12  12.426  -1.097  -6.977
    4   HE21  GLN  12          HE21      GLN  12  14.487  -0.684  -7.517
    5   HE22  GLN  12          HE22      GLN  12  15.082  -0.617  -9.137
    6    H    GLN  12           HN       GLN  12   8.255  -1.248  -8.360
    7    HB3  GLN  12           HB1      GLN  12  10.868  -0.595  -9.150
    8    HG3  GLN  12           HG1      GLN  12  12.225  -2.711  -7.658

  No H/Q in entry =           8
  In of MODEL   10
    1    HA   CYS  13           HA       CYS  13  10.034   3.385  -6.715
    2    HB2  CYS  13           HB2      CYS  13  11.732   2.585  -8.657
    3    H    CYS  13           HN       CYS  13   8.909   1.346  -8.398
    4    HB3  CYS  13           HB1      CYS  13  10.818   3.802  -9.541

  No H/Q in entry =           4
  In of MODEL   10
    1    HA   LYS  14           HA       LYS  14   6.465   5.103  -8.586
    2    HB2  LYS  14           HB2      LYS  14   6.638   3.108 -10.320
    3    HG2  LYS  14           HG2      LYS  14   5.361   5.445 -10.421
    4    HD2  LYS  14           HD2      LYS  14   3.133   3.500 -10.923
    5    HE2  LYS  14           HE2      LYS  14   2.738   6.325 -10.128
    6    HZ1  LYS  14           HZ1      LYS  14   1.494   4.590 -12.192
    7    HZ3  LYS  14           HZ2      LYS  14   0.992   6.155 -11.795
    8    HZ2  LYS  14           HZ3      LYS  14   0.861   4.912 -10.656
    9    H    LYS  14           HN       LYS  14   7.410   2.566  -7.487
   10    HB3  LYS  14           HB1      LYS  14   5.126   2.621  -9.566
   11    HG3  LYS  14           HG1      LYS  14   5.228   4.220 -11.684
   12    HD3  LYS  14           HD1      LYS  14   3.340   4.275  -9.351
   13    HE3  LYS  14           HE1      LYS  14   3.393   6.027 -11.738

  No H/Q in entry =          13
  In of MODEL   10
    1    HA   LEU  15           HA       LEU  15   4.031   4.415  -4.985
    2    HB2  LEU  15           HB2      LEU  15   4.402   7.038  -5.438
    3    HG   LEU  15           HG       LEU  15   2.226   6.075  -3.580
    4   HD13  LEU  15          HD11      LEU  15   3.907   4.824  -2.744
    5   HD12  LEU  15          HD12      LEU  15   4.384   6.354  -2.009
    6   HD11  LEU  15          HD13      LEU  15   5.161   5.809  -3.495
    7   HD21  LEU  15          HD21      LEU  15   2.485   8.560  -4.055
    8   HD23  LEU  15          HD22      LEU  15   4.047   8.440  -3.246
    9   HD22  LEU  15          HD23      LEU  15   2.567   8.058  -2.366
   10    H    LEU  15           HN       LEU  15   5.169   5.894  -7.074
   11    HB3  LEU  15           HB1      LEU  15   2.691   6.928  -5.802

  No H/Q in entry =          11
  In of MODEL   10
    1    HA   LYS  16           HA       LYS  16   0.533   2.843  -7.029
    2    HB2  LYS  16           HB2      LYS  16   0.586   1.932  -4.192
    3    HG2  LYS  16           HG2      LYS  16   1.576   0.854  -6.466
    4    HD2  LYS  16           HD2      LYS  16  -1.196  -0.217  -6.056
    5    HE2  LYS  16           HE2      LYS  16   0.991  -1.631  -7.563
    6    HZ1  LYS  16           HZ1      LYS  16  -1.554  -1.897  -7.998
    7    HZ3  LYS  16           HZ2      LYS  16  -1.489  -2.878  -6.622
    8    HZ2  LYS  16           HZ3      LYS  16  -0.541  -3.252  -7.972
    9    H    LYS  16           HN       LYS  16   2.087   3.456  -4.685
   10    HB3  LYS  16           HB1      LYS  16  -0.895   1.684  -5.107
   11    HG3  LYS  16           HG1      LYS  16   1.152  -0.067  -5.022
   12    HD3  LYS  16           HD1      LYS  16  -0.416   0.287  -7.557
   13    HE3  LYS  16           HE1      LYS  16   0.512  -2.064  -5.922

  No H/Q in entry =          13
  In of MODEL   10
    1    HA   PRO  17           HA       PRO  17  -2.758   5.739  -6.644
    2    HB2  PRO  17           HB2      PRO  17  -4.989   4.214  -7.024
    3    HG2  PRO  17           HG2      PRO  17  -4.043   2.107  -6.801
    4    HD2  PRO  17           HD2      PRO  17  -1.760   1.774  -6.900
    5    HB3  PRO  17           HB1      PRO  17  -3.891   4.676  -8.330
    6    HG3  PRO  17           HG1      PRO  17  -3.817   2.363  -8.542
    7    HD3  PRO  17           HD1      PRO  17  -1.568   2.838  -8.308

  No H/Q in entry =           7
  In of MODEL   10
    1    HA   ALA  18           HA       ALA  18  -3.852   5.576  -2.422
    2    HB3  ALA  18           HB1      ALA  18  -5.610   7.862  -3.239
    3    HB1  ALA  18           HB2      ALA  18  -3.859   8.050  -3.131
    4    HB2  ALA  18           HB3      ALA  18  -4.785   7.585  -1.704
    5    H    ALA  18           HN       ALA  18  -3.746   6.704  -4.981

  No H/Q in entry =           5
  In of MODEL   10
    1    HA3  GLY  19           HA2      GLY  19  -7.310   3.247  -1.137
    2    H    GLY  19           HN       GLY  19  -5.086   3.905  -1.853
    3    HA2  GLY  19           HA1      GLY  19  -7.939   3.988  -2.601

  No H/Q in entry =           3
  In of MODEL   10
    1    HA   THR  20           HA       THR  20  -6.618  -0.171  -3.869
    2    HB   THR  20           HB       THR  20  -5.056   1.141  -5.329
    3    HG1  THR  20           HG1      THR  20  -4.251  -1.555  -5.021
    4   HG23  THR  20          HG21      THR  20  -2.696   0.824  -5.197
    5   HG22  THR  20          HG22      THR  20  -2.867  -0.240  -3.800
    6   HG21  THR  20          HG23      THR  20  -3.257   1.474  -3.656
    7    H    THR  20           HN       THR  20  -5.113   1.894  -2.405

  No H/Q in entry =           7
  In of MODEL   10
    1    HA   THR  21           HA       THR  21  -5.211  -3.140  -1.105
    2    HB   THR  21           HB       THR  21  -4.139  -5.224  -2.409
    3    HG1  THR  21           HG1      THR  21  -5.092  -5.293  -4.495
    4   HG23  THR  21          HG21      THR  21  -6.087  -5.813  -1.428
    5   HG22  THR  21          HG22      THR  21  -6.643  -5.746  -3.100
    6   HG21  THR  21          HG23      THR  21  -6.945  -4.389  -2.016
    7    H    THR  21           HN       THR  21  -5.570  -2.341  -3.762

  No H/Q in entry =           7
  In of MODEL   10
    1    HA   CYS  22           HA       CYS  22  -0.878  -2.594  -0.876
    2    HB2  CYS  22           HB2      CYS  22  -2.147  -2.783   1.806
    3    H    CYS  22           HN       CYS  22  -3.430  -3.652   0.116
    4    HB3  CYS  22           HB1      CYS  22  -0.394  -2.933   1.737

  No H/Q in entry =           4
  In of MODEL   10
    1    HA   TRP  23           HA       TRP  23  -0.598  -7.236  -0.557
    2    HB2  TRP  23           HB2      TRP  23   1.044  -6.292   1.021
    3    HD1  TRP  23           HD1      TRP  23   1.713  -8.623  -0.545
    4    HE1  TRP  23           HE1      TRP  23   2.521 -10.885   0.379
    5    HE3  TRP  23           HE3      TRP  23  -0.029  -8.212   4.244
    6    HZ2  TRP  23           HZ2      TRP  23   2.433 -12.307   2.816
    7    HZ3  TRP  23           HZ3      TRP  23   0.375 -10.068   5.809
    8    HH2  TRP  23           HH2      TRP  23   1.580 -12.072   5.108
    9    H    TRP  23           HN       TRP  23  -2.353  -5.408   0.652
   10    HB3  TRP  23           HB1      TRP  23  -0.015  -6.703   2.365

  No H/Q in entry =          10
  In of MODEL   10
    1    HA   ARG  24           HA       ARG  24  -4.551  -8.658   1.348
    2    HB2  ARG  24           HB2      ARG  24  -5.891  -9.774  -0.457
    3    HG2  ARG  24           HG2      ARG  24  -4.010  -8.419  -2.368
    4    HD2  ARG  24           HD2      ARG  24  -6.384 -10.243  -2.670
    5    HE   ARG  24           HE       ARG  24  -5.241 -10.986  -4.511
    6   HH11  ARG  24          HH11      ARG  24  -4.819  -7.534  -4.228
    7   HH12  ARG  24          HH12      ARG  24  -4.054  -7.374  -5.773
    8   HH21  ARG  24          HH21      ARG  24  -4.234 -10.779  -6.543
    9   HH22  ARG  24          HH22      ARG  24  -3.722  -9.216  -7.088
   10    H    ARG  24           HN       ARG  24  -3.027  -7.642  -0.768
   11    HB3  ARG  24           HB1      ARG  24  -5.646  -8.048  -0.686
   12    HG3  ARG  24           HG1      ARG  24  -3.953 -10.147  -2.014
   13    HD3  ARG  24           HD1      ARG  24  -6.210  -8.589  -3.255

  No H/Q in entry =          13
  In of MODEL   10
    1    HA   THR  25           HA       THR  25  -2.784 -12.674   1.399
    2    HB   THR  25           HB       THR  25  -2.947 -13.300   4.000
    3    HG1  THR  25           HG1      THR  25  -3.032 -10.468   3.973
    4   HG22  THR  25          HG21      THR  25  -1.045 -11.146   3.146
    5   HG21  THR  25          HG22      THR  25  -0.879 -12.827   2.638
    6   HG23  THR  25          HG23      THR  25  -0.803 -12.411   4.350
    7    H    THR  25           HN       THR  25  -4.438 -10.485   2.467

  No H/Q in entry =           7
  In of MODEL   10
    1    HA   SER  26           HA       SER  26  -7.243 -13.965   1.688
    2    HB2  SER  26           HB2      SER  26  -6.105 -14.510   4.381
    3    HG   SER  26           HG       SER  26  -5.484 -15.719   2.549
    4    H    SER  26           HN       SER  26  -5.855 -11.842   2.859
    5    HB3  SER  26           HB1      SER  26  -7.765 -15.029   4.092

  No H/Q in entry =           5
  In of MODEL   10
    1    HA   VAL  27           HA       VAL  27  -9.706 -10.797   3.843
    2    HB   VAL  27           HB       VAL  27 -10.139 -12.615   5.443
    3    H    VAL  27           HN       VAL  27  -7.044 -11.781   4.440

  No H/Q in entry =           3
  In of MODEL   10
    1    HA   SER  28           HA       SER  28  -7.346  -8.039   6.994
    2    HB2  SER  28           HB2      SER  28  -5.713  -9.529   8.012
    3    HG   SER  28           HG       SER  28  -3.777  -7.939   7.580
    4    H    SER  28           HN       SER  28  -6.916 -10.621   6.010
    5    HB3  SER  28           HB1      SER  28  -4.741  -9.514   6.541

  No H/Q in entry =           5
  In of MODEL   10
    1    HA   SER  29           HA       SER  29  -5.617  -5.770   3.646
    2    HB2  SER  29           HB2      SER  29  -8.329  -4.505   4.093
    3    HG   SER  29           HG       SER  29  -7.972  -6.349   2.069
    4    H    SER  29           HN       SER  29  -7.223  -6.096   6.089
    5    HB3  SER  29           HB1      SER  29  -7.341  -4.409   2.636

  No H/Q in entry =           5
  In of MODEL   10
    1    HA   HIS  30           HA       HIS  30  -4.600  -2.084   5.791
    2    HB2  HIS  30           HB2      HIS  30  -2.315  -2.799   3.951
    3    HD1  HIS  30           HD1      HIS  30  -0.160  -3.281   5.770
    4    HD2  HIS  30           HD2      HIS  30  -4.057  -4.173   6.902
    5    HE1  HIS  30           HE1      HIS  30   0.048  -4.946   7.643
    6    HE2  HIS  30           HE2      HIS  30  -2.324  -5.536   8.253
    7    H    HIS  30           HN       HIS  30  -4.482  -3.887   3.467
    8    HB3  HIS  30           HB1      HIS  30  -2.241  -1.474   5.108

  No H/Q in entry =           8
  In of MODEL   10
    1    HA   TYR  31           HA       TYR  31  -5.178  -0.767   0.692
    2    HB2  TYR  31           HB2      TYR  31  -6.209   0.889   3.004
    3    HD1  TYR  31           HD1      TYR  31  -8.273   0.362   3.964
    4    HD2  TYR  31           HD2      TYR  31  -7.049  -1.653   0.422
    5    HE1  TYR  31           HE1      TYR  31 -10.191  -1.162   4.174
    6    HE2  TYR  31           HE2      TYR  31  -8.965  -3.181   0.622
    7    HH   TYR  31           HH       TYR  31 -11.496  -2.790   1.993
    8    H    TYR  31           HN       TYR  31  -4.620  -2.270   2.304
    9    HB3  TYR  31           HB1      TYR  31  -6.590   1.142   1.304

  No H/Q in entry =           9
  In of MODEL   10
    1    HA   CYS  32           HA       CYS  32  -1.708   1.845   0.752
    2    HB2  CYS  32           HB2      CYS  32  -2.502   1.158  -1.831
    3    H    CYS  32           HN       CYS  32  -4.080   0.752  -0.438
    4    HB3  CYS  32           HB1      CYS  32  -2.349   2.911  -1.876

  No H/Q in entry =           4
  In of MODEL   10
    1    HA   THR  33           HA       THR  33  -3.449   5.690   1.747
    2    HB   THR  33           HB       THR  33  -1.839   7.152   2.778
    3    HG1  THR  33           HG1      THR  33   0.159   5.547   1.565
    4   HG22  THR  33          HG21      THR  33  -0.320   5.246   3.928
    5   HG21  THR  33          HG22      THR  33  -1.659   4.275   3.316
    6   HG23  THR  33          HG23      THR  33  -1.975   5.624   4.408
    7    H    THR  33           HN       THR  33  -1.217   3.968   1.178

  No H/Q in entry =           7
  In of MODEL   10
    1    HA3  GLY  34           HA2      GLY  34  -1.032   6.555  -2.750
    2    H    GLY  34           HN       GLY  34  -0.728   5.695  -0.521
    3    HA2  GLY  34           HA1      GLY  34  -2.180   7.715  -2.099

  No H/Q in entry =           3
  In of MODEL   10
    1    HA   ARG  35           HA       ARG  35   1.290  10.243  -1.201
    2    HB2  ARG  35           HB2      ARG  35  -0.265  10.519   0.974
    3    HG2  ARG  35           HG2      ARG  35   2.115  12.001   0.048
    4    HD2  ARG  35           HD2      ARG  35   0.754  12.969   2.518
    5    HE   ARG  35           HE       ARG  35   2.308  14.578   2.126
    6   HH11  ARG  35          HH11      ARG  35   3.684  11.508   1.196
    7   HH12  ARG  35          HH12      ARG  35   5.225  12.182   0.785
    8   HH21  ARG  35          HH21      ARG  35   4.334  15.465   1.585
    9   HH22  ARG  35          HH22      ARG  35   5.595  14.428   1.006
   10    H    ARG  35           HN       ARG  35  -0.352   8.281   0.195
   11    HB3  ARG  35           HB1      ARG  35   1.257  10.131   1.764
   12    HG3  ARG  35           HG1      ARG  35   0.452  12.545   0.276
   13    HD3  ARG  35           HD1      ARG  35   2.081  11.817   2.664

  No H/Q in entry =          13
  In of MODEL   10
    1    HA   SER  36           HA       SER  36   4.439   7.277   0.142
    2    HB2  SER  36           HB2      SER  36   4.249   8.429   2.357
    3    HG   SER  36           HG       SER  36   5.744   7.047   3.391
    4    H    SER  36           HN       SER  36   1.598   7.374   0.759
    5    HB3  SER  36           HB1      SER  36   3.468   6.982   2.993

  No H/Q in entry =           5
  In of MODEL   10
    1    HA   CYS  37           HA       CYS  37   3.633   3.057  -0.195
    2    HB2  CYS  37           HB2      CYS  37   6.239   3.409  -0.544
    3    H    CYS  37           HN       CYS  37   5.389   5.149   0.625
    4    HB3  CYS  37           HB1      CYS  37   6.330   2.455   0.932

  No H/Q in entry =           4
  In of MODEL   10
    1    HA   GLU  38           HA       GLU  38   4.530   1.925   4.450
    2    HB2  GLU  38           HB2      GLU  38   4.237   3.477   6.335
    3    HG2  GLU  38           HG2      GLU  38   4.621   5.985   5.286
    4    H    GLU  38           HN       GLU  38   4.824   4.188   2.867
    5    HB3  GLU  38           HB1      GLU  38   5.552   3.974   5.279
    6    HG3  GLU  38           HG1      GLU  38   3.373   5.302   4.245

  No H/Q in entry =           6
  In of MODEL   10
    1    HA   CYS  39           HA       CYS  39   0.116   1.749   3.890
    2    HB2  CYS  39           HB2      CYS  39   1.104  -1.094   4.182
    3    H    CYS  39           HN       CYS  39   2.763   0.665   4.098
    4    HB3  CYS  39           HB1      CYS  39  -0.579  -0.654   3.917

  No H/Q in entry =           4
  In of MODEL   10
    1    HA   PRO  40           HA       PRO  40  -1.166   2.073   8.088
    2    HB2  PRO  40           HB2      PRO  40  -3.551   0.483   7.269
    3    HG2  PRO  40           HG2      PRO  40  -4.122   1.912   5.522
    4    HD2  PRO  40           HD2      PRO  40  -2.351   0.786   4.564
    5    HB3  PRO  40           HB1      PRO  40  -3.468   2.042   8.098
    6    HG3  PRO  40           HG1      PRO  40  -3.086   3.216   6.133
    7    HD3  PRO  40           HD1      PRO  40  -1.671   2.424   4.496

  No H/Q in entry =           7
  In of MODEL   10
    1    HA   SER  41           HA       SER  41  -1.242  -2.140   9.622
    2    HB2  SER  41           HB2      SER  41   0.373  -0.436  10.853
    3    HG   SER  41           HG       SER  41  -0.213  -2.863  12.173
    4    H    SER  41           HN       SER  41  -2.142   0.643   9.892
    5    HB3  SER  41           HB1      SER  41  -0.729  -0.719  12.201

  No H/Q in entry =           5
  In of MODEL   10
    1    HA   TYR  42           HA       TYR  42  -5.069  -2.614  11.671
    2    HB2  TYR  42           HB2      TYR  42  -4.896  -0.346  12.638
    3    HD1  TYR  42           HD1      TYR  42  -5.979  -1.642  14.385
    4    HD2  TYR  42           HD2      TYR  42  -8.211  -0.100  11.108
    5    HE1  TYR  42           HE1      TYR  42  -8.066  -2.081  15.608
    6    HE2  TYR  42           HE2      TYR  42 -10.305  -0.533  12.323
    7    HH   TYR  42           HH       TYR  42 -10.667  -0.845  15.314
    8    H    TYR  42           HN       TYR  42  -3.893  -1.036   9.537
    9    HB3  TYR  42           HB1      TYR  42  -5.819   0.292  11.281

  No H/Q in entry =           9
  In of MODEL   10
    1    HA   PRO  43           HA       PRO  43  -7.752  -3.627   8.288
    2    HB2  PRO  43           HB2      PRO  43  -9.749  -4.840   9.663
    3    HG2  PRO  43           HG2      PRO  43  -9.198  -4.165  11.816
    4    HD2  PRO  43           HD2      PRO  43  -7.123  -3.303  12.326
    5    HB3  PRO  43           HB1      PRO  43  -8.175  -5.599   9.394
    6    HG3  PRO  43           HG1      PRO  43  -8.276  -5.676  11.717
    7    HD3  PRO  43           HD1      PRO  43  -6.267  -4.581  11.440

  No H/Q in entry =           7
  In of MODEL   10
    1    HA3  GLY  44           HA2      GLY  44 -10.484  -0.247   8.120
    2    H    GLY  44           HN       GLY  44  -9.402  -2.671   7.210
    3    HA2  GLY  44           HA1      GLY  44 -11.061  -1.159   6.733

  No H/Q in entry =           3
  In of MODEL   10
    1    HA   ASN  45           HA       ASN  45 -14.344  -2.119   9.464
    2    HB2  ASN  45           HB2      ASN  45 -14.188   0.551   9.674
    3   HD21  ASN  45          HD21      ASN  45 -17.429  -0.780   9.680
    4   HD22  ASN  45          HD22      ASN  45 -17.552  -0.967  11.393
    5    H    ASN  45           HN       ASN  45 -13.203  -0.500   7.287
    6    HB3  ASN  45           HB1      ASN  45 -15.693   0.435   8.767

  No H/Q in entry =           6
  In of MODEL   10
    1    HA3  GLY  46           HA2      GLY  46 -16.387  -1.523   4.873
    2    H    GLY  46           HN       GLY  46 -15.562  -0.041   6.828
    3    HA2  GLY  46           HA1      GLY  46 -17.427  -2.200   6.116

  No H/Q in entry =           3
  In of MODEL   11
    1    H1   ALA   1           HT2      ALA   1  15.431  11.665   2.920
    2    H2   ALA   1           HT1      ALA   1  15.940  10.151   2.293
    3    H3   ALA   1           HT3      ALA   1  17.054  11.448   2.408
    4    HA   ALA   1           HA       ALA   1  15.915  12.677   0.789
    5    HB1  ALA   1           HB1      ALA   1  16.037   9.925  -0.371
    6    HB3  ALA   1           HB2      ALA   1  17.504  10.705   0.222
    7    HB2  ALA   1           HB3      ALA   1  16.563  11.458  -1.065

  No H/Q in entry =           7
  In of MODEL   11
    1    HA   MET   2           HA       MET   2  11.869  11.105  -0.240
    2    HB2  MET   2           HB2      MET   2  10.508  13.157  -0.705
    3    H    MET   2           HN       MET   2  14.272  12.631  -0.962
    4    HG2  MET   2           HG2      MET   2  13.187  14.323  -1.059
    5    HE1  MET   2           HE1      MET   2   9.812  15.633  -0.525
    6    HB3  MET   2           HB1      MET   2  11.498  13.255   0.744
    7    HE3  MET   2           HE2      MET   2  10.280  17.325  -0.351
    8    HE2  MET   2           HE3      MET   2   9.818  16.387   1.069
    9    HG3  MET   2           HG1      MET   2  11.639  14.792  -1.758

  No H/Q in entry =           9
  In of MODEL   11
    1    HA   ASP   3           HA       ASP   3  12.405  11.481  -4.762
    2    HB2  ASP   3           HB2      ASP   3  15.020  11.356  -4.299
    3    H    ASP   3           HN       ASP   3  13.765  10.623  -2.323
    4    HB3  ASP   3           HB1      ASP   3  14.791   9.691  -4.827

  No H/Q in entry =           4
  In of MODEL   11
    1    HA   CYS   4           HA       CYS   4   9.410   8.500  -5.870
    2    HB2  CYS   4           HB2      CYS   4  11.692   7.970  -7.074
    3    H    CYS   4           HN       CYS   4  10.716  10.285  -5.343
    4    HB3  CYS   4           HB1      CYS   4  11.790   6.685  -5.875

  No H/Q in entry =           4
  In of MODEL   11
    1    HA   THR   5           HA       THR   5   8.983   7.086  -1.695
    2    HB   THR   5           HB       THR   5   6.551   6.188  -1.570
    3    HG1  THR   5           HG1      THR   5   6.415   6.167  -3.945
    4   HG23  THR   5          HG21      THR   5   5.600   8.394  -1.346
    5   HG22  THR   5          HG22      THR   5   6.964   9.096  -2.215
    6   HG21  THR   5          HG23      THR   5   7.213   8.352  -0.636
    7    H    THR   5           HN       THR   5   8.133   7.944  -4.222

  No H/Q in entry =           7
  In of MODEL   11
    1    HA   THR   6           HA       THR   6   8.575   2.684  -2.472
    2    HB   THR   6           HB       THR   6  10.721   2.612  -0.427
    3    HG1  THR   6           HG1      THR   6  11.382   4.497  -1.196
    4   HG23  THR   6          HG21      THR   6  10.636   0.681  -1.712
    5   HG22  THR   6          HG22      THR   6  11.943   1.617  -2.439
    6   HG21  THR   6          HG23      THR   6  10.356   1.574  -3.207
    7    H    THR   6           HN       THR   6   8.607   4.982  -0.682

  No H/Q in entry =           7
  In of MODEL   11
    1    HA3  GLY   7           HA2      GLY   7   7.664   0.217   1.163
    2    H    GLY   7           HN       GLY   7   7.763   0.843  -1.545
    3    HA2  GLY   7           HA1      GLY   7   6.210   1.137   0.807

  No H/Q in entry =           3
  In of MODEL   11
    1    HA   PRO   8           HA       PRO   8   5.319  -3.340  -0.062
    2    HB2  PRO   8           HB2      PRO   8   2.876  -3.357   1.120
    3    HG2  PRO   8           HG2      PRO   8   2.756  -1.134   1.780
    4    HD2  PRO   8           HD2      PRO   8   4.621   0.219   1.850
    5    HB3  PRO   8           HB1      PRO   8   4.375  -3.641   2.012
    6    HG3  PRO   8           HG1      PRO   8   3.520  -1.844   3.215
    7    HD3  PRO   8           HD1      PRO   8   5.601  -1.011   2.674

  No H/Q in entry =           7
  In of MODEL   11
    1    HA   CYS   9           HA       CYS   9   1.839  -1.672  -2.578
    2    HB2  CYS   9           HB2      CYS   9   0.612  -0.526  -0.655
    3    H    CYS   9           HN       CYS   9   3.242  -0.482  -0.300
    4    HB3  CYS   9           HB1      CYS   9   1.242   0.990  -1.290

  No H/Q in entry =           4
  In of MODEL   11
    1    HA   CYS  10           HA       CYS  10   4.312   1.361  -4.743
    2    HB2  CYS  10           HB2      CYS  10   6.023   1.169  -2.640
    3    H    CYS  10           HN       CYS  10   4.560  -0.943  -2.923
    4    HB3  CYS  10           HB1      CYS  10   7.023   0.515  -3.933

  No H/Q in entry =           4
  In of MODEL   11
    1    HA   ARG  11           HA       ARG  11   5.531  -1.653  -7.678
    2    HB2  ARG  11           HB2      ARG  11   3.311  -0.332  -8.438
    3    HG2  ARG  11           HG2      ARG  11   4.958  -2.380  -9.785
    4    HD2  ARG  11           HD2      ARG  11   2.815  -0.785 -11.152
    5    HE   ARG  11           HE       ARG  11   2.035  -2.769 -11.953
    6   HH11  ARG  11          HH11      ARG  11   5.498  -3.015 -11.606
    7   HH12  ARG  11          HH12      ARG  11   5.586  -4.582 -12.337
    8   HH21  ARG  11          HH21      ARG  11   2.148  -4.831 -12.914
    9   HH22  ARG  11          HH22      ARG  11   3.684  -5.613 -13.080
   10    H    ARG  11           HN       ARG  11   4.591   0.995  -6.845
   11    HB3  ARG  11           HB1      ARG  11   4.425   0.243  -9.671
   12    HG3  ARG  11           HG1      ARG  11   3.275  -2.439  -9.254
   13    HD3  ARG  11           HD1      ARG  11   4.415  -1.220 -11.751

  No H/Q in entry =          13
  In of MODEL   11
    1    HA   GLN  12           HA       GLN  12   9.818  -0.992  -8.423
    2    HB2  GLN  12           HB2      GLN  12   8.053  -0.251 -10.680
    3    HG2  GLN  12           HG2      GLN  12  10.212  -1.495 -11.738
    4   HE21  GLN  12          HE21      GLN  12   8.205  -1.611 -12.975
    5   HE22  GLN  12          HE22      GLN  12   7.171  -2.977 -12.755
    6    H    GLN  12           HN       GLN  12   7.739  -1.473  -7.642
    7    HB3  GLN  12           HB1      GLN  12   9.679   0.416 -10.722
    8    HG3  GLN  12           HG1      GLN  12  10.184  -2.181 -10.115

  No H/Q in entry =           8
  In of MODEL   11
    1    HA   CYS  13           HA       CYS  13   9.342   3.543  -7.620
    2    HB2  CYS  13           HB2      CYS  13  10.935   3.178  -9.764
    3    H    CYS  13           HN       CYS  13   8.249   1.887  -9.745
    4    HB3  CYS  13           HB1      CYS  13   9.968   4.530 -10.344

  No H/Q in entry =           4
  In of MODEL   11
    1    HA   LYS  14           HA       LYS  14   5.676   5.582  -8.851
    2    HB2  LYS  14           HB2      LYS  14   5.750   3.923 -10.957
    3    HG2  LYS  14           HG2      LYS  14   4.742   6.314 -10.692
    4    HD2  LYS  14           HD2      LYS  14   2.228   4.680 -10.981
    5    HE2  LYS  14           HE2      LYS  14   2.931   7.532 -11.175
    6    HZ2  LYS  14           HZ1      LYS  14   1.078   8.376 -10.131
    7    HZ1  LYS  14           HZ2      LYS  14   1.563   7.183  -9.035
    8    HZ3  LYS  14           HZ3      LYS  14   0.273   6.888 -10.087
    9    H    LYS  14           HN       LYS  14   6.681   2.894  -8.339
   10    HB3  LYS  14           HB1      LYS  14   4.221   3.409 -10.258
   11    HG3  LYS  14           HG1      LYS  14   4.275   5.289 -12.051
   12    HD3  LYS  14           HD1      LYS  14   2.725   5.446  -9.471
   13    HE3  LYS  14           HE1      LYS  14   1.614   6.633 -11.928

  No H/Q in entry =          13
  In of MODEL   11
    1    HA   LEU  15           HA       LEU  15   3.128   4.334  -5.569
    2    HB2  LEU  15           HB2      LEU  15   3.073   6.974  -5.821
    3    HG   LEU  15           HG       LEU  15   2.563   5.719  -3.706
    4   HD12  LEU  15          HD11      LEU  15   0.985   7.564  -2.847
    5   HD11  LEU  15          HD12      LEU  15   1.134   8.237  -4.470
    6   HD13  LEU  15          HD13      LEU  15   2.570   8.029  -3.467
    7   HD22  LEU  15          HD21      LEU  15   0.754   4.354  -4.112
    8   HD21  LEU  15          HD22      LEU  15  -0.110   5.589  -5.027
    9   HD23  LEU  15          HD23      LEU  15  -0.011   5.702  -3.270
   10    H    LEU  15           HN       LEU  15   3.905   6.075  -7.670
   11    HB3  LEU  15           HB1      LEU  15   1.429   6.655  -6.340

  No H/Q in entry =          11
  In of MODEL   11
    1    HA   LYS  16           HA       LYS  16   0.231   2.013  -7.879
    2    HB2  LYS  16           HB2      LYS  16   0.320   1.134  -5.040
    3    HG2  LYS  16           HG2      LYS  16   0.507  -0.270  -7.691
    4    HD2  LYS  16           HD2      LYS  16  -0.016  -1.312  -4.991
    5    HE2  LYS  16           HE2      LYS  16   2.270  -1.950  -5.035
    6    HZ1  LYS  16           HZ1      LYS  16   1.800  -2.316  -7.878
    7    HZ3  LYS  16           HZ2      LYS  16   2.820  -3.451  -7.150
    8    HZ2  LYS  16           HZ3      LYS  16   3.194  -1.804  -7.066
    9    H    LYS  16           HN       LYS  16   1.711   2.729  -5.614
   10    HB3  LYS  16           HB1      LYS  16  -1.086   0.661  -5.984
   11    HG3  LYS  16           HG1      LYS  16   1.797   0.004  -6.518
   12    HD3  LYS  16           HD1      LYS  16  -0.317  -2.043  -6.570
   13    HE3  LYS  16           HE1      LYS  16   1.330  -3.371  -5.485

  No H/Q in entry =          13
  In of MODEL   11
    1    HA   PRO  17           HA       PRO  17  -3.403   4.499  -7.944
    2    HB2  PRO  17           HB2      PRO  17  -4.900   1.937  -8.227
    3    HG2  PRO  17           HG2      PRO  17  -3.667   1.213 -10.064
    4    HD2  PRO  17           HD2      PRO  17  -2.160   0.790  -8.369
    5    HB3  PRO  17           HB1      PRO  17  -4.953   3.389  -9.233
    6    HG3  PRO  17           HG1      PRO  17  -3.011   2.831 -10.373
    7    HD3  PRO  17           HD1      PRO  17  -1.177   1.942  -9.296

  No H/Q in entry =           7
  In of MODEL   11
    1    HA   ALA  18           HA       ALA  18  -4.753   4.307  -3.806
    2    HB2  ALA  18           HB1      ALA  18  -5.872   6.202  -3.255
    3    HB3  ALA  18           HB2      ALA  18  -6.967   6.089  -4.632
    4    HB1  ALA  18           HB3      ALA  18  -5.325   6.693  -4.858
    5    H    ALA  18           HN       ALA  18  -4.704   5.321  -6.414

  No H/Q in entry =           5
  In of MODEL   11
    1    HA3  GLY  19           HA2      GLY  19  -7.967   1.575  -2.794
    2    H    GLY  19           HN       GLY  19  -5.578   2.331  -3.407
    3    HA2  GLY  19           HA1      GLY  19  -8.217   1.668  -4.530

  No H/Q in entry =           3
  In of MODEL   11
    1    HA   THR  20           HA       THR  20  -5.948  -1.993  -5.357
    2    HB   THR  20           HB       THR  20  -3.148  -0.953  -5.039
    3    HG1  THR  20           HG1      THR  20  -3.776   0.582  -6.355
    4   HG22  THR  20          HG21      THR  20  -2.699  -2.356  -6.981
    5   HG21  THR  20          HG22      THR  20  -4.389  -2.857  -7.009
    6   HG23  THR  20          HG23      THR  20  -3.364  -3.289  -5.641
    7    H    THR  20           HN       THR  20  -5.410   0.722  -4.991

  No H/Q in entry =           7
  In of MODEL   11
    1    HA   THR  21           HA       THR  21  -5.353  -3.809  -1.495
    2    HB   THR  21           HB       THR  21  -4.518  -6.194  -1.682
    3    HG1  THR  21           HG1      THR  21  -3.809  -6.899  -3.528
    4   HG21  THR  21          HG21      THR  21  -6.986  -5.144  -2.413
    5   HG23  THR  21          HG22      THR  21  -6.612  -6.818  -2.005
    6   HG22  THR  21          HG23      THR  21  -6.573  -6.291  -3.687
    7    H    THR  21           HN       THR  21  -5.242  -3.857  -4.293

  No H/Q in entry =           7
  In of MODEL   11
    1    HA   CYS  22           HA       CYS  22  -1.063  -3.415  -0.707
    2    HB2  CYS  22           HB2      CYS  22  -2.642  -2.420   1.239
    3    H    CYS  22           HN       CYS  22  -3.736  -4.368   0.066
    4    HB3  CYS  22           HB1      CYS  22  -1.775  -3.643   2.162

  No H/Q in entry =           4
  In of MODEL   11
    1    HA   TRP  23           HA       TRP  23  -0.808  -7.834   0.686
    2    HB2  TRP  23           HB2      TRP  23   0.545  -6.549   2.325
    3    HD1  TRP  23           HD1      TRP  23   1.323  -9.159   1.169
    4    HE1  TRP  23           HE1      TRP  23   2.112 -11.179   2.556
    5    HE3  TRP  23           HE3      TRP  23  -0.702  -7.885   5.688
    6    HZ2  TRP  23           HZ2      TRP  23   1.904 -12.109   5.213
    7    HZ3  TRP  23           HZ3      TRP  23  -0.361  -9.394   7.601
    8    HH2  TRP  23           HH2      TRP  23   0.915 -11.462   7.366
    9    H    TRP  23           HN       TRP  23  -2.660  -5.781   1.422
   10    HB3  TRP  23           HB1      TRP  23  -0.704  -6.821   3.535

  No H/Q in entry =          10
  In of MODEL   11
    1    HA   ARG  24           HA       ARG  24  -4.450  -9.639   2.460
    2    HB2  ARG  24           HB2      ARG  24  -5.754  -8.185   0.975
    3    HG2  ARG  24           HG2      ARG  24  -6.468 -11.022   1.311
    4    HD2  ARG  24           HD2      ARG  24  -7.160 -10.777  -0.973
    5    HE   ARG  24           HE       ARG  24  -7.910  -8.100  -0.253
    6   HH11  ARG  24          HH11      ARG  24  -8.458 -10.712  -2.501
    7   HH12  ARG  24          HH12      ARG  24  -9.033  -9.673  -3.761
    8   HH21  ARG  24          HH21      ARG  24  -8.665  -6.732  -1.909
    9   HH22  ARG  24          HH22      ARG  24  -9.150  -7.413  -3.426
   10    H    ARG  24           HN       ARG  24  -2.954  -8.633   0.132
   11    HB3  ARG  24           HB1      ARG  24  -5.383  -9.233  -0.387
   12    HG3  ARG  24           HG1      ARG  24  -7.343  -9.562   1.779
   13    HD3  ARG  24           HD1      ARG  24  -8.585 -10.699   0.063

  No H/Q in entry =          13
  In of MODEL   11
    1    HA   THR  25           HA       THR  25  -3.219 -13.517   0.820
    2    HB   THR  25           HB       THR  25  -3.162 -15.071   2.983
    3    HG1  THR  25           HG1      THR  25  -3.344 -14.036   4.794
    4   HG22  THR  25          HG21      THR  25  -0.909 -14.187   3.539
    5   HG21  THR  25          HG22      THR  25  -1.198 -12.873   2.400
    6   HG23  THR  25          HG23      THR  25  -1.149 -14.540   1.828
    7    H    THR  25           HN       THR  25  -4.257 -11.727   2.892

  No H/Q in entry =           7
  In of MODEL   11
    1    HA   SER  26           HA       SER  26  -7.763 -14.406   1.349
    2    HB2  SER  26           HB2      SER  26  -6.375 -16.102   3.356
    3    HG   SER  26           HG       SER  26  -7.682 -17.462   1.516
    4    H    SER  26           HN       SER  26  -5.938 -13.075   2.997
    5    HB3  SER  26           HB1      SER  26  -8.120 -16.312   3.207

  No H/Q in entry =           5
  In of MODEL   11
    1    HA   VAL  27           HA       VAL  27  -9.678 -12.722   5.109
    2    HB   VAL  27           HB       VAL  27  -9.054 -14.605   6.564
    3    H    VAL  27           HN       VAL  27  -6.899 -13.599   4.667

  No H/Q in entry =           3
  In of MODEL   11
    1    HA   SER  28           HA       SER  28  -6.556  -9.613   7.060
    2    HB2  SER  28           HB2      SER  28  -4.271  -9.094   6.304
    3    HG   SER  28           HG       SER  28  -3.507 -11.089   4.923
    4    H    SER  28           HN       SER  28  -6.274 -11.996   5.620
    5    HB3  SER  28           HB1      SER  28  -4.406 -10.777   6.816

  No H/Q in entry =           5
  In of MODEL   11
    1    HA   SER  29           HA       SER  29  -6.518  -6.787   3.496
    2    HB2  SER  29           HB2      SER  29  -8.658  -5.852   5.408
    3    HG   SER  29           HG       SER  29  -9.684  -7.650   5.098
    4    H    SER  29           HN       SER  29  -6.044  -7.410   6.245
    5    HB3  SER  29           HB1      SER  29  -8.643  -5.730   3.649

  No H/Q in entry =           5
  In of MODEL   11
    1    HA   HIS  30           HA       HIS  30  -5.018  -3.032   5.223
    2    HB2  HIS  30           HB2      HIS  30  -2.987  -4.416   3.551
    3    HD1  HIS  30           HD1      HIS  30  -1.081  -2.541   5.708
    4    HD2  HIS  30           HD2      HIS  30  -3.820  -5.597   6.364
    5    HE1  HIS  30           HE1      HIS  30  -0.507  -3.485   7.967
    6    HE2  HIS  30           HE2      HIS  30  -2.227  -5.279   8.377
    7    H    HIS  30           HN       HIS  30  -5.366  -5.025   3.082
    8    HB3  HIS  30           HB1      HIS  30  -2.725  -2.705   3.875

  No H/Q in entry =           8
  In of MODEL   11
    1    HA   TYR  31           HA       TYR  31  -5.367  -2.299  -0.064
    2    HB2  TYR  31           HB2      TYR  31  -6.981  -0.820   2.022
    3    HD1  TYR  31           HD1      TYR  31  -7.611  -2.607  -1.196
    4    HD2  TYR  31           HD2      TYR  31  -8.473  -2.317   2.960
    5    HE1  TYR  31           HE1      TYR  31  -9.312  -4.366  -1.433
    6    HE2  TYR  31           HE2      TYR  31 -10.176  -4.077   2.735
    7    HH   TYR  31           HH       TYR  31 -10.761  -5.897   1.269
    8    H    TYR  31           HN       TYR  31  -4.865  -3.613   1.723
    9    HB3  TYR  31           HB1      TYR  31  -7.073  -0.501   0.293

  No H/Q in entry =           9
  In of MODEL   11
    1    HA   CYS  32           HA       CYS  32  -2.585   1.010   0.094
    2    HB2  CYS  32           HB2      CYS  32  -3.268   0.440  -2.472
    3    H    CYS  32           HN       CYS  32  -4.904  -0.243  -1.084
    4    HB3  CYS  32           HB1      CYS  32  -3.711   2.142  -2.392

  No H/Q in entry =           4
  In of MODEL   11
    1    HA   THR  33           HA       THR  33  -4.858   4.682   0.946
    2    HB   THR  33           HB       THR  33  -2.938   4.640   2.484
    3    HG1  THR  33           HG1      THR  33  -4.369   6.404   2.599
    4   HG22  THR  33          HG21      THR  33  -1.461   6.689   0.965
    5   HG21  THR  33          HG22      THR  33  -1.304   5.022   0.411
    6   HG23  THR  33          HG23      THR  33  -0.877   5.444   2.069
    7    H    THR  33           HN       THR  33  -2.423   3.487  -0.201

  No H/Q in entry =           7
  In of MODEL   11
    1    HA3  GLY  34           HA2      GLY  34  -2.529   6.201  -3.452
    2    H    GLY  34           HN       GLY  34  -2.228   5.136  -1.355
    3    HA2  GLY  34           HA1      GLY  34  -3.906   7.065  -2.786

  No H/Q in entry =           3
  In of MODEL   11
    1    HA   ARG  35           HA       ARG  35  -1.327  10.276  -1.355
    2    HB2  ARG  35           HB2      ARG  35  -1.720   9.046   1.334
    3    HG2  ARG  35           HG2      ARG  35  -2.218  11.903   0.667
    4    HD2  ARG  35           HD2      ARG  35  -2.596  10.582   2.920
    5    HE   ARG  35           HE       ARG  35  -4.283   9.072   2.732
    6   HH11  ARG  35          HH11      ARG  35  -4.997  11.754   0.616
    7   HH12  ARG  35          HH12      ARG  35  -6.536  11.125   0.132
    8   HH21  ARG  35          HH21      ARG  35  -6.307   8.243   2.097
    9   HH22  ARG  35          HH22      ARG  35  -7.281   9.132   0.973
   10    H    ARG  35           HN       ARG  35  -2.418   7.835  -0.362
   11    HB3  ARG  35           HB1      ARG  35  -0.582  10.380   1.191
   12    HG3  ARG  35           HG1      ARG  35  -3.312  10.671   0.033
   13    HD3  ARG  35           HD1      ARG  35  -3.726  11.821   2.376

  No H/Q in entry =          13
  In of MODEL   11
    1    HA   SER  36           HA       SER  36   2.564   7.896  -1.417
    2    HB2  SER  36           HB2      SER  36   2.933   8.910   0.732
    3    HG   SER  36           HG       SER  36   4.779   7.943   0.963
    4    H    SER  36           HN       SER  36   0.008   7.230  -0.280
    5    HB3  SER  36           HB1      SER  36   2.285   7.499   1.568

  No H/Q in entry =           5
  In of MODEL   11
    1    HA   CYS  37           HA       CYS  37   2.803   3.620  -1.878
    2    HB2  CYS  37           HB2      CYS  37   5.661   4.404  -1.431
    3    H    CYS  37           HN       CYS  37   4.136   6.016  -1.094
    4    HB3  CYS  37           HB1      CYS  37   5.245   2.706  -1.631

  No H/Q in entry =           4
  In of MODEL   11
    1    HA   GLU  38           HA       GLU  38   4.341   2.368   2.488
    2    HB2  GLU  38           HB2      GLU  38   5.317   4.678   3.108
    3    HG2  GLU  38           HG2      GLU  38   4.288   2.610   4.935
    4    H    GLU  38           HN       GLU  38   4.166   4.820   1.102
    5    HB3  GLU  38           HB1      GLU  38   3.741   4.996   3.821
    6    HG3  GLU  38           HG1      GLU  38   5.920   3.245   4.737

  No H/Q in entry =           6
  In of MODEL   11
    1    HA   CYS  39           HA       CYS  39   0.077   1.909   3.275
    2    HB2  CYS  39           HB2      CYS  39   1.438  -0.494   3.145
    3    H    CYS  39           HN       CYS  39   2.876   1.187   3.584
    4    HB3  CYS  39           HB1      CYS  39   0.641  -0.574   4.713

  No H/Q in entry =           4
  In of MODEL   11
    1    HA   PRO  40           HA       PRO  40  -0.686   3.502   7.309
    2    HB2  PRO  40           HB2      PRO  40  -3.005   1.629   7.377
    3    HG2  PRO  40           HG2      PRO  40  -3.912   2.401   5.377
    4    HD2  PRO  40           HD2      PRO  40  -2.181   1.108   4.568
    5    HB3  PRO  40           HB1      PRO  40  -2.957   3.373   7.662
    6    HG3  PRO  40           HG1      PRO  40  -2.928   3.876   5.397
    7    HD3  PRO  40           HD1      PRO  40  -1.664   2.668   3.896

  No H/Q in entry =           7
  In of MODEL   11
    1    HA   SER  41           HA       SER  41   0.341   0.266  10.073
    2    HB2  SER  41           HB2      SER  41  -0.308   2.353  12.150
    3    HG   SER  41           HG       SER  41   1.639   3.340  11.635
    4    H    SER  41           HN       SER  41  -1.140   2.752   9.590
    5    HB3  SER  41           HB1      SER  41   0.978   1.146  12.173

  No H/Q in entry =           5
  In of MODEL   11
    1    HA   TYR  42           HA       TYR  42  -3.630  -0.447  12.232
    2    HB2  TYR  42           HB2      TYR  42  -3.908   1.800  13.256
    3    HD1  TYR  42           HD1      TYR  42  -7.235   1.834  11.972
    4    HD2  TYR  42           HD2      TYR  42  -4.662  -0.189  14.690
    5    HE1  TYR  42           HE1      TYR  42  -9.197   0.943  13.156
    6    HE2  TYR  42           HE2      TYR  42  -6.617  -1.086  15.882
    7    HH   TYR  42           HH       TYR  42  -9.198  -0.201  16.113
    8    H    TYR  42           HN       TYR  42  -2.708   1.862  10.665
    9    HB3  TYR  42           HB1      TYR  42  -4.937   2.261  11.904

  No H/Q in entry =           9
  In of MODEL   11
    1    HA   PRO  43           HA       PRO  43  -5.536  -1.242   8.122
    2    HB2  PRO  43           HB2      PRO  43  -5.617  -3.940   8.427
    3    HG2  PRO  43           HG2      PRO  43  -4.797  -4.101  10.594
    4    HD2  PRO  43           HD2      PRO  43  -3.701  -2.348  11.616
    5    HB3  PRO  43           HB1      PRO  43  -4.186  -3.080   7.846
    6    HG3  PRO  43           HG1      PRO  43  -3.279  -4.188   9.679
    7    HD3  PRO  43           HD1      PRO  43  -2.702  -2.013  10.188

  No H/Q in entry =           7
  In of MODEL   11
    1    HA3  GLY  44           HA2      GLY  44  -9.590  -2.945   8.826
    2    H    GLY  44           HN       GLY  44  -7.675  -1.351   7.741
    3    HA2  GLY  44           HA1      GLY  44  -9.474  -1.622   9.976

  No H/Q in entry =           3
  In of MODEL   11
    1    HA   ASN  45           HA       ASN  45  -9.878   1.801   6.492
    2    HB2  ASN  45           HB2      ASN  45 -10.235  -0.579   5.276
    3   HD21  ASN  45          HD21      ASN  45  -8.901   1.088   4.208
    4   HD22  ASN  45          HD22      ASN  45  -9.644   2.057   2.987
    5    H    ASN  45           HN       ASN  45  -8.803   0.302   7.822
    6    HB3  ASN  45           HB1      ASN  45 -11.916  -0.146   5.572

  No H/Q in entry =           6
  In of MODEL   11
    1    HA3  GLY  46           HA2      GLY  46 -12.868   4.411   8.333
    2    H    GLY  46           HN       GLY  46 -10.982   3.314   7.549
    3    HA2  GLY  46           HA1      GLY  46 -13.792   2.940   8.073

  No H/Q in entry =           3
  In of MODEL   12
    1    H1   ALA   1           HT1      ALA   1  19.838  12.524  -5.896
    2    H2   ALA   1           HT3      ALA   1  19.561  10.906  -6.391
    3    H3   ALA   1           HT2      ALA   1  20.094  12.073  -7.532
    4    HA   ALA   1           HA       ALA   1  18.098  13.214  -7.463
    5    HB1  ALA   1           HB1      ALA   1  17.992  10.265  -7.792
    6    HB3  ALA   1           HB2      ALA   1  17.742  11.548  -8.976
    7    HB2  ALA   1           HB3      ALA   1  16.471  11.158  -7.817

  No H/Q in entry =           7
  In of MODEL   12
    1    HA   MET   2           HA       MET   2  15.610  13.521  -3.973
    2    HB2  MET   2           HB2      MET   2  13.522  13.141  -6.101
    3    H    MET   2           HN       MET   2  15.745  13.094  -6.738
    4    HG2  MET   2           HG2      MET   2  14.916  15.320  -5.630
    5    HE3  MET   2           HE1      MET   2  15.047  14.951  -2.171
    6    HB3  MET   2           HB1      MET   2  13.066  13.338  -4.414
    7    HE2  MET   2           HE2      MET   2  15.405  16.660  -2.413
    8    HE1  MET   2           HE3      MET   2  15.910  15.474  -3.617
    9    HG3  MET   2           HG1      MET   2  13.205  15.387  -6.046

  No H/Q in entry =           9
  In of MODEL   12
    1    HA   ASP   3           HA       ASP   3  14.899   9.623  -2.288
    2    HB2  ASP   3           HB2      ASP   3  14.629  11.072  -0.292
    3    H    ASP   3           HN       ASP   3  14.191  12.375  -2.430
    4    HB3  ASP   3           HB1      ASP   3  12.898  11.152  -0.609

  No H/Q in entry =           4
  In of MODEL   12
    1    HA   CYS   4           HA       CYS   4  11.366   8.711  -4.910
    2    HB2  CYS   4           HB2      CYS   4  13.421   7.574  -6.010
    3    H    CYS   4           HN       CYS   4  14.016   8.526  -4.024
    4    HB3  CYS   4           HB1      CYS   4  12.944   6.159  -5.078

  No H/Q in entry =           4
  In of MODEL   12
    1    HA   THR   5           HA       THR   5   9.321   6.231  -1.999
    2    HB   THR   5           HB       THR   5   7.422   7.223  -3.040
    3    HG1  THR   5           HG1      THR   5   6.938   4.433  -3.050
    4   HG23  THR   5          HG21      THR   5   7.225   7.112  -5.247
    5   HG22  THR   5          HG22      THR   5   6.469   5.540  -4.986
    6   HG21  THR   5          HG23      THR   5   8.193   5.641  -5.346
    7    H    THR   5           HN       THR   5   9.715   6.976  -4.780

  No H/Q in entry =           7
  In of MODEL   12
    1    HA   THR   6           HA       THR   6   9.362   1.916  -3.061
    2    HB   THR   6           HB       THR   6  11.256   1.806  -0.784
    3    HG1  THR   6           HG1      THR   6  11.826   3.806  -1.469
    4   HG21  THR   6          HG21      THR   6  11.160   0.806  -3.586
    5   HG23  THR   6          HG22      THR   6  11.448  -0.071  -2.084
    6   HG22  THR   6          HG23      THR   6  12.711   0.957  -2.761
    7    H    THR   6           HN       THR   6   9.136   4.162  -1.224

  No H/Q in entry =           7
  In of MODEL   12
    1    HA3  GLY   7           HA2      GLY   7   8.443  -1.072   0.323
    2    H    GLY   7           HN       GLY   7   8.949  -0.152  -2.033
    3    HA2  GLY   7           HA1      GLY   7   7.208   0.178   0.317

  No H/Q in entry =           3
  In of MODEL   12
    1    HA   PRO   8           HA       PRO   8   5.375  -3.718  -1.452
    2    HB2  PRO   8           HB2      PRO   8   3.290  -3.936   0.235
    3    HG2  PRO   8           HG2      PRO   8   3.574  -2.002   1.486
    4    HD2  PRO   8           HD2      PRO   8   5.539  -0.818   1.435
    5    HB3  PRO   8           HB1      PRO   8   4.895  -4.553   0.645
    6    HG3  PRO   8           HG1      PRO   8   4.528  -3.140   2.455
    7    HD3  PRO   8           HD1      PRO   8   6.525  -2.260   1.747

  No H/Q in entry =           7
  In of MODEL   12
    1    HA   CYS   9           HA       CYS   9   1.626  -1.066  -2.224
    2    HB2  CYS   9           HB2      CYS   9   1.662   0.008   0.262
    3    H    CYS   9           HN       CYS   9   3.742  -0.796  -0.263
    4    HB3  CYS   9           HB1      CYS   9   1.882   1.460  -0.708

  No H/Q in entry =           4
  In of MODEL   12
    1    HA   CYS  10           HA       CYS  10   3.422   1.229  -5.395
    2    HB2  CYS  10           HB2      CYS  10   5.651   2.337  -5.075
    3    H    CYS  10           HN       CYS  10   3.757  -0.980  -3.727
    4    HB3  CYS  10           HB1      CYS  10   4.520   2.584  -3.749

  No H/Q in entry =           4
  In of MODEL   12
    1    HA   ARG  11           HA       ARG  11   6.134  -1.460  -7.563
    2    HB2  ARG  11           HB2      ARG  11   3.895  -0.440  -9.236
    3    HG2  ARG  11           HG2      ARG  11   4.827  -3.272  -9.024
    4    HD2  ARG  11           HD2      ARG  11   2.130  -3.277  -8.924
    5    HE   ARG  11           HE       ARG  11   3.992  -3.636 -11.082
    6   HH11  ARG  11          HH11      ARG  11   0.620  -3.635 -10.185
    7   HH12  ARG  11          HH12      ARG  11   0.143  -4.670 -11.489
    8   HH21  ARG  11          HH21      ARG  11   3.368  -4.997 -12.798
    9   HH22  ARG  11          HH22      ARG  11   1.703  -5.444 -12.972
   10    H    ARG  11           HN       ARG  11   4.421   0.928  -7.354
   11    HB3  ARG  11           HB1      ARG  11   5.228  -1.234 -10.064
   12    HG3  ARG  11           HG1      ARG  11   3.886  -2.533  -7.726
   13    HD3  ARG  11           HD1      ARG  11   2.411  -1.814  -9.867

  No H/Q in entry =          13
  In of MODEL   12
    1    HA   GLN  12           HA       GLN  12   9.770  -0.493  -9.878
    2    HB2  GLN  12           HB2      GLN  12   7.670   1.424 -10.880
    3    HG2  GLN  12           HG2      GLN  12   9.240  -0.547 -12.495
    4   HE21  GLN  12          HE21      GLN  12   6.130  -1.070 -13.034
    5   HE22  GLN  12          HE22      GLN  12   5.820   0.058 -14.305
    6    H    GLN  12           HN       GLN  12   7.951  -1.393  -8.861
    7    HB3  GLN  12           HB1      GLN  12   9.351   1.506 -11.387
    8    HG3  GLN  12           HG1      GLN  12   7.753  -1.012 -11.669

  No H/Q in entry =           8
  In of MODEL   12
    1    HA   CYS  13           HA       CYS  13   9.594   3.219  -6.962
    2    HB2  CYS  13           HB2      CYS  13  11.108   3.509  -9.201
    3    H    CYS  13           HN       CYS  13   8.130   2.589  -9.328
    4    HB3  CYS  13           HB1      CYS  13  10.378   5.108  -9.092

  No H/Q in entry =           4
  In of MODEL   12
    1    HA   LYS  14           HA       LYS  14   6.253   6.031  -7.166
    2    HB2  LYS  14           HB2      LYS  14   6.146   5.454  -9.721
    3    HG2  LYS  14           HG2      LYS  14   3.879   6.825  -8.294
    4    HD2  LYS  14           HD2      LYS  14   4.400   6.335 -11.147
    5    HE2  LYS  14           HE2      LYS  14   3.159   8.683 -11.435
    6    HZ1  LYS  14           HZ1      LYS  14   5.959   7.902 -11.581
    7    HZ3  LYS  14           HZ2      LYS  14   5.641   9.562 -11.637
    8    HZ2  LYS  14           HZ3      LYS  14   4.945   8.530 -12.781
    9    H    LYS  14           HN       LYS  14   6.874   3.243  -7.751
   10    HB3  LYS  14           HB1      LYS  14   4.633   4.671  -9.286
   11    HG3  LYS  14           HG1      LYS  14   5.346   7.572  -8.928
   12    HD3  LYS  14           HD1      LYS  14   2.893   6.730 -10.319
   13    HE3  LYS  14           HE1      LYS  14   4.156   9.066 -10.032

  No H/Q in entry =          13
  In of MODEL   12
    1    HA   LEU  15           HA       LEU  15   3.507   4.179  -4.397
    2    HB2  LEU  15           HB2      LEU  15   1.887   5.701  -3.491
    3    HG   LEU  15           HG       LEU  15   2.216   7.194  -6.047
    4   HD11  LEU  15          HD11      LEU  15  -0.016   6.454  -4.190
    5   HD13  LEU  15          HD12      LEU  15   0.192   6.052  -5.895
    6   HD12  LEU  15          HD13      LEU  15  -0.222   7.700  -5.422
    7   HD23  LEU  15          HD21      LEU  15   1.417   8.592  -3.506
    8   HD22  LEU  15          HD22      LEU  15   1.679   9.294  -5.103
    9   HD21  LEU  15          HD23      LEU  15   3.046   8.676  -4.176
   10    H    LEU  15           HN       LEU  15   4.398   6.315  -5.972
   11    HB3  LEU  15           HB1      LEU  15   3.392   6.564  -3.746

  No H/Q in entry =          11
  In of MODEL   12
    1    HA   LYS  16           HA       LYS  16   0.308   2.595  -6.855
    2    HB2  LYS  16           HB2      LYS  16   0.048   1.505  -4.100
    3    HG2  LYS  16           HG2      LYS  16   0.093   0.009  -6.699
    4    HD2  LYS  16           HD2      LYS  16   1.399  -0.920  -4.206
    5    HE2  LYS  16           HE2      LYS  16  -0.414  -2.382  -6.106
    6    HZ3  LYS  16           HZ1      LYS  16   1.140  -4.228  -5.387
    7    HZ2  LYS  16           HZ2      LYS  16   0.027  -3.685  -4.235
    8    HZ1  LYS  16           HZ3      LYS  16   1.643  -3.196  -4.144
    9    H    LYS  16           HN       LYS  16   1.343   3.285  -4.233
   10    HB3  LYS  16           HB1      LYS  16  -1.281   1.208  -5.212
   11    HG3  LYS  16           HG1      LYS  16   1.568   0.577  -5.914
   12    HD3  LYS  16           HD1      LYS  16  -0.365  -0.926  -4.243
   13    HE3  LYS  16           HE1      LYS  16   1.307  -2.157  -6.419

  No H/Q in entry =          13
  In of MODEL   12
    1    HA   PRO  17           HA       PRO  17  -3.286   5.139  -6.814
    2    HB2  PRO  17           HB2      PRO  17  -5.238   3.497  -7.741
    3    HG2  PRO  17           HG2      PRO  17  -4.181   1.449  -7.458
    4    HD2  PRO  17           HD2      PRO  17  -1.909   1.289  -7.110
    5    HB3  PRO  17           HB1      PRO  17  -3.948   4.130  -8.770
    6    HG3  PRO  17           HG1      PRO  17  -3.653   1.847  -9.104
    7    HD3  PRO  17           HD1      PRO  17  -1.531   2.431  -8.416

  No H/Q in entry =           7
  In of MODEL   12
    1    HA   ALA  18           HA       ALA  18  -5.251   4.609  -2.987
    2    HB2  ALA  18           HB1      ALA  18  -6.898   6.240  -2.564
    3    HB3  ALA  18           HB2      ALA  18  -7.315   6.377  -4.272
    4    HB1  ALA  18           HB3      ALA  18  -5.768   6.992  -3.689
    5    H    ALA  18           HN       ALA  18  -4.949   5.769  -5.510

  No H/Q in entry =           5
  In of MODEL   12
    1    HA3  GLY  19           HA2      GLY  19  -8.442   1.693  -2.497
    2    H    GLY  19           HN       GLY  19  -6.029   2.622  -2.655
    3    HA2  GLY  19           HA1      GLY  19  -8.325   1.712  -4.250

  No H/Q in entry =           3
  In of MODEL   12
    1    HA   THR  20           HA       THR  20  -5.679  -1.775  -4.403
    2    HB   THR  20           HB       THR  20  -3.071  -0.488  -3.658
    3    HG1  THR  20           HG1      THR  20  -4.472  -0.185  -6.102
    4   HG21  THR  20          HG21      THR  20  -3.873  -2.645  -5.585
    5   HG23  THR  20          HG22      THR  20  -2.831  -2.777  -4.167
    6   HG22  THR  20          HG23      THR  20  -2.281  -1.887  -5.586
    7    H    THR  20           HN       THR  20  -5.434   0.995  -4.106

  No H/Q in entry =           7
  In of MODEL   12
    1    HA   THR  21           HA       THR  21  -4.975  -2.969  -0.259
    2    HB   THR  21           HB       THR  21  -4.945  -5.640  -0.361
    3    HG1  THR  21           HG1      THR  21  -6.085  -4.913  -2.849
    4   HG22  THR  21          HG21      THR  21  -7.421  -5.618  -0.642
    5   HG21  THR  21          HG22      THR  21  -7.305  -3.893  -0.993
    6   HG23  THR  21          HG23      THR  21  -6.805  -4.509   0.582
    7    H    THR  21           HN       THR  21  -4.713  -3.488  -3.137

  No H/Q in entry =           7
  In of MODEL   12
    1    HA   CYS  22           HA       CYS  22  -0.680  -3.365   0.189
    2    HB2  CYS  22           HB2      CYS  22  -1.826  -3.877   2.937
    3    H    CYS  22           HN       CYS  22  -3.320  -3.275   1.120
    4    HB3  CYS  22           HB1      CYS  22  -0.100  -3.773   2.610

  No H/Q in entry =           4
  In of MODEL   12
    1    HA   TRP  23           HA       TRP  23  -0.677  -7.874   0.795
    2    HB2  TRP  23           HB2      TRP  23   0.382  -7.382   3.026
    3    HD1  TRP  23           HD1      TRP  23   0.383  -9.751   0.751
    4    HE1  TRP  23           HE1      TRP  23   1.140 -12.099   1.486
    5    HE3  TRP  23           HE3      TRP  23  -0.338  -9.296   5.793
    6    HZ2  TRP  23           HZ2      TRP  23   1.397 -13.564   3.885
    7    HZ3  TRP  23           HZ3      TRP  23   0.187 -11.217   7.237
    8    HH2  TRP  23           HH2      TRP  23   1.036 -13.307   6.302
    9    H    TRP  23           HN       TRP  23  -2.059  -5.807   2.377
   10    HB3  TRP  23           HB1      TRP  23  -1.103  -7.944   3.787

  No H/Q in entry =          10
  In of MODEL   12
    1    HA   ARG  24           HA       ARG  24  -4.712  -9.587   1.053
    2    HB2  ARG  24           HB2      ARG  24  -3.847 -10.456  -1.701
    3    HG2  ARG  24           HG2      ARG  24  -4.940  -7.788  -0.852
    4    HD2  ARG  24           HD2      ARG  24  -5.292  -9.301  -3.350
    5    HE   ARG  24           HE       ARG  24  -3.789  -6.956  -3.535
    6   HH11  ARG  24          HH11      ARG  24  -6.712  -8.323  -4.864
    7   HH12  ARG  24          HH12      ARG  24  -6.590  -7.453  -6.356
    8   HH21  ARG  24          HH21      ARG  24  -3.626  -5.811  -5.497
    9   HH22  ARG  24          HH22      ARG  24  -4.838  -6.027  -6.716
   10    H    ARG  24           HN       ARG  24  -2.051  -9.226  -0.132
   11    HB3  ARG  24           HB1      ARG  24  -5.485 -10.237  -1.100
   12    HG3  ARG  24           HG1      ARG  24  -3.458  -8.118  -1.751
   13    HD3  ARG  24           HD1      ARG  24  -6.250  -7.983  -2.676

  No H/Q in entry =          13
  In of MODEL   12
    1    HA   THR  25           HA       THR  25  -3.724 -13.844   1.423
    2    HB   THR  25           HB       THR  25  -3.531 -14.232   4.042
    3    HG1  THR  25           HG1      THR  25  -4.210 -12.311   4.811
    4   HG21  THR  25          HG21      THR  25  -1.664 -14.247   2.359
    5   HG23  THR  25          HG22      THR  25  -1.231 -13.726   3.988
    6   HG22  THR  25          HG23      THR  25  -1.449 -12.532   2.708
    7    H    THR  25           HN       THR  25  -4.916 -11.310   2.311

  No H/Q in entry =           7
  In of MODEL   12
    1    HA   SER  26           HA       SER  26  -8.570 -13.502   1.359
    2    HB2  SER  26           HB2      SER  26  -7.153 -15.995   2.315
    3    HG   SER  26           HG       SER  26  -8.646 -15.913  -0.015
    4    H    SER  26           HN       SER  26  -6.416 -12.803   1.152
    5    HB3  SER  26           HB1      SER  26  -8.901 -15.907   2.092

  No H/Q in entry =           5
  In of MODEL   12
    1    HA   VAL  27           HA       VAL  27  -9.382 -12.133   5.420
    2    HB   VAL  27           HB       VAL  27  -8.342 -14.243   6.123
    3    H    VAL  27           HN       VAL  27  -7.328 -12.030   3.525

  No H/Q in entry =           3
  In of MODEL   12
    1    HA   SER  28           HA       SER  28  -6.079  -9.093   6.621
    2    HB2  SER  28           HB2      SER  28  -3.855 -10.077   4.816
    3    HG   SER  28           HG       SER  28  -4.494 -11.475   6.605
    4    H    SER  28           HN       SER  28  -5.991 -11.385   4.839
    5    HB3  SER  28           HB1      SER  28  -3.711  -8.810   6.033

  No H/Q in entry =           5
  In of MODEL   12
    1    HA   SER  29           HA       SER  29  -5.478  -6.093   3.300
    2    HB2  SER  29           HB2      SER  29  -7.654  -5.536   2.603
    3    HG   SER  29           HG       SER  29  -9.444  -5.933   4.170
    4    H    SER  29           HN       SER  29  -5.767  -6.940   5.959
    5    HB3  SER  29           HB1      SER  29  -7.836  -7.148   3.294

  No H/Q in entry =           5
  In of MODEL   12
    1    HA   HIS  30           HA       HIS  30  -5.214  -2.610   5.981
    2    HB2  HIS  30           HB2      HIS  30  -2.613  -3.075   4.592
    3    HD1  HIS  30           HD1      HIS  30  -0.769  -2.467   6.802
    4    HD2  HIS  30           HD2      HIS  30  -4.513  -4.131   7.497
    5    HE1  HIS  30           HE1      HIS  30  -0.603  -3.580   9.051
    6    HE2  HIS  30           HE2      HIS  30  -2.906  -4.505   9.489
    7    H    HIS  30           HN       HIS  30  -4.346  -4.327   3.770
    8    HB3  HIS  30           HB1      HIS  30  -2.895  -1.502   5.331

  No H/Q in entry =           8
  In of MODEL   12
    1    HA   TYR  31           HA       TYR  31  -5.301  -1.199   0.868
    2    HB2  TYR  31           HB2      TYR  31  -7.023   0.212   2.905
    3    HD1  TYR  31           HD1      TYR  31  -7.779  -2.156   0.139
    4    HD2  TYR  31           HD2      TYR  31  -8.067  -1.342   4.305
    5    HE1  TYR  31           HE1      TYR  31  -9.248  -4.110   0.413
    6    HE2  TYR  31           HE2      TYR  31  -9.535  -3.293   4.591
    7    HH   TYR  31           HH       TYR  31 -11.073  -4.817   2.112
    8    H    TYR  31           HN       TYR  31  -4.716  -2.646   2.522
    9    HB3  TYR  31           HB1      TYR  31  -7.252   0.136   1.161

  No H/Q in entry =           9
  In of MODEL   12
    1    HA   CYS  32           HA       CYS  32  -3.238   2.572   1.838
    2    HB2  CYS  32           HB2      CYS  32  -2.872   1.686  -0.976
    3    H    CYS  32           HN       CYS  32  -4.932   0.942   0.059
    4    HB3  CYS  32           HB1      CYS  32  -2.342   3.316  -0.575

  No H/Q in entry =           4
  In of MODEL   12
    1    HA   THR  33           HA       THR  33  -5.971   5.801   0.930
    2    HB   THR  33           HB       THR  33  -4.896   6.667   2.924
    3    HG1  THR  33           HG1      THR  33  -4.994   8.660   0.910
    4   HG23  THR  33          HG21      THR  33  -2.802   7.380   3.088
    5   HG22  THR  33          HG22      THR  33  -2.931   8.362   1.629
    6   HG21  THR  33          HG23      THR  33  -2.547   6.645   1.505
    7    H    THR  33           HN       THR  33  -3.369   4.828   1.661

  No H/Q in entry =           7
  In of MODEL   12
    1    HA3  GLY  34           HA2      GLY  34  -2.454   6.143  -2.799
    2    H    GLY  34           HN       GLY  34  -2.758   5.881  -0.439
    3    HA2  GLY  34           HA1      GLY  34  -3.888   7.159  -2.834

  No H/Q in entry =           3
  In of MODEL   12
    1    HA   ARG  35           HA       ARG  35  -0.696  10.118  -1.635
    2    HB2  ARG  35           HB2      ARG  35  -1.867   9.849   0.766
    3    HG2  ARG  35           HG2      ARG  35   0.114  11.847  -0.199
    4    HD2  ARG  35           HD2      ARG  35  -1.271  12.467   2.328
    5    HE   ARG  35           HE       ARG  35   0.995  13.448   0.932
    6   HH11  ARG  35          HH11      ARG  35  -0.294  13.025   4.147
    7   HH12  ARG  35          HH12      ARG  35   0.599  14.350   4.815
    8   HH21  ARG  35          HH21      ARG  35   2.171  15.190   1.808
    9   HH22  ARG  35          HH22      ARG  35   1.998  15.580   3.487
   10    H    ARG  35           HN       ARG  35  -1.462   7.570  -0.372
   11    HB3  ARG  35           HB1      ARG  35  -0.188   9.678   1.255
   12    HG3  ARG  35           HG1      ARG  35  -1.609  12.034   0.136
   13    HD3  ARG  35           HD1      ARG  35   0.080  11.341   2.449

  No H/Q in entry =          13
  In of MODEL   12
    1    HA   SER  36           HA       SER  36   3.079   7.601  -1.254
    2    HB2  SER  36           HB2      SER  36   4.340   7.440   0.817
    3    HG   SER  36           HG       SER  36   2.500   7.931   2.645
    4    H    SER  36           HN       SER  36   0.473   7.214  -0.066
    5    HB3  SER  36           HB1      SER  36   3.249   8.822   0.908

  No H/Q in entry =           5
  In of MODEL   12
    1    HA   CYS  37           HA       CYS  37   3.092   3.288  -1.199
    2    HB2  CYS  37           HB2      CYS  37   5.315   3.691  -2.153
    3    H    CYS  37           HN       CYS  37   4.548   5.684  -0.613
    4    HB3  CYS  37           HB1      CYS  37   6.017   3.690  -0.539

  No H/Q in entry =           4
  In of MODEL   12
    1    HA   GLU  38           HA       GLU  38   4.626   2.519   3.328
    2    HB2  GLU  38           HB2      GLU  38   3.880   5.343   4.110
    3    HG2  GLU  38           HG2      GLU  38   6.639   4.256   4.347
    4    H    GLU  38           HN       GLU  38   4.458   4.748   1.656
    5    HB3  GLU  38           HB1      GLU  38   4.507   4.100   5.184
    6    HG3  GLU  38           HG1      GLU  38   6.098   4.899   2.797

  No H/Q in entry =           6
  In of MODEL   12
    1    HA   CYS  39           HA       CYS  39   0.305   1.592   3.327
    2    HB2  CYS  39           HB2      CYS  39   1.890  -0.599   4.621
    3    H    CYS  39           HN       CYS  39   3.044   1.098   3.650
    4    HB3  CYS  39           HB1      CYS  39   0.138  -0.573   4.791

  No H/Q in entry =           4
  In of MODEL   12
    1    HA   PRO  40           HA       PRO  40  -0.889   3.542   7.101
    2    HB2  PRO  40           HB2      PRO  40  -3.452   2.687   7.334
    3    HG2  PRO  40           HG2      PRO  40  -3.416   0.943   5.801
    4    HD2  PRO  40           HD2      PRO  40  -1.735   0.731   4.239
    5    HB3  PRO  40           HB1      PRO  40  -2.947   3.881   6.133
    6    HG3  PRO  40           HG1      PRO  40  -3.899   2.280   4.740
    7    HD3  PRO  40           HD1      PRO  40  -1.808   2.445   3.785

  No H/Q in entry =           7
  In of MODEL   12
    1    HA   SER  41           HA       SER  41  -1.361   0.265  10.084
    2    HB2  SER  41           HB2      SER  41  -0.892   2.859  11.568
    3    HG   SER  41           HG       SER  41   1.246   1.459  11.596
    4    H    SER  41           HN       SER  41  -2.072   2.994   9.235
    5    HB3  SER  41           HB1      SER  41  -0.736   1.264  12.304

  No H/Q in entry =           5
  In of MODEL   12
    1    HA   TYR  42           HA       TYR  42  -5.493   0.301  11.442
    2    HB2  TYR  42           HB2      TYR  42  -5.021   2.958  11.545
    3    HD1  TYR  42           HD1      TYR  42  -5.149   1.945  13.832
    4    HD2  TYR  42           HD2      TYR  42  -8.603   2.541  11.421
    5    HE1  TYR  42           HE1      TYR  42  -6.572   1.722  15.825
    6    HE2  TYR  42           HE2      TYR  42 -10.036   2.322  13.407
    7    HH   TYR  42           HH       TYR  42  -8.770   2.321  16.596
    8    H    TYR  42           HN       TYR  42  -3.925   1.176   9.217
    9    HB3  TYR  42           HB1      TYR  42  -6.449   2.948  10.517

  No H/Q in entry =           9
  In of MODEL   12
    1    HA   PRO  43           HA       PRO  43  -7.237  -0.764   7.320
    2    HB2  PRO  43           HB2      PRO  43  -8.095  -3.231   8.062
    3    HG2  PRO  43           HG2      PRO  43  -7.522  -3.172  10.311
    4    HD2  PRO  43           HD2      PRO  43  -6.062  -1.601  11.156
    5    HB3  PRO  43           HB1      PRO  43  -6.440  -2.908   7.532
    6    HG3  PRO  43           HG1      PRO  43  -6.026  -3.833   9.626
    7    HD3  PRO  43           HD1      PRO  43  -4.898  -1.832   9.836

  No H/Q in entry =           7
  In of MODEL   12
    1    HA3  GLY  44           HA2      GLY  44 -10.657  -0.333  11.335
    2    H    GLY  44           HN       GLY  44  -8.570  -0.920  10.558
    3    HA2  GLY  44           HA1      GLY  44 -11.030   0.251   9.720

  No H/Q in entry =           3
  In of MODEL   12
    1    HA   ASN  45           HA       ASN  45 -13.324  -3.534   9.908
    2    HB2  ASN  45           HB2      ASN  45 -15.729  -3.199  10.302
    3   HD21  ASN  45          HD21      ASN  45 -14.479  -0.079  11.305
    4   HD22  ASN  45          HD22      ASN  45 -15.692   0.868  10.519
    5    H    ASN  45           HN       ASN  45 -13.136  -0.603   9.856
    6    HB3  ASN  45           HB1      ASN  45 -14.758  -2.370  11.515

  No H/Q in entry =           6
  In of MODEL   12
    1    HA3  GLY  46           HA2      GLY  46 -15.223  -2.866   5.884
    2    H    GLY  46           HN       GLY  46 -15.505  -4.121   8.533
    3    HA2  GLY  46           HA1      GLY  46 -15.092  -4.612   6.041

  No H/Q in entry =           3
  In of MODEL   13
    1    H1   ALA   1           HT1      ALA   1  19.924   8.827  -4.815
    2    H2   ALA   1           HT3      ALA   1  20.487   8.298  -6.345
    3    H3   ALA   1           HT2      ALA   1  21.462   9.333  -5.383
    4    HA   ALA   1           HA       ALA   1  20.156  11.138  -5.735
    5    HB3  ALA   1           HB1      ALA   1  19.650  10.979  -8.294
    6    HB1  ALA   1           HB2      ALA   1  20.500   9.439  -8.162
    7    HB2  ALA   1           HB3      ALA   1  21.314  10.936  -7.710

  No H/Q in entry =           7
  In of MODEL   13
    1    HA   MET   2           HA       MET   2  15.942   9.652  -7.378
    2    HB2  MET   2           HB2      MET   2  15.013   7.377  -7.631
    3    H    MET   2           HN       MET   2  18.434   8.368  -7.180
    4    HG2  MET   2           HG2      MET   2  17.063   5.654  -7.833
    5    HE2  MET   2           HE1      MET   2  17.374   3.963  -5.167
    6    HB3  MET   2           HB1      MET   2  16.426   7.640  -8.643
    7    HE1  MET   2           HE2      MET   2  16.843   3.493  -6.782
    8    HE3  MET   2           HE3      MET   2  15.867   3.071  -5.375
    9    HG3  MET   2           HG1      MET   2  17.594   6.606  -6.448

  No H/Q in entry =           9
  In of MODEL   13
    1    HA   ASP   3           HA       ASP   3  14.215   8.353  -3.480
    2    HB2  ASP   3           HB2      ASP   3  13.765  10.498  -2.262
    3    H    ASP   3           HN       ASP   3  14.141   9.667  -6.063
    4    HB3  ASP   3           HB1      ASP   3  15.395  10.370  -2.915

  No H/Q in entry =           4
  In of MODEL   13
    1    HA   CYS   4           HA       CYS   4   9.915   8.962  -4.035
    2    HB2  CYS   4           HB2      CYS   4   8.952   6.962  -5.310
    3    H    CYS   4           HN       CYS   4  12.317   7.332  -3.616
    4    HB3  CYS   4           HB1      CYS   4  10.123   7.963  -6.161

  No H/Q in entry =           4
  In of MODEL   13
    1    HA   THR   5           HA       THR   5   8.247   6.948  -0.627
    2    HB   THR   5           HB       THR   5   5.733   6.277  -2.049
    3    HG1  THR   5           HG1      THR   5   5.339   8.215  -2.736
    4   HG22  THR   5          HG21      THR   5   4.758   7.563  -0.146
    5   HG21  THR   5          HG22      THR   5   6.393   7.729   0.495
    6   HG23  THR   5          HG23      THR   5   5.675   6.128   0.315
    7    H    THR   5           HN       THR   5   7.937   7.910  -3.238

  No H/Q in entry =           7
  In of MODEL   13
    1    HA   THR   6           HA       THR   6   8.444   2.686  -1.627
    2    HB   THR   6           HB       THR   6   9.716   1.651   0.457
    3    HG1  THR   6           HG1      THR   6  10.333   4.406   0.688
    4   HG23  THR   6          HG21      THR   6  10.978   1.666  -1.452
    5   HG22  THR   6          HG22      THR   6  11.870   2.801  -0.439
    6   HG21  THR   6          HG23      THR   6  10.789   3.402  -1.696
    7    H    THR   6           HN       THR   6   8.442   4.966   0.231

  No H/Q in entry =           7
  In of MODEL   13
    1    HA3  GLY   7           HA2      GLY   7   6.535  -0.196   1.479
    2    H    GLY   7           HN       GLY   7   7.786   0.574  -0.672
    3    HA2  GLY   7           HA1      GLY   7   5.349   0.972   0.916

  No H/Q in entry =           3
  In of MODEL   13
    1    HA   PRO   8           HA       PRO   8   4.883  -3.510  -0.886
    2    HB2  PRO   8           HB2      PRO   8   2.290  -3.154   0.541
    3    HG2  PRO   8           HG2      PRO   8   3.238  -3.295   2.662
    4    HD2  PRO   8           HD2      PRO   8   3.853  -1.148   2.087
    5    HB3  PRO   8           HB1      PRO   8   3.278  -4.606   0.347
    6    HG3  PRO   8           HG1      PRO   8   4.743  -3.996   2.039
    7    HD3  PRO   8           HD1      PRO   8   5.481  -1.827   2.288

  No H/Q in entry =           7
  In of MODEL   13
    1    HA   CYS   9           HA       CYS   9   1.110  -1.300  -2.745
    2    HB2  CYS   9           HB2      CYS   9   0.480   0.185  -0.803
    3    H    CYS   9           HN       CYS   9   2.741  -0.723  -0.487
    4    HB3  CYS   9           HB1      CYS   9   1.557   1.405  -1.475

  No H/Q in entry =           4
  In of MODEL   13
    1    HA   CYS  10           HA       CYS  10   3.976   1.758  -4.890
    2    HB2  CYS  10           HB2      CYS  10   5.723   1.942  -2.500
    3    H    CYS  10           HN       CYS  10   3.981   0.685  -2.229
    4    HB3  CYS  10           HB1      CYS  10   6.495   2.219  -4.057

  No H/Q in entry =           4
  In of MODEL   13
    1    HA   ARG  11           HA       ARG  11   6.343  -1.590  -6.433
    2    HB2  ARG  11           HB2      ARG  11   4.254  -1.624  -7.773
    3    HG2  ARG  11           HG2      ARG  11   5.367  -2.364 -10.007
    4    HD2  ARG  11           HD2      ARG  11   6.431  -4.350  -8.547
    5    HE   ARG  11           HE       ARG  11   3.605  -4.505  -8.383
    6   HH11  ARG  11          HH11      ARG  11   6.225  -4.308 -10.680
    7   HH12  ARG  11          HH12      ARG  11   5.349  -5.114 -11.937
    8   HH21  ARG  11          HH21      ARG  11   2.452  -5.565 -10.036
    9   HH22  ARG  11          HH22      ARG  11   3.207  -5.828 -11.572
   10    H    ARG  11           HN       ARG  11   4.845   0.924  -6.680
   11    HB3  ARG  11           HB1      ARG  11   4.956  -0.431  -8.857
   12    HG3  ARG  11           HG1      ARG  11   6.866  -2.201  -9.090
   13    HD3  ARG  11           HD1      ARG  11   5.405  -3.600  -7.325

  No H/Q in entry =          13
  In of MODEL   13
    1    HA   GLN  12           HA       GLN  12  10.551  -0.808  -7.267
    2    HB2  GLN  12           HB2      GLN  12   8.869  -0.248  -9.636
    3    HG2  GLN  12           HG2      GLN  12  10.827  -1.447 -10.740
    4   HE21  GLN  12          HE21      GLN  12   8.893  -2.376 -11.459
    5   HE22  GLN  12          HE22      GLN  12   8.203  -3.753 -10.677
    6    H    GLN  12           HN       GLN  12   8.471  -1.423  -6.591
    7    HB3  GLN  12           HB1      GLN  12  10.441   0.538  -9.605
    8    HG3  GLN  12           HG1      GLN  12  11.387  -1.781  -9.102

  No H/Q in entry =           8
  In of MODEL   13
    1    HA   CYS  13           HA       CYS  13   9.567   3.705  -6.593
    2    HB2  CYS  13           HB2      CYS  13  11.667   3.514  -7.940
    3    H    CYS  13           HN       CYS  13   8.855   1.919  -8.743
    4    HB3  CYS  13           HB1      CYS  13  10.788   4.156  -9.323

  No H/Q in entry =           4
  In of MODEL   13
    1    HA   LYS  14           HA       LYS  14   6.196   5.938  -8.063
    2    HB2  LYS  14           HB2      LYS  14   5.905   3.413  -9.596
    3    HG2  LYS  14           HG2      LYS  14   6.336   6.282 -10.170
    4    HD2  LYS  14           HD2      LYS  14   4.534   4.543 -11.722
    5    HE2  LYS  14           HE2      LYS  14   6.198   6.409 -13.322
    6    HZ1  LYS  14           HZ1      LYS  14   4.146   4.875 -13.956
    7    HZ3  LYS  14           HZ2      LYS  14   5.391   3.769 -14.248
    8    HZ2  LYS  14           HZ3      LYS  14   5.372   5.253 -15.058
    9    H    LYS  14           HN       LYS  14   7.139   3.543  -6.880
   10    HB3  LYS  14           HB1      LYS  14   4.495   4.460  -9.523
   11    HG3  LYS  14           HG1      LYS  14   7.085   4.853 -10.886
   12    HD3  LYS  14           HD1      LYS  14   4.638   6.303 -11.658
   13    HE3  LYS  14           HE1      LYS  14   6.876   4.828 -12.936

  No H/Q in entry =          13
  In of MODEL   13
    1    HA   LEU  15           HA       LEU  15   3.089   4.855  -5.226
    2    HB2  LEU  15           HB2      LEU  15   3.292   7.471  -5.464
    3    HG   LEU  15           HG       LEU  15   2.204   6.085  -3.528
    4   HD12  LEU  15          HD11      LEU  15   1.086   8.813  -3.587
    5   HD11  LEU  15          HD12      LEU  15   2.825   8.676  -3.845
    6   HD13  LEU  15          HD13      LEU  15   2.098   8.022  -2.378
    7   HD21  LEU  15          HD21      LEU  15  -0.166   7.116  -5.057
    8   HD23  LEU  15          HD22      LEU  15  -0.235   6.786  -3.325
    9   HD22  LEU  15          HD23      LEU  15   0.133   5.484  -4.457
   10    H    LEU  15           HN       LEU  15   4.038   6.411  -7.493
   11    HB3  LEU  15           HB1      LEU  15   1.714   7.314  -6.212

  No H/Q in entry =          11
  In of MODEL   13
    1    HA   LYS  16           HA       LYS  16   0.273   2.781  -7.869
    2    HB2  LYS  16           HB2      LYS  16   0.731   1.383  -5.590
    3    HG2  LYS  16           HG2      LYS  16  -1.628   0.433  -7.086
    4    HD2  LYS  16           HD2      LYS  16   0.101  -0.778  -5.465
    5    HE2  LYS  16           HE2      LYS  16   1.902  -0.172  -7.267
    6    HZ2  LYS  16           HZ1      LYS  16   1.018  -1.087  -9.201
    7    HZ1  LYS  16           HZ2      LYS  16   0.530  -2.514  -8.434
    8    HZ3  LYS  16           HZ3      LYS  16   2.173  -2.225  -8.715
    9    H    LYS  16           HN       LYS  16   1.620   3.318  -5.466
   10    HB3  LYS  16           HB1      LYS  16  -0.971   1.774  -5.385
   11    HG3  LYS  16           HG1      LYS  16  -0.156   0.709  -8.020
   12    HD3  LYS  16           HD1      LYS  16  -0.672  -1.611  -6.816
   13    HE3  LYS  16           HE1      LYS  16   1.924  -1.743  -6.466

  No H/Q in entry =          13
  In of MODEL   13
    1    HA   PRO  17           HA       PRO  17  -3.228   5.442  -8.041
    2    HB2  PRO  17           HB2      PRO  17  -4.828   2.971  -8.511
    3    HG2  PRO  17           HG2      PRO  17  -3.527   2.260 -10.306
    4    HD2  PRO  17           HD2      PRO  17  -2.142   1.696  -8.550
    5    HB3  PRO  17           HB1      PRO  17  -4.756   4.462  -9.458
    6    HG3  PRO  17           HG1      PRO  17  -2.779   3.855 -10.509
    7    HD3  PRO  17           HD1      PRO  17  -1.054   2.836  -9.369

  No H/Q in entry =           7
  In of MODEL   13
    1    HA   ALA  18           HA       ALA  18  -4.942   5.254  -4.061
    2    HB3  ALA  18           HB1      ALA  18  -6.711   7.154  -5.584
    3    HB1  ALA  18           HB2      ALA  18  -5.399   7.548  -4.473
    4    HB2  ALA  18           HB3      ALA  18  -6.889   6.832  -3.860
    5    H    ALA  18           HN       ALA  18  -4.784   6.210  -6.685

  No H/Q in entry =           5
  In of MODEL   13
    1    HA3  GLY  19           HA2      GLY  19  -8.107   2.468  -2.820
    2    H    GLY  19           HN       GLY  19  -5.997   3.581  -3.227
    3    HA2  GLY  19           HA1      GLY  19  -8.508   2.721  -4.512

  No H/Q in entry =           3
  In of MODEL   13
    1    HA   THR  20           HA       THR  20  -5.877  -0.930  -4.820
    2    HB   THR  20           HB       THR  20  -3.180   0.293  -4.231
    3    HG1  THR  20           HG1      THR  20  -3.268   1.302  -6.105
    4   HG23  THR  20          HG21      THR  20  -2.243  -1.427  -5.276
    5   HG22  THR  20          HG22      THR  20  -3.454  -1.422  -6.558
    6   HG21  THR  20          HG23      THR  20  -3.782  -2.254  -5.038
    7    H    THR  20           HN       THR  20  -5.338   1.654  -3.527

  No H/Q in entry =           7
  In of MODEL   13
    1    HA   THR  21           HA       THR  21  -5.458  -2.894  -0.991
    2    HB   THR  21           HB       THR  21  -4.809  -5.429  -1.539
    3    HG1  THR  21           HG1      THR  21  -4.466  -5.520  -3.624
    4   HG23  THR  21          HG21      THR  21  -7.107  -5.973  -1.810
    5   HG22  THR  21          HG22      THR  21  -7.486  -4.343  -2.365
    6   HG21  THR  21          HG23      THR  21  -7.001  -4.615  -0.691
    7    H    THR  21           HN       THR  21  -5.352  -2.858  -3.832

  No H/Q in entry =           7
  In of MODEL   13
    1    HA   CYS  22           HA       CYS  22  -1.219  -2.425  -0.172
    2    HB2  CYS  22           HB2      CYS  22  -2.641  -2.332   2.114
    3    H    CYS  22           HN       CYS  22  -3.878  -3.014   0.486
    4    HB3  CYS  22           HB1      CYS  22  -1.724  -3.807   2.403

  No H/Q in entry =           4
  In of MODEL   13
    1    HA   TRP  23           HA       TRP  23  -0.796  -6.998  -0.645
    2    HB2  TRP  23           HB2      TRP  23   0.245  -6.377   1.717
    3    HD1  TRP  23           HD1      TRP  23   1.703  -7.181  -0.735
    4    HE1  TRP  23           HE1      TRP  23   3.217  -9.256  -0.899
    5    HE3  TRP  23           HE3      TRP  23  -0.201  -9.886   3.163
    6    HZ2  TRP  23           HZ2      TRP  23   3.559 -11.714   0.446
    7    HZ3  TRP  23           HZ3      TRP  23   0.775 -12.090   3.658
    8    HH2  TRP  23           HH2      TRP  23   2.616 -12.984   2.325
    9    H    TRP  23           HN       TRP  23  -2.652  -5.485   0.961
   10    HB3  TRP  23           HB1      TRP  23  -0.742  -7.735   2.247

  No H/Q in entry =          10
  In of MODEL   13
    1    HA   ARG  24           HA       ARG  24  -4.902  -8.850  -0.045
    2    HB2  ARG  24           HB2      ARG  24  -5.184  -7.809  -2.313
    3    HG2  ARG  24           HG2      ARG  24  -6.217 -10.483  -1.604
    4    HD2  ARG  24           HD2      ARG  24  -7.151  -9.397  -4.190
    5    HE   ARG  24           HE       ARG  24  -6.725 -12.192  -4.007
    6   HH11  ARG  24          HH11      ARG  24  -8.788  -9.641  -2.819
    7   HH12  ARG  24          HH12      ARG  24 -10.142 -10.688  -2.555
    8   HH21  ARG  24          HH21      ARG  24  -8.504 -13.571  -3.662
    9   HH22  ARG  24          HH22      ARG  24  -9.981 -12.919  -3.033
   10    H    ARG  24           HN       ARG  24  -2.889  -7.551  -1.536
   11    HB3  ARG  24           HB1      ARG  24  -4.326  -9.186  -2.992
   12    HG3  ARG  24           HG1      ARG  24  -7.080  -8.986  -1.960
   13    HD3  ARG  24           HD1      ARG  24  -5.596 -10.227  -4.196

  No H/Q in entry =          13
  In of MODEL   13
    1    HA   THR  25           HA       THR  25  -3.787 -13.082  -0.555
    2    HB   THR  25           HB       THR  25  -2.460 -13.693   1.563
    3    HG1  THR  25           HG1      THR  25  -2.191 -12.206   3.023
    4   HG21  THR  25          HG21      THR  25  -1.595 -12.666  -0.723
    5   HG23  THR  25          HG22      THR  25  -0.529 -12.953   0.653
    6   HG22  THR  25          HG23      THR  25  -1.159 -11.334   0.348
    7    H    THR  25           HN       THR  25  -4.990 -10.836   0.763

  No H/Q in entry =           7
  In of MODEL   13
    1    HA   SER  26           HA       SER  26  -6.995 -13.544   2.987
    2    HB2  SER  26           HB2      SER  26  -6.591 -15.811   3.900
    3    HG   SER  26           HG       SER  26  -4.523 -16.711   3.650
    4    H    SER  26           HN       SER  26  -4.380 -12.554   2.890
    5    HB3  SER  26           HB1      SER  26  -6.036 -15.659   2.233

  No H/Q in entry =           5
  In of MODEL   13
    1    HA   VAL  27           HA       VAL  27  -5.052 -13.278   7.249
    2    HB   VAL  27           HB       VAL  27  -2.759 -12.811   8.030
    3    H    VAL  27           HN       VAL  27  -3.880 -13.392   4.622

  No H/Q in entry =           3
  In of MODEL   13
    1    HA   SER  28           HA       SER  28  -4.570  -8.786   6.687
    2    HB2  SER  28           HB2      SER  28  -2.165  -9.047   5.707
    3    HG   SER  28           HG       SER  28  -2.034  -6.752   5.541
    4    H    SER  28           HN       SER  28  -3.887 -10.996   4.862
    5    HB3  SER  28           HB1      SER  28  -2.888  -8.419   4.226

  No H/Q in entry =           5
  In of MODEL   13
    1    HA   SER  29           HA       SER  29  -6.455  -7.043   2.840
    2    HB2  SER  29           HB2      SER  29  -7.961  -8.256   4.664
    3    HG   SER  29           HG       SER  29  -8.481  -7.858   2.418
    4    H    SER  29           HN       SER  29  -5.145  -6.729   5.316
    5    HB3  SER  29           HB1      SER  29  -8.505  -6.605   4.965

  No H/Q in entry =           5
  In of MODEL   13
    1    HA   HIS  30           HA       HIS  30  -5.995  -2.841   4.891
    2    HB2  HIS  30           HB2      HIS  30  -3.185  -3.352   3.906
    3    HD1  HIS  30           HD1      HIS  30  -2.337  -1.614   6.553
    4    HD2  HIS  30           HD2      HIS  30  -4.549  -5.127   6.367
    5    HE1  HIS  30           HE1      HIS  30  -2.089  -2.685   8.814
    6    HE2  HIS  30           HE2      HIS  30  -3.365  -4.851   8.650
    7    H    HIS  30           HN       HIS  30  -4.665  -5.221   4.096
    8    HB3  HIS  30           HB1      HIS  30  -3.743  -1.779   4.465

  No H/Q in entry =           8
  In of MODEL   13
    1    HA   TYR  31           HA       TYR  31  -5.634  -1.132   0.698
    2    HB2  TYR  31           HB2      TYR  31  -7.459   0.451   2.501
    3    HD1  TYR  31           HD1      TYR  31  -9.079  -1.010   3.252
    4    HD2  TYR  31           HD2      TYR  31  -7.630  -1.426  -0.727
    5    HE1  TYR  31           HE1      TYR  31 -10.715  -2.801   2.850
    6    HE2  TYR  31           HE2      TYR  31  -9.263  -3.217  -1.140
    7    HH   TYR  31           HH       TYR  31 -10.717  -4.922   1.048
    8    H    TYR  31           HN       TYR  31  -5.191  -0.744   3.553
    9    HB3  TYR  31           HB1      TYR  31  -7.360   0.757   0.771

  No H/Q in entry =           9
  In of MODEL   13
    1    HA   CYS  32           HA       CYS  32  -2.821   2.157   0.611
    2    HB2  CYS  32           HB2      CYS  32  -3.091   1.055  -1.837
    3    H    CYS  32           HN       CYS  32  -4.892   0.570  -0.592
    4    HB3  CYS  32           HB1      CYS  32  -3.628   2.694  -2.189

  No H/Q in entry =           4
  In of MODEL   13
    1    HA   THR  33           HA       THR  33  -5.203   5.836   0.484
    2    HB   THR  33           HB       THR  33  -3.549   7.818   0.966
    3    HG1  THR  33           HG1      THR  33  -1.851   5.589   1.377
    4   HG23  THR  33          HG21      THR  33  -3.825   7.431   3.150
    5   HG22  THR  33          HG22      THR  33  -3.151   5.804   3.054
    6   HG21  THR  33          HG23      THR  33  -4.830   6.091   2.599
    7    H    THR  33           HN       THR  33  -2.640   4.529  -0.126

  No H/Q in entry =           7
  In of MODEL   13
    1    HA3  GLY  34           HA2      GLY  34  -2.736   6.974  -3.754
    2    H    GLY  34           HN       GLY  34  -2.200   6.773  -1.206
    3    HA2  GLY  34           HA1      GLY  34  -3.843   8.207  -3.169

  No H/Q in entry =           3
  In of MODEL   13
    1    HA   ARG  35           HA       ARG  35  -0.329  10.772  -2.734
    2    HB2  ARG  35           HB2      ARG  35  -1.618  11.139  -0.067
    3    HG2  ARG  35           HG2      ARG  35  -1.798  13.504  -0.978
    4    HD2  ARG  35           HD2      ARG  35  -3.193  11.095  -2.021
    5    HE   ARG  35           HE       ARG  35  -3.795  12.245  -3.896
    6   HH11  ARG  35          HH11      ARG  35  -3.649  14.487  -1.226
    7   HH12  ARG  35          HH12      ARG  35  -4.289  15.811  -2.140
    8   HH21  ARG  35          HH21      ARG  35  -4.637  13.985  -5.100
    9   HH22  ARG  35          HH22      ARG  35  -4.851  15.526  -4.340
   10    H    ARG  35           HN       ARG  35  -2.143   9.193  -1.080
   11    HB3  ARG  35           HB1      ARG  35  -0.119  11.996  -0.397
   12    HG3  ARG  35           HG1      ARG  35  -1.261  12.831  -2.518
   13    HD3  ARG  35           HD1      ARG  35  -3.815  12.427  -1.048

  No H/Q in entry =          13
  In of MODEL   13
    1    HA   SER  36           HA       SER  36   2.640   8.450  -0.232
    2    HB2  SER  36           HB2      SER  36   0.886   8.204   2.220
    3    HG   SER  36           HG       SER  36   1.471  10.333   1.537
    4    H    SER  36           HN       SER  36  -0.302   8.461  -0.116
    5    HB3  SER  36           HB1      SER  36   2.607   7.817   2.206

  No H/Q in entry =           5
  In of MODEL   13
    1    HA   CYS  37           HA       CYS  37   1.798   4.097  -0.064
    2    HB2  CYS  37           HB2      CYS  37   4.630   4.747  -0.684
    3    H    CYS  37           HN       CYS  37   3.496   6.342   0.810
    4    HB3  CYS  37           HB1      CYS  37   4.246   3.053  -0.401

  No H/Q in entry =           4
  In of MODEL   13
    1    HA   GLU  38           HA       GLU  38   3.573   3.172   4.039
    2    HB2  GLU  38           HB2      GLU  38   3.306   4.593   6.016
    3    HG2  GLU  38           HG2      GLU  38   1.397   6.010   4.316
    4    H    GLU  38           HN       GLU  38   2.120   5.272   2.606
    5    HB3  GLU  38           HB1      GLU  38   4.046   5.482   4.692
    6    HG3  GLU  38           HG1      GLU  38   1.512   5.922   6.073

  No H/Q in entry =           6
  In of MODEL   13
    1    HA   CYS  39           HA       CYS  39  -0.446   1.297   4.340
    2    HB2  CYS  39           HB2      CYS  39   1.485  -0.566   4.113
    3    H    CYS  39           HN       CYS  39   2.339   1.396   4.226
    4    HB3  CYS  39           HB1      CYS  39   1.042  -0.811   5.799

  No H/Q in entry =           4
  In of MODEL   13
    1    HA   PRO  40           HA       PRO  40  -0.969   3.190   8.419
    2    HB2  PRO  40           HB2      PRO  40  -3.713   2.142   7.916
    3    HG2  PRO  40           HG2      PRO  40  -4.002   3.347   5.945
    4    HD2  PRO  40           HD2      PRO  40  -2.622   1.656   5.196
    5    HB3  PRO  40           HB1      PRO  40  -3.202   3.747   8.450
    6    HG3  PRO  40           HG1      PRO  40  -2.643   4.428   6.303
    7    HD3  PRO  40           HD1      PRO  40  -1.561   3.030   4.823

  No H/Q in entry =           7
  In of MODEL   13
    1    HA   SER  41           HA       SER  41  -1.589  -0.493  10.756
    2    HB2  SER  41           HB2      SER  41  -0.060   1.170  11.997
    3    HG   SER  41           HG       SER  41  -0.295  -1.074  12.556
    4    H    SER  41           HN       SER  41  -2.021   2.408  10.487
    5    HB3  SER  41           HB1      SER  41  -1.454   1.474  13.034

  No H/Q in entry =           5
  In of MODEL   13
    1    HA   TYR  42           HA       TYR  42  -5.812  -0.554  11.843
    2    HB2  TYR  42           HB2      TYR  42  -5.613   2.411  11.747
    3    HD1  TYR  42           HD1      TYR  42  -4.177   2.474  13.627
    4    HD2  TYR  42           HD2      TYR  42  -7.789   0.233  13.801
    5    HE1  TYR  42           HE1      TYR  42  -3.884   2.201  16.053
    6    HE2  TYR  42           HE2      TYR  42  -7.506  -0.046  16.227
    7    HH   TYR  42           HH       TYR  42  -6.362   1.026  18.084
    8    H    TYR  42           HN       TYR  42  -4.086   0.760   9.958
    9    HB3  TYR  42           HB1      TYR  42  -7.228   1.719  11.858

  No H/Q in entry =           9
  In of MODEL   13
    1    HA   PRO  43           HA       PRO  43  -7.103  -0.978   7.423
    2    HB2  PRO  43           HB2      PRO  43  -8.527  -3.217   8.774
    3    HG2  PRO  43           HG2      PRO  43  -6.574  -4.289   9.449
    4    HD2  PRO  43           HD2      PRO  43  -6.646  -2.571  10.988
    5    HB3  PRO  43           HB1      PRO  43  -7.625  -3.212   7.254
    6    HG3  PRO  43           HG1      PRO  43  -5.570  -3.362   8.319
    7    HD3  PRO  43           HD1      PRO  43  -5.095  -2.160  10.228

  No H/Q in entry =           7
  In of MODEL   13
    1    HA3  GLY  44           HA2      GLY  44 -11.025   0.232  10.092
    2    H    GLY  44           HN       GLY  44  -9.339  -1.902  10.026
    3    HA2  GLY  44           HA1      GLY  44 -11.558  -0.659   8.674

  No H/Q in entry =           3
  In of MODEL   13
    1    HA   ASN  45           HA       ASN  45 -13.527  -2.764  12.075
    2    HB2  ASN  45           HB2      ASN  45 -14.939  -0.486  11.851
    3   HD21  ASN  45          HD21      ASN  45 -17.514  -2.306  12.562
    4   HD22  ASN  45          HD22      ASN  45 -17.225  -2.616  14.236
    5    H    ASN  45           HN       ASN  45 -13.587  -0.864   9.846
    6    HB3  ASN  45           HB1      ASN  45 -16.100  -1.609  11.151

  No H/Q in entry =           6
  In of MODEL   13
    1    HA3  GLY  46           HA2      GLY  46 -14.704  -5.873   9.257
    2    H    GLY  46           HN       GLY  46 -12.972  -3.597   9.344
    3    HA2  GLY  46           HA1      GLY  46 -15.052  -4.742   7.958

  No H/Q in entry =           3
  In of MODEL   14
    1    H1   ALA   1           HT1      ALA   1  18.483  14.849  -4.536
    2    H2   ALA   1           HT3      ALA   1  17.494  16.024  -3.775
    3    H3   ALA   1           HT2      ALA   1  18.053  14.668  -2.884
    4    HA   ALA   1           HA       ALA   1  15.907  14.147  -3.346
    5    HB2  ALA   1           HB1      ALA   1  15.766  16.072  -5.035
    6    HB3  ALA   1           HB2      ALA   1  14.742  14.661  -5.300
    7    HB1  ALA   1           HB3      ALA   1  16.221  14.867  -6.239

  No H/Q in entry =           7
  In of MODEL   14
    1    HA   MET   2           HA       MET   2  17.162  10.430  -5.268
    2    HB2  MET   2           HB2      MET   2  18.834   9.128  -3.896
    3    H    MET   2           HN       MET   2  16.660  12.092  -2.903
    4    HG2  MET   2           HG2      MET   2  18.457  11.464  -2.074
    5    HE3  MET   2           HE1      MET   2  21.526  12.704  -0.913
    6    HB3  MET   2           HB1      MET   2  19.352  10.733  -4.393
    7    HE2  MET   2           HE2      MET   2  20.777  11.588   0.228
    8    HE1  MET   2           HE3      MET   2  19.769  12.581  -0.824
    9    HG3  MET   2           HG1      MET   2  18.583   9.751  -1.682

  No H/Q in entry =           9
  In of MODEL   14
    1    HA   ASP   3           HA       ASP   3  14.455   8.199  -2.475
    2    HB2  ASP   3           HB2      ASP   3  13.132  10.826  -1.801
    3    H    ASP   3           HN       ASP   3  14.786  10.878  -3.657
    4    HB3  ASP   3           HB1      ASP   3  12.501   9.278  -1.246

  No H/Q in entry =           4
  In of MODEL   14
    1    HA   CYS   4           HA       CYS   4  11.382   8.031  -5.627
    2    HB2  CYS   4           HB2      CYS   4  13.572   6.680  -6.447
    3    H    CYS   4           HN       CYS   4  13.545   6.931  -3.968
    4    HB3  CYS   4           HB1      CYS   4  12.462   5.334  -6.213

  No H/Q in entry =           4
  In of MODEL   14
    1    HA   THR   5           HA       THR   5   8.445   5.811  -3.366
    2    HB   THR   5           HB       THR   5   6.369   5.386  -4.786
    3    HG1  THR   5           HG1      THR   5   6.839   5.429  -6.839
    4   HG21  THR   5          HG21      THR   5   7.521   8.119  -4.418
    5   HG23  THR   5          HG22      THR   5   6.225   7.325  -3.525
    6   HG22  THR   5          HG23      THR   5   5.947   7.880  -5.176
    7    H    THR   5           HN       THR   5   9.370   7.110  -5.670

  No H/Q in entry =           7
  In of MODEL   14
    1    HA   THR   6           HA       THR   6   8.528   1.604  -4.541
    2    HB   THR   6           HB       THR   6  10.767   2.013  -5.236
    3    HG1  THR   6           HG1      THR   6  10.944   0.038  -3.214
    4   HG23  THR   6          HG21      THR   6  12.477   2.758  -4.001
    5   HG22  THR   6          HG22      THR   6  12.051   1.757  -2.613
    6   HG21  THR   6          HG23      THR   6  11.205   3.278  -2.897
    7    H    THR   6           HN       THR   6   9.063   3.834  -2.775

  No H/Q in entry =           7
  In of MODEL   14
    1    HA3  GLY   7           HA2      GLY   7   8.719  -1.330  -1.152
    2    H    GLY   7           HN       GLY   7   7.988  -0.226  -3.445
    3    HA2  GLY   7           HA1      GLY   7   7.789   0.031  -0.544

  No H/Q in entry =           3
  In of MODEL   14
    1    HA   PRO   8           HA       PRO   8   4.819  -3.501  -0.669
    2    HB2  PRO   8           HB2      PRO   8   3.370  -1.440   0.926
    3    HG2  PRO   8           HG2      PRO   8   4.951  -1.400   2.635
    4    HD2  PRO   8           HD2      PRO   8   6.063  -0.176   1.027
    5    HB3  PRO   8           HB1      PRO   8   3.553  -3.173   1.226
    6    HG3  PRO   8           HG1      PRO   8   5.683  -2.929   2.113
    7    HD3  PRO   8           HD1      PRO   8   7.234  -1.501   1.183

  No H/Q in entry =           7
  In of MODEL   14
    1    HA   CYS   9           HA       CYS   9   1.822  -0.797  -2.827
    2    HB2  CYS   9           HB2      CYS   9   1.105   0.378  -0.619
    3    H    CYS   9           HN       CYS   9   3.628  -0.133  -0.620
    4    HB3  CYS   9           HB1      CYS   9   1.811   1.817  -1.347

  No H/Q in entry =           4
  In of MODEL   14
    1    HA   CYS  10           HA       CYS  10   4.441   1.579  -5.385
    2    HB2  CYS  10           HB2      CYS  10   6.533   1.584  -3.208
    3    H    CYS  10           HN       CYS  10   4.609  -0.499  -3.366
    4    HB3  CYS  10           HB1      CYS  10   6.722   2.460  -4.723

  No H/Q in entry =           4
  In of MODEL   14
    1    HA   ARG  11           HA       ARG  11   6.997  -1.535  -7.121
    2    HB2  ARG  11           HB2      ARG  11   4.820  -0.711  -8.978
    3    HG2  ARG  11           HG2      ARG  11   5.721  -3.232  -7.667
    4    HD2  ARG  11           HD2      ARG  11   3.791  -3.146  -9.977
    5    HE   ARG  11           HE       ARG  11   4.002  -5.060  -8.078
    6   HH11  ARG  11          HH11      ARG  11   4.763  -4.977 -11.483
    7   HH12  ARG  11          HH12      ARG  11   4.448  -6.663 -11.721
    8   HH21  ARG  11          HH21      ARG  11   3.588  -7.277  -8.390
    9   HH22  ARG  11          HH22      ARG  11   3.781  -7.969  -9.966
   10    H    ARG  11           HN       ARG  11   5.166   0.760  -7.228
   11    HB3  ARG  11           HB1      ARG  11   6.179  -1.596  -9.657
   12    HG3  ARG  11           HG1      ARG  11   4.119  -2.490  -7.703
   13    HD3  ARG  11           HD1      ARG  11   5.466  -3.675 -10.123

  No H/Q in entry =          13
  In of MODEL   14
    1    HA   GLN  12           HA       GLN  12  10.951  -0.111  -8.289
    2    HB2  GLN  12           HB2      GLN  12   9.037   0.012 -10.544
    3    HG2  GLN  12           HG2      GLN  12  11.828  -1.037 -10.184
    4   HE21  GLN  12          HE21      GLN  12  12.957  -0.453 -11.931
    5   HE22  GLN  12          HE22      GLN  12  12.457  -0.713 -13.564
    6    H    GLN  12           HN       GLN  12   9.054  -1.003  -7.413
    7    HB3  GLN  12           HB1      GLN  12  10.467   1.026 -10.685
    8    HG3  GLN  12           HG1      GLN  12  10.339  -1.959 -10.389

  No H/Q in entry =           8
  In of MODEL   14
    1    HA   CYS  13           HA       CYS  13   9.439   4.237  -7.832
    2    HB2  CYS  13           HB2      CYS  13  10.363   4.222 -10.667
    3    H    CYS  13           HN       CYS  13   8.735   2.199  -9.786
    4    HB3  CYS  13           HB1      CYS  13   9.874   5.762  -9.968

  No H/Q in entry =           4
  In of MODEL   14
    1    HA   LYS  14           HA       LYS  14   5.385   5.224  -9.212
    2    HB2  LYS  14           HB2      LYS  14   5.098   2.417 -10.282
    3    HG2  LYS  14           HG2      LYS  14   5.737   5.058 -11.479
    4    HD2  LYS  14           HD2      LYS  14   4.427   2.853 -13.055
    5    HE2  LYS  14           HE2      LYS  14   4.274   4.600 -14.782
    6    HZ2  LYS  14           HZ1      LYS  14   6.613   4.672 -15.350
    7    HZ1  LYS  14           HZ2      LYS  14   6.199   3.133 -14.786
    8    HZ3  LYS  14           HZ3      LYS  14   7.042   4.202 -13.782
    9    H    LYS  14           HN       LYS  14   6.995   2.903  -8.428
   10    HB3  LYS  14           HB1      LYS  14   3.813   3.614 -10.384
   11    HG3  LYS  14           HG1      LYS  14   6.388   3.460 -11.847
   12    HD3  LYS  14           HD1      LYS  14   3.563   4.285 -12.491
   13    HE3  LYS  14           HE1      LYS  14   5.152   5.702 -13.723

  No H/Q in entry =          13
  In of MODEL   14
    1    HA   LEU  15           HA       LEU  15   3.199   3.707  -5.747
    2    HB2  LEU  15           HB2      LEU  15   3.546   6.306  -5.598
    3    HG   LEU  15           HG       LEU  15   2.707   4.598  -3.739
    4   HD12  LEU  15          HD11      LEU  15   2.362   6.695  -2.265
    5   HD11  LEU  15          HD12      LEU  15   2.791   7.588  -3.724
    6   HD13  LEU  15          HD13      LEU  15   3.929   6.432  -3.031
    7   HD23  LEU  15          HD21      LEU  15   0.536   5.720  -2.841
    8   HD22  LEU  15          HD22      LEU  15   0.429   4.470  -4.080
    9   HD21  LEU  15          HD23      LEU  15   0.293   6.170  -4.529
   10    H    LEU  15           HN       LEU  15   3.611   5.555  -7.980
   11    HB3  LEU  15           HB1      LEU  15   1.835   6.357  -5.977

  No H/Q in entry =          11
  In of MODEL   14
    1    HA   LYS  16           HA       LYS  16  -0.341   2.176  -7.797
    2    HB2  LYS  16           HB2      LYS  16  -0.013   0.920  -5.120
    3    HG2  LYS  16           HG2      LYS  16  -0.833  -0.627  -7.490
    4    HD2  LYS  16           HD2      LYS  16   1.188  -0.897  -5.280
    5    HE2  LYS  16           HE2      LYS  16   1.839  -1.794  -7.668
    6    HZ2  LYS  16           HZ1      LYS  16  -0.083  -3.047  -8.169
    7    HZ1  LYS  16           HZ2      LYS  16  -0.080  -3.817  -6.663
    8    HZ3  LYS  16           HZ3      LYS  16   1.125  -4.171  -7.795
    9    H    LYS  16           HN       LYS  16   1.525   2.368  -5.711
   10    HB3  LYS  16           HB1      LYS  16  -1.587   0.779  -5.891
   11    HG3  LYS  16           HG1      LYS  16   0.757   0.134  -7.565
   12    HD3  LYS  16           HD1      LYS  16  -0.263  -1.862  -5.559
   13    HE3  LYS  16           HE1      LYS  16   2.129  -2.755  -6.218

  No H/Q in entry =          13
  In of MODEL   14
    1    HA   PRO  17           HA       PRO  17  -3.517   5.121  -7.022
    2    HB2  PRO  17           HB2      PRO  17  -5.421   2.842  -7.289
    3    HG2  PRO  17           HG2      PRO  17  -4.609   2.179  -9.367
    4    HD2  PRO  17           HD2      PRO  17  -2.944   1.354  -8.000
    5    HB3  PRO  17           HB1      PRO  17  -5.402   4.397  -8.129
    6    HG3  PRO  17           HG1      PRO  17  -3.765   3.718  -9.626
    7    HD3  PRO  17           HD1      PRO  17  -1.948   2.466  -8.961

  No H/Q in entry =           7
  In of MODEL   14
    1    HA   ALA  18           HA       ALA  18  -4.356   4.719  -2.783
    2    HB1  ALA  18           HB1      ALA  18  -4.930   7.193  -3.576
    3    HB2  ALA  18           HB2      ALA  18  -5.290   6.615  -1.950
    4    HB3  ALA  18           HB3      ALA  18  -6.561   6.660  -3.171
    5    H    ALA  18           HN       ALA  18  -4.652   5.901  -5.305

  No H/Q in entry =           5
  In of MODEL   14
    1    HA3  GLY  19           HA2      GLY  19  -7.575   2.156  -1.373
    2    H    GLY  19           HN       GLY  19  -5.255   2.830  -2.241
    3    HA2  GLY  19           HA1      GLY  19  -8.039   2.316  -3.060

  No H/Q in entry =           3
  In of MODEL   14
    1    HA   THR  20           HA       THR  20  -6.156  -1.448  -4.239
    2    HB   THR  20           HB       THR  20  -3.423  -0.200  -4.590
    3    HG1  THR  20           HG1      THR  20  -4.054   0.321  -6.580
    4   HG23  THR  20          HG21      THR  20  -2.976  -2.453  -4.730
    5   HG22  THR  20          HG22      THR  20  -3.327  -2.033  -6.407
    6   HG21  THR  20          HG23      THR  20  -4.553  -2.831  -5.422
    7    H    THR  20           HN       THR  20  -5.441   1.248  -3.984

  No H/Q in entry =           7
  In of MODEL   14
    1    HA   THR  21           HA       THR  21  -4.661  -3.040  -0.492
    2    HB   THR  21           HB       THR  21  -5.051  -5.385  -0.307
    3    HG1  THR  21           HG1      THR  21  -4.922  -5.414  -3.135
    4   HG23  THR  21          HG21      THR  21  -7.250  -5.729  -1.249
    5   HG22  THR  21          HG22      THR  21  -7.022  -4.357  -2.333
    6   HG21  THR  21          HG23      THR  21  -7.109  -4.099  -0.590
    7    H    THR  21           HN       THR  21  -5.533  -3.298  -3.207

  No H/Q in entry =           7
  In of MODEL   14
    1    HA   CYS  22           HA       CYS  22  -0.457  -3.405  -1.851
    2    HB2  CYS  22           HB2      CYS  22   1.005  -2.338  -0.118
    3    H    CYS  22           HN       CYS  22  -2.584  -2.509  -0.163
    4    HB3  CYS  22           HB1      CYS  22  -0.230  -1.269  -0.775

  No H/Q in entry =           4
  In of MODEL   14
    1    HA   TRP  23           HA       TRP  23  -0.102  -6.815   1.096
    2    HB2  TRP  23           HB2      TRP  23   0.660  -5.191   2.847
    3    HD1  TRP  23           HD1      TRP  23   1.994  -7.719   2.493
    4    HE1  TRP  23           HE1      TRP  23   2.281  -9.547   4.282
    5    HE3  TRP  23           HE3      TRP  23  -1.797  -6.372   5.648
    6    HZ2  TRP  23           HZ2      TRP  23   1.063 -10.316   6.709
    7    HZ3  TRP  23           HZ3      TRP  23  -2.170  -7.707   7.681
    8    HH2  TRP  23           HH2      TRP  23  -0.769  -9.638   8.199
    9    H    TRP  23           HN       TRP  23  -1.868  -4.469   1.163
   10    HB3  TRP  23           HB1      TRP  23  -0.901  -5.385   3.639

  No H/Q in entry =          10
  In of MODEL   14
    1    HA   ARG  24           HA       ARG  24  -3.716  -8.898   2.483
    2    HB2  ARG  24           HB2      ARG  24  -4.995  -9.678   0.525
    3    HG2  ARG  24           HG2      ARG  24  -3.135  -8.388  -1.372
    4    HD2  ARG  24           HD2      ARG  24  -4.947 -10.796  -1.480
    5    HE   ARG  24           HE       ARG  24  -3.777 -11.223  -3.387
    6   HH11  ARG  24          HH11      ARG  24  -4.070  -7.764  -3.034
    7   HH12  ARG  24          HH12      ARG  24  -3.350  -7.420  -4.571
    8   HH21  ARG  24          HH21      ARG  24  -2.829 -10.774  -5.409
    9   HH22  ARG  24          HH22      ARG  24  -2.645  -9.129  -5.920
   10    H    ARG  24           HN       ARG  24  -1.253  -8.614   0.963
   11    HB3  ARG  24           HB1      ARG  24  -4.521  -7.992   0.376
   12    HG3  ARG  24           HG1      ARG  24  -2.707 -10.006  -0.809
   13    HD3  ARG  24           HD1      ARG  24  -5.303  -9.187  -2.109

  No H/Q in entry =          13
  In of MODEL   14
    1    HA   THR  25           HA       THR  25  -2.890 -13.246   1.268
    2    HB   THR  25           HB       THR  25  -2.696 -14.133   3.787
    3    HG1  THR  25           HG1      THR  25  -2.381 -11.331   4.051
    4   HG21  THR  25          HG21      THR  25  -0.884 -13.385   1.963
    5   HG23  THR  25          HG22      THR  25  -0.475 -13.856   3.613
    6   HG22  THR  25          HG23      THR  25  -0.608 -12.149   3.191
    7    H    THR  25           HN       THR  25  -4.605 -11.189   2.191

  No H/Q in entry =           7
  In of MODEL   14
    1    HA   SER  26           HA       SER  26  -7.318 -14.103   2.401
    2    HB2  SER  26           HB2      SER  26  -5.777 -15.117   4.740
    3    HG   SER  26           HG       SER  26  -7.116 -16.935   3.299
    4    H    SER  26           HN       SER  26  -5.422 -12.363   3.561
    5    HB3  SER  26           HB1      SER  26  -7.511 -15.438   4.702

  No H/Q in entry =           5
  In of MODEL   14
    1    HA   VAL  27           HA       VAL  27  -9.394 -12.018   5.883
    2    HB   VAL  27           HB       VAL  27  -7.637 -12.722   8.235
    3    H    VAL  27           HN       VAL  27  -6.840 -13.431   5.840

  No H/Q in entry =           3
  In of MODEL   14
    1    HA   SER  28           HA       SER  28  -6.421  -8.721   7.235
    2    HB2  SER  28           HB2      SER  28  -4.107  -8.626   7.702
    3    HG   SER  28           HG       SER  28  -3.156  -9.352   5.861
    4    H    SER  28           HN       SER  28  -5.973 -11.446   6.313
    5    HB3  SER  28           HB1      SER  28  -4.576 -10.274   8.118

  No H/Q in entry =           5
  In of MODEL   14
    1    HA   SER  29           HA       SER  29  -5.202  -7.133   3.326
    2    HB2  SER  29           HB2      SER  29  -7.807  -7.841   3.297
    3    HG   SER  29           HG       SER  29  -7.195  -6.169   1.207
    4    H    SER  29           HN       SER  29  -6.695  -7.115   5.848
    5    HB3  SER  29           HB1      SER  29  -7.972  -6.090   3.165

  No H/Q in entry =           5
  In of MODEL   14
    1    HA   HIS  30           HA       HIS  30  -5.040  -2.945   4.653
    2    HB2  HIS  30           HB2      HIS  30  -2.196  -3.762   4.030
    3    HD1  HIS  30           HD1      HIS  30  -0.811  -3.622   6.457
    4    HD2  HIS  30           HD2      HIS  30  -4.872  -4.496   6.537
    5    HE1  HIS  30           HE1      HIS  30  -1.223  -4.698   8.692
    6    HE2  HIS  30           HE2      HIS  30  -3.703  -5.139   8.753
    7    H    HIS  30           HN       HIS  30  -3.988  -5.368   3.362
    8    HB3  HIS  30           HB1      HIS  30  -2.656  -2.211   4.723

  No H/Q in entry =           8
  In of MODEL   14
    1    HA   TYR  31           HA       TYR  31  -5.083  -1.389   0.555
    2    HB2  TYR  31           HB2      TYR  31  -6.781   0.612   2.052
    3    HD1  TYR  31           HD1      TYR  31  -8.232  -0.541   3.480
    4    HD2  TYR  31           HD2      TYR  31  -7.560  -2.024  -0.451
    5    HE1  TYR  31           HE1      TYR  31 -10.032  -2.186   3.800
    6    HE2  TYR  31           HE2      TYR  31  -9.358  -3.673  -0.142
    7    HH   TYR  31           HH       TYR  31 -11.513  -3.782   1.391
    8    H    TYR  31           HN       TYR  31  -5.699  -1.347   3.390
    9    HB3  TYR  31           HB1      TYR  31  -6.784   0.289   0.321

  No H/Q in entry =           9
  In of MODEL   14
    1    HA   CYS  32           HA       CYS  32  -2.291   1.917   0.749
    2    HB2  CYS  32           HB2      CYS  32  -2.916   1.413  -1.827
    3    H    CYS  32           HN       CYS  32  -4.699   0.857  -0.469
    4    HB3  CYS  32           HB1      CYS  32  -3.339   3.120  -1.748

  No H/Q in entry =           4
  In of MODEL   14
    1    HA   THR  33           HA       THR  33  -4.302   5.667   1.765
    2    HB   THR  33           HB       THR  33  -2.419   5.824   3.182
    3    HG1  THR  33           HG1      THR  33  -2.059   8.032   3.249
    4   HG21  THR  33          HG21      THR  33  -0.824   6.717   0.795
    5   HG23  THR  33          HG22      THR  33  -0.629   5.222   1.709
    6   HG22  THR  33          HG23      THR  33  -0.258   6.772   2.465
    7    H    THR  33           HN       THR  33  -1.985   4.386   0.497

  No H/Q in entry =           7
  In of MODEL   14
    1    HA3  GLY  34           HA2      GLY  34  -2.487   7.076  -2.893
    2    H    GLY  34           HN       GLY  34  -1.891   6.115  -0.785
    3    HA2  GLY  34           HA1      GLY  34  -3.742   7.998  -2.079

  No H/Q in entry =           3
  In of MODEL   14
    1    HA   ARG  35           HA       ARG  35   0.357  10.254  -1.997
    2    HB2  ARG  35           HB2      ARG  35  -0.549   9.962   0.819
    3    HG2  ARG  35           HG2      ARG  35  -1.848  11.355  -0.672
    4    HD2  ARG  35           HD2      ARG  35   0.808  12.432  -1.342
    5    HE   ARG  35           HE       ARG  35   0.217  14.579  -0.873
    6   HH11  ARG  35          HH11      ARG  35  -2.640  12.863  -1.909
    7   HH12  ARG  35          HH12      ARG  35  -3.645  14.273  -1.893
    8   HH21  ARG  35          HH21      ARG  35  -1.104  16.434  -0.850
    9   HH22  ARG  35          HH22      ARG  35  -2.773  16.301  -1.292
   10    H    ARG  35           HN       ARG  35  -0.448   7.711  -0.907
   11    HB3  ARG  35           HB1      ARG  35   0.880  10.944   0.531
   12    HG3  ARG  35           HG1      ARG  35  -1.086  12.336   0.581
   13    HD3  ARG  35           HD1      ARG  35  -0.644  12.296  -2.332

  No H/Q in entry =          13
  In of MODEL   14
    1    HA   SER  36           HA       SER  36   3.827   7.774  -0.452
    2    HB2  SER  36           HB2      SER  36   2.772   7.629   2.376
    3    HG   SER  36           HG       SER  36   3.634   9.545   2.551
    4    H    SER  36           HN       SER  36   1.018   7.759   0.420
    5    HB3  SER  36           HB1      SER  36   4.420   7.177   1.941

  No H/Q in entry =           5
  In of MODEL   14
    1    HA   CYS  37           HA       CYS  37   3.477   3.493  -0.778
    2    HB2  CYS  37           HB2      CYS  37   6.200   3.477   0.538
    3    H    CYS  37           HN       CYS  37   4.969   5.712   0.214
    4    HB3  CYS  37           HB1      CYS  37   5.525   2.223  -0.497

  No H/Q in entry =           4
  In of MODEL   14
    1    HA   GLU  38           HA       GLU  38   3.889   2.261   3.836
    2    HB2  GLU  38           HB2      GLU  38   5.053   4.481   4.565
    3    HG2  GLU  38           HG2      GLU  38   3.239   3.312   6.641
    4    H    GLU  38           HN       GLU  38   4.387   4.636   2.394
    5    HB3  GLU  38           HB1      GLU  38   3.427   4.981   5.012
    6    HG3  GLU  38           HG1      GLU  38   4.609   2.409   5.997

  No H/Q in entry =           6
  In of MODEL   14
    1    HA   CYS  39           HA       CYS  39  -0.481   2.558   3.457
    2    HB2  CYS  39           HB2      CYS  39  -0.049  -0.308   4.312
    3    H    CYS  39           HN       CYS  39   2.025   1.219   3.984
    4    HB3  CYS  39           HB1      CYS  39  -1.475   0.367   3.532

  No H/Q in entry =           4
  In of MODEL   14
    1    HA   PRO  40           HA       PRO  40  -1.622   3.361   7.643
    2    HB2  PRO  40           HB2      PRO  40  -4.325   3.186   7.482
    3    HG2  PRO  40           HG2      PRO  40  -4.518   2.129   5.424
    4    HD2  PRO  40           HD2      PRO  40  -2.760   2.029   3.937
    5    HB3  PRO  40           HB1      PRO  40  -3.410   4.541   6.810
    6    HG3  PRO  40           HG1      PRO  40  -4.539   3.826   4.906
    7    HD3  PRO  40           HD1      PRO  40  -2.366   3.748   4.138

  No H/Q in entry =           7
  In of MODEL   14
    1    HA   SER  41           HA       SER  41  -2.871  -0.482   9.366
    2    HB2  SER  41           HB2      SER  41  -1.409   0.565  11.044
    3    HG   SER  41           HG       SER  41  -2.500  -1.445  11.533
    4    H    SER  41           HN       SER  41  -2.993   2.455   9.458
    5    HB3  SER  41           HB1      SER  41  -2.805   1.368  11.763

  No H/Q in entry =           5
  In of MODEL   14
    1    HA   TYR  42           HA       TYR  42  -7.202   0.412  10.300
    2    HB2  TYR  42           HB2      TYR  42  -6.951   2.416   8.118
    3    HD1  TYR  42           HD1      TYR  42  -9.895   2.935   9.874
    4    HD2  TYR  42           HD2      TYR  42  -5.675   3.107  10.392
    5    HE1  TYR  42           HE1      TYR  42 -10.194   4.508  11.740
    6    HE2  TYR  42           HE2      TYR  42  -5.963   4.680  12.260
    7    HH   TYR  42           HH       TYR  42  -8.873   6.263  12.900
    8    H    TYR  42           HN       TYR  42  -5.104   1.032   8.336
    9    HB3  TYR  42           HB1      TYR  42  -8.555   1.756   8.419

  No H/Q in entry =           9
  In of MODEL   14
    1    HA   PRO  43           HA       PRO  43  -7.589  -3.029   7.264
    2    HB2  PRO  43           HB2      PRO  43  -8.483  -4.844   9.073
    3    HG2  PRO  43           HG2      PRO  43  -8.601  -3.484  10.951
    4    HD2  PRO  43           HD2      PRO  43  -7.549  -1.436  11.040
    5    HB3  PRO  43           HB1      PRO  43  -6.766  -4.508   8.819
    6    HG3  PRO  43           HG1      PRO  43  -6.935  -4.072  11.098
    7    HD3  PRO  43           HD1      PRO  43  -6.034  -2.078  10.374

  No H/Q in entry =           7
  In of MODEL   14
    1    HA3  GLY  44           HA2      GLY  44 -11.951  -1.458   7.926
    2    H    GLY  44           HN       GLY  44  -9.792  -1.718   9.654
    3    HA2  GLY  44           HA1      GLY  44 -12.144  -3.007   8.731

  No H/Q in entry =           3
  In of MODEL   14
    1    HA   ASN  45           HA       ASN  45 -13.718  -0.990  12.197
    2    HB2  ASN  45           HB2      ASN  45 -14.703   0.790  10.003
    3   HD21  ASN  45          HD21      ASN  45 -13.977   1.602  13.313
    4   HD22  ASN  45          HD22      ASN  45 -12.466   2.379  12.997
    5    H    ASN  45           HN       ASN  45 -14.129  -2.033   9.561
    6    HB3  ASN  45           HB1      ASN  45 -15.363   0.986  11.624

  No H/Q in entry =           6
  In of MODEL   14
    1    HA3  GLY  46           HA2      GLY  46 -18.110  -2.114  11.819
    2    H    GLY  46           HN       GLY  46 -16.435  -0.622   9.928
    3    HA2  GLY  46           HA1      GLY  46 -18.690  -1.062  10.538

  No H/Q in entry =           3
  In of MODEL   15
    1    H1   ALA   1           HT3      ALA   1  19.567   9.354   0.847
    2    H2   ALA   1           HT2      ALA   1  20.668   8.482  -0.140
    3    H3   ALA   1           HT1      ALA   1  21.232   9.311   1.253
    4    HA   ALA   1           HA       ALA   1  20.950  11.356   0.327
    5    HB1  ALA   1           HB1      ALA   1  22.638   9.586  -0.788
    6    HB3  ALA   1           HB2      ALA   1  22.543  11.280  -1.269
    7    HB2  ALA   1           HB3      ALA   1  21.699  10.048  -2.207

  No H/Q in entry =           7
  In of MODEL   15
    1    HA   MET   2           HA       MET   2  17.752  11.105  -2.920
    2    HB2  MET   2           HB2      MET   2  19.362   9.638  -4.453
    3    H    MET   2           HN       MET   2  19.605   9.015  -2.007
    4    HG2  MET   2           HG2      MET   2  16.567   9.971  -5.453
    5    HE1  MET   2           HE1      MET   2  16.051   9.844  -7.434
    6    HB3  MET   2           HB1      MET   2  18.012   8.515  -4.366
    7    HE3  MET   2           HE2      MET   2  17.052   8.952  -8.580
    8    HE2  MET   2           HE3      MET   2  16.861  10.697  -8.747
    9    HG3  MET   2           HG1      MET   2  17.579  11.375  -5.121

  No H/Q in entry =           9
  In of MODEL   15
    1    HA   ASP   3           HA       ASP   3  14.603   8.132  -1.857
    2    HB2  ASP   3           HB2      ASP   3  14.258  10.616  -0.975
    3    H    ASP   3           HN       ASP   3  15.548  10.353  -3.531
    4    HB3  ASP   3           HB1      ASP   3  12.889  10.562  -2.080

  No H/Q in entry =           4
  In of MODEL   15
    1    HA   CYS   4           HA       CYS   4  11.600   7.891  -5.133
    2    HB2  CYS   4           HB2      CYS   4  13.715   6.228  -5.328
    3    H    CYS   4           HN       CYS   4  12.818   7.016  -2.633
    4    HB3  CYS   4           HB1      CYS   4  12.429   5.046  -5.109

  No H/Q in entry =           4
  In of MODEL   15
    1    HA   THR   5           HA       THR   5   8.118   6.398  -3.020
    2    HB   THR   5           HB       THR   5   6.148   6.291  -4.563
    3    HG1  THR   5           HG1      THR   5   6.443   6.315  -6.632
    4   HG21  THR   5          HG21      THR   5   7.340   8.512  -3.600
    5   HG23  THR   5          HG22      THR   5   5.826   8.503  -4.504
    6   HG22  THR   5          HG23      THR   5   7.344   8.853  -5.330
    7    H    THR   5           HN       THR   5   9.492   7.386  -5.251

  No H/Q in entry =           7
  In of MODEL   15
    1    HA   THR   6           HA       THR   6   7.954   2.155  -4.001
    2    HB   THR   6           HB       THR   6  10.213   2.171  -4.685
    3    HG1  THR   6           HG1      THR   6  10.411   0.154  -4.214
    4   HG21  THR   6          HG21      THR   6  10.771   3.078  -1.943
    5   HG23  THR   6          HG22      THR   6  11.553   3.499  -3.467
    6   HG22  THR   6          HG23      THR   6  11.953   1.983  -2.660
    7    H    THR   6           HN       THR   6   8.919   4.399  -2.396

  No H/Q in entry =           7
  In of MODEL   15
    1    HA3  GLY   7           HA2      GLY   7   7.713  -0.166  -0.225
    2    H    GLY   7           HN       GLY   7   6.965   0.644  -2.805
    3    HA2  GLY   7           HA1      GLY   7   6.458   1.053  -0.069

  No H/Q in entry =           3
  In of MODEL   15
    1    HA   PRO   8           HA       PRO   8   4.212  -2.979  -0.099
    2    HB2  PRO   8           HB2      PRO   8   2.120  -1.030   0.748
    3    HG2  PRO   8           HG2      PRO   8   3.237  -0.415   2.696
    4    HD2  PRO   8           HD2      PRO   8   4.477   0.747   1.138
    5    HB3  PRO   8           HB1      PRO   8   2.505  -2.625   1.406
    6    HG3  PRO   8           HG1      PRO   8   4.306  -1.829   2.634
    7    HD3  PRO   8           HD1      PRO   8   5.779  -0.281   1.772

  No H/Q in entry =           7
  In of MODEL   15
    1    HA   CYS   9           HA       CYS   9   1.173  -1.179  -3.128
    2    HB2  CYS   9           HB2      CYS   9   1.390   1.637  -2.106
    3    H    CYS   9           HN       CYS   9   2.682   0.111  -1.036
    4    HB3  CYS   9           HB1      CYS   9   0.579   1.305  -3.633

  No H/Q in entry =           4
  In of MODEL   15
    1    HA   CYS  10           HA       CYS  10   3.972   1.582  -5.838
    2    HB2  CYS  10           HB2      CYS  10   5.985   2.186  -3.662
    3    H    CYS  10           HN       CYS  10   3.610   1.427  -3.068
    4    HB3  CYS  10           HB1      CYS  10   6.065   2.752  -5.327

  No H/Q in entry =           4
  In of MODEL   15
    1    HA   ARG  11           HA       ARG  11   6.953  -1.647  -6.218
    2    HB2  ARG  11           HB2      ARG  11   5.225  -1.437  -8.672
    3    HG2  ARG  11           HG2      ARG  11   4.467  -2.422  -6.380
    4    HD2  ARG  11           HD2      ARG  11   5.421  -4.998  -7.445
    5    HE   ARG  11           HE       ARG  11   4.550  -3.994  -4.920
    6   HH11  ARG  11          HH11      ARG  11   6.492  -6.463  -6.440
    7   HH12  ARG  11          HH12      ARG  11   6.332  -7.576  -5.123
    8   HH21  ARG  11          HH21      ARG  11   4.339  -5.456  -3.186
    9   HH22  ARG  11          HH22      ARG  11   5.110  -7.005  -3.275
   10    H    ARG  11           HN       ARG  11   5.435   0.658  -7.247
   11    HB3  ARG  11           HB1      ARG  11   6.501  -2.641  -8.551
   12    HG3  ARG  11           HG1      ARG  11   4.064  -3.247  -7.887
   13    HD3  ARG  11           HD1      ARG  11   6.644  -3.989  -6.673

  No H/Q in entry =          13
  In of MODEL   15
    1    HA   GLN  12           HA       GLN  12   9.594  -0.023  -9.574
    2    HB2  GLN  12           HB2      GLN  12   7.364   0.273 -11.559
    3    HG2  GLN  12           HG2      GLN  12   8.790  -1.896 -10.888
    4   HE21  GLN  12          HE21      GLN  12   9.626  -0.195 -13.890
    5   HE22  GLN  12          HE22      GLN  12  11.280  -0.694 -13.912
    6    H    GLN  12           HN       GLN  12   6.687  -0.112  -9.414
    7    HB3  GLN  12           HB1      GLN  12   8.978   0.846 -11.957
    8    HG3  GLN  12           HG1      GLN  12   8.110  -1.626 -12.492

  No H/Q in entry =           8
  In of MODEL   15
    1    HA   CYS  13           HA       CYS  13   9.261   3.856  -7.017
    2    HB2  CYS  13           HB2      CYS  13  10.571   3.819  -9.684
    3    H    CYS  13           HN       CYS  13   9.042   1.699  -7.702
    4    HB3  CYS  13           HB1      CYS  13  10.213   5.398  -8.993

  No H/Q in entry =           4
  In of MODEL   15
    1    HA   LYS  14           HA       LYS  14   5.688   5.606  -8.971
    2    HB2  LYS  14           HB2      LYS  14   4.874   2.911 -10.070
    3    HG2  LYS  14           HG2      LYS  14   6.931   4.061 -11.044
    4    HD2  LYS  14           HD2      LYS  14   4.768   6.001 -11.758
    5    HE2  LYS  14           HE2      LYS  14   5.799   5.067 -13.861
    6    HZ3  LYS  14           HZ1      LYS  14   8.211   6.494 -12.881
    7    HZ2  LYS  14           HZ2      LYS  14   8.026   5.745 -14.386
    8    HZ1  LYS  14           HZ3      LYS  14   8.062   4.811 -12.976
    9    H    LYS  14           HN       LYS  14   6.745   2.973  -8.186
   10    HB3  LYS  14           HB1      LYS  14   4.024   4.416 -10.392
   11    HG3  LYS  14           HG1      LYS  14   5.648   3.589 -12.161
   12    HD3  LYS  14           HD1      LYS  14   6.410   6.317 -11.192
   13    HE3  LYS  14           HE1      LYS  14   5.963   6.807 -13.630

  No H/Q in entry =          13
  In of MODEL   15
    1    HA   LEU  15           HA       LEU  15   2.671   4.464  -6.007
    2    HB2  LEU  15           HB2      LEU  15   3.051   7.121  -6.261
    3    HG   LEU  15           HG       LEU  15   2.592   5.976  -4.109
    4   HD11  LEU  15          HD11      LEU  15   1.431   8.599  -4.855
    5   HD13  LEU  15          HD12      LEU  15   2.717   8.209  -3.712
    6   HD12  LEU  15          HD13      LEU  15   1.031   7.948  -3.266
    7   HD23  LEU  15          HD21      LEU  15   0.242   5.821  -3.358
    8   HD22  LEU  15          HD22      LEU  15   0.608   4.739  -4.702
    9   HD21  LEU  15          HD23      LEU  15  -0.279   6.235  -4.991
   10    H    LEU  15           HN       LEU  15   3.422   5.942  -8.436
   11    HB3  LEU  15           HB1      LEU  15   1.343   7.029  -6.648

  No H/Q in entry =          11
  In of MODEL   15
    1    HA   LYS  16           HA       LYS  16  -0.484   2.795  -8.576
    2    HB2  LYS  16           HB2      LYS  16  -0.433   1.536  -5.886
    3    HG2  LYS  16           HG2      LYS  16  -0.991   0.019  -8.360
    4    HD2  LYS  16           HD2      LYS  16   0.527  -0.321  -5.816
    5    HE2  LYS  16           HE2      LYS  16   2.221  -0.984  -7.313
    6    HZ1  LYS  16           HZ1      LYS  16   0.044  -2.200  -8.904
    7    HZ3  LYS  16           HZ2      LYS  16   1.661  -2.652  -9.111
    8    HZ2  LYS  16           HZ3      LYS  16   1.188  -1.053  -9.394
    9    H    LYS  16           HN       LYS  16   1.126   3.011  -6.298
   10    HB3  LYS  16           HB1      LYS  16  -1.923   1.385  -6.808
   11    HG3  LYS  16           HG1      LYS  16   0.606   0.755  -8.212
   12    HD3  LYS  16           HD1      LYS  16  -0.663  -1.386  -6.568
   13    HE3  LYS  16           HE1      LYS  16   1.418  -2.470  -6.809

  No H/Q in entry =          13
  In of MODEL   15
    1    HA   PRO  17           HA       PRO  17  -3.914   5.481  -7.943
    2    HB2  PRO  17           HB2      PRO  17  -6.059   3.954  -8.625
    3    HG2  PRO  17           HG2      PRO  17  -5.058   1.860  -8.591
    4    HD2  PRO  17           HD2      PRO  17  -2.766   1.602  -8.604
    5    HB3  PRO  17           HB1      PRO  17  -4.912   4.591  -9.809
    6    HG3  PRO  17           HG1      PRO  17  -4.763   2.318 -10.279
    7    HD3  PRO  17           HD1      PRO  17  -2.541   2.806  -9.890

  No H/Q in entry =           7
  In of MODEL   15
    1    HA   ALA  18           HA       ALA  18  -5.337   4.912  -3.892
    2    HB1  ALA  18           HB1      ALA  18  -5.818   7.284  -4.232
    3    HB2  ALA  18           HB2      ALA  18  -7.082   6.503  -3.281
    4    HB3  ALA  18           HB3      ALA  18  -7.357   6.867  -4.985
    5    H    ALA  18           HN       ALA  18  -5.356   6.128  -6.402

  No H/Q in entry =           5
  In of MODEL   15
    1    HA3  GLY  19           HA2      GLY  19  -8.509   2.050  -3.180
    2    H    GLY  19           HN       GLY  19  -6.026   2.847  -3.689
    3    HA2  GLY  19           HA1      GLY  19  -8.525   2.014  -4.937

  No H/Q in entry =           3
  In of MODEL   15
    1    HA   THR  20           HA       THR  20  -5.996  -1.548  -5.174
    2    HB   THR  20           HB       THR  20  -3.254  -0.513  -4.718
    3    HG1  THR  20           HG1      THR  20  -4.886   0.336  -6.872
    4   HG23  THR  20          HG21      THR  20  -3.255  -2.657  -5.594
    5   HG22  THR  20          HG22      THR  20  -2.982  -1.636  -7.006
    6   HG21  THR  20          HG23      THR  20  -4.583  -2.311  -6.701
    7    H    THR  20           HN       THR  20  -5.662   1.228  -5.017

  No H/Q in entry =           7
  In of MODEL   15
    1    HA   THR  21           HA       THR  21  -4.769  -2.613  -1.109
    2    HB   THR  21           HB       THR  21  -4.198  -5.213  -1.169
    3    HG1  THR  21           HG1      THR  21  -5.436  -4.790  -3.681
    4   HG23  THR  21          HG21      THR  21  -6.245  -4.651  -0.239
    5   HG22  THR  21          HG22      THR  21  -6.680  -5.655  -1.622
    6   HG21  THR  21          HG23      THR  21  -6.825  -3.901  -1.726
    7    H    THR  21           HN       THR  21  -4.427  -3.091  -3.987

  No H/Q in entry =           7
  In of MODEL   15
    1    HA   CYS  22           HA       CYS  22  -0.415  -2.517  -0.924
    2    HB2  CYS  22           HB2      CYS  22   0.300  -1.666   1.280
    3    H    CYS  22           HN       CYS  22  -3.069  -2.540   0.246
    4    HB3  CYS  22           HB1      CYS  22  -1.021  -0.719   0.605

  No H/Q in entry =           4
  In of MODEL   15
    1    HA   TRP  23           HA       TRP  23  -0.278  -6.516   1.221
    2    HB2  TRP  23           HB2      TRP  23   0.209  -5.128   3.281
    3    HD1  TRP  23           HD1      TRP  23   1.257  -7.875   2.115
    4    HE1  TRP  23           HE1      TRP  23   1.917  -9.775   3.721
    5    HE3  TRP  23           HE3      TRP  23  -1.377  -6.403   6.243
    6    HZ2  TRP  23           HZ2      TRP  23   1.390 -10.548   6.384
    7    HZ3  TRP  23           HZ3      TRP  23  -1.245  -7.779   8.278
    8    HH2  TRP  23           HH2      TRP  23   0.110  -9.809   8.346
    9    H    TRP  23           HN       TRP  23  -2.248  -4.368   1.455
   10    HB3  TRP  23           HB1      TRP  23  -1.352  -5.647   3.907

  No H/Q in entry =          10
  In of MODEL   15
    1    HA   ARG  24           HA       ARG  24  -4.160  -8.572   1.419
    2    HB2  ARG  24           HB2      ARG  24  -2.798  -9.120  -1.175
    3    HG2  ARG  24           HG2      ARG  24  -5.601  -8.269  -0.476
    4    HD2  ARG  24           HD2      ARG  24  -5.218  -7.563  -3.053
    5    HE   ARG  24           HE       ARG  24  -6.637  -9.736  -1.825
    6   HH11  ARG  24          HH11      ARG  24  -5.831  -8.204  -4.855
    7   HH12  ARG  24          HH12      ARG  24  -7.219  -8.826  -5.683
    8   HH21  ARG  24          HH21      ARG  24  -8.464 -10.555  -2.912
    9   HH22  ARG  24          HH22      ARG  24  -8.714 -10.160  -4.580
   10    H    ARG  24           HN       ARG  24  -1.410  -8.168   0.453
   11    HB3  ARG  24           HB1      ARG  24  -4.095 -10.199  -0.681
   12    HG3  ARG  24           HG1      ARG  24  -4.298  -7.215  -1.027
   13    HD3  ARG  24           HD1      ARG  24  -4.292  -9.062  -2.993

  No H/Q in entry =          13
  In of MODEL   15
    1    HA   THR  25           HA       THR  25  -2.941 -12.601   2.639
    2    HB   THR  25           HB       THR  25  -2.557 -12.383   5.263
    3    HG1  THR  25           HG1      THR  25  -2.267 -10.373   5.942
    4   HG21  THR  25          HG21      THR  25  -0.828 -12.710   3.430
    5   HG23  THR  25          HG22      THR  25  -0.296 -11.929   4.919
    6   HG22  THR  25          HG23      THR  25  -0.618 -10.960   3.480
    7    H    THR  25           HN       THR  25  -4.316 -10.047   2.966

  No H/Q in entry =           7
  In of MODEL   15
    1    HA   SER  26           HA       SER  26  -6.574 -13.922   4.674
    2    HB2  SER  26           HB2      SER  26  -5.313 -16.017   4.044
    3    HG   SER  26           HG       SER  26  -6.719 -17.358   5.207
    4    H    SER  26           HN       SER  26  -3.647 -13.984   4.755
    5    HB3  SER  26           HB1      SER  26  -4.804 -16.136   5.729

  No H/Q in entry =           5
  In of MODEL   15
    1    HA   VAL  27           HA       VAL  27  -6.066 -12.919   8.968
    2    HB   VAL  27           HB       VAL  27  -4.195 -11.530   9.967
    3    H    VAL  27           HN       VAL  27  -5.022 -12.094   6.342

  No H/Q in entry =           3
  In of MODEL   15
    1    HA   SER  28           HA       SER  28  -7.470  -8.717   7.786
    2    HB2  SER  28           HB2      SER  28  -4.708  -8.030   8.643
    3    HG   SER  28           HG       SER  28  -7.270  -7.368   9.670
    4    H    SER  28           HN       SER  28  -5.166 -10.208   6.890
    5    HB3  SER  28           HB1      SER  28  -5.736  -6.693   8.126

  No H/Q in entry =           5
  In of MODEL   15
    1    HA   SER  29           HA       SER  29  -5.908  -6.502   4.115
    2    HB2  SER  29           HB2      SER  29  -8.843  -6.573   4.586
    3    HG   SER  29           HG       SER  29  -7.470  -8.253   3.575
    4    H    SER  29           HN       SER  29  -7.131  -6.318   6.744
    5    HB3  SER  29           HB1      SER  29  -8.269  -5.555   3.266

  No H/Q in entry =           5
  In of MODEL   15
    1    HA   HIS  30           HA       HIS  30  -6.451  -2.104   4.581
    2    HB2  HIS  30           HB2      HIS  30  -3.667  -3.063   4.195
    3    HD1  HIS  30           HD1      HIS  30  -4.361   0.055   6.060
    4    HD2  HIS  30           HD2      HIS  30  -4.148  -4.022   6.833
    5    HE1  HIS  30           HE1      HIS  30  -4.257  -0.150   8.564
    6    HE2  HIS  30           HE2      HIS  30  -4.041  -2.621   9.005
    7    H    HIS  30           HN       HIS  30  -5.644  -4.482   3.084
    8    HB3  HIS  30           HB1      HIS  30  -3.947  -1.338   3.978

  No H/Q in entry =           8
  In of MODEL   15
    1    HA   TYR  31           HA       TYR  31  -5.584  -0.489   0.426
    2    HB2  TYR  31           HB2      TYR  31  -7.794   1.211   1.578
    3    HD1  TYR  31           HD1      TYR  31  -9.144  -0.048   3.008
    4    HD2  TYR  31           HD2      TYR  31  -7.767  -1.790  -0.622
    5    HE1  TYR  31           HE1      TYR  31 -10.603  -1.990   3.393
    6    HE2  TYR  31           HE2      TYR  31  -9.224  -3.735  -0.248
    7    HH   TYR  31           HH       TYR  31 -10.806  -4.300   2.739
    8    H    TYR  31           HN       TYR  31  -5.673  -0.077   3.297
    9    HB3  TYR  31           HB1      TYR  31  -7.569   0.718  -0.097

  No H/Q in entry =           9
  In of MODEL   15
    1    HA   CYS  32           HA       CYS  32  -3.010   2.970   1.059
    2    HB2  CYS  32           HB2      CYS  32  -2.968   2.098  -1.778
    3    H    CYS  32           HN       CYS  32  -4.281   0.968  -0.473
    4    HB3  CYS  32           HB1      CYS  32  -2.401   3.731  -1.447

  No H/Q in entry =           4
  In of MODEL   15
    1    HA   THR  33           HA       THR  33  -5.619   6.295  -0.095
    2    HB   THR  33           HB       THR  33  -4.896   8.324   0.929
    3    HG1  THR  33           HG1      THR  33  -2.697   8.697   1.381
    4   HG22  THR  33          HG21      THR  33  -3.256   7.093   2.807
    5   HG21  THR  33          HG22      THR  33  -4.346   5.828   2.238
    6   HG23  THR  33          HG23      THR  33  -5.002   7.327   2.897
    7    H    THR  33           HN       THR  33  -2.866   5.299   0.162

  No H/Q in entry =           7
  In of MODEL   15
    1    HA3  GLY  34           HA2      GLY  34  -2.329   6.638  -3.958
    2    H    GLY  34           HN       GLY  34  -2.439   6.363  -1.542
    3    HA2  GLY  34           HA1      GLY  34  -3.592   7.851  -3.816

  No H/Q in entry =           3
  In of MODEL   15
    1    HA   ARG  35           HA       ARG  35  -0.590  10.859  -2.810
    2    HB2  ARG  35           HB2      ARG  35  -2.227  11.143  -0.697
    3    HG2  ARG  35           HG2      ARG  35  -0.890  12.905  -2.060
    4    HD2  ARG  35           HD2      ARG  35   0.591  13.387   0.443
    5    HE   ARG  35           HE       ARG  35   0.699  14.499  -2.021
    6   HH11  ARG  35          HH11      ARG  35   3.018  12.761  -0.077
    7   HH12  ARG  35          HH12      ARG  35   4.385  13.593  -0.739
    8   HH21  ARG  35          HH21      ARG  35   2.495  15.595  -2.893
    9   HH22  ARG  35          HH22      ARG  35   4.088  15.203  -2.337
   10    H    ARG  35           HN       ARG  35  -2.285   9.013  -1.408
   11    HB3  ARG  35           HB1      ARG  35  -0.707  10.909   0.154
   12    HG3  ARG  35           HG1      ARG  35  -1.485  13.302  -0.447
   13    HD3  ARG  35           HD1      ARG  35   1.192  12.073  -0.567

  No H/Q in entry =          13
  In of MODEL   15
    1    HA   SER  36           HA       SER  36   2.748   8.354  -1.071
    2    HB2  SER  36           HB2      SER  36   1.717   7.463   1.603
    3    HG   SER  36           HG       SER  36   2.342   9.799   2.118
    4    H    SER  36           HN       SER  36  -0.147   8.154  -0.642
    5    HB3  SER  36           HB1      SER  36   3.301   8.112   1.180

  No H/Q in entry =           5
  In of MODEL   15
    1    HA   CYS  37           HA       CYS  37   2.578   4.106  -1.768
    2    HB2  CYS  37           HB2      CYS  37   5.125   4.147  -0.135
    3    H    CYS  37           HN       CYS  37   3.856   6.262  -0.407
    4    HB3  CYS  37           HB1      CYS  37   4.610   2.828  -1.182

  No H/Q in entry =           4
  In of MODEL   15
    1    HA   GLU  38           HA       GLU  38   2.389   2.499   2.741
    2    HB2  GLU  38           HB2      GLU  38   1.964   5.260   3.898
    3    HG2  GLU  38           HG2      GLU  38   4.297   3.561   4.600
    4    H    GLU  38           HN       GLU  38   3.024   4.994   1.581
    5    HB3  GLU  38           HB1      GLU  38   2.026   3.753   4.802
    6    HG3  GLU  38           HG1      GLU  38   4.354   4.504   3.112

  No H/Q in entry =           6
  In of MODEL   15
    1    HA   CYS  39           HA       CYS  39  -1.999   3.228   2.822
    2    HB2  CYS  39           HB2      CYS  39  -3.035   0.963   2.943
    3    H    CYS  39           HN       CYS  39   0.413   2.097   4.067
    4    HB3  CYS  39           HB1      CYS  39  -1.682   1.055   1.820

  No H/Q in entry =           4
  In of MODEL   15
    1    HA   PRO  40           HA       PRO  40  -2.053   3.149   7.557
    2    HB2  PRO  40           HB2      PRO  40  -2.103   5.831   7.960
    3    HG2  PRO  40           HG2      PRO  40  -1.978   6.552   5.756
    4    HD2  PRO  40           HD2      PRO  40  -1.328   5.146   4.051
    5    HB3  PRO  40           HB1      PRO  40  -0.600   4.908   7.845
    6    HG3  PRO  40           HG1      PRO  40  -0.252   6.468   6.156
    7    HD3  PRO  40           HD1      PRO  40   0.058   4.518   4.966

  No H/Q in entry =           7
  In of MODEL   15
    1    HA   SER  41           HA       SER  41  -6.201   4.414   7.936
    2    HB2  SER  41           HB2      SER  41  -5.913   3.513   5.407
    3    HG   SER  41           HG       SER  41  -8.320   4.090   6.789
    4    H    SER  41           HN       SER  41  -4.126   2.451   7.744
    5    HB3  SER  41           HB1      SER  41  -6.997   2.276   6.043

  No H/Q in entry =           5
  In of MODEL   15
    1    HA   TYR  42           HA       TYR  42  -5.430   0.896  11.206
    2    HB2  TYR  42           HB2      TYR  42  -8.027   2.198  10.587
    3    HD1  TYR  42           HD1      TYR  42  -8.268   1.010  13.777
    4    HD2  TYR  42           HD2      TYR  42  -5.957   3.777  11.517
    5    HE1  TYR  42           HE1      TYR  42  -7.750   2.250  15.836
    6    HE2  TYR  42           HE2      TYR  42  -5.431   5.024  13.571
    7    HH   TYR  42           HH       TYR  42  -7.045   4.439  16.541
    8    H    TYR  42           HN       TYR  42  -4.900   2.413   9.596
    9    HB3  TYR  42           HB1      TYR  42  -8.090   0.698  11.507

  No H/Q in entry =           9
  In of MODEL   15
    1    HA   PRO  43           HA       PRO  43  -6.151  -2.967   9.217
    2    HB2  PRO  43           HB2      PRO  43  -7.021  -4.524  11.262
    3    HG2  PRO  43           HG2      PRO  43  -7.540  -2.870  12.808
    4    HD2  PRO  43           HD2      PRO  43  -6.774  -0.709  12.581
    5    HB3  PRO  43           HB1      PRO  43  -5.343  -3.991  11.110
    6    HG3  PRO  43           HG1      PRO  43  -5.843  -3.168  13.227
    7    HD3  PRO  43           HD1      PRO  43  -5.119  -1.232  12.206

  No H/Q in entry =           7
  In of MODEL   15
    1    HA3  GLY  44           HA2      GLY  44 -10.542  -2.218   8.499
    2    H    GLY  44           HN       GLY  44  -7.851  -2.554   7.799
    3    HA2  GLY  44           HA1      GLY  44  -9.965  -2.769   6.933

  No H/Q in entry =           3
  In of MODEL   15
    1    HA   ASN  45           HA       ASN  45 -12.976  -5.464  10.091
    2    HB2  ASN  45           HB2      ASN  45 -12.921  -5.631   7.438
    3   HD21  ASN  45          HD21      ASN  45 -14.813  -5.656   9.271
    4   HD22  ASN  45          HD22      ASN  45 -15.717  -7.128   9.240
    5    H    ASN  45           HN       ASN  45 -11.907  -3.566   9.440
    6    HB3  ASN  45           HB1      ASN  45 -11.888  -7.015   7.787

  No H/Q in entry =           6
  In of MODEL   15
    1    HA3  GLY  46           HA2      GLY  46  -9.947  -8.005  11.880
    2    H    GLY  46           HN       GLY  46 -12.637  -7.766  10.773
    3    HA2  GLY  46           HA1      GLY  46 -11.360  -8.927  12.371

  No H/Q in entry =           3
  In of MODEL   16
    1    H1   ALA   1           HT1      ALA   1  13.416  14.554  -6.633
    2    H2   ALA   1           HT3      ALA   1  12.726  15.756  -5.624
    3    H3   ALA   1           HT2      ALA   1  13.466  16.203  -7.107
    4    HA   ALA   1           HA       ALA   1  15.561  15.769  -6.354
    5    HB1  ALA   1           HB1      ALA   1  15.148  17.799  -5.415
    6    HB3  ALA   1           HB2      ALA   1  15.439  16.872  -3.943
    7    HB2  ALA   1           HB3      ALA   1  13.787  17.208  -4.462

  No H/Q in entry =           7
  In of MODEL   16
    1    HA   MET   2           HA       MET   2  16.340  11.514  -5.231
    2    HB2  MET   2           HB2      MET   2  16.729  13.488  -3.001
    3    H    MET   2           HN       MET   2  15.789  13.469  -6.255
    4    HG2  MET   2           HG2      MET   2  18.691  11.660  -4.364
    5    HE2  MET   2           HE1      MET   2  21.547  12.003  -2.117
    6    HB3  MET   2           HB1      MET   2  16.946  11.766  -2.718
    7    HE1  MET   2           HE2      MET   2  20.936  11.451  -3.676
    8    HE3  MET   2           HE3      MET   2  20.145  10.936  -2.186
    9    HG3  MET   2           HG1      MET   2  18.409  13.338  -4.825

  No H/Q in entry =           9
  In of MODEL   16
    1    HA   ASP   3           HA       ASP   3  12.410  11.036  -3.031
    2    HB2  ASP   3           HB2      ASP   3  11.540  13.239  -3.974
    3    H    ASP   3           HN       ASP   3  13.571  12.206  -5.461
    4    HB3  ASP   3           HB1      ASP   3  10.891  12.297  -5.313

  No H/Q in entry =           4
  In of MODEL   16
    1    HA   CYS   4           HA       CYS   4  11.207   7.671  -5.570
    2    HB2  CYS   4           HB2      CYS   4  13.712   7.357  -5.420
    3    H    CYS   4           HN       CYS   4  12.368   8.881  -3.153
    4    HB3  CYS   4           HB1      CYS   4  13.432   6.410  -3.963

  No H/Q in entry =           4
  In of MODEL   16
    1    HA   THR   5           HA       THR   5   8.795   6.048  -2.250
    2    HB   THR   5           HB       THR   5   6.474   5.740  -3.004
    3    HG1  THR   5           HG1      THR   5   7.397   6.584  -5.546
    4   HG22  THR   5          HG21      THR   5   6.068   8.085  -3.927
    5   HG21  THR   5          HG22      THR   5   7.804   8.320  -3.725
    6   HG23  THR   5          HG23      THR   5   6.797   7.939  -2.328
    7    H    THR   5           HN       THR   5   9.280   6.940  -4.955

  No H/Q in entry =           7
  In of MODEL   16
    1    HA   THR   6           HA       THR   6   8.869   1.834  -3.462
    2    HB   THR   6           HB       THR   6  10.988   0.765  -2.555
    3    HG1  THR   6           HG1      THR   6  11.608   3.443  -1.869
    4   HG21  THR   6          HG21      THR   6  10.729   2.015  -4.815
    5   HG23  THR   6          HG22      THR   6  12.332   1.577  -4.224
    6   HG22  THR   6          HG23      THR   6  11.745   3.231  -4.041
    7    H    THR   6           HN       THR   6   9.455   4.088  -1.665

  No H/Q in entry =           7
  In of MODEL   16
    1    HA3  GLY   7           HA2      GLY   7   8.467  -1.084   0.004
    2    H    GLY   7           HN       GLY   7   8.343  -0.131  -2.452
    3    HA2  GLY   7           HA1      GLY   7   7.310   0.212   0.262

  No H/Q in entry =           3
  In of MODEL   16
    1    HA   PRO   8           HA       PRO   8   4.791  -3.487  -0.782
    2    HB2  PRO   8           HB2      PRO   8   2.682  -2.799   0.780
    3    HG2  PRO   8           HG2      PRO   8   3.420  -0.729   1.530
    4    HD2  PRO   8           HD2      PRO   8   5.623  -0.081   1.342
    5    HB3  PRO   8           HB1      PRO   8   4.104  -3.641   1.407
    6    HG3  PRO   8           HG1      PRO   8   4.090  -1.775   2.795
    7    HD3  PRO   8           HD1      PRO   8   6.232  -1.631   1.956

  No H/Q in entry =           7
  In of MODEL   16
    1    HA   CYS   9           HA       CYS   9   1.789  -0.535  -2.647
    2    HB2  CYS   9           HB2      CYS   9   1.553   0.882  -0.401
    3    H    CYS   9           HN       CYS   9   3.823  -0.088  -0.587
    4    HB3  CYS   9           HB1      CYS   9   2.214   2.150  -1.428

  No H/Q in entry =           4
  In of MODEL   16
    1    HA   CYS  10           HA       CYS  10   4.647   1.423  -5.345
    2    HB2  CYS  10           HB2      CYS  10   7.056   0.887  -3.597
    3    H    CYS  10           HN       CYS  10   4.635  -0.623  -3.255
    4    HB3  CYS  10           HB1      CYS  10   6.943   2.058  -4.906

  No H/Q in entry =           4
  In of MODEL   16
    1    HA   ARG  11           HA       ARG  11   6.277  -1.996  -7.478
    2    HB2  ARG  11           HB2      ARG  11   5.930   0.270  -9.412
    3    HG2  ARG  11           HG2      ARG  11   4.479  -2.243  -8.769
    4    HD2  ARG  11           HD2      ARG  11   5.237  -1.940 -11.326
    5    HE   ARG  11           HE       ARG  11   4.080  -0.229 -12.273
    6   HH11  ARG  11          HH11      ARG  11   2.078  -1.632  -9.783
    7   HH12  ARG  11          HH12      ARG  11   0.723  -0.610 -10.121
    8   HH21  ARG  11          HH21      ARG  11   2.299   1.117 -12.720
    9   HH22  ARG  11          HH22      ARG  11   0.847   0.951 -11.789
   10    H    ARG  11           HN       ARG  11   5.839   0.870  -7.196
   11    HB3  ARG  11           HB1      ARG  11   6.617  -1.256  -9.951
   12    HG3  ARG  11           HG1      ARG  11   3.853  -0.622  -9.074
   13    HD3  ARG  11           HD1      ARG  11   3.690  -2.637 -10.845

  No H/Q in entry =          13
  In of MODEL   16
    1    HA   GLN  12           HA       GLN  12  10.529  -0.658  -8.278
    2    HB2  GLN  12           HB2      GLN  12   9.648   0.496 -10.876
    3    HG2  GLN  12           HG2      GLN  12  10.183  -2.008 -10.214
    4   HE21  GLN  12          HE21      GLN  12  11.781  -3.587 -10.485
    5   HE22  GLN  12          HE22      GLN  12  13.461  -3.206 -10.360
    6    H    GLN  12           HN       GLN  12   8.009   0.573  -9.174
    7    HB3  GLN  12           HB1      GLN  12  11.331   0.719 -10.419
    8    HG3  GLN  12           HG1      GLN  12  10.521  -1.364 -11.820

  No H/Q in entry =           8
  In of MODEL   16
    1    HA   CYS  13           HA       CYS  13  10.135   3.631  -6.563
    2    HB2  CYS  13           HB2      CYS  13  11.906   3.679  -8.340
    3    H    CYS  13           HN       CYS  13   8.705   2.283  -8.545
    4    HB3  CYS  13           HB1      CYS  13  10.815   4.638  -9.333

  No H/Q in entry =           4
  In of MODEL   16
    1    HA   LYS  14           HA       LYS  14   6.517   5.950  -7.384
    2    HB2  LYS  14           HB2      LYS  14   4.662   5.213  -8.970
    3    HG2  LYS  14           HG2      LYS  14   6.546   2.906  -9.302
    4    HD2  LYS  14           HD2      LYS  14   4.371   3.275 -11.261
    5    HE2  LYS  14           HE2      LYS  14   5.996   1.346 -11.149
    6    HZ2  LYS  14           HZ1      LYS  14   8.092   2.132 -10.842
    7    HZ1  LYS  14           HZ2      LYS  14   7.843   3.531 -11.759
    8    HZ3  LYS  14           HZ3      LYS  14   8.094   2.048 -12.532
    9    H    LYS  14           HN       LYS  14   7.444   3.183  -7.297
   10    HB3  LYS  14           HB1      LYS  14   6.262   5.424  -9.667
   11    HG3  LYS  14           HG1      LYS  14   4.797   2.881  -9.072
   12    HD3  LYS  14           HD1      LYS  14   5.772   4.332 -11.451
   13    HE3  LYS  14           HE1      LYS  14   5.845   2.143 -12.715

  No H/Q in entry =          13
  In of MODEL   16
    1    HA   LEU  15           HA       LEU  15   3.495   4.094  -4.811
    2    HB2  LEU  15           HB2      LEU  15   3.510   6.776  -4.695
    3    HG   LEU  15           HG       LEU  15   1.914   6.701  -2.783
    4   HD12  LEU  15          HD11      LEU  15   1.728   3.758  -2.982
    5   HD11  LEU  15          HD12      LEU  15   0.685   4.698  -4.050
    6   HD13  LEU  15          HD13      LEU  15   0.595   4.927  -2.304
    7   HD21  LEU  15          HD21      LEU  15   4.303   5.010  -3.093
    8   HD23  LEU  15          HD22      LEU  15   3.287   4.647  -1.698
    9   HD22  LEU  15          HD23      LEU  15   3.946   6.269  -1.912
   10    H    LEU  15           HN       LEU  15   4.045   5.978  -6.999
   11    HB3  LEU  15           HB1      LEU  15   1.839   6.527  -5.163

  No H/Q in entry =          11
  In of MODEL   16
    1    HA   LYS  16           HA       LYS  16   0.518   2.274  -7.424
    2    HB2  LYS  16           HB2      LYS  16   0.435   1.087  -4.706
    3    HG2  LYS  16           HG2      LYS  16   0.143  -0.961  -6.420
    4    HD2  LYS  16           HD2      LYS  16   2.756   0.426  -5.827
    5    HE2  LYS  16           HE2      LYS  16   2.872  -1.395  -7.510
    6    HZ3  LYS  16           HZ1      LYS  16   2.595  -3.688  -6.552
    7    HZ2  LYS  16           HZ2      LYS  16   1.160  -2.856  -6.885
    8    HZ1  LYS  16           HZ3      LYS  16   1.715  -2.978  -5.292
    9    H    LYS  16           HN       LYS  16   1.926   2.641  -5.031
   10    HB3  LYS  16           HB1      LYS  16  -0.984   0.844  -5.715
   11    HG3  LYS  16           HG1      LYS  16   0.967   0.201  -7.463
   12    HD3  LYS  16           HD1      LYS  16   1.920  -0.684  -4.739
   13    HE3  LYS  16           HE1      LYS  16   3.765  -1.738  -6.029

  No H/Q in entry =          13
  In of MODEL   16
    1    HA   PRO  17           HA       PRO  17  -2.932   5.008  -7.375
    2    HB2  PRO  17           HB2      PRO  17  -4.584   2.604  -7.990
    3    HG2  PRO  17           HG2      PRO  17  -3.315   1.986  -9.841
    4    HD2  PRO  17           HD2      PRO  17  -1.924   1.283  -8.140
    5    HB3  PRO  17           HB1      PRO  17  -4.490   4.152  -8.837
    6    HG3  PRO  17           HG1      PRO  17  -2.537   3.576  -9.949
    7    HD3  PRO  17           HD1      PRO  17  -0.822   2.451  -8.897

  No H/Q in entry =           7
  In of MODEL   16
    1    HA   ALA  18           HA       ALA  18  -4.599   4.577  -3.392
    2    HB1  ALA  18           HB1      ALA  18  -5.022   6.970  -3.963
    3    HB2  ALA  18           HB2      ALA  18  -6.222   6.257  -2.885
    4    HB3  ALA  18           HB3      ALA  18  -6.597   6.486  -4.593
    5    H    ALA  18           HN       ALA  18  -4.446   5.714  -5.943

  No H/Q in entry =           5
  In of MODEL   16
    1    HA3  GLY  19           HA2      GLY  19  -8.202   2.212  -2.200
    2    H    GLY  19           HN       GLY  19  -6.049   3.259  -2.385
    3    HA2  GLY  19           HA1      GLY  19  -8.355   2.309  -3.948

  No H/Q in entry =           3
  In of MODEL   16
    1    HA   THR  20           HA       THR  20  -6.066  -1.362  -4.649
    2    HB   THR  20           HB       THR  20  -3.380  -0.005  -4.349
    3    HG1  THR  20           HG1      THR  20  -5.060  -0.413  -6.589
    4   HG23  THR  20          HG21      THR  20  -2.472  -1.771  -5.695
    5   HG22  THR  20          HG22      THR  20  -4.056  -2.537  -5.823
    6   HG21  THR  20          HG23      THR  20  -3.235  -2.462  -4.263
    7    H    THR  20           HN       THR  20  -5.541   1.358  -4.275

  No H/Q in entry =           7
  In of MODEL   16
    1    HA   THR  21           HA       THR  21  -5.757  -2.873  -0.587
    2    HB   THR  21           HB       THR  21  -5.402  -5.464  -0.798
    3    HG1  THR  21           HG1      THR  21  -6.055  -6.233  -2.827
    4   HG23  THR  21          HG21      THR  21  -7.726  -5.847  -1.151
    5   HG22  THR  21          HG22      THR  21  -7.916  -4.283  -1.945
    6   HG21  THR  21          HG23      THR  21  -7.548  -4.359  -0.221
    7    H    THR  21           HN       THR  21  -5.951  -3.101  -3.371

  No H/Q in entry =           7
  In of MODEL   16
    1    HA   CYS  22           HA       CYS  22  -1.472  -3.351  -0.053
    2    HB2  CYS  22           HB2      CYS  22  -2.714  -2.716   2.256
    3    H    CYS  22           HN       CYS  22  -4.189  -3.908   0.845
    4    HB3  CYS  22           HB1      CYS  22  -1.968  -4.238   2.731

  No H/Q in entry =           4
  In of MODEL   16
    1    HA   TRP  23           HA       TRP  23  -1.317  -7.875   0.533
    2    HB2  TRP  23           HB2      TRP  23  -0.254  -7.207   2.745
    3    HD1  TRP  23           HD1      TRP  23   0.567  -9.262   0.618
    4    HE1  TRP  23           HE1      TRP  23   1.387 -11.616   1.256
    5    HE3  TRP  23           HE3      TRP  23  -1.494  -9.603   5.285
    6    HZ2  TRP  23           HZ2      TRP  23   1.187 -13.384   3.448
    7    HZ3  TRP  23           HZ3      TRP  23  -1.132 -11.659   6.586
    8    HH2  TRP  23           HH2      TRP  23   0.180 -13.511   5.685
    9    H    TRP  23           HN       TRP  23  -2.898  -5.887   2.013
   10    HB3  TRP  23           HB1      TRP  23  -1.645  -7.946   3.533

  No H/Q in entry =          10
  In of MODEL   16
    1    HA   ARG  24           HA       ARG  24  -4.958 -10.219   1.414
    2    HB2  ARG  24           HB2      ARG  24  -4.113 -11.152  -1.328
    3    HG2  ARG  24           HG2      ARG  24  -5.908  -9.243  -1.876
    4    HD2  ARG  24           HD2      ARG  24  -3.991  -7.783  -2.466
    5    HE   ARG  24           HE       ARG  24  -3.025 -10.340  -3.340
    6   HH11  ARG  24          HH11      ARG  24  -5.580  -7.988  -3.686
    7   HH12  ARG  24          HH12      ARG  24  -6.017  -8.512  -5.278
    8   HH21  ARG  24          HH21      ARG  24  -3.598 -11.030  -5.434
    9   HH22  ARG  24          HH22      ARG  24  -4.892 -10.239  -6.270
   10    H    ARG  24           HN       ARG  24  -2.234  -9.911   0.341
   11    HB3  ARG  24           HB1      ARG  24  -5.738 -11.122  -0.658
   12    HG3  ARG  24           HG1      ARG  24  -5.120  -8.514  -0.475
   13    HD3  ARG  24           HD1      ARG  24  -2.930  -8.879  -1.580

  No H/Q in entry =          13
  In of MODEL   16
    1    HA   THR  25           HA       THR  25  -4.049 -14.524   1.755
    2    HB   THR  25           HB       THR  25  -3.059 -14.647   4.233
    3    HG1  THR  25           HG1      THR  25  -3.515 -12.552   4.827
    4   HG23  THR  25          HG21      THR  25  -0.966 -14.579   3.355
    5   HG22  THR  25          HG22      THR  25  -1.312 -13.176   2.344
    6   HG21  THR  25          HG23      THR  25  -1.903 -14.770   1.874
    7    H    THR  25           HN       THR  25  -5.263 -12.045   2.505

  No H/Q in entry =           7
  In of MODEL   16
    1    HA   SER  26           HA       SER  26  -8.667 -14.019   3.214
    2    HB2  SER  26           HB2      SER  26  -7.197 -16.505   4.119
    3    HG   SER  26           HG       SER  26  -8.612 -16.111   1.696
    4    H    SER  26           HN       SER  26  -6.692 -13.420   2.260
    5    HB3  SER  26           HB1      SER  26  -8.938 -16.318   3.909

  No H/Q in entry =           5
  In of MODEL   16
    1    HA   VAL  27           HA       VAL  27  -8.679 -12.704   7.305
    2    HB   VAL  27           HB       VAL  27  -6.524 -13.859   7.527
    3    H    VAL  27           HN       VAL  27  -7.852 -12.172   4.687

  No H/Q in entry =           3
  In of MODEL   16
    1    HA   SER  28           HA       SER  28  -8.158  -8.342   5.955
    2    HB2  SER  28           HB2      SER  28  -6.701  -8.284   7.860
    3    HG   SER  28           HG       SER  28  -5.143  -6.502   6.896
    4    H    SER  28           HN       SER  28  -6.666 -10.682   5.241
    5    HB3  SER  28           HB1      SER  28  -5.286  -8.610   6.860

  No H/Q in entry =           5
  In of MODEL   16
    1    HA   SER  29           HA       SER  29  -6.287  -7.431   2.099
    2    HB2  SER  29           HB2      SER  29  -8.780  -5.833   1.704
    3    HG   SER  29           HG       SER  29  -9.707  -7.550   2.678
    4    H    SER  29           HN       SER  29  -8.186  -6.951   4.292
    5    HB3  SER  29           HB1      SER  29  -7.944  -6.905   0.581

  No H/Q in entry =           5
  In of MODEL   16
    1    HA   HIS  30           HA       HIS  30  -7.057  -2.830   4.639
    2    HB2  HIS  30           HB2      HIS  30  -4.536  -4.099   3.720
    3    HD1  HIS  30           HD1      HIS  30  -3.627  -5.062   5.792
    4    HD2  HIS  30           HD2      HIS  30  -5.681  -1.524   6.520
    5    HE1  HIS  30           HE1      HIS  30  -3.458  -4.685   8.272
    6    HE2  HIS  30           HE2      HIS  30  -4.780  -2.583   8.700
    7    H    HIS  30           HN       HIS  30  -7.656  -4.977   4.188
    8    HB3  HIS  30           HB1      HIS  30  -4.558  -2.339   3.774

  No H/Q in entry =           8
  In of MODEL   16
    1    HA   TYR  31           HA       TYR  31  -6.330  -0.783   0.593
    2    HB2  TYR  31           HB2      TYR  31  -8.119   0.645   2.542
    3    HD1  TYR  31           HD1      TYR  31 -10.303  -0.146   2.584
    4    HD2  TYR  31           HD2      TYR  31  -7.803  -1.157  -0.706
    5    HE1  TYR  31           HE1      TYR  31 -12.046  -1.657   1.732
    6    HE2  TYR  31           HE2      TYR  31  -9.540  -2.670  -1.568
    7    HH   TYR  31           HH       TYR  31 -12.294  -2.703  -1.214
    8    H    TYR  31           HN       TYR  31  -5.826  -0.833   3.432
    9    HB3  TYR  31           HB1      TYR  31  -7.868   1.279   0.919

  No H/Q in entry =           9
  In of MODEL   16
    1    HA   CYS  32           HA       CYS  32  -2.905   1.862   1.267
    2    HB2  CYS  32           HB2      CYS  32  -3.364   1.333  -1.610
    3    H    CYS  32           HN       CYS  32  -4.710   0.340  -0.240
    4    HB3  CYS  32           HB1      CYS  32  -2.453   2.790  -1.232

  No H/Q in entry =           4
  In of MODEL   16
    1    HA   THR  33           HA       THR  33  -5.051   5.611   1.642
    2    HB   THR  33           HB       THR  33  -3.402   5.852   3.416
    3    HG1  THR  33           HG1      THR  33  -3.431   8.208   1.845
    4   HG22  THR  33          HG21      THR  33  -1.475   7.361   1.799
    5   HG21  THR  33          HG22      THR  33  -1.462   5.613   1.564
    6   HG23  THR  33          HG23      THR  33  -1.219   6.288   3.175
    7    H    THR  33           HN       THR  33  -2.731   3.993   1.729

  No H/Q in entry =           7
  In of MODEL   16
    1    HA3  GLY  34           HA2      GLY  34  -2.140   5.991  -2.665
    2    H    GLY  34           HN       GLY  34  -2.253   5.313  -0.429
    3    HA2  GLY  34           HA1      GLY  34  -3.568   6.984  -2.413

  No H/Q in entry =           3
  In of MODEL   16
    1    HA   ARG  35           HA       ARG  35   0.050   9.641  -1.520
    2    HB2  ARG  35           HB2      ARG  35  -1.494  10.243   0.295
    3    HG2  ARG  35           HG2      ARG  35   1.067  10.906   1.589
    4    HD2  ARG  35           HD2      ARG  35  -1.491  12.181   0.874
    5    HE   ARG  35           HE       ARG  35   0.805  13.543   0.107
    6   HH11  ARG  35          HH11      ARG  35  -1.934  14.051   2.209
    7   HH12  ARG  35          HH12      ARG  35  -1.912  15.773   2.028
    8   HH21  ARG  35          HH21      ARG  35   0.836  15.807  -0.132
    9   HH22  ARG  35          HH22      ARG  35  -0.340  16.770   0.698
   10    H    ARG  35           HN       ARG  35  -0.841   7.151  -0.251
   11    HB3  ARG  35           HB1      ARG  35  -0.523   9.313   1.429
   12    HG3  ARG  35           HG1      ARG  35   0.900  11.398  -0.098
   13    HD3  ARG  35           HD1      ARG  35  -0.491  12.371   2.314

  No H/Q in entry =          13
  In of MODEL   16
    1    HA   SER  36           HA       SER  36   3.573   7.421   0.282
    2    HB2  SER  36           HB2      SER  36   2.253   7.504   2.951
    3    HG   SER  36           HG       SER  36   4.162   8.800   3.325
    4    H    SER  36           HN       SER  36   0.717   7.204   0.957
    5    HB3  SER  36           HB1      SER  36   3.780   6.631   2.826

  No H/Q in entry =           5
  In of MODEL   16
    1    HA   CYS  37           HA       CYS  37   3.443   3.140  -0.200
    2    HB2  CYS  37           HB2      CYS  37   6.030   3.995  -0.337
    3    H    CYS  37           HN       CYS  37   4.820   5.471   0.697
    4    HB3  CYS  37           HB1      CYS  37   6.142   2.772   0.924

  No H/Q in entry =           4
  In of MODEL   16
    1    HA   GLU  38           HA       GLU  38   4.445   2.055   4.425
    2    HB2  GLU  38           HB2      GLU  38   3.493   4.822   5.180
    3    HG2  GLU  38           HG2      GLU  38   6.103   3.511   5.873
    4    H    GLU  38           HN       GLU  38   4.362   4.386   2.903
    5    HB3  GLU  38           HB1      GLU  38   3.783   3.529   6.336
    6    HG3  GLU  38           HG1      GLU  38   5.897   4.549   4.463

  No H/Q in entry =           6
  In of MODEL   16
    1    HA   CYS  39           HA       CYS  39   0.129   1.293   4.651
    2    HB2  CYS  39           HB2      CYS  39   1.551  -0.819   3.753
    3    H    CYS  39           HN       CYS  39   2.950   0.719   5.277
    4    HB3  CYS  39           HB1      CYS  39   0.941  -1.490   5.262

  No H/Q in entry =           4
  In of MODEL   16
    1    HA   PRO  40           HA       PRO  40   0.289   1.748   9.237
    2    HB2  PRO  40           HB2      PRO  40  -2.493   2.570   8.535
    3    HG2  PRO  40           HG2      PRO  40  -1.801   4.377   7.239
    4    HD2  PRO  40           HD2      PRO  40  -1.351   2.654   5.778
    5    HB3  PRO  40           HB1      PRO  40  -1.340   3.329   9.640
    6    HG3  PRO  40           HG1      PRO  40  -0.165   4.353   7.922
    7    HD3  PRO  40           HD1      PRO  40   0.309   3.260   5.953

  No H/Q in entry =           7
  In of MODEL   16
    1    HA   SER  41           HA       SER  41  -2.503  -1.587   9.990
    2    HB2  SER  41           HB2      SER  41  -1.145  -0.959  12.620
    3    HG   SER  41           HG       SER  41   0.411  -1.590  11.271
    4    H    SER  41           HN       SER  41  -1.254   0.916  10.917
    5    HB3  SER  41           HB1      SER  41  -2.047  -2.442  12.305

  No H/Q in entry =           5
  In of MODEL   16
    1    HA   TYR  42           HA       TYR  42  -6.329  -0.451  11.568
    2    HB2  TYR  42           HB2      TYR  42  -4.689   1.775  12.140
    3    HD1  TYR  42           HD1      TYR  42  -8.094   0.351  12.584
    4    HD2  TYR  42           HD2      TYR  42  -4.755   2.230  14.434
    5    HE1  TYR  42           HE1      TYR  42  -9.103  -0.044  14.791
    6    HE2  TYR  42           HE2      TYR  42  -5.754   1.838  16.647
    7    HH   TYR  42           HH       TYR  42  -8.703   1.334  17.272
    8    H    TYR  42           HN       TYR  42  -4.361  -0.053   9.621
    9    HB3  TYR  42           HB1      TYR  42  -6.219   2.423  11.559

  No H/Q in entry =           9
  In of MODEL   16
    1    HA   PRO  43           HA       PRO  43  -8.151   2.489   8.191
    2    HB2  PRO  43           HB2      PRO  43  -6.404   3.477   6.340
    3    HG2  PRO  43           HG2      PRO  43  -4.420   2.681   7.242
    4    HD2  PRO  43           HD2      PRO  43  -4.287   1.905   9.413
    5    HB3  PRO  43           HB1      PRO  43  -6.846   4.336   7.819
    6    HG3  PRO  43           HG1      PRO  43  -4.540   4.236   8.087
    7    HD3  PRO  43           HD1      PRO  43  -5.243   3.255  10.057

  No H/Q in entry =           7
  In of MODEL   16
    1    HA3  GLY  44           HA2      GLY  44  -7.585  -0.692   5.187
    2    H    GLY  44           HN       GLY  44  -8.473   0.049   7.907
    3    HA2  GLY  44           HA1      GLY  44  -7.674  -1.867   6.490

  No H/Q in entry =           3
  In of MODEL   16
    1    HA   ASN  45           HA       ASN  45 -12.045  -1.689   5.684
    2    HB2  ASN  45           HB2      ASN  45 -11.116  -3.709   4.600
    3   HD21  ASN  45          HD21      ASN  45 -13.177  -2.706   3.805
    4   HD22  ASN  45          HD22      ASN  45 -14.616  -3.649   3.963
    5    H    ASN  45           HN       ASN  45  -9.730  -2.514   7.274
    6    HB3  ASN  45           HB1      ASN  45 -11.269  -4.581   6.122

  No H/Q in entry =           6
  In of MODEL   16
    1    HA3  GLY  46           HA2      GLY  46 -15.525  -2.841   8.409
    2    H    GLY  46           HN       GLY  46 -14.109  -2.406   6.635
    3    HA2  GLY  46           HA1      GLY  46 -14.137  -3.415   9.323

  No H/Q in entry =           3
  In of MODEL   17
    1    H1   ALA   1           HT3      ALA   1  13.976   6.567   2.851
    2    H2   ALA   1           HT2      ALA   1  13.478   5.336   1.764
    3    H3   ALA   1           HT1      ALA   1  14.986   5.210   2.573
    4    HA   ALA   1           HA       ALA   1  15.843   7.048   1.419
    5    HB3  ALA   1           HB1      ALA   1  14.536   5.470  -0.744
    6    HB1  ALA   1           HB2      ALA   1  15.603   4.647   0.394
    7    HB2  ALA   1           HB3      ALA   1  16.215   5.984  -0.579

  No H/Q in entry =           7
  In of MODEL   17
    1    HA   MET   2           HA       MET   2  12.756   9.253  -1.028
    2    HB2  MET   2           HB2      MET   2  15.019  10.857   0.064
    3    H    MET   2           HN       MET   2  15.503   8.318  -0.716
    4    HG2  MET   2           HG2      MET   2  12.076  10.668   0.539
    5    HE1  MET   2           HE1      MET   2  11.371  12.694  -0.537
    6    HB3  MET   2           HB1      MET   2  13.890  11.658  -1.019
    7    HE3  MET   2           HE2      MET   2  11.409  14.291   0.209
    8    HE2  MET   2           HE3      MET   2  10.531  12.975   0.988
    9    HG3  MET   2           HG1      MET   2  13.406  10.483   1.681

  No H/Q in entry =           9
  In of MODEL   17
    1    HA   ASP   3           HA       ASP   3  13.275  11.779  -4.917
    2    HB2  ASP   3           HB2      ASP   3  15.705  11.823  -3.903
    3    H    ASP   3           HN       ASP   3  12.944  11.238  -2.733
    4    HB3  ASP   3           HB1      ASP   3  15.933  10.401  -4.917

  No H/Q in entry =           4
  In of MODEL   17
    1    HA   CYS   4           HA       CYS   4  11.837   8.181  -6.884
    2    HB2  CYS   4           HB2      CYS   4  14.036   7.249  -5.568
    3    H    CYS   4           HN       CYS   4  11.934   9.348  -4.341
    4    HB3  CYS   4           HB1      CYS   4  12.832   6.051  -5.108

  No H/Q in entry =           4
  In of MODEL   17
    1    HA   THR   5           HA       THR   5   9.559   6.969  -2.225
    2    HB   THR   5           HB       THR   5   7.687   7.091  -4.522
    3    HG1  THR   5           HG1      THR   5   8.888   9.439  -3.487
    4   HG21  THR   5          HG21      THR   5   7.363   7.121  -1.823
    5   HG23  THR   5          HG22      THR   5   6.179   7.692  -2.998
    6   HG22  THR   5          HG23      THR   5   7.273   8.836  -2.222
    7    H    THR   5           HN       THR   5  11.348   7.688  -3.432

  No H/Q in entry =           7
  In of MODEL   17
    1    HA   THR   6           HA       THR   6   8.441   2.925  -3.507
    2    HB   THR   6           HB       THR   6  11.056   2.542  -2.036
    3    HG1  THR   6           HG1      THR   6  10.605   2.807  -4.821
    4   HG22  THR   6          HG21      THR   6   9.778   0.779  -4.109
    5   HG21  THR   6          HG22      THR   6   9.767   0.463  -2.373
    6   HG23  THR   6          HG23      THR   6  11.294   0.497  -3.254
    7    H    THR   6           HN       THR   6   9.435   4.918  -1.634

  No H/Q in entry =           7
  In of MODEL   17
    1    HA3  GLY   7           HA2      GLY   7   7.832   0.334   0.196
    2    H    GLY   7           HN       GLY   7   7.694   0.987  -2.479
    3    HA2  GLY   7           HA1      GLY   7   6.508   1.482   0.070

  No H/Q in entry =           3
  In of MODEL   17
    1    HA   PRO   8           HA       PRO   8   5.005  -2.978  -0.533
    2    HB2  PRO   8           HB2      PRO   8   2.797  -1.701   1.009
    3    HG2  PRO   8           HG2      PRO   8   4.069  -1.424   2.938
    4    HD2  PRO   8           HD2      PRO   8   4.911   0.294   1.649
    5    HB3  PRO   8           HB1      PRO   8   3.488  -3.320   1.164
    6    HG3  PRO   8           HG1      PRO   8   5.308  -2.569   2.391
    7    HD3  PRO   8           HD1      PRO   8   6.418  -0.621   1.858

  No H/Q in entry =           7
  In of MODEL   17
    1    HA   CYS   9           HA       CYS   9   1.613  -0.906  -2.850
    2    HB2  CYS   9           HB2      CYS   9   0.692   0.337  -0.711
    3    H    CYS   9           HN       CYS   9   3.175   0.080  -0.580
    4    HB3  CYS   9           HB1      CYS   9   1.157   1.777  -1.611

  No H/Q in entry =           4
  In of MODEL   17
    1    HA   CYS  10           HA       CYS  10   4.033   1.742  -5.349
    2    HB2  CYS  10           HB2      CYS  10   5.955   1.779  -3.067
    3    H    CYS  10           HN       CYS  10   4.323  -0.362  -3.348
    4    HB3  CYS  10           HB1      CYS  10   6.507   2.380  -4.627

  No H/Q in entry =           4
  In of MODEL   17
    1    HA   ARG  11           HA       ARG  11   6.127  -1.540  -7.378
    2    HB2  ARG  11           HB2      ARG  11   4.618   0.169  -9.282
    3    HG2  ARG  11           HG2      ARG  11   4.046  -2.187  -8.110
    4    HD2  ARG  11           HD2      ARG  11   5.847  -3.341  -9.341
    5    HE   ARG  11           HE       ARG  11   5.085  -1.940 -11.554
    6   HH11  ARG  11          HH11      ARG  11   5.390  -5.329 -10.778
    7   HH12  ARG  11          HH12      ARG  11   5.768  -5.795 -12.402
    8   HH21  ARG  11          HH21      ARG  11   5.582  -2.551 -13.691
    9   HH22  ARG  11          HH22      ARG  11   5.878  -4.218 -14.056
   10    H    ARG  11           HN       ARG  11   4.585   0.879  -7.228
   11    HB3  ARG  11           HB1      ARG  11   5.900  -0.830  -9.953
   12    HG3  ARG  11           HG1      ARG  11   3.365  -1.655  -9.649
   13    HD3  ARG  11           HD1      ARG  11   4.243  -3.965  -9.724

  No H/Q in entry =          13
  In of MODEL   17
    1    HA   GLN  12           HA       GLN  12  10.433  -0.782  -7.168
    2    HB2  GLN  12           HB2      GLN  12   9.261  -0.115  -9.801
    3    HG2  GLN  12           HG2      GLN  12  11.923  -1.313  -9.642
    4   HE21  GLN  12          HE21      GLN  12  11.022  -3.855 -10.447
    5   HE22  GLN  12          HE22      GLN  12  10.307  -3.699 -12.012
    6    H    GLN  12           HN       GLN  12   8.242  -1.333  -6.923
    7    HB3  GLN  12           HB1      GLN  12  10.817   0.622  -9.445
    8    HG3  GLN  12           HG1      GLN  12  10.658  -2.237  -8.836

  No H/Q in entry =           8
  In of MODEL   17
    1    HA   CYS  13           HA       CYS  13   9.739   3.724  -6.553
    2    HB2  CYS  13           HB2      CYS  13  11.150   3.774  -9.169
    3    H    CYS  13           HN       CYS  13   9.142   2.038  -8.865
    4    HB3  CYS  13           HB1      CYS  13  10.752   5.329  -8.446

  No H/Q in entry =           4
  In of MODEL   17
    1    HA   LYS  14           HA       LYS  14   6.227   5.494  -8.597
    2    HB2  LYS  14           HB2      LYS  14   6.447   3.634 -10.440
    3    HG2  LYS  14           HG2      LYS  14   4.943   5.865 -10.313
    4    HD2  LYS  14           HD2      LYS  14   3.104   3.539 -10.246
    5    HE2  LYS  14           HE2      LYS  14   2.062   5.951 -11.588
    6    HZ3  LYS  14           HZ1      LYS  14   0.792   4.284 -12.786
    7    HZ2  LYS  14           HZ2      LYS  14   0.661   4.042 -11.117
    8    HZ1  LYS  14           HZ3      LYS  14   1.667   3.043 -12.039
    9    H    LYS  14           HN       LYS  14   7.277   2.854  -7.827
   10    HB3  LYS  14           HB1      LYS  14   4.998   2.989  -9.681
   11    HG3  LYS  14           HG1      LYS  14   4.972   4.766 -11.693
   12    HD3  LYS  14           HD1      LYS  14   2.882   5.176  -9.626
   13    HE3  LYS  14           HE1      LYS  14   3.108   4.915 -12.557

  No H/Q in entry =          13
  In of MODEL   17
    1    HA   LEU  15           HA       LEU  15   3.182   4.379  -5.677
    2    HB2  LEU  15           HB2      LEU  15   3.400   7.031  -6.039
    3    HG   LEU  15           HG       LEU  15   2.921   6.074  -3.851
    4   HD11  LEU  15          HD11      LEU  15   2.252   8.544  -4.675
    5   HD13  LEU  15          HD12      LEU  15   2.085   7.990  -3.009
    6   HD12  LEU  15          HD13      LEU  15   0.688   7.982  -4.085
    7   HD22  LEU  15          HD21      LEU  15   1.243   4.466  -4.341
    8   HD21  LEU  15          HD22      LEU  15   0.153   5.700  -4.974
    9   HD23  LEU  15          HD23      LEU  15   0.519   5.646  -3.249
   10    H    LEU  15           HN       LEU  15   3.975   5.843  -8.091
   11    HB3  LEU  15           HB1      LEU  15   1.728   6.820  -6.521

  No H/Q in entry =          11
  In of MODEL   17
    1    HA   LYS  16           HA       LYS  16   0.143   2.343  -8.049
    2    HB2  LYS  16           HB2      LYS  16  -0.073   1.640  -5.176
    3    HG2  LYS  16           HG2      LYS  16  -0.489  -0.642  -6.531
    4    HD2  LYS  16           HD2      LYS  16   2.109   0.737  -5.896
    5    HE2  LYS  16           HE2      LYS  16   2.574  -0.931  -7.590
    6    HZ3  LYS  16           HZ1      LYS  16   1.269  -2.913  -5.810
    7    HZ2  LYS  16           HZ2      LYS  16   1.975  -3.206  -7.319
    8    HZ1  LYS  16           HZ3      LYS  16   0.557  -2.290  -7.213
    9    H    LYS  16           HN       LYS  16   1.517   3.023  -5.701
   10    HB3  LYS  16           HB1      LYS  16  -1.491   1.329  -6.168
   11    HG3  LYS  16           HG1      LYS  16   0.433   0.267  -7.731
   12    HD3  LYS  16           HD1      LYS  16   1.246  -0.456  -4.923
   13    HE3  LYS  16           HE1      LYS  16   3.152  -1.483  -6.018

  No H/Q in entry =          13
  In of MODEL   17
    1    HA   PRO  17           HA       PRO  17  -3.196   5.206  -8.296
    2    HB2  PRO  17           HB2      PRO  17  -5.223   3.650  -9.215
    3    HG2  PRO  17           HG2      PRO  17  -4.319   1.554  -8.785
    4    HD2  PRO  17           HD2      PRO  17  -2.077   1.262  -8.340
    5    HB3  PRO  17           HB1      PRO  17  -3.855   4.140 -10.222
    6    HG3  PRO  17           HG1      PRO  17  -3.705   1.828 -10.426
    7    HD3  PRO  17           HD1      PRO  17  -1.575   2.307  -9.684

  No H/Q in entry =           7
  In of MODEL   17
    1    HA   ALA  18           HA       ALA  18  -5.325   4.999  -4.523
    2    HB3  ALA  18           HB1      ALA  18  -7.157   6.896  -5.969
    3    HB1  ALA  18           HB2      ALA  18  -5.600   7.386  -5.303
    4    HB2  ALA  18           HB3      ALA  18  -6.862   6.773  -4.235
    5    H    ALA  18           HN       ALA  18  -4.839   6.024  -7.078

  No H/Q in entry =           5
  In of MODEL   17
    1    HA3  GLY  19           HA2      GLY  19  -8.793   2.412  -4.000
    2    H    GLY  19           HN       GLY  19  -6.331   3.145  -4.090
    3    HA2  GLY  19           HA1      GLY  19  -8.638   2.371  -5.750

  No H/Q in entry =           3
  In of MODEL   17
    1    HA   THR  20           HA       THR  20  -6.368  -1.363  -5.699
    2    HB   THR  20           HB       THR  20  -3.587  -0.491  -5.146
    3    HG1  THR  20           HG1      THR  20  -5.122   0.460  -7.317
    4   HG23  THR  20          HG21      THR  20  -3.732  -2.672  -5.952
    5   HG22  THR  20          HG22      THR  20  -3.253  -1.712  -7.351
    6   HG21  THR  20          HG23      THR  20  -4.927  -2.238  -7.173
    7    H    THR  20           HN       THR  20  -5.840   1.399  -5.556

  No H/Q in entry =           7
  In of MODEL   17
    1    HA   THR  21           HA       THR  21  -5.628  -2.579  -1.605
    2    HB   THR  21           HB       THR  21  -4.694  -4.991  -1.478
    3    HG1  THR  21           HG1      THR  21  -3.682  -4.758  -3.609
    4   HG23  THR  21          HG21      THR  21  -7.049  -4.671  -1.368
    5   HG22  THR  21          HG22      THR  21  -6.725  -5.965  -2.523
    6   HG21  THR  21          HG23      THR  21  -7.141  -4.351  -3.100
    7    H    THR  21           HN       THR  21  -4.960  -2.970  -4.401

  No H/Q in entry =           7
  In of MODEL   17
    1    HA   CYS  22           HA       CYS  22  -1.253  -2.600  -0.715
    2    HB2  CYS  22           HB2      CYS  22  -2.370  -0.921   0.684
    3    H    CYS  22           HN       CYS  22  -3.937  -3.582  -0.018
    4    HB3  CYS  22           HB1      CYS  22  -2.695  -2.146   1.906

  No H/Q in entry =           4
  In of MODEL   17
    1    HA   TRP  23           HA       TRP  23  -0.921  -6.475   1.629
    2    HB2  TRP  23           HB2      TRP  23  -1.190  -5.013   3.731
    3    HD1  TRP  23           HD1      TRP  23   0.960  -7.006   3.057
    4    HE1  TRP  23           HE1      TRP  23   1.673  -8.897   4.650
    5    HE3  TRP  23           HE3      TRP  23  -3.254  -7.272   5.940
    6    HZ2  TRP  23           HZ2      TRP  23   0.593 -10.314   6.839
    7    HZ3  TRP  23           HZ3      TRP  23  -3.333  -8.923   7.763
    8    HH2  TRP  23           HH2      TRP  23  -1.449 -10.412   8.201
    9    H    TRP  23           HN       TRP  23  -3.162  -4.574   1.534
   10    HB3  TRP  23           HB1      TRP  23  -2.657  -5.940   4.031

  No H/Q in entry =          10
  In of MODEL   17
    1    HA   ARG  24           HA       ARG  24  -4.595  -8.818   0.718
    2    HB2  ARG  24           HB2      ARG  24  -2.687  -9.730  -1.439
    3    HG2  ARG  24           HG2      ARG  24  -4.459  -7.349  -1.319
    4    HD2  ARG  24           HD2      ARG  24  -4.907  -9.298  -3.245
    5    HE   ARG  24           HE       ARG  24  -3.731  -7.227  -4.859
    6   HH11  ARG  24          HH11      ARG  24  -3.215 -10.338  -3.362
    7   HH12  ARG  24          HH12      ARG  24  -1.963 -10.801  -4.465
    8   HH21  ARG  24          HH21      ARG  24  -2.084  -7.835  -6.310
    9   HH22  ARG  24          HH22      ARG  24  -1.320  -9.380  -6.138
   10    H    ARG  24           HN       ARG  24  -1.893  -7.877   0.190
   11    HB3  ARG  24           HB1      ARG  24  -4.425  -9.990  -1.378
   12    HG3  ARG  24           HG1      ARG  24  -2.892  -7.557  -2.103
   13    HD3  ARG  24           HD1      ARG  24  -5.389  -7.604  -3.321

  No H/Q in entry =          13
  In of MODEL   17
    1    HA   THR  25           HA       THR  25  -3.301 -12.769   2.076
    2    HB   THR  25           HB       THR  25  -2.518 -12.748   4.336
    3    HG1  THR  25           HG1      THR  25  -3.873 -10.273   4.616
    4   HG22  THR  25          HG21      THR  25  -1.952 -10.009   3.230
    5   HG21  THR  25          HG22      THR  25  -1.102 -11.485   2.772
    6   HG23  THR  25          HG23      THR  25  -1.000 -10.887   4.428
    7    H    THR  25           HN       THR  25  -4.856 -10.332   2.217

  No H/Q in entry =           7
  In of MODEL   17
    1    HA   SER  26           HA       SER  26  -7.002 -14.063   4.092
    2    HB2  SER  26           HB2      SER  26  -5.295 -16.292   5.199
    3    HG   SER  26           HG       SER  26  -4.602 -15.940   3.086
    4    H    SER  26           HN       SER  26  -4.073 -14.005   4.370
    5    HB3  SER  26           HB1      SER  26  -6.954 -16.381   4.608

  No H/Q in entry =           5
  In of MODEL   17
    1    HA   VAL  27           HA       VAL  27  -7.664 -12.934   8.184
    2    HB   VAL  27           HB       VAL  27  -5.331 -13.589   8.583
    3    H    VAL  27           HN       VAL  27  -6.759 -12.162   5.652

  No H/Q in entry =           3
  In of MODEL   17
    1    HA   SER  28           HA       SER  28  -7.992  -8.516   7.093
    2    HB2  SER  28           HB2      SER  28  -5.224  -7.486   7.371
    3    HG   SER  28           HG       SER  28  -5.906  -8.325   9.765
    4    H    SER  28           HN       SER  28  -5.988 -10.462   6.318
    5    HB3  SER  28           HB1      SER  28  -6.680  -7.072   8.277

  No H/Q in entry =           5
  In of MODEL   17
    1    HA   SER  29           HA       SER  29  -6.363  -6.828   3.326
    2    HB2  SER  29           HB2      SER  29  -9.296  -6.221   3.066
    3    HG   SER  29           HG       SER  29  -8.204  -8.793   2.657
    4    H    SER  29           HN       SER  29  -8.081  -6.698   5.706
    5    HB3  SER  29           HB1      SER  29  -8.160  -6.749   1.825

  No H/Q in entry =           5
  In of MODEL   17
    1    HA   HIS  30           HA       HIS  30  -6.551  -2.536   4.247
    2    HB2  HIS  30           HB2      HIS  30  -3.746  -3.293   3.477
    3    HD1  HIS  30           HD1      HIS  30  -2.502  -1.580   5.727
    4    HD2  HIS  30           HD2      HIS  30  -5.801  -4.059   6.206
    5    HE1  HIS  30           HE1      HIS  30  -2.581  -2.127   8.181
    6    HE2  HIS  30           HE2      HIS  30  -4.534  -3.698   8.432
    7    H    HIS  30           HN       HIS  30  -5.339  -4.958   3.140
    8    HB3  HIS  30           HB1      HIS  30  -4.194  -1.605   3.702

  No H/Q in entry =           8
  In of MODEL   17
    1    HA   TYR  31           HA       TYR  31  -6.252  -0.948   0.066
    2    HB2  TYR  31           HB2      TYR  31  -7.884   0.838   1.859
    3    HD1  TYR  31           HD1      TYR  31  -9.695  -0.378   2.590
    4    HD2  TYR  31           HD2      TYR  31  -8.205  -1.094  -1.330
    5    HE1  TYR  31           HE1      TYR  31 -11.503  -2.000   2.205
    6    HE2  TYR  31           HE2      TYR  31 -10.009  -2.717  -1.726
    7    HH   TYR  31           HH       TYR  31 -12.704  -3.007   0.325
    8    H    TYR  31           HN       TYR  31  -5.866  -0.478   2.939
    9    HB3  TYR  31           HB1      TYR  31  -7.771   1.131   0.126

  No H/Q in entry =           9
  In of MODEL   17
    1    HA   CYS  32           HA       CYS  32  -3.451   2.401  -0.071
    2    HB2  CYS  32           HB2      CYS  32  -3.471   0.906  -2.329
    3    H    CYS  32           HN       CYS  32  -5.685   0.925  -1.273
    4    HB3  CYS  32           HB1      CYS  32  -3.845   2.489  -3.002

  No H/Q in entry =           4
  In of MODEL   17
    1    HA   THR  33           HA       THR  33  -5.790   6.011  -0.785
    2    HB   THR  33           HB       THR  33  -4.742   6.386   1.408
    3    HG1  THR  33           HG1      THR  33  -5.880   8.101   0.218
    4   HG21  THR  33          HG21      THR  33  -2.341   6.334   0.179
    5   HG23  THR  33          HG22      THR  33  -2.632   7.027   1.775
    6   HG22  THR  33          HG23      THR  33  -2.590   8.071   0.354
    7    H    THR  33           HN       THR  33  -3.289   4.615  -0.202

  No H/Q in entry =           7
  In of MODEL   17
    1    HA3  GLY  34           HA2      GLY  34  -1.608   6.459  -3.890
    2    H    GLY  34           HN       GLY  34  -2.421   5.883  -1.770
    3    HA2  GLY  34           HA1      GLY  34  -3.112   7.310  -4.212

  No H/Q in entry =           3
  In of MODEL   17
    1    HA   ARG  35           HA       ARG  35  -0.652  10.550  -2.256
    2    HB2  ARG  35           HB2      ARG  35  -2.233  10.247  -0.266
    3    HG2  ARG  35           HG2      ARG  35   0.217  11.836   0.430
    4    HD2  ARG  35           HD2      ARG  35  -1.867  11.571   1.954
    5    HE   ARG  35           HE       ARG  35  -3.780  12.280   0.946
    6   HH11  ARG  35          HH11      ARG  35  -1.172  14.354  -0.090
    7   HH12  ARG  35          HH12      ARG  35  -2.207  15.419  -0.981
    8   HH21  ARG  35          HH21      ARG  35  -5.143  13.679  -0.225
    9   HH22  ARG  35          HH22      ARG  35  -4.461  15.037  -1.057
   10    H    ARG  35           HN       ARG  35  -1.308   7.851  -1.279
   11    HB3  ARG  35           HB1      ARG  35  -0.818   9.721   0.636
   12    HG3  ARG  35           HG1      ARG  35  -0.953  12.367  -0.780
   13    HD3  ARG  35           HD1      ARG  35  -1.186  13.174   1.680

  No H/Q in entry =          13
  In of MODEL   17
    1    HA   SER  36           HA       SER  36   3.280   8.363  -1.411
    2    HB2  SER  36           HB2      SER  36   2.731   9.616   0.824
    3    HG   SER  36           HG       SER  36   4.997   8.302   1.391
    4    H    SER  36           HN       SER  36   0.599   7.696  -0.657
    5    HB3  SER  36           HB1      SER  36   2.933   8.021   1.549

  No H/Q in entry =           5
  In of MODEL   17
    1    HA   CYS  37           HA       CYS  37   3.739   4.088  -1.144
    2    HB2  CYS  37           HB2      CYS  37   6.495   4.889  -0.189
    3    H    CYS  37           HN       CYS  37   4.843   6.658  -0.592
    4    HB3  CYS  37           HB1      CYS  37   6.051   3.273  -0.729

  No H/Q in entry =           4
  In of MODEL   17
    1    HA   GLU  38           HA       GLU  38   4.704   3.685   3.556
    2    HB2  GLU  38           HB2      GLU  38   4.120   6.610   3.832
    3    HG2  GLU  38           HG2      GLU  38   6.470   5.445   3.706
    4    H    GLU  38           HN       GLU  38   4.567   5.837   1.754
    5    HB3  GLU  38           HB1      GLU  38   3.911   5.547   5.216
    6    HG3  GLU  38           HG1      GLU  38   6.170   6.801   4.792

  No H/Q in entry =           6
  In of MODEL   17
    1    HA   CYS  39           HA       CYS  39   0.351   2.910   3.321
    2    HB2  CYS  39           HB2      CYS  39   1.815   0.632   2.766
    3    H    CYS  39           HN       CYS  39   3.133   2.188   3.587
    4    HB3  CYS  39           HB1      CYS  39   0.906   0.176   4.202

  No H/Q in entry =           4
  In of MODEL   17
    1    HA   PRO  40           HA       PRO  40  -0.784   3.519   7.533
    2    HB2  PRO  40           HB2      PRO  40  -3.022   1.631   6.980
    3    HG2  PRO  40           HG2      PRO  40  -3.804   2.820   5.137
    4    HD2  PRO  40           HD2      PRO  40  -1.965   1.785   4.206
    5    HB3  PRO  40           HB1      PRO  40  -3.068   3.263   7.655
    6    HG3  PRO  40           HG1      PRO  40  -2.885   4.273   5.574
    7    HD3  PRO  40           HD1      PRO  40  -1.462   3.468   3.949

  No H/Q in entry =           7
  In of MODEL   17
    1    HA   SER  41           HA       SER  41  -0.309  -0.486   9.459
    2    HB2  SER  41           HB2      SER  41   1.293   1.291  10.369
    3    HG   SER  41           HG       SER  41   1.456  -0.967  10.874
    4    H    SER  41           HN       SER  41  -1.445   2.225   9.525
    5    HB3  SER  41           HB1      SER  41   0.193   1.424  11.741

  No H/Q in entry =           5
  In of MODEL   17
    1    HA   TYR  42           HA       TYR  42  -3.967  -1.043  11.807
    2    HB2  TYR  42           HB2      TYR  42  -4.457   1.828  11.302
    3    HD1  TYR  42           HD1      TYR  42  -6.318   0.555  14.015
    4    HD2  TYR  42           HD2      TYR  42  -2.349   1.516  12.822
    5    HE1  TYR  42           HE1      TYR  42  -5.651   0.705  16.377
    6    HE2  TYR  42           HE2      TYR  42  -1.670   1.668  15.181
    7    HH   TYR  42           HH       TYR  42  -3.604   2.082  17.628
    8    H    TYR  42           HN       TYR  42  -3.069   0.422   9.450
    9    HB3  TYR  42           HB1      TYR  42  -5.874   0.890  11.765

  No H/Q in entry =           9
  In of MODEL   17
    1    HA   PRO  43           HA       PRO  43  -6.751  -2.829   8.885
    2    HB2  PRO  43           HB2      PRO  43  -8.753  -3.648  10.521
    3    HG2  PRO  43           HG2      PRO  43  -8.214  -2.434  12.426
    4    HD2  PRO  43           HD2      PRO  43  -6.145  -1.459  12.701
    5    HB3  PRO  43           HB1      PRO  43  -7.176  -4.445  10.465
    6    HG3  PRO  43           HG1      PRO  43  -7.287  -3.915  12.728
    7    HD3  PRO  43           HD1      PRO  43  -5.280  -2.920  12.185

  No H/Q in entry =           7
  In of MODEL   17
    1    HA3  GLY  44           HA2      GLY  44 -10.581  -0.313   9.245
    2    H    GLY  44           HN       GLY  44  -9.425  -2.932   8.780
    3    HA2  GLY  44           HA1      GLY  44 -10.316  -0.714   7.555

  No H/Q in entry =           3
  In of MODEL   17
    1    HA   ASN  45           HA       ASN  45 -14.193  -2.391  10.727
    2    HB2  ASN  45           HB2      ASN  45 -14.496  -2.276   7.722
    3   HD21  ASN  45          HD21      ASN  45 -16.821  -0.574   9.222
    4   HD22  ASN  45          HD22      ASN  45 -16.159   1.017   9.103
    5    H    ASN  45           HN       ASN  45 -12.194  -1.358  10.402
    6    HB3  ASN  45           HB1      ASN  45 -15.783  -2.392   8.918

  No H/Q in entry =           6
  In of MODEL   17
    1    HA3  GLY  46           HA2      GLY  46 -11.628  -6.336  10.634
    2    H    GLY  46           HN       GLY  46 -11.849  -4.011  10.415
    3    HA2  GLY  46           HA1      GLY  46 -13.173  -6.538   9.823

  No H/Q in entry =           3
  In of MODEL   18
    1    H1   ALA   1           HT1      ALA   1  10.580  10.675  -9.098
    2    H2   ALA   1           HT3      ALA   1   9.608  12.075  -9.283
    3    H3   ALA   1           HT2      ALA   1   9.452  10.770 -10.388
    4    HA   ALA   1           HA       ALA   1  11.407  11.198 -11.409
    5    HB1  ALA   1           HB1      ALA   1  11.408  13.852 -11.503
    6    HB2  ALA   1           HB2      ALA   1   9.861  13.623 -10.688
    7    HB3  ALA   1           HB3      ALA   1  10.145  12.884 -12.264

  No H/Q in entry =           7
  In of MODEL   18
    1    HA   MET   2           HA       MET   2  14.216  12.635  -8.163
    2    HB2  MET   2           HB2      MET   2  12.418  14.926  -7.412
    3    H    MET   2           HN       MET   2  11.281  12.706  -8.240
    4    HG2  MET   2           HG2      MET   2  14.852  14.627  -9.130
    5    HE2  MET   2           HE1      MET   2  15.403  18.182 -10.242
    6    HB3  MET   2           HB1      MET   2  14.021  14.756  -6.710
    7    HE1  MET   2           HE2      MET   2  15.426  16.457 -10.609
    8    HE3  MET   2           HE3      MET   2  16.659  17.152  -9.556
    9    HG3  MET   2           HG1      MET   2  13.265  15.260  -9.562

  No H/Q in entry =           9
  In of MODEL   18
    1    HA   ASP   3           HA       ASP   3  12.909  11.993  -3.818
    2    HB2  ASP   3           HB2      ASP   3  11.334  13.109  -2.290
    3    H    ASP   3           HN       ASP   3  11.715  13.676  -5.860
    4    HB3  ASP   3           HB1      ASP   3  12.259  14.277  -3.229

  No H/Q in entry =           4
  In of MODEL   18
    1    HA   CYS   4           HA       CYS   4   9.438   9.298  -3.830
    2    HB2  CYS   4           HB2      CYS   4  10.251   7.070  -4.789
    3    H    CYS   4           HN       CYS   4  12.259   9.989  -3.439
    4    HB3  CYS   4           HB1      CYS   4  10.349   8.475  -5.844

  No H/Q in entry =           4
  In of MODEL   18
    1    HA   THR   5           HA       THR   5  10.447   6.836  -0.339
    2    HB   THR   5           HB       THR   5   8.157   5.609   0.269
    3    HG1  THR   5           HG1      THR   5   7.345   6.074  -1.889
    4   HG23  THR   5          HG21      THR   5   7.764   7.321   1.639
    5   HG22  THR   5          HG22      THR   5   7.719   8.493   0.322
    6   HG21  THR   5          HG23      THR   5   9.267   7.982   0.995
    7    H    THR   5           HN       THR   5   8.918   7.140  -2.836

  No H/Q in entry =           7
  In of MODEL   18
    1    HA   THR   6           HA       THR   6  10.369   2.531  -1.491
    2    HB   THR   6           HB       THR   6  12.039   1.486   0.305
    3    HG1  THR   6           HG1      THR   6  12.393   4.279   0.635
    4   HG23  THR   6          HG21      THR   6  13.634   1.837  -1.204
    5   HG22  THR   6          HG22      THR   6  13.454   3.590  -1.122
    6   HG21  THR   6          HG23      THR   6  12.378   2.640  -2.147
    7    H    THR   6           HN       THR   6  10.128   4.553   0.635

  No H/Q in entry =           7
  In of MODEL   18
    1    HA3  GLY   7           HA2      GLY   7   8.808  -0.728   1.160
    2    H    GLY   7           HN       GLY   7   9.393   0.596  -1.119
    3    HA2  GLY   7           HA1      GLY   7   7.538   0.484   1.098

  No H/Q in entry =           3
  In of MODEL   18
    1    HA   PRO   8           HA       PRO   8   6.540  -3.503  -1.381
    2    HB2  PRO   8           HB2      PRO   8   4.255  -3.501   0.512
    3    HG2  PRO   8           HG2      PRO   8   5.526  -3.902   2.415
    4    HD2  PRO   8           HD2      PRO   8   5.986  -1.663   2.048
    5    HB3  PRO   8           HB1      PRO   8   5.241  -4.850  -0.062
    6    HG3  PRO   8           HG1      PRO   8   6.929  -4.442   1.473
    7    HD3  PRO   8           HD1      PRO   8   7.642  -2.300   1.974

  No H/Q in entry =           7
  In of MODEL   18
    1    HA   CYS   9           HA       CYS   9   2.851  -0.887  -2.353
    2    HB2  CYS   9           HB2      CYS   9   2.848   0.217   0.188
    3    H    CYS   9           HN       CYS   9   4.927  -0.612  -0.318
    4    HB3  CYS   9           HB1      CYS   9   2.879   1.625  -0.867

  No H/Q in entry =           4
  In of MODEL   18
    1    HA   CYS  10           HA       CYS  10   5.113   1.401  -5.259
    2    HB2  CYS  10           HB2      CYS  10   6.924   2.946  -4.609
    3    H    CYS  10           HN       CYS  10   5.430  -0.639  -3.382
    4    HB3  CYS  10           HB1      CYS  10   5.611   2.944  -3.437

  No H/Q in entry =           4
  In of MODEL   18
    1    HA   ARG  11           HA       ARG  11   8.464  -1.088  -6.601
    2    HB2  ARG  11           HB2      ARG  11   6.652  -0.755  -8.999
    3    HG2  ARG  11           HG2      ARG  11   6.854  -3.007  -7.011
    4    HD2  ARG  11           HD2      ARG  11   4.768  -3.710  -8.425
    5    HE   ARG  11           HE       ARG  11   7.132  -4.384  -9.909
    6   HH11  ARG  11          HH11      ARG  11   5.377  -4.913  -6.939
    7   HH12  ARG  11          HH12      ARG  11   6.096  -6.460  -6.643
    8   HH21  ARG  11          HH21      ARG  11   8.078  -6.419  -9.522
    9   HH22  ARG  11          HH22      ARG  11   7.630  -7.315  -8.109
   10    H    ARG  11           HN       ARG  11   6.173   0.712  -6.991
   11    HB3  ARG  11           HB1      ARG  11   7.991  -1.889  -8.887
   12    HG3  ARG  11           HG1      ARG  11   5.493  -1.902  -7.206
   13    HD3  ARG  11           HD1      ARG  11   5.547  -2.747  -9.680

  No H/Q in entry =          13
  In of MODEL   18
    1    HA   GLN  12           HA       GLN  12  12.008   1.317  -7.476
    2    HB2  GLN  12           HB2      GLN  12  11.125   0.013  -9.646
    3    HG2  GLN  12           HG2      GLN  12  12.858   1.613 -10.933
    4   HE21  GLN  12          HE21      GLN  12  12.776  -0.509  -8.116
    5   HE22  GLN  12          HE22      GLN  12  13.931  -1.646  -8.715
    6    H    GLN  12           HN       GLN  12  10.323  -0.003  -6.709
    7    HB3  GLN  12           HB1      GLN  12  10.763   1.658 -10.151
    8    HG3  GLN  12           HG1      GLN  12  13.286   1.972  -9.260

  No H/Q in entry =           8
  In of MODEL   18
    1    HA   CYS  13           HA       CYS  13   9.852   4.889  -5.477
    2    HB2  CYS  13           HB2      CYS  13  11.402   5.419  -8.008
    3    H    CYS  13           HN       CYS  13  10.540   2.781  -5.978
    4    HB3  CYS  13           HB1      CYS  13  10.654   6.714  -7.079

  No H/Q in entry =           4
  In of MODEL   18
    1    HA   LYS  14           HA       LYS  14   6.348   5.208  -8.139
    2    HB2  LYS  14           HB2      LYS  14   7.553   3.459  -9.725
    3    HG2  LYS  14           HG2      LYS  14   4.664   3.599 -10.326
    4    HD2  LYS  14           HD2      LYS  14   7.259   3.810 -11.714
    5    HE2  LYS  14           HE2      LYS  14   5.003   4.976 -13.207
    6    HZ2  LYS  14           HZ1      LYS  14   6.688   6.143 -14.285
    7    HZ1  LYS  14           HZ2      LYS  14   7.383   4.633 -13.978
    8    HZ3  LYS  14           HZ3      LYS  14   7.782   5.959 -13.007
    9    H    LYS  14           HN       LYS  14   8.063   3.158  -6.918
   10    HB3  LYS  14           HB1      LYS  14   6.236   2.420  -9.196
   11    HG3  LYS  14           HG1      LYS  14   5.518   5.132 -10.138
   12    HD3  LYS  14           HD1      LYS  14   5.745   3.074 -12.242
   13    HE3  LYS  14           HE1      LYS  14   5.710   6.006 -11.964

  No H/Q in entry =          13
  In of MODEL   18
    1    HA   LEU  15           HA       LEU  15   4.165   3.094  -4.789
    2    HB2  LEU  15           HB2      LEU  15   2.712   4.766  -3.663
    3    HG   LEU  15           HG       LEU  15   3.729   6.549  -5.803
    4   HD13  LEU  15          HD11      LEU  15   1.490   6.417  -6.026
    5   HD12  LEU  15          HD12      LEU  15   1.508   7.684  -4.800
    6   HD11  LEU  15          HD13      LEU  15   1.235   6.007  -4.330
    7   HD21  LEU  15          HD21      LEU  15   3.905   7.178  -2.920
    8   HD23  LEU  15          HD22      LEU  15   3.200   8.415  -3.960
    9   HD22  LEU  15          HD23      LEU  15   4.827   7.815  -4.282
   10    H    LEU  15           HN       LEU  15   5.271   5.317  -6.115
   11    HB3  LEU  15           HB1      LEU  15   4.421   5.156  -3.610

  No H/Q in entry =          11
  In of MODEL   18
    1    HA   LYS  16           HA       LYS  16   0.960   2.050  -7.527
    2    HB2  LYS  16           HB2      LYS  16   0.689   0.577  -4.970
    3    HG2  LYS  16           HG2      LYS  16   0.091  -1.188  -6.903
    4    HD2  LYS  16           HD2      LYS  16   2.970  -0.610  -6.752
    5    HE2  LYS  16           HE2      LYS  16   1.713  -2.790  -7.374
    6    HZ1  LYS  16           HZ1      LYS  16   1.429  -2.705  -4.451
    7    HZ3  LYS  16           HZ2      LYS  16   1.701  -4.192  -5.209
    8    HZ2  LYS  16           HZ3      LYS  16   0.343  -3.271  -5.619
    9    H    LYS  16           HN       LYS  16   2.370   1.936  -5.113
   10    HB3  LYS  16           HB1      LYS  16  -0.754   0.668  -5.970
   11    HG3  LYS  16           HG1      LYS  16   1.069  -0.043  -7.824
   12    HD3  LYS  16           HD1      LYS  16   2.158  -0.789  -5.195
   13    HE3  LYS  16           HE1      LYS  16   3.157  -2.880  -6.366

  No H/Q in entry =          13
  In of MODEL   18
    1    HA   PRO  17           HA       PRO  17  -2.270   4.988  -6.967
    2    HB2  PRO  17           HB2      PRO  17  -4.484   3.706  -7.895
    3    HG2  PRO  17           HG2      PRO  17  -3.670   1.533  -7.940
    4    HD2  PRO  17           HD2      PRO  17  -1.413   1.071  -7.814
    5    HB3  PRO  17           HB1      PRO  17  -3.203   4.311  -8.952
    6    HG3  PRO  17           HG1      PRO  17  -3.210   2.068  -9.567
    7    HD3  PRO  17           HD1      PRO  17  -0.991   2.333  -8.989

  No H/Q in entry =           7
  In of MODEL   18
    1    HA   ALA  18           HA       ALA  18  -4.045   4.338  -3.073
    2    HB2  ALA  18           HB1      ALA  18  -5.520   6.064  -2.418
    3    HB3  ALA  18           HB2      ALA  18  -5.997   6.392  -4.084
    4    HB1  ALA  18           HB3      ALA  18  -4.372   6.803  -3.535
    5    H    ALA  18           HN       ALA  18  -3.777   5.672  -5.503

  No H/Q in entry =           5
  In of MODEL   18
    1    HA3  GLY  19           HA2      GLY  19  -7.689   1.963  -2.169
    2    H    GLY  19           HN       GLY  19  -5.431   2.866  -2.281
    3    HA2  GLY  19           HA1      GLY  19  -7.798   2.185  -3.909

  No H/Q in entry =           3
  In of MODEL   18
    1    HA   THR  20           HA       THR  20  -5.678  -1.541  -4.767
    2    HB   THR  20           HB       THR  20  -2.947  -0.255  -4.577
    3    HG1  THR  20           HG1      THR  20  -3.200  -0.076  -6.853
    4   HG22  THR  20          HG21      THR  20  -3.739  -2.696  -6.139
    5   HG21  THR  20          HG22      THR  20  -2.910  -2.740  -4.583
    6   HG23  THR  20          HG23      THR  20  -2.129  -1.994  -5.978
    7    H    THR  20           HN       THR  20  -5.037   1.154  -4.283

  No H/Q in entry =           7
  In of MODEL   18
    1    HA   THR  21           HA       THR  21  -5.196  -3.059  -0.697
    2    HB   THR  21           HB       THR  21  -6.778  -4.677  -1.517
    3    HG1  THR  21           HG1      THR  21  -6.225  -6.038  -0.031
    4   HG21  THR  21          HG21      THR  21  -4.914  -5.206  -3.524
    5   HG23  THR  21          HG22      THR  21  -6.480  -5.978  -3.276
    6   HG22  THR  21          HG23      THR  21  -5.026  -6.685  -2.570
    7    H    THR  21           HN       THR  21  -5.755  -3.220  -3.438

  No H/Q in entry =           7
  In of MODEL   18
    1    HA   CYS  22           HA       CYS  22  -0.827  -3.373  -0.964
    2    HB2  CYS  22           HB2      CYS  22  -1.471  -3.412   1.992
    3    H    CYS  22           HN       CYS  22  -3.298  -2.964   0.287
    4    HB3  CYS  22           HB1      CYS  22   0.136  -3.228   1.299

  No H/Q in entry =           4
  In of MODEL   18
    1    HA   TRP  23           HA       TRP  23  -1.597  -7.842  -0.234
    2    HB2  TRP  23           HB2      TRP  23  -0.051  -7.131   1.643
    3    HD1  TRP  23           HD1      TRP  23   0.145  -9.511  -0.215
    4    HE1  TRP  23           HE1      TRP  23   0.639 -11.893   0.625
    5    HE3  TRP  23           HE3      TRP  23  -1.324  -8.978   4.654
    6    HZ2  TRP  23           HZ2      TRP  23   0.433 -13.353   3.032
    7    HZ3  TRP  23           HZ3      TRP  23  -1.143 -10.916   6.159
    8    HH2  TRP  23           HH2      TRP  23  -0.283 -13.058   5.363
    9    H    TRP  23           HN       TRP  23  -2.918  -5.548   0.796
   10    HB3  TRP  23           HB1      TRP  23  -1.363  -7.498   2.757

  No H/Q in entry =          10
  In of MODEL   18
    1    HA   ARG  24           HA       ARG  24  -5.722  -8.807   1.065
    2    HB2  ARG  24           HB2      ARG  24  -5.777  -8.257  -1.554
    3    HG2  ARG  24           HG2      ARG  24  -8.004  -9.980  -0.570
    4    HD2  ARG  24           HD2      ARG  24  -9.327  -8.096  -1.535
    5    HE   ARG  24           HE       ARG  24  -7.951 -10.024  -3.010
    6   HH11  ARG  24          HH11      ARG  24  -9.497  -6.936  -3.514
    7   HH12  ARG  24          HH12      ARG  24  -9.914  -7.272  -5.160
    8   HH21  ARG  24          HH21      ARG  24  -8.497 -10.467  -5.176
    9   HH22  ARG  24          HH22      ARG  24  -9.346  -9.277  -6.105
   10    H    ARG  24           HN       ARG  24  -3.534  -8.651  -0.854
   11    HB3  ARG  24           HB1      ARG  24  -5.960 -10.003  -1.646
   12    HG3  ARG  24           HG1      ARG  24  -7.702  -8.414   0.186
   13    HD3  ARG  24           HD1      ARG  24  -7.811  -7.381  -2.083

  No H/Q in entry =          13
  In of MODEL   18
    1    HA   THR  25           HA       THR  25  -5.561 -13.339   0.595
    2    HB   THR  25           HB       THR  25  -5.729 -13.945   3.144
    3    HG1  THR  25           HG1      THR  25  -5.345 -11.139   3.248
    4   HG21  THR  25          HG21      THR  25  -3.622 -13.244   1.534
    5   HG23  THR  25          HG22      THR  25  -3.511 -13.911   3.163
    6   HG22  THR  25          HG23      THR  25  -3.450 -12.166   2.919
    7    H    THR  25           HN       THR  25  -6.978 -10.907   1.109

  No H/Q in entry =           7
  In of MODEL   18
    1    HA   SER  26           HA       SER  26 -10.171 -13.234   1.913
    2    HB2  SER  26           HB2      SER  26  -8.745 -15.497   2.161
    3    HG   SER  26           HG       SER  26 -10.687 -16.555   1.942
    4    H    SER  26           HN       SER  26  -7.791 -12.562   3.227
    5    HB3  SER  26           HB1      SER  26  -9.540 -15.493   3.736

  No H/Q in entry =           5
  In of MODEL   18
    1    HA   VAL  27           HA       VAL  27 -10.824 -12.502   6.378
    2    HB   VAL  27           HB       VAL  27  -9.717 -14.509   7.272
    3    H    VAL  27           HN       VAL  27  -8.393 -13.337   4.951

  No H/Q in entry =           3
  In of MODEL   18
    1    HA   SER  28           HA       SER  28  -7.881  -9.086   7.111
    2    HB2  SER  28           HB2      SER  28  -5.397  -8.860   6.851
    3    HG   SER  28           HG       SER  28  -5.463 -11.561   6.017
    4    H    SER  28           HN       SER  28  -7.546 -11.583   5.591
    5    HB3  SER  28           HB1      SER  28  -5.890 -10.279   7.775

  No H/Q in entry =           5
  In of MODEL   18
    1    HA   SER  29           HA       SER  29  -6.714  -6.990   3.300
    2    HB2  SER  29           HB2      SER  29  -9.063  -7.307   3.066
    3    HG   SER  29           HG       SER  29  -8.765  -5.681   1.727
    4    H    SER  29           HN       SER  29  -7.249  -7.092   6.123
    5    HB3  SER  29           HB1      SER  29  -9.416  -6.183   4.378

  No H/Q in entry =           5
  In of MODEL   18
    1    HA   HIS  30           HA       HIS  30  -5.891  -2.818   4.492
    2    HB2  HIS  30           HB2      HIS  30  -3.255  -4.214   3.990
    3    HD1  HIS  30           HD1      HIS  30  -2.458  -5.600   5.895
    4    HD2  HIS  30           HD2      HIS  30  -5.690  -3.207   6.939
    5    HE1  HIS  30           HE1      HIS  30  -3.082  -6.295   8.229
    6    HE2  HIS  30           HE2      HIS  30  -5.094  -4.893   8.807
    7    H    HIS  30           HN       HIS  30  -5.605  -5.192   2.815
    8    HB3  HIS  30           HB1      HIS  30  -3.418  -2.611   4.699

  No H/Q in entry =           8
  In of MODEL   18
    1    HA   TYR  31           HA       TYR  31  -4.949  -1.172   0.536
    2    HB2  TYR  31           HB2      TYR  31  -6.957   0.736   1.753
    3    HD1  TYR  31           HD1      TYR  31  -6.769  -1.841  -0.953
    4    HD2  TYR  31           HD2      TYR  31  -8.931  -0.277   2.360
    5    HE1  TYR  31           HE1      TYR  31  -8.542  -3.502  -1.334
    6    HE2  TYR  31           HE2      TYR  31 -10.710  -1.934   1.989
    7    HH   TYR  31           HH       TYR  31 -11.172  -3.557  -0.735
    8    H    TYR  31           HN       TYR  31  -5.849  -0.993   3.334
    9    HB3  TYR  31           HB1      TYR  31  -6.513   0.649   0.052

  No H/Q in entry =           9
  In of MODEL   18
    1    HA   CYS  32           HA       CYS  32  -1.908   1.761   1.428
    2    HB2  CYS  32           HB2      CYS  32  -1.873   1.101  -1.236
    3    H    CYS  32           HN       CYS  32  -3.743   0.523  -0.359
    4    HB3  CYS  32           HB1      CYS  32  -2.015   2.855  -1.296

  No H/Q in entry =           4
  In of MODEL   18
    1    HA   THR  33           HA       THR  33  -3.887   5.651   1.574
    2    HB   THR  33           HB       THR  33  -2.337   5.844   3.387
    3    HG1  THR  33           HG1      THR  33  -2.091   8.215   1.859
    4   HG21  THR  33          HG21      THR  33  -0.335   5.885   1.335
    5   HG23  THR  33          HG22      THR  33  -0.161   5.635   3.072
    6   HG22  THR  33          HG23      THR  33  -0.152   7.270   2.411
    7    H    THR  33           HN       THR  33  -1.392   4.186   1.100

  No H/Q in entry =           7
  In of MODEL   18
    1    HA3  GLY  34           HA2      GLY  34  -1.047   6.368  -2.709
    2    H    GLY  34           HN       GLY  34  -1.077   5.544  -0.501
    3    HA2  GLY  34           HA1      GLY  34  -2.397   7.420  -2.311

  No H/Q in entry =           3
  In of MODEL   18
    1    HA   ARG  35           HA       ARG  35   1.421   9.753  -1.340
    2    HB2  ARG  35           HB2      ARG  35   0.508   9.203   1.454
    3    HG2  ARG  35           HG2      ARG  35   0.130  11.802   1.140
    4    HD2  ARG  35           HD2      ARG  35  -1.580   9.594   0.016
    5    HE   ARG  35           HE       ARG  35  -2.846  11.318  -0.783
    6   HH11  ARG  35          HH11      ARG  35  -1.544  12.239   2.321
    7   HH12  ARG  35          HH12      ARG  35  -2.461  13.705   2.411
    8   HH21  ARG  35          HH21      ARG  35  -4.053  13.246  -0.667
    9   HH22  ARG  35          HH22      ARG  35  -3.886  14.277   0.715
   10    H    ARG  35           HN       ARG  35   0.409   7.223  -0.257
   11    HB3  ARG  35           HB1      ARG  35   1.839  10.322   1.192
   12    HG3  ARG  35           HG1      ARG  35   0.127  11.341  -0.564
   13    HD3  ARG  35           HD1      ARG  35  -1.671  10.313   1.623

  No H/Q in entry =          13
  In of MODEL   18
    1    HA   SER  36           HA       SER  36   4.808   7.067   0.056
    2    HB2  SER  36           HB2      SER  36   4.119   6.532   2.930
    3    HG   SER  36           HG       SER  36   3.700   8.560   3.207
    4    H    SER  36           HN       SER  36   2.001   7.082   0.906
    5    HB3  SER  36           HB1      SER  36   5.666   7.006   2.228

  No H/Q in entry =           5
  In of MODEL   18
    1    HA   CYS  37           HA       CYS  37   4.331   2.792  -0.165
    2    HB2  CYS  37           HB2      CYS  37   7.073   2.609   1.076
    3    H    CYS  37           HN       CYS  37   5.914   4.998   0.705
    4    HB3  CYS  37           HB1      CYS  37   6.332   1.513  -0.085

  No H/Q in entry =           4
  In of MODEL   18
    1    HA   GLU  38           HA       GLU  38   5.026   1.775   4.531
    2    HB2  GLU  38           HB2      GLU  38   4.650   4.709   5.044
    3    HG2  GLU  38           HG2      GLU  38   6.475   3.953   6.807
    4    H    GLU  38           HN       GLU  38   5.311   4.035   2.931
    5    HB3  GLU  38           HB1      GLU  38   4.316   3.533   6.307
    6    HG3  GLU  38           HG1      GLU  38   6.734   2.683   5.612

  No H/Q in entry =           6
  In of MODEL   18
    1    HA   CYS  39           HA       CYS  39   0.617   1.647   4.270
    2    HB2  CYS  39           HB2      CYS  39   1.060   0.455   2.174
    3    H    CYS  39           HN       CYS  39   3.304   0.475   4.052
    4    HB3  CYS  39           HB1      CYS  39   1.487  -0.995   3.078

  No H/Q in entry =           4
  In of MODEL   18
    1    HA   PRO  40           HA       PRO  40   1.057  -0.560   8.282
    2    HB2  PRO  40           HB2      PRO  40  -0.654   1.070   9.624
    3    HG2  PRO  40           HG2      PRO  40  -1.326   2.439   7.873
    4    HD2  PRO  40           HD2      PRO  40  -0.166   2.530   5.882
    5    HB3  PRO  40           HB1      PRO  40   1.056   1.450   9.394
    6    HG3  PRO  40           HG1      PRO  40   0.088   3.342   8.449
    7    HD3  PRO  40           HD1      PRO  40   1.409   2.639   6.694

  No H/Q in entry =           7
  In of MODEL   18
    1    HA   SER  41           HA       SER  41  -2.882  -2.435   8.108
    2    HB2  SER  41           HB2      SER  41  -3.233  -3.768  10.387
    3    HG   SER  41           HG       SER  41  -1.745  -2.858  11.686
    4    H    SER  41           HN       SER  41  -0.780  -1.305   9.799
    5    HB3  SER  41           HB1      SER  41  -1.975  -4.221   9.238

  No H/Q in entry =           5
  In of MODEL   18
    1    HA   TYR  42           HA       TYR  42  -5.378   0.268  10.648
    2    HB2  TYR  42           HB2      TYR  42  -3.661   2.084   9.742
    3    HD1  TYR  42           HD1      TYR  42  -3.525   3.815  11.287
    4    HD2  TYR  42           HD2      TYR  42  -7.321   2.087  10.448
    5    HE1  TYR  42           HE1      TYR  42  -4.526   5.150  13.093
    6    HE2  TYR  42           HE2      TYR  42  -8.333   3.418  12.251
    7    HH   TYR  42           HH       TYR  42  -7.672   4.567  14.285
    8    H    TYR  42           HN       TYR  42  -3.664  -0.035   8.277
    9    HB3  TYR  42           HB1      TYR  42  -5.013   2.488   8.688

  No H/Q in entry =           9
  In of MODEL   18
    1    HA   PRO  43           HA       PRO  43  -8.292  -0.923   7.245
    2    HB2  PRO  43           HB2      PRO  43  -9.890  -2.459   8.812
    3    HG2  PRO  43           HG2      PRO  43  -8.833  -2.149  10.856
    4    HD2  PRO  43           HD2      PRO  43  -6.701  -1.287  11.006
    5    HB3  PRO  43           HB1      PRO  43  -8.426  -3.077   8.039
    6    HG3  PRO  43           HG1      PRO  43  -7.953  -3.569  10.262
    7    HD3  PRO  43           HD1      PRO  43  -6.081  -2.339   9.717

  No H/Q in entry =           7
  In of MODEL   18
    1    HA3  GLY  44           HA2      GLY  44 -11.472   1.709   8.611
    2    H    GLY  44           HN       GLY  44 -10.818  -0.869   7.417
    3    HA2  GLY  44           HA1      GLY  44 -12.450   0.819   7.454

  No H/Q in entry =           3
  In of MODEL   18
    1    HA   ASN  45           HA       ASN  45 -14.395  -0.301  11.253
    2    HB2  ASN  45           HB2      ASN  45 -16.532   1.360   9.901
    3   HD21  ASN  45          HD21      ASN  45 -15.611   3.250   9.457
    4   HD22  ASN  45          HD22      ASN  45 -14.692   4.196  10.572
    5    H    ASN  45           HN       ASN  45 -14.361   0.898   8.569
    6    HB3  ASN  45           HB1      ASN  45 -16.550   0.793  11.569

  No H/Q in entry =           6
  In of MODEL   18
    1    HA3  GLY  46           HA2      GLY  46 -15.769  -4.011   9.322
    2    H    GLY  46           HN       GLY  46 -14.189  -1.872   8.832
    3    HA2  GLY  46           HA1      GLY  46 -16.806  -2.995   8.332

  No H/Q in entry =           3
  In of MODEL   19
    1    H1   ALA   1           HT2      ALA   1  14.047  16.045  -0.748
    2    H2   ALA   1           HT1      ALA   1  14.912  15.208   0.475
    3    H3   ALA   1           HT3      ALA   1  14.833  16.919   0.503
    4    HA   ALA   1           HA       ALA   1  16.254  17.172  -1.211
    5    HB1  ALA   1           HB1      ALA   1  17.112  15.863   0.936
    6    HB3  ALA   1           HB2      ALA   1  18.171  16.242  -0.423
    7    HB2  ALA   1           HB3      ALA   1  17.464  14.632  -0.278

  No H/Q in entry =           7
  In of MODEL   19
    1    HA   MET   2           HA       MET   2  15.065  13.749  -4.014
    2    HB2  MET   2           HB2      MET   2  17.443  13.014  -3.157
    3    H    MET   2           HN       MET   2  15.257  13.760  -1.117
    4    HG2  MET   2           HG2      MET   2  15.819  11.560  -5.214
    5    HE2  MET   2           HE1      MET   2  17.957   8.875  -6.617
    6    HB3  MET   2           HB1      MET   2  16.620  11.503  -2.796
    7    HE1  MET   2           HE2      MET   2  17.006  10.249  -7.181
    8    HE3  MET   2           HE3      MET   2  16.373   9.199  -5.914
    9    HG3  MET   2           HG1      MET   2  17.030  12.817  -5.457

  No H/Q in entry =           9
  In of MODEL   19
    1    HA   ASP   3           HA       ASP   3  11.871  11.332  -1.897
    2    HB2  ASP   3           HB2      ASP   3   9.632  12.030  -2.809
    3    H    ASP   3           HN       ASP   3  12.821  13.571  -3.374
    4    HB3  ASP   3           HB1      ASP   3  10.509  13.303  -1.965

  No H/Q in entry =           4
  In of MODEL   19
    1    HA   CYS   4           HA       CYS   4  10.272   9.059  -5.539
    2    HB2  CYS   4           HB2      CYS   4  12.689   8.634  -5.213
    3    H    CYS   4           HN       CYS   4  10.350   9.711  -2.815
    4    HB3  CYS   4           HB1      CYS   4  12.298   7.455  -3.966

  No H/Q in entry =           4
  In of MODEL   19
    1    HA   THR   5           HA       THR   5   8.946   6.402  -1.117
    2    HB   THR   5           HB       THR   5   6.844   6.471  -3.211
    3    HG1  THR   5           HG1      THR   5   7.820   8.768  -1.888
    4   HG22  THR   5          HG21      THR   5   5.907   7.526  -0.812
    5   HG21  THR   5          HG22      THR   5   6.988   6.209  -0.358
    6   HG23  THR   5          HG23      THR   5   5.638   5.905  -1.450
    7    H    THR   5           HN       THR   5  10.325   7.816  -2.244

  No H/Q in entry =           7
  In of MODEL   19
    1    HA   THR   6           HA       THR   6   9.031   2.631  -3.358
    2    HB   THR   6           HB       THR   6  11.114   1.363  -2.747
    3    HG1  THR   6           HG1      THR   6  12.234   1.968  -1.093
    4   HG21  THR   6          HG21      THR   6  10.907   3.660  -4.276
    5   HG23  THR   6          HG22      THR   6  12.232   2.496  -4.283
    6   HG22  THR   6          HG23      THR   6  12.323   3.929  -3.259
    7    H    THR   6           HN       THR   6   9.557   4.349  -1.029

  No H/Q in entry =           7
  In of MODEL   19
    1    HA3  GLY   7           HA2      GLY   7   8.592  -0.930  -0.547
    2    H    GLY   7           HN       GLY   7   8.571   0.430  -2.889
    3    HA2  GLY   7           HA1      GLY   7   7.174   0.095  -0.384

  No H/Q in entry =           3
  In of MODEL   19
    1    HA   PRO   8           HA       PRO   8   6.107  -3.871  -2.692
    2    HB2  PRO   8           HB2      PRO   8   4.328  -4.862  -0.911
    3    HG2  PRO   8           HG2      PRO   8   4.427  -3.198   0.706
    4    HD2  PRO   8           HD2      PRO   8   6.139  -1.661   0.760
    5    HB3  PRO   8           HB1      PRO   8   6.061  -5.197  -0.811
    6    HG3  PRO   8           HG1      PRO   8   5.698  -4.284   1.298
    7    HD3  PRO   8           HD1      PRO   8   7.391  -2.904   0.568

  No H/Q in entry =           7
  In of MODEL   19
    1    HA   CYS   9           HA       CYS   9   1.922  -1.891  -2.691
    2    HB2  CYS   9           HB2      CYS   9   2.159  -1.105  -0.083
    3    H    CYS   9           HN       CYS   9   4.270  -1.397  -1.029
    4    HB3  CYS   9           HB1      CYS   9   1.890   0.436  -0.890

  No H/Q in entry =           4
  In of MODEL   19
    1    HA   CYS  10           HA       CYS  10   3.054   1.069  -5.633
    2    HB2  CYS  10           HB2      CYS  10   4.964   2.669  -5.227
    3    H    CYS  10           HN       CYS  10   4.059  -1.122  -4.206
    4    HB3  CYS  10           HB1      CYS  10   3.829   2.506  -3.892

  No H/Q in entry =           4
  In of MODEL   19
    1    HA   ARG  11           HA       ARG  11   6.163  -0.545  -8.238
    2    HB2  ARG  11           HB2      ARG  11   5.875   0.249 -10.505
    3    HG2  ARG  11           HG2      ARG  11   4.545   2.637  -9.256
    4    HD2  ARG  11           HD2      ARG  11   4.404   3.092 -11.907
    5    HE   ARG  11           HE       ARG  11   2.463   2.356  -9.958
    6   HH11  ARG  11          HH11      ARG  11   2.921   2.877 -13.379
    7   HH12  ARG  11          HH12      ARG  11   1.261   3.275 -13.667
    8   HH21  ARG  11          HH21      ARG  11   0.279   2.880 -10.336
    9   HH22  ARG  11          HH22      ARG  11  -0.239   3.278 -11.940
   10    H    ARG  11           HN       ARG  11   4.551   1.758  -7.403
   11    HB3  ARG  11           HB1      ARG  11   4.307   0.172  -9.715
   12    HG3  ARG  11           HG1      ARG  11   5.944   2.614 -10.332
   13    HD3  ARG  11           HD1      ARG  11   4.138   1.349 -11.878

  No H/Q in entry =          13
  In of MODEL   19
    1    HA   GLN  12           HA       GLN  12   9.958   1.481  -8.690
    2    HB2  GLN  12           HB2      GLN  12   9.657   0.554 -11.182
    3    HG2  GLN  12           HG2      GLN  12  11.809   1.283  -9.705
    4   HE21  GLN  12          HE21      GLN  12  12.235   2.013 -13.083
    5   HE22  GLN  12          HE22      GLN  12  12.908   3.589 -12.863
    6    H    GLN  12           HN       GLN  12   7.771   0.558 -10.141
    7    HB3  GLN  12           HB1      GLN  12   9.753   2.271 -11.549
    8    HG3  GLN  12           HG1      GLN  12  11.881   0.618 -11.336

  No H/Q in entry =           8
  In of MODEL   19
    1    HA   CYS  13           HA       CYS  13   9.171   5.399  -6.788
    2    HB2  CYS  13           HB2      CYS  13  10.961   5.404  -8.812
    3    H    CYS  13           HN       CYS  13   9.358   3.211  -7.375
    4    HB3  CYS  13           HB1      CYS  13   9.716   6.433  -9.510

  No H/Q in entry =           4
  In of MODEL   19
    1    HA   LYS  14           HA       LYS  14   5.140   6.542  -7.769
    2    HB2  LYS  14           HB2      LYS  14   5.666   4.534  -9.857
    3    HG2  LYS  14           HG2      LYS  14   4.899   7.375  -9.685
    4    HD2  LYS  14           HD2      LYS  14   4.431   7.006 -12.295
    5    HE2  LYS  14           HE2      LYS  14   3.015   8.291 -10.791
    6    HZ1  LYS  14           HZ1      LYS  14   2.847   6.562  -9.037
    7    HZ3  LYS  14           HZ2      LYS  14   1.753   5.722 -10.015
    8    HZ2  LYS  14           HZ3      LYS  14   1.364   7.267  -9.447
    9    H    LYS  14           HN       LYS  14   6.809   4.408  -7.037
   10    HB3  LYS  14           HB1      LYS  14   3.962   4.857  -9.568
   11    HG3  LYS  14           HG1      LYS  14   6.040   6.566 -10.760
   12    HD3  LYS  14           HD1      LYS  14   3.755   5.501 -11.668
   13    HE3  LYS  14           HE1      LYS  14   2.046   7.233 -11.815

  No H/Q in entry =          13
  In of MODEL   19
    1    HA   LEU  15           HA       LEU  15   2.965   3.847  -5.075
    2    HB2  LEU  15           HB2      LEU  15   1.332   5.275  -3.752
    3    HG   LEU  15           HG       LEU  15   1.667   7.205  -5.641
    4   HD12  LEU  15          HD11      LEU  15   0.970   8.727  -3.552
    5   HD11  LEU  15          HD12      LEU  15   0.716   7.131  -2.847
    6   HD13  LEU  15          HD13      LEU  15  -0.130   7.586  -4.326
    7   HD22  LEU  15          HD21      LEU  15   3.700   8.112  -5.333
    8   HD21  LEU  15          HD22      LEU  15   3.861   7.456  -3.704
    9   HD23  LEU  15          HD23      LEU  15   2.930   8.929  -3.973
   10    H    LEU  15           HN       LEU  15   3.587   6.381  -6.305
   11    HB3  LEU  15           HB1      LEU  15   3.037   5.631  -3.560

  No H/Q in entry =          11
  In of MODEL   19
    1    HA   LYS  16           HA       LYS  16  -0.419   3.029  -7.662
    2    HB2  LYS  16           HB2      LYS  16  -0.488   1.026  -5.416
    3    HG2  LYS  16           HG2      LYS  16   0.010   0.682  -8.366
    4    HD2  LYS  16           HD2      LYS  16   0.809  -1.353  -6.384
    5    HE2  LYS  16           HE2      LYS  16   0.779  -1.233  -9.082
    6    HZ3  LYS  16           HZ1      LYS  16  -1.542  -2.952  -8.468
    7    HZ2  LYS  16           HZ2      LYS  16  -0.990  -2.419  -9.975
    8    HZ1  LYS  16           HZ3      LYS  16  -1.747  -1.334  -8.922
    9    H    LYS  16           HN       LYS  16   1.149   2.646  -5.305
   10    HB3  LYS  16           HB1      LYS  16  -1.706   1.029  -6.684
   11    HG3  LYS  16           HG1      LYS  16   1.259   0.740  -7.120
   12    HD3  LYS  16           HD1      LYS  16  -0.924  -1.197  -6.680
   13    HE3  LYS  16           HE1      LYS  16   0.741  -2.734  -8.157

  No H/Q in entry =          13
  In of MODEL   19
    1    HA   PRO  17           HA       PRO  17  -3.997   5.250  -6.408
    2    HB2  PRO  17           HB2      PRO  17  -5.643   2.835  -6.996
    3    HG2  PRO  17           HG2      PRO  17  -4.836   2.597  -9.166
    4    HD2  PRO  17           HD2      PRO  17  -3.044   1.768  -7.974
    5    HB3  PRO  17           HB1      PRO  17  -5.827   4.492  -7.583
    6    HG3  PRO  17           HG1      PRO  17  -4.177   4.244  -9.196
    7    HD3  PRO  17           HD1      PRO  17  -2.211   3.121  -8.766

  No H/Q in entry =           7
  In of MODEL   19
    1    HA   ALA  18           HA       ALA  18  -4.667   4.131  -2.274
    2    HB1  ALA  18           HB1      ALA  18  -5.403   6.553  -2.454
    3    HB2  ALA  18           HB2      ALA  18  -6.117   5.607  -1.148
    4    HB3  ALA  18           HB3      ALA  18  -7.047   5.936  -2.610
    5    H    ALA  18           HN       ALA  18  -5.199   5.608  -4.594

  No H/Q in entry =           5
  In of MODEL   19
    1    HA3  GLY  19           HA2      GLY  19  -7.336   0.918  -0.869
    2    H    GLY  19           HN       GLY  19  -5.518   2.321  -1.477
    3    HA2  GLY  19           HA1      GLY  19  -8.261   1.583  -2.206

  No H/Q in entry =           3
  In of MODEL   19
    1    HA   THR  20           HA       THR  20  -5.884  -1.592  -4.375
    2    HB   THR  20           HB       THR  20  -3.096  -0.532  -3.870
    3    HG1  THR  20           HG1      THR  20  -5.045   0.085  -5.824
    4   HG22  THR  20          HG21      THR  20  -3.018  -1.489  -6.372
    5   HG21  THR  20          HG22      THR  20  -4.119  -2.651  -5.632
    6   HG23  THR  20          HG23      THR  20  -2.509  -2.407  -4.954
    7    H    THR  20           HN       THR  20  -4.956   0.424  -2.463

  No H/Q in entry =           7
  In of MODEL   19
    1    HA   THR  21           HA       THR  21  -5.259  -4.521  -1.157
    2    HB   THR  21           HB       THR  21  -5.672  -6.838  -2.398
    3    HG1  THR  21           HG1      THR  21  -5.811  -6.117  -4.472
    4   HG23  THR  21          HG21      THR  21  -7.205  -6.254  -0.747
    5   HG22  THR  21          HG22      THR  21  -8.177  -6.411  -2.210
    6   HG21  THR  21          HG23      THR  21  -7.730  -4.811  -1.615
    7    H    THR  21           HN       THR  21  -6.136  -3.590  -3.648

  No H/Q in entry =           7
  In of MODEL   19
    1    HA   CYS  22           HA       CYS  22  -1.333  -5.976  -2.490
    2    HB2  CYS  22           HB2      CYS  22   0.452  -4.813  -1.307
    3    H    CYS  22           HN       CYS  22  -3.237  -4.861  -0.535
    4    HB3  CYS  22           HB1      CYS  22  -0.780  -3.665  -1.821

  No H/Q in entry =           4
  In of MODEL   19
    1    HA   TRP  23           HA       TRP  23  -0.966  -8.522   1.259
    2    HB2  TRP  23           HB2      TRP  23  -0.372  -6.378   2.680
    3    HD1  TRP  23           HD1      TRP  23   1.131  -8.987   2.202
    4    HE1  TRP  23           HE1      TRP  23   2.036 -10.422   4.137
    5    HE3  TRP  23           HE3      TRP  23  -1.901  -7.294   5.955
    6    HZ2  TRP  23           HZ2      TRP  23   1.531 -10.788   6.891
    7    HZ3  TRP  23           HZ3      TRP  23  -1.625  -8.238   8.210
    8    HH2  TRP  23           HH2      TRP  23   0.056  -9.949   8.666
    9    H    TRP  23           HN       TRP  23  -2.359  -5.951   0.891
   10    HB3  TRP  23           HB1      TRP  23  -1.807  -6.845   3.588

  No H/Q in entry =          10
  In of MODEL   19
    1    HA   ARG  24           HA       ARG  24  -4.510 -10.308   3.202
    2    HB2  ARG  24           HB2      ARG  24  -5.500  -9.071   1.326
    3    HG2  ARG  24           HG2      ARG  24  -6.432 -11.788   1.993
    4    HD2  ARG  24           HD2      ARG  24  -8.351 -11.549   0.431
    5    HE   ARG  24           HE       ARG  24  -5.782 -12.420  -0.324
    6   HH11  ARG  24          HH11      ARG  24  -8.858 -11.551  -1.725
    7   HH12  ARG  24          HH12      ARG  24  -8.660 -12.576  -3.106
    8   HH21  ARG  24          HH21      ARG  24  -5.520 -13.769  -2.140
    9   HH22  ARG  24          HH22      ARG  24  -6.765 -13.836  -3.342
   10    H    ARG  24           HN       ARG  24  -2.182 -10.255   1.641
   11    HB3  ARG  24           HB1      ARG  24  -5.013 -10.349   0.221
   12    HG3  ARG  24           HG1      ARG  24  -7.263 -10.236   2.115
   13    HD3  ARG  24           HD1      ARG  24  -7.490 -10.229  -0.359

  No H/Q in entry =          13
  In of MODEL   19
    1    HA   THR  25           HA       THR  25  -3.209 -14.429   2.371
    2    HB   THR  25           HB       THR  25  -3.125 -15.585   4.718
    3    HG1  THR  25           HG1      THR  25  -4.311 -13.774   5.676
    4   HG22  THR  25          HG21      THR  25  -1.072 -13.770   5.134
    5   HG21  THR  25          HG22      THR  25  -1.279 -13.824   3.383
    6   HG23  THR  25          HG23      THR  25  -0.975 -15.311   4.281
    7    H    THR  25           HN       THR  25  -4.197 -12.252   4.056

  No H/Q in entry =           7
  In of MODEL   19
    1    HA   SER  26           HA       SER  26  -7.779 -15.094   3.000
    2    HB2  SER  26           HB2      SER  26  -6.329 -16.818   4.393
    3    HG   SER  26           HG       SER  26  -9.020 -17.306   4.770
    4    H    SER  26           HN       SER  26  -5.932 -13.526   4.396
    5    HB3  SER  26           HB1      SER  26  -7.398 -16.314   5.701

  No H/Q in entry =           5
  In of MODEL   19
    1    HA   VAL  27           HA       VAL  27  -9.688 -12.726   6.379
    2    HB   VAL  27           HB       VAL  27  -9.058 -14.260   8.191
    3    H    VAL  27           HN       VAL  27  -6.921 -13.705   6.120

  No H/Q in entry =           3
  In of MODEL   19
    1    HA   SER  28           HA       SER  28  -6.589  -9.262   7.551
    2    HB2  SER  28           HB2      SER  28  -4.450 -10.693   7.453
    3    HG   SER  28           HG       SER  28  -3.851  -8.777   8.088
    4    H    SER  28           HN       SER  28  -6.280 -11.912   6.647
    5    HB3  SER  28           HB1      SER  28  -4.331 -10.171   5.773

  No H/Q in entry =           5
  In of MODEL   19
    1    HA   SER  29           HA       SER  29  -7.823  -7.909   3.501
    2    HB2  SER  29           HB2      SER  29 -10.163  -7.673   5.333
    3    HG   SER  29           HG       SER  29  -9.661  -8.707   2.749
    4    H    SER  29           HN       SER  29  -8.238  -8.271   6.375
    5    HB3  SER  29           HB1      SER  29 -10.143  -6.654   3.894

  No H/Q in entry =           5
  In of MODEL   19
    1    HA   HIS  30           HA       HIS  30  -6.556  -3.877   4.973
    2    HB2  HIS  30           HB2      HIS  30  -4.116  -5.460   4.499
    3    HD1  HIS  30           HD1      HIS  30  -3.425  -2.319   6.124
    4    HD2  HIS  30           HD2      HIS  30  -5.145  -5.932   7.243
    5    HE1  HIS  30           HE1      HIS  30  -3.357  -2.346   8.638
    6    HE2  HIS  30           HE2      HIS  30  -4.327  -4.578   9.289
    7    H    HIS  30           HN       HIS  30  -5.961  -6.516   3.870
    8    HB3  HIS  30           HB1      HIS  30  -3.954  -3.740   4.165

  No H/Q in entry =           8
  In of MODEL   19
    1    HA   TYR  31           HA       TYR  31  -5.595  -2.399   0.785
    2    HB2  TYR  31           HB2      TYR  31  -6.981  -0.167   2.284
    3    HD1  TYR  31           HD1      TYR  31  -7.881  -2.920  -0.084
    4    HD2  TYR  31           HD2      TYR  31  -8.798  -0.854   3.520
    5    HE1  TYR  31           HE1      TYR  31  -9.882  -4.320   0.202
    6    HE2  TYR  31           HE2      TYR  31 -10.801  -2.249   3.817
    7    HH   TYR  31           HH       TYR  31 -12.032  -4.248   1.347
    8    H    TYR  31           HN       TYR  31  -5.246  -2.083   3.657
    9    HB3  TYR  31           HB1      TYR  31  -7.027  -0.459   0.548

  No H/Q in entry =           9
  In of MODEL   19
    1    HA   CYS  32           HA       CYS  32  -2.056   0.046   0.620
    2    HB2  CYS  32           HB2      CYS  32  -2.979  -0.279  -1.890
    3    H    CYS  32           HN       CYS  32  -4.486  -0.835  -0.455
    4    HB3  CYS  32           HB1      CYS  32  -3.099   1.473  -1.762

  No H/Q in entry =           4
  In of MODEL   19
    1    HA   THR  33           HA       THR  33  -3.028   3.739   2.622
    2    HB   THR  33           HB       THR  33  -1.095   5.318   2.719
    3    HG1  THR  33           HG1      THR  33   0.224   3.385   1.124
    4   HG22  THR  33          HG21      THR  33   0.608   3.451   3.508
    5   HG21  THR  33          HG22      THR  33  -0.848   2.459   3.430
    6   HG23  THR  33          HG23      THR  33  -0.813   3.895   4.453
    7    H    THR  33           HN       THR  33  -1.285   2.077   1.193

  No H/Q in entry =           7
  In of MODEL   19
    1    HA3  GLY  34           HA2      GLY  34  -2.869   5.052  -2.421
    2    H    GLY  34           HN       GLY  34  -1.703   4.010  -0.640
    3    HA2  GLY  34           HA1      GLY  34  -3.777   5.989  -1.244

  No H/Q in entry =           3
  In of MODEL   19
    1    HA   ARG  35           HA       ARG  35  -0.280   8.702  -1.671
    2    HB2  ARG  35           HB2      ARG  35  -1.663   9.338   0.479
    3    HG2  ARG  35           HG2      ARG  35   0.877  10.877   0.227
    4    HD2  ARG  35           HD2      ARG  35  -1.008  12.690   0.047
    5    HE   ARG  35           HE       ARG  35  -0.933  11.770   2.756
    6   HH11  ARG  35          HH11      ARG  35   0.961  13.213   0.205
    7   HH12  ARG  35          HH12      ARG  35   2.076  13.972   1.291
    8   HH21  ARG  35          HH21      ARG  35   0.532  12.767   4.186
    9   HH22  ARG  35          HH22      ARG  35   1.833  13.719   3.551
   10    H    ARG  35           HN       ARG  35  -1.293   6.688   0.225
   11    HB3  ARG  35           HB1      ARG  35  -0.123   9.090   1.289
   12    HG3  ARG  35           HG1      ARG  35  -0.270  10.855  -1.114
   13    HD3  ARG  35           HD1      ARG  35  -2.004  11.426   0.767

  No H/Q in entry =          13
  In of MODEL   19
    1    HA   SER  36           HA       SER  36   3.411   6.872   0.277
    2    HB2  SER  36           HB2      SER  36   1.946   6.050   2.748
    3    HG   SER  36           HG       SER  36   4.279   7.609   2.328
    4    H    SER  36           HN       SER  36   0.560   6.413   0.852
    5    HB3  SER  36           HB1      SER  36   3.587   5.453   2.507

  No H/Q in entry =           5
  In of MODEL   19
    1    HA   CYS  37           HA       CYS  37   3.713   2.781  -1.098
    2    HB2  CYS  37           HB2      CYS  37   6.365   3.402   0.121
    3    H    CYS  37           HN       CYS  37   4.747   4.800   0.695
    4    HB3  CYS  37           HB1      CYS  37   6.074   1.761  -0.445

  No H/Q in entry =           4
  In of MODEL   19
    1    HA   GLU  38           HA       GLU  38   4.266   0.588   3.206
    2    HB2  GLU  38           HB2      GLU  38   2.931   2.996   4.444
    3    HG2  GLU  38           HG2      GLU  38   5.328   1.824   5.658
    4    H    GLU  38           HN       GLU  38   4.114   3.216   2.311
    5    HB3  GLU  38           HB1      GLU  38   3.145   1.466   5.284
    6    HG3  GLU  38           HG1      GLU  38   5.581   2.584   4.087

  No H/Q in entry =           6
  In of MODEL   19
    1    HA   CYS  39           HA       CYS  39   0.365  -0.906   1.989
    2    HB2  CYS  39           HB2      CYS  39   2.000  -3.020   3.251
    3    H    CYS  39           HN       CYS  39   2.876  -1.064   3.333
    4    HB3  CYS  39           HB1      CYS  39   0.265  -3.317   3.223

  No H/Q in entry =           4
  In of MODEL   19
    1    HA   PRO  40           HA       PRO  40  -1.574  -1.605   6.336
    2    HB2  PRO  40           HB2      PRO  40   0.037  -1.512   8.512
    3    HG2  PRO  40           HG2      PRO  40   2.076  -1.132   7.468
    4    HD2  PRO  40           HD2      PRO  40   2.364  -1.467   5.209
    5    HB3  PRO  40           HB1      PRO  40  -0.259  -3.001   7.606
    6    HG3  PRO  40           HG1      PRO  40   2.062  -2.905   7.487
    7    HD3  PRO  40           HD1      PRO  40   1.564  -3.051   5.243

  No H/Q in entry =           7
  In of MODEL   19
    1    HA   SER  41           HA       SER  41  -1.445   2.273   8.525
    2    HB2  SER  41           HB2      SER  41  -1.975   4.031   6.888
    3    HG   SER  41           HG       SER  41  -2.534   1.878   5.123
    4    H    SER  41           HN       SER  41  -2.626   0.037   7.317
    5    HB3  SER  41           HB1      SER  41  -0.804   2.887   6.231

  No H/Q in entry =           5
  In of MODEL   19
    1    HA   TYR  42           HA       TYR  42  -5.095   1.607  11.031
    2    HB2  TYR  42           HB2      TYR  42  -5.663   3.800   9.026
    3    HD1  TYR  42           HD1      TYR  42  -3.387   4.713   9.060
    4    HD2  TYR  42           HD2      TYR  42  -5.612   4.192  12.648
    5    HE1  TYR  42           HE1      TYR  42  -1.814   6.189  10.242
    6    HE2  TYR  42           HE2      TYR  42  -4.047   5.667  13.840
    7    HH   TYR  42           HH       TYR  42  -2.329   7.726  12.835
    8    H    TYR  42           HN       TYR  42  -3.084   1.472   9.977
    9    HB3  TYR  42           HB1      TYR  42  -6.536   3.517  10.528

  No H/Q in entry =           9
  In of MODEL   19
    1    HA   PRO  43           HA       PRO  43  -6.926  -1.316   7.965
    2    HB2  PRO  43           HB2      PRO  43  -8.127  -2.175  10.556
    3    HG2  PRO  43           HG2      PRO  43  -6.080  -2.733  11.513
    4    HD2  PRO  43           HD2      PRO  43  -5.982  -0.436  11.681
    5    HB3  PRO  43           HB1      PRO  43  -7.430  -3.153   9.259
    6    HG3  PRO  43           HG1      PRO  43  -5.251  -2.750   9.945
    7    HD3  PRO  43           HD1      PRO  43  -4.561  -0.666  10.642

  No H/Q in entry =           7
  In of MODEL   19
    1    HA3  GLY  44           HA2      GLY  44 -11.020   0.433   9.293
    2    H    GLY  44           HN       GLY  44  -8.355   0.704  10.447
    3    HA2  GLY  44           HA1      GLY  44 -10.600   1.335  10.741

  No H/Q in entry =           3
  In of MODEL   19
    1    HA   ASN  45           HA       ASN  45 -11.085   4.126   7.089
    2    HB2  ASN  45           HB2      ASN  45  -8.208   3.377   6.902
    3   HD21  ASN  45          HD21      ASN  45  -6.893   4.927   7.900
    4   HD22  ASN  45          HD22      ASN  45  -7.546   6.093   8.995
    5    H    ASN  45           HN       ASN  45 -10.359   1.375   7.210
    6    HB3  ASN  45           HB1      ASN  45  -8.807   4.601   5.787

  No H/Q in entry =           6
  In of MODEL   19
    1    HA3  GLY  46           HA2      GLY  46 -11.935   2.365   3.175
    2    H    GLY  46           HN       GLY  46 -12.153   4.414   5.241
    3    HA2  GLY  46           HA1      GLY  46 -13.190   3.588   3.299

  No H/Q in entry =           3
  In of MODEL   20
    1    H1   ALA   1           HT3      ALA   1  15.510  14.072   1.023
    2    H2   ALA   1           HT2      ALA   1  14.892  15.508   1.732
    3    H3   ALA   1           HT1      ALA   1  14.969  14.059   2.650
    4    HA   ALA   1           HA       ALA   1  12.787  14.220   2.080
    5    HB3  ALA   1           HB1      ALA   1  12.074  14.704  -0.265
    6    HB1  ALA   1           HB2      ALA   1  13.758  15.071  -0.641
    7    HB2  ALA   1           HB3      ALA   1  12.887  16.043   0.544

  No H/Q in entry =           7
  In of MODEL   20
    1    HA   MET   2           HA       MET   2  12.600  10.088   0.915
    2    HB2  MET   2           HB2      MET   2   9.992  10.894  -0.382
    3    H    MET   2           HN       MET   2  11.426  12.630   0.974
    4    HG2  MET   2           HG2      MET   2  10.526  11.342   2.229
    5    HE2  MET   2           HE1      MET   2   8.071   7.546   2.701
    6    HB3  MET   2           HB1      MET   2  10.456   9.280   0.139
    7    HE1  MET   2           HE2      MET   2   7.910   8.755   1.427
    8    HE3  MET   2           HE3      MET   2   7.504   9.169   3.092
    9    HG3  MET   2           HG1      MET   2   8.930  10.974   1.579

  No H/Q in entry =           9
  In of MODEL   20
    1    HA   ASP   3           HA       ASP   3  14.183  10.198  -3.147
    2    HB2  ASP   3           HB2      ASP   3  15.061   7.743  -1.710
    3    H    ASP   3           HN       ASP   3  13.616   8.966  -0.619
    4    HB3  ASP   3           HB1      ASP   3  15.242   7.765  -3.462

  No H/Q in entry =           4
  In of MODEL   20
    1    HA   CYS   4           HA       CYS   4  10.291   9.655  -5.312
    2    HB2  CYS   4           HB2      CYS   4  12.605   8.184  -6.138
    3    H    CYS   4           HN       CYS   4  11.984  10.323  -3.950
    4    HB3  CYS   4           HB1      CYS   4  11.191   7.147  -6.297

  No H/Q in entry =           4
  In of MODEL   20
    1    HA   THR   5           HA       THR   5   7.716   6.925  -3.219
    2    HB   THR   5           HB       THR   5   6.292   5.446  -4.943
    3    HG1  THR   5           HG1      THR   5   6.170   6.490  -6.921
    4   HG22  THR   5          HG21      THR   5   4.728   7.283  -5.211
    5   HG21  THR   5          HG22      THR   5   5.961   8.424  -4.673
    6   HG23  THR   5          HG23      THR   5   5.340   7.206  -3.558
    7    H    THR   5           HN       THR   5   8.644   7.921  -5.672

  No H/Q in entry =           7
  In of MODEL   20
    1    HA   THR   6           HA       THR   6   9.952   3.126  -3.605
    2    HB   THR   6           HB       THR   6  11.795   2.981  -1.884
    3    HG1  THR   6           HG1      THR   6  11.164   5.708  -1.450
    4   HG21  THR   6          HG21      THR   6  11.800   5.311  -3.779
    5   HG23  THR   6          HG22      THR   6  12.446   3.692  -4.051
    6   HG22  THR   6          HG23      THR   6  13.219   4.766  -2.884
    7    H    THR   6           HN       THR   6   9.319   5.664  -2.259

  No H/Q in entry =           7
  In of MODEL   20
    1    HA3  GLY   7           HA2      GLY   7   8.816   0.404  -0.310
    2    H    GLY   7           HN       GLY   7   9.093   1.300  -2.858
    3    HA2  GLY   7           HA1      GLY   7   7.369   1.372  -0.547

  No H/Q in entry =           3
  In of MODEL   20
    1    HA   PRO   8           HA       PRO   8   6.667  -2.994  -2.126
    2    HB2  PRO   8           HB2      PRO   8   4.556  -3.595  -0.542
    3    HG2  PRO   8           HG2      PRO   8   4.385  -1.606   0.645
    4    HD2  PRO   8           HD2      PRO   8   6.093  -0.064   0.683
    5    HB3  PRO   8           HB1      PRO   8   6.230  -3.863  -0.040
    6    HG3  PRO   8           HG1      PRO   8   5.491  -2.506   1.700
    7    HD3  PRO   8           HD1      PRO   8   7.327  -1.295   1.017

  No H/Q in entry =           7
  In of MODEL   20
    1    HA   CYS   9           HA       CYS   9   2.639  -1.170  -3.430
    2    HB2  CYS   9           HB2      CYS   9   2.011  -0.302  -1.038
    3    H    CYS   9           HN       CYS   9   4.532  -0.304  -1.370
    4    HB3  CYS   9           HB1      CYS   9   2.260   1.286  -1.755

  No H/Q in entry =           4
  In of MODEL   20
    1    HA   CYS  10           HA       CYS  10   4.577   1.569  -6.215
    2    HB2  CYS  10           HB2      CYS  10   5.834   3.581  -5.502
    3    H    CYS  10           HN       CYS  10   5.288  -0.168  -4.111
    4    HB3  CYS  10           HB1      CYS  10   4.429   3.270  -4.488

  No H/Q in entry =           4
  In of MODEL   20
    1    HA   ARG  11           HA       ARG  11   8.636   0.080  -7.020
    2    HB2  ARG  11           HB2      ARG  11   8.576  -1.561  -8.880
    3    HG2  ARG  11           HG2      ARG  11   6.368  -0.319  -9.798
    4    HD2  ARG  11           HD2      ARG  11   5.301  -1.650  -7.695
    5    HE   ARG  11           HE       ARG  11   5.228  -3.856  -8.307
    6   HH11  ARG  11          HH11      ARG  11   4.367  -1.885 -11.056
    7   HH12  ARG  11          HH12      ARG  11   3.875  -3.232 -12.026
    8   HH21  ARG  11          HH21      ARG  11   4.582  -5.629  -9.582
    9   HH22  ARG  11          HH22      ARG  11   3.996  -5.358 -11.189
   10    H    ARG  11           HN       ARG  11   5.823   0.630  -7.695
   11    HB3  ARG  11           HB1      ARG  11   7.444  -1.943  -7.589
   12    HG3  ARG  11           HG1      ARG  11   6.811  -1.980 -10.198
   13    HD3  ARG  11           HD1      ARG  11   4.418  -1.235  -9.164

  No H/Q in entry =          13
  In of MODEL   20
    1    HA   GLN  12           HA       GLN  12  11.292   2.383  -9.643
    2    HB2  GLN  12           HB2      GLN  12   9.917   0.672 -11.203
    3    HG2  GLN  12           HG2      GLN  12  12.134   2.034 -11.601
    4   HE21  GLN  12          HE21      GLN  12  10.437   2.423 -14.541
    5   HE22  GLN  12          HE22      GLN  12  10.563   4.142 -14.652
    6    H    GLN  12           HN       GLN  12  10.235   0.983  -8.195
    7    HB3  GLN  12           HB1      GLN  12   9.168   2.182 -11.702
    8    HG3  GLN  12           HG1      GLN  12  11.288   1.231 -12.922

  No H/Q in entry =           8
  In of MODEL   20
    1    HA   CYS  13           HA       CYS  13   8.720   5.600  -7.225
    2    HB2  CYS  13           HB2      CYS  13  10.702   6.345  -8.652
    3    H    CYS  13           HN       CYS  13   9.634   3.588  -7.757
    4    HB3  CYS  13           HB1      CYS  13   9.546   6.559  -9.962

  No H/Q in entry =           4
  In of MODEL   20
    1    HA   LYS  14           HA       LYS  14   4.967   5.360  -9.515
    2    HB2  LYS  14           HB2      LYS  14   6.290   3.708 -11.161
    3    HG2  LYS  14           HG2      LYS  14   3.343   4.291 -11.198
    4    HD2  LYS  14           HD2      LYS  14   3.777   2.282 -12.535
    5    HE2  LYS  14           HE2      LYS  14   5.641   4.000 -14.159
    6    HZ3  LYS  14           HZ1      LYS  14   5.451   1.064 -14.247
    7    HZ2  LYS  14           HZ2      LYS  14   6.006   2.134 -15.433
    8    HZ1  LYS  14           HZ3      LYS  14   4.349   2.004 -15.122
    9    H    LYS  14           HN       LYS  14   7.056   3.612  -8.420
   10    HB3  LYS  14           HB1      LYS  14   5.087   2.580 -10.551
   11    HG3  LYS  14           HG1      LYS  14   4.632   5.137 -12.056
   12    HD3  LYS  14           HD1      LYS  14   3.358   3.665 -13.548
   13    HE3  LYS  14           HE1      LYS  14   6.190   2.818 -12.971

  No H/Q in entry =          13
  In of MODEL   20
    1    HA   LEU  15           HA       LEU  15   3.198   3.190  -6.054
    2    HB2  LEU  15           HB2      LEU  15   2.735   5.845  -5.874
    3    HG   LEU  15           HG       LEU  15   2.567   3.865  -4.073
    4   HD11  LEU  15          HD11      LEU  15   2.784   6.522  -3.961
    5   HD13  LEU  15          HD12      LEU  15   2.541   5.521  -2.530
    6   HD12  LEU  15          HD13      LEU  15   1.171   6.345  -3.272
    7   HD22  LEU  15          HD21      LEU  15   0.489   3.300  -3.395
    8   HD21  LEU  15          HD22      LEU  15   0.076   3.692  -5.065
    9   HD23  LEU  15          HD23      LEU  15  -0.188   4.880  -3.788
   10    H    LEU  15           HN       LEU  15   3.659   5.399  -7.765
   11    HB3  LEU  15           HB1      LEU  15   1.116   5.281  -6.240

  No H/Q in entry =          11
  In of MODEL   20
    1    HA   LYS  16           HA       LYS  16   0.345   0.984  -8.453
    2    HB2  LYS  16           HB2      LYS  16   0.388  -0.088  -5.685
    3    HG2  LYS  16           HG2      LYS  16   0.486  -2.253  -7.126
    4    HD2  LYS  16           HD2      LYS  16   2.994  -1.450  -7.710
    5    HE2  LYS  16           HE2      LYS  16   3.567  -2.045  -5.348
    6    HZ1  LYS  16           HZ1      LYS  16   3.131  -3.734  -7.119
    7    HZ3  LYS  16           HZ2      LYS  16   1.564  -3.897  -6.504
    8    HZ2  LYS  16           HZ3      LYS  16   2.896  -4.287  -5.537
    9    H    LYS  16           HN       LYS  16   1.624   1.660  -6.024
   10    HB3  LYS  16           HB1      LYS  16  -0.978  -0.551  -6.692
   11    HG3  LYS  16           HG1      LYS  16   0.879  -1.135  -8.434
   12    HD3  LYS  16           HD1      LYS  16   2.545  -0.235  -6.511
   13    HE3  LYS  16           HE1      LYS  16   1.839  -2.104  -5.006

  No H/Q in entry =          13
  In of MODEL   20
    1    HA   PRO  17           HA       PRO  17  -3.354   3.399  -8.458
    2    HB2  PRO  17           HB2      PRO  17  -4.693   0.877  -9.304
    3    HG2  PRO  17           HG2      PRO  17  -3.262   0.498 -11.099
    4    HD2  PRO  17           HD2      PRO  17  -1.905  -0.149  -9.347
    5    HB3  PRO  17           HB1      PRO  17  -4.715   2.472 -10.063
    6    HG3  PRO  17           HG1      PRO  17  -2.654   2.164 -11.080
    7    HD3  PRO  17           HD1      PRO  17  -0.890   1.160  -9.985

  No H/Q in entry =           7
  In of MODEL   20
    1    HA   ALA  18           HA       ALA  18  -5.219   2.617  -4.629
    2    HB3  ALA  18           HB1      ALA  18  -7.670   3.916  -5.672
    3    HB1  ALA  18           HB2      ALA  18  -6.195   4.881  -5.625
    4    HB2  ALA  18           HB3      ALA  18  -6.820   4.155  -4.145
    5    H    ALA  18           HN       ALA  18  -5.082   3.809  -7.142

  No H/Q in entry =           5
  In of MODEL   20
    1    HA3  GLY  19           HA2      GLY  19  -8.154  -0.583  -4.188
    2    H    GLY  19           HN       GLY  19  -5.787   0.593  -4.181
    3    HA2  GLY  19           HA1      GLY  19  -7.722  -0.786  -5.880

  No H/Q in entry =           3
  In of MODEL   20
    1    HA   THR  20           HA       THR  20  -4.697  -3.851  -5.069
    2    HB   THR  20           HB       THR  20  -2.366  -2.369  -4.017
    3    HG1  THR  20           HG1      THR  20  -2.728  -0.789  -5.377
    4   HG22  THR  20          HG21      THR  20  -1.475  -3.495  -6.240
    5   HG21  THR  20          HG22      THR  20  -2.894  -4.511  -5.986
    6   HG23  THR  20          HG23      THR  20  -1.658  -4.394  -4.733
    7    H    THR  20           HN       THR  20  -4.847  -1.065  -5.180

  No H/Q in entry =           7
  In of MODEL   20
    1    HA   THR  21           HA       THR  21  -4.495  -4.385  -0.726
    2    HB   THR  21           HB       THR  21  -3.440  -6.854  -0.396
    3    HG1  THR  21           HG1      THR  21  -3.586  -8.003  -2.260
    4   HG21  THR  21          HG21      THR  21  -6.094  -5.918  -1.289
    5   HG23  THR  21          HG22      THR  21  -5.633  -6.851   0.135
    6   HG22  THR  21          HG23      THR  21  -5.752  -7.642  -1.437
    7    H    THR  21           HN       THR  21  -3.275  -4.979  -3.333

  No H/Q in entry =           7
  In of MODEL   20
    1    HA   CYS  22           HA       CYS  22  -0.770  -4.140   1.515
    2    HB2  CYS  22           HB2      CYS  22  -0.290  -3.299  -0.998
    3    H    CYS  22           HN       CYS  22  -3.189  -3.179   0.504
    4    HB3  CYS  22           HB1      CYS  22  -0.071  -1.779  -0.138

  No H/Q in entry =           4
  In of MODEL   20
    1    HA   TRP  23           HA       TRP  23  -2.007  -1.143   4.393
    2    HB2  TRP  23           HB2      TRP  23  -2.092   0.375   2.425
    3    HD1  TRP  23           HD1      TRP  23  -1.149   1.766   4.566
    4    HE1  TRP  23           HE1      TRP  23  -2.287   3.551   6.030
    5    HE3  TRP  23           HE3      TRP  23  -6.025   0.840   3.335
    6    HZ2  TRP  23           HZ2      TRP  23  -4.905   4.448   6.589
    7    HZ3  TRP  23           HZ3      TRP  23  -7.784   2.206   4.379
    8    HH2  TRP  23           HH2      TRP  23  -7.234   3.972   5.973
    9    H    TRP  23           HN       TRP  23  -3.080  -2.985   2.572
   10    HB3  TRP  23           HB1      TRP  23  -3.833   0.131   2.348

  No H/Q in entry =          10
  In of MODEL   20
    1    HA   ARG  24           HA       ARG  24  -6.026  -1.990   5.953
    2    HB2  ARG  24           HB2      ARG  24  -4.874  -4.093   6.422
    3    HG2  ARG  24           HG2      ARG  24  -7.013  -3.243   7.810
    4    HD2  ARG  24           HD2      ARG  24  -5.037  -4.128   9.903
    5    HE   ARG  24           HE       ARG  24  -7.846  -3.937   9.973
    6   HH11  ARG  24          HH11      ARG  24  -5.031  -3.102  11.859
    7   HH12  ARG  24          HH12      ARG  24  -5.868  -3.182  13.373
    8   HH21  ARG  24          HH21      ARG  24  -8.948  -4.043  11.963
    9   HH22  ARG  24          HH22      ARG  24  -8.091  -3.717  13.433
   10    H    ARG  24           HN       ARG  24  -3.133  -1.483   6.178
   11    HB3  ARG  24           HB1      ARG  24  -4.067  -3.364   7.803
   12    HG3  ARG  24           HG1      ARG  24  -6.292  -4.843   7.992
   13    HD3  ARG  24           HD1      ARG  24  -5.523  -2.452   9.656

  No H/Q in entry =          13
  In of MODEL   20
    1    HA   THR  25           HA       THR  25  -6.048   0.345   9.753
    2    HB   THR  25           HB       THR  25  -8.068   2.046   9.007
    3    HG1  THR  25           HG1      THR  25  -8.163   0.721   7.017
    4   HG21  THR  25          HG21      THR  25  -5.723   2.640   9.597
    5   HG23  THR  25          HG22      THR  25  -6.403   3.560   8.255
    6   HG22  THR  25          HG23      THR  25  -5.268   2.248   7.939
    7    H    THR  25           HN       THR  25  -7.320  -1.243   7.669

  No H/Q in entry =           7
  In of MODEL   20
    1    HA   SER  26           HA       SER  26 -10.362  -1.481  10.483
    2    HB2  SER  26           HB2      SER  26  -9.794   0.797  11.722
    3    HG   SER  26           HG       SER  26 -11.427   0.278  13.183
    4    H    SER  26           HN       SER  26  -9.372   0.345   8.549
    5    HB3  SER  26           HB1      SER  26 -11.358   1.272  11.061

  No H/Q in entry =           5
  In of MODEL   20
    1    HA   VAL  27           HA       VAL  27 -13.824   0.600   8.012
    2    HB   VAL  27           HB       VAL  27 -13.656   2.227   6.084
    3    H    VAL  27           HN       VAL  27 -11.096   1.304   8.444

  No H/Q in entry =           3
  In of MODEL   20
    1    HA   SER  28           HA       SER  28 -12.278  -1.880   4.550
    2    HB2  SER  28           HB2      SER  28 -10.775   0.268   3.803
    3    HG   SER  28           HG       SER  28 -11.275  -2.179   2.481
    4    H    SER  28           HN       SER  28 -10.801  -0.180   6.450
    5    HB3  SER  28           HB1      SER  28  -9.575  -1.023   3.732

  No H/Q in entry =           5
  In of MODEL   20
    1    HA   SER  29           HA       SER  29 -10.084  -5.261   6.046
    2    HB2  SER  29           HB2      SER  29 -10.516  -5.777   3.151
    3    HG   SER  29           HG       SER  29 -10.926  -7.652   5.167
    4    H    SER  29           HN       SER  29 -11.206  -3.841   3.913
    5    HB3  SER  29           HB1      SER  29  -9.357  -6.813   3.984

  No H/Q in entry =           5
  In of MODEL   20
    1    HA   HIS  30           HA       HIS  30  -6.067  -3.735   4.187
    2    HB2  HIS  30           HB2      HIS  30  -5.686  -6.020   4.880
    3    HD1  HIS  30           HD1      HIS  30  -3.400  -4.845   5.325
    4    HD2  HIS  30           HD2      HIS  30  -3.822  -6.442   1.514
    5    HE1  HIS  30           HE1      HIS  30  -1.083  -4.875   4.350
    6    HE2  HIS  30           HE2      HIS  30  -1.347  -5.955   2.089
    7    H    HIS  30           HN       HIS  30  -8.378  -4.935   2.966
    8    HB3  HIS  30           HB1      HIS  30  -5.981  -6.609   3.249

  No H/Q in entry =           8
  In of MODEL   20
    1    HA   TYR  31           HA       TYR  31  -5.798  -3.032  -0.157
    2    HB2  TYR  31           HB2      TYR  31  -8.202  -1.278   0.386
    3    HD1  TYR  31           HD1      TYR  31  -9.720  -2.789   1.387
    4    HD2  TYR  31           HD2      TYR  31  -7.588  -3.944  -2.108
    5    HE1  TYR  31           HE1      TYR  31 -11.154  -4.775   1.176
    6    HE2  TYR  31           HE2      TYR  31  -9.017  -5.933  -2.330
    7    HH   TYR  31           HH       TYR  31 -10.448  -7.377  -0.565
    8    H    TYR  31           HN       TYR  31  -6.915  -2.280   2.464
    9    HB3  TYR  31           HB1      TYR  31  -7.513  -1.599  -1.202

  No H/Q in entry =           9
  In of MODEL   20
    1    HA   CYS  32           HA       CYS  32  -3.105   0.313   0.523
    2    HB2  CYS  32           HB2      CYS  32  -2.375  -1.085  -1.674
    3    H    CYS  32           HN       CYS  32  -4.285  -1.728  -0.968
    4    HB3  CYS  32           HB1      CYS  32  -2.781   0.460  -2.415

  No H/Q in entry =           4
  In of MODEL   20
    1    HA   THR  33           HA       THR  33  -5.908   3.570  -0.162
    2    HB   THR  33           HB       THR  33  -5.219   5.559   0.941
    3    HG1  THR  33           HG1      THR  33  -2.565   4.567   0.921
    4   HG21  THR  33          HG21      THR  33  -5.473   3.486   2.402
    5   HG23  THR  33          HG22      THR  33  -4.641   4.881   3.090
    6   HG22  THR  33          HG23      THR  33  -3.712   3.500   2.505
    7    H    THR  33           HN       THR  33  -3.521   2.414   0.776

  No H/Q in entry =           7
  In of MODEL   20
    1    HA3  GLY  34           HA2      GLY  34  -1.983   4.030  -3.598
    2    H    GLY  34           HN       GLY  34  -2.663   3.527  -1.438
    3    HA2  GLY  34           HA1      GLY  34  -3.607   4.605  -3.943

  No H/Q in entry =           3
  In of MODEL   20
    1    HA   ARG  35           HA       ARG  35  -1.383   8.330  -2.619
    2    HB2  ARG  35           HB2      ARG  35  -3.278   8.123  -0.771
    3    HG2  ARG  35           HG2      ARG  35  -2.110  10.240  -1.944
    4    HD2  ARG  35           HD2      ARG  35  -1.348  10.285   0.947
    5    HE   ARG  35           HE       ARG  35  -2.548  12.493  -0.321
    6   HH11  ARG  35          HH11      ARG  35   0.266  11.672   1.574
    7   HH12  ARG  35          HH12      ARG  35   0.425  13.257   2.253
    8   HH21  ARG  35          HH21      ARG  35  -2.340  14.578   0.571
    9   HH22  ARG  35          HH22      ARG  35  -1.054  14.907   1.684
   10    H    ARG  35           HN       ARG  35  -1.857   5.801  -1.187
   11    HB3  ARG  35           HB1      ARG  35  -1.912   8.352   0.313
   12    HG3  ARG  35           HG1      ARG  35  -3.355  10.366  -0.700
   13    HD3  ARG  35           HD1      ARG  35  -0.396  10.740  -0.465

  No H/Q in entry =          13
  In of MODEL   20
    1    HA   SER  36           HA       SER  36   2.305   7.453  -0.125
    2    HB2  SER  36           HB2      SER  36   2.405   6.414   2.323
    3    HG   SER  36           HG       SER  36   0.236   5.610   2.187
    4    H    SER  36           HN       SER  36  -0.369   6.224   0.023
    5    HB3  SER  36           HB1      SER  36   1.734   8.018   2.030

  No H/Q in entry =           5
  In of MODEL   20
    1    HA   CYS  37           HA       CYS  37   3.758   3.502  -1.079
    2    HB2  CYS  37           HB2      CYS  37   6.108   5.046  -0.034
    3    H    CYS  37           HN       CYS  37   4.107   6.064   0.134
    4    HB3  CYS  37           HB1      CYS  37   6.292   3.348  -0.460

  No H/Q in entry =           4
  In of MODEL   20
    1    HA   GLU  38           HA       GLU  38   4.864   2.453   3.554
    2    HB2  GLU  38           HB2      GLU  38   2.762   4.489   4.244
    3    HG2  GLU  38           HG2      GLU  38   5.452   4.724   4.237
    4    H    GLU  38           HN       GLU  38   3.860   4.635   2.171
    5    HB3  GLU  38           HB1      GLU  38   3.201   3.216   5.375
    6    HG3  GLU  38           HG1      GLU  38   4.369   5.641   5.283

  No H/Q in entry =           6
  In of MODEL   20
    1    HA   CYS  39           HA       CYS  39   1.344  -0.199   3.440
    2    HB2  CYS  39           HB2      CYS  39   2.727  -1.007   1.598
    3    H    CYS  39           HN       CYS  39   4.138   0.471   4.067
    4    HB3  CYS  39           HB1      CYS  39   3.781  -1.846   2.731

  No H/Q in entry =           4
  In of MODEL   20
    1    HA   PRO  40           HA       PRO  40   2.034  -1.234   7.876
    2    HB2  PRO  40           HB2      PRO  40  -0.874  -1.762   7.441
    3    HG2  PRO  40           HG2      PRO  40  -1.348   0.456   6.915
    4    HD2  PRO  40           HD2      PRO  40  -0.361  -0.181   4.938
    5    HB3  PRO  40           HB1      PRO  40  -0.069  -0.942   8.784
    6    HG3  PRO  40           HG1      PRO  40   0.181   1.037   7.601
    7    HD3  PRO  40           HD1      PRO  40   0.828   1.054   5.396

  No H/Q in entry =           7
  In of MODEL   20
    1    HA   SER  41           HA       SER  41   2.511  -5.490   7.006
    2    HB2  SER  41           HB2      SER  41   2.694  -5.880   9.938
    3    HG   SER  41           HG       SER  41   4.737  -4.479   8.573
    4    H    SER  41           HN       SER  41   2.626  -3.187   8.579
    5    HB3  SER  41           HB1      SER  41   3.747  -6.469   8.652

  No H/Q in entry =           5
  In of MODEL   20
    1    HA   TYR  42           HA       TYR  42  -1.177  -6.529   9.997
    2    HB2  TYR  42           HB2      TYR  42  -1.322  -4.005  10.833
    3    HD1  TYR  42           HD1      TYR  42  -2.380  -3.936  12.907
    4    HD2  TYR  42           HD2      TYR  42  -3.790  -6.649   9.949
    5    HE1  TYR  42           HE1      TYR  42  -3.893  -4.945  14.562
    6    HE2  TYR  42           HE2      TYR  42  -5.308  -7.665  11.595
    7    HH   TYR  42           HH       TYR  42  -6.192  -6.285  14.379
    8    H    TYR  42           HN       TYR  42   0.303  -4.253   9.418
    9    HB3  TYR  42           HB1      TYR  42  -2.633  -3.951   9.659

  No H/Q in entry =           9
  In of MODEL   20
    1    HA   PRO  43           HA       PRO  43  -2.842  -7.119   5.831
    2    HB2  PRO  43           HB2      PRO  43  -3.657  -9.658   6.175
    3    HG2  PRO  43           HG2      PRO  43  -3.435  -9.852   8.478
    4    HD2  PRO  43           HD2      PRO  43  -2.235  -8.324   9.697
    5    HB3  PRO  43           HB1      PRO  43  -1.952  -9.248   5.948
    6    HG3  PRO  43           HG1      PRO  43  -1.828 -10.399   7.965
    7    HD3  PRO  43           HD1      PRO  43  -0.817  -8.454   8.640

  No H/Q in entry =           7
  In of MODEL   20
    1    HA3  GLY  44           HA2      GLY  44  -7.142  -7.620   7.143
    2    H    GLY  44           HN       GLY  44  -5.047  -8.548   5.300
    3    HA2  GLY  44           HA1      GLY  44  -7.226  -7.161   5.449

  No H/Q in entry =           3
  In of MODEL   20
    1    HA   ASN  45           HA       ASN  45  -9.437 -10.255   3.293
    2    HB2  ASN  45           HB2      ASN  45  -7.021 -11.262   3.909
    3   HD21  ASN  45          HD21      ASN  45  -6.559 -13.307   2.896
    4   HD22  ASN  45          HD22      ASN  45  -7.666 -13.954   1.738
    5    H    ASN  45           HN       ASN  45  -8.255  -8.481   4.084
    6    HB3  ASN  45           HB1      ASN  45  -8.013 -12.219   5.005

  No H/Q in entry =           6
  In of MODEL   20
    1    HA3  GLY  46           HA2      GLY  46 -12.381 -11.973   6.013
    2    H    GLY  46           HN       GLY  46 -11.491 -10.287   3.940
    3    HA2  GLY  46           HA1      GLY  46 -12.375 -10.316   6.598

  No H/Q in entry =           3
  In of MODEL   21
    1    H1   ALA   1           HT2      ALA   1   9.491  14.805  -1.097
    2    H2   ALA   1           HT1      ALA   1   9.161  15.111  -2.753
    3    H3   ALA   1           HT3      ALA   1   8.187  14.006  -1.876
    4    HA   ALA   1           HA       ALA   1   9.799  12.427  -1.784
    5    HB2  ALA   1           HB1      ALA   1  10.154  13.770  -4.460
    6    HB1  ALA   1           HB2      ALA   1   8.811  12.714  -4.021
    7    HB3  ALA   1           HB3      ALA   1  10.453  12.072  -4.086

  No H/Q in entry =           7
  In of MODEL   21
    1    HA   MET   2           HA       MET   2  13.738  14.291  -1.106
    2    HB2  MET   2           HB2      MET   2  12.873  13.848   1.229
    3    H    MET   2           HN       MET   2  11.586  12.388  -0.579
    4    HG2  MET   2           HG2      MET   2  15.740  13.046   1.178
    5    HE3  MET   2           HE1      MET   2  16.148  16.272   3.828
    6    HB3  MET   2           HB1      MET   2  13.585  12.245   1.109
    7    HE2  MET   2           HE2      MET   2  15.687  16.536   2.146
    8    HE1  MET   2           HE3      MET   2  17.036  15.468   2.534
    9    HG3  MET   2           HG1      MET   2  15.276  14.645   0.598

  No H/Q in entry =           9
  In of MODEL   21
    1    HA   ASP   3           HA       ASP   3  15.204  10.425  -3.067
    2    HB2  ASP   3           HB2      ASP   3  16.353   8.732  -1.707
    3    H    ASP   3           HN       ASP   3  13.001  10.882  -1.302
    4    HB3  ASP   3           HB1      ASP   3  16.405  10.312  -0.932

  No H/Q in entry =           4
  In of MODEL   21
    1    HA   CYS   4           HA       CYS   4  10.803   8.716  -3.987
    2    HB2  CYS   4           HB2      CYS   4  12.964   8.007  -5.320
    3    H    CYS   4           HN       CYS   4  12.384  10.150  -3.202
    4    HB3  CYS   4           HB1      CYS   4  12.836   6.549  -4.341

  No H/Q in entry =           4
  In of MODEL   21
    1    HA   THR   5           HA       THR   5  10.114   5.968  -0.666
    2    HB   THR   5           HB       THR   5   7.432   5.593  -1.925
    3    HG1  THR   5           HG1      THR   5   8.389   8.057  -0.900
    4   HG23  THR   5          HG21      THR   5   6.742   5.255   0.149
    5   HG22  THR   5          HG22      THR   5   7.510   6.736   0.719
    6   HG21  THR   5          HG23      THR   5   8.438   5.239   0.630
    7    H    THR   5           HN       THR   5   9.493   6.941  -3.363

  No H/Q in entry =           7
  In of MODEL   21
    1    HA   THR   6           HA       THR   6   9.341   1.870  -2.319
    2    HB   THR   6           HB       THR   6  11.451   1.199  -0.346
    3    HG1  THR   6           HG1      THR   6  12.696   2.792  -0.841
    4   HG23  THR   6          HG21      THR   6  11.224  -0.422  -1.984
    5   HG22  THR   6          HG22      THR   6  12.598   0.534  -2.540
    6   HG21  THR   6          HG23      THR   6  11.009   0.766  -3.270
    7    H    THR   6           HN       THR   6   9.555   3.754  -0.109

  No H/Q in entry =           7
  In of MODEL   21
    1    HA3  GLY   7           HA2      GLY   7   8.095  -1.216   0.660
    2    H    GLY   7           HN       GLY   7   8.228   0.060  -1.793
    3    HA2  GLY   7           HA1      GLY   7   6.825  -0.002   0.683

  No H/Q in entry =           3
  In of MODEL   21
    1    HA   PRO   8           HA       PRO   8   5.064  -3.855  -1.215
    2    HB2  PRO   8           HB2      PRO   8   2.704  -3.753   0.121
    3    HG2  PRO   8           HG2      PRO   8   3.030  -1.793   1.323
    4    HD2  PRO   8           HD2      PRO   8   5.118  -0.852   1.574
    5    HB3  PRO   8           HB1      PRO   8   4.151  -4.517   0.788
    6    HG3  PRO   8           HG1      PRO   8   3.693  -2.974   2.468
    7    HD3  PRO   8           HD1      PRO   8   5.874  -2.404   1.986

  No H/Q in entry =           7
  In of MODEL   21
    1    HA   CYS   9           HA       CYS   9   1.919  -0.956  -2.939
    2    HB2  CYS   9           HB2      CYS   9   1.461   0.191  -0.541
    3    H    CYS   9           HN       CYS   9   3.732  -0.646  -0.661
    4    HB3  CYS   9           HB1      CYS   9   2.007   1.601  -1.442

  No H/Q in entry =           4
  In of MODEL   21
    1    HA   CYS  10           HA       CYS  10   5.000   1.768  -4.736
    2    HB2  CYS  10           HB2      CYS  10   6.736   0.654  -2.983
    3    H    CYS  10           HN       CYS  10   4.720  -0.861  -3.438
    4    HB3  CYS  10           HB1      CYS  10   7.381   0.027  -4.496

  No H/Q in entry =           4
  In of MODEL   21
    1    HA   ARG  11           HA       ARG  11   6.466  -0.630  -8.330
    2    HB2  ARG  11           HB2      ARG  11   4.641  -0.038 -10.005
    3    HG2  ARG  11           HG2      ARG  11   3.198   1.230  -7.729
    4    HD2  ARG  11           HD2      ARG  11   1.777   2.069  -9.421
    5    HE   ARG  11           HE       ARG  11   2.021  -0.614  -9.222
    6   HH11  ARG  11          HH11      ARG  11   1.349   1.524 -11.897
    7   HH12  ARG  11          HH12      ARG  11   0.387   0.362 -12.747
    8   HH21  ARG  11          HH21      ARG  11   0.756  -2.144 -10.338
    9   HH22  ARG  11          HH22      ARG  11   0.050  -1.721 -11.862
   10    H    ARG  11           HN       ARG  11   6.192   1.749  -6.815
   11    HB3  ARG  11           HB1      ARG  11   4.114  -0.742  -8.483
   12    HG3  ARG  11           HG1      ARG  11   4.213   2.224  -8.776
   13    HD3  ARG  11           HD1      ARG  11   2.938   1.681 -10.689

  No H/Q in entry =          13
  In of MODEL   21
    1    HA   GLN  12           HA       GLN  12   9.783   1.148 -10.561
    2    HB2  GLN  12           HB2      GLN  12   7.638   0.998 -12.065
    3    HG2  GLN  12           HG2      GLN  12  10.157   1.671 -12.648
    4   HE21  GLN  12          HE21      GLN  12  11.260   3.212 -13.911
    5   HE22  GLN  12          HE22      GLN  12  10.800   4.877 -13.894
    6    H    GLN  12           HN       GLN  12   8.309   0.002  -9.264
    7    HB3  GLN  12           HB1      GLN  12   7.543   2.728 -11.767
    8    HG3  GLN  12           HG1      GLN  12   8.851   1.669 -13.833

  No H/Q in entry =           8
  In of MODEL   21
    1    HA   CYS  13           HA       CYS  13  10.030   3.949  -6.759
    2    HB2  CYS  13           HB2      CYS  13  11.478   4.274  -9.065
    3    H    CYS  13           HN       CYS  13   9.532   2.141  -8.045
    4    HB3  CYS  13           HB1      CYS  13  10.597   5.796  -8.974

  No H/Q in entry =           4
  In of MODEL   21
    1    HA   LYS  14           HA       LYS  14   6.359   6.303  -7.327
    2    HB2  LYS  14           HB2      LYS  14   5.806   4.558  -9.673
    3    HG2  LYS  14           HG2      LYS  14   6.991   6.963  -9.460
    4    HD2  LYS  14           HD2      LYS  14   5.020   8.335 -10.703
    5    HE2  LYS  14           HE2      LYS  14   4.611   9.172  -8.173
    6    HZ1  LYS  14           HZ1      LYS  14   7.020   9.621  -9.846
    7    HZ3  LYS  14           HZ2      LYS  14   6.630  10.545  -8.484
    8    HZ2  LYS  14           HZ3      LYS  14   5.603  10.546  -9.828
    9    H    LYS  14           HN       LYS  14   7.326   3.571  -7.757
   10    HB3  LYS  14           HB1      LYS  14   4.467   5.502  -9.032
   11    HG3  LYS  14           HG1      LYS  14   6.156   6.399 -10.909
   12    HD3  LYS  14           HD1      LYS  14   4.085   7.433  -9.508
   13    HE3  LYS  14           HE1      LYS  14   6.125   8.292  -7.970

  No H/Q in entry =          13
  In of MODEL   21
    1    HA   LEU  15           HA       LEU  15   3.436   4.137  -4.945
    2    HB2  LEU  15           HB2      LEU  15   1.601   5.616  -4.155
    3    HG   LEU  15           HG       LEU  15   1.644   6.920  -6.507
    4   HD13  LEU  15          HD11      LEU  15   0.120   8.372  -5.571
    5   HD12  LEU  15          HD12      LEU  15   1.015   8.505  -4.057
    6   HD11  LEU  15          HD13      LEU  15   0.101   7.040  -4.415
    7   HD21  LEU  15          HD21      LEU  15   3.993   7.787  -5.529
    8   HD23  LEU  15          HD22      LEU  15   2.914   9.013  -4.864
    9   HD22  LEU  15          HD23      LEU  15   2.973   8.742  -6.605
   10    H    LEU  15           HN       LEU  15   3.949   6.287  -6.851
   11    HB3  LEU  15           HB1      LEU  15   3.195   6.339  -4.050

  No H/Q in entry =          11
  In of MODEL   21
    1    HA   LYS  16           HA       LYS  16   0.583   2.224  -7.576
    2    HB2  LYS  16           HB2      LYS  16   0.413   1.097  -4.860
    3    HG2  LYS  16           HG2      LYS  16   0.009  -0.603  -7.223
    4    HD2  LYS  16           HD2      LYS  16   2.043  -0.682  -4.999
    5    HE2  LYS  16           HE2      LYS  16   2.699  -2.093  -6.811
    6    HZ3  LYS  16           HZ1      LYS  16   1.160  -3.860  -7.592
    7    HZ2  LYS  16           HZ2      LYS  16   0.700  -2.299  -8.052
    8    HZ1  LYS  16           HZ3      LYS  16  -0.100  -3.075  -6.779
    9    H    LYS  16           HN       LYS  16   1.701   2.775  -5.033
   10    HB3  LYS  16           HB1      LYS  16  -1.022   0.850  -5.847
   11    HG3  LYS  16           HG1      LYS  16   1.546   0.261  -7.160
   12    HD3  LYS  16           HD1      LYS  16   0.448  -1.434  -4.920
   13    HE3  LYS  16           HE1      LYS  16   2.039  -3.114  -5.534

  No H/Q in entry =          13
  In of MODEL   21
    1    HA   PRO  17           HA       PRO  17  -3.141   4.563  -7.728
    2    HB2  PRO  17           HB2      PRO  17  -5.058   2.733  -8.384
    3    HG2  PRO  17           HG2      PRO  17  -3.861   0.784  -7.997
    4    HD2  PRO  17           HD2      PRO  17  -1.563   0.784  -7.767
    5    HB3  PRO  17           HB1      PRO  17  -3.866   3.353  -9.533
    6    HG3  PRO  17           HG1      PRO  17  -3.428   1.076  -9.692
    7    HD3  PRO  17           HD1      PRO  17  -1.328   1.873  -9.150

  No H/Q in entry =           7
  In of MODEL   21
    1    HA   ALA  18           HA       ALA  18  -4.980   4.324  -3.809
    2    HB2  ALA  18           HB1      ALA  18  -7.078   5.848  -3.805
    3    HB1  ALA  18           HB2      ALA  18  -6.537   6.303  -5.421
    4    HB3  ALA  18           HB3      ALA  18  -5.485   6.571  -4.031
    5    H    ALA  18           HN       ALA  18  -4.786   5.278  -6.446

  No H/Q in entry =           5
  In of MODEL   21
    1    HA3  GLY  19           HA2      GLY  19  -8.014   1.355  -2.778
    2    H    GLY  19           HN       GLY  19  -5.877   2.473  -3.191
    3    HA2  GLY  19           HA1      GLY  19  -8.428   1.681  -4.454

  No H/Q in entry =           3
  In of MODEL   21
    1    HA   THR  20           HA       THR  20  -5.680  -1.831  -5.114
    2    HB   THR  20           HB       THR  20  -3.043  -0.734  -4.135
    3    HG1  THR  20           HG1      THR  20  -2.866   0.129  -6.254
    4   HG22  THR  20          HG21      THR  20  -2.241  -1.958  -6.213
    5   HG21  THR  20          HG22      THR  20  -3.795  -2.790  -6.177
    6   HG23  THR  20          HG23      THR  20  -2.685  -2.935  -4.814
    7    H    THR  20           HN       THR  20  -5.214   0.649  -3.646

  No H/Q in entry =           7
  In of MODEL   21
    1    HA   THR  21           HA       THR  21  -5.088  -4.123  -1.459
    2    HB   THR  21           HB       THR  21  -4.576  -6.640  -2.298
    3    HG1  THR  21           HG1      THR  21  -5.762  -5.386  -4.542
    4   HG21  THR  21          HG21      THR  21  -6.663  -5.820  -1.223
    5   HG23  THR  21          HG22      THR  21  -6.915  -7.023  -2.488
    6   HG22  THR  21          HG23      THR  21  -7.224  -5.319  -2.818
    7    H    THR  21           HN       THR  21  -4.561  -3.816  -4.320

  No H/Q in entry =           7
  In of MODEL   21
    1    HA   CYS  22           HA       CYS  22  -0.680  -3.878  -1.080
    2    HB2  CYS  22           HB2      CYS  22  -1.905  -2.636   0.983
    3    H    CYS  22           HN       CYS  22  -3.363  -3.654  -0.245
    4    HB3  CYS  22           HB1      CYS  22  -1.238  -4.030   1.825

  No H/Q in entry =           4
  In of MODEL   21
    1    HA   TRP  23           HA       TRP  23  -0.502  -8.004   0.824
    2    HB2  TRP  23           HB2      TRP  23  -0.578  -6.770   3.210
    3    HD1  TRP  23           HD1      TRP  23   1.236  -8.820   1.387
    4    HE1  TRP  23           HE1      TRP  23   2.567 -10.640   2.628
    5    HE3  TRP  23           HE3      TRP  23  -1.397  -8.908   5.769
    6    HZ2  TRP  23           HZ2      TRP  23   2.509 -11.941   5.133
    7    HZ3  TRP  23           HZ3      TRP  23  -0.694 -10.469   7.536
    8    HH2  TRP  23           HH2      TRP  23   1.219 -11.954   7.223
    9    H    TRP  23           HN       TRP  23  -2.239  -5.735   1.536
   10    HB3  TRP  23           HB1      TRP  23  -1.863  -7.947   3.462

  No H/Q in entry =          10
  In of MODEL   21
    1    HA   ARG  24           HA       ARG  24  -4.442 -10.223   1.295
    2    HB2  ARG  24           HB2      ARG  24  -3.030 -10.592  -0.880
    3    HG2  ARG  24           HG2      ARG  24  -5.550 -11.276  -0.268
    4    HD2  ARG  24           HD2      ARG  24  -4.772 -13.524   0.514
    5    HE   ARG  24           HE       ARG  24  -3.277 -13.677  -1.730
    6   HH11  ARG  24          HH11      ARG  24  -5.971 -15.546  -0.534
    7   HH12  ARG  24          HH12      ARG  24  -5.457 -17.011  -1.302
    8   HH21  ARG  24          HH21      ARG  24  -2.600 -15.602  -2.741
    9   HH22  ARG  24          HH22      ARG  24  -3.543 -17.043  -2.555
   10    H    ARG  24           HN       ARG  24  -1.579 -10.136   1.800
   11    HB3  ARG  24           HB1      ARG  24  -2.745 -12.188  -0.199
   12    HG3  ARG  24           HG1      ARG  24  -4.791 -11.623  -1.823
   13    HD3  ARG  24           HD1      ARG  24  -5.983 -13.560  -0.767

  No H/Q in entry =          13
  In of MODEL   21
    1    HA   THR  25           HA       THR  25  -3.850 -13.684   3.921
    2    HB   THR  25           HB       THR  25  -3.996 -13.101   6.247
    3    HG1  THR  25           HG1      THR  25  -5.222 -10.705   5.359
    4   HG22  THR  25          HG21      THR  25  -2.919 -10.531   5.744
    5   HG21  THR  25          HG22      THR  25  -2.374 -11.622   4.470
    6   HG23  THR  25          HG23      THR  25  -2.076 -12.023   6.161
    7    H    THR  25           HN       THR  25  -5.116 -11.155   3.115

  No H/Q in entry =           7
  In of MODEL   21
    1    HA   SER  26           HA       SER  26  -8.022 -14.819   4.597
    2    HB2  SER  26           HB2      SER  26  -8.308 -16.699   6.242
    3    HG   SER  26           HG       SER  26  -6.151 -17.306   7.172
    4    H    SER  26           HN       SER  26  -5.454 -14.438   5.955
    5    HB3  SER  26           HB1      SER  26  -6.921 -16.883   5.170

  No H/Q in entry =           5
  In of MODEL   21
    1    HA   VAL  27           HA       VAL  27  -9.794 -11.980   7.400
    2    HB   VAL  27           HB       VAL  27  -8.736 -13.387   9.133
    3    H    VAL  27           HN       VAL  27  -7.379 -12.365   6.034

  No H/Q in entry =           3
  In of MODEL   21
    1    HA   SER  28           HA       SER  28  -8.458  -7.998   6.283
    2    HB2  SER  28           HB2      SER  28  -5.794  -9.266   6.624
    3    HG   SER  28           HG       SER  28  -5.795  -8.031   8.374
    4    H    SER  28           HN       SER  28  -8.250 -10.661   5.436
    5    HB3  SER  28           HB1      SER  28  -5.818  -7.654   5.909

  No H/Q in entry =           5
  In of MODEL   21
    1    HA   SER  29           HA       SER  29  -7.723  -7.783   1.965
    2    HB2  SER  29           HB2      SER  29  -9.228  -6.133   1.011
    3    HG   SER  29           HG       SER  29  -9.621  -5.150   3.640
    4    H    SER  29           HN       SER  29  -8.210  -6.537   4.588
    5    HB3  SER  29           HB1      SER  29 -10.036  -6.944   2.353

  No H/Q in entry =           5
  In of MODEL   21
    1    HA   HIS  30           HA       HIS  30  -5.418  -3.421   3.937
    2    HB2  HIS  30           HB2      HIS  30  -4.218  -5.668   2.396
    3    HD1  HIS  30           HD1      HIS  30  -1.479  -4.175   3.805
    4    HD2  HIS  30           HD2      HIS  30  -4.822  -5.969   5.500
    5    HE1  HIS  30           HE1      HIS  30  -0.786  -4.825   6.133
    6    HE2  HIS  30           HE2      HIS  30  -2.797  -5.986   7.109
    7    H    HIS  30           HN       HIS  30  -7.014  -5.038   4.023
    8    HB3  HIS  30           HB1      HIS  30  -3.429  -4.097   2.291

  No H/Q in entry =           8
  In of MODEL   21
    1    HA   TYR  31           HA       TYR  31  -6.476  -1.527   0.087
    2    HB2  TYR  31           HB2      TYR  31  -8.286  -0.297   2.161
    3    HD1  TYR  31           HD1      TYR  31 -10.384  -1.284   2.368
    4    HD2  TYR  31           HD2      TYR  31  -7.992  -2.201  -1.029
    5    HE1  TYR  31           HE1      TYR  31 -12.012  -2.998   1.692
    6    HE2  TYR  31           HE2      TYR  31  -9.614  -3.917  -1.715
    7    HH   TYR  31           HH       TYR  31 -11.857  -5.211   0.232
    8    H    TYR  31           HN       TYR  31  -6.561  -1.760   3.017
    9    HB3  TYR  31           HB1      TYR  31  -8.218   0.298   0.505

  No H/Q in entry =           9
  In of MODEL   21
    1    HA   CYS  32           HA       CYS  32  -3.263   1.373   0.984
    2    HB2  CYS  32           HB2      CYS  32  -2.872   0.161  -1.406
    3    H    CYS  32           HN       CYS  32  -4.753  -0.417  -0.570
    4    HB3  CYS  32           HB1      CYS  32  -3.228   1.799  -1.943

  No H/Q in entry =           4
  In of MODEL   21
    1    HA   THR  33           HA       THR  33  -5.511   5.033   0.276
    2    HB   THR  33           HB       THR  33  -4.048   7.030   1.117
    3    HG1  THR  33           HG1      THR  33  -2.277   6.292   2.360
    4   HG23  THR  33          HG21      THR  33  -4.565   6.585   3.326
    5   HG22  THR  33          HG22      THR  33  -4.357   4.844   3.129
    6   HG21  THR  33          HG23      THR  33  -5.764   5.649   2.434
    7    H    THR  33           HN       THR  33  -2.929   3.693   0.568

  No H/Q in entry =           7
  In of MODEL   21
    1    HA3  GLY  34           HA2      GLY  34  -1.780   5.547  -3.318
    2    H    GLY  34           HN       GLY  34  -2.215   5.119  -1.013
    3    HA2  GLY  34           HA1      GLY  34  -3.274   6.469  -3.396

  No H/Q in entry =           3
  In of MODEL   21
    1    HA   ARG  35           HA       ARG  35  -0.376   9.567  -1.851
    2    HB2  ARG  35           HB2      ARG  35   0.133  10.108   0.579
    3    HG2  ARG  35           HG2      ARG  35  -1.417   7.573   1.066
    4    HD2  ARG  35           HD2      ARG  35  -0.307   9.610   2.992
    5    HE   ARG  35           HE       ARG  35  -0.828   6.998   3.544
    6   HH11  ARG  35          HH11      ARG  35  -2.264  10.025   4.521
    7   HH12  ARG  35          HH12      ARG  35  -2.768   9.430   6.067
    8   HH21  ARG  35          HH21      ARG  35  -1.491   6.214   5.577
    9   HH22  ARG  35          HH22      ARG  35  -2.330   7.267   6.667
   10    H    ARG  35           HN       ARG  35  -1.008   6.896  -0.783
   11    HB3  ARG  35           HB1      ARG  35  -1.558   9.838   0.179
   12    HG3  ARG  35           HG1      ARG  35   0.287   7.825   1.448
   13    HD3  ARG  35           HD1      ARG  35  -2.010   9.418   2.580

  No H/Q in entry =          13
  In of MODEL   21
    1    HA   SER  36           HA       SER  36   3.582   7.389  -1.430
    2    HB2  SER  36           HB2      SER  36   3.260   8.083   1.062
    3    HG   SER  36           HG       SER  36   5.460   6.873   1.402
    4    H    SER  36           HN       SER  36   0.947   6.645  -0.448
    5    HB3  SER  36           HB1      SER  36   3.402   6.355   1.385

  No H/Q in entry =           5
  In of MODEL   21
    1    HA   CYS  37           HA       CYS  37   3.959   3.166  -2.198
    2    HB2  CYS  37           HB2      CYS  37   6.739   3.839  -1.263
    3    H    CYS  37           HN       CYS  37   5.151   5.486  -1.041
    4    HB3  CYS  37           HB1      CYS  37   6.328   2.219  -1.817

  No H/Q in entry =           4
  In of MODEL   21
    1    HA   GLU  38           HA       GLU  38   4.809   1.465   2.134
    2    HB2  GLU  38           HB2      GLU  38   6.065   3.556   3.022
    3    HG2  GLU  38           HG2      GLU  38   4.650   1.511   4.644
    4    H    GLU  38           HN       GLU  38   4.938   4.098   1.022
    5    HB3  GLU  38           HB1      GLU  38   4.518   3.986   3.738
    6    HG3  GLU  38           HG1      GLU  38   6.378   1.777   4.415

  No H/Q in entry =           6
  In of MODEL   21
    1    HA   CYS  39           HA       CYS  39   0.524   1.672   2.949
    2    HB2  CYS  39           HB2      CYS  39   1.605  -1.074   3.261
    3    H    CYS  39           HN       CYS  39   3.194   0.542   3.382
    4    HB3  CYS  39           HB1      CYS  39   0.003  -0.779   3.927

  No H/Q in entry =           4
  In of MODEL   21
    1    HA   PRO  40           HA       PRO  40  -0.014   2.680   7.207
    2    HB2  PRO  40           HB2      PRO  40  -2.676   2.271   7.530
    3    HG2  PRO  40           HG2      PRO  40  -3.108   1.028   5.617
    4    HD2  PRO  40           HD2      PRO  40  -1.621   0.944   3.859
    5    HB3  PRO  40           HB1      PRO  40  -2.020   3.633   6.614
    6    HG3  PRO  40           HG1      PRO  40  -3.378   2.665   4.992
    7    HD3  PRO  40           HD1      PRO  40  -1.371   2.702   3.861

  No H/Q in entry =           7
  In of MODEL   21
    1    HA   SER  41           HA       SER  41  -0.863  -1.132   9.323
    2    HB2  SER  41           HB2      SER  41   0.059  -0.931  11.591
    3    HG   SER  41           HG       SER  41  -0.486   0.878  12.538
    4    H    SER  41           HN       SER  41  -1.130   1.803   9.265
    5    HB3  SER  41           HB1      SER  41   1.044  -0.037  10.433

  No H/Q in entry =           5
  In of MODEL   21
    1    HA   TYR  42           HA       TYR  42  -4.779  -0.582  11.250
    2    HB2  TYR  42           HB2      TYR  42  -4.370   2.030  10.998
    3    HD1  TYR  42           HD1      TYR  42  -7.402  -0.128  11.182
    4    HD2  TYR  42           HD2      TYR  42  -5.222   3.110  12.873
    5    HE1  TYR  42           HE1      TYR  42  -8.976  -0.063  13.070
    6    HE2  TYR  42           HE2      TYR  42  -6.788   3.183  14.767
    7    HH   TYR  42           HH       TYR  42  -9.358   2.421  15.061
    8    H    TYR  42           HN       TYR  42  -3.288   0.332   8.895
    9    HB3  TYR  42           HB1      TYR  42  -5.722   1.894   9.878

  No H/Q in entry =           9
  In of MODEL   21
    1    HA   PRO  43           HA       PRO  43  -6.422  -2.586   7.412
    2    HB2  PRO  43           HB2      PRO  43  -7.589  -4.224   9.613
    3    HG2  PRO  43           HG2      PRO  43  -5.522  -4.945  10.408
    4    HD2  PRO  43           HD2      PRO  43  -5.549  -2.795  11.243
    5    HB3  PRO  43           HB1      PRO  43  -6.835  -4.744   8.102
    6    HG3  PRO  43           HG1      PRO  43  -4.683  -4.460   8.922
    7    HD3  PRO  43           HD1      PRO  43  -4.104  -2.647  10.222

  No H/Q in entry =           7
  In of MODEL   21
    1    HA3  GLY  44           HA2      GLY  44 -10.871  -2.370   6.690
    2    H    GLY  44           HN       GLY  44  -8.517  -2.613   6.573
    3    HA2  GLY  44           HA1      GLY  44 -10.694  -1.665   8.289

  No H/Q in entry =           3
  In of MODEL   21
    1    HA   ASN  45           HA       ASN  45 -11.059   1.850   5.563
    2    HB2  ASN  45           HB2      ASN  45 -13.259   2.959   5.700
    3   HD21  ASN  45          HD21      ASN  45 -13.812   3.680   7.784
    4   HD22  ASN  45          HD22      ASN  45 -14.859   2.756   8.802
    5    H    ASN  45           HN       ASN  45 -12.151  -0.003   7.542
    6    HB3  ASN  45           HB1      ASN  45 -13.411   1.247   5.318

  No H/Q in entry =           6
  In of MODEL   21
    1    HA3  GLY  46           HA2      GLY  46 -10.064   3.134  10.169
    2    H    GLY  46           HN       GLY  46 -11.826   1.620   8.979
    3    HA2  GLY  46           HA1      GLY  46 -10.994   4.404   9.389

  No H/Q in entry =           3
  In of MODEL   22
    1    H1   ALA   1           HT1      ALA   1  11.559  18.179  -1.979
    2    H2   ALA   1           HT3      ALA   1  11.645  19.224  -3.334
    3    H3   ALA   1           HT2      ALA   1  10.227  18.299  -3.055
    4    HA   ALA   1           HA       ALA   1  11.411  17.296  -4.778
    5    HB2  ALA   1           HB1      ALA   1  13.802  16.771  -3.108
    6    HB1  ALA   1           HB2      ALA   1  13.613  18.395  -3.770
    7    HB3  ALA   1           HB3      ALA   1  13.662  17.002  -4.851

  No H/Q in entry =           7
  In of MODEL   22
    1    HA   MET   2           HA       MET   2   9.937  13.989  -2.166
    2    HB2  MET   2           HB2      MET   2   8.404  14.042  -4.746
    3    H    MET   2           HN       MET   2   9.897  15.718  -4.442
    4    HG2  MET   2           HG2      MET   2   7.890  15.264  -2.404
    5    HE2  MET   2           HE1      MET   2   6.301  14.980   0.042
    6    HB3  MET   2           HB1      MET   2   8.306  12.645  -3.682
    7    HE1  MET   2           HE2      MET   2   8.025  14.787  -0.276
    8    HE3  MET   2           HE3      MET   2   7.166  13.585   0.686
    9    HG3  MET   2           HG1      MET   2   6.653  14.757  -3.553

  No H/Q in entry =           9
  In of MODEL   22
    1    HA   ASP   3           HA       ASP   3  12.480  10.989  -4.074
    2    HB2  ASP   3           HB2      ASP   3  13.207   9.357  -2.291
    3    H    ASP   3           HN       ASP   3  10.491  11.800  -2.071
    4    HB3  ASP   3           HB1      ASP   3  13.422  11.055  -1.878

  No H/Q in entry =           4
  In of MODEL   22
    1    HA   CYS   4           HA       CYS   4  10.050   7.492  -4.966
    2    HB2  CYS   4           HB2      CYS   4  12.864   6.484  -5.307
    3    H    CYS   4           HN       CYS   4  12.654   8.409  -4.027
    4    HB3  CYS   4           HB1      CYS   4  11.480   5.480  -5.725

  No H/Q in entry =           4
  In of MODEL   22
    1    HA   THR   5           HA       THR   5   9.725   5.591  -0.961
    2    HB   THR   5           HB       THR   5   7.041   4.824  -1.980
    3    HG1  THR   5           HG1      THR   5   7.806   7.499  -1.443
    4   HG21  THR   5          HG21      THR   5   8.228   5.688   0.598
    5   HG23  THR   5          HG22      THR   5   7.139   4.347   0.243
    6   HG22  THR   5          HG23      THR   5   6.517   5.996   0.308
    7    H    THR   5           HN       THR   5   8.811   6.776  -3.330

  No H/Q in entry =           7
  In of MODEL   22
    1    HA   THR   6           HA       THR   6   9.481   1.370  -2.343
    2    HB   THR   6           HB       THR   6  11.424   0.281  -0.935
    3    HG1  THR   6           HG1      THR   6  11.888   3.044  -0.507
    4   HG21  THR   6          HG21      THR   6  11.373   1.731  -3.311
    5   HG23  THR   6          HG22      THR   6  12.644   0.650  -2.739
    6   HG22  THR   6          HG23      THR   6  12.733   2.377  -2.394
    7    H    THR   6           HN       THR   6   9.561   3.405  -0.231

  No H/Q in entry =           7
  In of MODEL   22
    1    HA3  GLY   7           HA2      GLY   7   8.293  -1.802   0.571
    2    H    GLY   7           HN       GLY   7   8.469  -0.484  -1.785
    3    HA2  GLY   7           HA1      GLY   7   7.090  -0.535   0.754

  No H/Q in entry =           3
  In of MODEL   22
    1    HA   PRO   8           HA       PRO   8   5.249  -4.171  -1.573
    2    HB2  PRO   8           HB2      PRO   8   3.614  -5.163   0.308
    3    HG2  PRO   8           HG2      PRO   8   3.956  -3.634   2.018
    4    HD2  PRO   8           HD2      PRO   8   5.705  -2.161   1.958
    5    HB3  PRO   8           HB1      PRO   8   5.323  -5.611   0.236
    6    HG3  PRO   8           HG1      PRO   8   5.210  -4.821   2.418
    7    HD3  PRO   8           HD1      PRO   8   6.901  -3.449   1.713

  No H/Q in entry =           7
  In of MODEL   22
    1    HA   CYS   9           HA       CYS   9   1.780  -1.765  -2.542
    2    HB2  CYS   9           HB2      CYS   9   2.219  -0.989   0.016
    3    H    CYS   9           HN       CYS   9   4.560  -1.614  -2.053
    4    HB3  CYS   9           HB1      CYS   9   2.240   0.574  -0.792

  No H/Q in entry =           4
  In of MODEL   22
    1    HA   CYS  10           HA       CYS  10   3.398   0.860  -5.620
    2    HB2  CYS  10           HB2      CYS  10   5.117   2.552  -5.162
    3    H    CYS  10           HN       CYS  10   4.242  -1.226  -3.948
    4    HB3  CYS  10           HB1      CYS  10   4.069   2.316  -3.767

  No H/Q in entry =           4
  In of MODEL   22
    1    HA   ARG  11           HA       ARG  11   6.902  -0.811  -7.694
    2    HB2  ARG  11           HB2      ARG  11   5.414   0.828  -9.259
    3    HG2  ARG  11           HG2      ARG  11   7.119  -0.009 -11.150
    4    HD2  ARG  11           HD2      ARG  11   4.902  -1.276  -9.668
    5    HE   ARG  11           HE       ARG  11   6.882  -2.949 -10.767
    6   HH11  ARG  11          HH11      ARG  11   3.422  -2.490 -10.780
    7   HH12  ARG  11          HH12      ARG  11   3.077  -4.159 -11.086
    8   HH21  ARG  11          HH21      ARG  11   6.429  -5.145 -11.169
    9   HH22  ARG  11          HH22      ARG  11   4.783  -5.667 -11.306
   10    H    ARG  11           HN       ARG  11   5.557   1.685  -6.908
   11    HB3  ARG  11           HB1      ARG  11   7.011   1.519  -9.510
   12    HG3  ARG  11           HG1      ARG  11   7.576  -1.092  -9.833
   13    HD3  ARG  11           HD1      ARG  11   5.069  -0.939 -11.391

  No H/Q in entry =          13
  In of MODEL   22
    1    HA   GLN  12           HA       GLN  12  10.933   0.709  -7.278
    2    HB2  GLN  12           HB2      GLN  12  10.802   0.799 -10.249
    3    HG2  GLN  12           HG2      GLN  12  13.020  -0.502  -9.805
    4   HE21  GLN  12          HE21      GLN  12  12.851  -2.584 -10.457
    5   HE22  GLN  12          HE22      GLN  12  11.350  -3.414 -10.662
    6    H    GLN  12           HN       GLN  12   8.964   0.200  -9.193
    7    HB3  GLN  12           HB1      GLN  12  12.171   1.586  -9.475
    8    HG3  GLN  12           HG1      GLN  12  12.353  -0.683  -8.183

  No H/Q in entry =           8
  In of MODEL   22
    1    HA   CYS  13           HA       CYS  13   9.636   5.078  -7.427
    2    HB2  CYS  13           HB2      CYS  13  10.643   4.901 -10.229
    3    H    CYS  13           HN       CYS  13   8.915   2.876  -9.125
    4    HB3  CYS  13           HB1      CYS  13  10.097   6.470  -9.647

  No H/Q in entry =           4
  In of MODEL   22
    1    HA   LYS  14           HA       LYS  14   5.540   5.922  -8.608
    2    HB2  LYS  14           HB2      LYS  14   6.015   4.827 -10.797
    3    HG2  LYS  14           HG2      LYS  14   3.632   5.763  -9.982
    4    HD2  LYS  14           HD2      LYS  14   3.348   2.851 -10.288
    5    HE2  LYS  14           HE2      LYS  14   1.821   4.759 -11.944
    6    HZ3  LYS  14           HZ1      LYS  14  -0.082   3.051 -11.791
    7    HZ2  LYS  14           HZ2      LYS  14   0.008   4.278 -10.630
    8    HZ1  LYS  14           HZ3      LYS  14   0.540   2.717 -10.253
    9    H    LYS  14           HN       LYS  14   7.237   3.713  -7.878
   10    HB3  LYS  14           HB1      LYS  14   5.309   3.344 -10.169
   11    HG3  LYS  14           HG1      LYS  14   3.944   5.143 -11.605
   12    HD3  LYS  14           HD1      LYS  14   2.336   4.006  -9.418
   13    HE3  LYS  14           HE1      LYS  14   2.168   3.051 -12.209

  No H/Q in entry =          13
  In of MODEL   22
    1    HA   LEU  15           HA       LEU  15   3.483   3.672  -5.459
    2    HB2  LEU  15           HB2      LEU  15   3.414   6.351  -5.020
    3    HG   LEU  15           HG       LEU  15   3.213   4.272  -3.367
    4   HD11  LEU  15          HD11      LEU  15   3.594   6.932  -3.091
    5   HD13  LEU  15          HD12      LEU  15   3.541   5.794  -1.745
    6   HD12  LEU  15          HD13      LEU  15   2.103   6.719  -2.174
    7   HD21  LEU  15          HD21      LEU  15   0.704   4.194  -4.079
    8   HD23  LEU  15          HD22      LEU  15   0.535   5.512  -2.920
    9   HD22  LEU  15          HD23      LEU  15   1.153   3.947  -2.391
   10    H    LEU  15           HN       LEU  15   4.017   5.968  -7.106
   11    HB3  LEU  15           HB1      LEU  15   1.708   6.017  -5.249

  No H/Q in entry =          11
  In of MODEL   22
    1    HA   LYS  16           HA       LYS  16   0.172   2.162  -7.811
    2    HB2  LYS  16           HB2      LYS  16   0.133   0.807  -5.139
    3    HG2  LYS  16           HG2      LYS  16   0.102  -0.638  -7.725
    4    HD2  LYS  16           HD2      LYS  16   1.819  -1.055  -5.293
    5    HE2  LYS  16           HE2      LYS  16   0.792  -2.916  -7.432
    6    HZ2  LYS  16           HZ1      LYS  16   1.042  -4.144  -5.443
    7    HZ1  LYS  16           HZ2      LYS  16   2.509  -3.392  -5.063
    8    HZ3  LYS  16           HZ3      LYS  16   2.421  -4.460  -6.372
    9    H    LYS  16           HN       LYS  16   1.723   2.369  -5.453
   10    HB3  LYS  16           HB1      LYS  16  -1.189   0.544  -6.268
   11    HG3  LYS  16           HG1      LYS  16   1.582   0.210  -7.274
   12    HD3  LYS  16           HD1      LYS  16   0.173  -1.680  -5.406
   13    HE3  LYS  16           HE1      LYS  16   2.439  -2.302  -7.298

  No H/Q in entry =          13
  In of MODEL   22
    1    HA   PRO  17           HA       PRO  17  -3.215   4.920  -7.246
    2    HB2  PRO  17           HB2      PRO  17  -4.951   2.603  -7.952
    3    HG2  PRO  17           HG2      PRO  17  -3.834   2.139  -9.940
    4    HD2  PRO  17           HD2      PRO  17  -2.335   1.268  -8.417
    5    HB3  PRO  17           HB1      PRO  17  -4.889   4.220  -8.661
    6    HG3  PRO  17           HG1      PRO  17  -3.036   3.723  -9.964
    7    HD3  PRO  17           HD1      PRO  17  -1.270   2.483  -9.151

  No H/Q in entry =           7
  In of MODEL   22
    1    HA   ALA  18           HA       ALA  18  -4.576   4.133  -3.200
    2    HB2  ALA  18           HB1      ALA  18  -6.249   5.749  -2.465
    3    HB3  ALA  18           HB2      ALA  18  -6.527   6.233  -4.138
    4    HB1  ALA  18           HB3      ALA  18  -4.965   6.540  -3.379
    5    H    ALA  18           HN       ALA  18  -4.589   5.506  -5.635

  No H/Q in entry =           5
  In of MODEL   22
    1    HA3  GLY  19           HA2      GLY  19  -7.860   1.363  -2.645
    2    H    GLY  19           HN       GLY  19  -5.344   2.087  -3.126
    3    HA2  GLY  19           HA1      GLY  19  -7.882   1.432  -4.400

  No H/Q in entry =           3
  In of MODEL   22
    1    HA   THR  20           HA       THR  20  -5.476  -2.198  -4.865
    2    HB   THR  20           HB       THR  20  -2.712  -1.271  -4.274
    3    HG1  THR  20           HG1      THR  20  -4.312  -0.275  -6.381
    4   HG21  THR  20          HG21      THR  20  -3.944  -2.833  -6.528
    5   HG23  THR  20          HG22      THR  20  -2.958  -3.461  -5.208
    6   HG22  THR  20          HG23      THR  20  -2.238  -2.399  -6.418
    7    H    THR  20           HN       THR  20  -5.036   0.540  -4.509

  No H/Q in entry =           7
  In of MODEL   22
    1    HA   THR  21           HA       THR  21  -4.386  -3.540  -0.831
    2    HB   THR  21           HB       THR  21  -4.727  -6.192  -0.977
    3    HG1  THR  21           HG1      THR  21  -5.432  -6.839  -2.832
    4   HG23  THR  21          HG21      THR  21  -6.754  -5.819  -0.140
    5   HG22  THR  21          HG22      THR  21  -7.268  -4.887  -1.546
    6   HG21  THR  21          HG23      THR  21  -6.336  -4.110  -0.266
    7    H    THR  21           HN       THR  21  -4.446  -3.998  -3.739

  No H/Q in entry =           7
  In of MODEL   22
    1    HA   CYS  22           HA       CYS  22  -0.329  -5.135  -1.163
    2    HB2  CYS  22           HB2      CYS  22   0.982  -4.332   0.819
    3    H    CYS  22           HN       CYS  22  -2.629  -4.094   0.323
    4    HB3  CYS  22           HB1      CYS  22   0.122  -3.060  -0.043

  No H/Q in entry =           4
  In of MODEL   22
    1    HA   TRP  23           HA       TRP  23  -1.144  -8.436   1.837
    2    HB2  TRP  23           HB2      TRP  23  -0.194  -6.793   3.615
    3    HD1  TRP  23           HD1      TRP  23   0.975  -9.385   3.057
    4    HE1  TRP  23           HE1      TRP  23   1.167 -11.336   4.724
    5    HE3  TRP  23           HE3      TRP  23  -2.683  -8.003   6.351
    6    HZ2  TRP  23           HZ2      TRP  23  -0.069 -12.179   7.118
    7    HZ3  TRP  23           HZ3      TRP  23  -3.116  -9.437   8.303
    8    HH2  TRP  23           HH2      TRP  23  -1.835 -11.482   8.677
    9    H    TRP  23           HN       TRP  23  -2.226  -5.705   1.762
   10    HB3  TRP  23           HB1      TRP  23  -1.771  -6.964   4.380

  No H/Q in entry =          10
  In of MODEL   22
    1    HA   ARG  24           HA       ARG  24  -5.225  -9.524   3.003
    2    HB2  ARG  24           HB2      ARG  24  -5.697  -8.194   0.997
    3    HG2  ARG  24           HG2      ARG  24  -7.404  -9.932   1.992
    4    HD2  ARG  24           HD2      ARG  24  -6.495 -11.135  -0.550
    5    HE   ARG  24           HE       ARG  24  -9.229 -10.483  -0.260
    6   HH11  ARG  24          HH11      ARG  24  -7.133 -13.129  -1.145
    7   HH12  ARG  24          HH12      ARG  24  -8.305 -13.875  -2.179
    8   HH21  ARG  24          HH21      ARG  24 -10.772 -11.463  -1.619
    9   HH22  ARG  24          HH22      ARG  24 -10.371 -12.930  -2.448
   10    H    ARG  24           HN       ARG  24  -2.771  -9.781   1.478
   11    HB3  ARG  24           HB1      ARG  24  -5.247  -9.554  -0.021
   12    HG3  ARG  24           HG1      ARG  24  -7.758  -9.029   0.518
   13    HD3  ARG  24           HD1      ARG  24  -7.154 -11.901   0.895

  No H/Q in entry =          13
  In of MODEL   22
    1    HA   THR  25           HA       THR  25  -4.084 -13.803   2.573
    2    HB   THR  25           HB       THR  25  -4.915 -14.907   4.790
    3    HG1  THR  25           HG1      THR  25  -5.896 -13.562   6.044
    4   HG22  THR  25          HG21      THR  25  -2.708 -12.874   4.968
    5   HG21  THR  25          HG22      THR  25  -2.542 -14.477   4.251
    6   HG23  THR  25          HG23      THR  25  -2.920 -14.313   5.965
    7    H    THR  25           HN       THR  25  -4.946 -11.465   3.981

  No H/Q in entry =           7
  In of MODEL   22
    1    HA   SER  26           HA       SER  26  -8.633 -13.850   1.613
    2    HB2  SER  26           HB2      SER  26  -8.013 -15.595   3.575
    3    HG   SER  26           HG       SER  26  -9.360 -16.806   2.497
    4    H    SER  26           HN       SER  26  -7.168 -12.449   3.541
    5    HB3  SER  26           HB1      SER  26  -9.503 -14.922   4.237

  No H/Q in entry =           5
  In of MODEL   22
    1    HA   VAL  27           HA       VAL  27 -11.141 -10.927   4.008
    2    HB   VAL  27           HB       VAL  27 -11.639 -12.534   5.797
    3    H    VAL  27           HN       VAL  27  -8.701 -12.371   4.808

  No H/Q in entry =           3
  In of MODEL   22
    1    HA   SER  28           HA       SER  28  -8.300  -8.139   6.701
    2    HB2  SER  28           HB2      SER  28  -6.009 -10.044   6.284
    3    HG   SER  28           HG       SER  28  -7.285  -8.854   8.511
    4    H    SER  28           HN       SER  28  -8.157 -10.818   5.890
    5    HB3  SER  28           HB1      SER  28  -5.721  -8.371   6.761

  No H/Q in entry =           5
  In of MODEL   22
    1    HA   SER  29           HA       SER  29  -5.830  -6.203   3.408
    2    HB2  SER  29           HB2      SER  29  -7.663  -4.848   2.235
    3    HG   SER  29           HG       SER  29  -9.799  -5.707   2.982
    4    H    SER  29           HN       SER  29  -7.081  -6.304   5.917
    5    HB3  SER  29           HB1      SER  29  -7.903  -6.592   2.334

  No H/Q in entry =           5
  In of MODEL   22
    1    HA   HIS  30           HA       HIS  30  -5.043  -2.593   5.870
    2    HB2  HIS  30           HB2      HIS  30  -2.536  -3.114   4.258
    3    HD1  HIS  30           HD1      HIS  30  -1.028  -4.827   5.225
    4    HD2  HIS  30           HD2      HIS  30  -3.956  -3.630   7.919
    5    HE1  HIS  30           HE1      HIS  30  -0.743  -6.315   7.232
    6    HE2  HIS  30           HE2      HIS  30  -2.581  -5.629   8.813
    7    H    HIS  30           HN       HIS  30  -4.377  -4.780   4.175
    8    HB3  HIS  30           HB1      HIS  30  -2.698  -1.895   5.519

  No H/Q in entry =           8
  In of MODEL   22
    1    HA   TYR  31           HA       TYR  31  -4.852  -1.556   0.645
    2    HB2  TYR  31           HB2      TYR  31  -6.774  -0.503   2.693
    3    HD1  TYR  31           HD1      TYR  31  -8.367  -2.168   2.852
    4    HD2  TYR  31           HD2      TYR  31  -6.754  -1.232  -0.972
    5    HE1  TYR  31           HE1      TYR  31  -9.936  -3.749   1.810
    6    HE2  TYR  31           HE2      TYR  31  -8.320  -2.810  -2.024
    7    HH   TYR  31           HH       TYR  31  -9.834  -5.158  -0.551
    8    H    TYR  31           HN       TYR  31  -4.457  -2.936   2.410
    9    HB3  TYR  31           HB1      TYR  31  -6.586   0.333   1.155

  No H/Q in entry =           9
  In of MODEL   22
    1    HA   CYS  32           HA       CYS  32  -2.642   2.151   1.534
    2    HB2  CYS  32           HB2      CYS  32  -2.242   1.113  -1.208
    3    H    CYS  32           HN       CYS  32  -4.376   0.557  -0.239
    4    HB3  CYS  32           HB1      CYS  32  -1.707   2.767  -0.930

  No H/Q in entry =           4
  In of MODEL   22
    1    HA   THR  33           HA       THR  33  -5.522   5.312   0.686
    2    HB   THR  33           HB       THR  33  -4.924   7.353   1.845
    3    HG1  THR  33           HG1      THR  33  -2.877   7.591   2.766
    4   HG22  THR  33          HG21      THR  33  -4.121   6.342   4.105
    5   HG21  THR  33          HG22      THR  33  -4.406   4.805   3.290
    6   HG23  THR  33          HG23      THR  33  -5.724   5.962   3.476
    7    H    THR  33           HN       THR  33  -3.183   4.212   1.812

  No H/Q in entry =           7
  In of MODEL   22
    1    HA3  GLY  34           HA2      GLY  34  -1.617   5.840  -2.566
    2    H    GLY  34           HN       GLY  34  -2.165   5.428  -0.254
    3    HA2  GLY  34           HA1      GLY  34  -2.961   6.970  -2.635

  No H/Q in entry =           3
  In of MODEL   22
    1    HA   ARG  35           HA       ARG  35   0.323   9.514  -0.864
    2    HB2  ARG  35           HB2      ARG  35  -0.260   8.598   1.956
    3    HG2  ARG  35           HG2      ARG  35  -2.176   9.505   0.577
    4    HD2  ARG  35           HD2      ARG  35  -0.499  11.340  -0.345
    5    HE   ARG  35           HE       ARG  35  -0.682  12.324   2.166
    6   HH11  ARG  35          HH11      ARG  35  -1.822  13.462  -0.930
    7   HH12  ARG  35          HH12      ARG  35  -1.708  15.135  -0.498
    8   HH21  ARG  35          HH21      ARG  35  -0.531  14.524   2.736
    9   HH22  ARG  35          HH22      ARG  35  -0.975  15.738   1.583
   10    H    ARG  35           HN       ARG  35  -0.809   6.969   0.094
   11    HB3  ARG  35           HB1      ARG  35   0.606  10.076   1.556
   12    HG3  ARG  35           HG1      ARG  35  -1.840  10.326   2.103
   13    HD3  ARG  35           HD1      ARG  35  -2.225  11.654  -0.163

  No H/Q in entry =          13
  In of MODEL   22
    1    HA   SER  36           HA       SER  36   3.798   6.722   0.007
    2    HB2  SER  36           HB2      SER  36   3.901   7.611   2.224
    3    HG   SER  36           HG       SER  36   4.913   5.760   3.367
    4    H    SER  36           HN       SER  36   0.994   6.467   0.746
    5    HB3  SER  36           HB1      SER  36   2.849   6.342   2.851

  No H/Q in entry =           5
  In of MODEL   22
    1    HA   CYS  37           HA       CYS  37   3.428   2.489  -0.702
    2    HB2  CYS  37           HB2      CYS  37   5.979   3.128  -1.038
    3    H    CYS  37           HN       CYS  37   4.982   4.659   0.297
    4    HB3  CYS  37           HB1      CYS  37   6.190   2.058   0.344

  No H/Q in entry =           4
  In of MODEL   22
    1    HA   GLU  38           HA       GLU  38   4.432   0.957   3.758
    2    HB2  GLU  38           HB2      GLU  38   4.343   3.815   4.618
    3    HG2  GLU  38           HG2      GLU  38   6.068   2.511   6.260
    4    H    GLU  38           HN       GLU  38   4.589   3.429   2.440
    5    HB3  GLU  38           HB1      GLU  38   3.895   2.575   5.781
    6    HG3  GLU  38           HG1      GLU  38   6.217   1.572   4.776

  No H/Q in entry =           6
  In of MODEL   22
    1    HA   CYS  39           HA       CYS  39   0.067   0.743   3.942
    2    HB2  CYS  39           HB2      CYS  39   1.347  -1.922   4.060
    3    H    CYS  39           HN       CYS  39   2.770  -0.257   4.391
    4    HB3  CYS  39           HB1      CYS  39  -0.297  -1.835   4.683

  No H/Q in entry =           4
  In of MODEL   22
    1    HA   PRO  40           HA       PRO  40  -0.806   1.344   8.226
    2    HB2  PRO  40           HB2      PRO  40  -3.479   0.886   8.272
    3    HG2  PRO  40           HG2      PRO  40  -3.725  -0.157   6.212
    4    HD2  PRO  40           HD2      PRO  40  -2.091  -0.050   4.591
    5    HB3  PRO  40           HB1      PRO  40  -2.769   2.340   7.559
    6    HG3  PRO  40           HG1      PRO  40  -3.967   1.534   5.736
    7    HD3  PRO  40           HD1      PRO  40  -1.871   1.700   4.792

  No H/Q in entry =           7
  In of MODEL   22
    1    HA   SER  41           HA       SER  41  -0.575  -2.746   9.772
    2    HB2  SER  41           HB2      SER  41  -0.479  -1.216  12.365
    3    HG   SER  41           HG       SER  41   1.877  -1.762  10.988
    4    H    SER  41           HN       SER  41  -0.480   0.081   9.940
    5    HB3  SER  41           HB1      SER  41   0.268  -2.764  11.973

  No H/Q in entry =           5
  In of MODEL   22
    1    HA   TYR  42           HA       TYR  42  -4.548  -2.328  12.128
    2    HB2  TYR  42           HB2      TYR  42  -4.035   0.345  12.709
    3    HD1  TYR  42           HD1      TYR  42  -7.364   0.320  13.493
    4    HD2  TYR  42           HD2      TYR  42  -3.800  -1.816  14.403
    5    HE1  TYR  42           HE1      TYR  42  -8.351  -0.405  15.625
    6    HE2  TYR  42           HE2      TYR  42  -4.777  -2.549  16.538
    7    HH   TYR  42           HH       TYR  42  -7.725  -2.700  17.256
    8    H    TYR  42           HN       TYR  42  -2.796  -0.321  10.953
    9    HB3  TYR  42           HB1      TYR  42  -5.636   0.369  11.978

  No H/Q in entry =           9
  In of MODEL   22
    1    HA   PRO  43           HA       PRO  43  -7.095  -2.751   8.545
    2    HB2  PRO  43           HB2      PRO  43  -9.456  -3.433   9.690
    3    HG2  PRO  43           HG2      PRO  43  -9.007  -2.829  11.887
    4    HD2  PRO  43           HD2      PRO  43  -6.860  -2.438  12.625
    5    HB3  PRO  43           HB1      PRO  43  -8.078  -4.537   9.610
    6    HG3  PRO  43           HG1      PRO  43  -8.448  -4.512  11.906
    7    HD3  PRO  43           HD1      PRO  43  -6.225  -3.906  11.856

  No H/Q in entry =           7
  In of MODEL   22
    1    HA3  GLY  44           HA2      GLY  44 -10.640  -0.290   7.037
    2    H    GLY  44           HN       GLY  44  -9.217  -1.995   7.619
    3    HA2  GLY  44           HA1      GLY  44 -10.670   0.138   8.741

  No H/Q in entry =           3
  In of MODEL   22
    1    HA   ASN  45           HA       ASN  45  -8.337   3.376   6.651
    2    HB2  ASN  45           HB2      ASN  45  -6.514   1.427   6.437
    3   HD21  ASN  45          HD21      ASN  45  -5.363   2.515   7.882
    4   HD22  ASN  45          HD22      ASN  45  -4.620   4.052   7.617
    5    H    ASN  45           HN       ASN  45  -9.332   0.835   5.632
    6    HB3  ASN  45           HB1      ASN  45  -6.509   1.981   4.766

  No H/Q in entry =           6
  In of MODEL   22
    1    HA3  GLY  46           HA2      GLY  46  -9.276   3.730   2.197
    2    H    GLY  46           HN       GLY  46  -8.697   1.312   3.775
    3    HA2  GLY  46           HA1      GLY  46  -8.771   2.183   1.533

  No H/Q in entry =           3
  In of MODEL   23
    1    H1   ALA   1           HT3      ALA   1  20.314   7.887  -0.108
    2    H2   ALA   1           HT2      ALA   1  21.627   7.270  -1.026
    3    H3   ALA   1           HT1      ALA   1  21.116   8.895  -1.239
    4    HA   ALA   1           HA       ALA   1  20.365   7.584  -3.033
    5    HB3  ALA   1           HB1      ALA   1  20.403   5.432  -1.815
    6    HB1  ALA   1           HB2      ALA   1  18.912   5.688  -2.721
    7    HB2  ALA   1           HB3      ALA   1  18.931   5.915  -0.973

  No H/Q in entry =           7
  In of MODEL   23
    1    HA   MET   2           HA       MET   2  16.125   8.752   0.035
    2    HB2  MET   2           HB2      MET   2  17.585  10.725  -0.078
    3    H    MET   2           HN       MET   2  18.074   7.629  -0.298
    4    HG2  MET   2           HG2      MET   2  14.860  10.951  -1.277
    5    HE3  MET   2           HE1      MET   2  13.865  13.971  -2.081
    6    HB3  MET   2           HB1      MET   2  17.387  10.776  -1.824
    7    HE2  MET   2           HE2      MET   2  14.369  14.683  -0.548
    8    HE1  MET   2           HE3      MET   2  13.677  13.061  -0.582
    9    HG3  MET   2           HG1      MET   2  15.421  11.436   0.321

  No H/Q in entry =           9
  In of MODEL   23
    1    HA   ASP   3           HA       ASP   3  14.425   7.218  -3.858
    2    HB2  ASP   3           HB2      ASP   3  13.466   5.580  -1.565
    3    H    ASP   3           HN       ASP   3  14.972   7.079  -1.065
    4    HB3  ASP   3           HB1      ASP   3  12.446   5.643  -2.999

  No H/Q in entry =           4
  In of MODEL   23
    1    HA   CYS   4           HA       CYS   4  10.720   9.550  -3.364
    2    HB2  CYS   4           HB2      CYS   4   9.460   9.572  -5.571
    3    H    CYS   4           HN       CYS   4  11.914   7.081  -4.437
    4    HB3  CYS   4           HB1      CYS   4  11.190   9.881  -5.665

  No H/Q in entry =           4
  In of MODEL   23
    1    HA   THR   5           HA       THR   5   8.035   5.923  -2.353
    2    HB   THR   5           HB       THR   5   6.401   5.270  -4.403
    3    HG1  THR   5           HG1      THR   5   6.554   6.883  -5.970
    4   HG22  THR   5          HG21      THR   5   6.101   8.089  -3.986
    5   HG21  THR   5          HG22      THR   5   6.448   7.272  -2.462
    6   HG23  THR   5          HG23      THR   5   5.079   6.757  -3.447
    7    H    THR   5           HN       THR   5  10.131   6.204  -4.221

  No H/Q in entry =           7
  In of MODEL   23
    1    HA   THR   6           HA       THR   6   8.979   1.837  -3.633
    2    HB   THR   6           HB       THR   6  10.896   0.919  -2.197
    3    HG1  THR   6           HG1      THR   6  12.043   2.445  -1.032
    4   HG22  THR   6          HG21      THR   6  12.330   3.076  -3.240
    5   HG21  THR   6          HG22      THR   6  10.962   2.833  -4.326
    6   HG23  THR   6          HG23      THR   6  12.061   1.498  -3.980
    7    H    THR   6           HN       THR   6   8.919   4.042  -1.684

  No H/Q in entry =           7
  In of MODEL   23
    1    HA3  GLY   7           HA2      GLY   7   7.462  -1.170  -0.801
    2    H    GLY   7           HN       GLY   7   7.631   0.257  -3.099
    3    HA2  GLY   7           HA1      GLY   7   6.406   0.198  -0.485

  No H/Q in entry =           3
  In of MODEL   23
    1    HA   PRO   8           HA       PRO   8   4.011  -3.168  -2.695
    2    HB2  PRO   8           HB2      PRO   8   2.056  -3.454  -0.847
    3    HG2  PRO   8           HG2      PRO   8   2.748  -1.867   0.701
    4    HD2  PRO   8           HD2      PRO   8   4.874  -0.986   0.666
    5    HB3  PRO   8           HB1      PRO   8   3.582  -4.342  -0.762
    6    HG3  PRO   8           HG1      PRO   8   3.603  -3.295   1.315
    7    HD3  PRO   8           HD1      PRO   8   5.636  -2.581   0.505

  No H/Q in entry =           7
  In of MODEL   23
    1    HA   CYS   9           HA       CYS   9   0.753   0.094  -2.762
    2    HB2  CYS   9           HB2      CYS   9   0.613   0.531  -0.292
    3    H    CYS   9           HN       CYS   9   3.126  -0.189  -1.071
    4    HB3  CYS   9           HB1      CYS   9   1.681   1.909  -0.530

  No H/Q in entry =           4
  In of MODEL   23
    1    HA   CYS  10           HA       CYS  10   3.079   2.546  -5.514
    2    HB2  CYS  10           HB2      CYS  10   4.925   3.956  -4.796
    3    H    CYS  10           HN       CYS  10   3.409   0.280  -3.898
    4    HB3  CYS  10           HB1      CYS  10   3.784   3.752  -3.472

  No H/Q in entry =           4
  In of MODEL   23
    1    HA   ARG  11           HA       ARG  11   6.708   0.754  -7.334
    2    HB2  ARG  11           HB2      ARG  11   4.134  -0.067  -8.581
    3    HG2  ARG  11           HG2      ARG  11   5.647  -1.193  -6.661
    4    HD2  ARG  11           HD2      ARG  11   6.685  -2.125  -9.287
    5    HE   ARG  11           HE       ARG  11   5.779  -3.976  -7.337
    6   HH11  ARG  11          HH11      ARG  11   8.442  -3.321  -9.494
    7   HH12  ARG  11          HH12      ARG  11   8.900  -4.985  -9.635
    8   HH21  ARG  11          HH21      ARG  11   6.380  -6.165  -7.521
    9   HH22  ARG  11          HH22      ARG  11   7.730  -6.600  -8.516
   10    H    ARG  11           HN       ARG  11   4.299   2.380  -7.332
   11    HB3  ARG  11           HB1      ARG  11   5.607  -0.373  -9.491
   12    HG3  ARG  11           HG1      ARG  11   4.561  -2.094  -7.720
   13    HD3  ARG  11           HD1      ARG  11   7.531  -1.896  -7.757

  No H/Q in entry =          13
  In of MODEL   23
    1    HA   GLN  12           HA       GLN  12   9.118   2.573 -10.538
    2    HB2  GLN  12           HB2      GLN  12   7.242   1.447 -11.866
    3    HG2  GLN  12           HG2      GLN  12   8.367   4.077 -12.789
    4   HE21  GLN  12          HE21      GLN  12   6.724   4.869 -14.018
    5   HE22  GLN  12          HE22      GLN  12   6.089   4.058 -15.405
    6    H    GLN  12           HN       GLN  12   8.134   1.307  -8.926
    7    HB3  GLN  12           HB1      GLN  12   6.379   2.973 -11.729
    8    HG3  GLN  12           HG1      GLN  12   9.001   2.462 -13.105

  No H/Q in entry =           8
  In of MODEL   23
    1    HA   CYS  13           HA       CYS  13   8.377   5.968  -7.274
    2    HB2  CYS  13           HB2      CYS  13   9.963   6.340  -9.288
    3    H    CYS  13           HN       CYS  13   8.484   3.885  -8.179
    4    HB3  CYS  13           HB1      CYS  13   8.584   7.138 -10.035

  No H/Q in entry =           4
  In of MODEL   23
    1    HA   LYS  14           HA       LYS  14   4.204   7.007  -8.032
    2    HB2  LYS  14           HB2      LYS  14   4.290   4.882 -10.115
    3    HG2  LYS  14           HG2      LYS  14   4.800   7.476 -10.295
    4    HD2  LYS  14           HD2      LYS  14   2.041   7.557 -11.354
    5    HE2  LYS  14           HE2      LYS  14   4.119   9.418 -10.362
    6    HZ2  LYS  14           HZ1      LYS  14   2.276   9.997  -8.940
    7    HZ1  LYS  14           HZ2      LYS  14   1.222  10.058 -10.261
    8    HZ3  LYS  14           HZ3      LYS  14   2.473  11.188 -10.126
    9    H    LYS  14           HN       LYS  14   5.944   4.677  -7.935
   10    HB3  LYS  14           HB1      LYS  14   2.710   5.479  -9.627
   11    HG3  LYS  14           HG1      LYS  14   4.065   6.564 -11.615
   12    HD3  LYS  14           HD1      LYS  14   2.219   7.704  -9.604
   13    HE3  LYS  14           HE1      LYS  14   3.063   9.545 -11.768

  No H/Q in entry =          13
  In of MODEL   23
    1    HA   LEU  15           HA       LEU  15   2.507   4.520  -4.868
    2    HB2  LEU  15           HB2      LEU  15   0.875   5.746  -3.604
    3    HG   LEU  15           HG       LEU  15  -0.173   6.794  -5.822
    4   HD12  LEU  15          HD11      LEU  15  -0.361   8.623  -3.521
    5   HD11  LEU  15          HD12      LEU  15  -0.717   6.928  -3.191
    6   HD13  LEU  15          HD13      LEU  15  -1.629   7.796  -4.425
    7   HD22  LEU  15          HD21      LEU  15   1.351   8.304  -6.593
    8   HD21  LEU  15          HD22      LEU  15   1.983   8.658  -4.985
    9   HD23  LEU  15          HD23      LEU  15   0.442   9.346  -5.498
   10    H    LEU  15           HN       LEU  15   2.747   6.848  -6.466
   11    HB3  LEU  15           HB1      LEU  15   2.194   6.823  -4.022

  No H/Q in entry =          11
  In of MODEL   23
    1    HA   LYS  16           HA       LYS  16  -0.590   2.382  -6.982
    2    HB2  LYS  16           HB2      LYS  16  -0.662   1.429  -4.141
    3    HG2  LYS  16           HG2      LYS  16   1.098   0.635  -5.729
    4    HD2  LYS  16           HD2      LYS  16  -1.268  -0.686  -7.054
    5    HE2  LYS  16           HE2      LYS  16   0.265  -1.823  -8.453
    6    HZ2  LYS  16           HZ1      LYS  16   1.372  -3.241  -6.967
    7    HZ1  LYS  16           HZ2      LYS  16   0.003  -2.711  -6.128
    8    HZ3  LYS  16           HZ3      LYS  16   1.517  -2.044  -5.780
    9    H    LYS  16           HN       LYS  16   0.757   3.115  -4.591
   10    HB3  LYS  16           HB1      LYS  16  -1.868   0.856  -5.285
   11    HG3  LYS  16           HG1      LYS  16   0.106  -0.637  -5.013
   12    HD3  LYS  16           HD1      LYS  16  -0.231   0.552  -7.767
   13    HE3  LYS  16           HE1      LYS  16   1.631  -0.906  -7.820

  No H/Q in entry =          13
  In of MODEL   23
    1    HA   PRO  17           HA       PRO  17  -4.369   4.629  -6.735
    2    HB2  PRO  17           HB2      PRO  17  -6.212   2.808  -7.547
    3    HG2  PRO  17           HG2      PRO  17  -4.954   0.869  -7.331
    4    HD2  PRO  17           HD2      PRO  17  -2.659   0.923  -7.120
    5    HB3  PRO  17           HB1      PRO  17  -5.050   3.555  -8.649
    6    HG3  PRO  17           HG1      PRO  17  -4.563   1.309  -9.004
    7    HD3  PRO  17           HD1      PRO  17  -2.468   2.093  -8.441

  No H/Q in entry =           7
  In of MODEL   23
    1    HA   ALA  18           HA       ALA  18  -6.047   3.932  -2.799
    2    HB1  ALA  18           HB1      ALA  18  -6.758   6.233  -3.221
    3    HB2  ALA  18           HB2      ALA  18  -8.003   5.323  -2.365
    4    HB3  ALA  18           HB3      ALA  18  -8.172   5.638  -4.092
    5    H    ALA  18           HN       ALA  18  -5.998   5.113  -5.331

  No H/Q in entry =           5
  In of MODEL   23
    1    HA3  GLY  19           HA2      GLY  19  -8.846   0.670  -2.332
    2    H    GLY  19           HN       GLY  19  -6.465   1.770  -2.719
    3    HA2  GLY  19           HA1      GLY  19  -8.812   0.706  -4.088

  No H/Q in entry =           3
  In of MODEL   23
    1    HA   THR  20           HA       THR  20  -5.905  -2.549  -4.341
    2    HB   THR  20           HB       THR  20  -3.329  -1.102  -3.912
    3    HG1  THR  20           HG1      THR  20  -5.093  -0.691  -6.085
    4   HG22  THR  20          HG21      THR  20  -2.925  -2.342  -6.165
    5   HG21  THR  20          HG22      THR  20  -4.309  -3.307  -5.651
    6   HG23  THR  20          HG23      THR  20  -2.868  -3.222  -4.637
    7    H    THR  20           HN       THR  20  -5.875   0.254  -4.109

  No H/Q in entry =           7
  In of MODEL   23
    1    HA   THR  21           HA       THR  21  -4.550  -3.558  -0.312
    2    HB   THR  21           HB       THR  21  -3.637  -6.015  -0.355
    3    HG1  THR  21           HG1      THR  21  -3.156  -5.787  -2.674
    4   HG22  THR  21          HG21      THR  21  -6.079  -6.624  -1.394
    5   HG21  THR  21          HG22      THR  21  -6.313  -4.967  -0.836
    6   HG23  THR  21          HG23      THR  21  -5.758  -6.207   0.289
    7    H    THR  21           HN       THR  21  -4.153  -3.916  -3.195

  No H/Q in entry =           7
  In of MODEL   23
    1    HA   CYS  22           HA       CYS  22  -0.266  -2.918   0.051
    2    HB2  CYS  22           HB2      CYS  22  -1.194  -1.634   1.921
    3    H    CYS  22           HN       CYS  22  -2.836  -3.726   1.153
    4    HB3  CYS  22           HB1      CYS  22  -1.220  -3.084   2.918

  No H/Q in entry =           4
  In of MODEL   23
    1    HA   TRP  23           HA       TRP  23   1.195  -6.739   2.098
    2    HB2  TRP  23           HB2      TRP  23   0.528  -5.888   4.477
    3    HD1  TRP  23           HD1      TRP  23   3.050  -7.238   3.177
    4    HE1  TRP  23           HE1      TRP  23   4.317  -9.093   4.434
    5    HE3  TRP  23           HE3      TRP  23  -0.658  -8.742   6.359
    6    HZ2  TRP  23           HZ2      TRP  23   3.811 -10.948   6.500
    7    HZ3  TRP  23           HZ3      TRP  23  -0.185 -10.563   7.944
    8    HH2  TRP  23           HH2      TRP  23   2.003 -11.643   8.012
    9    H    TRP  23           HN       TRP  23  -1.106  -5.072   2.763
   10    HB3  TRP  23           HB1      TRP  23  -0.614  -7.227   4.441

  No H/Q in entry =          10
  In of MODEL   23
    1    HA   ARG  24           HA       ARG  24  -1.988  -9.332   0.338
    2    HB2  ARG  24           HB2      ARG  24  -1.016  -8.333  -1.740
    3    HG2  ARG  24           HG2      ARG  24  -1.060 -10.678  -3.037
    4    HD2  ARG  24           HD2      ARG  24  -3.500 -10.428  -3.172
    5    HE   ARG  24           HE       ARG  24  -2.804  -7.667  -3.278
    6   HH11  ARG  24          HH11      ARG  24  -2.166 -10.769  -4.746
    7   HH12  ARG  24          HH12      ARG  24  -1.696 -10.092  -6.268
    8   HH21  ARG  24          HH21      ARG  24  -2.186  -6.775  -5.280
    9   HH22  ARG  24          HH22      ARG  24  -1.706  -7.824  -6.572
   10    H    ARG  24           HN       ARG  24   0.505  -7.878   0.298
   11    HB3  ARG  24           HB1      ARG  24   0.277  -9.521  -1.654
   12    HG3  ARG  24           HG1      ARG  24  -1.861 -11.149  -1.537
   13    HD3  ARG  24           HD1      ARG  24  -3.448  -9.297  -1.820

  No H/Q in entry =          13
  In of MODEL   23
    1    HA   THR  25           HA       THR  25   0.389 -12.773   1.852
    2    HB   THR  25           HB       THR  25  -0.335 -13.051   4.443
    3    HG1  THR  25           HG1      THR  25  -0.401 -10.262   3.939
    4   HG21  THR  25          HG21      THR  25   1.976 -12.661   3.377
    5   HG23  THR  25          HG22      THR  25   1.719 -12.200   5.060
    6   HG22  THR  25          HG23      THR  25   1.704 -10.970   3.796
    7    H    THR  25           HN       THR  25  -1.494 -10.561   2.290

  No H/Q in entry =           7
  In of MODEL   23
    1    HA   SER  26           HA       SER  26  -4.770 -13.304   1.540
    2    HB2  SER  26           HB2      SER  26  -3.014 -14.767   0.285
    3    HG   SER  26           HG       SER  26  -5.131 -15.113  -0.178
    4    H    SER  26           HN       SER  26  -2.933 -12.015   1.952
    5    HB3  SER  26           HB1      SER  26  -3.141 -15.825   1.690

  No H/Q in entry =           5
  In of MODEL   23
    1    HA   VAL  27           HA       VAL  27  -4.888 -14.808   5.769
    2    HB   VAL  27           HB       VAL  27  -3.734 -13.594   7.701
    3    H    VAL  27           HN       VAL  27  -3.790 -12.595   4.163

  No H/Q in entry =           3
  In of MODEL   23
    1    HA   SER  28           HA       SER  28  -7.626 -11.259   6.432
    2    HB2  SER  28           HB2      SER  28  -5.547 -10.369   7.848
    3    HG   SER  28           HG       SER  28  -7.005  -9.110   8.942
    4    H    SER  28           HN       SER  28  -5.032 -11.374   5.094
    5    HB3  SER  28           HB1      SER  28  -5.825  -8.925   6.874

  No H/Q in entry =           5
  In of MODEL   23
    1    HA   SER  29           HA       SER  29  -7.973  -8.201   3.221
    2    HB2  SER  29           HB2      SER  29 -10.335  -7.873   5.058
    3    HG   SER  29           HG       SER  29 -11.273  -8.887   3.079
    4    H    SER  29           HN       SER  29  -8.219  -8.626   6.128
    5    HB3  SER  29           HB1      SER  29 -10.246  -6.999   3.529

  No H/Q in entry =           5
  In of MODEL   23
    1    HA   HIS  30           HA       HIS  30  -6.867  -4.188   4.630
    2    HB2  HIS  30           HB2      HIS  30  -4.358  -5.639   3.872
    3    HD1  HIS  30           HD1      HIS  30  -2.605  -5.002   6.051
    4    HD2  HIS  30           HD2      HIS  30  -6.714  -5.110   6.658
    5    HE1  HIS  30           HE1      HIS  30  -2.910  -5.322   8.526
    6    HE2  HIS  30           HE2      HIS  30  -5.404  -5.298   8.881
    7    H    HIS  30           HN       HIS  30  -6.454  -6.650   3.062
    8    HB3  HIS  30           HB1      HIS  30  -4.315  -3.893   4.090

  No H/Q in entry =           8
  In of MODEL   23
    1    HA   TYR  31           HA       TYR  31  -5.743  -2.270   0.682
    2    HB2  TYR  31           HB2      TYR  31  -8.155  -0.951   1.946
    3    HD1  TYR  31           HD1      TYR  31  -7.398  -3.057  -1.046
    4    HD2  TYR  31           HD2      TYR  31  -9.731  -2.554   2.476
    5    HE1  TYR  31           HE1      TYR  31  -8.705  -5.056  -1.633
    6    HE2  TYR  31           HE2      TYR  31 -11.044  -4.552   1.899
    7    HH   TYR  31           HH       TYR  31 -10.592  -6.701   0.463
    8    H    TYR  31           HN       TYR  31  -6.013  -2.209   3.552
    9    HB3  TYR  31           HB1      TYR  31  -7.674  -0.774   0.262

  No H/Q in entry =           9
  In of MODEL   23
    1    HA   CYS  32           HA       CYS  32  -3.874   1.516   1.752
    2    HB2  CYS  32           HB2      CYS  32  -3.058   0.554  -0.674
    3    H    CYS  32           HN       CYS  32  -5.272  -0.136  -0.217
    4    HB3  CYS  32           HB1      CYS  32  -3.572   2.183  -1.100

  No H/Q in entry =           4
  In of MODEL   23
    1    HA   THR  33           HA       THR  33  -6.747   4.715   1.312
    2    HB   THR  33           HB       THR  33  -5.821   6.906   2.156
    3    HG1  THR  33           HG1      THR  33  -3.712   6.873   2.952
    4   HG22  THR  33          HG21      THR  33  -4.970   5.778   4.408
    5   HG21  THR  33          HG22      THR  33  -5.750   4.376   3.675
    6   HG23  THR  33          HG23      THR  33  -6.674   5.851   3.958
    7    H    THR  33           HN       THR  33  -4.061   3.805   1.748

  No H/Q in entry =           7
  In of MODEL   23
    1    HA3  GLY  34           HA2      GLY  34  -3.424   5.868  -2.467
    2    H    GLY  34           HN       GLY  34  -3.567   5.544  -0.050
    3    HA2  GLY  34           HA1      GLY  34  -4.989   6.663  -2.385

  No H/Q in entry =           3
  In of MODEL   23
    1    HA   ARG  35           HA       ARG  35  -2.198   9.971  -1.101
    2    HB2  ARG  35           HB2      ARG  35  -2.599   9.019   1.693
    3    HG2  ARG  35           HG2      ARG  35  -3.578  11.252  -0.006
    4    HD2  ARG  35           HD2      ARG  35  -2.544  12.034   2.292
    5    HE   ARG  35           HE       ARG  35  -3.660  10.995   4.000
    6   HH11  ARG  35          HH11      ARG  35  -5.970  12.027   1.597
    7   HH12  ARG  35          HH12      ARG  35  -7.346  11.654   2.579
    8   HH21  ARG  35          HH21      ARG  35  -5.470  10.503   5.293
    9   HH22  ARG  35          HH22      ARG  35  -7.063  10.790   4.677
   10    H    ARG  35           HN       ARG  35  -2.599   7.291   0.054
   11    HB3  ARG  35           HB1      ARG  35  -1.544  10.403   1.442
   12    HG3  ARG  35           HG1      ARG  35  -4.474  10.148   1.039
   13    HD3  ARG  35           HD1      ARG  35  -4.079  12.674   1.706

  No H/Q in entry =          13
  In of MODEL   23
    1    HA   SER  36           HA       SER  36   1.881   7.973  -0.725
    2    HB2  SER  36           HB2      SER  36   2.148   9.198   1.297
    3    HG   SER  36           HG       SER  36   3.888   8.201   2.127
    4    H    SER  36           HN       SER  36  -0.656   7.222   0.436
    5    HB3  SER  36           HB1      SER  36   1.463   7.893   2.264

  No H/Q in entry =           5
  In of MODEL   23
    1    HA   CYS  37           HA       CYS  37   2.516   3.712  -0.751
    2    HB2  CYS  37           HB2      CYS  37   4.834   4.704  -1.341
    3    H    CYS  37           HN       CYS  37   3.593   6.266  -0.083
    4    HB3  CYS  37           HB1      CYS  37   5.314   4.150   0.260

  No H/Q in entry =           4
  In of MODEL   23
    1    HA   GLU  38           HA       GLU  38   3.738   2.942   3.811
    2    HB2  GLU  38           HB2      GLU  38   3.392   5.865   4.370
    3    HG2  GLU  38           HG2      GLU  38   5.553   3.893   4.541
    4    H    GLU  38           HN       GLU  38   3.535   5.263   2.207
    5    HB3  GLU  38           HB1      GLU  38   3.229   4.704   5.681
    6    HG3  GLU  38           HG1      GLU  38   5.617   5.633   4.267

  No H/Q in entry =           6
  In of MODEL   23
    1    HA   CYS  39           HA       CYS  39  -0.761   2.541   3.450
    2    HB2  CYS  39           HB2      CYS  39  -1.343   0.174   3.503
    3    H    CYS  39           HN       CYS  39   1.898   1.692   3.237
    4    HB3  CYS  39           HB1      CYS  39  -0.069   0.457   2.321

  No H/Q in entry =           4
  In of MODEL   23
    1    HA   PRO  40           HA       PRO  40  -1.473   2.806   7.796
    2    HB2  PRO  40           HB2      PRO  40  -4.112   2.191   7.923
    3    HG2  PRO  40           HG2      PRO  40  -4.394   1.276   5.807
    4    HD2  PRO  40           HD2      PRO  40  -2.845   1.586   4.131
    5    HB3  PRO  40           HB1      PRO  40  -3.517   3.728   7.284
    6    HG3  PRO  40           HG1      PRO  40  -4.750   2.978   5.460
    7    HD3  PRO  40           HD1      PRO  40  -2.710   3.328   4.446

  No H/Q in entry =           7
  In of MODEL   23
    1    HA   SER  41           HA       SER  41  -2.058  -1.347   9.209
    2    HB2  SER  41           HB2      SER  41  -1.200   0.495  11.390
    3    HG   SER  41           HG       SER  41   0.013  -1.920  10.627
    4    H    SER  41           HN       SER  41  -2.517   1.532   9.641
    5    HB3  SER  41           HB1      SER  41  -1.622  -1.159  11.835

  No H/Q in entry =           5
  In of MODEL   23
    1    HA   TYR  42           HA       TYR  42  -6.090  -1.145  11.135
    2    HB2  TYR  42           HB2      TYR  42  -6.397   1.444   9.709
    3    HD1  TYR  42           HD1      TYR  42  -4.612   0.988  11.923
    4    HD2  TYR  42           HD2      TYR  42  -8.812   1.665  11.972
    5    HE1  TYR  42           HE1      TYR  42  -4.436   1.876  14.209
    6    HE2  TYR  42           HE2      TYR  42  -8.648   2.556  14.258
    7    HH   TYR  42           HH       TYR  42  -7.173   2.445  16.176
    8    H    TYR  42           HN       TYR  42  -4.574   0.073   8.920
    9    HB3  TYR  42           HB1      TYR  42  -7.876   0.597  10.147

  No H/Q in entry =           9
  In of MODEL   23
    1    HA   PRO  43           HA       PRO  43  -8.050  -3.765   8.177
    2    HB2  PRO  43           HB2      PRO  43 -10.456  -4.175   9.362
    3    HG2  PRO  43           HG2      PRO  43 -10.407  -2.464  10.931
    4    HD2  PRO  43           HD2      PRO  43  -8.453  -1.376  11.484
    5    HB3  PRO  43           HB1      PRO  43  -8.958  -4.898   9.960
    6    HG3  PRO  43           HG1      PRO  43  -9.659  -3.770  11.870
    7    HD3  PRO  43           HD1      PRO  43  -7.541  -2.890  11.643

  No H/Q in entry =           7
  In of MODEL   23
    1    HA3  GLY  44           HA2      GLY  44  -9.167  -0.280   5.346
    2    H    GLY  44           HN       GLY  44  -8.046  -1.465   6.969
    3    HA2  GLY  44           HA1      GLY  44 -10.537  -1.350   5.597

  No H/Q in entry =           3
  In of MODEL   23
    1    HA   ASN  45           HA       ASN  45 -11.423   2.869   7.221
    2    HB2  ASN  45           HB2      ASN  45  -9.977   1.635   9.508
    3   HD21  ASN  45          HD21      ASN  45 -12.945   3.505   9.022
    4   HD22  ASN  45          HD22      ASN  45 -14.025   2.219   9.426
    5    H    ASN  45           HN       ASN  45  -8.941   1.574   6.728
    6    HB3  ASN  45           HB1      ASN  45 -10.629   3.253   9.751

  No H/Q in entry =           6
  In of MODEL   23
    1    HA3  GLY  46           HA2      GLY  46  -8.080   5.738   6.596
    2    H    GLY  46           HN       GLY  46 -10.665   4.558   6.021
    3    HA2  GLY  46           HA1      GLY  46  -9.217   6.262   5.362

  No H/Q in entry =           3
  In of MODEL   24
    1    H1   ALA   1           HT3      ALA   1  10.674  15.317  -0.014
    2    H2   ALA   1           HT2      ALA   1  10.513  13.921   0.971
    3    H3   ALA   1           HT1      ALA   1  11.106  15.384   1.643
    4    HA   ALA   1           HA       ALA   1  13.084  15.253   0.521
    5    HB3  ALA   1           HB1      ALA   1  13.424  13.841   2.272
    6    HB2  ALA   1           HB2      ALA   1  13.674  12.703   0.948
    7    HB1  ALA   1           HB3      ALA   1  12.125  12.749   1.791

  No H/Q in entry =           7
  In of MODEL   24
    1    HA   MET   2           HA       MET   2  10.573  11.870  -2.756
    2    HB2  MET   2           HB2      MET   2  10.689  14.308  -3.446
    3    H    MET   2           HN       MET   2  10.796  12.859  -0.721
    4    HG2  MET   2           HG2      MET   2  11.809  12.401  -5.485
    5    HE1  MET   2           HE1      MET   2   8.601  14.636  -5.514
    6    HB3  MET   2           HB1      MET   2  12.387  14.036  -3.816
    7    HE3  MET   2           HE2      MET   2   9.201  16.135  -6.225
    8    HE2  MET   2           HE3      MET   2   9.735  15.646  -4.617
    9    HG3  MET   2           HG1      MET   2  10.104  12.519  -5.056

  No H/Q in entry =           9
  In of MODEL   24
    1    HA   ASP   3           HA       ASP   3  14.235   9.758  -3.869
    2    HB2  ASP   3           HB2      ASP   3  13.439   8.939  -1.111
    3    H    ASP   3           HN       ASP   3  11.517   9.941  -2.879
    4    HB3  ASP   3           HB1      ASP   3  14.592   7.931  -1.980

  No H/Q in entry =           4
  In of MODEL   24
    1    HA   CYS   4           HA       CYS   4  10.630   7.506  -6.159
    2    HB2  CYS   4           HB2      CYS   4  13.419   6.536  -5.902
    3    H    CYS   4           HN       CYS   4  11.671   9.135  -4.963
    4    HB3  CYS   4           HB1      CYS   4  12.223   5.342  -6.391

  No H/Q in entry =           4
  In of MODEL   24
    1    HA   THR   5           HA       THR   5   9.386   5.474  -2.297
    2    HB   THR   5           HB       THR   5   7.019   5.646  -2.013
    3    HG1  THR   5           HG1      THR   5   5.658   6.283  -3.646
    4   HG23  THR   5          HG21      THR   5   7.117   7.782  -1.476
    5   HG22  THR   5          HG22      THR   5   6.991   8.241  -3.175
    6   HG21  THR   5          HG23      THR   5   8.574   7.948  -2.456
    7    H    THR   5           HN       THR   5   9.098   7.243  -4.450

  No H/Q in entry =           7
  In of MODEL   24
    1    HA   THR   6           HA       THR   6   8.270   1.755  -4.347
    2    HB   THR   6           HB       THR   6  10.468   1.780  -5.196
    3    HG1  THR   6           HG1      THR   6  10.427  -0.514  -3.538
    4   HG23  THR   6          HG21      THR   6  11.939   2.658  -3.706
    5   HG22  THR   6          HG22      THR   6  12.355   0.951  -3.563
    6   HG21  THR   6          HG23      THR   6  11.315   1.709  -2.357
    7    H    THR   6           HN       THR   6   9.682   3.355  -2.326

  No H/Q in entry =           7
  In of MODEL   24
    1    HA3  GLY   7           HA2      GLY   7   8.372  -1.721  -1.431
    2    H    GLY   7           HN       GLY   7   7.685  -0.352  -3.706
    3    HA2  GLY   7           HA1      GLY   7   7.126  -0.600  -0.906

  No H/Q in entry =           3
  In of MODEL   24
    1    HA   PRO   8           HA       PRO   8   4.862  -4.363  -2.237
    2    HB2  PRO   8           HB2      PRO   8   2.816  -4.054  -0.482
    3    HG2  PRO   8           HG2      PRO   8   3.421  -2.021   0.461
    4    HD2  PRO   8           HD2      PRO   8   5.537  -1.147   0.212
    5    HB3  PRO   8           HB1      PRO   8   4.347  -4.822  -0.046
    6    HG3  PRO   8           HG1      PRO   8   4.271  -3.133   1.550
    7    HD3  PRO   8           HD1      PRO   8   6.325  -2.689   0.604

  No H/Q in entry =           7
  In of MODEL   24
    1    HA   CYS   9           HA       CYS   9   1.291  -1.640  -3.395
    2    HB2  CYS   9           HB2      CYS   9   0.808  -0.633  -1.146
    3    H    CYS   9           HN       CYS   9   3.336  -1.254  -1.375
    4    HB3  CYS   9           HB1      CYS   9   1.749   0.772  -1.635

  No H/Q in entry =           4
  In of MODEL   24
    1    HA   CYS  10           HA       CYS  10   3.839   1.126  -5.826
    2    HB2  CYS  10           HB2      CYS  10   6.412   1.074  -4.258
    3    H    CYS  10           HN       CYS  10   4.385  -0.809  -3.675
    4    HB3  CYS  10           HB1      CYS  10   5.815   2.335  -5.330

  No H/Q in entry =           4
  In of MODEL   24
    1    HA   ARG  11           HA       ARG  11   6.210  -1.588  -8.237
    2    HB2  ARG  11           HB2      ARG  11   6.171   1.036  -9.665
    3    HG2  ARG  11           HG2      ARG  11   4.915  -1.637 -10.009
    4    HD2  ARG  11           HD2      ARG  11   5.317   0.365 -12.228
    5    HE   ARG  11           HE       ARG  11   3.382  -0.588 -12.971
    6   HH11  ARG  11          HH11      ARG  11   5.323  -3.063 -11.458
    7   HH12  ARG  11          HH12      ARG  11   4.263  -4.352 -11.921
    8   HH21  ARG  11          HH21      ARG  11   1.988  -2.282 -13.581
    9   HH22  ARG  11          HH22      ARG  11   2.370  -3.909 -13.127
   10    H    ARG  11           HN       ARG  11   5.592   1.154  -7.505
   11    HB3  ARG  11           HB1      ARG  11   7.143  -0.270 -10.328
   12    HG3  ARG  11           HG1      ARG  11   4.192  -0.029 -10.090
   13    HD3  ARG  11           HD1      ARG  11   6.036  -1.243 -12.146

  No H/Q in entry =          13
  In of MODEL   24
    1    HA   GLN  12           HA       GLN  12  10.346   0.262  -7.177
    2    HB2  GLN  12           HB2      GLN  12  10.390   0.215 -10.161
    3    HG2  GLN  12           HG2      GLN  12  10.233  -1.884  -8.875
    4   HE21  GLN  12          HE21      GLN  12  13.607  -2.044  -8.964
    5   HE22  GLN  12          HE22      GLN  12  13.892  -2.167  -7.265
    6    H    GLN  12           HN       GLN  12   8.190   1.297  -8.810
    7    HB3  GLN  12           HB1      GLN  12  11.877   0.599  -9.307
    8    HG3  GLN  12           HG1      GLN  12  11.675  -1.784  -9.883

  No H/Q in entry =           8
  In of MODEL   24
    1    HA   CYS  13           HA       CYS  13  10.403   4.650  -6.728
    2    HB2  CYS  13           HB2      CYS  13  11.269   4.587  -9.019
    3    H    CYS  13           HN       CYS  13   8.589   2.709  -7.547
    4    HB3  CYS  13           HB1      CYS  13   9.656   4.895  -9.651

  No H/Q in entry =           4
  In of MODEL   24
    1    HA   LYS  14           HA       LYS  14   6.134   6.182  -6.906
    2    HB2  LYS  14           HB2      LYS  14   5.227   5.136  -9.592
    3    HG2  LYS  14           HG2      LYS  14   6.299   7.882  -9.281
    4    HD2  LYS  14           HD2      LYS  14   5.236   6.501 -11.354
    5    HE2  LYS  14           HE2      LYS  14   8.135   6.490 -12.037
    6    HZ1  LYS  14           HZ1      LYS  14   5.740   5.013 -12.966
    7    HZ3  LYS  14           HZ2      LYS  14   7.310   4.623 -13.457
    8    HZ2  LYS  14           HZ3      LYS  14   6.661   6.140 -13.829
    9    H    LYS  14           HN       LYS  14   7.397   4.009  -8.448
   10    HB3  LYS  14           HB1      LYS  14   4.568   6.511  -8.716
   11    HG3  LYS  14           HG1      LYS  14   7.453   6.554  -9.419
   12    HD3  LYS  14           HD1      LYS  14   6.357   7.853 -11.530
   13    HE3  LYS  14           HE1      LYS  14   7.463   5.111 -11.168

  No H/Q in entry =          13
  In of MODEL   24
    1    HA   LEU  15           HA       LEU  15   3.526   3.049  -5.433
    2    HB2  LEU  15           HB2      LEU  15   3.352   5.066  -3.857
    3    HG   LEU  15           HG       LEU  15   2.183   2.652  -3.608
    4   HD11  LEU  15          HD11      LEU  15   3.164   4.140  -1.852
    5   HD13  LEU  15          HD12      LEU  15   1.746   3.226  -1.340
    6   HD12  LEU  15          HD13      LEU  15   1.595   4.937  -1.740
    7   HD21  LEU  15          HD21      LEU  15   0.023   4.597  -4.129
    8   HD23  LEU  15          HD22      LEU  15  -0.215   3.501  -2.768
    9   HD22  LEU  15          HD23      LEU  15   0.069   2.853  -4.383
   10    H    LEU  15           HN       LEU  15   4.020   5.819  -6.118
   11    HB3  LEU  15           HB1      LEU  15   1.825   5.400  -4.651

  No H/Q in entry =          11
  In of MODEL   24
    1    HA   LYS  16           HA       LYS  16   0.381   2.382  -8.306
    2    HB2  LYS  16           HB2      LYS  16   0.023   0.491  -6.066
    3    HG2  LYS  16           HG2      LYS  16  -0.384  -0.337  -8.863
    4    HD2  LYS  16           HD2      LYS  16   1.168  -1.315  -6.481
    5    HE2  LYS  16           HE2      LYS  16   1.169  -2.389  -9.296
    6    HZ3  LYS  16           HZ1      LYS  16   2.824  -3.970  -7.962
    7    HZ2  LYS  16           HZ2      LYS  16   1.197  -4.352  -8.223
    8    HZ1  LYS  16           HZ3      LYS  16   1.681  -3.685  -6.746
    9    H    LYS  16           HN       LYS  16   1.450   2.031  -5.684
   10    HB3  LYS  16           HB1      LYS  16  -1.375   0.688  -7.114
   11    HG3  LYS  16           HG1      LYS  16   1.218   0.286  -8.462
   12    HD3  LYS  16           HD1      LYS  16  -0.228  -2.062  -7.261
   13    HE3  LYS  16           HE1      LYS  16   2.556  -1.790  -8.387

  No H/Q in entry =          13
  In of MODEL   24
    1    HA   PRO  17           HA       PRO  17  -3.085   5.053  -7.892
    2    HB2  PRO  17           HB2      PRO  17  -4.875   2.771  -8.582
    3    HG2  PRO  17           HG2      PRO  17  -3.744   2.253 -10.550
    4    HD2  PRO  17           HD2      PRO  17  -2.284   1.364  -9.002
    5    HB3  PRO  17           HB1      PRO  17  -4.766   4.376  -9.313
    6    HG3  PRO  17           HG1      PRO  17  -2.907   3.816 -10.584
    7    HD3  PRO  17           HD1      PRO  17  -1.182   2.551  -9.728

  No H/Q in entry =           7
  In of MODEL   24
    1    HA   ALA  18           HA       ALA  18  -4.522   4.468  -3.841
    2    HB1  ALA  18           HB1      ALA  18  -4.989   6.813  -4.050
    3    HB2  ALA  18           HB2      ALA  18  -6.377   6.028  -3.296
    4    HB3  ALA  18           HB3      ALA  18  -6.439   6.485  -4.999
    5    H    ALA  18           HN       ALA  18  -4.482   5.710  -6.324

  No H/Q in entry =           5
  In of MODEL   24
    1    HA3  GLY  19           HA2      GLY  19  -7.914   1.870  -2.687
    2    H    GLY  19           HN       GLY  19  -5.653   2.846  -2.979
    3    HA2  GLY  19           HA1      GLY  19  -8.049   1.912  -4.438

  No H/Q in entry =           3
  In of MODEL   24
    1    HA   THR  20           HA       THR  20  -5.560  -1.661  -5.013
    2    HB   THR  20           HB       THR  20  -2.831  -0.553  -4.456
    3    HG1  THR  20           HG1      THR  20  -4.337  -0.067  -6.809
    4   HG23  THR  20          HG21      THR  20  -2.708  -2.778  -5.141
    5   HG22  THR  20          HG22      THR  20  -2.366  -1.842  -6.596
    6   HG21  THR  20          HG23      THR  20  -3.959  -2.564  -6.366
    7    H    THR  20           HN       THR  20  -5.164   1.078  -4.651

  No H/Q in entry =           7
  In of MODEL   24
    1    HA   THR  21           HA       THR  21  -4.779  -3.148  -1.010
    2    HB   THR  21           HB       THR  21  -4.459  -5.764  -1.229
    3    HG1  THR  21           HG1      THR  21  -5.173  -6.538  -3.189
    4   HG21  THR  21          HG21      THR  21  -6.936  -4.214  -1.874
    5   HG23  THR  21          HG22      THR  21  -6.503  -5.045  -0.380
    6   HG22  THR  21          HG23      THR  21  -6.930  -5.977  -1.815
    7    H    THR  21           HN       THR  21  -4.641  -3.473  -3.897

  No H/Q in entry =           7
  In of MODEL   24
    1    HA   CYS  22           HA       CYS  22  -0.422  -2.948  -0.753
    2    HB2  CYS  22           HB2      CYS  22  -1.676  -2.874   1.941
    3    H    CYS  22           HN       CYS  22  -3.044  -2.968   0.233
    4    HB3  CYS  22           HB1      CYS  22   0.034  -3.284   1.865

  No H/Q in entry =           4
  In of MODEL   24
    1    HA   TRP  23           HA       TRP  23  -0.568  -7.502  -0.141
    2    HB2  TRP  23           HB2      TRP  23   0.816  -6.807   1.777
    3    HD1  TRP  23           HD1      TRP  23   1.105  -9.314   0.110
    4    HE1  TRP  23           HE1      TRP  23   1.575 -11.624   1.143
    5    HE3  TRP  23           HE3      TRP  23  -0.577  -8.439   4.859
    6    HZ2  TRP  23           HZ2      TRP  23   1.274 -12.906   3.640
    7    HZ3  TRP  23           HZ3      TRP  23  -0.451 -10.260   6.509
    8    HH2  TRP  23           HH2      TRP  23   0.455 -12.447   5.911
    9    H    TRP  23           HN       TRP  23  -2.215  -5.443   1.011
   10    HB3  TRP  23           HB1      TRP  23  -0.541  -7.103   2.859

  No H/Q in entry =          10
  In of MODEL   24
    1    HA   ARG  24           HA       ARG  24  -4.922  -8.570   0.642
    2    HB2  ARG  24           HB2      ARG  24  -5.808  -9.734  -1.326
    3    HG2  ARG  24           HG2      ARG  24  -3.108  -9.281  -2.580
    4    HD2  ARG  24           HD2      ARG  24  -4.262 -10.802  -4.336
    5    HE   ARG  24           HE       ARG  24  -3.950  -8.114  -4.314
    6   HH11  ARG  24          HH11      ARG  24  -6.477 -10.221  -5.479
    7   HH12  ARG  24          HH12      ARG  24  -6.956  -9.149  -6.752
    8   HH21  ARG  24          HH21      ARG  24  -4.580  -6.703  -5.988
    9   HH22  ARG  24          HH22      ARG  24  -5.879  -7.152  -7.041
   10    H    ARG  24           HN       ARG  24  -2.709  -7.958  -0.964
   11    HB3  ARG  24           HB1      ARG  24  -5.109  -8.181  -1.764
   12    HG3  ARG  24           HG1      ARG  24  -3.748 -10.848  -2.082
   13    HD3  ARG  24           HD1      ARG  24  -5.757 -10.227  -3.599

  No H/Q in entry =          13
  In of MODEL   24
    1    HA   THR  25           HA       THR  25  -4.309 -12.921   1.264
    2    HB   THR  25           HB       THR  25  -3.503 -13.199   3.546
    3    HG1  THR  25           HG1      THR  25  -4.941 -11.772   4.584
    4   HG23  THR  25          HG21      THR  25  -1.595 -11.801   3.544
    5   HG22  THR  25          HG22      THR  25  -2.399 -10.596   2.538
    6   HG21  THR  25          HG23      THR  25  -1.972 -12.168   1.861
    7    H    THR  25           HN       THR  25  -5.578 -10.365   1.697

  No H/Q in entry =           7
  In of MODEL   24
    1    HA   SER  26           HA       SER  26  -8.031 -13.989   3.355
    2    HB2  SER  26           HB2      SER  26  -6.485 -16.541   3.864
    3    HG   SER  26           HG       SER  26  -7.960 -16.410   1.584
    4    H    SER  26           HN       SER  26  -5.113 -14.360   3.356
    5    HB3  SER  26           HB1      SER  26  -8.230 -16.384   3.663

  No H/Q in entry =           5
  In of MODEL   24
    1    HA   VAL  27           HA       VAL  27  -8.218 -13.430   7.611
    2    HB   VAL  27           HB       VAL  27  -5.976 -14.428   7.689
    3    H    VAL  27           HN       VAL  27  -7.399 -12.398   5.141

  No H/Q in entry =           3
  In of MODEL   24
    1    HA   SER  28           HA       SER  28  -8.061  -8.869   6.968
    2    HB2  SER  28           HB2      SER  28  -6.406  -9.390   8.884
    3    HG   SER  28           HG       SER  28  -6.025  -7.005   9.097
    4    H    SER  28           HN       SER  28  -6.360 -10.929   5.969
    5    HB3  SER  28           HB1      SER  28  -5.198  -8.610   7.862

  No H/Q in entry =           5
  In of MODEL   24
    1    HA   SER  29           HA       SER  29  -5.509  -6.831   3.911
    2    HB2  SER  29           HB2      SER  29  -8.182  -6.837   3.540
    3    HG   SER  29           HG       SER  29  -6.430  -6.856   1.945
    4    H    SER  29           HN       SER  29  -7.280  -6.673   6.244
    5    HB3  SER  29           HB1      SER  29  -7.898  -5.098   3.616

  No H/Q in entry =           5
  In of MODEL   24
    1    HA   HIS  30           HA       HIS  30  -4.482  -2.886   5.505
    2    HB2  HIS  30           HB2      HIS  30  -2.382  -3.944   3.675
    3    HD1  HIS  30           HD1      HIS  30   0.004  -3.404   5.310
    4    HD2  HIS  30           HD2      HIS  30  -3.666  -4.273   7.053
    5    HE1  HIS  30           HE1      HIS  30   0.539  -4.240   7.620
    6    HE2  HIS  30           HE2      HIS  30  -1.702  -4.677   8.686
    7    H    HIS  30           HN       HIS  30  -4.488  -4.875   3.340
    8    HB3  HIS  30           HB1      HIS  30  -2.247  -2.266   4.192

  No H/Q in entry =           8
  In of MODEL   24
    1    HA   TYR  31           HA       TYR  31  -5.546  -1.946   0.392
    2    HB2  TYR  31           HB2      TYR  31  -6.668  -0.519   2.798
    3    HD1  TYR  31           HD1      TYR  31  -7.641  -2.064  -0.471
    4    HD2  TYR  31           HD2      TYR  31  -8.444  -1.671   3.689
    5    HE1  TYR  31           HE1      TYR  31  -9.545  -3.603  -0.699
    6    HE2  TYR  31           HE2      TYR  31 -10.349  -3.210   3.472
    7    HH   TYR  31           HH       TYR  31 -10.817  -5.214   0.939
    8    H    TYR  31           HN       TYR  31  -4.821  -3.321   2.052
    9    HB3  TYR  31           HB1      TYR  31  -6.942   0.060   1.158

  No H/Q in entry =           9
  In of MODEL   24
    1    HA   CYS  32           HA       CYS  32  -2.951   1.659   0.577
    2    HB2  CYS  32           HB2      CYS  32  -3.813   1.216  -2.284
    3    H    CYS  32           HN       CYS  32  -5.431   0.418  -0.418
    4    HB3  CYS  32           HB1      CYS  32  -2.508   2.304  -1.825

  No H/Q in entry =           4
  In of MODEL   24
    1    HA   THR  33           HA       THR  33  -5.363   5.284  -0.096
    2    HB   THR  33           HB       THR  33  -4.476   5.668   2.070
    3    HG1  THR  33           HG1      THR  33  -4.055   7.918   2.009
    4   HG22  THR  33          HG21      THR  33  -1.882   6.560   0.840
    5   HG21  THR  33          HG22      THR  33  -2.145   4.999   1.618
    6   HG23  THR  33          HG23      THR  33  -2.279   6.486   2.557
    7    H    THR  33           HN       THR  33  -2.732   3.961   0.018

  No H/Q in entry =           7
  In of MODEL   24
    1    HA3  GLY  34           HA2      GLY  34  -1.357   6.124  -3.287
    2    H    GLY  34           HN       GLY  34  -1.977   5.444  -1.084
    3    HA2  GLY  34           HA1      GLY  34  -2.807   7.114  -3.355

  No H/Q in entry =           3
  In of MODEL   24
    1    HA   ARG  35           HA       ARG  35   0.281   9.772  -1.351
    2    HB2  ARG  35           HB2      ARG  35  -0.848   8.733   1.200
    3    HG2  ARG  35           HG2      ARG  35  -0.875  11.600   0.502
    4    HD2  ARG  35           HD2      ARG  35  -2.913   9.610   1.484
    5    HE   ARG  35           HE       ARG  35  -3.597  12.372   1.719
    6   HH11  ARG  35          HH11      ARG  35  -3.709   9.619  -0.423
    7   HH12  ARG  35          HH12      ARG  35  -5.082  10.202  -1.303
    8   HH21  ARG  35          HH21      ARG  35  -5.403  13.141   0.563
    9   HH22  ARG  35          HH22      ARG  35  -6.043  12.201  -0.745
   10    H    ARG  35           HN       ARG  35  -0.617   7.065  -0.618
   11    HB3  ARG  35           HB1      ARG  35   0.432   9.935   1.302
   12    HG3  ARG  35           HG1      ARG  35  -1.799  10.522  -0.546
   13    HD3  ARG  35           HD1      ARG  35  -2.076  10.832   2.440

  No H/Q in entry =          13
  In of MODEL   24
    1    HA   SER  36           HA       SER  36   3.829   7.130  -0.205
    2    HB2  SER  36           HB2      SER  36   3.122   8.219   2.155
    3    HG   SER  36           HG       SER  36   5.199   8.427   2.090
    4    H    SER  36           HN       SER  36   1.023   6.840   0.471
    5    HB3  SER  36           HB1      SER  36   3.371   6.552   2.671

  No H/Q in entry =           5
  In of MODEL   24
    1    HA   CYS  37           HA       CYS  37   3.561   2.832  -0.349
    2    HB2  CYS  37           HB2      CYS  37   6.187   3.623  -0.714
    3    H    CYS  37           HN       CYS  37   5.065   5.185   0.206
    4    HB3  CYS  37           HB1      CYS  37   6.314   2.374   0.520

  No H/Q in entry =           4
  In of MODEL   24
    1    HA   GLU  38           HA       GLU  38   4.942   2.061   4.218
    2    HB2  GLU  38           HB2      GLU  38   4.353   4.965   4.782
    3    HG2  GLU  38           HG2      GLU  38   6.615   4.679   5.981
    4    H    GLU  38           HN       GLU  38   4.802   4.295   2.535
    5    HB3  GLU  38           HB1      GLU  38   4.507   3.764   6.058
    6    HG3  GLU  38           HG1      GLU  38   6.792   3.246   4.969

  No H/Q in entry =           6
  In of MODEL   24
    1    HA   CYS  39           HA       CYS  39   0.479   1.477   3.775
    2    HB2  CYS  39           HB2      CYS  39   1.653  -1.211   4.517
    3    H    CYS  39           HN       CYS  39   3.166   0.721   3.722
    4    HB3  CYS  39           HB1      CYS  39  -0.017  -0.904   4.053

  No H/Q in entry =           4
  In of MODEL   24
    1    HA   PRO  40           HA       PRO  40  -0.379   2.120   8.059
    2    HB2  PRO  40           HB2      PRO  40  -3.025   1.551   8.130
    3    HG2  PRO  40           HG2      PRO  40  -3.239   0.448   6.097
    4    HD2  PRO  40           HD2      PRO  40  -1.619   0.583   4.466
    5    HB3  PRO  40           HB1      PRO  40  -2.385   3.017   7.377
    6    HG3  PRO  40           HG1      PRO  40  -3.560   2.114   5.583
    7    HD3  PRO  40           HD1      PRO  40  -1.484   2.347   4.612

  No H/Q in entry =           7
  In of MODEL   24
    1    HA   SER  41           HA       SER  41  -1.393  -1.921   9.722
    2    HB2  SER  41           HB2      SER  41  -0.449  -1.691  12.186
    3    HG   SER  41           HG       SER  41   0.135   0.257  12.659
    4    H    SER  41           HN       SER  41  -1.590   1.001   9.934
    5    HB3  SER  41           HB1      SER  41   0.625  -1.594  10.791

  No H/Q in entry =           5
  In of MODEL   24
    1    HA   TYR  42           HA       TYR  42  -5.033  -1.226  12.103
    2    HB2  TYR  42           HB2      TYR  42  -4.355   1.270  12.315
    3    HD1  TYR  42           HD1      TYR  42  -4.913   1.600  14.519
    4    HD2  TYR  42           HD2      TYR  42  -7.906   0.180  11.851
    5    HE1  TYR  42           HE1      TYR  42  -6.544   1.600  16.359
    6    HE2  TYR  42           HE2      TYR  42  -9.546   0.176  13.683
    7    HH   TYR  42           HH       TYR  42  -9.357   1.784  16.325
    8    H    TYR  42           HN       TYR  42  -3.678  -0.127   9.745
    9    HB3  TYR  42           HB1      TYR  42  -5.650   1.561  11.159

  No H/Q in entry =           9
  In of MODEL   24
    1    HA   PRO  43           HA       PRO  43  -7.433  -2.201   8.302
    2    HB2  PRO  43           HB2      PRO  43  -8.371  -4.577   9.222
    3    HG2  PRO  43           HG2      PRO  43  -7.478  -4.534  11.365
    4    HD2  PRO  43           HD2      PRO  43  -5.790  -3.078  11.953
    5    HB3  PRO  43           HB1      PRO  43  -6.789  -4.401   8.455
    6    HG3  PRO  43           HG1      PRO  43  -6.153  -5.327  10.492
    7    HD3  PRO  43           HD1      PRO  43  -4.850  -3.425  10.488

  No H/Q in entry =           7
  In of MODEL   24
    1    HA3  GLY  44           HA2      GLY  44 -11.686  -1.559   9.017
    2    H    GLY  44           HN       GLY  44  -9.224  -0.980   8.251
    3    HA2  GLY  44           HA1      GLY  44 -11.041  -0.963  10.539

  No H/Q in entry =           3
  In of MODEL   24
    1    HA   ASN  45           HA       ASN  45 -11.063   2.863   8.002
    2    HB2  ASN  45           HB2      ASN  45 -10.323   1.554   5.394
    3   HD21  ASN  45          HD21      ASN  45  -8.467   3.341   4.636
    4   HD22  ASN  45          HD22      ASN  45  -7.187   3.418   5.794
    5    H    ASN  45           HN       ASN  45 -10.682   0.115   7.163
    6    HB3  ASN  45           HB1      ASN  45 -10.721   3.267   5.480

  No H/Q in entry =           6
  In of MODEL   24
    1    HA3  GLY  46           HA2      GLY  46 -14.689   4.331   5.774
    2    H    GLY  46           HN       GLY  46 -12.768   4.178   7.480
    3    HA2  GLY  46           HA1      GLY  46 -15.157   2.785   6.466

  No H/Q in entry =           3
  In of MODEL   25
    1    H1   ALA   1           HT3      ALA   1  13.328   5.699  -1.170
    2    H2   ALA   1           HT2      ALA   1  14.321   4.398  -0.654
    3    H3   ALA   1           HT1      ALA   1  13.638   5.469   0.500
    4    HA   ALA   1           HA       ALA   1  15.784   6.153   0.350
    5    HB3  ALA   1           HB1      ALA   1  16.796   5.050  -1.367
    6    HB2  ALA   1           HB2      ALA   1  16.647   6.645  -2.105
    7    HB1  ALA   1           HB3      ALA   1  15.485   5.378  -2.500

  No H/Q in entry =           7
  In of MODEL   25
    1    HA   MET   2           HA       MET   2  12.261   9.507   0.297
    2    HB2  MET   2           HB2      MET   2  14.540  10.027   1.285
    3    H    MET   2           HN       MET   2  13.160   7.419   0.338
    4    HG2  MET   2           HG2      MET   2  13.012  12.090  -0.254
    5    HE3  MET   2           HE1      MET   2  16.702  12.922   2.362
    6    HB3  MET   2           HB1      MET   2  15.035  10.516  -0.330
    7    HE2  MET   2           HE2      MET   2  16.610  11.484   1.346
    8    HE1  MET   2           HE3      MET   2  15.468  11.701   2.673
    9    HG3  MET   2           HG1      MET   2  13.021  11.786   1.483

  No H/Q in entry =           9
  In of MODEL   25
    1    HA   ASP   3           HA       ASP   3  10.902  12.018  -3.141
    2    HB2  ASP   3           HB2      ASP   3  13.616  11.889  -3.306
    3    H    ASP   3           HN       ASP   3  11.498  11.126  -1.135
    4    HB3  ASP   3           HB1      ASP   3  13.153  10.899  -4.687

  No H/Q in entry =           4
  In of MODEL   25
    1    HA   CYS   4           HA       CYS   4  10.683   8.316  -6.055
    2    HB2  CYS   4           HB2      CYS   4  13.173   7.315  -5.110
    3    H    CYS   4           HN       CYS   4  12.614   9.060  -4.160
    4    HB3  CYS   4           HB1      CYS   4  12.021   5.984  -5.086

  No H/Q in entry =           4
  In of MODEL   25
    1    HA   THR   5           HA       THR   5   7.601   7.014  -3.207
    2    HB   THR   5           HB       THR   5   5.727   6.006  -4.807
    3    HG1  THR   5           HG1      THR   5   5.911   6.582  -6.848
    4   HG23  THR   5          HG21      THR   5   5.049   7.886  -3.694
    5   HG22  THR   5          HG22      THR   5   5.078   8.464  -5.360
    6   HG21  THR   5          HG23      THR   5   6.409   8.851  -4.269
    7    H    THR   5           HN       THR   5   8.663   7.698  -5.712

  No H/Q in entry =           7
  In of MODEL   25
    1    HA   THR   6           HA       THR   6   8.455   2.709  -3.524
    2    HB   THR   6           HB       THR   6  10.655   2.086  -2.367
    3    HG1  THR   6           HG1      THR   6  11.175   3.768  -1.131
    4   HG22  THR   6          HG21      THR   6  12.078   3.075  -4.162
    5   HG21  THR   6          HG22      THR   6  10.653   3.951  -4.721
    6   HG23  THR   6          HG23      THR   6  10.667   2.187  -4.735
    7    H    THR   6           HN       THR   6   8.949   5.372  -2.360

  No H/Q in entry =           7
  In of MODEL   25
    1    HA3  GLY   7           HA2      GLY   7   7.961   1.022   0.567
    2    H    GLY   7           HN       GLY   7   7.624   1.182  -2.207
    3    HA2  GLY   7           HA1      GLY   7   6.482   1.920   0.262

  No H/Q in entry =           3
  In of MODEL   25
    1    HA   PRO   8           HA       PRO   8   5.537  -2.676   0.537
    2    HB2  PRO   8           HB2      PRO   8   3.127  -1.489   1.803
    3    HG2  PRO   8           HG2      PRO   8   4.261  -0.544   3.599
    4    HD2  PRO   8           HD2      PRO   8   4.809   0.936   1.907
    5    HB3  PRO   8           HB1      PRO   8   4.101  -2.872   2.312
    6    HG3  PRO   8           HG1      PRO   8   5.704  -1.539   3.327
    7    HD3  PRO   8           HD1      PRO   8   6.447   0.430   2.369

  No H/Q in entry =           7
  In of MODEL   25
    1    HA   CYS   9           HA       CYS   9   1.968  -1.459  -2.140
    2    HB2  CYS   9           HB2      CYS   9   1.528   0.836  -0.766
    3    H    CYS   9           HN       CYS   9   3.786   0.167  -0.532
    4    HB3  CYS   9           HB1      CYS   9   1.869   1.487  -2.365

  No H/Q in entry =           4
  In of MODEL   25
    1    HA   CYS  10           HA       CYS  10   4.236   1.129  -5.413
    2    HB2  CYS  10           HB2      CYS  10   6.591   2.037  -3.761
    3    H    CYS  10           HN       CYS  10   4.319   1.165  -2.585
    4    HB3  CYS  10           HB1      CYS  10   6.084   2.621  -5.342

  No H/Q in entry =           4
  In of MODEL   25
    1    HA   ARG  11           HA       ARG  11   6.957  -2.178  -6.084
    2    HB2  ARG  11           HB2      ARG  11   5.726  -1.995  -8.204
    3    HG2  ARG  11           HG2      ARG  11   7.854  -3.512  -7.892
    4    HD2  ARG  11           HD2      ARG  11   8.761  -1.303  -9.609
    5    HE   ARG  11           HE       ARG  11  10.047  -3.664 -10.490
    6   HH11  ARG  11          HH11      ARG  11   7.156  -1.772 -10.982
    7   HH12  ARG  11          HH12      ARG  11   6.938  -2.301 -12.616
    8   HH21  ARG  11          HH21      ARG  11   9.761  -4.360 -12.640
    9   HH22  ARG  11          HH22      ARG  11   8.416  -3.770 -13.558
   10    H    ARG  11           HN       ARG  11   5.869   0.392  -6.885
   11    HB3  ARG  11           HB1      ARG  11   6.911  -0.840  -8.795
   12    HG3  ARG  11           HG1      ARG  11   7.031  -3.378  -9.447
   13    HD3  ARG  11           HD1      ARG  11   9.690  -2.426  -8.617

  No H/Q in entry =          13
  In of MODEL   25
    1    HA   GLN  12           HA       GLN  12  10.926  -0.105  -6.779
    2    HB2  GLN  12           HB2      GLN  12  11.058  -1.052  -9.036
    3    HG2  GLN  12           HG2      GLN  12  12.558   1.554  -8.934
    4   HE21  GLN  12          HE21      GLN  12  13.645  -1.724  -9.481
    5   HE22  GLN  12          HE22      GLN  12  14.169  -1.484 -11.109
    6    H    GLN  12           HN       GLN  12   8.422   0.161  -8.305
    7    HB3  GLN  12           HB1      GLN  12  10.536   0.480  -9.720
    8    HG3  GLN  12           HG1      GLN  12  13.073   0.057  -8.157

  No H/Q in entry =           8
  In of MODEL   25
    1    HA   CYS  13           HA       CYS  13   9.321   4.247  -6.590
    2    HB2  CYS  13           HB2      CYS  13  11.380   4.246  -8.024
    3    H    CYS  13           HN       CYS  13   8.633   2.079  -8.201
    4    HB3  CYS  13           HB1      CYS  13  10.353   4.574  -9.414

  No H/Q in entry =           4
  In of MODEL   25
    1    HA   LYS  14           HA       LYS  14   5.604   5.210  -8.729
    2    HB2  LYS  14           HB2      LYS  14   6.181   3.137 -10.296
    3    HG2  LYS  14           HG2      LYS  14   4.783   5.172 -10.862
    4    HD2  LYS  14           HD2      LYS  14   2.676   3.313  -9.833
    5    HE2  LYS  14           HE2      LYS  14   1.020   4.774 -11.022
    6    HZ3  LYS  14           HZ1      LYS  14   2.616   3.432 -13.083
    7    HZ2  LYS  14           HZ2      LYS  14   0.944   3.408 -12.832
    8    HZ1  LYS  14           HZ3      LYS  14   1.961   2.498 -11.833
    9    H    LYS  14           HN       LYS  14   6.996   2.929  -7.521
   10    HB3  LYS  14           HB1      LYS  14   4.738   2.477  -9.538
   11    HG3  LYS  14           HG1      LYS  14   4.408   3.681 -11.729
   12    HD3  LYS  14           HD1      LYS  14   2.870   5.044  -9.551
   13    HE3  LYS  14           HE1      LYS  14   2.361   5.402 -11.979

  No H/Q in entry =          13
  In of MODEL   25
    1    HA   LEU  15           HA       LEU  15   2.949   4.186  -5.431
    2    HB2  LEU  15           HB2      LEU  15   2.882   6.859  -6.096
    3    HG   LEU  15           HG       LEU  15   2.933   6.048  -3.782
    4   HD12  LEU  15          HD11      LEU  15   0.521   7.714  -3.682
    5   HD11  LEU  15          HD12      LEU  15   1.824   8.354  -4.684
    6   HD13  LEU  15          HD13      LEU  15   2.120   7.981  -2.986
    7   HD22  LEU  15          HD21      LEU  15   1.305   4.843  -2.808
    8   HD21  LEU  15          HD22      LEU  15   0.840   4.469  -4.467
    9   HD23  LEU  15          HD23      LEU  15   0.016   5.758  -3.589
   10    H    LEU  15           HN       LEU  15   3.740   5.715  -7.749
   11    HB3  LEU  15           HB1      LEU  15   1.199   6.388  -6.231

  No H/Q in entry =          11
  In of MODEL   25
    1    HA   LYS  16           HA       LYS  16   0.124   1.788  -7.780
    2    HB2  LYS  16           HB2      LYS  16  -0.327   1.087  -4.875
    3    HG2  LYS  16           HG2      LYS  16   1.865   0.390  -5.751
    4    HD2  LYS  16           HD2      LYS  16   1.408  -1.711  -7.398
    5    HE2  LYS  16           HE2      LYS  16   1.725   0.968  -8.661
    6    HZ1  LYS  16           HZ1      LYS  16   2.065  -1.203  -9.841
    7    HZ3  LYS  16           HZ2      LYS  16   3.422  -1.451  -8.863
    8    HZ2  LYS  16           HZ3      LYS  16   3.370  -0.128  -9.915
    9    H    LYS  16           HN       LYS  16   1.570   2.554  -5.518
   10    HB3  LYS  16           HB1      LYS  16  -1.106   0.273  -6.225
   11    HG3  LYS  16           HG1      LYS  16   0.817  -0.973  -5.354
   12    HD3  LYS  16           HD1      LYS  16   0.177  -0.576  -7.957
   13    HE3  LYS  16           HE1      LYS  16   2.951   0.415  -7.521

  No H/Q in entry =          13
  In of MODEL   25
    1    HA   PRO  17           HA       PRO  17  -3.528   4.252  -7.775
    2    HB2  PRO  17           HB2      PRO  17  -5.408   2.477  -8.620
    3    HG2  PRO  17           HG2      PRO  17  -4.224   0.502  -8.324
    4    HD2  PRO  17           HD2      PRO  17  -1.936   0.484  -8.029
    5    HB3  PRO  17           HB1      PRO  17  -4.181   3.166  -9.690
    6    HG3  PRO  17           HG1      PRO  17  -3.752   0.900  -9.987
    7    HD3  PRO  17           HD1      PRO  17  -1.659   1.636  -9.351

  No H/Q in entry =           7
  In of MODEL   25
    1    HA   ALA  18           HA       ALA  18  -5.412   3.752  -3.906
    2    HB3  ALA  18           HB1      ALA  18  -7.348   5.498  -5.420
    3    HB1  ALA  18           HB2      ALA  18  -6.062   6.023  -4.333
    4    HB2  ALA  18           HB3      ALA  18  -7.455   5.151  -3.694
    5    H    ALA  18           HN       ALA  18  -5.213   4.830  -6.472

  No H/Q in entry =           5
  In of MODEL   25
    1    HA3  GLY  19           HA2      GLY  19  -8.803   1.035  -2.831
    2    H    GLY  19           HN       GLY  19  -6.789   2.330  -2.925
    3    HA2  GLY  19           HA1      GLY  19  -8.853   1.052  -4.588

  No H/Q in entry =           3
  In of MODEL   25
    1    HA   THR  20           HA       THR  20  -6.169  -2.381  -4.931
    2    HB   THR  20           HB       THR  20  -3.624  -0.756  -4.784
    3    HG1  THR  20           HG1      THR  20  -4.724   0.143  -6.422
    4   HG22  THR  20          HG21      THR  20  -4.151  -3.313  -6.272
    5   HG21  THR  20          HG22      THR  20  -3.346  -3.222  -4.705
    6   HG23  THR  20          HG23      THR  20  -2.619  -2.454  -6.116
    7    H    THR  20           HN       THR  20  -5.955   0.421  -4.746

  No H/Q in entry =           7
  In of MODEL   25
    1    HA   THR  21           HA       THR  21  -5.125  -3.527  -0.890
    2    HB   THR  21           HB       THR  21  -4.509  -6.028  -0.846
    3    HG1  THR  21           HG1      THR  21  -4.897  -7.113  -2.784
    4   HG22  THR  21          HG21      THR  21  -6.917  -6.432  -2.102
    5   HG21  THR  21          HG22      THR  21  -7.031  -4.770  -1.522
    6   HG23  THR  21          HG23      THR  21  -6.679  -6.076  -0.391
    7    H    THR  21           HN       THR  21  -5.145  -4.028  -3.727

  No H/Q in entry =           7
  In of MODEL   25
    1    HA   CYS  22           HA       CYS  22  -0.820  -2.572  -1.048
    2    HB2  CYS  22           HB2      CYS  22  -1.806  -1.072   0.759
    3    H    CYS  22           HN       CYS  22  -3.399  -2.652   0.040
    4    HB3  CYS  22           HB1      CYS  22  -1.441  -2.364   1.898

  No H/Q in entry =           4
  In of MODEL   25
    1    HA   TRP  23           HA       TRP  23  -0.415  -6.878   0.494
    2    HB2  TRP  23           HB2      TRP  23   0.595  -5.346   2.343
    3    HD1  TRP  23           HD1      TRP  23   2.242  -7.184   0.897
    4    HE1  TRP  23           HE1      TRP  23   3.434  -9.257   1.850
    5    HE3  TRP  23           HE3      TRP  23  -0.581  -7.885   5.102
    6    HZ2  TRP  23           HZ2      TRP  23   3.208 -10.962   4.088
    7    HZ3  TRP  23           HZ3      TRP  23  -0.028  -9.760   6.596
    8    HH2  TRP  23           HH2      TRP  23   1.828 -11.266   6.097
    9    H    TRP  23           HN       TRP  23  -2.383  -4.898   1.039
   10    HB3  TRP  23           HB1      TRP  23  -0.546  -6.161   3.407

  No H/Q in entry =          10
  In of MODEL   25
    1    HA   ARG  24           HA       ARG  24  -4.128  -8.763   2.016
    2    HB2  ARG  24           HB2      ARG  24  -5.257  -7.588   0.178
    3    HG2  ARG  24           HG2      ARG  24  -5.851 -10.496   0.525
    4    HD2  ARG  24           HD2      ARG  24  -6.440  -9.610  -1.827
    5    HE   ARG  24           HE       ARG  24  -7.900  -7.728  -0.330
    6   HH11  ARG  24          HH11      ARG  24  -8.259  -9.849  -3.078
    7   HH12  ARG  24          HH12      ARG  24  -9.442  -8.851  -3.853
    8   HH21  ARG  24          HH21      ARG  24  -9.456  -6.412  -1.348
    9   HH22  ARG  24          HH22      ARG  24 -10.121  -6.899  -2.871
   10    H    ARG  24           HN       ARG  24  -2.372  -7.890  -0.176
   11    HB3  ARG  24           HB1      ARG  24  -4.627  -8.765  -0.966
   12    HG3  ARG  24           HG1      ARG  24  -6.750  -9.093   1.107
   13    HD3  ARG  24           HD1      ARG  24  -7.683 -10.441  -0.892

  No H/Q in entry =          13
  In of MODEL   25
    1    HA   THR  25           HA       THR  25  -2.362 -12.674   1.045
    2    HB   THR  25           HB       THR  25  -2.122 -13.891   3.344
    3    HG1  THR  25           HG1      THR  25  -3.405 -12.567   4.584
    4   HG21  THR  25          HG21      THR  25  -0.235 -12.903   2.105
    5   HG23  THR  25          HG22      THR  25  -0.071 -12.758   3.855
    6   HG22  THR  25          HG23      THR  25  -0.560 -11.361   2.896
    7    H    THR  25           HN       THR  25  -3.605 -10.689   2.802

  No H/Q in entry =           7
  In of MODEL   25
    1    HA   SER  26           HA       SER  26  -6.820 -13.894   1.645
    2    HB2  SER  26           HB2      SER  26  -5.337 -15.125   3.904
    3    HG   SER  26           HG       SER  26  -6.688 -16.585   1.968
    4    H    SER  26           HN       SER  26  -5.170 -12.161   3.090
    5    HB3  SER  26           HB1      SER  26  -7.051 -15.516   3.774

  No H/Q in entry =           5
  In of MODEL   25
    1    HA   VAL  27           HA       VAL  27  -8.974 -11.781   5.033
    2    HB   VAL  27           HB       VAL  27  -7.116 -12.255   7.362
    3    H    VAL  27           HN       VAL  27  -6.127 -12.505   4.805

  No H/Q in entry =           3
  In of MODEL   25
    1    HA   SER  28           HA       SER  28  -6.351  -8.213   6.643
    2    HB2  SER  28           HB2      SER  28  -4.299  -9.328   7.422
    3    HG   SER  28           HG       SER  28  -3.463  -7.140   5.857
    4    H    SER  28           HN       SER  28  -5.650 -10.842   5.754
    5    HB3  SER  28           HB1      SER  28  -3.668  -9.318   5.776

  No H/Q in entry =           5
  In of MODEL   25
    1    HA   SER  29           HA       SER  29  -6.293  -7.084   2.299
    2    HB2  SER  29           HB2      SER  29  -8.758  -6.221   1.756
    3    HG   SER  29           HG       SER  29  -9.347  -6.709   4.027
    4    H    SER  29           HN       SER  29  -7.713  -7.673   4.777
    5    HB3  SER  29           HB1      SER  29  -8.338  -7.933   1.684

  No H/Q in entry =           5
  In of MODEL   25
    1    HA   HIS  30           HA       HIS  30  -6.072  -2.984   4.001
    2    HB2  HIS  30           HB2      HIS  30  -3.414  -3.610   2.719
    3    HD1  HIS  30           HD1      HIS  30  -2.410  -1.922   5.446
    4    HD2  HIS  30           HD2      HIS  30  -4.471  -5.515   5.120
    5    HE1  HIS  30           HE1      HIS  30  -1.989  -3.137   7.607
    6    HE2  HIS  30           HE2      HIS  30  -3.175  -5.345   7.351
    7    H    HIS  30           HN       HIS  30  -5.026  -5.318   2.647
    8    HB3  HIS  30           HB1      HIS  30  -3.796  -2.025   3.382

  No H/Q in entry =           8
  In of MODEL   25
    1    HA   TYR  31           HA       TYR  31  -6.063  -0.930  -0.036
    2    HB2  TYR  31           HB2      TYR  31  -7.494   0.629   2.107
    3    HD1  TYR  31           HD1      TYR  31  -7.808  -1.389  -1.018
    4    HD2  TYR  31           HD2      TYR  31  -9.574  -0.215   2.670
    5    HE1  TYR  31           HE1      TYR  31  -9.654  -2.967  -1.406
    6    HE2  TYR  31           HE2      TYR  31 -11.424  -1.790   2.293
    7    HH   TYR  31           HH       TYR  31 -12.216  -3.054  -0.534
    8    H    TYR  31           HN       TYR  31  -5.275  -0.822   2.774
    9    HB3  TYR  31           HB1      TYR  31  -7.555   1.114   0.416

  No H/Q in entry =           9
  In of MODEL   25
    1    HA   CYS  32           HA       CYS  32  -2.703   1.853  -0.065
    2    HB2  CYS  32           HB2      CYS  32  -2.967   0.627  -2.447
    3    H    CYS  32           HN       CYS  32  -4.764   0.293  -1.234
    4    HB3  CYS  32           HB1      CYS  32  -3.369   2.273  -2.926

  No H/Q in entry =           4
  In of MODEL   25
    1    HA   THR  33           HA       THR  33  -4.706   5.677   0.151
    2    HB   THR  33           HB       THR  33  -2.847   7.550   0.215
    3    HG1  THR  33           HG1      THR  33  -1.018   6.646  -0.344
    4   HG21  THR  33          HG21      THR  33  -4.085   6.144   2.156
    5   HG23  THR  33          HG22      THR  33  -2.897   7.415   2.446
    6   HG22  THR  33          HG23      THR  33  -2.400   5.723   2.461
    7    H    THR  33           HN       THR  33  -2.340   4.098  -0.200

  No H/Q in entry =           7
  In of MODEL   25
    1    HA3  GLY  34           HA2      GLY  34  -2.419   6.216  -4.466
    2    H    GLY  34           HN       GLY  34  -1.918   6.066  -2.050
    3    HA2  GLY  34           HA1      GLY  34  -3.798   7.210  -4.024

  No H/Q in entry =           3
  In of MODEL   25
    1    HA   ARG  35           HA       ARG  35  -0.834  10.459  -3.769
    2    HB2  ARG  35           HB2      ARG  35  -2.721  11.005  -1.931
    3    HG2  ARG  35           HG2      ARG  35  -0.601  13.061  -2.043
    4    HD2  ARG  35           HD2      ARG  35  -3.539  12.863  -2.112
    5    HE   ARG  35           HE       ARG  35  -2.775  15.357  -3.226
    6   HH11  ARG  35          HH11      ARG  35  -3.448  12.041  -4.083
    7   HH12  ARG  35          HH12      ARG  35  -3.935  12.427  -5.699
    8   HH21  ARG  35          HH21      ARG  35  -3.416  15.866  -5.351
    9   HH22  ARG  35          HH22      ARG  35  -3.917  14.598  -6.420
   10    H    ARG  35           HN       ARG  35  -2.186   8.605  -1.942
   11    HB3  ARG  35           HB1      ARG  35  -1.287  11.204  -0.934
   12    HG3  ARG  35           HG1      ARG  35  -1.299  12.539  -3.577
   13    HD3  ARG  35           HD1      ARG  35  -2.501  14.076  -1.365

  No H/Q in entry =          13
  In of MODEL   25
    1    HA   SER  36           HA       SER  36   2.544   9.081  -1.092
    2    HB2  SER  36           HB2      SER  36   2.520   8.482   1.423
    3    HG   SER  36           HG       SER  36   0.628   8.529   2.435
    4    H    SER  36           HN       SER  36  -0.328   8.440  -0.964
    5    HB3  SER  36           HB1      SER  36   1.900  10.062   0.945

  No H/Q in entry =           5
  In of MODEL   25
    1    HA   CYS  37           HA       CYS  37   2.841   4.711  -0.888
    2    HB2  CYS  37           HB2      CYS  37   5.053   5.776  -1.734
    3    H    CYS  37           HN       CYS  37   3.843   7.297   0.087
    4    HB3  CYS  37           HB1      CYS  37   5.709   5.257  -0.186

  No H/Q in entry =           4
  In of MODEL   25
    1    HA   GLU  38           HA       GLU  38   3.752   4.307   3.645
    2    HB2  GLU  38           HB2      GLU  38   2.079   6.765   3.908
    3    HG2  GLU  38           HG2      GLU  38   4.750   5.848   4.846
    4    H    GLU  38           HN       GLU  38   2.436   6.124   1.803
    5    HB3  GLU  38           HB1      GLU  38   2.169   5.664   5.276
    6    HG3  GLU  38           HG1      GLU  38   4.287   7.356   4.057

  No H/Q in entry =           6
  In of MODEL   25
    1    HA   CYS  39           HA       CYS  39  -0.031   2.129   4.229
    2    HB2  CYS  39           HB2      CYS  39   2.212   0.405   3.325
    3    H    CYS  39           HN       CYS  39   2.868   2.540   4.523
    4    HB3  CYS  39           HB1      CYS  39   0.832  -0.409   4.055

  No H/Q in entry =           4
  In of MODEL   25
    1    HA   PRO  40           HA       PRO  40   1.076   1.575   8.659
    2    HB2  PRO  40           HB2      PRO  40  -1.319   2.445   9.602
    3    HG2  PRO  40           HG2      PRO  40  -2.419   2.786   7.585
    4    HD2  PRO  40           HD2      PRO  40  -1.284   2.904   5.582
    5    HB3  PRO  40           HB1      PRO  40   0.002   3.539   9.178
    6    HG3  PRO  40           HG1      PRO  40  -1.680   4.383   7.811
    7    HD3  PRO  40           HD1      PRO  40  -0.039   3.985   6.240

  No H/Q in entry =           7
  In of MODEL   25
    1    HA   SER  41           HA       SER  41  -1.388  -1.974   9.242
    2    HB2  SER  41           HB2      SER  41  -1.021  -1.617  12.192
    3    HG   SER  41           HG       SER  41   1.037  -1.335  11.982
    4    H    SER  41           HN       SER  41  -0.310   0.468  10.424
    5    HB3  SER  41           HB1      SER  41  -0.827  -3.067  11.207

  No H/Q in entry =           5
  In of MODEL   25
    1    HA   TYR  42           HA       TYR  42  -5.227  -0.426  10.858
    2    HB2  TYR  42           HB2      TYR  42  -4.301   2.128   9.650
    3    HD1  TYR  42           HD1      TYR  42  -3.205   3.228  11.344
    4    HD2  TYR  42           HD2      TYR  42  -6.609   0.868  12.315
    5    HE1  TYR  42           HE1      TYR  42  -2.972   3.875  13.705
    6    HE2  TYR  42           HE2      TYR  42  -6.386   1.508  14.679
    7    HH   TYR  42           HH       TYR  42  -5.385   3.397  15.989
    8    H    TYR  42           HN       TYR  42  -3.088   0.141   8.910
    9    HB3  TYR  42           HB1      TYR  42  -6.036   1.930   9.870

  No H/Q in entry =           9
  In of MODEL   25
    1    HA   PRO  43           HA       PRO  43  -6.659  -1.916   6.717
    2    HB2  PRO  43           HB2      PRO  43  -7.966  -4.091   7.680
    3    HG2  PRO  43           HG2      PRO  43  -7.606  -3.778   9.952
    4    HD2  PRO  43           HD2      PRO  43  -5.999  -2.326  10.742
    5    HB3  PRO  43           HB1      PRO  43  -6.239  -4.097   7.308
    6    HG3  PRO  43           HG1      PRO  43  -6.178  -4.746   9.541
    7    HD3  PRO  43           HD1      PRO  43  -4.767  -2.924   9.613

  No H/Q in entry =           7
  In of MODEL   25
    1    HA3  GLY  44           HA2      GLY  44 -10.044   1.065   6.743
    2    H    GLY  44           HN       GLY  44  -8.003   0.017   6.776
    3    HA2  GLY  44           HA1      GLY  44 -10.746  -0.546   6.767

  No H/Q in entry =           3
  In of MODEL   25
    1    HA   ASN  45           HA       ASN  45  -9.043   1.120  11.511
    2    HB2  ASN  45           HB2      ASN  45 -11.483   2.140  10.183
    3   HD21  ASN  45          HD21      ASN  45  -8.949   3.003   9.882
    4   HD22  ASN  45          HD22      ASN  45  -8.712   4.490  10.730
    5    H    ASN  45           HN       ASN  45  -8.677   0.663   9.315
    6    HB3  ASN  45           HB1      ASN  45 -11.616   1.860  11.917

  No H/Q in entry =           6
  In of MODEL   25
    1    HA3  GLY  46           HA2      GLY  46 -13.132  -2.218  11.156
    2    H    GLY  46           HN       GLY  46 -12.332   0.001  10.777
    3    HA2  GLY  46           HA1      GLY  46 -11.769  -2.491  12.230

  No H/Q in entry =           3
  In of MODEL   26
    1    H1   ALA   1           HT1      ALA   1   6.044  14.467  -3.678
    2    H2   ALA   1           HT3      ALA   1   5.151  13.075  -4.127
    3    H3   ALA   1           HT2      ALA   1   4.626  14.042  -2.810
    4    HA   ALA   1           HA       ALA   1   6.320  13.378  -1.461
    5    HB1  ALA   1           HB1      ALA   1   4.929  11.588  -1.328
    6    HB3  ALA   1           HB2      ALA   1   6.352  10.771  -1.975
    7    HB2  ALA   1           HB3      ALA   1   5.035  11.234  -3.053

  No H/Q in entry =           7
  In of MODEL   26
    1    HA   MET   2           HA       MET   2  10.116  13.263  -3.669
    2    HB2  MET   2           HB2      MET   2  10.290  14.869  -1.516
    3    H    MET   2           HN       MET   2   8.443  13.632  -1.374
    4    HG2  MET   2           HG2      MET   2  12.949  14.077  -2.490
    5    HE2  MET   2           HE1      MET   2  10.716  17.408  -3.676
    6    HB3  MET   2           HB1      MET   2  11.349  13.568  -0.991
    7    HE1  MET   2           HE2      MET   2  11.880  16.490  -4.632
    8    HE3  MET   2           HE3      MET   2  12.324  18.067  -3.979
    9    HG3  MET   2           HG1      MET   2  11.789  14.557  -3.728

  No H/Q in entry =           9
  In of MODEL   26
    1    HA   ASP   3           HA       ASP   3  13.527  10.211  -2.671
    2    HB2  ASP   3           HB2      ASP   3  12.306  10.578  -0.324
    3    H    ASP   3           HN       ASP   3  12.417  12.180  -2.917
    4    HB3  ASP   3           HB1      ASP   3  11.476   9.106  -0.818

  No H/Q in entry =           4
  In of MODEL   26
    1    HA   CYS   4           HA       CYS   4  11.774   7.279  -5.283
    2    HB2  CYS   4           HB2      CYS   4  13.947   6.204  -4.920
    3    H    CYS   4           HN       CYS   4  13.378   7.838  -3.028
    4    HB3  CYS   4           HB1      CYS   4  13.314   5.382  -3.498

  No H/Q in entry =           4
  In of MODEL   26
    1    HA   THR   5           HA       THR   5   9.631   5.882  -0.638
    2    HB   THR   5           HB       THR   5   7.729   5.992  -2.915
    3    HG1  THR   5           HG1      THR   5   8.627   7.815  -3.519
    4   HG21  THR   5          HG21      THR   5   7.419   5.937  -0.217
    5   HG23  THR   5          HG22      THR   5   6.214   6.517  -1.368
    6   HG22  THR   5          HG23      THR   5   7.287   7.662  -0.562
    7    H    THR   5           HN       THR   5  11.372   6.676  -1.866

  No H/Q in entry =           7
  In of MODEL   26
    1    HA   THR   6           HA       THR   6   9.680   1.818  -2.552
    2    HB   THR   6           HB       THR   6  11.633   1.055  -0.448
    3    HG1  THR   6           HG1      THR   6  12.709   2.831  -0.975
    4   HG23  THR   6          HG21      THR   6  12.017  -0.639  -1.808
    5   HG22  THR   6          HG22      THR   6  12.418   0.459  -3.129
    6   HG21  THR   6          HG23      THR   6  10.745  -0.034  -2.869
    7    H    THR   6           HN       THR   6  10.803   3.817  -0.756

  No H/Q in entry =           7
  In of MODEL   26
    1    HA3  GLY   7           HA2      GLY   7   8.178  -0.887   0.757
    2    H    GLY   7           HN       GLY   7   8.652  -0.081  -1.846
    3    HA2  GLY   7           HA1      GLY   7   6.913   0.274   0.382

  No H/Q in entry =           3
  In of MODEL   26
    1    HA   PRO   8           HA       PRO   8   6.123  -4.273  -1.146
    2    HB2  PRO   8           HB2      PRO   8   3.975  -4.004   0.898
    3    HG2  PRO   8           HG2      PRO   8   5.431  -4.057   2.712
    4    HD2  PRO   8           HD2      PRO   8   5.769  -1.897   1.969
    5    HB3  PRO   8           HB1      PRO   8   4.954  -5.413   0.472
    6    HG3  PRO   8           HG1      PRO   8   6.764  -4.703   1.737
    7    HD3  PRO   8           HD1      PRO   8   7.431  -2.495   1.786

  No H/Q in entry =           7
  In of MODEL   26
    1    HA   CYS   9           HA       CYS   9   1.989  -2.082  -1.977
    2    HB2  CYS   9           HB2      CYS   9   1.947  -0.428  -0.111
    3    H    CYS   9           HN       CYS   9   4.260  -1.405  -0.391
    4    HB3  CYS   9           HB1      CYS   9   2.915   0.660  -1.099

  No H/Q in entry =           4
  In of MODEL   26
    1    HA   CYS  10           HA       CYS  10   3.886   0.964  -5.121
    2    HB2  CYS  10           HB2      CYS  10   6.682   1.050  -3.986
    3    H    CYS  10           HN       CYS  10   4.557   0.344  -2.480
    4    HB3  CYS  10           HB1      CYS  10   6.012   2.051  -5.270

  No H/Q in entry =           4
  In of MODEL   26
    1    HA   ARG  11           HA       ARG  11   5.743  -2.421  -7.145
    2    HB2  ARG  11           HB2      ARG  11   3.834  -1.815  -8.563
    3    HG2  ARG  11           HG2      ARG  11   5.939  -2.193 -10.608
    4    HD2  ARG  11           HD2      ARG  11   3.234  -3.244  -9.954
    5    HE   ARG  11           HE       ARG  11   3.970  -5.340 -10.510
    6   HH11  ARG  11          HH11      ARG  11   5.452  -3.011 -12.645
    7   HH12  ARG  11          HH12      ARG  11   6.128  -4.213 -13.691
    8   HH21  ARG  11          HH21      ARG  11   4.859  -6.923 -11.886
    9   HH22  ARG  11          HH22      ARG  11   5.791  -6.434 -13.261
   10    H    ARG  11           HN       ARG  11   4.884   0.378  -7.110
   11    HB3  ARG  11           HB1      ARG  11   4.824  -0.625  -9.398
   12    HG3  ARG  11           HG1      ARG  11   5.794  -3.425  -9.353
   13    HD3  ARG  11           HD1      ARG  11   3.868  -2.638 -11.483

  No H/Q in entry =          13
  In of MODEL   26
    1    HA   GLN  12           HA       GLN  12   9.371  -0.340  -8.935
    2    HB2  GLN  12           HB2      GLN  12   7.774   0.424 -11.357
    3    HG2  GLN  12           HG2      GLN  12   8.338  -1.978 -10.796
    4   HE21  GLN  12          HE21      GLN  12  10.224  -3.263 -12.355
    5   HE22  GLN  12          HE22      GLN  12  11.777  -3.097 -11.615
    6    H    GLN  12           HN       GLN  12   6.527   0.391  -9.190
    7    HB3  GLN  12           HB1      GLN  12   9.502   0.742 -11.303
    8    HG3  GLN  12           HG1      GLN  12   8.779  -1.408 -12.406

  No H/Q in entry =           8
  In of MODEL   26
    1    HA   CYS  13           HA       CYS  13   9.604   3.269  -6.193
    2    HB2  CYS  13           HB2      CYS  13  11.473   3.062  -7.944
    3    H    CYS  13           HN       CYS  13   9.153   1.238  -7.111
    4    HB3  CYS  13           HB1      CYS  13  10.523   4.183  -8.912

  No H/Q in entry =           4
  In of MODEL   26
    1    HA   LYS  14           HA       LYS  14   6.173   5.574  -7.745
    2    HB2  LYS  14           HB2      LYS  14   6.186   3.879  -9.835
    3    HG2  LYS  14           HG2      LYS  14   3.733   5.510  -9.753
    4    HD2  LYS  14           HD2      LYS  14   5.285   6.463 -11.747
    5    HE2  LYS  14           HE2      LYS  14   3.778   3.874 -12.014
    6    HZ1  LYS  14           HZ1      LYS  14   4.995   5.151 -13.929
    7    HZ3  LYS  14           HZ2      LYS  14   3.606   6.115 -13.890
    8    HZ2  LYS  14           HZ3      LYS  14   3.473   4.454 -14.180
    9    H    LYS  14           HN       LYS  14   6.991   2.776  -7.376
   10    HB3  LYS  14           HB1      LYS  14   4.600   3.505  -9.175
   11    HG3  LYS  14           HG1      LYS  14   5.254   6.367  -9.494
   12    HD3  LYS  14           HD1      LYS  14   5.914   4.821 -11.609
   13    HE3  LYS  14           HE1      LYS  14   2.976   5.433 -11.822

  No H/Q in entry =          13
  In of MODEL   26
    1    HA   LEU  15           HA       LEU  15   3.530   4.413  -4.485
    2    HB2  LEU  15           HB2      LEU  15   3.120   7.279  -5.194
    3    HG   LEU  15           HG       LEU  15   4.872   6.403  -3.508
    4   HD11  LEU  15          HD11      LEU  15   2.954   8.656  -3.132
    5   HD13  LEU  15          HD12      LEU  15   4.662   8.693  -3.569
    6   HD12  LEU  15          HD13      LEU  15   4.184   8.343  -1.908
    7   HD21  LEU  15          HD21      LEU  15   2.328   6.118  -1.923
    8   HD23  LEU  15          HD22      LEU  15   3.930   6.234  -1.195
    9   HD22  LEU  15          HD23      LEU  15   3.538   4.879  -2.253
   10    H    LEU  15           HN       LEU  15   4.567   6.192  -6.444
   11    HB3  LEU  15           HB1      LEU  15   1.941   6.505  -4.153

  No H/Q in entry =          11
  In of MODEL   26
    1    HA   LYS  16           HA       LYS  16   0.174   2.967  -6.855
    2    HB2  LYS  16           HB2      LYS  16  -0.162   1.776  -4.098
    3    HG2  LYS  16           HG2      LYS  16   1.788   1.120  -5.739
    4    HD2  LYS  16           HD2      LYS  16  -0.051  -0.989  -6.641
    5    HE2  LYS  16           HE2      LYS  16   1.882   0.593  -8.293
    6    HZ1  LYS  16           HZ1      LYS  16   0.371  -1.288  -9.137
    7    HZ3  LYS  16           HZ2      LYS  16   1.449  -2.321  -8.343
    8    HZ2  LYS  16           HZ3      LYS  16   2.006  -1.306  -9.575
    9    H    LYS  16           HN       LYS  16   1.728   3.224  -4.475
   10    HB3  LYS  16           HB1      LYS  16  -1.165   1.352  -5.479
   11    HG3  LYS  16           HG1      LYS  16   0.914  -0.097  -4.808
   12    HD3  LYS  16           HD1      LYS  16  -0.275   0.582  -7.412
   13    HE3  LYS  16           HE1      LYS  16   2.453  -0.628  -7.156

  No H/Q in entry =          13
  In of MODEL   26
    1    HA   PRO  17           HA       PRO  17  -3.079   5.888  -6.351
    2    HB2  PRO  17           HB2      PRO  17  -4.935   3.614  -6.873
    3    HG2  PRO  17           HG2      PRO  17  -3.902   2.997  -8.866
    4    HD2  PRO  17           HD2      PRO  17  -2.393   2.143  -7.344
    5    HB3  PRO  17           HB1      PRO  17  -4.829   5.187  -7.672
    6    HG3  PRO  17           HG1      PRO  17  -3.040   4.541  -9.000
    7    HD3  PRO  17           HD1      PRO  17  -1.302   3.273  -8.172

  No H/Q in entry =           7
  In of MODEL   26
    1    HA   ALA  18           HA       ALA  18  -4.272   5.319  -2.203
    2    HB3  ALA  18           HB1      ALA  18  -6.098   7.581  -2.987
    3    HB1  ALA  18           HB2      ALA  18  -4.397   7.800  -2.577
    4    HB2  ALA  18           HB3      ALA  18  -5.519   7.165  -1.374
    5    H    ALA  18           HN       ALA  18  -4.223   6.650  -4.665

  No H/Q in entry =           5
  In of MODEL   26
    1    HA3  GLY  19           HA2      GLY  19  -7.679   2.744  -1.614
    2    H    GLY  19           HN       GLY  19  -5.221   3.285  -2.424
    3    HA2  GLY  19           HA1      GLY  19  -8.006   3.141  -3.294

  No H/Q in entry =           3
  In of MODEL   26
    1    HA   THR  20           HA       THR  20  -6.271  -0.578  -4.811
    2    HB   THR  20           HB       THR  20  -3.400   0.360  -4.731
    3    HG1  THR  20           HG1      THR  20  -5.392   0.767  -6.705
    4   HG22  THR  20          HG21      THR  20  -3.223  -1.058  -6.780
    5   HG21  THR  20          HG22      THR  20  -4.815  -1.708  -6.386
    6   HG23  THR  20          HG23      THR  20  -3.467  -1.944  -5.274
    7    H    THR  20           HN       THR  20  -5.398   1.997  -4.143

  No H/Q in entry =           7
  In of MODEL   26
    1    HA   THR  21           HA       THR  21  -4.693  -2.765  -1.378
    2    HB   THR  21           HB       THR  21  -4.970  -5.297  -1.871
    3    HG1  THR  21           HG1      THR  21  -4.880  -5.300  -4.077
    4   HG21  THR  21          HG21      THR  21  -7.330  -3.472  -2.259
    5   HG23  THR  21          HG22      THR  21  -6.684  -4.017  -0.711
    6   HG22  THR  21          HG23      THR  21  -7.394  -5.181  -1.829
    7    H    THR  21           HN       THR  21  -5.140  -2.628  -4.273

  No H/Q in entry =           7
  In of MODEL   26
    1    HA   CYS  22           HA       CYS  22  -0.652  -4.130  -2.391
    2    HB2  CYS  22           HB2      CYS  22   0.890  -3.336  -0.678
    3    H    CYS  22           HN       CYS  22  -2.829  -3.519  -0.507
    4    HB3  CYS  22           HB1      CYS  22  -0.317  -2.103  -1.023

  No H/Q in entry =           4
  In of MODEL   26
    1    HA   TRP  23           HA       TRP  23  -0.485  -7.501   0.738
    2    HB2  TRP  23           HB2      TRP  23  -1.132  -5.883   2.761
    3    HD1  TRP  23           HD1      TRP  23   1.041  -8.141   1.996
    4    HE1  TRP  23           HE1      TRP  23   1.790  -9.793   3.822
    5    HE3  TRP  23           HE3      TRP  23  -2.931  -7.687   5.183
    6    HZ2  TRP  23           HZ2      TRP  23   0.826 -10.774   6.287
    7    HZ3  TRP  23           HZ3      TRP  23  -2.941  -9.018   7.253
    8    HH2  TRP  23           HH2      TRP  23  -1.101 -10.529   7.791
    9    H    TRP  23           HN       TRP  23  -2.139  -5.088   0.667
   10    HB3  TRP  23           HB1      TRP  23  -2.528  -6.954   2.835

  No H/Q in entry =          10
  In of MODEL   26
    1    HA   ARG  24           HA       ARG  24  -4.128  -9.862  -0.004
    2    HB2  ARG  24           HB2      ARG  24  -3.104  -9.262  -2.261
    3    HG2  ARG  24           HG2      ARG  24  -4.134 -12.018  -2.549
    4    HD2  ARG  24           HD2      ARG  24  -4.716  -9.320  -3.740
    5    HE   ARG  24           HE       ARG  24  -6.118 -11.457  -4.972
    6   HH11  ARG  24          HH11      ARG  24  -6.281  -9.232  -2.288
    7   HH12  ARG  24          HH12      ARG  24  -8.010  -9.264  -2.205
    8   HH21  ARG  24          HH21      ARG  24  -8.393 -11.500  -4.864
    9   HH22  ARG  24          HH22      ARG  24  -9.209 -10.551  -3.667
   10    H    ARG  24           HN       ARG  24  -1.228  -9.431   0.137
   11    HB3  ARG  24           HB1      ARG  24  -2.257 -10.800  -2.173
   12    HG3  ARG  24           HG1      ARG  24  -5.189 -10.842  -1.762
   13    HD3  ARG  24           HD1      ARG  24  -4.008 -10.731  -4.526

  No H/Q in entry =          13
  In of MODEL   26
    1    HA   THR  25           HA       THR  25  -3.341 -14.066   0.939
    2    HB   THR  25           HB       THR  25  -2.762 -14.026   3.540
    3    HG1  THR  25           HG1      THR  25  -3.371 -11.741   3.606
    4   HG22  THR  25          HG21      THR  25  -0.696 -12.706   1.874
    5   HG21  THR  25          HG22      THR  25  -1.242 -14.319   1.414
    6   HG23  THR  25          HG23      THR  25  -0.553 -14.043   3.014
    7    H    THR  25           HN       THR  25  -4.603 -11.537   1.240

  No H/Q in entry =           7
  In of MODEL   26
    1    HA   SER  26           HA       SER  26  -6.965 -15.069   3.162
    2    HB2  SER  26           HB2      SER  26  -6.280 -17.229   2.264
    3    HG   SER  26           HG       SER  26  -7.239 -18.580   3.975
    4    H    SER  26           HN       SER  26  -4.074 -15.501   2.982
    5    HB3  SER  26           HB1      SER  26  -5.297 -17.539   3.695

  No H/Q in entry =           5
  In of MODEL   26
    1    HA   VAL  27           HA       VAL  27  -5.757 -14.636   7.478
    2    HB   VAL  27           HB       VAL  27  -3.344 -14.371   7.076
    3    H    VAL  27           HN       VAL  27  -5.091 -13.576   4.812

  No H/Q in entry =           3
  In of MODEL   26
    1    HA   SER  28           HA       SER  28  -8.189 -10.777   6.622
    2    HB2  SER  28           HB2      SER  28  -6.588 -10.212   8.423
    3    HG   SER  28           HG       SER  28  -7.532  -8.343   8.696
    4    H    SER  28           HN       SER  28  -5.916 -11.843   5.370
    5    HB3  SER  28           HB1      SER  28  -5.632  -9.288   7.266

  No H/Q in entry =           5
  In of MODEL   26
    1    HA   SER  29           HA       SER  29  -7.125  -7.943   3.262
    2    HB2  SER  29           HB2      SER  29  -9.548  -8.619   3.295
    3    HG   SER  29           HG       SER  29  -8.530  -7.218   1.635
    4    H    SER  29           HN       SER  29  -8.070  -8.132   6.032
    5    HB3  SER  29           HB1      SER  29  -9.903  -7.094   4.106

  No H/Q in entry =           5
  In of MODEL   26
    1    HA   HIS  30           HA       HIS  30  -6.701  -3.762   4.565
    2    HB2  HIS  30           HB2      HIS  30  -4.043  -5.034   4.023
    3    HD1  HIS  30           HD1      HIS  30  -2.618  -5.064   6.269
    4    HD2  HIS  30           HD2      HIS  30  -6.617  -4.019   6.686
    5    HE1  HIS  30           HE1      HIS  30  -3.120  -5.294   8.722
    6    HE2  HIS  30           HE2      HIS  30  -5.568  -4.738   8.938
    7    H    HIS  30           HN       HIS  30  -6.088  -6.098   2.886
    8    HB3  HIS  30           HB1      HIS  30  -4.134  -3.295   4.284

  No H/Q in entry =           8
  In of MODEL   26
    1    HA   TYR  31           HA       TYR  31  -5.431  -1.823   0.679
    2    HB2  TYR  31           HB2      TYR  31  -7.314   0.027   2.160
    3    HD1  TYR  31           HD1      TYR  31  -8.928  -1.380   3.126
    4    HD2  TYR  31           HD2      TYR  31  -7.684  -2.063  -0.885
    5    HE1  TYR  31           HE1      TYR  31 -10.738  -3.021   2.850
    6    HE2  TYR  31           HE2      TYR  31  -9.491  -3.706  -1.172
    7    HH   TYR  31           HH       TYR  31 -10.860  -5.244   0.470
    8    H    TYR  31           HN       TYR  31  -5.548  -1.750   3.589
    9    HB3  TYR  31           HB1      TYR  31  -7.029   0.014   0.422

  No H/Q in entry =           9
  In of MODEL   26
    1    HA   CYS  32           HA       CYS  32  -2.236   0.969   1.552
    2    HB2  CYS  32           HB2      CYS  32  -2.105   0.152  -1.012
    3    H    CYS  32           HN       CYS  32  -4.070  -0.326  -0.179
    4    HB3  CYS  32           HB1      CYS  32  -2.406   1.868  -1.269

  No H/Q in entry =           4
  In of MODEL   26
    1    HA   THR  33           HA       THR  33  -4.497   4.595   2.346
    2    HB   THR  33           HB       THR  33  -3.176   6.214   3.556
    3    HG1  THR  33           HG1      THR  33  -1.048   6.318   3.434
    4   HG23  THR  33          HG21      THR  33  -3.186   4.909   5.332
    5   HG22  THR  33          HG22      THR  33  -1.683   4.162   4.791
    6   HG21  THR  33          HG23      THR  33  -3.233   3.480   4.300
    7    H    THR  33           HN       THR  33  -2.217   2.968   2.374

  No H/Q in entry =           7
  In of MODEL   26
    1    HA3  GLY  34           HA2      GLY  34  -1.484   5.537  -1.789
    2    H    GLY  34           HN       GLY  34  -1.546   4.688   0.424
    3    HA2  GLY  34           HA1      GLY  34  -2.886   6.529  -1.420

  No H/Q in entry =           3
  In of MODEL   26
    1    HA   ARG  35           HA       ARG  35  -0.335   9.738   0.081
    2    HB2  ARG  35           HB2      ARG  35  -1.812   9.649   2.146
    3    HG2  ARG  35           HG2      ARG  35   0.715  10.833   3.096
    4    HD2  ARG  35           HD2      ARG  35  -2.167  11.462   2.991
    5    HE   ARG  35           HE       ARG  35  -0.315  13.479   2.263
    6   HH11  ARG  35          HH11      ARG  35  -3.097  12.902   4.290
    7   HH12  ARG  35          HH12      ARG  35  -3.610  14.556   4.271
    8   HH21  ARG  35          HH21      ARG  35  -0.988  15.655   2.237
    9   HH22  ARG  35          HH22      ARG  35  -2.413  16.119   3.105
   10    H    ARG  35           HN       ARG  35  -1.668   7.443   1.127
   11    HB3  ARG  35           HB1      ARG  35  -0.453   8.903   2.977
   12    HG3  ARG  35           HG1      ARG  35   0.101  11.429   1.552
   13    HD3  ARG  35           HD1      ARG  35  -0.994  11.727   4.280

  No H/Q in entry =          13
  In of MODEL   26
    1    HA   SER  36           HA       SER  36   3.473   7.472   0.976
    2    HB2  SER  36           HB2      SER  36   2.828   7.701   3.471
    3    HG   SER  36           HG       SER  36   4.839   6.536   4.043
    4    H    SER  36           HN       SER  36   0.692   6.740   1.553
    5    HB3  SER  36           HB1      SER  36   2.787   5.938   3.474

  No H/Q in entry =           5
  In of MODEL   26
    1    HA   CYS  37           HA       CYS  37   3.783   3.496  -0.652
    2    HB2  CYS  37           HB2      CYS  37   6.198   4.412  -0.655
    3    H    CYS  37           HN       CYS  37   4.920   5.520   1.002
    4    HB3  CYS  37           HB1      CYS  37   6.476   3.295   0.676

  No H/Q in entry =           4
  In of MODEL   26
    1    HA   GLU  38           HA       GLU  38   4.530   1.054   3.443
    2    HB2  GLU  38           HB2      GLU  38   5.048   3.257   4.821
    3    HG2  GLU  38           HG2      GLU  38   3.786   1.222   6.548
    4    H    GLU  38           HN       GLU  38   4.533   3.768   2.744
    5    HB3  GLU  38           HB1      GLU  38   3.370   3.071   5.312
    6    HG3  GLU  38           HG1      GLU  38   5.091   0.676   5.496

  No H/Q in entry =           6
  In of MODEL   26
    1    HA   CYS  39           HA       CYS  39   0.124   0.640   3.829
    2    HB2  CYS  39           HB2      CYS  39   1.623  -1.891   3.456
    3    H    CYS  39           HN       CYS  39   2.841  -0.074   4.708
    4    HB3  CYS  39           HB1      CYS  39  -0.062  -2.049   3.938

  No H/Q in entry =           4
  In of MODEL   26
    1    HA   PRO  40           HA       PRO  40   0.079   0.213   8.408
    2    HB2  PRO  40           HB2      PRO  40  -1.916   2.020   8.784
    3    HG2  PRO  40           HG2      PRO  40  -2.397   2.519   6.568
    4    HD2  PRO  40           HD2      PRO  40  -0.955   1.973   4.854
    5    HB3  PRO  40           HB1      PRO  40  -0.218   2.481   8.620
    6    HG3  PRO  40           HG1      PRO  40  -1.148   3.735   6.896
    7    HD3  PRO  40           HD1      PRO  40   0.468   2.573   5.730

  No H/Q in entry =           7
  In of MODEL   26
    1    HA   SER  41           HA       SER  41  -3.587  -2.146   8.460
    2    HB2  SER  41           HB2      SER  41  -3.778  -3.396  10.492
    3    HG   SER  41           HG       SER  41  -2.298  -1.311  11.725
    4    H    SER  41           HN       SER  41  -1.648  -0.469   9.860
    5    HB3  SER  41           HB1      SER  41  -2.060  -3.075  10.254

  No H/Q in entry =           5
  In of MODEL   26
    1    HA   TYR  42           HA       TYR  42  -6.448   0.792  10.230
    2    HB2  TYR  42           HB2      TYR  42  -4.471   2.577   9.846
    3    HD1  TYR  42           HD1      TYR  42  -4.816   3.085  12.119
    4    HD2  TYR  42           HD2      TYR  42  -7.951   3.744   9.318
    5    HE1  TYR  42           HE1      TYR  42  -6.092   4.293  13.839
    6    HE2  TYR  42           HE2      TYR  42  -9.235   4.955  11.031
    7    HH   TYR  42           HH       TYR  42  -8.920   4.744  14.057
    8    H    TYR  42           HN       TYR  42  -4.252   0.494   8.288
    9    HB3  TYR  42           HB1      TYR  42  -5.598   3.131   8.613

  No H/Q in entry =           9
  In of MODEL   26
    1    HA   PRO  43           HA       PRO  43  -8.551  -0.381   6.284
    2    HB2  PRO  43           HB2      PRO  43 -10.724  -0.573   8.317
    3    HG2  PRO  43           HG2      PRO  43  -9.674  -2.256   9.535
    4    HD2  PRO  43           HD2      PRO  43  -8.437  -0.433  10.216
    5    HB3  PRO  43           HB1      PRO  43 -10.301  -1.688   7.012
    6    HG3  PRO  43           HG1      PRO  43  -8.558  -2.639   8.211
    7    HD3  PRO  43           HD1      PRO  43  -7.118  -1.368   9.484

  No H/Q in entry =           7
  In of MODEL   26
    1    HA3  GLY  44           HA2      GLY  44 -12.451   2.089   5.343
    2    H    GLY  44           HN       GLY  44 -10.936   0.363   5.657
    3    HA2  GLY  44           HA1      GLY  44 -11.686   2.957   6.665

  No H/Q in entry =           3
  In of MODEL   26
    1    HA   ASN  45           HA       ASN  45  -8.631   2.775   2.344
    2    HB2  ASN  45           HB2      ASN  45 -11.099   3.548   1.841
    3   HD21  ASN  45          HD21      ASN  45 -11.425   4.693  -0.194
    4   HD22  ASN  45          HD22      ASN  45 -10.111   4.790  -1.311
    5    H    ASN  45           HN       ASN  45  -9.849   1.740   3.961
    6    HB3  ASN  45           HB1      ASN  45 -10.491   5.119   2.353

  No H/Q in entry =           6
  In of MODEL   26
    1    HA3  GLY  46           HA2      GLY  46  -5.232   4.810   4.193
    2    H    GLY  46           HN       GLY  46  -6.919   3.124   3.862
    3    HA2  GLY  46           HA1      GLY  46  -6.516   5.988   4.420

  No H/Q in entry =           3
  In of MODEL   27
    1    H1   ALA   1           HT2      ALA   1  21.028   7.564  -2.223
    2    H2   ALA   1           HT1      ALA   1  20.338   6.755  -3.570
    3    H3   ALA   1           HT3      ALA   1  21.852   7.542  -3.729
    4    HA   ALA   1           HA       ALA   1  20.922   9.630  -3.534
    5    HB3  ALA   1           HB1      ALA   1  18.801   8.420  -5.198
    6    HB1  ALA   1           HB2      ALA   1  20.466   8.044  -5.641
    7    HB2  ALA   1           HB3      ALA   1  19.931   9.723  -5.566

  No H/Q in entry =           7
  In of MODEL   27
    1    HA   MET   2           HA       MET   2  16.578   7.133  -1.672
    2    HB2  MET   2           HB2      MET   2  18.331   8.082  -0.015
    3    H    MET   2           HN       MET   2  18.478   7.135  -2.921
    4    HG2  MET   2           HG2      MET   2  15.755   7.378   0.364
    5    HE3  MET   2           HE1      MET   2  14.484  10.130   3.306
    6    HB3  MET   2           HB1      MET   2  17.535   9.624  -0.291
    7    HE2  MET   2           HE2      MET   2  16.244  10.033   3.241
    8    HE1  MET   2           HE3      MET   2  15.280   8.557   3.274
    9    HG3  MET   2           HG1      MET   2  16.851   7.888   1.647

  No H/Q in entry =           9
  In of MODEL   27
    1    HA   ASP   3           HA       ASP   3  13.899  10.184  -3.201
    2    HB2  ASP   3           HB2      ASP   3  15.595   9.483  -5.546
    3    H    ASP   3           HN       ASP   3  15.280   7.648  -3.482
    4    HB3  ASP   3           HB1      ASP   3  14.056  10.277  -5.866

  No H/Q in entry =           4
  In of MODEL   27
    1    HA   CYS   4           HA       CYS   4  10.072   9.362  -5.605
    2    HB2  CYS   4           HB2      CYS   4  11.689   8.147  -7.128
    3    H    CYS   4           HN       CYS   4  12.037  10.255  -4.891
    4    HB3  CYS   4           HB1      CYS   4  11.601   6.789  -6.011

  No H/Q in entry =           4
  In of MODEL   27
    1    HA   THR   5           HA       THR   5   8.551   7.065  -2.249
    2    HB   THR   5           HB       THR   5   6.145   6.895  -2.292
    3    HG1  THR   5           HG1      THR   5   6.297   7.368  -5.082
    4   HG22  THR   5          HG21      THR   5   5.785   9.190  -3.772
    5   HG21  THR   5          HG22      THR   5   7.459   9.296  -3.225
    6   HG23  THR   5          HG23      THR   5   6.158   9.097  -2.051
    7    H    THR   5           HN       THR   5   8.349   7.860  -5.042

  No H/Q in entry =           7
  In of MODEL   27
    1    HA   THR   6           HA       THR   6   8.068   2.850  -3.435
    2    HB   THR   6           HB       THR   6  10.051   1.644  -2.270
    3    HG1  THR   6           HG1      THR   6  10.812   4.344  -1.867
    4   HG23  THR   6          HG21      THR   6  11.379   2.065  -4.041
    5   HG22  THR   6          HG22      THR   6  11.153   3.811  -3.940
    6   HG21  THR   6          HG23      THR   6   9.902   2.800  -4.664
    7    H    THR   6           HN       THR   6   8.664   5.024  -1.548

  No H/Q in entry =           7
  In of MODEL   27
    1    HA3  GLY   7           HA2      GLY   7   7.433   0.237   0.283
    2    H    GLY   7           HN       GLY   7   7.638   0.776  -2.397
    3    HA2  GLY   7           HA1      GLY   7   5.957   1.111  -0.099

  No H/Q in entry =           3
  In of MODEL   27
    1    HA   PRO   8           HA       PRO   8   5.454  -3.481  -1.019
    2    HB2  PRO   8           HB2      PRO   8   3.365  -3.924   0.656
    3    HG2  PRO   8           HG2      PRO   8   3.153  -1.802   1.573
    4    HD2  PRO   8           HD2      PRO   8   4.821  -0.223   1.388
    5    HB3  PRO   8           HB1      PRO   8   5.051  -4.081   1.164
    6    HG3  PRO   8           HG1      PRO   8   4.298  -2.523   2.719
    7    HD3  PRO   8           HD1      PRO   8   6.094  -1.375   1.839

  No H/Q in entry =           7
  In of MODEL   27
    1    HA   CYS   9           HA       CYS   9   1.119  -1.968  -2.178
    2    HB2  CYS   9           HB2      CYS   9   0.700  -0.224  -0.477
    3    H    CYS   9           HN       CYS   9   3.220  -0.796  -0.630
    4    HB3  CYS   9           HB1      CYS   9   1.591   0.933  -1.460

  No H/Q in entry =           4
  In of MODEL   27
    1    HA   CYS  10           HA       CYS  10   2.645   0.777  -5.627
    2    HB2  CYS  10           HB2      CYS  10   4.270   2.588  -5.806
    3    H    CYS  10           HN       CYS  10   3.286   0.794  -2.830
    4    HB3  CYS  10           HB1      CYS  10   3.201   2.863  -4.435

  No H/Q in entry =           4
  In of MODEL   27
    1    HA   ARG  11           HA       ARG  11   6.504  -1.246  -6.595
    2    HB2  ARG  11           HB2      ARG  11   4.314  -1.982  -7.975
    3    HG2  ARG  11           HG2      ARG  11   6.585  -3.239  -7.360
    4    HD2  ARG  11           HD2      ARG  11   7.352  -2.165  -9.716
    5    HE   ARG  11           HE       ARG  11   6.285  -3.353 -11.355
    6   HH11  ARG  11          HH11      ARG  11   7.296  -5.551  -8.841
    7   HH12  ARG  11          HH12      ARG  11   6.886  -6.971  -9.744
    8   HH21  ARG  11          HH21      ARG  11   5.745  -5.218 -12.545
    9   HH22  ARG  11          HH22      ARG  11   6.006  -6.782 -11.847
   10    H    ARG  11           HN       ARG  11   4.446   0.738  -7.277
   11    HB3  ARG  11           HB1      ARG  11   5.311  -1.411  -9.305
   12    HG3  ARG  11           HG1      ARG  11   5.365  -3.922  -8.437
   13    HD3  ARG  11           HD1      ARG  11   7.985  -3.676  -9.064

  No H/Q in entry =          13
  In of MODEL   27
    1    HA   GLN  12           HA       GLN  12  10.185   0.511  -8.147
    2    HB2  GLN  12           HB2      GLN  12   8.203   0.220 -10.325
    3    HG2  GLN  12           HG2      GLN  12  11.179  -0.185 -10.372
    4   HE21  GLN  12          HE21      GLN  12   8.903  -2.558 -11.325
    5   HE22  GLN  12          HE22      GLN  12   9.101  -2.387 -13.032
    6    H    GLN  12           HN       GLN  12   8.471  -0.600  -7.152
    7    HB3  GLN  12           HB1      GLN  12   9.449   1.436 -10.574
    8    HG3  GLN  12           HG1      GLN  12  10.038  -1.419  -9.840

  No H/Q in entry =           8
  In of MODEL   27
    1    HA   CYS  13           HA       CYS  13   7.840   4.560  -7.803
    2    HB2  CYS  13           HB2      CYS  13   9.276   4.606 -10.409
    3    H    CYS  13           HN       CYS  13   7.600   2.385  -9.662
    4    HB3  CYS  13           HB1      CYS  13   8.458   6.083  -9.912

  No H/Q in entry =           4
  In of MODEL   27
    1    HA   LYS  14           HA       LYS  14   3.978   5.648  -9.360
    2    HB2  LYS  14           HB2      LYS  14   4.241   2.830 -10.260
    3    HG2  LYS  14           HG2      LYS  14   3.912   5.498 -11.496
    4    HD2  LYS  14           HD2      LYS  14   1.961   4.194 -12.322
    5    HE2  LYS  14           HE2      LYS  14   4.112   2.357 -13.366
    6    HZ2  LYS  14           HZ1      LYS  14   2.659   2.189 -15.062
    7    HZ1  LYS  14           HZ2      LYS  14   1.352   2.793 -14.173
    8    HZ3  LYS  14           HZ3      LYS  14   1.825   1.179 -13.990
    9    H    LYS  14           HN       LYS  14   5.564   3.887  -7.806
   10    HB3  LYS  14           HB1      LYS  14   2.622   3.516 -10.261
   11    HG3  LYS  14           HG1      LYS  14   4.955   4.151 -11.957
   12    HD3  LYS  14           HD1      LYS  14   3.125   4.609 -13.582
   13    HE3  LYS  14           HE1      LYS  14   2.878   1.953 -12.173

  No H/Q in entry =          13
  In of MODEL   27
    1    HA   LEU  15           HA       LEU  15   2.130   4.625  -5.434
    2    HB2  LEU  15           HB2      LEU  15   2.312   7.276  -5.725
    3    HG   LEU  15           HG       LEU  15   2.066   6.173  -3.532
    4   HD11  LEU  15          HD11      LEU  15   1.666   8.716  -4.064
    5   HD13  LEU  15          HD12      LEU  15   1.389   8.068  -2.447
    6   HD12  LEU  15          HD13      LEU  15   0.026   8.339  -3.534
    7   HD22  LEU  15          HD21      LEU  15   0.187   4.754  -3.898
    8   HD21  LEU  15          HD22      LEU  15  -0.849   6.127  -4.287
    9   HD23  LEU  15          HD23      LEU  15  -0.258   5.907  -2.640
   10    H    LEU  15           HN       LEU  15   2.960   6.292  -7.533
   11    HB3  LEU  15           HB1      LEU  15   0.589   7.100  -5.997

  No H/Q in entry =          11
  In of MODEL   27
    1    HA   LYS  16           HA       LYS  16  -1.259   2.764  -7.493
    2    HB2  LYS  16           HB2      LYS  16  -1.417   1.623  -4.700
    3    HG2  LYS  16           HG2      LYS  16   0.759   1.293  -6.236
    4    HD2  LYS  16           HD2      LYS  16  -0.886  -1.128  -6.892
    5    HE2  LYS  16           HE2      LYS  16   1.782  -0.725  -6.978
    6    HZ3  LYS  16           HZ1      LYS  16   0.973  -0.335  -9.789
    7    HZ2  LYS  16           HZ2      LYS  16   2.506  -0.167  -9.095
    8    HZ1  LYS  16           HZ3      LYS  16   1.310   0.990  -8.792
    9    H    LYS  16           HN       LYS  16   0.576   3.155  -5.374
   10    HB3  LYS  16           HB1      LYS  16  -2.173   0.974  -6.149
   11    HG3  LYS  16           HG1      LYS  16   0.129   0.055  -5.147
   12    HD3  LYS  16           HD1      LYS  16  -0.805   0.250  -7.992
   13    HE3  LYS  16           HE1      LYS  16   0.915  -1.837  -8.036

  No H/Q in entry =          13
  In of MODEL   27
    1    HA   PRO  17           HA       PRO  17  -4.701   5.372  -6.656
    2    HB2  PRO  17           HB2      PRO  17  -6.377   2.911  -6.815
    3    HG2  PRO  17           HG2      PRO  17  -5.573   2.288  -8.910
    4    HD2  PRO  17           HD2      PRO  17  -3.790   1.660  -7.588
    5    HB3  PRO  17           HB1      PRO  17  -6.540   4.442  -7.683
    6    HG3  PRO  17           HG1      PRO  17  -4.895   3.897  -9.225
    7    HD3  PRO  17           HD1      PRO  17  -2.941   2.844  -8.602

  No H/Q in entry =           7
  In of MODEL   27
    1    HA   ALA  18           HA       ALA  18  -5.340   4.983  -2.380
    2    HB3  ALA  18           HB1      ALA  18  -7.647   6.806  -3.003
    3    HB1  ALA  18           HB2      ALA  18  -5.977   7.371  -2.955
    4    HB2  ALA  18           HB3      ALA  18  -6.718   6.684  -1.509
    5    H    ALA  18           HN       ALA  18  -5.829   6.079  -4.909

  No H/Q in entry =           5
  In of MODEL   27
    1    HA3  GLY  19           HA2      GLY  19  -8.034   2.030  -0.584
    2    H    GLY  19           HN       GLY  19  -6.144   3.208  -1.485
    3    HA2  GLY  19           HA1      GLY  19  -8.966   2.535  -1.986

  No H/Q in entry =           3
  In of MODEL   27
    1    HA   THR  20           HA       THR  20  -6.813  -1.080  -3.618
    2    HB   THR  20           HB       THR  20  -4.052   0.088  -3.983
    3    HG1  THR  20           HG1      THR  20  -6.406   0.538  -5.496
    4   HG21  THR  20          HG21      THR  20  -4.817  -2.346  -4.723
    5   HG23  THR  20          HG22      THR  20  -3.719  -1.355  -5.685
    6   HG22  THR  20          HG23      THR  20  -5.431  -1.435  -6.103
    7    H    THR  20           HN       THR  20  -5.716   1.308  -2.294

  No H/Q in entry =           7
  In of MODEL   27
    1    HA   THR  21           HA       THR  21  -5.027  -3.481  -0.493
    2    HB   THR  21           HB       THR  21  -4.924  -5.912  -1.208
    3    HG1  THR  21           HG1      THR  21  -5.537  -6.451  -3.200
    4   HG22  THR  21          HG21      THR  21  -7.608  -5.377  -2.024
    5   HG21  THR  21          HG22      THR  21  -7.167  -4.324  -0.680
    6   HG23  THR  21          HG23      THR  21  -7.013  -6.074  -0.517
    7    H    THR  21           HN       THR  21  -6.053  -3.106  -3.117

  No H/Q in entry =           7
  In of MODEL   27
    1    HA   CYS  22           HA       CYS  22  -0.860  -3.698  -1.853
    2    HB2  CYS  22           HB2      CYS  22   0.579  -2.621  -0.092
    3    H    CYS  22           HN       CYS  22  -2.987  -3.427   0.155
    4    HB3  CYS  22           HB1      CYS  22  -0.727  -1.607  -0.696

  No H/Q in entry =           4
  In of MODEL   27
    1    HA   TRP  23           HA       TRP  23   0.211  -6.902   1.224
    2    HB2  TRP  23           HB2      TRP  23   0.242  -5.382   3.217
    3    HD1  TRP  23           HD1      TRP  23   1.619  -8.153   2.429
    4    HE1  TRP  23           HE1      TRP  23   2.210  -9.832   4.288
    5    HE3  TRP  23           HE3      TRP  23  -1.572  -6.498   6.065
    6    HZ2  TRP  23           HZ2      TRP  23   1.428 -10.382   6.944
    7    HZ3  TRP  23           HZ3      TRP  23  -1.588  -7.656   8.236
    8    HH2  TRP  23           HH2      TRP  23  -0.119  -9.558   8.665
    9    H    TRP  23           HN       TRP  23  -1.821  -4.783   1.379
   10    HB3  TRP  23           HB1      TRP  23  -1.347  -6.002   3.654

  No H/Q in entry =          10
  In of MODEL   27
    1    HA   ARG  24           HA       ARG  24  -2.930  -9.937   1.749
    2    HB2  ARG  24           HB2      ARG  24  -3.612 -10.671  -0.610
    3    HG2  ARG  24           HG2      ARG  24  -2.371  -8.198  -1.639
    4    HD2  ARG  24           HD2      ARG  24  -3.047 -10.912  -2.752
    5    HE   ARG  24           HE       ARG  24  -1.334  -8.936  -3.910
    6   HH11  ARG  24          HH11      ARG  24  -3.746 -11.353  -4.627
    7   HH12  ARG  24          HH12      ARG  24  -3.196 -11.601  -6.250
    8   HH21  ARG  24          HH21      ARG  24  -0.608  -9.261  -6.045
    9   HH22  ARG  24          HH22      ARG  24  -1.414 -10.414  -7.055
   10    H    ARG  24           HN       ARG  24  -0.439  -8.885   0.740
   11    HB3  ARG  24           HB1      ARG  24  -3.899  -8.993  -0.170
   12    HG3  ARG  24           HG1      ARG  24  -1.321  -9.608  -1.480
   13    HD3  ARG  24           HD1      ARG  24  -3.878  -9.388  -3.058

  No H/Q in entry =          13
  In of MODEL   27
    1    HA   THR  25           HA       THR  25   0.154 -13.123   1.235
    2    HB   THR  25           HB       THR  25   0.869 -12.483   3.459
    3    HG1  THR  25           HG1      THR  25   0.138 -15.221   3.429
    4   HG23  THR  25          HG21      THR  25  -1.196 -12.147   4.613
    5   HG22  THR  25          HG22      THR  25  -0.268 -13.383   5.462
    6   HG21  THR  25          HG23      THR  25  -1.624 -13.849   4.436
    7    H    THR  25           HN       THR  25  -1.629 -11.449   2.791

  No H/Q in entry =           7
  In of MODEL   27
    1    HA   SER  26           HA       SER  26  -3.909 -15.391   1.145
    2    HB2  SER  26           HB2      SER  26  -3.814 -17.343   2.449
    3    HG   SER  26           HG       SER  26  -2.690 -16.070   4.674
    4    H    SER  26           HN       SER  26  -2.975 -13.345   2.816
    5    HB3  SER  26           HB1      SER  26  -2.211 -16.635   2.648

  No H/Q in entry =           5
  In of MODEL   27
    1    HA   VAL  27           HA       VAL  27  -7.042 -13.938   4.093
    2    HB   VAL  27           HB       VAL  27  -6.296 -15.362   5.949
    3    H    VAL  27           HN       VAL  27  -4.106 -13.939   4.349

  No H/Q in entry =           3
  In of MODEL   27
    1    HA   SER  28           HA       SER  28  -5.518  -9.815   6.017
    2    HB2  SER  28           HB2      SER  28  -2.725 -10.432   5.113
    3    HG   SER  28           HG       SER  28  -3.579  -9.197   7.500
    4    H    SER  28           HN       SER  28  -4.203 -12.146   5.158
    5    HB3  SER  28           HB1      SER  28  -3.205  -8.756   5.382

  No H/Q in entry =           5
  In of MODEL   27
    1    HA   SER  29           HA       SER  29  -5.157  -7.405   2.186
    2    HB2  SER  29           HB2      SER  29  -7.942  -8.062   3.116
    3    HG   SER  29           HG       SER  29  -7.184  -8.772   0.610
    4    H    SER  29           HN       SER  29  -5.577  -7.721   4.969
    5    HB3  SER  29           HB1      SER  29  -7.679  -7.050   1.695

  No H/Q in entry =           5
  In of MODEL   27
    1    HA   HIS  30           HA       HIS  30  -5.836  -3.556   4.381
    2    HB2  HIS  30           HB2      HIS  30  -2.854  -3.926   4.253
    3    HD1  HIS  30           HD1      HIS  30  -1.844  -4.226   6.602
    4    HD2  HIS  30           HD2      HIS  30  -5.981  -3.831   6.580
    5    HE1  HIS  30           HE1      HIS  30  -2.596  -4.893   8.908
    6    HE2  HIS  30           HE2      HIS  30  -5.093  -4.563   8.896
    7    H    HIS  30           HN       HIS  30  -4.093  -5.618   3.280
    8    HB3  HIS  30           HB1      HIS  30  -3.554  -2.365   4.667

  No H/Q in entry =           8
  In of MODEL   27
    1    HA   TYR  31           HA       TYR  31  -5.840  -1.447   0.584
    2    HB2  TYR  31           HB2      TYR  31  -7.040   0.677   2.359
    3    HD1  TYR  31           HD1      TYR  31  -7.887  -2.417   0.452
    4    HD2  TYR  31           HD2      TYR  31  -9.089   0.399   3.406
    5    HE1  TYR  31           HE1      TYR  31  -9.859  -3.796   0.956
    6    HE2  TYR  31           HE2      TYR  31 -11.064  -0.973   3.919
    7    HH   TYR  31           HH       TYR  31 -12.130  -3.475   1.936
    8    H    TYR  31           HN       TYR  31  -6.265  -1.627   3.423
    9    HB3  TYR  31           HB1      TYR  31  -7.308   0.429   0.636

  No H/Q in entry =           9
  In of MODEL   27
    1    HA   CYS  32           HA       CYS  32  -2.618   1.469   0.855
    2    HB2  CYS  32           HB2      CYS  32  -3.245   0.959  -1.700
    3    H    CYS  32           HN       CYS  32  -5.217   0.804  -0.305
    4    HB3  CYS  32           HB1      CYS  32  -3.517   2.698  -1.699

  No H/Q in entry =           4
  In of MODEL   27
    1    HA   THR  33           HA       THR  33  -3.999   5.178   2.578
    2    HB   THR  33           HB       THR  33  -1.998   6.879   2.584
    3    HG1  THR  33           HG1      THR  33  -0.113   6.106   1.982
    4   HG21  THR  33          HG21      THR  33  -2.805   5.002   4.370
    5   HG23  THR  33          HG22      THR  33  -1.508   6.167   4.639
    6   HG22  THR  33          HG23      THR  33  -1.127   4.534   4.092
    7    H    THR  33           HN       THR  33  -2.027   3.522   1.476

  No H/Q in entry =           7
  In of MODEL   27
    1    HA3  GLY  34           HA2      GLY  34  -3.135   6.338  -2.436
    2    H    GLY  34           HN       GLY  34  -2.204   5.408  -0.462
    3    HA2  GLY  34           HA1      GLY  34  -4.248   7.267  -1.442

  No H/Q in entry =           3
  In of MODEL   27
    1    HA   ARG  35           HA       ARG  35  -1.106  10.326  -1.321
    2    HB2  ARG  35           HB2      ARG  35  -2.232  10.414   1.111
    3    HG2  ARG  35           HG2      ARG  35   0.033  12.297   0.561
    4    HD2  ARG  35           HD2      ARG  35  -2.454  12.293   2.133
    5    HE   ARG  35           HE       ARG  35  -3.273  14.176   1.157
    6   HH11  ARG  35          HH11      ARG  35   0.210  14.286   0.963
    7   HH12  ARG  35          HH12      ARG  35   0.245  15.865   0.254
    8   HH21  ARG  35          HH21      ARG  35  -3.228  16.253   0.224
    9   HH22  ARG  35          HH22      ARG  35  -1.706  16.982  -0.166
   10    H    ARG  35           HN       ARG  35  -2.064   8.136   0.358
   11    HB3  ARG  35           HB1      ARG  35  -0.547  10.277   1.596
   12    HG3  ARG  35           HG1      ARG  35  -1.460  12.340  -0.380
   13    HD3  ARG  35           HD1      ARG  35  -0.942  13.159   2.402

  No H/Q in entry =          13
  In of MODEL   27
    1    HA   SER  36           HA       SER  36   2.757   8.134  -0.466
    2    HB2  SER  36           HB2      SER  36   2.442   8.795   2.013
    3    HG   SER  36           HG       SER  36   4.487   7.809   2.527
    4    H    SER  36           HN       SER  36   0.063   7.642   0.598
    5    HB3  SER  36           HB1      SER  36   2.357   7.060   2.319

  No H/Q in entry =           5
  In of MODEL   27
    1    HA   CYS  37           HA       CYS  37   2.811   3.930  -1.404
    2    HB2  CYS  37           HB2      CYS  37   5.630   4.491  -0.566
    3    H    CYS  37           HN       CYS  37   4.163   6.133  -0.199
    4    HB3  CYS  37           HB1      CYS  37   5.165   2.842  -0.970

  No H/Q in entry =           4
  In of MODEL   27
    1    HA   GLU  38           HA       GLU  38   3.769   2.099   2.927
    2    HB2  GLU  38           HB2      GLU  38   3.673   4.869   4.067
    3    HG2  GLU  38           HG2      GLU  38   5.633   2.699   3.878
    4    H    GLU  38           HN       GLU  38   3.899   4.692   1.828
    5    HB3  GLU  38           HB1      GLU  38   3.341   3.488   5.104
    6    HG3  GLU  38           HG1      GLU  38   5.869   4.443   3.984

  No H/Q in entry =           6
  In of MODEL   27
    1    HA   CYS  39           HA       CYS  39  -0.568   2.001   3.509
    2    HB2  CYS  39           HB2      CYS  39   0.674  -0.695   3.687
    3    H    CYS  39           HN       CYS  39   2.154   1.046   4.079
    4    HB3  CYS  39           HB1      CYS  39  -0.994  -0.542   4.227

  No H/Q in entry =           4
  In of MODEL   27
    1    HA   PRO  40           HA       PRO  40  -1.342   2.627   7.808
    2    HB2  PRO  40           HB2      PRO  40  -4.013   2.167   7.922
    3    HG2  PRO  40           HG2      PRO  40  -4.308   1.110   5.875
    4    HD2  PRO  40           HD2      PRO  40  -2.714   1.207   4.215
    5    HB3  PRO  40           HB1      PRO  40  -3.322   3.616   7.183
    6    HG3  PRO  40           HG1      PRO  40  -4.563   2.798   5.394
    7    HD3  PRO  40           HD1      PRO  40  -2.490   2.958   4.399

  No H/Q in entry =           7
  In of MODEL   27
    1    HA   SER  41           HA       SER  41  -1.494  -1.388   9.505
    2    HB2  SER  41           HB2      SER  41   0.209  -0.127  10.862
    3    HG   SER  41           HG       SER  41   0.341  -1.943  11.883
    4    H    SER  41           HN       SER  41  -1.506   1.509   9.718
    5    HB3  SER  41           HB1      SER  41  -1.085   0.305  11.979

  No H/Q in entry =           5
  In of MODEL   27
    1    HA   TYR  42           HA       TYR  42  -5.430  -0.846  11.718
    2    HB2  TYR  42           HB2      TYR  42  -6.371   1.112  13.070
    3    HD1  TYR  42           HD1      TYR  42  -6.572   3.372  12.396
    4    HD2  TYR  42           HD2      TYR  42  -2.716   1.688  13.025
    5    HE1  TYR  42           HE1      TYR  42  -5.575   5.615  12.254
    6    HE2  TYR  42           HE2      TYR  42  -1.709   3.926  12.886
    7    HH   TYR  42           HH       TYR  42  -2.877   6.391  11.562
    8    H    TYR  42           HN       TYR  42  -3.506   1.174  10.768
    9    HB3  TYR  42           HB1      TYR  42  -4.826   0.452  13.594

  No H/Q in entry =           9
  In of MODEL   27
    1    HA   PRO  43           HA       PRO  43  -7.319   0.812   7.837
    2    HB2  PRO  43           HB2      PRO  43  -9.023  -1.546   8.492
    3    HG2  PRO  43           HG2      PRO  43  -7.283  -3.079   8.288
    4    HD2  PRO  43           HD2      PRO  43  -6.779  -2.170  10.347
    5    HB3  PRO  43           HB1      PRO  43  -8.343  -1.045   6.940
    6    HG3  PRO  43           HG1      PRO  43  -6.252  -1.926   7.420
    7    HD3  PRO  43           HD1      PRO  43  -5.287  -1.711   9.502

  No H/Q in entry =           7
  In of MODEL   27
    1    HA3  GLY  44           HA2      GLY  44 -10.356   2.993  10.092
    2    H    GLY  44           HN       GLY  44  -8.928   2.264   7.775
    3    HA2  GLY  44           HA1      GLY  44 -10.683   3.572   8.465

  No H/Q in entry =           3
  In of MODEL   27
    1    HA   ASN  45           HA       ASN  45 -14.172   1.001  10.039
    2    HB2  ASN  45           HB2      ASN  45 -14.901   3.573  10.379
    3   HD21  ASN  45          HD21      ASN  45 -17.103   3.845  11.232
    4   HD22  ASN  45          HD22      ASN  45 -17.911   2.455  11.862
    5    H    ASN  45           HN       ASN  45 -12.905   3.456   9.570
    6    HB3  ASN  45           HB1      ASN  45 -15.816   3.202   8.921

  No H/Q in entry =           6
  In of MODEL   27
    1    HA3  GLY  46           HA2      GLY  46 -15.970   0.371   5.959
    2    H    GLY  46           HN       GLY  46 -15.672  -0.183   8.763
    3    HA2  GLY  46           HA1      GLY  46 -14.864  -0.957   6.273

  No H/Q in entry =           3
  In of MODEL   28
    1    H1   ALA   1           HT1      ALA   1  14.690   7.244   2.242
    2    H2   ALA   1           HT3      ALA   1  14.164   5.814   1.456
    3    H3   ALA   1           HT2      ALA   1  15.839   6.176   1.546
    4    HA   ALA   1           HA       ALA   1  15.614   8.004   0.138
    5    HB3  ALA   1           HB1      ALA   1  15.328   6.865  -1.833
    6    HB2  ALA   1           HB2      ALA   1  13.931   5.968  -1.240
    7    HB1  ALA   1           HB3      ALA   1  15.553   5.525  -0.709

  No H/Q in entry =           7
  In of MODEL   28
    1    HA   MET   2           HA       MET   2  11.526   9.578  -0.345
    2    HB2  MET   2           HB2      MET   2  13.405  11.696   0.672
    3    H    MET   2           HN       MET   2  14.457   9.699  -0.583
    4    HG2  MET   2           HG2      MET   2  11.769  11.624   2.603
    5    HE1  MET   2           HE1      MET   2  11.710   8.082   2.495
    6    HB3  MET   2           HB1      MET   2  11.723  12.064   0.314
    7    HE3  MET   2           HE2      MET   2  11.856   8.569   4.184
    8    HE2  MET   2           HE3      MET   2  13.094   7.548   3.450
    9    HG3  MET   2           HG1      MET   2  11.133  10.151   1.875

  No H/Q in entry =           9
  In of MODEL   28
    1    HA   ASP   3           HA       ASP   3  12.041  11.358  -4.314
    2    HB2  ASP   3           HB2      ASP   3  14.150  11.520  -5.610
    3    H    ASP   3           HN       ASP   3  13.121   9.188  -2.685
    4    HB3  ASP   3           HB1      ASP   3  14.343  12.036  -3.937

  No H/Q in entry =           4
  In of MODEL   28
    1    HA   CYS   4           HA       CYS   4  10.735   7.896  -6.590
    2    HB2  CYS   4           HB2      CYS   4  13.227   7.121  -5.772
    3    H    CYS   4           HN       CYS   4  11.122   8.709  -3.941
    4    HB3  CYS   4           HB1      CYS   4  12.267   5.702  -5.367

  No H/Q in entry =           4
  In of MODEL   28
    1    HA   THR   5           HA       THR   5   9.428   5.793  -1.881
    2    HB   THR   5           HB       THR   5   7.231   5.789  -3.866
    3    HG1  THR   5           HG1      THR   5   7.018   7.960  -3.918
    4   HG23  THR   5          HG21      THR   5   5.916   5.988  -2.086
    5   HG22  THR   5          HG22      THR   5   6.896   7.279  -1.391
    6   HG21  THR   5          HG23      THR   5   7.354   5.594  -1.145
    7    H    THR   5           HN       THR   5  10.905   6.884  -3.223

  No H/Q in entry =           7
  In of MODEL   28
    1    HA   THR   6           HA       THR   6   9.073   1.786  -3.625
    2    HB   THR   6           HB       THR   6  11.139   0.467  -3.182
    3    HG1  THR   6           HG1      THR   6  12.092   1.101  -1.406
    4   HG23  THR   6          HG21      THR   6  12.696   1.810  -4.457
    5   HG22  THR   6          HG22      THR   6  11.709   3.245  -4.182
    6   HG21  THR   6          HG23      THR   6  11.076   1.912  -5.147
    7    H    THR   6           HN       THR   6   9.973   3.732  -1.612

  No H/Q in entry =           7
  In of MODEL   28
    1    HA3  GLY   7           HA2      GLY   7   8.379  -1.064  -0.308
    2    H    GLY   7           HN       GLY   7   7.899   0.167  -2.805
    3    HA2  GLY   7           HA1      GLY   7   7.079   0.105  -0.136

  No H/Q in entry =           3
  In of MODEL   28
    1    HA   PRO   8           HA       PRO   8   5.167  -4.006  -1.204
    2    HB2  PRO   8           HB2      PRO   8   2.958  -2.636   0.239
    3    HG2  PRO   8           HG2      PRO   8   4.104  -2.459   2.256
    4    HD2  PRO   8           HD2      PRO   8   5.115  -0.774   1.035
    5    HB3  PRO   8           HB1      PRO   8   3.554  -4.291   0.403
    6    HG3  PRO   8           HG1      PRO   8   5.315  -3.663   1.775
    7    HD3  PRO   8           HD1      PRO   8   6.555  -1.754   1.382

  No H/Q in entry =           7
  In of MODEL   28
    1    HA   CYS   9           HA       CYS   9   1.580  -1.733  -3.256
    2    HB2  CYS   9           HB2      CYS   9   1.913   0.635  -1.506
    3    H    CYS   9           HN       CYS   9   3.128  -1.080  -0.997
    4    HB3  CYS   9           HB1      CYS   9   1.235   0.938  -3.102

  No H/Q in entry =           4
  In of MODEL   28
    1    HA   CYS  10           HA       CYS  10   3.780   1.591  -5.829
    2    HB2  CYS  10           HB2      CYS  10   5.486   3.184  -5.353
    3    H    CYS  10           HN       CYS  10   3.497   1.242  -3.115
    4    HB3  CYS  10           HB1      CYS  10   4.358   3.238  -4.005

  No H/Q in entry =           4
  In of MODEL   28
    1    HA   ARG  11           HA       ARG  11   6.908  -1.369  -6.637
    2    HB2  ARG  11           HB2      ARG  11   4.971  -1.124  -8.879
    3    HG2  ARG  11           HG2      ARG  11   5.222  -2.852  -6.774
    4    HD2  ARG  11           HD2      ARG  11   5.571  -4.877  -8.715
    5    HE   ARG  11           HE       ARG  11   6.303  -5.572  -6.657
    6   HH11  ARG  11          HH11      ARG  11   8.060  -2.702  -7.586
    7   HH12  ARG  11          HH12      ARG  11   9.194  -2.823  -6.283
    8   HH21  ARG  11          HH21      ARG  11   7.794  -5.731  -4.942
    9   HH22  ARG  11          HH22      ARG  11   9.043  -4.542  -4.782
   10    H    ARG  11           HN       ARG  11   4.891   0.626  -7.397
   11    HB3  ARG  11           HB1      ARG  11   6.504  -1.912  -9.225
   12    HG3  ARG  11           HG1      ARG  11   4.277  -3.138  -8.237
   13    HD3  ARG  11           HD1      ARG  11   6.963  -3.801  -8.827

  No H/Q in entry =          13
  In of MODEL   28
    1    HA   GLN  12           HA       GLN  12   9.306   0.958  -9.754
    2    HB2  GLN  12           HB2      GLN  12   7.667   0.232 -11.696
    3    HG2  GLN  12           HG2      GLN  12   9.443   2.335 -12.710
    4   HE21  GLN  12          HE21      GLN  12  10.484   1.654 -14.564
    5   HE22  GLN  12          HE22      GLN  12  10.090   0.173 -15.361
    6    H    GLN  12           HN       GLN  12   6.432   0.502  -9.623
    7    HB3  GLN  12           HB1      GLN  12   7.410   1.966 -11.831
    8    HG3  GLN  12           HG1      GLN  12  10.220   1.118 -11.698

  No H/Q in entry =           8
  In of MODEL   28
    1    HA   CYS  13           HA       CYS  13   8.297   4.414  -6.726
    2    HB2  CYS  13           HB2      CYS  13   9.503   5.298  -9.356
    3    H    CYS  13           HN       CYS  13   8.373   2.349  -7.673
    4    HB3  CYS  13           HB1      CYS  13   9.494   6.229  -7.862

  No H/Q in entry =           4
  In of MODEL   28
    1    HA   LYS  14           HA       LYS  14   4.757   6.050  -8.837
    2    HB2  LYS  14           HB2      LYS  14   4.615   3.474 -10.365
    3    HG2  LYS  14           HG2      LYS  14   4.782   6.352 -11.234
    4    HD2  LYS  14           HD2      LYS  14   5.422   5.074 -13.428
    5    HE2  LYS  14           HE2      LYS  14   2.761   5.792 -12.333
    6    HZ2  LYS  14           HZ1      LYS  14   1.553   4.969 -14.085
    7    HZ1  LYS  14           HZ2      LYS  14   2.614   3.683 -13.801
    8    HZ3  LYS  14           HZ3      LYS  14   2.905   4.751 -15.079
    9    H    LYS  14           HN       LYS  14   6.006   3.452  -8.240
   10    HB3  LYS  14           HB1      LYS  14   3.265   4.600 -10.415
   11    HG3  LYS  14           HG1      LYS  14   6.104   5.183 -11.233
   12    HD3  LYS  14           HD1      LYS  14   4.457   3.781 -12.712
   13    HE3  LYS  14           HE1      LYS  14   3.627   6.445 -13.724

  No H/Q in entry =          13
  In of MODEL   28
    1    HA   LEU  15           HA       LEU  15   2.363   4.478  -5.456
    2    HB2  LEU  15           HB2      LEU  15   2.615   7.173  -5.355
    3    HG   LEU  15           HG       LEU  15   0.699   5.514  -3.715
    4   HD11  LEU  15          HD11      LEU  15   3.592   6.074  -3.638
    5   HD13  LEU  15          HD12      LEU  15   2.687   4.672  -3.066
    6   HD12  LEU  15          HD13      LEU  15   2.747   6.141  -2.092
    7   HD23  LEU  15          HD21      LEU  15   1.758   8.267  -3.097
    8   HD22  LEU  15          HD22      LEU  15   0.638   7.310  -2.128
    9   HD21  LEU  15          HD23      LEU  15   0.133   7.936  -3.697
   10    H    LEU  15           HN       LEU  15   3.493   6.419  -7.124
   11    HB3  LEU  15           HB1      LEU  15   0.903   7.031  -5.708

  No H/Q in entry =          11
  In of MODEL   28
    1    HA   LYS  16           HA       LYS  16  -0.793   3.129  -8.186
    2    HB2  LYS  16           HB2      LYS  16  -0.675   1.442  -5.730
    3    HG2  LYS  16           HG2      LYS  16  -0.840  -0.333  -7.625
    4    HD2  LYS  16           HD2      LYS  16   1.423   1.303  -6.687
    5    HE2  LYS  16           HE2      LYS  16   1.915   1.226  -9.078
    6    HZ1  LYS  16           HZ1      LYS  16   0.637  -1.084  -9.196
    7    HZ3  LYS  16           HZ2      LYS  16   2.220  -1.669  -9.072
    8    HZ2  LYS  16           HZ3      LYS  16   1.801  -0.626 -10.336
    9    H    LYS  16           HN       LYS  16   0.807   3.066  -5.858
   10    HB3  LYS  16           HB1      LYS  16  -2.116   1.343  -6.733
   11    HG3  LYS  16           HG1      LYS  16  -0.393   1.018  -8.668
   12    HD3  LYS  16           HD1      LYS  16   1.203  -0.448  -6.671
   13    HE3  LYS  16           HE1      LYS  16   3.029   0.215  -8.158

  No H/Q in entry =          13
  In of MODEL   28
    1    HA   PRO  17           HA       PRO  17  -4.224   5.725  -7.262
    2    HB2  PRO  17           HB2      PRO  17  -5.931   3.439  -8.129
    3    HG2  PRO  17           HG2      PRO  17  -4.874   3.204 -10.189
    4    HD2  PRO  17           HD2      PRO  17  -3.299   2.229  -8.814
    5    HB3  PRO  17           HB1      PRO  17  -5.935   5.119  -8.678
    6    HG3  PRO  17           HG1      PRO  17  -4.116   4.804 -10.083
    7    HD3  PRO  17           HD1      PRO  17  -2.292   3.545  -9.451

  No H/Q in entry =           7
  In of MODEL   28
    1    HA   ALA  18           HA       ALA  18  -5.457   4.588  -3.265
    2    HB3  ALA  18           HB1      ALA  18  -7.673   6.513  -3.940
    3    HB1  ALA  18           HB2      ALA  18  -6.064   7.009  -3.415
    4    HB2  ALA  18           HB3      ALA  18  -7.090   6.061  -2.338
    5    H    ALA  18           HN       ALA  18  -5.608   6.117  -5.592

  No H/Q in entry =           5
  In of MODEL   28
    1    HA3  GLY  19           HA2      GLY  19  -8.539   1.574  -2.932
    2    H    GLY  19           HN       GLY  19  -6.037   2.468  -3.420
    3    HA2  GLY  19           HA1      GLY  19  -8.517   1.683  -4.686

  No H/Q in entry =           3
  In of MODEL   28
    1    HA   THR  20           HA       THR  20  -5.847  -1.754  -5.158
    2    HB   THR  20           HB       THR  20  -3.178  -0.596  -4.512
    3    HG1  THR  20           HG1      THR  20  -4.751   0.168  -6.741
    4   HG23  THR  20          HG21      THR  20  -2.943  -2.695  -5.431
    5   HG22  THR  20          HG22      THR  20  -2.751  -1.640  -6.832
    6   HG21  THR  20          HG23      THR  20  -4.284  -2.467  -6.554
    7    H    THR  20           HN       THR  20  -5.619   1.004  -4.748

  No H/Q in entry =           7
  In of MODEL   28
    1    HA   THR  21           HA       THR  21  -5.190  -3.333  -1.186
    2    HB   THR  21           HB       THR  21  -4.229  -5.809  -1.481
    3    HG1  THR  21           HG1      THR  21  -4.028  -6.373  -3.474
    4   HG23  THR  21          HG21      THR  21  -6.413  -5.635  -0.712
    5   HG22  THR  21          HG22      THR  21  -6.565  -6.520  -2.230
    6   HG21  THR  21          HG23      THR  21  -6.960  -4.802  -2.167
    7    H    THR  21           HN       THR  21  -4.795  -3.507  -4.036

  No H/Q in entry =           7
  In of MODEL   28
    1    HA   CYS  22           HA       CYS  22  -0.882  -3.177  -0.417
    2    HB2  CYS  22           HB2      CYS  22  -2.392  -1.986   1.477
    3    H    CYS  22           HN       CYS  22  -3.610  -3.911   0.401
    4    HB3  CYS  22           HB1      CYS  22  -1.594  -3.208   2.460

  No H/Q in entry =           4
  In of MODEL   28
    1    HA   TRP  23           HA       TRP  23  -0.428  -7.232   1.609
    2    HB2  TRP  23           HB2      TRP  23   0.210  -5.895   3.644
    3    HD1  TRP  23           HD1      TRP  23   0.969  -8.753   2.311
    4    HE1  TRP  23           HE1      TRP  23   1.864 -10.612   3.850
    5    HE3  TRP  23           HE3      TRP  23  -0.811  -7.032   6.784
    6    HZ2  TRP  23           HZ2      TRP  23   1.822 -11.262   6.596
    7    HZ3  TRP  23           HZ3      TRP  23  -0.339  -8.331   8.819
    8    HH2  TRP  23           HH2      TRP  23   0.949 -10.403   8.726
    9    H    TRP  23           HN       TRP  23  -2.350  -5.087   2.216
   10    HB3  TRP  23           HB1      TRP  23  -1.287  -6.437   4.396

  No H/Q in entry =          10
  In of MODEL   28
    1    HA   ARG  24           HA       ARG  24  -4.371  -9.235   2.084
    2    HB2  ARG  24           HB2      ARG  24  -5.117  -7.922   0.148
    3    HG2  ARG  24           HG2      ARG  24  -6.183 -10.020  -1.158
    4    HD2  ARG  24           HD2      ARG  24  -7.748 -10.016   1.050
    5    HE   ARG  24           HE       ARG  24  -7.701  -8.376  -1.309
    6   HH11  ARG  24          HH11      ARG  24  -9.360  -9.023   1.692
    7   HH12  ARG  24          HH12      ARG  24 -10.865  -8.360   1.148
    8   HH21  ARG  24          HH21      ARG  24  -9.678  -7.504  -2.026
    9   HH22  ARG  24          HH22      ARG  24 -11.046  -7.498  -0.963
   10    H    ARG  24           HN       ARG  24  -2.234  -8.127   0.398
   11    HB3  ARG  24           HB1      ARG  24  -4.213  -8.982  -0.925
   12    HG3  ARG  24           HG1      ARG  24  -5.748 -10.787   0.370
   13    HD3  ARG  24           HD1      ARG  24  -6.878  -8.497   1.261

  No H/Q in entry =          13
  In of MODEL   28
    1    HA   THR  25           HA       THR  25  -1.732 -12.794   1.196
    2    HB   THR  25           HB       THR  25  -0.800 -12.290   3.416
    3    HG1  THR  25           HG1      THR  25  -0.247 -14.283   2.700
    4   HG23  THR  25          HG21      THR  25  -1.806 -13.061   5.442
    5   HG22  THR  25          HG22      THR  25  -3.181 -13.725   4.560
    6   HG21  THR  25          HG23      THR  25  -2.935 -11.980   4.626
    7    H    THR  25           HN       THR  25  -2.928 -10.861   2.934

  No H/Q in entry =           7
  In of MODEL   28
    1    HA   SER  26           HA       SER  26  -6.110 -14.371   1.400
    2    HB2  SER  26           HB2      SER  26  -6.403 -16.096   3.406
    3    HG   SER  26           HG       SER  26  -4.771 -16.168   4.745
    4    H    SER  26           HN       SER  26  -4.721 -12.565   3.020
    5    HB3  SER  26           HB1      SER  26  -5.113 -16.276   2.217

  No H/Q in entry =           5
  In of MODEL   28
    1    HA   VAL  27           HA       VAL  27  -8.676 -12.483   4.626
    2    HB   VAL  27           HB       VAL  27  -8.156 -14.220   6.281
    3    H    VAL  27           HN       VAL  27  -5.783 -13.031   4.639

  No H/Q in entry =           3
  In of MODEL   28
    1    HA   SER  28           HA       SER  28  -6.259  -8.997   6.890
    2    HB2  SER  28           HB2      SER  28  -3.714 -10.155   5.861
    3    HG   SER  28           HG       SER  28  -4.252 -10.452   8.019
    4    H    SER  28           HN       SER  28  -5.500 -11.446   5.765
    5    HB3  SER  28           HB1      SER  28  -3.772  -8.411   6.112

  No H/Q in entry =           5
  In of MODEL   28
    1    HA   SER  29           HA       SER  29  -5.369  -6.343   3.251
    2    HB2  SER  29           HB2      SER  29  -7.571  -5.655   2.606
    3    HG   SER  29           HG       SER  29  -9.267  -5.582   4.021
    4    H    SER  29           HN       SER  29  -5.617  -6.825   6.004
    5    HB3  SER  29           HB1      SER  29  -7.724  -7.266   3.307

  No H/Q in entry =           5
  In of MODEL   28
    1    HA   HIS  30           HA       HIS  30  -4.714  -2.713   5.748
    2    HB2  HIS  30           HB2      HIS  30  -2.193  -3.538   4.407
    3    HD1  HIS  30           HD1      HIS  30  -0.202  -3.304   6.278
    4    HD2  HIS  30           HD2      HIS  30  -4.125  -3.272   7.648
    5    HE1  HIS  30           HE1      HIS  30  -0.062  -3.840   8.732
    6    HE2  HIS  30           HE2      HIS  30  -2.440  -3.728   9.556
    7    H    HIS  30           HN       HIS  30  -3.917  -4.794   3.901
    8    HB3  HIS  30           HB1      HIS  30  -2.342  -1.840   4.849

  No H/Q in entry =           8
  In of MODEL   28
    1    HA   TYR  31           HA       TYR  31  -4.874  -1.846   0.516
    2    HB2  TYR  31           HB2      TYR  31  -6.510  -0.325   2.558
    3    HD1  TYR  31           HD1      TYR  31  -8.114  -1.593   3.606
    4    HD2  TYR  31           HD2      TYR  31  -6.944  -2.647  -0.347
    5    HE1  TYR  31           HE1      TYR  31  -9.740  -3.438   3.622
    6    HE2  TYR  31           HE2      TYR  31  -8.568  -4.494  -0.341
    7    HH   TYR  31           HH       TYR  31 -10.651  -5.112   0.821
    8    H    TYR  31           HN       TYR  31  -4.334  -3.147   2.301
    9    HB3  TYR  31           HB1      TYR  31  -6.672  -0.190   0.810

  No H/Q in entry =           9
  In of MODEL   28
    1    HA   CYS  32           HA       CYS  32  -2.813   2.055   1.170
    2    HB2  CYS  32           HB2      CYS  32  -2.729   1.021  -1.611
    3    H    CYS  32           HN       CYS  32  -4.840   0.511  -0.300
    4    HB3  CYS  32           HB1      CYS  32  -2.143   2.663  -1.364

  No H/Q in entry =           4
  In of MODEL   28
    1    HA   THR  33           HA       THR  33  -5.802   5.157   0.499
    2    HB   THR  33           HB       THR  33  -5.029   5.839   2.670
    3    HG1  THR  33           HG1      THR  33  -4.753   8.052   0.923
    4   HG21  THR  33          HG21      THR  33  -2.491   6.011   1.487
    5   HG23  THR  33          HG22      THR  33  -2.931   6.297   3.171
    6   HG22  THR  33          HG23      THR  33  -2.914   7.637   2.024
    7    H    THR  33           HN       THR  33  -3.329   4.123   1.463

  No H/Q in entry =           7
  In of MODEL   28
    1    HA3  GLY  34           HA2      GLY  34  -1.889   5.982  -2.746
    2    H    GLY  34           HN       GLY  34  -2.469   5.431  -0.503
    3    HA2  GLY  34           HA1      GLY  34  -3.370   6.919  -2.869

  No H/Q in entry =           3
  In of MODEL   28
    1    HA   ARG  35           HA       ARG  35  -0.545   9.904  -0.999
    2    HB2  ARG  35           HB2      ARG  35  -1.996   9.813   1.007
    3    HG2  ARG  35           HG2      ARG  35  -0.560  11.107   2.576
    4    HD2  ARG  35           HD2      ARG  35   0.191  12.756   0.601
    5    HE   ARG  35           HE       ARG  35  -2.282  12.415   1.986
    6   HH11  ARG  35          HH11      ARG  35  -0.719  14.201  -0.572
    7   HH12  ARG  35          HH12      ARG  35  -1.783  15.560  -0.444
    8   HH21  ARG  35          HH21      ARG  35  -3.683  14.202   2.157
    9   HH22  ARG  35          HH22      ARG  35  -3.466  15.562   1.106
   10    H    ARG  35           HN       ARG  35  -1.279   7.199  -0.096
   11    HB3  ARG  35           HB1      ARG  35  -0.766   8.865   1.832
   12    HG3  ARG  35           HG1      ARG  35   0.808  10.780   1.509
   13    HD3  ARG  35           HD1      ARG  35  -0.937  11.732  -0.288

  No H/Q in entry =          13
  In of MODEL   28
    1    HA   SER  36           HA       SER  36   3.299   7.487  -0.468
    2    HB2  SER  36           HB2      SER  36   3.342   8.704   1.648
    3    HG   SER  36           HG       SER  36   5.241   7.606   1.199
    4    H    SER  36           HN       SER  36   0.627   6.923   0.420
    5    HB3  SER  36           HB1      SER  36   2.746   7.282   2.503

  No H/Q in entry =           5
  In of MODEL   28
    1    HA   CYS  37           HA       CYS  37   3.437   3.182  -0.573
    2    HB2  CYS  37           HB2      CYS  37   5.873   4.116  -1.221
    3    H    CYS  37           HN       CYS  37   4.772   5.648  -0.058
    4    HB3  CYS  37           HB1      CYS  37   6.305   3.154   0.188

  No H/Q in entry =           4
  In of MODEL   28
    1    HA   GLU  38           HA       GLU  38   5.133   2.519   3.925
    2    HB2  GLU  38           HB2      GLU  38   5.593   5.045   4.318
    3    HG2  GLU  38           HG2      GLU  38   4.897   4.570   6.906
    4    H    GLU  38           HN       GLU  38   4.719   4.717   2.264
    5    HB3  GLU  38           HB1      GLU  38   3.956   5.080   4.957
    6    HG3  GLU  38           HG1      GLU  38   5.029   2.935   6.259

  No H/Q in entry =           6
  In of MODEL   28
    1    HA   CYS  39           HA       CYS  39   0.893   1.572   4.592
    2    HB2  CYS  39           HB2      CYS  39   2.092  -0.365   3.127
    3    H    CYS  39           HN       CYS  39   3.761   0.951   4.418
    4    HB3  CYS  39           HB1      CYS  39   1.769  -1.254   4.612

  No H/Q in entry =           4
  In of MODEL   28
    1    HA   PRO  40           HA       PRO  40   2.051   1.011   9.010
    2    HB2  PRO  40           HB2      PRO  40   0.135   2.680   9.966
    3    HG2  PRO  40           HG2      PRO  40  -0.933   3.215   7.975
    4    HD2  PRO  40           HD2      PRO  40   0.038   2.808   5.924
    5    HB3  PRO  40           HB1      PRO  40   1.705   3.251   9.390
    6    HG3  PRO  40           HG1      PRO  40   0.293   4.496   8.024
    7    HD3  PRO  40           HD1      PRO  40   1.604   3.476   6.425

  No H/Q in entry =           7
  In of MODEL   28
    1    HA   SER  41           HA       SER  41  -1.245  -1.655   9.940
    2    HB2  SER  41           HB2      SER  41   0.638  -2.050  11.689
    3    HG   SER  41           HG       SER  41  -0.512  -3.777  11.926
    4    H    SER  41           HN       SER  41   0.722   0.267  10.853
    5    HB3  SER  41           HB1      SER  41  -0.461  -1.255  12.816

  No H/Q in entry =           5
  In of MODEL   28
    1    HA   TYR  42           HA       TYR  42  -4.569   0.734  11.391
    2    HB2  TYR  42           HB2      TYR  42  -2.681   2.605  11.633
    3    HD1  TYR  42           HD1      TYR  42  -6.302   3.184  10.878
    4    HD2  TYR  42           HD2      TYR  42  -3.178   3.309  13.763
    5    HE1  TYR  42           HE1      TYR  42  -7.888   4.044  12.549
    6    HE2  TYR  42           HE2      TYR  42  -4.755   4.168  15.442
    7    HH   TYR  42           HH       TYR  42  -7.732   3.903  15.476
    8    H    TYR  42           HN       TYR  42  -2.446   0.575   9.410
    9    HB3  TYR  42           HB1      TYR  42  -3.624   3.360  10.353

  No H/Q in entry =           9
  In of MODEL   28
    1    HA   PRO  43           HA       PRO  43  -5.955   0.750   6.934
    2    HB2  PRO  43           HB2      PRO  43  -7.735  -1.279   7.186
    3    HG2  PRO  43           HG2      PRO  43  -7.475  -1.741   9.447
    4    HD2  PRO  43           HD2      PRO  43  -5.667  -0.967  10.646
    5    HB3  PRO  43           HB1      PRO  43  -6.024  -1.547   6.835
    6    HG3  PRO  43           HG1      PRO  43  -6.251  -2.827   8.764
    7    HD3  PRO  43           HD1      PRO  43  -4.505  -1.464   9.399

  No H/Q in entry =           7
  In of MODEL   28
    1    HA3  GLY  44           HA2      GLY  44  -9.847   2.432   8.061
    2    H    GLY  44           HN       GLY  44  -8.435   0.589   6.248
    3    HA2  GLY  44           HA1      GLY  44 -10.106   2.320   6.326

  No H/Q in entry =           3
  In of MODEL   28
    1    HA   ASN  45           HA       ASN  45 -12.949  -0.613   8.350
    2    HB2  ASN  45           HB2      ASN  45 -13.658   1.654  10.206
    3   HD21  ASN  45          HD21      ASN  45 -13.724  -1.789  10.751
    4   HD22  ASN  45          HD22      ASN  45 -12.360  -1.845  11.810
    5    H    ASN  45           HN       ASN  45 -12.012   2.152   8.577
    6    HB3  ASN  45           HB1      ASN  45 -14.635   0.192  10.107

  No H/Q in entry =           6
  In of MODEL   28
    1    HA3  GLY  46           HA2      GLY  46 -16.561   0.978   6.346
    2    H    GLY  46           HN       GLY  46 -14.844  -1.171   7.379
    3    HA2  GLY  46           HA1      GLY  46 -15.899  -0.193   5.215

  No H/Q in entry =           3
  In of MODEL   29
    1    H1   ALA   1           HT2      ALA   1  15.696  13.623  -1.146
    2    H2   ALA   1           HT1      ALA   1  16.759  14.968  -1.239
    3    H3   ALA   1           HT3      ALA   1  15.063  15.215  -1.255
    4    HA   ALA   1           HA       ALA   1  14.837  14.229  -3.334
    5    HB1  ALA   1           HB1      ALA   1  17.274  15.832  -3.838
    6    HB3  ALA   1           HB2      ALA   1  15.968  16.612  -2.946
    7    HB2  ALA   1           HB3      ALA   1  15.666  15.952  -4.553

  No H/Q in entry =           7
  In of MODEL   29
    1    HA   MET   2           HA       MET   2  17.739  11.406  -4.877
    2    HB2  MET   2           HB2      MET   2  18.105  11.300  -2.246
    3    H    MET   2           HN       MET   2  15.315  12.043  -3.470
    4    HG2  MET   2           HG2      MET   2  19.117   9.452  -4.350
    5    HE1  MET   2           HE1      MET   2  19.560  10.613  -0.885
    6    HB3  MET   2           HB1      MET   2  17.346   9.727  -2.446
    7    HE3  MET   2           HE2      MET   2  21.070   9.783  -0.504
    8    HE2  MET   2           HE3      MET   2  19.536   9.137   0.081
    9    HG3  MET   2           HG1      MET   2  19.965  10.712  -3.455

  No H/Q in entry =           9
  In of MODEL   29
    1    HA   ASP   3           HA       ASP   3  14.909   7.781  -5.058
    2    HB2  ASP   3           HB2      ASP   3  13.483   7.885  -2.396
    3    H    ASP   3           HN       ASP   3  15.278   9.716  -2.918
    4    HB3  ASP   3           HB1      ASP   3  13.627   6.506  -3.482

  No H/Q in entry =           4
  In of MODEL   29
    1    HA   CYS   4           HA       CYS   4  10.608   9.385  -5.158
    2    HB2  CYS   4           HB2      CYS   4   9.951   8.720  -7.544
    3    H    CYS   4           HN       CYS   4  12.333   7.074  -4.961
    4    HB3  CYS   4           HB1      CYS   4  11.471   9.584  -7.341

  No H/Q in entry =           4
  In of MODEL   29
    1    HA   THR   5           HA       THR   5   7.951   6.819  -2.639
    2    HB   THR   5           HB       THR   5   7.011   5.961  -5.317
    3    HG1  THR   5           HG1      THR   5   7.335   7.932  -6.028
    4   HG23  THR   5          HG21      THR   5   5.292   5.537  -3.957
    5   HG22  THR   5          HG22      THR   5   4.956   7.260  -4.126
    6   HG21  THR   5          HG23      THR   5   5.853   6.669  -2.727
    7    H    THR   5           HN       THR   5   9.568   8.185  -3.470

  No H/Q in entry =           7
  In of MODEL   29
    1    HA   THR   6           HA       THR   6   9.025   2.628  -3.249
    2    HB   THR   6           HB       THR   6  11.345   3.146  -1.472
    3    HG1  THR   6           HG1      THR   6  12.409   4.258  -3.177
    4   HG23  THR   6          HG21      THR   6  12.570   1.908  -3.098
    5   HG22  THR   6          HG22      THR   6  11.225   1.977  -4.237
    6   HG21  THR   6          HG23      THR   6  11.076   1.039  -2.751
    7    H    THR   6           HN       THR   6   8.782   5.068  -1.695

  No H/Q in entry =           7
  In of MODEL   29
    1    HA3  GLY   7           HA2      GLY   7   9.169   0.143   0.566
    2    H    GLY   7           HN       GLY   7   8.935   0.731  -1.988
    3    HA2  GLY   7           HA1      GLY   7   7.750   1.177   0.650

  No H/Q in entry =           3
  In of MODEL   29
    1    HA   PRO   8           HA       PRO   8   6.121  -3.078   0.063
    2    HB2  PRO   8           HB2      PRO   8   3.884  -2.705   1.543
    3    HG2  PRO   8           HG2      PRO   8   4.112  -0.446   2.028
    4    HD2  PRO   8           HD2      PRO   8   6.109   0.662   1.741
    5    HB3  PRO   8           HB1      PRO   8   5.446  -3.116   2.262
    6    HG3  PRO   8           HG1      PRO   8   4.973  -1.149   3.410
    7    HD3  PRO   8           HD1      PRO   8   7.042  -0.610   2.555

  No H/Q in entry =           7
  In of MODEL   29
    1    HA   CYS   9           HA       CYS   9   2.571  -1.172  -2.131
    2    HB2  CYS   9           HB2      CYS   9   1.752   0.080   0.125
    3    H    CYS   9           HN       CYS   9   4.185  -0.085   0.064
    4    HB3  CYS   9           HB1      CYS   9   1.872   1.457  -0.965

  No H/Q in entry =           4
  In of MODEL   29
    1    HA   CYS  10           HA       CYS  10   4.700   1.918  -4.468
    2    HB2  CYS  10           HB2      CYS  10   7.219   1.283  -2.925
    3    H    CYS  10           HN       CYS  10   5.205  -0.404  -2.730
    4    HB3  CYS  10           HB1      CYS  10   7.131   2.491  -4.202

  No H/Q in entry =           4
  In of MODEL   29
    1    HA   ARG  11           HA       ARG  11   7.426  -0.652  -7.052
    2    HB2  ARG  11           HB2      ARG  11   5.065   0.283  -8.000
    3    HG2  ARG  11           HG2      ARG  11   7.085  -1.563  -9.101
    4    HD2  ARG  11           HD2      ARG  11   4.669  -0.767 -10.713
    5    HE   ARG  11           HE       ARG  11   6.491  -2.949 -10.951
    6   HH11  ARG  11          HH11      ARG  11   4.563  -0.691 -12.785
    7   HH12  ARG  11          HH12      ARG  11   4.423  -1.735 -14.159
    8   HH21  ARG  11          HH21      ARG  11   6.307  -4.323 -12.758
    9   HH22  ARG  11          HH22      ARG  11   5.412  -3.797 -14.144
   10    H    ARG  11           HN       ARG  11   6.646   1.995  -6.152
   11    HB3  ARG  11           HB1      ARG  11   6.171   0.959  -9.188
   12    HG3  ARG  11           HG1      ARG  11   5.389  -1.838  -8.699
   13    HD3  ARG  11           HD1      ARG  11   6.309  -0.227 -11.073

  No H/Q in entry =          13
  In of MODEL   29
    1    HA   GLN  12           HA       GLN  12  10.731   1.247  -9.104
    2    HB2  GLN  12           HB2      GLN  12  11.050   1.128 -11.555
    3    HG2  GLN  12           HG2      GLN  12   8.138   0.520 -11.517
    4   HE21  GLN  12          HE21      GLN  12   7.159  -0.681 -13.114
    5   HE22  GLN  12          HE22      GLN  12   8.009  -1.848 -14.062
    6    H    GLN  12           HN       GLN  12   8.280  -0.036  -9.591
    7    HB3  GLN  12           HB1      GLN  12  10.508  -0.398 -10.868
    8    HG3  GLN  12           HG1      GLN  12   9.070   1.504 -12.644

  No H/Q in entry =           8
  In of MODEL   29
    1    HA   CYS  13           HA       CYS  13   9.848   5.524  -8.188
    2    HB2  CYS  13           HB2      CYS  13  11.430   5.070 -10.273
    3    H    CYS  13           HN       CYS  13  10.164   3.272  -8.170
    4    HB3  CYS  13           HB1      CYS  13  10.022   5.636 -11.165

  No H/Q in entry =           4
  In of MODEL   29
    1    HA   LYS  14           HA       LYS  14   5.613   5.815  -9.136
    2    HB2  LYS  14           HB2      LYS  14   6.272   4.346 -11.204
    3    HG2  LYS  14           HG2      LYS  14   4.081   5.828 -10.688
    4    HD2  LYS  14           HD2      LYS  14   3.038   3.098 -11.426
    5    HE2  LYS  14           HE2      LYS  14   1.284   5.274 -10.479
    6    HZ1  LYS  14           HZ1      LYS  14   0.812   2.879 -11.482
    7    HZ3  LYS  14           HZ2      LYS  14   0.792   3.767 -12.921
    8    HZ2  LYS  14           HZ3      LYS  14  -0.267   4.170 -11.666
    9    H    LYS  14           HN       LYS  14   7.548   3.859  -8.317
   10    HB3  LYS  14           HB1      LYS  14   5.252   3.139 -10.432
   11    HG3  LYS  14           HG1      LYS  14   4.356   4.954 -12.197
   12    HD3  LYS  14           HD1      LYS  14   2.887   3.817  -9.821
   13    HE3  LYS  14           HE1      LYS  14   1.981   5.480 -12.085

  No H/Q in entry =          13
  In of MODEL   29
    1    HA   LEU  15           HA       LEU  15   4.018   3.679  -5.644
    2    HB2  LEU  15           HB2      LEU  15   3.684   6.211  -5.259
    3    HG   LEU  15           HG       LEU  15   3.040   4.222  -3.633
    4   HD12  LEU  15          HD11      LEU  15   1.853   6.184  -2.240
    5   HD11  LEU  15          HD12      LEU  15   2.634   7.140  -3.499
    6   HD13  LEU  15          HD13      LEU  15   3.597   6.076  -2.475
    7   HD21  LEU  15          HD21      LEU  15   0.474   5.115  -4.795
    8   HD23  LEU  15          HD22      LEU  15   0.517   4.890  -3.047
    9   HD22  LEU  15          HD23      LEU  15   0.933   3.553  -4.118
   10    H    LEU  15           HN       LEU  15   4.252   5.833  -7.485
   11    HB3  LEU  15           HB1      LEU  15   2.059   5.944  -5.861

  No H/Q in entry =          11
  In of MODEL   29
    1    HA   LYS  16           HA       LYS  16   0.883   1.366  -7.497
    2    HB2  LYS  16           HB2      LYS  16   0.464   0.824  -4.554
    3    HG2  LYS  16           HG2      LYS  16   2.631   0.061  -5.429
    4    HD2  LYS  16           HD2      LYS  16   0.864  -1.263  -7.449
    5    HE2  LYS  16           HE2      LYS  16   2.770  -2.714  -8.051
    6    HZ2  LYS  16           HZ1      LYS  16   2.314  -4.367  -6.503
    7    HZ1  LYS  16           HZ2      LYS  16   0.914  -3.418  -6.476
    8    HZ3  LYS  16           HZ3      LYS  16   2.058  -3.271  -5.239
    9    H    LYS  16           HN       LYS  16   2.235   2.349  -5.209
   10    HB3  LYS  16           HB1      LYS  16  -0.350  -0.055  -5.841
   11    HG3  LYS  16           HG1      LYS  16   1.579  -1.273  -4.952
   12    HD3  LYS  16           HD1      LYS  16   2.363  -0.364  -7.695
   13    HE3  LYS  16           HE1      LYS  16   3.600  -2.190  -6.586

  No H/Q in entry =          13
  In of MODEL   29
    1    HA   PRO  17           HA       PRO  17  -2.788   3.800  -7.610
    2    HB2  PRO  17           HB2      PRO  17  -4.650   1.983  -8.390
    3    HG2  PRO  17           HG2      PRO  17  -3.467   0.026  -7.984
    4    HD2  PRO  17           HD2      PRO  17  -1.186   0.027  -7.658
    5    HB3  PRO  17           HB1      PRO  17  -3.412   2.619  -9.480
    6    HG3  PRO  17           HG1      PRO  17  -2.980   0.341  -9.660
    7    HD3  PRO  17           HD1      PRO  17  -0.891   1.099  -9.043

  No H/Q in entry =           7
  In of MODEL   29
    1    HA   ALA  18           HA       ALA  18  -4.680   3.435  -3.727
    2    HB2  ALA  18           HB1      ALA  18  -6.420   4.994  -3.399
    3    HB3  ALA  18           HB2      ALA  18  -6.848   4.992  -5.110
    4    HB1  ALA  18           HB3      ALA  18  -5.336   5.729  -4.580
    5    H    ALA  18           HN       ALA  18  -4.468   4.429  -6.329

  No H/Q in entry =           5
  In of MODEL   29
    1    HA3  GLY  19           HA2      GLY  19  -8.018   0.706  -2.620
    2    H    GLY  19           HN       GLY  19  -5.936   1.938  -2.760
    3    HA2  GLY  19           HA1      GLY  19  -8.051   0.666  -4.376

  No H/Q in entry =           3
  In of MODEL   29
    1    HA   THR  20           HA       THR  20  -5.368  -2.778  -4.609
    2    HB   THR  20           HB       THR  20  -2.865  -1.085  -4.464
    3    HG1  THR  20           HG1      THR  20  -4.445  -1.943  -6.652
    4   HG23  THR  20          HG21      THR  20  -1.714  -2.852  -5.561
    5   HG22  THR  20          HG22      THR  20  -3.194  -3.799  -5.711
    6   HG21  THR  20          HG23      THR  20  -2.483  -3.519  -4.121
    7    H    THR  20           HN       THR  20  -5.155   0.020  -4.489

  No H/Q in entry =           7
  In of MODEL   29
    1    HA   THR  21           HA       THR  21  -4.916  -3.700  -0.371
    2    HB   THR  21           HB       THR  21  -4.493  -6.310  -0.301
    3    HG1  THR  21           HG1      THR  21  -4.125  -6.310  -2.636
    4   HG23  THR  21          HG21      THR  21  -6.556  -5.988   0.485
    5   HG22  THR  21          HG22      THR  21  -7.065  -6.461  -1.136
    6   HG21  THR  21          HG23      THR  21  -6.933  -4.753  -0.716
    7    H    THR  21           HN       THR  21  -5.199  -4.300  -3.103

  No H/Q in entry =           7
  In of MODEL   29
    1    HA   CYS  22           HA       CYS  22  -0.598  -3.447  -0.044
    2    HB2  CYS  22           HB2      CYS  22  -1.362  -3.958   2.835
    3    H    CYS  22           HN       CYS  22  -3.214  -3.685   0.989
    4    HB3  CYS  22           HB1      CYS  22   0.113  -3.200   2.245

  No H/Q in entry =           4
  In of MODEL   29
    1    HA   TRP  23           HA       TRP  23   0.159  -7.757   1.284
    2    HB2  TRP  23           HB2      TRP  23  -0.668  -7.268   3.735
    3    HD1  TRP  23           HD1      TRP  23   0.500 -10.057   1.489
    4    HE1  TRP  23           HE1      TRP  23   2.017 -11.653   2.822
    5    HE3  TRP  23           HE3      TRP  23  -0.363  -8.256   6.196
    6    HZ2  TRP  23           HZ2      TRP  23   2.750 -12.091   5.512
    7    HZ3  TRP  23           HZ3      TRP  23   0.786  -9.320   8.094
    8    HH2  TRP  23           HH2      TRP  23   2.309 -11.198   7.758
    9    H    TRP  23           HN       TRP  23  -2.060  -5.975   2.002
   10    HB3  TRP  23           HB1      TRP  23  -1.899  -8.463   3.340

  No H/Q in entry =          10
  In of MODEL   29
    1    HA   ARG  24           HA       ARG  24  -4.965  -8.611   0.120
    2    HB2  ARG  24           HB2      ARG  24  -3.388  -7.981  -1.781
    3    HG2  ARG  24           HG2      ARG  24  -5.405 -10.137  -1.868
    4    HD2  ARG  24           HD2      ARG  24  -3.184 -10.356  -3.526
    5    HE   ARG  24           HE       ARG  24  -5.205  -9.640  -5.441
    6   HH11  ARG  24          HH11      ARG  24  -2.432  -8.514  -3.646
    7   HH12  ARG  24          HH12      ARG  24  -2.051  -7.261  -4.779
    8   HH21  ARG  24          HH21      ARG  24  -4.705  -7.992  -6.932
    9   HH22  ARG  24          HH22      ARG  24  -3.342  -6.964  -6.644
   10    H    ARG  24           HN       ARG  24  -3.342  -7.471   1.232
   11    HB3  ARG  24           HB1      ARG  24  -2.782  -9.629  -1.693
   12    HG3  ARG  24           HG1      ARG  24  -5.343  -8.600  -2.732
   13    HD3  ARG  24           HD1      ARG  24  -4.755 -11.122  -3.752

  No H/Q in entry =          13
  In of MODEL   29
    1    HA   THR  25           HA       THR  25  -4.170 -12.726   1.549
    2    HB   THR  25           HB       THR  25  -4.802 -11.967   4.340
    3    HG1  THR  25           HG1      THR  25  -2.712 -11.053   4.598
    4   HG22  THR  25          HG21      THR  25  -2.286 -13.147   4.172
    5   HG21  THR  25          HG22      THR  25  -3.276 -13.974   2.969
    6   HG23  THR  25          HG23      THR  25  -3.801 -13.911   4.651
    7    H    THR  25           HN       THR  25  -4.977  -9.950   2.124

  No H/Q in entry =           7
  In of MODEL   29
    1    HA   SER  26           HA       SER  26  -8.167 -14.247   2.127
    2    HB2  SER  26           HB2      SER  26  -7.006 -16.207   3.121
    3    HG   SER  26           HG       SER  26  -8.860 -17.121   3.652
    4    H    SER  26           HN       SER  26  -5.604 -14.146   3.292
    5    HB3  SER  26           HB1      SER  26  -7.258 -15.513   4.723

  No H/Q in entry =           5
  In of MODEL   29
    1    HA   VAL  27           HA       VAL  27  -9.335 -11.129   5.244
    2    HB   VAL  27           HB       VAL  27 -10.015 -13.145   6.473
    3    H    VAL  27           HN       VAL  27  -6.938 -12.696   5.005

  No H/Q in entry =           3
  In of MODEL   29
    1    HA   SER  28           HA       SER  28  -6.229  -8.626   6.994
    2    HB2  SER  28           HB2      SER  28  -4.339 -10.506   5.625
    3    HG   SER  28           HG       SER  28  -3.631 -10.691   7.826
    4    H    SER  28           HN       SER  28  -6.891 -10.221   4.648
    5    HB3  SER  28           HB1      SER  28  -3.720  -9.002   6.305

  No H/Q in entry =           5
  In of MODEL   29
    1    HA   SER  29           HA       SER  29  -5.873  -6.712   2.729
    2    HB2  SER  29           HB2      SER  29  -8.845  -6.411   3.215
    3    HG   SER  29           HG       SER  29  -7.291  -7.945   1.419
    4    H    SER  29           HN       SER  29  -7.605  -8.011   4.578
    5    HB3  SER  29           HB1      SER  29  -7.977  -5.686   1.861

  No H/Q in entry =           5
  In of MODEL   29
    1    HA   HIS  30           HA       HIS  30  -5.663  -3.057   5.152
    2    HB2  HIS  30           HB2      HIS  30  -3.063  -3.742   3.914
    3    HD1  HIS  30           HD1      HIS  30  -1.916  -1.850   6.433
    4    HD2  HIS  30           HD2      HIS  30  -4.396  -5.183   6.503
    5    HE1  HIS  30           HE1      HIS  30  -1.683  -2.813   8.745
    6    HE2  HIS  30           HE2      HIS  30  -3.260  -4.778   8.791
    7    H    HIS  30           HN       HIS  30  -4.788  -4.895   3.048
    8    HB3  HIS  30           HB1      HIS  30  -3.279  -2.053   4.359

  No H/Q in entry =           8
  In of MODEL   29
    1    HA   TYR  31           HA       TYR  31  -5.700  -1.888  -0.017
    2    HB2  TYR  31           HB2      TYR  31  -7.339  -0.359   2.011
    3    HD1  TYR  31           HD1      TYR  31  -7.982  -2.768  -0.772
    4    HD2  TYR  31           HD2      TYR  31  -8.707  -1.714   3.285
    5    HE1  TYR  31           HE1      TYR  31  -9.565  -4.639  -0.575
    6    HE2  TYR  31           HE2      TYR  31 -10.291  -3.583   3.494
    7    HH   TYR  31           HH       TYR  31 -11.773  -4.996   1.265
    8    H    TYR  31           HN       TYR  31  -5.138  -3.261   1.706
    9    HB3  TYR  31           HB1      TYR  31  -7.552  -0.365   0.264

  No H/Q in entry =           9
  In of MODEL   29
    1    HA   CYS  32           HA       CYS  32  -2.538   1.081   0.524
    2    HB2  CYS  32           HB2      CYS  32  -2.688   0.256  -2.048
    3    H    CYS  32           HN       CYS  32  -4.340  -0.502  -0.918
    4    HB3  CYS  32           HB1      CYS  32  -3.163   1.941  -2.238

  No H/Q in entry =           4
  In of MODEL   29
    1    HA   THR  33           HA       THR  33  -4.807   4.705   1.171
    2    HB   THR  33           HB       THR  33  -2.838   5.109   2.552
    3    HG1  THR  33           HG1      THR  33  -3.538   7.444   1.106
    4   HG21  THR  33          HG21      THR  33  -1.632   6.381   0.109
    5   HG23  THR  33          HG22      THR  33  -1.063   4.925   0.925
    6   HG22  THR  33          HG23      THR  33  -0.983   6.484   1.745
    7    H    THR  33           HN       THR  33  -2.311   3.419   0.510

  No H/Q in entry =           7
  In of MODEL   29
    1    HA3  GLY  34           HA2      GLY  34  -2.837   5.627  -3.564
    2    H    GLY  34           HN       GLY  34  -2.318   5.014  -1.325
    3    HA2  GLY  34           HA1      GLY  34  -4.267   6.461  -2.975

  No H/Q in entry =           3
  In of MODEL   29
    1    HA   ARG  35           HA       ARG  35  -0.340   9.143  -3.129
    2    HB2  ARG  35           HB2      ARG  35  -0.517  10.726  -1.290
    3    HG2  ARG  35           HG2      ARG  35  -1.553   8.373   0.243
    4    HD2  ARG  35           HD2      ARG  35  -3.238  10.176   0.370
    5    HE   ARG  35           HE       ARG  35  -2.339  12.280   0.374
    6   HH11  ARG  35          HH11      ARG  35  -0.669  10.334   2.741
    7   HH12  ARG  35          HH12      ARG  35   0.212  11.670   3.402
    8   HH21  ARG  35          HH21      ARG  35  -1.180  14.038   1.242
    9   HH22  ARG  35          HH22      ARG  35  -0.078  13.773   2.551
   10    H    ARG  35           HN       ARG  35  -0.946   6.732  -1.783
   11    HB3  ARG  35           HB1      ARG  35  -2.093  10.033  -1.648
   12    HG3  ARG  35           HG1      ARG  35  -0.309   9.538   0.701
   13    HD3  ARG  35           HD1      ARG  35  -2.445   9.859   1.912

  No H/Q in entry =          13
  In of MODEL   29
    1    HA   SER  36           HA       SER  36   3.045   7.482  -0.611
    2    HB2  SER  36           HB2      SER  36   2.471   8.984   1.223
    3    HG   SER  36           HG       SER  36   4.388   7.882   1.546
    4    H    SER  36           HN       SER  36   0.147   7.229  -0.207
    5    HB3  SER  36           HB1      SER  36   1.607   7.686   2.046

  No H/Q in entry =           5
  In of MODEL   29
    1    HA   CYS  37           HA       CYS  37   3.152   3.216  -0.023
    2    HB2  CYS  37           HB2      CYS  37   5.732   4.272   0.455
    3    H    CYS  37           HN       CYS  37   4.272   5.768   0.581
    4    HB3  CYS  37           HB1      CYS  37   5.483   2.999   1.645

  No H/Q in entry =           4
  In of MODEL   29
    1    HA   GLU  38           HA       GLU  38   3.158   3.148   4.811
    2    HB2  GLU  38           HB2      GLU  38   2.198   6.015   4.892
    3    HG2  GLU  38           HG2      GLU  38   4.692   5.586   4.469
    4    H    GLU  38           HN       GLU  38   3.487   5.133   2.869
    5    HB3  GLU  38           HB1      GLU  38   2.396   4.960   6.285
    6    HG3  GLU  38           HG1      GLU  38   4.229   6.672   5.779

  No H/Q in entry =           6
  In of MODEL   29
    1    HA   CYS  39           HA       CYS  39  -0.962   2.159   3.361
    2    HB2  CYS  39           HB2      CYS  39   0.266  -0.139   4.850
    3    H    CYS  39           HN       CYS  39   1.608   1.640   4.339
    4    HB3  CYS  39           HB1      CYS  39  -1.461  -0.128   4.512

  No H/Q in entry =           4
  In of MODEL   29
    1    HA   PRO  40           HA       PRO  40  -3.348   3.885   6.629
    2    HB2  PRO  40           HB2      PRO  40  -5.318   1.716   6.081
    3    HG2  PRO  40           HG2      PRO  40  -5.493   2.208   3.812
    4    HD2  PRO  40           HD2      PRO  40  -3.460   1.117   3.836
    5    HB3  PRO  40           HB1      PRO  40  -5.562   3.465   6.156
    6    HG3  PRO  40           HG1      PRO  40  -4.746   3.805   4.011
    7    HD3  PRO  40           HD1      PRO  40  -2.895   2.683   3.219

  No H/Q in entry =           7
  In of MODEL   29
    1    HA   SER  41           HA       SER  41  -3.216   0.935   9.894
    2    HB2  SER  41           HB2      SER  41  -4.297   3.527  10.956
    3    HG   SER  41           HG       SER  41  -2.064   3.277  10.354
    4    H    SER  41           HN       SER  41  -4.662   3.159   8.619
    5    HB3  SER  41           HB1      SER  41  -4.055   2.159  12.041

  No H/Q in entry =           5
  In of MODEL   29
    1    HA   TYR  42           HA       TYR  42  -7.653   0.079  10.653
    2    HB2  TYR  42           HB2      TYR  42  -8.824   2.593   9.445
    3    HD1  TYR  42           HD1      TYR  42  -6.768   3.594  10.771
    4    HD2  TYR  42           HD2      TYR  42 -10.118   1.695  12.580
    5    HE1  TYR  42           HE1      TYR  42  -6.279   4.755  12.883
    6    HE2  TYR  42           HE2      TYR  42  -9.639   2.852  14.696
    7    HH   TYR  42           HH       TYR  42  -7.486   5.451  14.925
    8    H    TYR  42           HN       TYR  42  -6.354   2.247   9.158
    9    HB3  TYR  42           HB1      TYR  42  -9.739   1.372  10.323

  No H/Q in entry =           9
  In of MODEL   29
    1    HA   PRO  43           HA       PRO  43  -7.834  -1.556   6.365
    2    HB2  PRO  43           HB2      PRO  43  -7.988  -4.162   7.124
    3    HG2  PRO  43           HG2      PRO  43  -8.066  -3.879   9.428
    4    HD2  PRO  43           HD2      PRO  43  -7.473  -1.890  10.434
    5    HB3  PRO  43           HB1      PRO  43  -6.457  -3.291   6.972
    6    HG3  PRO  43           HG1      PRO  43  -6.313  -3.988   9.187
    7    HD3  PRO  43           HD1      PRO  43  -6.009  -1.715   9.445

  No H/Q in entry =           7
  In of MODEL   29
    1    HA3  GLY  44           HA2      GLY  44 -12.241  -1.887   7.670
    2    H    GLY  44           HN       GLY  44  -9.842  -2.138   9.179
    3    HA2  GLY  44           HA1      GLY  44 -11.943  -3.569   8.081

  No H/Q in entry =           3
  In of MODEL   29
    1    HA   ASN  45           HA       ASN  45 -13.481   0.345  11.327
    2    HB2  ASN  45           HB2      ASN  45 -15.028  -1.714  10.563
    3   HD21  ASN  45          HD21      ASN  45 -16.444  -0.024  10.566
    4   HD22  ASN  45          HD22      ASN  45 -17.178   0.596  12.002
    5    H    ASN  45           HN       ASN  45 -12.568  -0.365   9.370
    6    HB3  ASN  45           HB1      ASN  45 -14.433  -2.364  12.088

  No H/Q in entry =           6
  In of MODEL   29
    1    HA3  GLY  46           HA2      GLY  46 -10.161  -2.276  13.526
    2    H    GLY  46           HN       GLY  46 -10.756  -0.699  11.287
    3    HA2  GLY  46           HA1      GLY  46  -9.058  -1.138  12.767

  No H/Q in entry =           3
  In of MODEL   30
    1    H1   ALA   1           HT3      ALA   1  15.623   9.656  -7.014
    2    H2   ALA   1           HT2      ALA   1  16.650  10.573  -8.038
    3    H3   ALA   1           HT1      ALA   1  16.981   8.914  -7.750
    4    HA   ALA   1           HA       ALA   1  17.708   9.260  -5.659
    5    HB3  ALA   1           HB1      ALA   1  19.059  11.521  -5.872
    6    HB1  ALA   1           HB2      ALA   1  18.514  11.409  -7.545
    7    HB2  ALA   1           HB3      ALA   1  19.468  10.104  -6.839

  No H/Q in entry =           7
  In of MODEL   30
    1    HA   MET   2           HA       MET   2  16.134  13.445  -4.044
    2    HB2  MET   2           HB2      MET   2  16.166  14.774  -6.200
    3    H    MET   2           HN       MET   2  16.484  12.467  -6.644
    4    HG2  MET   2           HG2      MET   2  14.222  15.243  -4.008
    5    HE3  MET   2           HE1      MET   2  13.672  18.144  -3.814
    6    HB3  MET   2           HB1      MET   2  14.501  14.265  -6.445
    7    HE2  MET   2           HE2      MET   2  13.383  19.080  -5.281
    8    HE1  MET   2           HE3      MET   2  15.018  18.554  -4.877
    9    HG3  MET   2           HG1      MET   2  15.635  16.181  -4.488

  No H/Q in entry =           9
  In of MODEL   30
    1    HA   ASP   3           HA       ASP   3  12.393  10.854  -3.827
    2    HB2  ASP   3           HB2      ASP   3  11.393  12.517  -6.116
    3    H    ASP   3           HN       ASP   3  14.072  11.493  -6.081
    4    HB3  ASP   3           HB1      ASP   3  10.302  11.408  -5.289

  No H/Q in entry =           4
  In of MODEL   30
    1    HA   CYS   4           HA       CYS   4  10.755   7.788  -6.788
    2    HB2  CYS   4           HB2      CYS   4  13.126   7.320  -6.372
    3    H    CYS   4           HN       CYS   4  10.849   9.125  -4.330
    4    HB3  CYS   4           HB1      CYS   4  12.719   6.603  -4.817

  No H/Q in entry =           4
  In of MODEL   30
    1    HA   THR   5           HA       THR   5   9.279   6.431  -1.852
    2    HB   THR   5           HB       THR   5   7.216   6.159  -3.995
    3    HG1  THR   5           HG1      THR   5   7.966   8.646  -2.861
    4   HG21  THR   5          HG21      THR   5   7.151   6.049  -1.233
    5   HG23  THR   5          HG22      THR   5   5.770   6.191  -2.321
    6   HG22  THR   5          HG23      THR   5   6.498   7.639  -1.626
    7    H    THR   5           HN       THR   5  10.726   7.446  -3.284

  No H/Q in entry =           7
  In of MODEL   30
    1    HA   THR   6           HA       THR   6   9.256   2.230  -3.122
    2    HB   THR   6           HB       THR   6  11.664   2.104  -1.336
    3    HG1  THR   6           HG1      THR   6  11.659   3.077  -3.998
    4   HG21  THR   6          HG21      THR   6  10.894   0.735  -3.897
    5   HG23  THR   6          HG22      THR   6  11.082   0.013  -2.299
    6   HG22  THR   6          HG23      THR   6  12.493   0.626  -3.162
    7    H    THR   6           HN       THR   6   9.993   4.456  -1.339

  No H/Q in entry =           7
  In of MODEL   30
    1    HA3  GLY   7           HA2      GLY   7   8.704  -0.609   0.382
    2    H    GLY   7           HN       GLY   7   8.630   0.285  -2.134
    3    HA2  GLY   7           HA1      GLY   7   7.490   0.654   0.517

  No H/Q in entry =           3
  In of MODEL   30
    1    HA   PRO   8           HA       PRO   8   5.258  -3.241  -0.594
    2    HB2  PRO   8           HB2      PRO   8   3.115  -2.768   1.004
    3    HG2  PRO   8           HG2      PRO   8   3.716  -0.688   1.843
    4    HD2  PRO   8           HD2      PRO   8   5.870   0.115   1.679
    5    HB3  PRO   8           HB1      PRO   8   4.595  -3.539   1.587
    6    HG3  PRO   8           HG1      PRO   8   4.464  -1.742   3.058
    7    HD3  PRO   8           HD1      PRO   8   6.586  -1.418   2.217

  No H/Q in entry =           7
  In of MODEL   30
    1    HA   CYS   9           HA       CYS   9   2.072  -0.403  -2.328
    2    HB2  CYS   9           HB2      CYS   9   2.541   1.682  -0.262
    3    H    CYS   9           HN       CYS   9   4.158   0.097  -0.334
    4    HB3  CYS   9           HB1      CYS   9   1.712   2.184  -1.731

  No H/Q in entry =           4
  In of MODEL   30
    1    HA   CYS  10           HA       CYS  10   4.817   1.709  -5.050
    2    HB2  CYS  10           HB2      CYS  10   7.249   0.995  -3.398
    3    H    CYS  10           HN       CYS  10   4.899  -0.412  -3.025
    4    HB3  CYS  10           HB1      CYS  10   7.230   2.122  -4.750

  No H/Q in entry =           4
  In of MODEL   30
    1    HA   ARG  11           HA       ARG  11   6.075  -1.870  -7.269
    2    HB2  ARG  11           HB2      ARG  11   3.994  -0.355  -8.802
    3    HG2  ARG  11           HG2      ARG  11   3.976  -3.288  -8.279
    4    HD2  ARG  11           HD2      ARG  11   1.806  -1.195  -8.298
    5    HE   ARG  11           HE       ARG  11   1.608  -3.726  -7.331
    6   HH11  ARG  11          HH11      ARG  11   0.244  -2.067 -10.081
    7   HH12  ARG  11          HH12      ARG  11  -1.204  -3.016 -10.094
    8   HH21  ARG  11          HH21      ARG  11  -0.296  -4.976  -7.346
    9   HH22  ARG  11          HH22      ARG  11  -1.511  -4.667  -8.541
   10    H    ARG  11           HN       ARG  11   4.820   0.757  -6.967
   11    HB3  ARG  11           HB1      ARG  11   4.894  -1.638  -9.598
   12    HG3  ARG  11           HG1      ARG  11   3.581  -2.169  -6.973
   13    HD3  ARG  11           HD1      ARG  11   2.241  -2.208  -9.674

  No H/Q in entry =          13
  In of MODEL   30
    1    HA   GLN  12           HA       GLN  12  10.186  -0.437  -8.263
    2    HB2  GLN  12           HB2      GLN  12   8.983  -1.890 -10.108
    3    HG2  GLN  12           HG2      GLN  12  11.212  -0.108 -11.034
    4   HE21  GLN  12          HE21      GLN  12  12.864  -1.566 -12.124
    5   HE22  GLN  12          HE22      GLN  12  12.233  -2.755 -13.206
    6    H    GLN  12           HN       GLN  12   8.244  -1.069  -7.266
    7    HB3  GLN  12           HB1      GLN  12   8.866  -0.348 -10.943
    8    HG3  GLN  12           HG1      GLN  12  11.462  -1.427  -9.892

  No H/Q in entry =           8
  In of MODEL   30
    1    HA   CYS  13           HA       CYS  13   9.639   3.911  -7.070
    2    HB2  CYS  13           HB2      CYS  13  11.398   3.273  -8.990
    3    H    CYS  13           HN       CYS  13   9.631   1.638  -7.131
    4    HB3  CYS  13           HB1      CYS  13  10.237   4.161  -9.971

  No H/Q in entry =           4
  In of MODEL   30
    1    HA   LYS  14           HA       LYS  14   5.737   4.826  -8.817
    2    HB2  LYS  14           HB2      LYS  14   5.325   1.983  -9.761
    3    HG2  LYS  14           HG2      LYS  14   6.286   4.345 -11.358
    4    HD2  LYS  14           HD2      LYS  14   6.350   1.441 -12.116
    5    HE2  LYS  14           HE2      LYS  14   6.101   3.781 -13.957
    6    HZ3  LYS  14           HZ1      LYS  14   7.821   1.507 -14.509
    7    HZ2  LYS  14           HZ2      LYS  14   6.749   2.327 -15.528
    8    HZ1  LYS  14           HZ3      LYS  14   6.163   1.173 -14.440
    9    H    LYS  14           HN       LYS  14   7.173   2.585  -7.636
   10    HB3  LYS  14           HB1      LYS  14   4.381   3.381 -10.259
   11    HG3  LYS  14           HG1      LYS  14   7.336   3.068 -10.741
   12    HD3  LYS  14           HD1      LYS  14   4.946   2.456 -12.453
   13    HE3  LYS  14           HE1      LYS  14   7.671   3.366 -13.271

  No H/Q in entry =          13
  In of MODEL   30
    1    HA   LEU  15           HA       LEU  15   3.680   3.561  -5.079
    2    HB2  LEU  15           HB2      LEU  15   3.989   6.225  -5.147
    3    HG   LEU  15           HG       LEU  15   3.383   4.621  -3.140
    4   HD13  LEU  15          HD11      LEU  15   3.716   6.412  -1.802
    5   HD12  LEU  15          HD12      LEU  15   2.507   7.395  -2.628
    6   HD11  LEU  15          HD13      LEU  15   4.109   7.188  -3.335
    7   HD23  LEU  15          HD21      LEU  15   1.084   5.695  -2.311
    8   HD22  LEU  15          HD22      LEU  15   1.160   4.185  -3.218
    9   HD21  LEU  15          HD23      LEU  15   0.779   5.694  -4.048
   10    H    LEU  15           HN       LEU  15   4.652   5.364  -7.005
   11    HB3  LEU  15           HB1      LEU  15   2.265   6.140  -5.455

  No H/Q in entry =          11
  In of MODEL   30
    1    HA   LYS  16           HA       LYS  16   0.062   2.219  -7.055
    2    HB2  LYS  16           HB2      LYS  16   0.159   1.166  -4.276
    3    HG2  LYS  16           HG2      LYS  16  -0.476  -0.931  -5.791
    4    HD2  LYS  16           HD2      LYS  16   2.181  -0.865  -6.297
    5    HE2  LYS  16           HE2      LYS  16   2.481  -1.793  -4.006
    6    HZ1  LYS  16           HZ1      LYS  16   0.433  -2.713  -5.865
    7    HZ3  LYS  16           HZ2      LYS  16   0.449  -3.436  -4.336
    8    HZ2  LYS  16           HZ3      LYS  16   1.828  -3.498  -5.314
    9    H    LYS  16           HN       LYS  16   1.662   2.688  -4.710
   10    HB3  LYS  16           HB1      LYS  16  -1.369   1.029  -5.135
   11    HG3  LYS  16           HG1      LYS  16   0.272   0.086  -7.024
   12    HD3  LYS  16           HD1      LYS  16   2.063   0.339  -5.012
   13    HE3  LYS  16           HE1      LYS  16   0.817  -1.331  -3.650

  No H/Q in entry =          13
  In of MODEL   30
    1    HA   PRO  17           HA       PRO  17  -3.061   5.300  -6.745
    2    HB2  PRO  17           HB2      PRO  17  -5.028   3.063  -6.875
    3    HG2  PRO  17           HG2      PRO  17  -4.142   2.167  -8.833
    4    HD2  PRO  17           HD2      PRO  17  -2.573   1.437  -7.308
    5    HB3  PRO  17           HB1      PRO  17  -4.917   4.522  -7.866
    6    HG3  PRO  17           HG1      PRO  17  -3.235   3.646  -9.203
    7    HD3  PRO  17           HD1      PRO  17  -1.495   2.417  -8.323

  No H/Q in entry =           7
  In of MODEL   30
    1    HA   ALA  18           HA       ALA  18  -4.114   5.386  -2.538
    2    HB3  ALA  18           HB1      ALA  18  -5.997   7.437  -3.698
    3    HB1  ALA  18           HB2      ALA  18  -4.349   7.745  -3.149
    4    HB2  ALA  18           HB3      ALA  18  -5.586   7.249  -1.994
    5    H    ALA  18           HN       ALA  18  -4.259   6.285  -5.183

  No H/Q in entry =           5
  In of MODEL   30
    1    HA3  GLY  19           HA2      GLY  19  -7.316   3.024  -0.647
    2    H    GLY  19           HN       GLY  19  -5.294   3.986  -1.407
    3    HA2  GLY  19           HA1      GLY  19  -8.087   3.518  -2.147

  No H/Q in entry =           3
  In of MODEL   30
    1    HA   THR  20           HA       THR  20  -6.284  -0.424  -3.393
    2    HB   THR  20           HB       THR  20  -3.387   0.441  -3.501
    3    HG1  THR  20           HG1      THR  20  -5.504   0.776  -5.354
    4   HG23  THR  20          HG21      THR  20  -3.044  -1.616  -4.269
    5   HG22  THR  20          HG22      THR  20  -3.883  -1.071  -5.721
    6   HG21  THR  20          HG23      THR  20  -4.768  -1.932  -4.462
    7    H    THR  20           HN       THR  20  -5.001   1.894  -2.121

  No H/Q in entry =           7
  In of MODEL   30
    1    HA   THR  21           HA       THR  21  -5.377  -2.919   0.008
    2    HB   THR  21           HB       THR  21  -4.947  -5.375  -0.895
    3    HG1  THR  21           HG1      THR  21  -5.844  -5.662  -2.929
    4   HG21  THR  21          HG21      THR  21  -7.525  -3.866  -0.882
    5   HG23  THR  21          HG22      THR  21  -6.933  -5.080   0.252
    6   HG22  THR  21          HG23      THR  21  -7.465  -5.563  -1.358
    7    H    THR  21           HN       THR  21  -5.843  -2.507  -2.723

  No H/Q in entry =           7
  In of MODEL   30
    1    HA   CYS  22           HA       CYS  22  -1.008  -2.624  -0.110
    2    HB2  CYS  22           HB2      CYS  22  -1.534  -3.229   2.801
    3    H    CYS  22           HN       CYS  22  -3.555  -2.857   1.129
    4    HB3  CYS  22           HB1      CYS  22  -0.120  -2.444   2.106

  No H/Q in entry =           4
  In of MODEL   30
    1    HA   TRP  23           HA       TRP  23  -0.646  -7.097   0.621
    2    HB2  TRP  23           HB2      TRP  23  -0.118  -6.382   3.094
    3    HD1  TRP  23           HD1      TRP  23   1.376  -7.988   0.868
    4    HE1  TRP  23           HE1      TRP  23   2.586 -10.188   1.432
    5    HE3  TRP  23           HE3      TRP  23  -1.110  -9.204   5.167
    6    HZ2  TRP  23           HZ2      TRP  23   2.498 -12.177   3.434
    7    HZ3  TRP  23           HZ3      TRP  23  -0.486 -11.272   6.345
    8    HH2  TRP  23           HH2      TRP  23   1.281 -12.727   5.495
    9    H    TRP  23           HN       TRP  23  -2.460  -5.175   1.911
   10    HB3  TRP  23           HB1      TRP  23  -1.443  -7.475   3.483

  No H/Q in entry =          10
  In of MODEL   30
    1    HA   ARG  24           HA       ARG  24  -4.723  -8.827   0.307
    2    HB2  ARG  24           HB2      ARG  24  -4.010  -7.914  -2.110
    3    HG2  ARG  24           HG2      ARG  24  -6.130 -10.028  -1.805
    4    HD2  ARG  24           HD2      ARG  24  -6.352  -7.610  -3.526
    5    HE   ARG  24           HE       ARG  24  -7.717 -10.127  -3.338
    6   HH11  ARG  24          HH11      ARG  24  -6.950  -7.452  -5.444
    7   HH12  ARG  24          HH12      ARG  24  -8.324  -7.701  -6.467
    8   HH21  ARG  24          HH21      ARG  24  -9.525 -10.457  -4.683
    9   HH22  ARG  24          HH22      ARG  24  -9.786  -9.406  -6.036
   10    H    ARG  24           HN       ARG  24  -2.129  -8.017  -0.718
   11    HB3  ARG  24           HB1      ARG  24  -3.831  -9.638  -2.408
   12    HG3  ARG  24           HG1      ARG  24  -6.330  -8.335  -1.350
   13    HD3  ARG  24           HD1      ARG  24  -5.391  -8.971  -4.102

  No H/Q in entry =          13
  In of MODEL   30
    1    HA   THR  25           HA       THR  25  -3.697 -13.117   0.099
    2    HB   THR  25           HB       THR  25  -3.449 -13.874   2.508
    3    HG1  THR  25           HG1      THR  25  -3.930 -11.123   2.998
    4   HG23  THR  25          HG21      THR  25  -1.348 -13.105   2.617
    5   HG22  THR  25          HG22      THR  25  -1.833 -11.427   2.376
    6   HG21  THR  25          HG23      THR  25  -1.695 -12.512   0.993
    7    H    THR  25           HN       THR  25  -5.249 -10.819   0.955

  No H/Q in entry =           7
  In of MODEL   30
    1    HA   SER  26           HA       SER  26  -8.195 -13.536   1.717
    2    HB2  SER  26           HB2      SER  26  -7.000 -15.668   1.430
    3    HG   SER  26           HG       SER  26  -8.795 -16.072   3.560
    4    H    SER  26           HN       SER  26  -5.813 -12.659   2.895
    5    HB3  SER  26           HB1      SER  26  -6.677 -15.720   3.163

  No H/Q in entry =           5
  In of MODEL   30
    1    HA   VAL  27           HA       VAL  27  -8.527 -13.342   6.352
    2    HB   VAL  27           HB       VAL  27  -6.598 -14.670   7.090
    3    H    VAL  27           HN       VAL  27  -6.206 -13.551   4.622

  No H/Q in entry =           3
  In of MODEL   30
    1    HA   SER  28           HA       SER  28  -7.448  -8.957   6.095
    2    HB2  SER  28           HB2      SER  28  -4.538  -9.614   6.389
    3    HG   SER  28           HG       SER  28  -4.920  -8.975   8.452
    4    H    SER  28           HN       SER  28  -6.044 -11.287   4.999
    5    HB3  SER  28           HB1      SER  28  -5.041  -7.928   6.278

  No H/Q in entry =           5
  In of MODEL   30
    1    HA   SER  29           HA       SER  29  -5.423  -7.237   2.353
    2    HB2  SER  29           HB2      SER  29  -8.030  -5.833   2.284
    3    HG   SER  29           HG       SER  29  -9.237  -7.624   2.377
    4    H    SER  29           HN       SER  29  -6.415  -6.890   5.015
    5    HB3  SER  29           HB1      SER  29  -7.281  -6.883   1.081

  No H/Q in entry =           5
  In of MODEL   30
    1    HA   HIS  30           HA       HIS  30  -6.701  -2.908   5.203
    2    HB2  HIS  30           HB2      HIS  30  -4.011  -3.869   4.365
    3    HD1  HIS  30           HD1      HIS  30  -2.431  -2.624   6.573
    4    HD2  HIS  30           HD2      HIS  30  -6.295  -4.046   7.131
    5    HE1  HIS  30           HE1      HIS  30  -2.632  -3.074   9.039
    6    HE2  HIS  30           HE2      HIS  30  -4.950  -4.015   9.339
    7    H    HIS  30           HN       HIS  30  -7.074  -5.071   4.604
    8    HB3  HIS  30           HB1      HIS  30  -4.221  -2.135   4.584

  No H/Q in entry =           8
  In of MODEL   30
    1    HA   TYR  31           HA       TYR  31  -6.080  -0.619   1.324
    2    HB2  TYR  31           HB2      TYR  31  -7.699   0.935   3.346
    3    HD1  TYR  31           HD1      TYR  31  -7.857  -1.041   0.174
    4    HD2  TYR  31           HD2      TYR  31  -9.760   0.025   3.827
    5    HE1  TYR  31           HE1      TYR  31  -9.694  -2.595  -0.336
    6    HE2  TYR  31           HE2      TYR  31 -11.601  -1.526   3.327
    7    HH   TYR  31           HH       TYR  31 -11.427  -3.863   0.888
    8    H    TYR  31           HN       TYR  31  -5.621  -0.740   4.198
    9    HB3  TYR  31           HB1      TYR  31  -7.602   1.376   1.644

  No H/Q in entry =           9
  In of MODEL   30
    1    HA   CYS  32           HA       CYS  32  -2.620   1.976   2.017
    2    HB2  CYS  32           HB2      CYS  32  -2.418   0.811  -0.355
    3    H    CYS  32           HN       CYS  32  -4.466   0.497   0.471
    4    HB3  CYS  32           HB1      CYS  32  -2.833   2.423  -0.928

  No H/Q in entry =           4
  In of MODEL   30
    1    HA   THR  33           HA       THR  33  -4.420   5.919   1.507
    2    HB   THR  33           HB       THR  33  -2.926   6.287   3.352
    3    HG1  THR  33           HG1      THR  33  -2.573   8.412   1.511
    4   HG21  THR  33          HG21      THR  33  -0.794   6.704   1.280
    5   HG23  THR  33          HG22      THR  33  -0.825   5.521   2.588
    6   HG22  THR  33          HG23      THR  33  -0.643   7.237   2.954
    7    H    THR  33           HN       THR  33  -1.994   4.278   1.393

  No H/Q in entry =           7
  In of MODEL   30
    1    HA3  GLY  34           HA2      GLY  34  -1.264   5.932  -2.621
    2    H    GLY  34           HN       GLY  34  -1.430   5.488  -0.298
    3    HA2  GLY  34           HA1      GLY  34  -2.594   7.070  -2.472

  No H/Q in entry =           3
  In of MODEL   30
    1    HA   ARG  35           HA       ARG  35   0.174  10.294  -1.480
    2    HB2  ARG  35           HB2      ARG  35  -0.567   9.909   1.414
    3    HG2  ARG  35           HG2      ARG  35  -2.247  10.790  -0.281
    4    HD2  ARG  35           HD2      ARG  35  -0.432  12.281  -1.343
    5    HE   ARG  35           HE       ARG  35   0.359  13.852   0.108
    6   HH11  ARG  35          HH11      ARG  35  -3.086  13.550   0.580
    7   HH12  ARG  35          HH12      ARG  35  -3.175  14.874   1.693
    8   HH21  ARG  35          HH21      ARG  35   0.243  15.593   1.571
    9   HH22  ARG  35          HH22      ARG  35  -1.286  16.034   2.255
   10    H    ARG  35           HN       ARG  35  -1.369   8.334  -0.090
   11    HB3  ARG  35           HB1      ARG  35   0.483  11.218   0.890
   12    HG3  ARG  35           HG1      ARG  35  -1.976  11.756   1.171
   13    HD3  ARG  35           HD1      ARG  35  -2.050  12.943  -1.121

  No H/Q in entry =          13
  In of MODEL   30
    1    HA   SER  36           HA       SER  36   3.724   7.861  -0.062
    2    HB2  SER  36           HB2      SER  36   4.400   7.458   2.294
    3    HG   SER  36           HG       SER  36   2.959   7.191   3.812
    4    H    SER  36           HN       SER  36   0.898   7.582   0.611
    5    HB3  SER  36           HB1      SER  36   3.555   8.992   2.089

  No H/Q in entry =           5
  In of MODEL   30
    1    HA   CYS  37           HA       CYS  37   3.599   3.562  -0.302
    2    HB2  CYS  37           HB2      CYS  37   6.214   4.333  -0.253
    3    H    CYS  37           HN       CYS  37   4.971   5.883   0.627
    4    HB3  CYS  37           HB1      CYS  37   6.183   3.162   1.061

  No H/Q in entry =           4
  In of MODEL   30
    1    HA   GLU  38           HA       GLU  38   4.174   2.515   4.376
    2    HB2  GLU  38           HB2      GLU  38   3.553   5.377   5.128
    3    HG2  GLU  38           HG2      GLU  38   5.992   4.037   6.095
    4    H    GLU  38           HN       GLU  38   4.438   4.838   2.835
    5    HB3  GLU  38           HB1      GLU  38   3.742   4.051   6.267
    6    HG3  GLU  38           HG1      GLU  38   5.976   4.495   4.393

  No H/Q in entry =           6
  In of MODEL   30
    1    HA   CYS  39           HA       CYS  39  -0.179   2.165   3.935
    2    HB2  CYS  39           HB2      CYS  39   0.552  -0.038   3.156
    3    H    CYS  39           HN       CYS  39   2.478   1.233   4.615
    4    HB3  CYS  39           HB1      CYS  39   0.799  -0.558   4.819

  No H/Q in entry =           4
  In of MODEL   30
    1    HA   PRO  40           HA       PRO  40  -1.467   3.304   8.020
    2    HB2  PRO  40           HB2      PRO  40  -4.044   2.053   7.189
    3    HG2  PRO  40           HG2      PRO  40  -4.264   3.368   5.280
    4    HD2  PRO  40           HD2      PRO  40  -2.667   1.868   4.560
    5    HB3  PRO  40           HB1      PRO  40  -3.738   3.655   7.872
    6    HG3  PRO  40           HG1      PRO  40  -3.052   4.537   5.838
    7    HD3  PRO  40           HD1      PRO  40  -1.709   3.352   4.388

  No H/Q in entry =           7
  In of MODEL   30
    1    HA   SER  41           HA       SER  41  -1.538  -0.598  10.012
    2    HB2  SER  41           HB2      SER  41   0.271   1.064  11.094
    3    HG   SER  41           HG       SER  41   0.830  -0.965  11.352
    4    H    SER  41           HN       SER  41  -1.530   2.333   9.981
    5    HB3  SER  41           HB1      SER  41  -0.842   0.943  12.458

  No H/Q in entry =           5
  In of MODEL   30
    1    HA   TYR  42           HA       TYR  42  -5.284   0.019  12.293
    2    HB2  TYR  42           HB2      TYR  42  -5.193   2.599  11.248
    3    HD1  TYR  42           HD1      TYR  42  -4.527   2.003  13.785
    4    HD2  TYR  42           HD2      TYR  42  -8.495   2.417  12.306
    5    HE1  TYR  42           HE1      TYR  42  -5.320   2.483  16.063
    6    HE2  TYR  42           HE2      TYR  42  -9.298   2.898  14.580
    7    HH   TYR  42           HH       TYR  42  -8.631   2.526  16.886
    8    H    TYR  42           HN       TYR  42  -4.014   0.790   9.751
    9    HB3  TYR  42           HB1      TYR  42  -6.794   2.015  10.807

  No H/Q in entry =           9
  In of MODEL   30
    1    HA   PRO  43           HA       PRO  43  -7.805  -2.637   9.825
    2    HB2  PRO  43           HB2      PRO  43 -10.008  -2.833  11.394
    3    HG2  PRO  43           HG2      PRO  43  -9.615  -1.054  12.833
    4    HD2  PRO  43           HD2      PRO  43  -7.541  -0.066  13.007
    5    HB3  PRO  43           HB1      PRO  43  -8.477  -3.620  11.792
    6    HG3  PRO  43           HG1      PRO  43  -8.799  -2.357  13.718
    7    HD3  PRO  43           HD1      PRO  43  -6.700  -1.626  13.112

  No H/Q in entry =           7
  In of MODEL   30
    1    HA3  GLY  44           HA2      GLY  44 -11.362  -0.194   8.558
    2    H    GLY  44           HN       GLY  44 -10.022  -2.786   8.845
    3    HA2  GLY  44           HA1      GLY  44 -10.725  -0.957   7.109

  No H/Q in entry =           3
  In of MODEL   30
    1    HA   ASN  45           HA       ASN  45 -15.011  -2.450   8.412
    2    HB2  ASN  45           HB2      ASN  45 -15.658  -0.440   6.243
    3   HD21  ASN  45          HD21      ASN  45 -17.283  -1.003   9.266
    4   HD22  ASN  45          HD22      ASN  45 -16.903   0.522   9.983
    5    H    ASN  45           HN       ASN  45 -13.440  -0.315   7.498
    6    HB3  ASN  45           HB1      ASN  45 -16.827  -1.442   7.099

  No H/Q in entry =           6
  In of MODEL   30
    1    HA3  GLY  46           HA2      GLY  46 -16.161  -5.751   5.686
    2    H    GLY  46           HN       GLY  46 -15.572  -4.361   7.558
    3    HA2  GLY  46           HA1      GLY  46 -15.033  -4.832   4.701

  No H/Q in entry =           3
  In of MODEL   31
    1    H1   ALA   1           HT2      ALA   1  14.983  14.059  -8.433
    2    H2   ALA   1           HT1      ALA   1  16.372  14.559  -7.557
    3    H3   ALA   1           HT3      ALA   1  15.764  15.535  -8.829
    4    HA   ALA   1           HA       ALA   1  16.430  14.088 -10.446
    5    HB2  ALA   1           HB1      ALA   1  18.862  13.563  -9.728
    6    HB3  ALA   1           HB2      ALA   1  18.437  14.434  -8.255
    7    HB1  ALA   1           HB3      ALA   1  18.336  15.243  -9.819

  No H/Q in entry =           7
  In of MODEL   31
    1    HA   MET   2           HA       MET   2  16.253   9.987  -8.421
    2    HB2  MET   2           HB2      MET   2  19.065  10.571  -7.642
    3    H    MET   2           HN       MET   2  17.256  12.515  -7.349
    4    HG2  MET   2           HG2      MET   2  18.153   8.327  -9.379
    5    HE2  MET   2           HE1      MET   2  20.314   8.641 -11.956
    6    HB3  MET   2           HB1      MET   2  18.407   9.005  -7.188
    7    HE1  MET   2           HE2      MET   2  19.469   7.434 -10.986
    8    HE3  MET   2           HE3      MET   2  21.232   7.457 -11.025
    9    HG3  MET   2           HG1      MET   2  18.143   9.978  -9.997

  No H/Q in entry =           9
  In of MODEL   31
    1    HA   ASP   3           HA       ASP   3  14.772   9.133  -4.475
    2    HB2  ASP   3           HB2      ASP   3  16.040  11.152  -3.815
    3    H    ASP   3           HN       ASP   3  14.529  10.486  -6.922
    4    HB3  ASP   3           HB1      ASP   3  14.638  12.145  -4.203

  No H/Q in entry =           4
  In of MODEL   31
    1    HA   CYS   4           HA       CYS   4  10.454   9.973  -4.178
    2    HB2  CYS   4           HB2      CYS   4   9.335   8.443  -5.901
    3    H    CYS   4           HN       CYS   4  12.812   8.365  -4.059
    4    HB3  CYS   4           HB1      CYS   4  10.465   9.646  -6.512

  No H/Q in entry =           4
  In of MODEL   31
    1    HA   THR   5           HA       THR   5   8.825   7.032  -1.502
    2    HB   THR   5           HB       THR   5   6.422   6.223  -2.075
    3    HG1  THR   5           HG1      THR   5   5.425   7.589  -3.629
    4   HG23  THR   5          HG21      THR   5   5.945   7.829  -0.639
    5   HG22  THR   5          HG22      THR   5   5.880   8.960  -1.991
    6   HG21  THR   5          HG23      THR   5   7.386   8.736  -1.100
    7    H    THR   5           HN       THR   5   8.453   8.554  -3.820

  No H/Q in entry =           7
  In of MODEL   31
    1    HA   THR   6           HA       THR   6   9.181   3.081  -3.392
    2    HB   THR   6           HB       THR   6  11.650   3.037  -1.691
    3    HG1  THR   6           HG1      THR   6  11.391   4.457  -4.129
    4   HG23  THR   6          HG21      THR   6  12.226   1.351  -2.988
    5   HG22  THR   6          HG22      THR   6  12.083   2.377  -4.416
    6   HG21  THR   6          HG23      THR   6  10.683   1.477  -3.832
    7    H    THR   6           HN       THR   6   9.584   5.048  -1.239

  No H/Q in entry =           7
  In of MODEL   31
    1    HA3  GLY   7           HA2      GLY   7   9.212  -0.485  -0.568
    2    H    GLY   7           HN       GLY   7   8.917   0.920  -2.747
    3    HA2  GLY   7           HA1      GLY   7   8.012   0.651   0.032

  No H/Q in entry =           3
  In of MODEL   31
    1    HA   PRO   8           HA       PRO   8   5.898  -3.220  -1.629
    2    HB2  PRO   8           HB2      PRO   8   4.120  -2.375   0.606
    3    HG2  PRO   8           HG2      PRO   8   5.706  -2.773   2.263
    4    HD2  PRO   8           HD2      PRO   8   6.499  -0.784   1.400
    5    HB3  PRO   8           HB1      PRO   8   4.655  -3.995   0.145
    6    HG3  PRO   8           HG1      PRO   8   6.716  -3.754   1.184
    7    HD3  PRO   8           HD1      PRO   8   7.921  -1.791   1.064

  No H/Q in entry =           7
  In of MODEL   31
    1    HA   CYS   9           HA       CYS   9   2.497  -0.252  -2.545
    2    HB2  CYS   9           HB2      CYS   9   3.007   1.336  -0.102
    3    H    CYS   9           HN       CYS   9   4.695  -0.050  -0.623
    4    HB3  CYS   9           HB1      CYS   9   2.136   2.168  -1.386

  No H/Q in entry =           4
  In of MODEL   31
    1    HA   CYS  10           HA       CYS  10   4.906   2.384  -5.086
    2    HB2  CYS  10           HB2      CYS  10   7.472   2.060  -3.523
    3    H    CYS  10           HN       CYS  10   5.305   0.074  -3.360
    4    HB3  CYS  10           HB1      CYS  10   7.046   3.378  -4.610

  No H/Q in entry =           4
  In of MODEL   31
    1    HA   ARG  11           HA       ARG  11   7.178  -0.428  -7.568
    2    HB2  ARG  11           HB2      ARG  11   5.024   0.904  -9.188
    3    HG2  ARG  11           HG2      ARG  11   4.828  -1.173  -7.498
    4    HD2  ARG  11           HD2      ARG  11   5.755  -2.248 -10.124
    5    HE   ARG  11           HE       ARG  11   3.506  -3.314  -8.693
    6   HH11  ARG  11          HH11      ARG  11   6.264  -4.114 -10.676
    7   HH12  ARG  11          HH12      ARG  11   5.583  -5.602 -11.242
    8   HH21  ARG  11          HH21      ARG  11   2.609  -5.271  -9.436
    9   HH22  ARG  11          HH22      ARG  11   3.508  -6.259 -10.538
   10    H    ARG  11           HN       ARG  11   5.554   1.983  -7.108
   11    HB3  ARG  11           HB1      ARG  11   6.169  -0.199  -9.939
   12    HG3  ARG  11           HG1      ARG  11   3.816  -0.972  -8.930
   13    HD3  ARG  11           HD1      ARG  11   6.153  -2.782  -8.492

  No H/Q in entry =          13
  In of MODEL   31
    1    HA   GLN  12           HA       GLN  12  11.107   0.976  -8.842
    2    HB2  GLN  12           HB2      GLN  12   9.023   1.560 -10.855
    3    HG2  GLN  12           HG2      GLN  12  10.738   0.670 -12.397
    4   HE21  GLN  12          HE21      GLN  12  11.764  -1.409  -9.993
    5   HE22  GLN  12          HE22      GLN  12  10.515  -2.596 -10.120
    6    H    GLN  12           HN       GLN  12   9.236   0.049  -7.947
    7    HB3  GLN  12           HB1      GLN  12  10.476   2.546 -10.954
    8    HG3  GLN  12           HG1      GLN  12  11.820   0.463 -11.020

  No H/Q in entry =           8
  In of MODEL   31
    1    HA   CYS  13           HA       CYS  13   9.938   5.248  -7.519
    2    HB2  CYS  13           HB2      CYS  13  11.512   5.550  -9.446
    3    H    CYS  13           HN       CYS  13   8.919   3.615  -9.703
    4    HB3  CYS  13           HB1      CYS  13  10.164   6.177 -10.387

  No H/Q in entry =           4
  In of MODEL   31
    1    HA   LYS  14           HA       LYS  14   5.830   6.627  -8.140
    2    HB2  LYS  14           HB2      LYS  14   5.439   4.258  -9.944
    3    HG2  LYS  14           HG2      LYS  14   5.649   7.211 -10.309
    4    HD2  LYS  14           HD2      LYS  14   4.790   5.634 -12.641
    5    HE2  LYS  14           HE2      LYS  14   5.268   8.163 -12.427
    6    HZ1  LYS  14           HZ1      LYS  14   3.765   8.464 -10.495
    7    HZ3  LYS  14           HZ2      LYS  14   2.449   8.142 -11.506
    8    HZ2  LYS  14           HZ3      LYS  14   3.421   9.496 -11.792
    9    H    LYS  14           HN       LYS  14   7.371   4.149  -8.034
   10    HB3  LYS  14           HB1      LYS  14   4.080   5.286  -9.512
   11    HG3  LYS  14           HG1      LYS  14   6.478   5.911 -11.167
   12    HD3  LYS  14           HD1      LYS  14   3.544   5.928 -11.425
   13    HE3  LYS  14           HE1      LYS  14   3.858   7.635 -13.343

  No H/Q in entry =          13
  In of MODEL   31
    1    HA   LEU  15           HA       LEU  15   3.864   4.456  -4.923
    2    HB2  LEU  15           HB2      LEU  15   3.739   7.134  -4.601
    3    HG   LEU  15           HG       LEU  15   3.788   5.261  -2.805
    4   HD13  LEU  15          HD11      LEU  15   3.822   6.898  -1.260
    5   HD12  LEU  15          HD12      LEU  15   2.257   7.545  -1.752
    6   HD11  LEU  15          HD13      LEU  15   3.707   7.948  -2.673
    7   HD22  LEU  15          HD21      LEU  15   1.863   4.469  -1.942
    8   HD21  LEU  15          HD22      LEU  15   1.220   4.879  -3.532
    9   HD23  LEU  15          HD23      LEU  15   1.005   5.991  -2.180
   10    H    LEU  15           HN       LEU  15   4.051   6.644  -6.824
   11    HB3  LEU  15           HB1      LEU  15   2.029   6.765  -4.713

  No H/Q in entry =          11
  In of MODEL   31
    1    HA   LYS  16           HA       LYS  16   0.477   2.572  -6.844
    2    HB2  LYS  16           HB2      LYS  16   0.410   1.721  -3.959
    3    HG2  LYS  16           HG2      LYS  16   2.070   0.803  -5.737
    4    HD2  LYS  16           HD2      LYS  16  -0.552  -0.328  -6.580
    5    HE2  LYS  16           HE2      LYS  16   1.917  -1.836  -7.260
    6    HZ2  LYS  16           HZ1      LYS  16   0.014  -2.549  -8.382
    7    HZ1  LYS  16           HZ2      LYS  16  -0.964  -2.449  -7.006
    8    HZ3  LYS  16           HZ3      LYS  16   0.198  -3.672  -7.129
    9    H    LYS  16           HN       LYS  16   2.150   3.109  -4.664
   10    HB3  LYS  16           HB1      LYS  16  -0.821   1.193  -5.098
   11    HG3  LYS  16           HG1      LYS  16   1.239  -0.307  -4.644
   12    HD3  LYS  16           HD1      LYS  16   0.835   0.157  -7.558
   13    HE3  LYS  16           HE1      LYS  16   1.167  -2.132  -5.692

  No H/Q in entry =          13
  In of MODEL   31
    1    HA   PRO  17           HA       PRO  17  -2.928   5.332  -6.392
    2    HB2  PRO  17           HB2      PRO  17  -5.014   3.793  -7.200
    3    HG2  PRO  17           HG2      PRO  17  -4.007   1.703  -7.101
    4    HD2  PRO  17           HD2      PRO  17  -1.718   1.459  -6.971
    5    HB3  PRO  17           HB1      PRO  17  -3.802   4.431  -8.317
    6    HG3  PRO  17           HG1      PRO  17  -3.615   2.158  -8.770
    7    HD3  PRO  17           HD1      PRO  17  -1.422   2.648  -8.255

  No H/Q in entry =           7
  In of MODEL   31
    1    HA   ALA  18           HA       ALA  18  -4.556   4.707  -2.424
    2    HB3  ALA  18           HB1      ALA  18  -5.070   6.919  -2.240
    3    HB2  ALA  18           HB2      ALA  18  -6.702   6.251  -2.246
    4    HB1  ALA  18           HB3      ALA  18  -6.024   6.936  -3.723
    5    H    ALA  18           HN       ALA  18  -4.437   5.964  -4.915

  No H/Q in entry =           5
  In of MODEL   31
    1    HA3  GLY  19           HA2      GLY  19  -8.095   2.227  -1.307
    2    H    GLY  19           HN       GLY  19  -5.938   3.290  -1.480
    3    HA2  GLY  19           HA1      GLY  19  -8.264   2.390  -3.049

  No H/Q in entry =           3
  In of MODEL   31
    1    HA   THR  20           HA       THR  20  -5.959  -1.229  -3.905
    2    HB   THR  20           HB       THR  20  -3.290   0.175  -3.685
    3    HG1  THR  20           HG1      THR  20  -4.983  -0.278  -5.912
    4   HG23  THR  20          HG21      THR  20  -2.331  -1.542  -4.958
    5   HG22  THR  20          HG22      THR  20  -3.899  -2.263  -5.318
    6   HG21  THR  20          HG23      THR  20  -3.242  -2.352  -3.684
    7    H    THR  20           HN       THR  20  -5.463   1.491  -3.473

  No H/Q in entry =           7
  In of MODEL   31
    1    HA   THR  21           HA       THR  21  -5.138  -2.726   0.100
    2    HB   THR  21           HB       THR  21  -5.621  -5.138   0.216
    3    HG1  THR  21           HG1      THR  21  -5.935  -5.001  -2.596
    4   HG22  THR  21          HG21      THR  21  -7.791  -4.578  -1.567
    5   HG21  THR  21          HG22      THR  21  -7.441  -3.171  -0.562
    6   HG23  THR  21          HG23      THR  21  -7.790  -4.728   0.190
    7    H    THR  21           HN       THR  21  -5.683  -3.019  -2.708

  No H/Q in entry =           7
  In of MODEL   31
    1    HA   CYS  22           HA       CYS  22  -0.878  -3.507  -0.209
    2    HB2  CYS  22           HB2      CYS  22  -1.516  -2.635   2.260
    3    H    CYS  22           HN       CYS  22  -3.319  -3.205   1.184
    4    HB3  CYS  22           HB1      CYS  22  -0.964  -4.259   2.658

  No H/Q in entry =           4
  In of MODEL   31
    1    HA   TRP  23           HA       TRP  23  -1.923  -7.978  -0.081
    2    HB2  TRP  23           HB2      TRP  23  -0.442  -7.460   2.065
    3    HD1  TRP  23           HD1      TRP  23  -0.168  -9.145  -0.594
    4    HE1  TRP  23           HE1      TRP  23   0.824 -11.518  -0.508
    5    HE3  TRP  23           HE3      TRP  23  -0.983 -10.189   4.344
    6    HZ2  TRP  23           HZ2      TRP  23   1.211 -13.562   1.400
    7    HZ3  TRP  23           HZ3      TRP  23  -0.272 -12.375   5.220
    8    HH2  TRP  23           HH2      TRP  23   0.801 -14.026   3.777
    9    H    TRP  23           HN       TRP  23  -3.072  -5.773   1.293
   10    HB3  TRP  23           HB1      TRP  23  -1.717  -8.371   2.868

  No H/Q in entry =          10
  In of MODEL   31
    1    HA   ARG  24           HA       ARG  24  -5.687  -9.635   1.492
    2    HB2  ARG  24           HB2      ARG  24  -6.409  -8.104  -0.306
    3    HG2  ARG  24           HG2      ARG  24  -7.907 -10.578  -0.952
    4    HD2  ARG  24           HD2      ARG  24  -8.935  -7.984   0.143
    5    HE   ARG  24           HE       ARG  24 -10.845  -9.152  -0.273
    6   HH11  ARG  24          HH11      ARG  24  -8.569  -9.829  -2.830
    7   HH12  ARG  24          HH12      ARG  24  -9.697 -10.759  -3.758
    8   HH21  ARG  24          HH21      ARG  24 -12.330 -10.375  -1.492
    9   HH22  ARG  24          HH22      ARG  24 -11.832 -11.069  -2.999
   10    H    ARG  24           HN       ARG  24  -3.505  -9.387  -0.459
   11    HB3  ARG  24           HB1      ARG  24  -6.064  -9.353  -1.495
   12    HG3  ARG  24           HG1      ARG  24  -7.928 -10.013   0.719
   13    HD3  ARG  24           HD1      ARG  24  -8.510  -8.153  -1.559

  No H/Q in entry =          13
  In of MODEL   31
    1    HA   THR  25           HA       THR  25  -4.909 -13.767   0.163
    2    HB   THR  25           HB       THR  25  -4.234 -15.044   2.409
    3    HG1  THR  25           HG1      THR  25  -4.604 -13.245   3.747
    4   HG21  THR  25          HG21      THR  25  -2.689 -13.498   0.470
    5   HG23  THR  25          HG22      THR  25  -2.462 -15.145   1.059
    6   HG22  THR  25          HG23      THR  25  -1.870 -13.780   2.006
    7    H    THR  25           HN       THR  25  -5.241 -11.659   2.187

  No H/Q in entry =           7
  In of MODEL   31
    1    HA   SER  26           HA       SER  26  -9.068 -14.180   2.171
    2    HB2  SER  26           HB2      SER  26  -7.239 -15.541   4.095
    3    HG   SER  26           HG       SER  26  -9.105 -16.383   2.132
    4    H    SER  26           HN       SER  26  -6.785 -12.743   2.936
    5    HB3  SER  26           HB1      SER  26  -8.977 -15.664   4.371

  No H/Q in entry =           5
  In of MODEL   31
    1    HA   VAL  27           HA       VAL  27 -10.034 -12.038   6.064
    2    HB   VAL  27           HB       VAL  27  -8.155 -13.360   8.023
    3    H    VAL  27           HN       VAL  27  -7.801 -13.836   5.454

  No H/Q in entry =           3
  In of MODEL   31
    1    HA   SER  28           HA       SER  28  -6.204  -9.659   7.344
    2    HB2  SER  28           HB2      SER  28  -4.584 -11.786   7.195
    3    HG   SER  28           HG       SER  28  -3.253 -10.510   8.232
    4    H    SER  28           HN       SER  28  -6.538 -12.208   6.029
    5    HB3  SER  28           HB1      SER  28  -3.964 -10.882   5.814

  No H/Q in entry =           5
  In of MODEL   31
    1    HA   SER  29           HA       SER  29  -6.285  -7.884   3.268
    2    HB2  SER  29           HB2      SER  29  -9.051  -7.180   4.281
    3    HG   SER  29           HG       SER  29  -8.069  -9.171   2.529
    4    H    SER  29           HN       SER  29  -7.531  -8.408   5.877
    5    HB3  SER  29           HB1      SER  29  -8.431  -6.802   2.674

  No H/Q in entry =           5
  In of MODEL   31
    1    HA   HIS  30           HA       HIS  30  -5.285  -4.033   5.140
    2    HB2  HIS  30           HB2      HIS  30  -2.992  -5.049   3.509
    3    HD1  HIS  30           HD1      HIS  30  -0.838  -5.233   5.096
    4    HD2  HIS  30           HD2      HIS  30  -4.477  -4.631   7.009
    5    HE1  HIS  30           HE1      HIS  30  -0.442  -5.847   7.502
    6    HE2  HIS  30           HE2      HIS  30  -2.634  -5.391   8.657
    7    H    HIS  30           HN       HIS  30  -4.937  -6.220   3.229
    8    HB3  HIS  30           HB1      HIS  30  -2.984  -3.371   4.039

  No H/Q in entry =           8
  In of MODEL   31
    1    HA   TYR  31           HA       TYR  31  -5.647  -1.409   1.522
    2    HB2  TYR  31           HB2      TYR  31  -6.732  -0.060   3.996
    3    HD1  TYR  31           HD1      TYR  31  -8.410  -1.359   4.888
    4    HD2  TYR  31           HD2      TYR  31  -7.902  -1.297   0.665
    5    HE1  TYR  31           HE1      TYR  31 -10.371  -2.821   4.637
    6    HE2  TYR  31           HE2      TYR  31  -9.863  -2.758   0.401
    7    HH   TYR  31           HH       TYR  31 -12.091  -3.171   2.091
    8    H    TYR  31           HN       TYR  31  -4.682  -1.806   4.262
    9    HB3  TYR  31           HB1      TYR  31  -6.986   0.569   2.372

  No H/Q in entry =           9
  In of MODEL   31
    1    HA   CYS  32           HA       CYS  32  -1.933   0.953   1.741
    2    HB2  CYS  32           HB2      CYS  32  -1.966  -0.056  -0.588
    3    H    CYS  32           HN       CYS  32  -4.036  -0.422   0.507
    4    HB3  CYS  32           HB1      CYS  32  -2.842   1.380  -1.106

  No H/Q in entry =           4
  In of MODEL   31
    1    HA   THR  33           HA       THR  33  -3.825   4.736   2.723
    2    HB   THR  33           HB       THR  33  -1.831   6.459   3.017
    3    HG1  THR  33           HG1      THR  33   0.107   5.552   3.207
    4   HG22  THR  33          HG21      THR  33  -1.953   4.157   4.933
    5   HG21  THR  33          HG22      THR  33  -3.222   5.377   4.828
    6   HG23  THR  33          HG23      THR  33  -1.580   5.848   5.266
    7    H    THR  33           HN       THR  33  -1.653   3.004   2.378

  No H/Q in entry =           7
  In of MODEL   31
    1    HA3  GLY  34           HA2      GLY  34  -1.652   5.343  -1.985
    2    H    GLY  34           HN       GLY  34  -1.293   4.654   0.254
    3    HA2  GLY  34           HA1      GLY  34  -2.984   6.348  -1.435

  No H/Q in entry =           3
  In of MODEL   31
    1    HA   ARG  35           HA       ARG  35  -0.004   9.501  -0.806
    2    HB2  ARG  35           HB2      ARG  35  -0.703   9.340   2.128
    3    HG2  ARG  35           HG2      ARG  35  -1.746  11.198   0.002
    4    HD2  ARG  35           HD2      ARG  35  -2.887  10.688   2.729
    5    HE   ARG  35           HE       ARG  35  -3.255  13.254   1.555
    6   HH11  ARG  35          HH11      ARG  35  -4.394   9.957   1.453
    7   HH12  ARG  35          HH12      ARG  35  -5.965  10.385   0.865
    8   HH21  ARG  35          HH21      ARG  35  -5.321  13.820   0.782
    9   HH22  ARG  35          HH22      ARG  35  -6.492  12.578   0.483
   10    H    ARG  35           HN       ARG  35  -1.325   7.442   0.778
   11    HB3  ARG  35           HB1      ARG  35   0.152  10.693   1.400
   12    HG3  ARG  35           HG1      ARG  35  -2.598   9.770   0.594
   13    HD3  ARG  35           HD1      ARG  35  -1.650  11.917   2.463

  No H/Q in entry =          13
  In of MODEL   31
    1    HA   SER  36           HA       SER  36   3.595   7.460   1.018
    2    HB2  SER  36           HB2      SER  36   2.428   6.665   3.695
    3    HG   SER  36           HG       SER  36   1.973   8.841   3.259
    4    H    SER  36           HN       SER  36   0.736   6.968   1.488
    5    HB3  SER  36           HB1      SER  36   4.123   6.991   3.337

  No H/Q in entry =           5
  In of MODEL   31
    1    HA   CYS  37           HA       CYS  37   3.757   3.231   0.197
    2    HB2  CYS  37           HB2      CYS  37   6.319   4.280   0.309
    3    H    CYS  37           HN       CYS  37   4.950   5.573   1.303
    4    HB3  CYS  37           HB1      CYS  37   6.421   2.849   1.329

  No H/Q in entry =           4
  In of MODEL   31
    1    HA   GLU  38           HA       GLU  38   4.716   1.870   4.758
    2    HB2  GLU  38           HB2      GLU  38   3.452   4.432   5.751
    3    HG2  GLU  38           HG2      GLU  38   6.273   3.534   6.227
    4    H    GLU  38           HN       GLU  38   4.504   4.297   3.409
    5    HB3  GLU  38           HB1      GLU  38   4.020   3.108   6.760
    6    HG3  GLU  38           HG1      GLU  38   5.835   4.600   4.893

  No H/Q in entry =           6
  In of MODEL   31
    1    HA   CYS  39           HA       CYS  39   0.469   0.771   4.726
    2    HB2  CYS  39           HB2      CYS  39   2.275  -1.555   4.336
    3    H    CYS  39           HN       CYS  39   3.320   0.317   5.306
    4    HB3  CYS  39           HB1      CYS  39   0.618  -1.908   4.813

  No H/Q in entry =           4
  In of MODEL   31
    1    HA   PRO  40           HA       PRO  40   0.575   0.346   9.301
    2    HB2  PRO  40           HB2      PRO  40  -1.663   1.832   9.717
    3    HG2  PRO  40           HG2      PRO  40  -2.256   2.249   7.511
    4    HD2  PRO  40           HD2      PRO  40  -0.781   1.922   5.769
    5    HB3  PRO  40           HB1      PRO  40  -0.057   2.543   9.521
    6    HG3  PRO  40           HG1      PRO  40  -1.197   3.639   7.816
    7    HD3  PRO  40           HD1      PRO  40   0.553   2.728   6.619

  No H/Q in entry =           7
  In of MODEL   31
    1    HA   SER  41           HA       SER  41  -2.518  -2.724   9.267
    2    HB2  SER  41           HB2      SER  41  -1.778  -3.035  12.154
    3    HG   SER  41           HG       SER  41   0.246  -3.033  11.568
    4    H    SER  41           HN       SER  41  -0.590  -1.020  10.599
    5    HB3  SER  41           HB1      SER  41  -2.125  -4.276  10.950

  No H/Q in entry =           5
  In of MODEL   31
    1    HA   TYR  42           HA       TYR  42  -5.697  -0.680  11.523
    2    HB2  TYR  42           HB2      TYR  42  -4.061   1.427  11.308
    3    HD1  TYR  42           HD1      TYR  42  -7.729   2.007  11.112
    4    HD2  TYR  42           HD2      TYR  42  -4.307   1.678  13.620
    5    HE1  TYR  42           HE1      TYR  42  -9.068   2.767  13.029
    6    HE2  TYR  42           HE2      TYR  42  -5.637   2.437  15.544
    7    HH   TYR  42           HH       TYR  42  -8.776   3.772  15.197
    8    H    TYR  42           HN       TYR  42  -3.790  -0.474   9.289
    9    HB3  TYR  42           HB1      TYR  42  -5.329   1.965  10.212

  No H/Q in entry =           9
  In of MODEL   31
    1    HA   PRO  43           HA       PRO  43  -7.912  -1.236   7.489
    2    HB2  PRO  43           HB2      PRO  43  -9.547  -3.214   8.371
    3    HG2  PRO  43           HG2      PRO  43  -8.856  -3.323  10.585
    4    HD2  PRO  43           HD2      PRO  43  -6.882  -2.367  11.293
    5    HB3  PRO  43           HB1      PRO  43  -7.922  -3.521   7.747
    6    HG3  PRO  43           HG1      PRO  43  -7.742  -4.493   9.853
    7    HD3  PRO  43           HD1      PRO  43  -5.958  -3.035   9.932

  No H/Q in entry =           7
  In of MODEL   31
    1    HA3  GLY  44           HA2      GLY  44 -12.199  -0.586   9.228
    2    H    GLY  44           HN       GLY  44 -10.445  -1.460   7.262
    3    HA2  GLY  44           HA1      GLY  44 -11.558   0.860   8.463

  No H/Q in entry =           3
  In of MODEL   31
    1    HA   ASN  45           HA       ASN  45 -14.711  -0.560   5.635
    2    HB2  ASN  45           HB2      ASN  45 -15.840  -2.756   5.402
    3   HD21  ASN  45          HD21      ASN  45 -16.678  -4.520   6.279
    4   HD22  ASN  45          HD22      ASN  45 -16.403  -5.063   7.896
    5    H    ASN  45           HN       ASN  45 -14.063  -1.250   8.420
    6    HB3  ASN  45           HB1      ASN  45 -14.104  -2.911   5.654

  No H/Q in entry =           6
  In of MODEL   31
    1    HA3  GLY  46           HA2      GLY  46 -19.381  -0.876   6.048
    2    H    GLY  46           HN       GLY  46 -17.160  -0.995   5.250
    3    HA2  GLY  46           HA1      GLY  46 -18.763  -0.425   7.630

  No H/Q in entry =           3
  In of MODEL   32
    1    H1   ALA   1           HT1      ALA   1  10.969  17.131  -2.127
    2    H2   ALA   1           HT3      ALA   1   9.387  16.513  -1.897
    3    H3   ALA   1           HT2      ALA   1  10.080  17.554  -0.721
    4    HA   ALA   1           HA       ALA   1  11.491  15.995   0.057
    5    HB1  ALA   1           HB1      ALA   1  10.063  14.452   0.889
    6    HB2  ALA   1           HB2      ALA   1   9.431  14.019  -0.699
    7    HB3  ALA   1           HB3      ALA   1   8.862  15.480   0.108

  No H/Q in entry =           7
  In of MODEL   32
    1    HA   MET   2           HA       MET   2  10.971  13.435  -4.620
    2    HB2  MET   2           HB2      MET   2  13.361  14.839  -3.532
    3    H    MET   2           HN       MET   2  10.104  14.743  -2.974
    4    HG2  MET   2           HG2      MET   2  12.303  14.557  -6.335
    5    HE2  MET   2           HE1      MET   2  13.757  17.274  -8.030
    6    HB3  MET   2           HB1      MET   2  13.635  13.483  -4.616
    7    HE1  MET   2           HE2      MET   2  12.883  15.742  -8.050
    8    HE3  MET   2           HE3      MET   2  14.611  15.777  -8.404
    9    HG3  MET   2           HG1      MET   2  11.954  15.898  -5.246

  No H/Q in entry =           9
  In of MODEL   32
    1    HA   ASP   3           HA       ASP   3  12.383   9.733  -2.808
    2    HB2  ASP   3           HB2      ASP   3   9.585   9.705  -1.669
    3    H    ASP   3           HN       ASP   3  10.295  11.440  -3.922
    4    HB3  ASP   3           HB1      ASP   3  10.982   8.797  -1.100

  No H/Q in entry =           4
  In of MODEL   32
    1    HA   CYS   4           HA       CYS   4  10.613   7.245  -5.916
    2    HB2  CYS   4           HB2      CYS   4  13.251   6.724  -5.587
    3    H    CYS   4           HN       CYS   4  12.470   7.810  -3.795
    4    HB3  CYS   4           HB1      CYS   4  12.567   5.168  -5.130

  No H/Q in entry =           4
  In of MODEL   32
    1    HA   THR   5           HA       THR   5  10.150   4.579  -1.343
    2    HB   THR   5           HB       THR   5   7.712   4.571  -3.032
    3    HG1  THR   5           HG1      THR   5   7.267   6.737  -2.427
    4   HG22  THR   5          HG21      THR   5   8.125   5.313  -0.148
    5   HG21  THR   5          HG22      THR   5   7.700   3.703  -0.730
    6   HG23  THR   5          HG23      THR   5   6.586   5.050  -0.967
    7    H    THR   5           HN       THR   5  11.266   6.025  -2.697

  No H/Q in entry =           7
  In of MODEL   32
    1    HA   THR   6           HA       THR   6   8.927   0.772  -3.531
    2    HB   THR   6           HB       THR   6  10.957  -0.704  -2.598
    3    HG1  THR   6           HG1      THR   6  12.513   0.453  -1.707
    4   HG21  THR   6          HG21      THR   6  10.549   0.744  -4.876
    5   HG23  THR   6          HG22      THR   6  11.933  -0.300  -4.555
    6   HG22  THR   6          HG23      THR   6  12.045   1.432  -4.246
    7    H    THR   6           HN       THR   6   9.148   2.409  -1.226

  No H/Q in entry =           7
  In of MODEL   32
    1    HA3  GLY   7           HA2      GLY   7   8.076  -2.716  -0.799
    2    H    GLY   7           HN       GLY   7   8.024  -1.217  -3.063
    3    HA2  GLY   7           HA1      GLY   7   6.898  -1.468  -0.421

  No H/Q in entry =           3
  In of MODEL   32
    1    HA   PRO   8           HA       PRO   8   4.794  -5.007  -2.658
    2    HB2  PRO   8           HB2      PRO   8   2.948  -5.557  -0.760
    3    HG2  PRO   8           HG2      PRO   8   3.518  -3.949   0.816
    4    HD2  PRO   8           HD2      PRO   8   5.533  -2.841   0.743
    5    HB3  PRO   8           HB1      PRO   8   4.562  -6.276  -0.752
    6    HG3  PRO   8           HG1      PRO   8   4.541  -5.293   1.357
    7    HD3  PRO   8           HD1      PRO   8   6.457  -4.339   0.511

  No H/Q in entry =           7
  In of MODEL   32
    1    HA   CYS   9           HA       CYS   9   1.211  -2.087  -2.476
    2    HB2  CYS   9           HB2      CYS   9   1.547  -1.436   0.026
    3    H    CYS   9           HN       CYS   9   3.749  -2.110  -1.028
    4    HB3  CYS   9           HB1      CYS   9   2.121   0.094  -0.627

  No H/Q in entry =           4
  In of MODEL   32
    1    HA   CYS  10           HA       CYS  10   2.880   0.361  -5.645
    2    HB2  CYS  10           HB2      CYS  10   4.854   1.757  -5.340
    3    H    CYS  10           HN       CYS  10   3.503  -1.875  -4.077
    4    HB3  CYS  10           HB1      CYS  10   3.977   1.612  -3.821

  No H/Q in entry =           4
  In of MODEL   32
    1    HA   ARG  11           HA       ARG  11   6.457  -1.413  -7.838
    2    HB2  ARG  11           HB2      ARG  11   5.421  -2.318  -9.849
    3    HG2  ARG  11           HG2      ARG  11   3.997  -0.109 -10.149
    4    HD2  ARG  11           HD2      ARG  11   2.186  -1.997  -8.658
    5    HE   ARG  11           HE       ARG  11   0.589  -1.202 -10.078
    6   HH11  ARG  11          HH11      ARG  11   2.823   1.384  -9.371
    7   HH12  ARG  11          HH12      ARG  11   1.891   2.585 -10.199
    8   HH21  ARG  11          HH21      ARG  11  -0.639   0.376 -11.169
    9   HH22  ARG  11          HH22      ARG  11  -0.075   2.013 -11.220
   10    H    ARG  11           HN       ARG  11   4.572   0.712  -7.401
   11    HB3  ARG  11           HB1      ARG  11   4.357  -2.529  -8.466
   12    HG3  ARG  11           HG1      ARG  11   3.464  -1.665 -10.789
   13    HD3  ARG  11           HD1      ARG  11   2.587  -0.333  -8.233

  No H/Q in entry =          13
  In of MODEL   32
    1    HA   GLN  12           HA       GLN  12   8.837   0.130 -11.336
    2    HB2  GLN  12           HB2      GLN  12   6.189   1.571 -11.497
    3    HG2  GLN  12           HG2      GLN  12   7.433  -0.664 -12.985
    4   HE21  GLN  12          HE21      GLN  12   6.906  -1.147 -15.115
    5   HE22  GLN  12          HE22      GLN  12   6.443   0.075 -16.246
    6    H    GLN  12           HN       GLN  12   7.647  -1.141  -9.873
    7    HB3  GLN  12           HB1      GLN  12   7.560   1.954 -12.529
    8    HG3  GLN  12           HG1      GLN  12   5.745  -0.379 -12.565

  No H/Q in entry =           8
  In of MODEL   32
    1    HA   CYS  13           HA       CYS  13   9.764   2.305  -7.070
    2    HB2  CYS  13           HB2      CYS  13  11.281   2.431  -9.303
    3    H    CYS  13           HN       CYS  13   8.874   0.765  -8.486
    4    HB3  CYS  13           HB1      CYS  13  10.698   4.091  -9.241

  No H/Q in entry =           4
  In of MODEL   32
    1    HA   LYS  14           HA       LYS  14   6.728   5.453  -7.216
    2    HB2  LYS  14           HB2      LYS  14   5.599   4.138  -9.675
    3    HG2  LYS  14           HG2      LYS  14   6.564   6.950  -9.511
    4    HD2  LYS  14           HD2      LYS  14   6.943   4.937 -11.704
    5    HE2  LYS  14           HE2      LYS  14   7.943   7.412 -11.453
    6    HZ1  LYS  14           HZ1      LYS  14   5.409   8.104 -11.566
    7    HZ3  LYS  14           HZ2      LYS  14   5.708   8.010 -13.228
    8    HZ2  LYS  14           HZ3      LYS  14   6.630   9.047 -12.261
    9    H    LYS  14           HN       LYS  14   7.042   2.632  -7.883
   10    HB3  LYS  14           HB1      LYS  14   4.829   5.544  -8.955
   11    HG3  LYS  14           HG1      LYS  14   7.736   5.635  -9.610
   12    HD3  LYS  14           HD1      LYS  14   5.439   5.844 -11.532
   13    HE3  LYS  14           HE1      LYS  14   7.518   6.690 -13.005

  No H/Q in entry =          13
  In of MODEL   32
    1    HA   LEU  15           HA       LEU  15   3.951   3.495  -4.478
    2    HB2  LEU  15           HB2      LEU  15   2.649   5.347  -3.271
    3    HG   LEU  15           HG       LEU  15   3.573   7.033  -5.214
    4   HD12  LEU  15          HD11      LEU  15   3.155   8.785  -3.247
    5   HD11  LEU  15          HD12      LEU  15   2.481   7.345  -2.484
    6   HD13  LEU  15          HD13      LEU  15   1.848   7.901  -4.033
    7   HD23  LEU  15          HD21      LEU  15   5.190   7.952  -2.926
    8   HD22  LEU  15          HD22      LEU  15   5.473   8.118  -4.659
    9   HD21  LEU  15          HD23      LEU  15   5.846   6.598  -3.845
   10    H    LEU  15           HN       LEU  15   5.323   5.654  -5.608
   11    HB3  LEU  15           HB1      LEU  15   4.381   5.251  -3.018

  No H/Q in entry =          11
  In of MODEL   32
    1    HA   LYS  16           HA       LYS  16   0.568   3.123  -7.182
    2    HB2  LYS  16           HB2      LYS  16   0.152   1.439  -4.762
    3    HG2  LYS  16           HG2      LYS  16  -0.354   0.588  -7.571
    4    HD2  LYS  16           HD2      LYS  16   1.187  -0.992  -5.599
    5    HE2  LYS  16           HE2      LYS  16  -1.193  -2.040  -6.988
    6    HZ2  LYS  16           HZ1      LYS  16   0.177  -3.587  -5.892
    7    HZ1  LYS  16           HZ2      LYS  16   1.593  -2.948  -6.561
    8    HZ3  LYS  16           HZ3      LYS  16   0.501  -3.788  -7.541
    9    H    LYS  16           HN       LYS  16   2.037   2.580  -4.863
   10    HB3  LYS  16           HB1      LYS  16  -1.241   1.747  -5.790
   11    HG3  LYS  16           HG1      LYS  16   1.307   0.788  -7.009
   12    HD3  LYS  16           HD1      LYS  16  -0.527  -0.744  -5.259
   13    HE3  LYS  16           HE1      LYS  16   0.141  -1.529  -8.022

  No H/Q in entry =          13
  In of MODEL   32
    1    HA   PRO  17           HA       PRO  17  -2.263   6.326  -6.128
    2    HB2  PRO  17           HB2      PRO  17  -4.606   5.478  -7.208
    3    HG2  PRO  17           HG2      PRO  17  -4.076   3.246  -7.563
    4    HD2  PRO  17           HD2      PRO  17  -1.899   2.489  -7.524
    5    HB3  PRO  17           HB1      PRO  17  -3.251   6.056  -8.185
    6    HG3  PRO  17           HG1      PRO  17  -3.545   3.941  -9.106
    7    HD3  PRO  17           HD1      PRO  17  -1.314   3.828  -8.532

  No H/Q in entry =           7
  In of MODEL   32
    1    HA   ALA  18           HA       ALA  18  -4.125   5.311  -2.354
    2    HB1  ALA  18           HB1      ALA  18  -4.117   7.695  -2.107
    3    HB2  ALA  18           HB2      ALA  18  -5.692   7.089  -1.593
    4    HB3  ALA  18           HB3      ALA  18  -5.515   7.857  -3.170
    5    H    ALA  18           HN       ALA  18  -3.687   6.957  -4.561

  No H/Q in entry =           5
  In of MODEL   32
    1    HA3  GLY  19           HA2      GLY  19  -7.790   3.057  -2.620
    2    H    GLY  19           HN       GLY  19  -5.103   3.374  -2.927
    3    HA2  GLY  19           HA1      GLY  19  -7.606   3.320  -4.348

  No H/Q in entry =           3
  In of MODEL   32
    1    HA   THR  20           HA       THR  20  -5.816  -0.610  -5.006
    2    HB   THR  20           HB       THR  20  -2.959  -0.208  -4.321
    3    HG1  THR  20           HG1      THR  20  -4.311   1.296  -6.298
    4   HG21  THR  20          HG21      THR  20  -4.519  -1.473  -6.511
    5   HG23  THR  20          HG22      THR  20  -3.195  -2.121  -5.543
    6   HG22  THR  20          HG23      THR  20  -2.863  -0.953  -6.822
    7    H    THR  20           HN       THR  20  -4.961   1.992  -4.365

  No H/Q in entry =           7
  In of MODEL   32
    1    HA   THR  21           HA       THR  21  -4.633  -2.390  -1.098
    2    HB   THR  21           HB       THR  21  -6.737  -3.408  -1.870
    3    HG1  THR  21           HG1      THR  21  -6.569  -5.276  -0.604
    4   HG23  THR  21          HG21      THR  21  -6.867  -5.441  -3.037
    5   HG22  THR  21          HG22      THR  21  -5.126  -5.702  -2.934
    6   HG21  THR  21          HG23      THR  21  -5.766  -4.422  -3.964
    7    H    THR  21           HN       THR  21  -4.634  -2.588  -4.035

  No H/Q in entry =           7
  In of MODEL   32
    1    HA   CYS  22           HA       CYS  22  -0.631  -4.045  -1.859
    2    HB2  CYS  22           HB2      CYS  22   0.502  -4.314   0.395
    3    H    CYS  22           HN       CYS  22  -2.673  -2.849  -0.373
    4    HB3  CYS  22           HB1      CYS  22  -0.013  -2.682  -0.016

  No H/Q in entry =           4
  In of MODEL   32
    1    HA   TRP  23           HA       TRP  23  -3.889  -7.620   0.176
    2    HB2  TRP  23           HB2      TRP  23  -2.770  -7.666  -2.247
    3    HD1  TRP  23           HD1      TRP  23  -2.249 -11.098  -2.132
    4    HE1  TRP  23           HE1      TRP  23  -4.413 -12.489  -2.200
    5    HE3  TRP  23           HE3      TRP  23  -5.595  -7.460  -0.823
    6    HZ2  TRP  23           HZ2      TRP  23  -7.173 -12.097  -1.757
    7    HZ3  TRP  23           HZ3      TRP  23  -7.978  -8.051  -0.668
    8    HH2  TRP  23           HH2      TRP  23  -8.750 -10.322  -1.126
    9    H    TRP  23           HN       TRP  23  -3.225  -5.462  -0.097
   10    HB3  TRP  23           HB1      TRP  23  -1.625  -8.717  -1.420

  No H/Q in entry =          10
  In of MODEL   32
    1    HA   ARG  24           HA       ARG  24  -0.763  -8.319   3.298
    2    HB2  ARG  24           HB2      ARG  24  -3.427  -7.847   4.526
    3    HG2  ARG  24           HG2      ARG  24  -1.868  -6.001   4.381
    4    HD2  ARG  24           HD2      ARG  24  -0.032  -7.937   5.729
    5    HE   ARG  24           HE       ARG  24   0.986  -5.303   5.829
    6   HH11  ARG  24          HH11      ARG  24  -1.181  -7.457   7.514
    7   HH12  ARG  24          HH12      ARG  24  -0.957  -6.685   9.048
    8   HH21  ARG  24          HH21      ARG  24   1.282  -4.285   7.845
    9   HH22  ARG  24          HH22      ARG  24   0.440  -4.884   9.236
   10    H    ARG  24           HN       ARG  24  -3.401  -7.701   2.356
   11    HB3  ARG  24           HB1      ARG  24  -2.269  -8.782   5.462
   12    HG3  ARG  24           HG1      ARG  24  -2.139  -6.451   6.066
   13    HD3  ARG  24           HD1      ARG  24   0.276  -6.878   4.353

  No H/Q in entry =          13
  In of MODEL   32
    1    HA   THR  25           HA       THR  25  -4.095 -12.353   2.431
    2    HB   THR  25           HB       THR  25  -2.388 -13.806   1.689
    3    HG1  THR  25           HG1      THR  25  -0.418 -12.020   2.653
    4   HG22  THR  25          HG21      THR  25  -0.902 -12.363   0.199
    5   HG21  THR  25          HG22      THR  25  -1.829 -10.998   0.823
    6   HG23  THR  25          HG23      THR  25  -2.646 -12.292  -0.054
    7    H    THR  25           HN       THR  25  -3.622 -10.129   2.476

  No H/Q in entry =           7
  In of MODEL   32
    1    HA   SER  26           HA       SER  26  -3.154 -13.445   6.629
    2    HB2  SER  26           HB2      SER  26  -1.376 -11.592   6.775
    3    HG   SER  26           HG       SER  26  -1.862 -11.723   9.311
    4    H    SER  26           HN       SER  26  -3.688 -11.031   5.035
    5    HB3  SER  26           HB1      SER  26  -2.596 -10.666   7.649

  No H/Q in entry =           5
  In of MODEL   32
    1    HA   VAL  27           HA       VAL  27  -7.024 -11.495   8.000
    2    HB   VAL  27           HB       VAL  27  -7.252  -9.228   9.226
    3    H    VAL  27           HN       VAL  27  -4.733 -10.275   6.630

  No H/Q in entry =           3
  In of MODEL   32
    1    HA   SER  28           HA       SER  28  -7.156  -9.075   3.556
    2    HB2  SER  28           HB2      SER  28  -9.329 -10.242   5.159
    3    HG   SER  28           HG       SER  28  -8.794 -10.008   2.381
    4    H    SER  28           HN       SER  28  -6.128 -10.190   5.249
    5    HB3  SER  28           HB1      SER  28  -9.824  -8.880   4.152

  No H/Q in entry =           5
  In of MODEL   32
    1    HA   SER  29           HA       SER  29  -9.145  -4.927   3.318
    2    HB2  SER  29           HB2      SER  29  -9.154  -5.518   6.287
    3    HG   SER  29           HG       SER  29 -10.679  -6.780   5.161
    4    H    SER  29           HN       SER  29  -8.774  -7.162   3.119
    5    HB3  SER  29           HB1      SER  29  -9.837  -4.091   5.508

  No H/Q in entry =           5
  In of MODEL   32
    1    HA   HIS  30           HA       HIS  30  -5.539  -2.768   4.346
    2    HB2  HIS  30           HB2      HIS  30  -4.528  -5.314   3.142
    3    HD1  HIS  30           HD1      HIS  30  -3.036  -3.177   5.869
    4    HD2  HIS  30           HD2      HIS  30  -5.138  -6.733   5.417
    5    HE1  HIS  30           HE1      HIS  30  -3.003  -4.269   8.134
    6    HE2  HIS  30           HE2      HIS  30  -4.356  -6.376   7.857
    7    H    HIS  30           HN       HIS  30  -7.155  -4.256   2.502
    8    HB3  HIS  30           HB1      HIS  30  -3.411  -3.972   3.366

  No H/Q in entry =           8
  In of MODEL   32
    1    HA   TYR  31           HA       TYR  31  -4.795  -0.949   0.419
    2    HB2  TYR  31           HB2      TYR  31  -6.780   1.028   1.537
    3    HD1  TYR  31           HD1      TYR  31  -9.069   0.585   1.659
    4    HD2  TYR  31           HD2      TYR  31  -6.506  -2.228  -0.243
    5    HE1  TYR  31           HE1      TYR  31 -10.939  -1.004   1.501
    6    HE2  TYR  31           HE2      TYR  31  -8.368  -3.825  -0.407
    7    HH   TYR  31           HH       TYR  31 -10.530  -4.260   0.776
    8    H    TYR  31           HN       TYR  31  -5.698  -0.918   3.224
    9    HB3  TYR  31           HB1      TYR  31  -6.380   0.731  -0.151

  No H/Q in entry =           9
  In of MODEL   32
    1    HA   CYS  32           HA       CYS  32  -2.515   2.546   1.870
    2    HB2  CYS  32           HB2      CYS  32  -1.909   2.053  -1.031
    3    H    CYS  32           HN       CYS  32  -4.146   1.361  -0.281
    4    HB3  CYS  32           HB1      CYS  32  -1.061   3.313  -0.141

  No H/Q in entry =           4
  In of MODEL   32
    1    HA   THR  33           HA       THR  33  -4.377   6.257   0.487
    2    HB   THR  33           HB       THR  33  -4.217   7.906   2.197
    3    HG1  THR  33           HG1      THR  33  -2.529   7.860   3.727
    4   HG22  THR  33          HG21      THR  33  -4.166   6.530   4.346
    5   HG21  THR  33          HG22      THR  33  -3.959   5.133   3.289
    6   HG23  THR  33          HG23      THR  33  -5.398   6.143   3.144
    7    H    THR  33           HN       THR  33  -2.156   4.831   1.783

  No H/Q in entry =           7
  In of MODEL   32
    1    HA3  GLY  34           HA2      GLY  34  -0.334   6.442  -2.272
    2    H    GLY  34           HN       GLY  34  -1.866   5.511  -0.840
    3    HA2  GLY  34           HA1      GLY  34  -1.379   7.855  -2.274

  No H/Q in entry =           3
  In of MODEL   32
    1    HA   ARG  35           HA       ARG  35   1.625   9.170   0.824
    2    HB2  ARG  35           HB2      ARG  35  -0.007   8.083   2.656
    3    HG2  ARG  35           HG2      ARG  35   1.000  10.270   2.927
    4    HD2  ARG  35           HD2      ARG  35   3.281  10.126   4.262
    5    HE   ARG  35           HE       ARG  35   3.914   9.955   1.502
    6   HH11  ARG  35          HH11      ARG  35   2.143  11.881   3.812
    7   HH12  ARG  35          HH12      ARG  35   2.273  13.338   2.885
    8   HH21  ARG  35          HH21      ARG  35   4.086  11.870   0.282
    9   HH22  ARG  35          HH22      ARG  35   3.375  13.332   0.880
   10    H    ARG  35           HN       ARG  35   0.080   6.689   0.668
   11    HB3  ARG  35           HB1      ARG  35   1.498   7.308   3.133
   12    HG3  ARG  35           HG1      ARG  35   1.153   9.326   4.410
   13    HD3  ARG  35           HD1      ARG  35   3.463   8.651   3.312

  No H/Q in entry =          13
  In of MODEL   32
    1    HA   SER  36           HA       SER  36   4.646   5.771  -0.092
    2    HB2  SER  36           HB2      SER  36   4.257   5.590   2.859
    3    HG   SER  36           HG       SER  36   5.482   7.265   2.571
    4    H    SER  36           HN       SER  36   1.989   5.688   0.804
    5    HB3  SER  36           HB1      SER  36   5.506   4.580   2.130

  No H/Q in entry =           5
  In of MODEL   32
    1    HA   CYS  37           HA       CYS  37   3.837   1.609  -0.853
    2    HB2  CYS  37           HB2      CYS  37   6.733   1.256  -0.051
    3    H    CYS  37           HN       CYS  37   5.705   3.515   0.145
    4    HB3  CYS  37           HB1      CYS  37   5.780   0.091  -0.963

  No H/Q in entry =           4
  In of MODEL   32
    1    HA   GLU  38           HA       GLU  38   4.762  -0.280   3.448
    2    HB2  GLU  38           HB2      GLU  38   5.193   2.474   4.596
    3    HG2  GLU  38           HG2      GLU  38   7.015   0.720   3.583
    4    H    GLU  38           HN       GLU  38   5.295   2.226   2.252
    5    HB3  GLU  38           HB1      GLU  38   4.933   1.060   5.607
    6    HG3  GLU  38           HG1      GLU  38   7.354   1.974   4.775

  No H/Q in entry =           6
  In of MODEL   32
    1    HA   CYS  39           HA       CYS  39   0.371   0.425   3.376
    2    HB2  CYS  39           HB2      CYS  39   1.091  -2.305   3.173
    3    H    CYS  39           HN       CYS  39   2.738  -1.070   3.331
    4    HB3  CYS  39           HB1      CYS  39  -0.084  -2.189   4.479

  No H/Q in entry =           4
  In of MODEL   32
    1    HA   PRO  40           HA       PRO  40  -0.143   1.453   7.640
    2    HB2  PRO  40           HB2      PRO  40  -2.843   1.637   7.788
    3    HG2  PRO  40           HG2      PRO  40  -3.411   0.567   5.807
    4    HD2  PRO  40           HD2      PRO  40  -1.867   0.196   4.140
    5    HB3  PRO  40           HB1      PRO  40  -1.847   2.843   6.964
    6    HG3  PRO  40           HG1      PRO  40  -3.275   2.238   5.230
    7    HD3  PRO  40           HD1      PRO  40  -1.242   1.856   4.216

  No H/Q in entry =           7
  In of MODEL   32
    1    HA   SER  41           HA       SER  41  -1.557  -2.166   9.648
    2    HB2  SER  41           HB2      SER  41  -0.878  -0.101  11.698
    3    HG   SER  41           HG       SER  41   0.127  -2.716  11.267
    4    H    SER  41           HN       SER  41  -1.380   0.760   9.627
    5    HB3  SER  41           HB1      SER  41  -1.576  -1.626  12.243

  No H/Q in entry =           5
  In of MODEL   32
    1    HA   TYR  42           HA       TYR  42  -5.834  -1.529  10.351
    2    HB2  TYR  42           HB2      TYR  42  -5.116   1.144  10.512
    3    HD1  TYR  42           HD1      TYR  42  -5.807  -0.976  12.389
    4    HD2  TYR  42           HD2      TYR  42  -8.294   1.975  10.598
    5    HE1  TYR  42           HE1      TYR  42  -7.350  -1.126  14.298
    6    HE2  TYR  42           HE2      TYR  42  -9.843   1.834  12.502
    7    HH   TYR  42           HH       TYR  42 -10.461   0.318  14.266
    8    H    TYR  42           HN       TYR  42  -3.712  -0.496   8.640
    9    HB3  TYR  42           HB1      TYR  42  -6.482   1.156   9.402

  No H/Q in entry =           9
  In of MODEL   32
    1    HA   PRO  43           HA       PRO  43  -7.593  -2.540   6.427
    2    HB2  PRO  43           HB2      PRO  43 -10.201  -2.814   7.112
    3    HG2  PRO  43           HG2      PRO  43 -10.163  -1.782   9.192
    4    HD2  PRO  43           HD2      PRO  43  -8.192  -1.375  10.311
    5    HB3  PRO  43           HB1      PRO  43  -8.965  -3.993   7.567
    6    HG3  PRO  43           HG1      PRO  43  -9.807  -3.454   9.667
    7    HD3  PRO  43           HD1      PRO  43  -7.573  -3.012  10.015

  No H/Q in entry =           7
  In of MODEL   32
    1    HA3  GLY  44           HA2      GLY  44  -9.154   2.291   7.242
    2    H    GLY  44           HN       GLY  44  -8.873   0.144   8.282
    3    HA2  GLY  44           HA1      GLY  44  -9.573   1.469   5.748

  No H/Q in entry =           3
  In of MODEL   32
    1    HA   ASN  45           HA       ASN  45 -13.535   2.444   7.477
    2    HB2  ASN  45           HB2      ASN  45 -13.096   4.041   5.345
    3   HD21  ASN  45          HD21      ASN  45 -13.862   5.811   6.213
    4   HD22  ASN  45          HD22      ASN  45 -15.395   5.993   6.987
    5    H    ASN  45           HN       ASN  45 -11.556   2.311   5.359
    6    HB3  ASN  45           HB1      ASN  45 -14.332   2.981   4.674

  No H/Q in entry =           6
  In of MODEL   32
    1    HA3  GLY  46           HA2      GLY  46 -15.401  -1.323   6.481
    2    H    GLY  46           HN       GLY  46 -15.565   1.383   7.408
    3    HA2  GLY  46           HA1      GLY  46 -16.767  -0.585   7.304

  No H/Q in entry =           3
  In of MODEL   33
    1    H1   ALA   1           HT3      ALA   1  18.186  10.513  -9.202
    2    H2   ALA   1           HT2      ALA   1  16.873  10.661 -10.298
    3    H3   ALA   1           HT1      ALA   1  17.324  11.991  -9.312
    4    HA   ALA   1           HA       ALA   1  15.453  11.124  -8.337
    5    HB3  ALA   1           HB1      ALA   1  16.710   8.494  -8.994
    6    HB1  ALA   1           HB2      ALA   1  15.082   9.077  -9.339
    7    HB2  ALA   1           HB3      ALA   1  15.521   8.608  -7.697

  No H/Q in entry =           7
  In of MODEL   33
    1    HA   MET   2           HA       MET   2  17.997  11.603  -4.786
    2    HB2  MET   2           HB2      MET   2  16.349  13.622  -4.906
    3    H    MET   2           HN       MET   2  15.607  11.906  -6.351
    4    HG2  MET   2           HG2      MET   2  17.797  12.603  -2.529
    5    HE3  MET   2           HE1      MET   2  15.712  13.349   0.249
    6    HB3  MET   2           HB1      MET   2  15.429  12.719  -3.710
    7    HE2  MET   2           HE2      MET   2  17.432  13.740   0.254
    8    HE1  MET   2           HE3      MET   2  16.850  12.339  -0.644
    9    HG3  MET   2           HG1      MET   2  18.051  14.073  -3.468

  No H/Q in entry =           9
  In of MODEL   33
    1    HA   ASP   3           HA       ASP   3  15.155   8.262  -3.093
    2    HB2  ASP   3           HB2      ASP   3  15.115  10.491  -1.122
    3    H    ASP   3           HN       ASP   3  14.586  10.899  -4.001
    4    HB3  ASP   3           HB1      ASP   3  14.289   9.002  -0.671

  No H/Q in entry =           4
  In of MODEL   33
    1    HA   CYS   4           HA       CYS   4  10.884   9.033  -4.330
    2    HB2  CYS   4           HB2      CYS   4  11.388   6.165  -5.123
    3    H    CYS   4           HN       CYS   4  13.408   7.819  -4.468
    4    HB3  CYS   4           HB1      CYS   4  10.088   7.219  -5.668

  No H/Q in entry =           4
  In of MODEL   33
    1    HA   THR   5           HA       THR   5   9.144   6.602  -1.112
    2    HB   THR   5           HB       THR   5   6.578   6.309  -2.583
    3    HG1  THR   5           HG1      THR   5   6.489   8.298  -3.208
    4   HG23  THR   5          HG21      THR   5   5.641   7.385  -0.642
    5   HG22  THR   5          HG22      THR   5   7.255   7.702  -0.005
    6   HG21  THR   5          HG23      THR   5   6.673   6.043  -0.148
    7    H    THR   5           HN       THR   5   8.991   7.111  -4.000

  No H/Q in entry =           7
  In of MODEL   33
    1    HA   THR   6           HA       THR   6   9.279   2.431  -2.660
    2    HB   THR   6           HB       THR   6  10.980   1.336  -0.804
    3    HG1  THR   6           HG1      THR   6  11.984   3.924  -1.347
    4   HG22  THR   6          HG21      THR   6  12.716   2.349  -2.696
    5   HG21  THR   6          HG22      THR   6  11.177   2.216  -3.547
    6   HG23  THR   6          HG23      THR   6  11.873   0.801  -2.756
    7    H    THR   6           HN       THR   6  10.171   4.639  -1.013

  No H/Q in entry =           7
  In of MODEL   33
    1    HA3  GLY   7           HA2      GLY   7   7.624  -0.250   0.544
    2    H    GLY   7           HN       GLY   7   8.147   0.647  -1.991
    3    HA2  GLY   7           HA1      GLY   7   6.424   1.003   0.272

  No H/Q in entry =           3
  In of MODEL   33
    1    HA   PRO   8           HA       PRO   8   4.851  -3.058  -1.435
    2    HB2  PRO   8           HB2      PRO   8   2.556  -3.164  -0.014
    3    HG2  PRO   8           HG2      PRO   8   2.732  -1.171   1.166
    4    HD2  PRO   8           HD2      PRO   8   4.723  -0.033   1.327
    5    HB3  PRO   8           HB1      PRO   8   4.088  -3.783   0.613
    6    HG3  PRO   8           HG1      PRO   8   3.535  -2.277   2.297
    7    HD3  PRO   8           HD1      PRO   8   5.632  -1.491   1.771

  No H/Q in entry =           7
  In of MODEL   33
    1    HA   CYS   9           HA       CYS   9   1.447  -0.331  -2.975
    2    HB2  CYS   9           HB2      CYS   9   1.893   1.619  -0.819
    3    H    CYS   9           HN       CYS   9   3.525   0.130  -0.975
    4    HB3  CYS   9           HB1      CYS   9   1.232   2.310  -2.297

  No H/Q in entry =           4
  In of MODEL   33
    1    HA   CYS  10           HA       CYS  10   4.176   1.664  -5.790
    2    HB2  CYS  10           HB2      CYS  10   6.628   1.821  -4.044
    3    H    CYS  10           HN       CYS  10   4.426  -0.149  -3.523
    4    HB3  CYS  10           HB1      CYS  10   6.145   2.905  -5.343

  No H/Q in entry =           4
  In of MODEL   33
    1    HA   ARG  11           HA       ARG  11   6.846  -1.380  -7.419
    2    HB2  ARG  11           HB2      ARG  11   5.821  -0.416  -9.396
    3    HG2  ARG  11           HG2      ARG  11   7.438  -0.896 -11.115
    4    HD2  ARG  11           HD2      ARG  11   8.159  -2.748  -8.874
    5    HE   ARG  11           HE       ARG  11   8.526  -2.977 -11.563
    6   HH11  ARG  11          HH11      ARG  11   6.682  -4.748  -9.189
    7   HH12  ARG  11          HH12      ARG  11   6.805  -6.255 -10.033
    8   HH21  ARG  11          HH21      ARG  11   8.690  -4.958 -12.676
    9   HH22  ARG  11          HH22      ARG  11   7.946  -6.374 -12.013
   10    H    ARG  11           HN       ARG  11   6.210   1.474  -7.211
   11    HB3  ARG  11           HB1      ARG  11   7.036   0.853  -9.450
   12    HG3  ARG  11           HG1      ARG  11   8.759  -0.770  -9.951
   13    HD3  ARG  11           HD1      ARG  11   6.525  -2.724  -9.538

  No H/Q in entry =          13
  In of MODEL   33
    1    HA   GLN  12           HA       GLN  12  10.909   0.668  -6.859
    2    HB2  GLN  12           HB2      GLN  12  10.903  -0.173  -9.400
    3    HG2  GLN  12           HG2      GLN  12  13.509   0.337  -9.311
    4   HE21  GLN  12          HE21      GLN  12  12.774  -1.753 -10.178
    5   HE22  GLN  12          HE22      GLN  12  12.801  -3.128  -9.131
    6    H    GLN  12           HN       GLN  12   8.662   1.446  -8.571
    7    HB3  GLN  12           HB1      GLN  12  11.572   1.434  -9.650
    8    HG3  GLN  12           HG1      GLN  12  13.117   0.659  -7.623

  No H/Q in entry =           8
  In of MODEL   33
    1    HA   CYS  13           HA       CYS  13  10.305   5.091  -6.406
    2    HB2  CYS  13           HB2      CYS  13  11.759   5.097  -8.355
    3    H    CYS  13           HN       CYS  13   8.870   3.044  -7.594
    4    HB3  CYS  13           HB1      CYS  13  10.372   5.232  -9.428

  No H/Q in entry =           4
  In of MODEL   33
    1    HA   LYS  14           HA       LYS  14   6.226   6.510  -7.898
    2    HB2  LYS  14           HB2      LYS  14   5.771   4.662 -10.246
    3    HG2  LYS  14           HG2      LYS  14   6.342   6.989 -11.412
    4    HD2  LYS  14           HD2      LYS  14   8.775   6.074 -11.526
    5    HE2  LYS  14           HE2      LYS  14   6.617   4.167 -12.379
    6    HZ2  LYS  14           HZ1      LYS  14   8.548   3.353 -13.223
    7    HZ1  LYS  14           HZ2      LYS  14   9.309   4.863 -13.291
    8    HZ3  LYS  14           HZ3      LYS  14   8.165   4.439 -14.463
    9    H    LYS  14           HN       LYS  14   7.830   4.190  -8.722
   10    HB3  LYS  14           HB1      LYS  14   4.902   6.150  -9.897
   11    HG3  LYS  14           HG1      LYS  14   7.392   7.121  -9.999
   12    HD3  LYS  14           HD1      LYS  14   8.107   4.702 -10.640
   13    HE3  LYS  14           HE1      LYS  14   6.845   5.730 -13.163

  No H/Q in entry =          13
  In of MODEL   33
    1    HA   LEU  15           HA       LEU  15   3.836   3.605  -5.716
    2    HB2  LEU  15           HB2      LEU  15   2.325   4.700  -4.206
    3    HG   LEU  15           HG       LEU  15   2.491   7.002  -6.089
    4   HD12  LEU  15          HD11      LEU  15   0.116   7.223  -5.057
    5   HD11  LEU  15          HD12      LEU  15   0.405   5.576  -4.498
    6   HD13  LEU  15          HD13      LEU  15   0.448   5.942  -6.223
    7   HD22  LEU  15          HD21      LEU  15   2.104   8.634  -4.441
    8   HD21  LEU  15          HD22      LEU  15   3.486   7.706  -3.860
    9   HD23  LEU  15          HD23      LEU  15   1.885   7.424  -3.177
   10    H    LEU  15           HN       LEU  15   4.458   6.236  -6.691
   11    HB3  LEU  15           HB1      LEU  15   3.824   5.607  -4.260

  No H/Q in entry =          11
  In of MODEL   33
    1    HA   LYS  16           HA       LYS  16   0.498   2.819  -8.343
    2    HB2  LYS  16           HB2      LYS  16   0.074   1.145  -5.898
    3    HG2  LYS  16           HG2      LYS  16   0.119  -0.006  -8.610
    4    HD2  LYS  16           HD2      LYS  16   1.679  -0.711  -6.132
    5    HE2  LYS  16           HE2      LYS  16   0.917  -2.206  -8.631
    6    HZ2  LYS  16           HZ1      LYS  16   1.943  -4.130  -7.631
    7    HZ1  LYS  16           HZ2      LYS  16   0.631  -3.634  -6.686
    8    HZ3  LYS  16           HZ3      LYS  16   2.209  -3.289  -6.186
    9    H    LYS  16           HN       LYS  16   1.694   2.672  -5.736
   10    HB3  LYS  16           HB1      LYS  16  -1.155   1.160  -7.155
   11    HG3  LYS  16           HG1      LYS  16   1.625   0.718  -8.042
   12    HD3  LYS  16           HD1      LYS  16   0.044  -1.295  -6.453
   13    HE3  LYS  16           HE1      LYS  16   2.539  -1.817  -8.058

  No H/Q in entry =          13
  In of MODEL   33
    1    HA   PRO  17           HA       PRO  17  -2.768   5.717  -7.822
    2    HB2  PRO  17           HB2      PRO  17  -4.600   3.561  -8.766
    3    HG2  PRO  17           HG2      PRO  17  -3.397   3.158 -10.718
    4    HD2  PRO  17           HD2      PRO  17  -2.039   2.098  -9.184
    5    HB3  PRO  17           HB1      PRO  17  -4.405   5.214  -9.362
    6    HG3  PRO  17           HG1      PRO  17  -2.508   4.688 -10.591
    7    HD3  PRO  17           HD1      PRO  17  -0.867   3.299  -9.762

  No H/Q in entry =           7
  In of MODEL   33
    1    HA   ALA  18           HA       ALA  18  -4.455   4.857  -3.925
    2    HB2  ALA  18           HB1      ALA  18  -5.867   6.548  -3.148
    3    HB3  ALA  18           HB2      ALA  18  -6.507   6.880  -4.757
    4    HB1  ALA  18           HB3      ALA  18  -4.857   7.351  -4.350
    5    H    ALA  18           HN       ALA  18  -4.264   6.298  -6.308

  No H/Q in entry =           5
  In of MODEL   33
    1    HA3  GLY  19           HA2      GLY  19  -7.932   2.257  -3.389
    2    H    GLY  19           HN       GLY  19  -5.478   3.007  -3.557
    3    HA2  GLY  19           HA1      GLY  19  -7.881   2.384  -5.141

  No H/Q in entry =           3
  In of MODEL   33
    1    HA   THR  20           HA       THR  20  -5.563  -1.297  -5.633
    2    HB   THR  20           HB       THR  20  -2.803  -0.410  -4.925
    3    HG1  THR  20           HG1      THR  20  -3.056   1.284  -6.136
    4   HG21  THR  20          HG21      THR  20  -4.027  -2.132  -7.043
    5   HG23  THR  20          HG22      THR  20  -2.813  -2.548  -5.834
    6   HG22  THR  20          HG23      THR  20  -2.384  -1.507  -7.192
    7    H    THR  20           HN       THR  20  -5.063   1.417  -5.176

  No H/Q in entry =           7
  In of MODEL   33
    1    HA   THR  21           HA       THR  21  -5.331  -3.034  -1.688
    2    HB   THR  21           HB       THR  21  -4.545  -5.542  -1.935
    3    HG1  THR  21           HG1      THR  21  -3.723  -5.214  -4.064
    4   HG23  THR  21          HG21      THR  21  -6.782  -5.330  -1.477
    5   HG22  THR  21          HG22      THR  21  -6.813  -6.049  -3.087
    6   HG21  THR  21          HG23      THR  21  -7.087  -4.318  -2.888
    7    H    THR  21           HN       THR  21  -4.919  -3.170  -4.502

  No H/Q in entry =           7
  In of MODEL   33
    1    HA   CYS  22           HA       CYS  22  -1.096  -2.777  -0.678
    2    HB2  CYS  22           HB2      CYS  22  -2.648  -1.454   1.073
    3    H    CYS  22           HN       CYS  22  -3.913  -3.163  -0.020
    4    HB3  CYS  22           HB1      CYS  22  -2.015  -2.700   2.144

  No H/Q in entry =           4
  In of MODEL   33
    1    HA   TRP  23           HA       TRP  23  -1.181  -7.075   0.828
    2    HB2  TRP  23           HB2      TRP  23  -0.969  -5.718   3.048
    3    HD1  TRP  23           HD1      TRP  23   0.718  -7.933   1.646
    4    HE1  TRP  23           HE1      TRP  23   1.674  -9.907   2.994
    5    HE3  TRP  23           HE3      TRP  23  -2.456  -7.796   5.653
    6    HZ2  TRP  23           HZ2      TRP  23   1.153 -11.230   5.432
    7    HZ3  TRP  23           HZ3      TRP  23  -2.159  -9.451   7.449
    8    HH2  TRP  23           HH2      TRP  23  -0.392 -11.132   7.339
    9    H    TRP  23           HN       TRP  23  -3.229  -5.050   0.900
   10    HB3  TRP  23           HB1      TRP  23  -2.409  -6.612   3.527

  No H/Q in entry =          10
  In of MODEL   33
    1    HA   ARG  24           HA       ARG  24  -5.065  -9.111   0.544
    2    HB2  ARG  24           HB2      ARG  24  -3.231 -10.161  -1.600
    3    HG2  ARG  24           HG2      ARG  24  -4.720  -7.923  -1.612
    4    HD2  ARG  24           HD2      ARG  24  -6.535 -10.171  -2.166
    5    HE   ARG  24           HE       ARG  24  -7.365  -8.004  -3.772
    6   HH11  ARG  24          HH11      ARG  24  -5.169 -10.717  -3.791
    7   HH12  ARG  24          HH12      ARG  24  -5.190 -10.882  -5.515
    8   HH21  ARG  24          HH21      ARG  24  -7.394  -8.220  -6.039
    9   HH22  ARG  24          HH22      ARG  24  -6.453  -9.465  -6.791
   10    H    ARG  24           HN       ARG  24  -2.211  -8.754  -0.009
   11    HB3  ARG  24           HB1      ARG  24  -4.824 -10.855  -1.331
   12    HG3  ARG  24           HG1      ARG  24  -4.343  -8.864  -3.056
   13    HD3  ARG  24           HD1      ARG  24  -6.890  -8.535  -1.614

  No H/Q in entry =          13
  In of MODEL   33
    1    HA   THR  25           HA       THR  25  -4.629 -13.281   2.002
    2    HB   THR  25           HB       THR  25  -2.921 -12.260   3.307
    3    HG1  THR  25           HG1      THR  25  -4.818 -13.238   5.168
    4   HG22  THR  25          HG21      THR  25  -3.962 -11.124   5.544
    5   HG21  THR  25          HG22      THR  25  -5.072 -10.556   4.298
    6   HG23  THR  25          HG23      THR  25  -3.343 -10.241   4.149
    7    H    THR  25           HN       THR  25  -5.840 -10.766   1.708

  No H/Q in entry =           7
  In of MODEL   33
    1    HA   SER  26           HA       SER  26  -8.529 -13.870   3.802
    2    HB2  SER  26           HB2      SER  26  -7.531 -16.195   3.089
    3    HG   SER  26           HG       SER  26  -9.811 -15.590   3.513
    4    H    SER  26           HN       SER  26  -5.732 -14.634   3.626
    5    HB3  SER  26           HB1      SER  26  -7.470 -16.479   4.829

  No H/Q in entry =           5
  In of MODEL   33
    1    HA   VAL  27           HA       VAL  27  -8.228 -13.039   8.050
    2    HB   VAL  27           HB       VAL  27  -5.429 -11.957   7.737
    3    H    VAL  27           HN       VAL  27  -7.331 -12.199   5.425

  No H/Q in entry =           3
  In of MODEL   33
    1    HA   SER  28           HA       SER  28  -8.601  -8.570   7.109
    2    HB2  SER  28           HB2      SER  28  -5.647  -8.265   7.686
    3    HG   SER  28           HG       SER  28  -6.222  -8.539   9.699
    4    H    SER  28           HN       SER  28  -6.654 -10.494   6.162
    5    HB3  SER  28           HB1      SER  28  -6.807  -6.941   7.789

  No H/Q in entry =           5
  In of MODEL   33
    1    HA   SER  29           HA       SER  29  -6.615  -6.535   3.558
    2    HB2  SER  29           HB2      SER  29  -8.785  -5.368   2.561
    3    HG   SER  29           HG       SER  29 -10.608  -6.602   3.483
    4    H    SER  29           HN       SER  29  -7.959  -6.307   6.120
    5    HB3  SER  29           HB1      SER  29  -8.634  -7.124   2.620

  No H/Q in entry =           5
  In of MODEL   33
    1    HA   HIS  30           HA       HIS  30  -6.245  -2.326   4.776
    2    HB2  HIS  30           HB2      HIS  30  -3.408  -3.232   4.239
    3    HD1  HIS  30           HD1      HIS  30  -3.081  -2.044   7.358
    4    HD2  HIS  30           HD2      HIS  30  -5.193  -5.337   5.956
    5    HE1  HIS  30           HE1      HIS  30  -3.329  -3.577   9.337
    6    HE2  HIS  30           HE2      HIS  30  -4.685  -5.522   8.485
    7    H    HIS  30           HN       HIS  30  -5.293  -4.847   3.597
    8    HB3  HIS  30           HB1      HIS  30  -3.878  -1.726   5.020

  No H/Q in entry =           8
  In of MODEL   33
    1    HA   TYR  31           HA       TYR  31  -6.235  -1.139   0.513
    2    HB2  TYR  31           HB2      TYR  31  -8.136   0.608   2.062
    3    HD1  TYR  31           HD1      TYR  31  -9.983  -0.706   2.493
    4    HD2  TYR  31           HD2      TYR  31  -7.987  -1.140  -1.240
    5    HE1  TYR  31           HE1      TYR  31 -11.702  -2.307   1.767
    6    HE2  TYR  31           HE2      TYR  31  -9.702  -2.741  -1.977
    7    HH   TYR  31           HH       TYR  31 -11.581  -4.381  -0.181
    8    H    TYR  31           HN       TYR  31  -7.090  -1.066   3.240
    9    HB3  TYR  31           HB1      TYR  31  -7.739   0.953   0.382

  No H/Q in entry =           9
  In of MODEL   33
    1    HA   CYS  32           HA       CYS  32  -3.154   1.887   0.768
    2    HB2  CYS  32           HB2      CYS  32  -3.128   0.831  -1.639
    3    H    CYS  32           HN       CYS  32  -5.260   0.563  -0.680
    4    HB3  CYS  32           HB1      CYS  32  -3.722   2.415  -2.124

  No H/Q in entry =           4
  In of MODEL   33
    1    HA   THR  33           HA       THR  33  -5.132   5.784   0.587
    2    HB   THR  33           HB       THR  33  -3.615   5.991   2.463
    3    HG1  THR  33           HG1      THR  33  -3.485   8.315   0.845
    4   HG23  THR  33          HG21      THR  33  -1.400   6.956   2.261
    5   HG22  THR  33          HG22      THR  33  -1.550   6.962   0.504
    6   HG21  THR  33          HG23      THR  33  -1.507   5.432   1.381
    7    H    THR  33           HN       THR  33  -2.662   4.224   0.287

  No H/Q in entry =           7
  In of MODEL   33
    1    HA3  GLY  34           HA2      GLY  34  -1.872   6.374  -3.409
    2    H    GLY  34           HN       GLY  34  -1.997   5.793  -1.076
    3    HA2  GLY  34           HA1      GLY  34  -3.228   7.465  -3.166

  No H/Q in entry =           3
  In of MODEL   33
    1    HA   ARG  35           HA       ARG  35  -0.554  10.641  -1.824
    2    HB2  ARG  35           HB2      ARG  35  -0.414  11.530   0.439
    3    HG2  ARG  35           HG2      ARG  35  -1.661   8.950   1.364
    4    HD2  ARG  35           HD2      ARG  35  -0.573  10.925   3.258
    5    HE   ARG  35           HE       ARG  35  -2.166   8.763   3.548
    6   HH11  ARG  35          HH11      ARG  35  -2.633  12.164   4.177
    7   HH12  ARG  35          HH12      ARG  35  -3.740  11.899   5.481
    8   HH21  ARG  35          HH21      ARG  35  -3.622   8.412   5.264
    9   HH22  ARG  35          HH22      ARG  35  -4.301   9.769   6.099
   10    H    ARG  35           HN       ARG  35  -2.049   8.512  -0.656
   11    HB3  ARG  35           HB1      ARG  35  -2.050  10.983   0.099
   12    HG3  ARG  35           HG1      ARG  35   0.008   9.438   1.662
   13    HD3  ARG  35           HD1      ARG  35  -2.048  11.404   2.421

  No H/Q in entry =          13
  In of MODEL   33
    1    HA   SER  36           HA       SER  36   3.016   7.979  -0.862
    2    HB2  SER  36           HB2      SER  36   2.609   7.580   2.078
    3    HG   SER  36           HG       SER  36   2.908  10.124   0.860
    4    H    SER  36           HN       SER  36   0.254   7.717  -0.091
    5    HB3  SER  36           HB1      SER  36   4.021   8.192   1.218

  No H/Q in entry =           5
  In of MODEL   33
    1    HA   CYS  37           HA       CYS  37   2.865   3.676  -0.698
    2    HB2  CYS  37           HB2      CYS  37   5.544   4.442  -0.617
    3    H    CYS  37           HN       CYS  37   4.300   6.038   0.006
    4    HB3  CYS  37           HB1      CYS  37   5.417   3.181   0.605

  No H/Q in entry =           4
  In of MODEL   33
    1    HA   GLU  38           HA       GLU  38   3.547   2.999   4.037
    2    HB2  GLU  38           HB2      GLU  38   3.039   5.937   4.533
    3    HG2  GLU  38           HG2      GLU  38   5.467   4.229   4.655
    4    H    GLU  38           HN       GLU  38   3.822   5.179   2.305
    5    HB3  GLU  38           HB1      GLU  38   3.144   4.719   5.797
    6    HG3  GLU  38           HG1      GLU  38   5.282   5.895   4.108

  No H/Q in entry =           6
  In of MODEL   33
    1    HA   CYS  39           HA       CYS  39  -0.839   2.801   3.781
    2    HB2  CYS  39           HB2      CYS  39   0.381   0.095   3.948
    3    H    CYS  39           HN       CYS  39   1.828   1.749   4.304
    4    HB3  CYS  39           HB1      CYS  39  -1.319   0.236   4.382

  No H/Q in entry =           4
  In of MODEL   33
    1    HA   PRO  40           HA       PRO  40  -2.420   3.223   7.860
    2    HB2  PRO  40           HB2      PRO  40  -4.231   0.900   7.402
    3    HG2  PRO  40           HG2      PRO  40  -5.156   1.782   5.456
    4    HD2  PRO  40           HD2      PRO  40  -3.119   1.065   4.646
    5    HB3  PRO  40           HB1      PRO  40  -4.616   2.535   7.951
    6    HG3  PRO  40           HG1      PRO  40  -4.551   3.413   5.804
    7    HD3  PRO  40           HD1      PRO  40  -2.936   2.792   4.282

  No H/Q in entry =           7
  In of MODEL   33
    1    HA   SER  41           HA       SER  41  -0.512   0.059  10.166
    2    HB2  SER  41           HB2      SER  41   0.041   2.119  11.416
    3    HG   SER  41           HG       SER  41   0.674   0.115  12.312
    4    H    SER  41           HN       SER  41  -2.222   2.396   9.945
    5    HB3  SER  41           HB1      SER  41  -1.473   1.973  12.308

  No H/Q in entry =           5
  In of MODEL   33
    1    HA   TYR  42           HA       TYR  42  -4.273  -1.455  12.385
    2    HB2  TYR  42           HB2      TYR  42  -6.534  -0.443  12.799
    3    HD1  TYR  42           HD1      TYR  42  -7.813   0.389  10.895
    4    HD2  TYR  42           HD2      TYR  42  -4.617   2.657  12.552
    5    HE1  TYR  42           HE1      TYR  42  -8.610   2.379   9.691
    6    HE2  TYR  42           HE2      TYR  42  -5.406   4.654  11.353
    7    HH   TYR  42           HH       TYR  42  -7.709   5.446  10.409
    8    H    TYR  42           HN       TYR  42  -3.772   1.049  10.968
    9    HB3  TYR  42           HB1      TYR  42  -5.190   0.485  13.456

  No H/Q in entry =           9
  In of MODEL   33
    1    HA   PRO  43           HA       PRO  43  -6.114  -3.453   8.909
    2    HB2  PRO  43           HB2      PRO  43  -7.906  -5.076  10.139
    3    HG2  PRO  43           HG2      PRO  43  -7.927  -4.098  12.245
    4    HD2  PRO  43           HD2      PRO  43  -6.283  -2.632  12.922
    5    HB3  PRO  43           HB1      PRO  43  -6.163  -5.366  10.184
    6    HG3  PRO  43           HG1      PRO  43  -6.622  -5.280  12.463
    7    HD3  PRO  43           HD1      PRO  43  -4.974  -3.673  12.325

  No H/Q in entry =           7
  In of MODEL   33
    1    HA3  GLY  44           HA2      GLY  44 -10.442  -2.081   8.969
    2    H    GLY  44           HN       GLY  44  -8.604  -4.302   8.427
    3    HA2  GLY  44           HA1      GLY  44 -10.065  -2.455   7.294

  No H/Q in entry =           3
  In of MODEL   33
    1    HA   ASN  45           HA       ASN  45 -12.262  -6.353   8.880
    2    HB2  ASN  45           HB2      ASN  45 -12.329  -5.314  11.685
    3   HD21  ASN  45          HD21      ASN  45 -12.946  -8.508  11.639
    4   HD22  ASN  45          HD22      ASN  45 -11.334  -9.128  11.683
    5    H    ASN  45           HN       ASN  45 -10.981  -4.259  10.234
    6    HB3  ASN  45           HB1      ASN  45 -13.515  -6.520  11.195

  No H/Q in entry =           6
  In of MODEL   33
    1    HA3  GLY  46           HA2      GLY  46 -16.449  -4.384   9.639
    2    H    GLY  46           HN       GLY  46 -13.947  -3.933  10.884
    3    HA2  GLY  46           HA1      GLY  46 -16.052  -3.033  10.690

  No H/Q in entry =           3
  In of MODEL   34
    1    H1   ALA   1           HT3      ALA   1  14.124   9.620   3.512
    2    H2   ALA   1           HT2      ALA   1  14.783  11.155   3.116
    3    H3   ALA   1           HT1      ALA   1  13.543  11.030   4.296
    4    HA   ALA   1           HA       ALA   1  11.974  10.392   2.712
    5    HB2  ALA   1           HB1      ALA   1  11.681  12.430   1.692
    6    HB1  ALA   1           HB2      ALA   1  13.395  12.613   1.320
    7    HB3  ALA   1           HB3      ALA   1  12.821  12.852   2.970

  No H/Q in entry =           7
  In of MODEL   34
    1    HA   MET   2           HA       MET   2  13.976   7.904  -0.360
    2    HB2  MET   2           HB2      MET   2  11.108   7.107  -0.010
    3    H    MET   2           HN       MET   2  11.929   8.666   1.414
    4    HG2  MET   2           HG2      MET   2  13.341   6.222   1.217
    5    HE3  MET   2           HE1      MET   2  12.696   2.776   0.769
    6    HB3  MET   2           HB1      MET   2  12.017   6.513  -1.392
    7    HE2  MET   2           HE2      MET   2  12.991   2.325  -0.910
    8    HE1  MET   2           HE3      MET   2  11.602   3.331  -0.499
    9    HG3  MET   2           HG1      MET   2  11.881   5.262   0.985

  No H/Q in entry =           9
  In of MODEL   34
    1    HA   ASP   3           HA       ASP   3  13.136  10.537  -3.698
    2    HB2  ASP   3           HB2      ASP   3  14.952   8.399  -4.826
    3    H    ASP   3           HN       ASP   3  14.270   8.190  -2.532
    4    HB3  ASP   3           HB1      ASP   3  14.481   9.848  -5.709

  No H/Q in entry =           4
  In of MODEL   34
    1    HA   CYS   4           HA       CYS   4  10.916   7.827  -6.705
    2    HB2  CYS   4           HB2      CYS   4  12.800   6.549  -7.657
    3    H    CYS   4           HN       CYS   4  13.307   7.315  -5.194
    4    HB3  CYS   4           HB1      CYS   4  12.547   5.290  -6.452

  No H/Q in entry =           4
  In of MODEL   34
    1    HA   THR   5           HA       THR   5   8.103   5.949  -4.023
    2    HB   THR   5           HB       THR   5   6.114   4.955  -5.509
    3    HG1  THR   5           HG1      THR   5   7.481   5.242  -7.426
    4   HG23  THR   5          HG21      THR   5   5.826   6.901  -4.126
    5   HG22  THR   5          HG22      THR   5   5.175   7.214  -5.736
    6   HG21  THR   5          HG23      THR   5   6.737   7.888  -5.269
    7    H    THR   5           HN       THR   5   9.026   6.462  -6.686

  No H/Q in entry =           7
  In of MODEL   34
    1    HA   THR   6           HA       THR   6   8.659   1.619  -4.294
    2    HB   THR   6           HB       THR   6  11.004   1.058  -3.189
    3    HG1  THR   6           HG1      THR   6  12.298   2.710  -2.957
    4   HG22  THR   6          HG21      THR   6  12.133   1.447  -5.319
    5   HG21  THR   6          HG22      THR   6  10.763   2.415  -5.862
    6   HG23  THR   6          HG23      THR   6  10.554   0.694  -5.537
    7    H    THR   6           HN       THR   6   9.194   4.254  -3.113

  No H/Q in entry =           7
  In of MODEL   34
    1    HA3  GLY   7           HA2      GLY   7   8.864  -0.408  -0.229
    2    H    GLY   7           HN       GLY   7   8.401  -0.082  -2.814
    3    HA2  GLY   7           HA1      GLY   7   7.609   0.820  -0.151

  No H/Q in entry =           3
  In of MODEL   34
    1    HA   PRO   8           HA       PRO   8   5.417  -3.226  -0.053
    2    HB2  PRO   8           HB2      PRO   8   3.473  -2.432   1.655
    3    HG2  PRO   8           HG2      PRO   8   4.036  -0.189   1.869
    4    HD2  PRO   8           HD2      PRO   8   6.092   0.613   1.217
    5    HB3  PRO   8           HB1      PRO   8   5.059  -2.983   2.207
    6    HG3  PRO   8           HG1      PRO   8   4.989  -0.879   3.196
    7    HD3  PRO   8           HD1      PRO   8   6.970  -0.695   2.036

  No H/Q in entry =           7
  In of MODEL   34
    1    HA   CYS   9           HA       CYS   9   1.885  -0.967  -1.961
    2    HB2  CYS   9           HB2      CYS   9   1.753   0.843  -0.067
    3    H    CYS   9           HN       CYS   9   4.142   0.052  -0.398
    4    HB3  CYS   9           HB1      CYS   9   2.290   1.935  -1.338

  No H/Q in entry =           4
  In of MODEL   34
    1    HA   CYS  10           HA       CYS  10   4.164   0.619  -5.389
    2    HB2  CYS  10           HB2      CYS  10   6.813   0.318  -3.959
    3    H    CYS  10           HN       CYS  10   4.619  -1.004  -2.985
    4    HB3  CYS  10           HB1      CYS  10   6.578   1.123  -5.506

  No H/Q in entry =           4
  In of MODEL   34
    1    HA   ARG  11           HA       ARG  11   5.141  -3.284  -7.090
    2    HB2  ARG  11           HB2      ARG  11   3.088  -2.673  -8.286
    3    HG2  ARG  11           HG2      ARG  11   4.776  -3.424 -10.580
    4    HD2  ARG  11           HD2      ARG  11   2.183  -4.117  -9.373
    5    HE   ARG  11           HE       ARG  11   2.515  -6.360  -9.526
    6   HH11  ARG  11          HH11      ARG  11   4.440  -4.816 -11.994
    7   HH12  ARG  11          HH12      ARG  11   5.000  -6.310 -12.667
    8   HH21  ARG  11          HH21      ARG  11   3.251  -8.325 -10.410
    9   HH22  ARG  11          HH22      ARG  11   4.325  -8.302 -11.769
   10    H    ARG  11           HN       ARG  11   4.342  -0.498  -7.227
   11    HB3  ARG  11           HB1      ARG  11   4.020  -1.665  -9.384
   12    HG3  ARG  11           HG1      ARG  11   4.851  -4.489  -9.175
   13    HD3  ARG  11           HD1      ARG  11   2.649  -3.995 -11.069

  No H/Q in entry =          13
  In of MODEL   34
    1    HA   GLN  12           HA       GLN  12   8.595  -1.713  -9.599
    2    HB2  GLN  12           HB2      GLN  12   7.001  -2.258 -11.603
    3    HG2  GLN  12           HG2      GLN  12   9.604  -0.912 -12.266
    4   HE21  GLN  12          HE21      GLN  12  10.098  -3.802 -13.225
    5   HE22  GLN  12          HE22      GLN  12   9.374  -3.820 -14.794
    6    H    GLN  12           HN       GLN  12   5.801  -0.779  -9.537
    7    HB3  GLN  12           HB1      GLN  12   7.261  -0.571 -12.027
    8    HG3  GLN  12           HG1      GLN  12   9.492  -2.537 -11.592

  No H/Q in entry =           8
  In of MODEL   34
    1    HA   CYS  13           HA       CYS  13   9.463   2.142  -7.365
    2    HB2  CYS  13           HB2      CYS  13  10.813   1.531  -9.653
    3    H    CYS  13           HN       CYS  13   8.746   0.068  -7.961
    4    HB3  CYS  13           HB1      CYS  13  10.044   3.047 -10.110

  No H/Q in entry =           4
  In of MODEL   34
    1    HA   LYS  14           HA       LYS  14   6.002   4.561  -8.593
    2    HB2  LYS  14           HB2      LYS  14   4.013   3.750  -9.904
    3    HG2  LYS  14           HG2      LYS  14   4.750   1.438 -11.043
    4    HD2  LYS  14           HD2      LYS  14   3.181   0.459  -9.074
    5    HE2  LYS  14           HE2      LYS  14   2.563   0.512 -11.409
    6    HZ3  LYS  14           HZ1      LYS  14   1.853   3.369 -11.059
    7    HZ2  LYS  14           HZ2      LYS  14   1.783   2.457 -12.481
    8    HZ1  LYS  14           HZ3      LYS  14   3.281   2.851 -11.804
    9    H    LYS  14           HN       LYS  14   6.685   1.767  -8.025
   10    HB3  LYS  14           HB1      LYS  14   5.569   3.496 -10.683
   11    HG3  LYS  14           HG1      LYS  14   5.304   1.151  -9.392
   12    HD3  LYS  14           HD1      LYS  14   2.853   2.186  -8.917
   13    HE3  LYS  14           HE1      LYS  14   1.256   1.176 -10.429

  No H/Q in entry =          13
  In of MODEL   34
    1    HA   LEU  15           HA       LEU  15   3.088   3.693  -5.458
    2    HB2  LEU  15           HB2      LEU  15   3.194   6.288  -6.048
    3    HG   LEU  15           HG       LEU  15   2.772   5.378  -3.763
    4   HD12  LEU  15          HD11      LEU  15   1.123   7.379  -3.195
    5   HD11  LEU  15          HD12      LEU  15   1.528   7.839  -4.848
    6   HD13  LEU  15          HD13      LEU  15   2.806   7.645  -3.648
    7   HD22  LEU  15          HD21      LEU  15   0.873   3.993  -4.108
    8   HD21  LEU  15          HD22      LEU  15  -0.066   5.333  -4.767
    9   HD23  LEU  15          HD23      LEU  15   0.361   5.312  -3.056
   10    H    LEU  15           HN       LEU  15   3.585   4.924  -8.072
   11    HB3  LEU  15           HB1      LEU  15   1.504   6.016  -6.427

  No H/Q in entry =          11
  In of MODEL   34
    1    HA   LYS  16           HA       LYS  16  -0.121   1.395  -7.309
    2    HB2  LYS  16           HB2      LYS  16   0.013   0.888  -4.383
    3    HG2  LYS  16           HG2      LYS  16  -0.415  -1.187  -6.476
    4    HD2  LYS  16           HD2      LYS  16   1.146  -1.024  -3.903
    5    HE2  LYS  16           HE2      LYS  16   0.753  -3.618  -5.240
    6    HZ3  LYS  16           HZ1      LYS  16   3.260  -3.587  -4.535
    7    HZ2  LYS  16           HZ2      LYS  16   2.039  -3.832  -3.390
    8    HZ1  LYS  16           HZ3      LYS  16   2.753  -2.308  -3.550
    9    H    LYS  16           HN       LYS  16   1.466   2.312  -5.168
   10    HB3  LYS  16           HB1      LYS  16  -1.466   0.421  -5.210
   11    HG3  LYS  16           HG1      LYS  16   1.167  -0.420  -6.327
   12    HD3  LYS  16           HD1      LYS  16  -0.335  -1.937  -4.197
   13    HE3  LYS  16           HE1      LYS  16   1.909  -2.532  -6.009

  No H/Q in entry =          13
  In of MODEL   34
    1    HA   PRO  17           HA       PRO  17  -3.640   4.041  -7.306
    2    HB2  PRO  17           HB2      PRO  17  -5.700   2.320  -7.708
    3    HG2  PRO  17           HG2      PRO  17  -4.633   0.322  -7.203
    4    HD2  PRO  17           HD2      PRO  17  -2.336   0.161  -7.096
    5    HB3  PRO  17           HB1      PRO  17  -4.536   2.735  -8.971
    6    HG3  PRO  17           HG1      PRO  17  -4.298   0.422  -8.942
    7    HD3  PRO  17           HD1      PRO  17  -2.106   1.056  -8.611

  No H/Q in entry =           7
  In of MODEL   34
    1    HA   ALA  18           HA       ALA  18  -5.141   4.211  -3.242
    2    HB2  ALA  18           HB1      ALA  18  -6.677   5.958  -2.905
    3    HB3  ALA  18           HB2      ALA  18  -7.313   5.827  -4.544
    4    HB1  ALA  18           HB3      ALA  18  -5.692   6.468  -4.276
    5    H    ALA  18           HN       ALA  18  -5.120   4.936  -5.941

  No H/Q in entry =           5
  In of MODEL   34
    1    HA3  GLY  19           HA2      GLY  19  -8.260   1.489  -1.923
    2    H    GLY  19           HN       GLY  19  -5.888   2.301  -2.548
    3    HA2  GLY  19           HA1      GLY  19  -8.415   1.285  -3.661

  No H/Q in entry =           3
  In of MODEL   34
    1    HA   THR  20           HA       THR  20  -5.987  -2.339  -3.538
    2    HB   THR  20           HB       THR  20  -3.476  -0.837  -4.306
    3    HG1  THR  20           HG1      THR  20  -5.495  -2.030  -5.898
    4   HG21  THR  20          HG21      THR  20  -3.294  -3.299  -3.556
    5   HG23  THR  20          HG22      THR  20  -2.537  -2.796  -5.068
    6   HG22  THR  20          HG23      THR  20  -4.081  -3.649  -5.095
    7    H    THR  20           HN       THR  20  -5.579   0.462  -3.905

  No H/Q in entry =           7
  In of MODEL   34
    1    HA   THR  21           HA       THR  21  -4.487  -2.864   0.473
    2    HB   THR  21           HB       THR  21  -3.724  -5.134   0.935
    3    HG1  THR  21           HG1      THR  21  -3.635  -5.374  -1.886
    4   HG21  THR  21          HG21      THR  21  -6.064  -4.906  -0.915
    5   HG23  THR  21          HG22      THR  21  -6.047  -5.123   0.835
    6   HG22  THR  21          HG23      THR  21  -5.574  -6.453  -0.223
    7    H    THR  21           HN       THR  21  -4.975  -3.753  -2.132

  No H/Q in entry =           7
  In of MODEL   34
    1    HA   CYS  22           HA       CYS  22  -0.283  -1.841   0.270
    2    HB2  CYS  22           HB2      CYS  22  -0.976  -0.811   2.377
    3    H    CYS  22           HN       CYS  22  -2.514  -2.978   1.728
    4    HB3  CYS  22           HB1      CYS  22  -0.673  -2.319   3.231

  No H/Q in entry =           4
  In of MODEL   34
    1    HA   TRP  23           HA       TRP  23   1.218  -6.090   0.673
    2    HB2  TRP  23           HB2      TRP  23   2.209  -6.852   2.642
    3    HD1  TRP  23           HD1      TRP  23   1.617  -8.572   4.423
    4    HE1  TRP  23           HE1      TRP  23  -0.106  -8.752   6.325
    5    HE3  TRP  23           HE3      TRP  23  -0.935  -4.215   3.624
    6    HZ2  TRP  23           HZ2      TRP  23  -2.262  -7.247   7.352
    7    HZ3  TRP  23           HZ3      TRP  23  -2.814  -3.660   5.110
    8    HH2  TRP  23           HH2      TRP  23  -3.463  -5.146   6.935
    9    H    TRP  23           HN       TRP  23  -1.150  -4.854   1.768
   10    HB3  TRP  23           HB1      TRP  23   1.747  -5.206   3.055

  No H/Q in entry =          10
  In of MODEL   34
    1    HA   ARG  24           HA       ARG  24  -1.991  -9.004   0.126
    2    HB2  ARG  24           HB2      ARG  24   0.435  -9.747  -1.428
    3    HG2  ARG  24           HG2      ARG  24  -1.651 -10.186  -3.057
    4    HD2  ARG  24           HD2      ARG  24  -1.406  -7.571  -3.486
    5    HE   ARG  24           HE       ARG  24   1.059  -8.741  -4.191
    6   HH11  ARG  24          HH11      ARG  24  -2.372  -9.157  -4.676
    7   HH12  ARG  24          HH12      ARG  24  -2.188  -9.923  -6.218
    8   HH21  ARG  24          HH21      ARG  24   1.303  -9.748  -6.219
    9   HH22  ARG  24          HH22      ARG  24  -0.102 -10.259  -7.094
   10    H    ARG  24           HN       ARG  24   0.604  -7.927  -0.234
   11    HB3  ARG  24           HB1      ARG  24  -0.770 -10.999  -1.162
   12    HG3  ARG  24           HG1      ARG  24  -2.355  -8.979  -1.979
   13    HD3  ARG  24           HD1      ARG  24  -0.015  -7.796  -2.426

  No H/Q in entry =          13
  In of MODEL   34
    1    HA   THR  25           HA       THR  25  -0.828 -12.602   2.517
    2    HB   THR  25           HB       THR  25  -2.025 -12.197   4.731
    3    HG1  THR  25           HG1      THR  25  -2.932 -10.098   4.923
    4   HG22  THR  25          HG21      THR  25  -0.478  -9.802   3.804
    5   HG21  THR  25          HG22      THR  25   0.282 -11.347   4.183
    6   HG23  THR  25          HG23      THR  25  -0.598 -10.467   5.432
    7    H    THR  25           HN       THR  25  -2.664 -10.919   1.088

  No H/Q in entry =           7
  In of MODEL   34
    1    HA   SER  26           HA       SER  26  -5.068 -14.110   1.210
    2    HB2  SER  26           HB2      SER  26  -6.143 -15.100   3.050
    3    HG   SER  26           HG       SER  26  -5.915 -13.706   5.139
    4    H    SER  26           HN       SER  26  -4.197 -11.610   2.126
    5    HB3  SER  26           HB1      SER  26  -4.596 -14.570   3.710

  No H/Q in entry =           5
  In of MODEL   34
    1    HA   VAL  27           HA       VAL  27  -8.021 -10.635   1.022
    2    HB   VAL  27           HB       VAL  27  -9.220 -11.973   2.695
    3    H    VAL  27           HN       VAL  27  -5.937 -11.178   2.955

  No H/Q in entry =           3
  In of MODEL   34
    1    HA   SER  28           HA       SER  28  -5.773  -7.627   4.821
    2    HB2  SER  28           HB2      SER  28  -4.480  -7.588   2.734
    3    HG   SER  28           HG       SER  28  -3.957  -5.603   3.150
    4    H    SER  28           HN       SER  28  -6.486  -9.646   4.051
    5    HB3  SER  28           HB1      SER  28  -5.855  -6.879   1.887

  No H/Q in entry =           5
  In of MODEL   34
    1    HA   SER  29           HA       SER  29  -8.937  -4.451   4.040
    2    HB2  SER  29           HB2      SER  29  -8.678  -5.584   6.789
    3    HG   SER  29           HG       SER  29 -11.144  -5.543   5.878
    4    H    SER  29           HN       SER  29  -6.381  -5.288   5.026
    5    HB3  SER  29           HB1      SER  29  -9.717  -4.177   6.567

  No H/Q in entry =           5
  In of MODEL   34
    1    HA   HIS  30           HA       HIS  30  -6.566  -1.029   5.703
    2    HB2  HIS  30           HB2      HIS  30  -4.134  -2.315   4.458
    3    HD1  HIS  30           HD1      HIS  30  -2.272  -2.154   6.719
    4    HD2  HIS  30           HD2      HIS  30  -6.309  -2.946   7.302
    5    HE1  HIS  30           HE1      HIS  30  -2.418  -3.290   8.958
    6    HE2  HIS  30           HE2      HIS  30  -4.860  -3.837   9.250
    7    H    HIS  30           HN       HIS  30  -6.324  -3.390   3.957
    8    HB3  HIS  30           HB1      HIS  30  -4.101  -0.725   5.212

  No H/Q in entry =           8
  In of MODEL   34
    1    HA   TYR  31           HA       TYR  31  -5.366  -0.901   0.477
    2    HB2  TYR  31           HB2      TYR  31  -7.600   0.810   1.565
    3    HD1  TYR  31           HD1      TYR  31  -7.121  -2.389  -0.321
    4    HD2  TYR  31           HD2      TYR  31  -9.450  -0.195   2.482
    5    HE1  TYR  31           HE1      TYR  31  -8.635  -4.312  -0.083
    6    HE2  TYR  31           HE2      TYR  31 -10.971  -2.112   2.728
    7    HH   TYR  31           HH       TYR  31 -10.235  -5.188   1.687
    8    H    TYR  31           HN       TYR  31  -5.312  -1.953   2.492
    9    HB3  TYR  31           HB1      TYR  31  -7.296   0.361  -0.110

  No H/Q in entry =           9
  In of MODEL   34
    1    HA   CYS  32           HA       CYS  32  -3.195   2.793   1.222
    2    HB2  CYS  32           HB2      CYS  32  -2.796   1.877  -1.580
    3    H    CYS  32           HN       CYS  32  -4.526   0.917  -0.564
    4    HB3  CYS  32           HB1      CYS  32  -2.257   3.504  -1.179

  No H/Q in entry =           4
  In of MODEL   34
    1    HA   THR  33           HA       THR  33  -5.688   6.048  -0.303
    2    HB   THR  33           HB       THR  33  -5.004   8.186   0.653
    3    HG1  THR  33           HG1      THR  33  -2.963   8.507   1.420
    4   HG23  THR  33          HG21      THR  33  -4.728   7.606   2.944
    5   HG22  THR  33          HG22      THR  33  -4.111   6.009   2.521
    6   HG21  THR  33          HG23      THR  33  -5.798   6.415   2.204
    7    H    THR  33           HN       THR  33  -2.983   5.103   0.342

  No H/Q in entry =           7
  In of MODEL   34
    1    HA3  GLY  34           HA2      GLY  34  -1.820   6.382  -3.673
    2    H    GLY  34           HN       GLY  34  -2.356   6.127  -1.354
    3    HA2  GLY  34           HA1      GLY  34  -3.250   7.388  -3.856

  No H/Q in entry =           3
  In of MODEL   34
    1    HA   ARG  35           HA       ARG  35  -0.217  10.378  -2.359
    2    HB2  ARG  35           HB2      ARG  35  -1.592  10.115  -0.085
    3    HG2  ARG  35           HG2      ARG  35  -0.462  12.212  -1.227
    4    HD2  ARG  35           HD2      ARG  35   1.102  11.918   1.331
    5    HE   ARG  35           HE       ARG  35   1.840  13.943  -0.569
    6   HH11  ARG  35          HH11      ARG  35  -0.160  13.206   2.195
    7   HH12  ARG  35          HH12      ARG  35  -0.299  14.859   2.692
    8   HH21  ARG  35          HH21      ARG  35   1.658  16.118   0.084
    9   HH22  ARG  35          HH22      ARG  35   0.733  16.512   1.494
   10    H    ARG  35           HN       ARG  35  -1.068   7.819  -1.175
   11    HB3  ARG  35           HB1      ARG  35   0.026   9.896   0.567
   12    HG3  ARG  35           HG1      ARG  35  -1.097  12.271   0.418
   13    HD3  ARG  35           HD1      ARG  35   1.773  11.671  -0.280

  No H/Q in entry =          13
  In of MODEL   34
    1    HA   SER  36           HA       SER  36   3.485   7.730  -1.770
    2    HB2  SER  36           HB2      SER  36   3.248   9.199   0.451
    3    HG   SER  36           HG       SER  36   5.517   8.603   0.843
    4    H    SER  36           HN       SER  36   0.844   7.469  -0.726
    5    HB3  SER  36           HB1      SER  36   3.551   7.634   1.205

  No H/Q in entry =           5
  In of MODEL   34
    1    HA   CYS  37           HA       CYS  37   3.523   3.481  -1.058
    2    HB2  CYS  37           HB2      CYS  37   6.102   4.240  -1.487
    3    H    CYS  37           HN       CYS  37   4.936   5.943  -0.792
    4    HB3  CYS  37           HB1      CYS  37   6.260   3.382   0.041

  No H/Q in entry =           4
  In of MODEL   34
    1    HA   GLU  38           HA       GLU  38   4.562   3.336   3.604
    2    HB2  GLU  38           HB2      GLU  38   4.791   6.303   3.599
    3    HG2  GLU  38           HG2      GLU  38   6.265   4.149   5.098
    4    H    GLU  38           HN       GLU  38   4.717   5.362   1.631
    5    HB3  GLU  38           HB1      GLU  38   4.249   5.535   5.086
    6    HG3  GLU  38           HG1      GLU  38   6.810   4.940   3.620

  No H/Q in entry =           6
  In of MODEL   34
    1    HA   CYS  39           HA       CYS  39   0.122   3.608   3.590
    2    HB2  CYS  39           HB2      CYS  39  -0.813   1.321   3.973
    3    H    CYS  39           HN       CYS  39   2.658   2.242   3.664
    4    HB3  CYS  39           HB1      CYS  39   0.246   1.430   2.572

  No H/Q in entry =           4
  In of MODEL   34
    1    HA   PRO  40           HA       PRO  40  -0.383   4.273   7.922
    2    HB2  PRO  40           HB2      PRO  40  -3.082   4.137   8.152
    3    HG2  PRO  40           HG2      PRO  40  -3.591   3.149   6.113
    4    HD2  PRO  40           HD2      PRO  40  -2.071   3.074   4.384
    5    HB3  PRO  40           HB1      PRO  40  -2.254   5.502   7.393
    6    HG3  PRO  40           HG1      PRO  40  -3.661   4.861   5.655
    7    HD3  PRO  40           HD1      PRO  40  -1.628   4.783   4.572

  No H/Q in entry =           7
  In of MODEL   34
    1    HA   SER  41           HA       SER  41  -1.415   0.402   9.708
    2    HB2  SER  41           HB2      SER  41  -1.651   1.718  12.353
    3    HG   SER  41           HG       SER  41  -0.235   3.176  11.582
    4    H    SER  41           HN       SER  41  -1.645   3.326   9.859
    5    HB3  SER  41           HB1      SER  41  -0.598   0.400  11.837

  No H/Q in entry =           5
  In of MODEL   34
    1    HA   TYR  42           HA       TYR  42  -5.555   1.597  11.907
    2    HB2  TYR  42           HB2      TYR  42  -5.230   4.185  11.309
    3    HD1  TYR  42           HD1      TYR  42  -5.927   4.624  13.499
    4    HD2  TYR  42           HD2      TYR  42  -8.589   2.669  10.817
    5    HE1  TYR  42           HE1      TYR  42  -7.741   4.850  15.144
    6    HE2  TYR  42           HE2      TYR  42 -10.411   2.890  12.455
    7    HH   TYR  42           HH       TYR  42 -10.138   3.303  15.465
    8    H    TYR  42           HN       TYR  42  -3.574   3.018  10.548
    9    HB3  TYR  42           HB1      TYR  42  -6.404   3.770  10.064

  No H/Q in entry =           9
  In of MODEL   34
    1    HA   PRO  43           HA       PRO  43  -6.803  -0.952   8.383
    2    HB2  PRO  43           HB2      PRO  43  -8.477  -2.561   9.789
    3    HG2  PRO  43           HG2      PRO  43  -8.465  -1.436  11.821
    4    HD2  PRO  43           HD2      PRO  43  -6.859   0.137  12.334
    5    HB3  PRO  43           HB1      PRO  43  -6.722  -2.771   9.785
    6    HG3  PRO  43           HG1      PRO  43  -7.102  -2.544  12.069
    7    HD3  PRO  43           HD1      PRO  43  -5.532  -0.886  11.747

  No H/Q in entry =           7
  In of MODEL   34
    1    HA3  GLY  44           HA2      GLY  44 -10.926   0.497   7.938
    2    H    GLY  44           HN       GLY  44  -9.215  -1.902   7.941
    3    HA2  GLY  44           HA1      GLY  44 -10.990  -0.791   6.745

  No H/Q in entry =           3
  In of MODEL   34
    1    HA   ASN  45           HA       ASN  45 -12.291  -2.107  11.744
    2    HB2  ASN  45           HB2      ASN  45 -13.828  -0.332  10.810
    3   HD21  ASN  45          HD21      ASN  45 -16.374  -2.221  10.452
    4   HD22  ASN  45          HD22      ASN  45 -16.797  -2.526  12.099
    5    H    ASN  45           HN       ASN  45 -10.831  -1.232  10.235
    6    HB3  ASN  45           HB1      ASN  45 -14.488  -1.566   9.742

  No H/Q in entry =           6
  In of MODEL   34
    1    HA3  GLY  46           HA2      GLY  46 -13.989  -5.117   7.649
    2    H    GLY  46           HN       GLY  46 -13.764  -3.041   8.627
    3    HA2  GLY  46           HA1      GLY  46 -12.829  -5.737   8.814

  No H/Q in entry =           3
  In of MODEL   35
    1    H1   ALA   1           HT1      ALA   1  17.608   8.916   2.542
    2    H2   ALA   1           HT3      ALA   1  17.120  10.554   2.666
    3    H3   ALA   1           HT2      ALA   1  16.328   9.351   3.599
    4    HA   ALA   1           HA       ALA   1  15.236   8.485   1.839
    5    HB1  ALA   1           HB1      ALA   1  14.039  10.395   2.132
    6    HB2  ALA   1           HB2      ALA   1  14.571  10.661   0.472
    7    HB3  ALA   1           HB3      ALA   1  15.419  11.444   1.805

  No H/Q in entry =           7
  In of MODEL   35
    1    HA   MET   2           HA       MET   2  17.121   8.734  -2.166
    2    HB2  MET   2           HB2      MET   2  17.302   6.063  -0.861
    3    H    MET   2           HN       MET   2  15.230   7.688  -0.207
    4    HG2  MET   2           HG2      MET   2  18.987   7.914  -0.552
    5    HE1  MET   2           HE1      MET   2  21.874   7.698  -1.576
    6    HB3  MET   2           HB1      MET   2  17.648   6.154  -2.583
    7    HE3  MET   2           HE2      MET   2  21.139   9.274  -1.285
    8    HE2  MET   2           HE3      MET   2  21.989   8.964  -2.799
    9    HG3  MET   2           HG1      MET   2  19.622   6.343  -1.037

  No H/Q in entry =           9
  In of MODEL   35
    1    HA   ASP   3           HA       ASP   3  14.262   5.729  -4.447
    2    HB2  ASP   3           HB2      ASP   3  13.020   4.550  -1.954
    3    H    ASP   3           HN       ASP   3  15.144   5.788  -1.789
    4    HB3  ASP   3           HB1      ASP   3  12.497   4.174  -3.593

  No H/Q in entry =           4
  In of MODEL   35
    1    HA   CYS   4           HA       CYS   4  11.094   8.703  -4.177
    2    HB2  CYS   4           HB2      CYS   4  10.162   9.121  -6.453
    3    H    CYS   4           HN       CYS   4  12.449   6.478  -5.473
    4    HB3  CYS   4           HB1      CYS   4  11.922   9.113  -6.406

  No H/Q in entry =           4
  In of MODEL   35
    1    HA   THR   5           HA       THR   5   7.959   6.378  -1.977
    2    HB   THR   5           HB       THR   5   6.586   6.726  -4.589
    3    HG1  THR   5           HG1      THR   5   7.607   8.619  -4.694
    4   HG23  THR   5          HG21      THR   5   4.911   6.409  -3.156
    5   HG22  THR   5          HG22      THR   5   5.172   8.096  -2.713
    6   HG21  THR   5          HG23      THR   5   5.904   6.809  -1.755
    7    H    THR   5           HN       THR   5   9.868   7.386  -2.692

  No H/Q in entry =           7
  In of MODEL   35
    1    HA   THR   6           HA       THR   6   7.934   2.465  -3.914
    2    HB   THR   6           HB       THR   6  10.092   1.246  -3.988
    3    HG1  THR   6           HG1      THR   6  10.972   3.472  -2.480
    4   HG23  THR   6          HG21      THR   6  10.102   2.449  -5.888
    5   HG22  THR   6          HG22      THR   6  11.419   3.293  -5.073
    6   HG21  THR   6          HG23      THR   6   9.793   3.974  -5.057
    7    H    THR   6           HN       THR   6   9.067   4.344  -1.966

  No H/Q in entry =           7
  In of MODEL   35
    1    HA3  GLY   7           HA2      GLY   7   8.287  -0.658  -0.710
    2    H    GLY   7           HN       GLY   7   7.379   0.474  -3.103
    3    HA2  GLY   7           HA1      GLY   7   6.851   0.284  -0.340

  No H/Q in entry =           3
  In of MODEL   35
    1    HA   PRO   8           HA       PRO   8   5.373  -3.930  -1.499
    2    HB2  PRO   8           HB2      PRO   8   3.331  -3.977   0.288
    3    HG2  PRO   8           HG2      PRO   8   3.555  -1.845   1.181
    4    HD2  PRO   8           HD2      PRO   8   5.469  -0.596   0.886
    5    HB3  PRO   8           HB1      PRO   8   4.985  -4.433   0.711
    6    HG3  PRO   8           HG1      PRO   8   4.612  -2.755   2.277
    7    HD3  PRO   8           HD1      PRO   8   6.535  -1.958   1.287

  No H/Q in entry =           7
  In of MODEL   35
    1    HA   CYS   9           HA       CYS   9   1.436  -1.727  -2.666
    2    HB2  CYS   9           HB2      CYS   9   1.551  -0.020  -0.612
    3    H    CYS   9           HN       CYS   9   3.705  -0.873  -1.066
    4    HB3  CYS   9           HB1      CYS   9   1.812   1.130  -1.920

  No H/Q in entry =           4
  In of MODEL   35
    1    HA   CYS  10           HA       CYS  10   3.239   1.695  -5.465
    2    HB2  CYS  10           HB2      CYS  10   5.977   1.851  -4.200
    3    H    CYS  10           HN       CYS  10   3.854   0.892  -2.856
    4    HB3  CYS  10           HB1      CYS  10   5.302   2.910  -5.433

  No H/Q in entry =           4
  In of MODEL   35
    1    HA   ARG  11           HA       ARG  11   5.481  -1.388  -7.613
    2    HB2  ARG  11           HB2      ARG  11   3.643   0.108  -9.435
    3    HG2  ARG  11           HG2      ARG  11   3.087  -1.907  -7.834
    4    HD2  ARG  11           HD2      ARG  11   3.044  -3.902  -9.620
    5    HE   ARG  11           HE       ARG  11   4.805  -3.343  -7.420
    6   HH11  ARG  11          HH11      ARG  11   4.009  -5.627  -9.936
    7   HH12  ARG  11          HH12      ARG  11   4.703  -6.977  -9.103
    8   HH21  ARG  11          HH21      ARG  11   5.719  -5.118  -6.324
    9   HH22  ARG  11          HH22      ARG  11   5.674  -6.688  -7.052
   10    H    ARG  11           HN       ARG  11   4.178   1.243  -7.465
   11    HB3  ARG  11           HB1      ARG  11   4.769  -1.049 -10.131
   12    HG3  ARG  11           HG1      ARG  11   2.344  -1.759  -9.428
   13    HD3  ARG  11           HD1      ARG  11   4.548  -3.119 -10.101

  No H/Q in entry =          13
  In of MODEL   35
    1    HA   GLN  12           HA       GLN  12   8.375   1.315  -9.849
    2    HB2  GLN  12           HB2      GLN  12   6.431   1.697 -12.118
    3    HG2  GLN  12           HG2      GLN  12   8.855   0.107 -12.497
    4   HE21  GLN  12          HE21      GLN  12   6.006  -1.626 -11.990
    5   HE22  GLN  12          HE22      GLN  12   5.487  -1.738 -13.634
    6    H    GLN  12           HN       GLN  12   5.428   1.392  -9.831
    7    HB3  GLN  12           HB1      GLN  12   8.111   2.201 -12.241
    8    HG3  GLN  12           HG1      GLN  12   7.735  -0.546 -11.302

  No H/Q in entry =           8
  In of MODEL   35
    1    HA   CYS  13           HA       CYS  13   8.109   5.035  -7.267
    2    HB2  CYS  13           HB2      CYS  13   9.810   5.207  -9.112
    3    H    CYS  13           HN       CYS  13   8.002   2.907  -8.061
    4    HB3  CYS  13           HB1      CYS  13   8.539   5.853 -10.145

  No H/Q in entry =           4
  In of MODEL   35
    1    HA   LYS  14           HA       LYS  14   4.093   6.454  -8.409
    2    HB2  LYS  14           HB2      LYS  14   3.999   4.093 -10.163
    3    HG2  LYS  14           HG2      LYS  14   3.081   5.671 -11.771
    4    HD2  LYS  14           HD2      LYS  14   5.187   7.351 -10.591
    5    HE2  LYS  14           HE2      LYS  14   5.464   5.797 -13.108
    6    HZ1  LYS  14           HZ1      LYS  14   6.056   8.588 -12.295
    7    HZ3  LYS  14           HZ2      LYS  14   6.283   7.994 -13.862
    8    HZ2  LYS  14           HZ3      LYS  14   7.173   7.348 -12.576
    9    H    LYS  14           HN       LYS  14   5.552   3.925  -8.102
   10    HB3  LYS  14           HB1      LYS  14   2.423   4.686  -9.657
   11    HG3  LYS  14           HG1      LYS  14   2.977   6.905 -10.513
   12    HD3  LYS  14           HD1      LYS  14   5.623   5.658 -10.831
   13    HE3  LYS  14           HE1      LYS  14   4.256   7.081 -13.054

  No H/Q in entry =          13
  In of MODEL   35
    1    HA   LEU  15           HA       LEU  15   1.965   4.760  -5.022
    2    HB2  LEU  15           HB2      LEU  15   1.707   7.430  -5.122
    3    HG   LEU  15           HG       LEU  15   0.127   5.652  -3.262
    4   HD12  LEU  15          HD11      LEU  15   2.539   7.067  -2.355
    5   HD11  LEU  15          HD12      LEU  15   2.812   5.772  -3.520
    6   HD13  LEU  15          HD13      LEU  15   1.977   5.433  -2.004
    7   HD21  LEU  15          HD21      LEU  15  -0.473   8.200  -3.558
    8   HD23  LEU  15          HD22      LEU  15   0.960   8.418  -2.553
    9   HD22  LEU  15          HD23      LEU  15  -0.395   7.458  -1.960
   10    H    LEU  15           HN       LEU  15   2.297   6.665  -7.156
   11    HB3  LEU  15           HB1      LEU  15   0.031   6.980  -5.370

  No H/Q in entry =          11
  In of MODEL   35
    1    HA   LYS  16           HA       LYS  16  -1.129   2.454  -7.018
    2    HB2  LYS  16           HB2      LYS  16  -1.115   1.659  -4.115
    3    HG2  LYS  16           HG2      LYS  16   0.650   0.899  -5.864
    4    HD2  LYS  16           HD2      LYS  16  -1.681  -0.907  -6.502
    5    HE2  LYS  16           HE2      LYS  16   1.253  -1.123  -6.982
    6    HZ2  LYS  16           HZ1      LYS  16   0.451  -1.106  -9.199
    7    HZ1  LYS  16           HZ2      LYS  16  -0.860  -2.104  -8.816
    8    HZ3  LYS  16           HZ3      LYS  16   0.712  -2.727  -8.787
    9    H    LYS  16           HN       LYS  16   0.438   3.241  -4.815
   10    HB3  LYS  16           HB1      LYS  16  -2.271   0.973  -5.249
   11    HG3  LYS  16           HG1      LYS  16  -0.060  -0.277  -4.755
   12    HD3  LYS  16           HD1      LYS  16  -0.905   0.228  -7.608
   13    HE3  LYS  16           HE1      LYS  16   0.092  -2.375  -6.543

  No H/Q in entry =          13
  In of MODEL   35
    1    HA   PRO  17           HA       PRO  17  -4.801   4.878  -6.911
    2    HB2  PRO  17           HB2      PRO  17  -6.274   2.289  -7.027
    3    HG2  PRO  17           HG2      PRO  17  -5.152   1.534  -8.923
    4    HD2  PRO  17           HD2      PRO  17  -3.530   1.177  -7.322
    5    HB3  PRO  17           HB1      PRO  17  -6.417   3.713  -8.065
    6    HG3  PRO  17           HG1      PRO  17  -4.544   3.153  -9.316
    7    HD3  PRO  17           HD1      PRO  17  -2.630   2.321  -8.339

  No H/Q in entry =           7
  In of MODEL   35
    1    HA   ALA  18           HA       ALA  18  -6.013   4.879  -2.748
    2    HB2  ALA  18           HB1      ALA  18  -8.061   6.307  -2.421
    3    HB3  ALA  18           HB2      ALA  18  -8.103   6.511  -4.172
    4    HB1  ALA  18           HB3      ALA  18  -6.715   7.089  -3.251
    5    H    ALA  18           HN       ALA  18  -6.243   5.635  -5.428

  No H/Q in entry =           5
  In of MODEL   35
    1    HA3  GLY  19           HA2      GLY  19  -8.559   1.611  -1.559
    2    H    GLY  19           HN       GLY  19  -6.357   2.637  -2.589
    3    HA2  GLY  19           HA1      GLY  19  -9.015   1.617  -3.255

  No H/Q in entry =           3
  In of MODEL   35
    1    HA   THR  20           HA       THR  20  -6.374  -1.718  -4.276
    2    HB   THR  20           HB       THR  20  -3.711  -0.389  -4.463
    3    HG1  THR  20           HG1      THR  20  -4.745   1.190  -5.466
    4   HG21  THR  20          HG21      THR  20  -5.115  -2.609  -5.760
    5   HG23  THR  20          HG22      THR  20  -3.395  -2.370  -5.449
    6   HG22  THR  20          HG23      THR  20  -4.157  -1.591  -6.836
    7    H    THR  20           HN       THR  20  -6.212   1.070  -4.080

  No H/Q in entry =           7
  In of MODEL   35
    1    HA   THR  21           HA       THR  21  -4.150  -2.833  -0.686
    2    HB   THR  21           HB       THR  21  -3.596  -5.244  -0.682
    3    HG1  THR  21           HG1      THR  21  -4.210  -5.142  -3.447
    4   HG21  THR  21          HG21      THR  21  -6.166  -4.347  -1.896
    5   HG23  THR  21          HG22      THR  21  -5.850  -5.019  -0.296
    6   HG22  THR  21          HG23      THR  21  -5.824  -6.067  -1.714
    7    H    THR  21           HN       THR  21  -4.453  -3.161  -3.584

  No H/Q in entry =           7
  In of MODEL   35
    1    HA   CYS  22           HA       CYS  22   0.220  -3.107  -1.535
    2    HB2  CYS  22           HB2      CYS  22   1.349  -2.480   0.664
    3    H    CYS  22           HN       CYS  22  -2.043  -3.976   0.135
    4    HB3  CYS  22           HB1      CYS  22   0.067  -1.411   0.106

  No H/Q in entry =           4
  In of MODEL   35
    1    HA   TRP  23           HA       TRP  23   1.150  -7.131   0.356
    2    HB2  TRP  23           HB2      TRP  23   1.736  -5.649   2.486
    3    HD1  TRP  23           HD1      TRP  23   3.540  -7.260   0.692
    4    HE1  TRP  23           HE1      TRP  23   5.091  -9.119   1.567
    5    HE3  TRP  23           HE3      TRP  23   1.147  -8.315   5.085
    6    HZ2  TRP  23           HZ2      TRP  23   5.276 -10.808   3.821
    7    HZ3  TRP  23           HZ3      TRP  23   2.075 -10.066   6.543
    8    HH2  TRP  23           HH2      TRP  23   4.097 -11.286   5.923
    9    H    TRP  23           HN       TRP  23  -0.798  -5.109   1.212
   10    HB3  TRP  23           HB1      TRP  23   0.668  -6.801   3.280

  No H/Q in entry =          10
  In of MODEL   35
    1    HA   ARG  24           HA       ARG  24  -2.691  -9.210   1.258
    2    HB2  ARG  24           HB2      ARG  24  -3.255  -7.956  -0.995
    3    HG2  ARG  24           HG2      ARG  24  -4.630 -10.518  -0.212
    4    HD2  ARG  24           HD2      ARG  24  -6.602  -9.521  -1.285
    5    HE   ARG  24           HE       ARG  24  -5.662 -10.893  -2.889
    6   HH11  ARG  24          HH11      ARG  24  -4.010  -7.814  -2.836
    7   HH12  ARG  24          HH12      ARG  24  -3.177  -8.098  -4.326
    8   HH21  ARG  24          HH21      ARG  24  -4.565 -11.262  -4.847
    9   HH22  ARG  24          HH22      ARG  24  -3.491 -10.052  -5.468
   10    H    ARG  24           HN       ARG  24  -0.760  -8.069  -0.629
   11    HB3  ARG  24           HB1      ARG  24  -2.933  -9.533  -1.703
   12    HG3  ARG  24           HG1      ARG  24  -4.984  -8.905   0.410
   13    HD3  ARG  24           HD1      ARG  24  -5.605  -8.184  -1.854

  No H/Q in entry =          13
  In of MODEL   35
    1    HA   THR  25           HA       THR  25  -1.124 -13.163   0.187
    2    HB   THR  25           HB       THR  25   0.077 -13.981   2.425
    3    HG1  THR  25           HG1      THR  25  -0.675 -12.203   3.648
    4   HG21  THR  25          HG21      THR  25   1.070 -13.205   0.154
    5   HG23  THR  25          HG22      THR  25   2.088 -13.264   1.593
    6   HG22  THR  25          HG23      THR  25   1.433 -11.723   1.039
    7    H    THR  25           HN       THR  25  -2.183 -11.141   2.038

  No H/Q in entry =           7
  In of MODEL   35
    1    HA   SER  26           HA       SER  26  -5.633 -13.788   1.917
    2    HB2  SER  26           HB2      SER  26  -3.701 -16.086   1.579
    3    HG   SER  26           HG       SER  26  -4.614 -16.281  -0.346
    4    H    SER  26           HN       SER  26  -3.822 -12.647   1.151
    5    HB3  SER  26           HB1      SER  26  -5.390 -16.312   2.031

  No H/Q in entry =           5
  In of MODEL   35
    1    HA   VAL  27           HA       VAL  27  -5.451 -13.931   6.208
    2    HB   VAL  27           HB       VAL  27  -3.173 -14.805   5.934
    3    H    VAL  27           HN       VAL  27  -4.903 -12.450   3.900

  No H/Q in entry =           3
  In of MODEL   35
    1    HA   SER  28           HA       SER  28  -5.271  -9.448   6.857
    2    HB2  SER  28           HB2      SER  28  -2.353  -9.510   6.273
    3    HG   SER  28           HG       SER  28  -2.920 -10.137   8.293
    4    H    SER  28           HN       SER  28  -3.843 -11.092   4.883
    5    HB3  SER  28           HB1      SER  28  -3.089  -7.931   6.546

  No H/Q in entry =           5
  In of MODEL   35
    1    HA   SER  29           HA       SER  29  -4.982  -6.531   3.367
    2    HB2  SER  29           HB2      SER  29  -7.784  -6.533   4.512
    3    HG   SER  29           HG       SER  29  -6.800  -8.220   2.471
    4    H    SER  29           HN       SER  29  -5.273  -7.085   6.168
    5    HB3  SER  29           HB1      SER  29  -7.317  -6.109   2.865

  No H/Q in entry =           5
  In of MODEL   35
    1    HA   HIS  30           HA       HIS  30  -4.706  -2.938   6.086
    2    HB2  HIS  30           HB2      HIS  30  -2.154  -3.081   4.479
    3    HD1  HIS  30           HD1      HIS  30  -0.059  -3.230   6.201
    4    HD2  HIS  30           HD2      HIS  30  -3.789  -4.305   7.685
    5    HE1  HIS  30           HE1      HIS  30   0.404  -4.553   8.288
    6    HE2  HIS  30           HE2      HIS  30  -1.864  -5.266   9.121
    7    H    HIS  30           HN       HIS  30  -3.629  -4.924   4.337
    8    HB3  HIS  30           HB1      HIS  30  -2.552  -1.721   5.523

  No H/Q in entry =           8
  In of MODEL   35
    1    HA   TYR  31           HA       TYR  31  -5.120  -2.046   0.875
    2    HB2  TYR  31           HB2      TYR  31  -6.929  -1.170   3.096
    3    HD1  TYR  31           HD1      TYR  31  -8.788  -2.528   3.290
    4    HD2  TYR  31           HD2      TYR  31  -6.697  -2.431  -0.413
    5    HE1  TYR  31           HE1      TYR  31 -10.255  -4.300   2.422
    6    HE2  TYR  31           HE2      TYR  31  -8.158  -4.203  -1.292
    7    HH   TYR  31           HH       TYR  31  -9.961  -6.163   0.512
    8    H    TYR  31           HN       TYR  31  -4.358  -3.278   2.627
    9    HB3  TYR  31           HB1      TYR  31  -7.005  -0.341   1.545

  No H/Q in entry =           9
  In of MODEL   35
    1    HA   CYS  32           HA       CYS  32  -3.238   1.896   1.345
    2    HB2  CYS  32           HB2      CYS  32  -3.189   0.901  -1.457
    3    H    CYS  32           HN       CYS  32  -4.971   0.037  -0.146
    4    HB3  CYS  32           HB1      CYS  32  -2.725   2.578  -1.194

  No H/Q in entry =           4
  In of MODEL   35
    1    HA   THR  33           HA       THR  33  -6.580   4.656   0.815
    2    HB   THR  33           HB       THR  33  -6.284   6.611   2.147
    3    HG1  THR  33           HG1      THR  33  -3.517   6.027   2.016
    4   HG23  THR  33          HG21      THR  33  -6.417   5.414   3.995
    5   HG22  THR  33          HG22      THR  33  -4.656   5.322   4.034
    6   HG21  THR  33          HG23      THR  33  -5.587   4.064   3.221
    7    H    THR  33           HN       THR  33  -3.996   3.869   1.722

  No H/Q in entry =           7
  In of MODEL   35
    1    HA3  GLY  34           HA2      GLY  34  -2.830   5.987  -2.447
    2    H    GLY  34           HN       GLY  34  -3.306   5.326  -0.203
    3    HA2  GLY  34           HA1      GLY  34  -4.395   6.783  -2.511

  No H/Q in entry =           3
  In of MODEL   35
    1    HA   ARG  35           HA       ARG  35  -1.825   9.960  -0.590
    2    HB2  ARG  35           HB2      ARG  35  -2.321   8.704   2.086
    3    HG2  ARG  35           HG2      ARG  35  -3.495  10.925   0.499
    4    HD2  ARG  35           HD2      ARG  35  -3.035  10.944   3.417
    5    HE   ARG  35           HE       ARG  35  -5.651  10.766   2.690
    6   HH11  ARG  35          HH11      ARG  35  -3.663  13.298   4.036
    7   HH12  ARG  35          HH12      ARG  35  -4.971  14.041   4.893
    8   HH21  ARG  35          HH21      ARG  35  -7.373  11.742   3.816
    9   HH22  ARG  35          HH22      ARG  35  -7.077  13.158   4.769
   10    H    ARG  35           HN       ARG  35  -2.295   7.173   0.239
   11    HB3  ARG  35           HB1      ARG  35  -1.430  10.216   1.981
   12    HG3  ARG  35           HG1      ARG  35  -4.291   9.653   1.428
   13    HD3  ARG  35           HD1      ARG  35  -3.261  12.285   2.296

  No H/Q in entry =          13
  In of MODEL   35
    1    HA   SER  36           HA       SER  36   2.244   7.972  -0.107
    2    HB2  SER  36           HB2      SER  36   1.626   8.628   2.432
    3    HG   SER  36           HG       SER  36   3.876   8.623   2.796
    4    H    SER  36           HN       SER  36  -0.368   7.058   0.727
    5    HB3  SER  36           HB1      SER  36   2.236   6.994   2.694

  No H/Q in entry =           5
  In of MODEL   35
    1    HA   CYS  37           HA       CYS  37   2.931   3.755  -0.658
    2    HB2  CYS  37           HB2      CYS  37   5.339   4.968  -0.762
    3    H    CYS  37           HN       CYS  37   3.925   6.217   0.382
    4    HB3  CYS  37           HB1      CYS  37   5.644   3.817   0.535

  No H/Q in entry =           4
  In of MODEL   35
    1    HA   GLU  38           HA       GLU  38   3.952   2.427   3.827
    2    HB2  GLU  38           HB2      GLU  38   4.815   4.568   4.755
    3    HG2  GLU  38           HG2      GLU  38   2.974   2.869   6.367
    4    H    GLU  38           HN       GLU  38   3.785   4.928   2.520
    5    HB3  GLU  38           HB1      GLU  38   3.156   5.094   5.006
    6    HG3  GLU  38           HG1      GLU  38   4.729   3.022   6.451

  No H/Q in entry =           6
  In of MODEL   35
    1    HA   CYS  39           HA       CYS  39  -0.373   1.699   3.778
    2    HB2  CYS  39           HB2      CYS  39   1.185  -0.677   3.648
    3    H    CYS  39           HN       CYS  39   2.396   0.997   4.163
    4    HB3  CYS  39           HB1      CYS  39  -0.086  -0.942   4.836

  No H/Q in entry =           4
  In of MODEL   35
    1    HA   PRO  40           HA       PRO  40  -1.443   2.417   7.998
    2    HB2  PRO  40           HB2      PRO  40  -4.042   1.636   8.009
    3    HG2  PRO  40           HG2      PRO  40  -4.098   0.467   6.003
    4    HD2  PRO  40           HD2      PRO  40  -2.443   0.691   4.417
    5    HB3  PRO  40           HB1      PRO  40  -3.492   3.127   7.235
    6    HG3  PRO  40           HG1      PRO  40  -4.528   2.089   5.430
    7    HD3  PRO  40           HD1      PRO  40  -2.439   2.462   4.531

  No H/Q in entry =           7
  In of MODEL   35
    1    HA   SER  41           HA       SER  41  -2.031  -1.607   9.818
    2    HB2  SER  41           HB2      SER  41  -1.350   0.438  11.923
    3    HG   SER  41           HG       SER  41   0.323  -1.659  11.225
    4    H    SER  41           HN       SER  41  -2.630   1.277   9.880
    5    HB3  SER  41           HB1      SER  41  -1.464  -1.278  12.311

  No H/Q in entry =           5
  In of MODEL   35
    1    HA   TYR  42           HA       TYR  42  -6.154  -1.843  11.188
    2    HB2  TYR  42           HB2      TYR  42  -5.917   1.109  11.442
    3    HD1  TYR  42           HD1      TYR  42  -7.892  -1.425  13.310
    4    HD2  TYR  42           HD2      TYR  42  -4.442   1.064  13.259
    5    HE1  TYR  42           HE1      TYR  42  -7.445  -2.008  15.657
    6    HE2  TYR  42           HE2      TYR  42  -3.985   0.488  15.606
    7    HH   TYR  42           HH       TYR  42  -5.626  -2.049  17.230
    8    H    TYR  42           HN       TYR  42  -4.561  -0.369   9.324
    9    HB3  TYR  42           HB1      TYR  42  -7.533   0.424  11.582

  No H/Q in entry =           9
  In of MODEL   35
    1    HA   PRO  43           HA       PRO  43  -7.779  -1.720   6.856
    2    HB2  PRO  43           HB2      PRO  43  -9.126  -4.100   8.043
    3    HG2  PRO  43           HG2      PRO  43  -7.139  -5.253   8.420
    4    HD2  PRO  43           HD2      PRO  43  -7.063  -3.737  10.157
    5    HB3  PRO  43           HB1      PRO  43  -8.351  -3.915   6.465
    6    HG3  PRO  43           HG1      PRO  43  -6.218  -4.198   7.332
    7    HD3  PRO  43           HD1      PRO  43  -5.575  -3.238   9.327

  No H/Q in entry =           7
  In of MODEL   35
    1    HA3  GLY  44           HA2      GLY  44 -11.742   0.027   6.878
    2    H    GLY  44           HN       GLY  44  -9.137   0.036   6.992
    3    HA2  GLY  44           HA1      GLY  44 -11.572  -0.215   8.610

  No H/Q in entry =           3
  In of MODEL   35
    1    HA   ASN  45           HA       ASN  45  -9.929   4.066   8.212
    2    HB2  ASN  45           HB2      ASN  45  -8.811   4.043   5.402
    3   HD21  ASN  45          HD21      ASN  45  -7.832   2.030   5.538
    4   HD22  ASN  45          HD22      ASN  45  -6.487   1.731   6.580
    5    H    ASN  45           HN       ASN  45  -9.738   1.855   6.380
    6    HB3  ASN  45           HB1      ASN  45  -8.505   5.247   6.650

  No H/Q in entry =           6
  In of MODEL   35
    1    HA3  GLY  46           HA2      GLY  46 -12.616   6.014   5.019
    2    H    GLY  46           HN       GLY  46 -10.746   3.806   4.743
    3    HA2  GLY  46           HA1      GLY  46 -12.166   5.207   3.525

  No H/Q in entry =           3
  In of MODEL   36
    1    H1   ALA   1           HT2      ALA   1  14.702  13.748   0.224
    2    H2   ALA   1           HT1      ALA   1  16.418  13.776   0.251
    3    H3   ALA   1           HT3      ALA   1  15.530  15.064   0.952
    4    HA   ALA   1           HA       ALA   1  14.771  15.801  -1.092
    5    HB1  ALA   1           HB1      ALA   1  17.061  16.444  -0.458
    6    HB2  ALA   1           HB2      ALA   1  16.843  16.374  -2.207
    7    HB3  ALA   1           HB3      ALA   1  17.683  15.068  -1.370

  No H/Q in entry =           7
  In of MODEL   36
    1    HA   MET   2           HA       MET   2  12.777  13.604  -4.302
    2    HB2  MET   2           HB2      MET   2  15.733  13.709  -4.762
    3    H    MET   2           HN       MET   2  13.494  14.874  -2.557
    4    HG2  MET   2           HG2      MET   2  13.316  14.915  -5.961
    5    HE1  MET   2           HE1      MET   2  14.163  16.776  -7.648
    6    HB3  MET   2           HB1      MET   2  14.741  12.668  -5.773
    7    HE3  MET   2           HE2      MET   2  13.600  16.009  -9.133
    8    HE2  MET   2           HE3      MET   2  15.291  16.482  -8.971
    9    HG3  MET   2           HG1      MET   2  14.906  15.613  -5.664

  No H/Q in entry =           9
  In of MODEL   36
    1    HA   ASP   3           HA       ASP   3  13.569   9.610  -2.519
    2    HB2  ASP   3           HB2      ASP   3  11.434  10.856  -0.856
    3    H    ASP   3           HN       ASP   3  11.966  12.060  -2.758
    4    HB3  ASP   3           HB1      ASP   3  11.535   9.098  -0.874

  No H/Q in entry =           4
  In of MODEL   36
    1    HA   CYS   4           HA       CYS   4  10.441   7.686  -4.897
    2    HB2  CYS   4           HB2      CYS   4  12.678   5.826  -4.294
    3    H    CYS   4           HN       CYS   4  12.462   7.544  -2.769
    4    HB3  CYS   4           HB1      CYS   4  11.228   5.124  -5.006

  No H/Q in entry =           4
  In of MODEL   36
    1    HA   THR   5           HA       THR   5   9.829   5.337  -0.182
    2    HB   THR   5           HB       THR   5   7.339   6.015  -1.686
    3    HG1  THR   5           HG1      THR   5   8.336   7.905  -2.000
    4   HG21  THR   5          HG21      THR   5   8.134   6.315   1.199
    5   HG23  THR   5          HG22      THR   5   7.094   5.062   0.520
    6   HG22  THR   5          HG23      THR   5   6.567   6.745   0.515
    7    H    THR   5           HN       THR   5  11.130   6.365  -1.739

  No H/Q in entry =           7
  In of MODEL   36
    1    HA   THR   6           HA       THR   6   9.044   1.723  -2.695
    2    HB   THR   6           HB       THR   6  10.604  -0.139  -1.894
    3    HG1  THR   6           HG1      THR   6  11.398   0.468  -0.002
    4   HG22  THR   6          HG21      THR   6  12.073   2.287  -2.871
    5   HG21  THR   6          HG22      THR   6  11.028   1.312  -3.905
    6   HG23  THR   6          HG23      THR   6  12.451   0.589  -3.156
    7    H    THR   6           HN       THR   6  10.538   3.255  -0.737

  No H/Q in entry =           7
  In of MODEL   36
    1    HA3  GLY   7           HA2      GLY   7   7.556  -1.551   0.182
    2    H    GLY   7           HN       GLY   7   8.075  -0.360  -2.154
    3    HA2  GLY   7           HA1      GLY   7   6.515  -0.140   0.291

  No H/Q in entry =           3
  In of MODEL   36
    1    HA   PRO   8           HA       PRO   8   4.238  -3.590  -1.900
    2    HB2  PRO   8           HB2      PRO   8   2.088  -3.661  -0.262
    3    HG2  PRO   8           HG2      PRO   8   2.667  -1.965   1.215
    4    HD2  PRO   8           HD2      PRO   8   4.815  -1.149   1.342
    5    HB3  PRO   8           HB1      PRO   8   3.562  -4.580   0.064
    6    HG3  PRO   8           HG1      PRO   8   3.397  -3.358   2.037
    7    HD3  PRO   8           HD1      PRO   8   5.531  -2.772   1.404

  No H/Q in entry =           7
  In of MODEL   36
    1    HA   CYS   9           HA       CYS   9   1.201  -0.178  -2.595
    2    HB2  CYS   9           HB2      CYS   9   2.262   1.298  -0.322
    3    H    CYS   9           HN       CYS   9   3.612  -0.346  -0.949
    4    HB3  CYS   9           HB1      CYS   9   1.747   2.371  -1.619

  No H/Q in entry =           4
  In of MODEL   36
    1    HA   CYS  10           HA       CYS  10   3.663   1.171  -5.939
    2    HB2  CYS  10           HB2      CYS  10   5.750   2.437  -5.644
    3    H    CYS  10           HN       CYS  10   3.837  -0.617  -3.779
    4    HB3  CYS  10           HB1      CYS  10   4.592   2.802  -4.370

  No H/Q in entry =           4
  In of MODEL   36
    1    HA   ARG  11           HA       ARG  11   6.901  -1.675  -7.056
    2    HB2  ARG  11           HB2      ARG  11   5.715  -0.473  -9.559
    3    HG2  ARG  11           HG2      ARG  11   5.101  -2.970  -8.003
    4    HD2  ARG  11           HD2      ARG  11   5.188  -3.445 -10.427
    5    HE   ARG  11           HE       ARG  11   3.698  -1.022 -10.681
    6   HH11  ARG  11          HH11      ARG  11   4.207  -4.172 -12.094
    7   HH12  ARG  11          HH12      ARG  11   3.701  -3.682 -13.676
    8   HH21  ARG  11          HH21      ARG  11   3.032  -0.375 -12.760
    9   HH22  ARG  11          HH22      ARG  11   3.035  -1.526 -14.055
   10    H    ARG  11           HN       ARG  11   5.682   0.985  -7.383
   11    HB3  ARG  11           HB1      ARG  11   6.756  -1.890  -9.564
   12    HG3  ARG  11           HG1      ARG  11   4.029  -1.608  -8.335
   13    HD3  ARG  11           HD1      ARG  11   3.565  -3.583  -9.752

  No H/Q in entry =          13
  In of MODEL   36
    1    HA   GLN  12           HA       GLN  12  10.069   1.037  -8.861
    2    HB2  GLN  12           HB2      GLN  12   8.729   1.354 -11.553
    3    HG2  GLN  12           HG2      GLN  12   9.447  -0.990 -10.360
    4   HE21  GLN  12          HE21      GLN  12  11.741   0.502  -9.828
    5   HE22  GLN  12          HE22      GLN  12  13.093  -0.287 -10.558
    6    H    GLN  12           HN       GLN  12   7.202   0.865  -9.524
    7    HB3  GLN  12           HB1      GLN  12  10.440   1.615 -11.244
    8    HG3  GLN  12           HG1      GLN  12   9.334  -0.717 -12.098

  No H/Q in entry =           8
  In of MODEL   36
    1    HA   CYS  13           HA       CYS  13   9.100   4.877  -6.677
    2    HB2  CYS  13           HB2      CYS  13  11.058   4.919  -8.450
    3    H    CYS  13           HN       CYS  13   9.299   2.706  -7.321
    4    HB3  CYS  13           HB1      CYS  13   9.890   5.835  -9.396

  No H/Q in entry =           4
  In of MODEL   36
    1    HA   LYS  14           HA       LYS  14   5.229   5.896  -8.448
    2    HB2  LYS  14           HB2      LYS  14   5.739   3.722 -10.433
    3    HG2  LYS  14           HG2      LYS  14   5.638   6.673 -10.429
    4    HD2  LYS  14           HD2      LYS  14   5.485   6.195 -13.087
    5    HE2  LYS  14           HE2      LYS  14   4.313   7.979 -11.969
    6    HZ2  LYS  14           HZ1      LYS  14   2.358   7.641 -10.705
    7    HZ1  LYS  14           HZ2      LYS  14   3.528   6.603 -10.061
    8    HZ3  LYS  14           HZ3      LYS  14   2.312   5.988 -11.064
    9    H    LYS  14           HN       LYS  14   6.834   3.530  -7.915
   10    HB3  LYS  14           HB1      LYS  14   4.140   4.452 -10.376
   11    HG3  LYS  14           HG1      LYS  14   6.707   5.571 -11.299
   12    HD3  LYS  14           HD1      LYS  14   4.333   5.007 -12.474
   13    HE3  LYS  14           HE1      LYS  14   3.182   7.070 -12.970

  No H/Q in entry =          13
  In of MODEL   36
    1    HA   LEU  15           HA       LEU  15   3.085   3.182  -5.630
    2    HB2  LEU  15           HB2      LEU  15   1.409   4.560  -4.412
    3    HG   LEU  15           HG       LEU  15   2.327   6.673  -6.295
    4   HD12  LEU  15          HD11      LEU  15  -0.228   6.816  -4.836
    5   HD11  LEU  15          HD12      LEU  15  -0.029   5.434  -5.913
    6   HD13  LEU  15          HD13      LEU  15   0.124   7.073  -6.545
    7   HD22  LEU  15          HD21      LEU  15   3.108   7.883  -4.550
    8   HD21  LEU  15          HD22      LEU  15   2.176   6.975  -3.360
    9   HD23  LEU  15          HD23      LEU  15   1.392   8.225  -4.325
   10    H    LEU  15           HN       LEU  15   3.988   5.622  -6.663
   11    HB3  LEU  15           HB1      LEU  15   3.059   5.130  -4.249

  No H/Q in entry =          11
  In of MODEL   36
    1    HA   LYS  16           HA       LYS  16  -0.145   2.185  -8.325
    2    HB2  LYS  16           HB2      LYS  16  -0.671   0.614  -5.809
    3    HG2  LYS  16           HG2      LYS  16  -0.153  -0.714  -8.381
    4    HD2  LYS  16           HD2      LYS  16   1.277  -1.152  -5.791
    5    HE2  LYS  16           HE2      LYS  16   0.223  -3.072  -7.860
    6    HZ2  LYS  16           HZ1      LYS  16   0.627  -4.415  -6.103
    7    HZ1  LYS  16           HZ2      LYS  16   1.732  -3.358  -5.381
    8    HZ3  LYS  16           HZ3      LYS  16   2.214  -4.324  -6.683
    9    H    LYS  16           HN       LYS  16   1.095   2.121  -5.748
   10    HB3  LYS  16           HB1      LYS  16  -1.693   0.462  -7.231
   11    HG3  LYS  16           HG1      LYS  16   1.204   0.178  -7.691
   12    HD3  LYS  16           HD1      LYS  16  -0.391  -1.695  -5.987
   13    HE3  LYS  16           HE1      LYS  16   1.866  -2.432  -7.844

  No H/Q in entry =          13
  In of MODEL   36
    1    HA   PRO  17           HA       PRO  17  -3.582   4.891  -7.906
    2    HB2  PRO  17           HB2      PRO  17  -5.358   2.566  -8.485
    3    HG2  PRO  17           HG2      PRO  17  -4.261   2.000 -10.459
    4    HD2  PRO  17           HD2      PRO  17  -2.760   1.178  -8.914
    5    HB3  PRO  17           HB1      PRO  17  -5.283   4.149  -9.269
    6    HG3  PRO  17           HG1      PRO  17  -3.444   3.571 -10.559
    7    HD3  PRO  17           HD1      PRO  17  -1.687   2.354  -9.699

  No H/Q in entry =           7
  In of MODEL   36
    1    HA   ALA  18           HA       ALA  18  -4.966   4.378  -3.830
    2    HB3  ALA  18           HB1      ALA  18  -7.096   6.277  -4.782
    3    HB1  ALA  18           HB2      ALA  18  -5.456   6.793  -4.390
    4    HB2  ALA  18           HB3      ALA  18  -6.473   6.067  -3.146
    5    H    ALA  18           HN       ALA  18  -4.993   5.573  -6.355

  No H/Q in entry =           5
  In of MODEL   36
    1    HA3  GLY  19           HA2      GLY  19  -8.183   1.587  -3.024
    2    H    GLY  19           HN       GLY  19  -5.713   2.350  -3.560
    3    HA2  GLY  19           HA1      GLY  19  -8.252   1.570  -4.780

  No H/Q in entry =           3
  In of MODEL   36
    1    HA   THR  20           HA       THR  20  -5.791  -2.035  -5.134
    2    HB   THR  20           HB       THR  20  -3.046  -0.944  -4.677
    3    HG1  THR  20           HG1      THR  20  -4.694  -0.360  -6.905
    4   HG21  THR  20          HG21      THR  20  -4.232  -2.872  -6.652
    5   HG23  THR  20          HG22      THR  20  -3.119  -3.226  -5.331
    6   HG22  THR  20          HG23      THR  20  -2.570  -2.286  -6.719
    7    H    THR  20           HN       THR  20  -5.395   0.725  -4.924

  No H/Q in entry =           7
  In of MODEL   36
    1    HA   THR  21           HA       THR  21  -5.574  -3.254  -0.968
    2    HB   THR  21           HB       THR  21  -5.035  -5.861  -1.062
    3    HG1  THR  21           HG1      THR  21  -4.558  -5.949  -3.248
    4   HG22  THR  21          HG21      THR  21  -7.404  -6.343  -1.442
    5   HG21  THR  21          HG22      THR  21  -7.644  -4.681  -1.981
    6   HG23  THR  21          HG23      THR  21  -7.164  -5.008  -0.316
    7    H    THR  21           HN       THR  21  -5.653  -3.677  -3.735

  No H/Q in entry =           7
  In of MODEL   36
    1    HA   CYS  22           HA       CYS  22  -1.265  -3.746  -0.365
    2    HB2  CYS  22           HB2      CYS  22  -2.372  -2.343   1.541
    3    H    CYS  22           HN       CYS  22  -4.018  -4.172   0.577
    4    HB3  CYS  22           HB1      CYS  22  -2.047  -3.761   2.531

  No H/Q in entry =           4
  In of MODEL   36
    1    HA   TRP  23           HA       TRP  23  -0.998  -7.787   1.743
    2    HB2  TRP  23           HB2      TRP  23  -2.035  -6.688   4.016
    3    HD1  TRP  23           HD1      TRP  23   0.642  -8.184   2.816
    4    HE1  TRP  23           HE1      TRP  23   1.895  -9.792   4.387
    5    HE3  TRP  23           HE3      TRP  23  -3.104  -9.137   6.163
    6    HZ2  TRP  23           HZ2      TRP  23   1.367 -11.269   6.734
    7    HZ3  TRP  23           HZ3      TRP  23  -2.648 -10.658   8.042
    8    HH2  TRP  23           HH2      TRP  23  -0.459 -11.702   8.320
    9    H    TRP  23           HN       TRP  23  -3.053  -5.707   2.020
   10    HB3  TRP  23           HB1      TRP  23  -3.049  -8.115   3.834

  No H/Q in entry =          10
  In of MODEL   36
    1    HA   ARG  24           HA       ARG  24  -6.192  -8.421   0.743
    2    HB2  ARG  24           HB2      ARG  24  -5.866  -9.441  -1.423
    3    HG2  ARG  24           HG2      ARG  24  -2.909  -9.025  -1.235
    4    HD2  ARG  24           HD2      ARG  24  -3.131 -10.923  -2.991
    5    HE   ARG  24           HE       ARG  24  -4.134  -8.599  -4.282
    6   HH11  ARG  24          HH11      ARG  24  -1.392  -9.818  -2.501
    7   HH12  ARG  24          HH12      ARG  24  -0.272  -8.715  -3.227
    8   HH21  ARG  24          HH21      ARG  24  -2.662  -7.148  -5.239
    9   HH22  ARG  24          HH22      ARG  24  -0.992  -7.199  -4.781
   10    H    ARG  24           HN       ARG  24  -4.429  -7.150   1.452
   11    HB3  ARG  24           HB1      ARG  24  -4.966  -7.932  -1.350
   12    HG3  ARG  24           HG1      ARG  24  -3.648 -10.558  -0.768
   13    HD3  ARG  24           HD1      ARG  24  -4.815 -10.408  -3.080

  No H/Q in entry =          13
  In of MODEL   36
    1    HA   THR  25           HA       THR  25  -4.811 -12.442   2.388
    2    HB   THR  25           HB       THR  25  -4.014 -12.683   4.683
    3    HG1  THR  25           HG1      THR  25  -4.432  -9.884   4.870
    4   HG23  THR  25          HG21      THR  25  -1.940 -11.547   4.568
    5   HG22  THR  25          HG22      THR  25  -2.599 -10.321   3.484
    6   HG21  THR  25          HG23      THR  25  -2.392 -11.979   2.919
    7    H    THR  25           HN       THR  25  -4.949  -9.581   2.965

  No H/Q in entry =           7
  In of MODEL   36
    1    HA   SER  26           HA       SER  26  -8.694 -13.171   4.158
    2    HB2  SER  26           HB2      SER  26  -7.148 -15.696   4.687
    3    HG   SER  26           HG       SER  26  -9.158 -16.174   3.171
    4    H    SER  26           HN       SER  26  -5.888 -13.888   4.075
    5    HB3  SER  26           HB1      SER  26  -8.840 -15.560   5.165

  No H/Q in entry =           5
  In of MODEL   36
    1    HA   VAL  27           HA       VAL  27  -8.878 -11.864   8.255
    2    HB   VAL  27           HB       VAL  27  -6.956 -13.337   8.660
    3    H    VAL  27           HN       VAL  27  -7.693 -11.408   5.762

  No H/Q in entry =           3
  In of MODEL   36
    1    HA   SER  28           HA       SER  28  -7.392  -7.624   7.657
    2    HB2  SER  28           HB2      SER  28  -4.554  -8.564   7.439
    3    HG   SER  28           HG       SER  28  -4.662  -8.270   9.510
    4    H    SER  28           HN       SER  28  -6.373 -10.125   6.494
    5    HB3  SER  28           HB1      SER  28  -4.906  -6.839   7.337

  No H/Q in entry =           5
  In of MODEL   36
    1    HA   SER  29           HA       SER  29  -7.313  -6.847   3.318
    2    HB2  SER  29           HB2      SER  29  -9.805  -7.194   3.943
    3    HG   SER  29           HG       SER  29  -9.001  -5.442   1.862
    4    H    SER  29           HN       SER  29  -8.396  -6.641   6.026
    5    HB3  SER  29           HB1      SER  29  -9.868  -5.435   4.047

  No H/Q in entry =           5
  In of MODEL   36
    1    HA   HIS  30           HA       HIS  30  -5.927  -2.718   4.492
    2    HB2  HIS  30           HB2      HIS  30  -3.510  -4.346   3.763
    3    HD1  HIS  30           HD1      HIS  30  -1.645  -3.798   5.782
    4    HD2  HIS  30           HD2      HIS  30  -5.686  -3.317   6.622
    5    HE1  HIS  30           HE1      HIS  30  -1.822  -3.856   8.290
    6    HE2  HIS  30           HE2      HIS  30  -4.287  -3.650   8.771
    7    H    HIS  30           HN       HIS  30  -5.478  -5.477   3.802
    8    HB3  HIS  30           HB1      HIS  30  -3.414  -2.589   3.835

  No H/Q in entry =           8
  In of MODEL   36
    1    HA   TYR  31           HA       TYR  31  -5.518  -1.443   0.275
    2    HB2  TYR  31           HB2      TYR  31  -7.484   0.397   1.654
    3    HD1  TYR  31           HD1      TYR  31  -8.899  -1.089   2.804
    4    HD2  TYR  31           HD2      TYR  31  -7.781  -1.940  -1.212
    5    HE1  TYR  31           HE1      TYR  31 -10.549  -2.911   2.737
    6    HE2  TYR  31           HE2      TYR  31  -9.428  -3.763  -1.290
    7    HH   TYR  31           HH       TYR  31 -10.558  -5.305   0.556
    8    H    TYR  31           HN       TYR  31  -5.672  -0.922   3.165
    9    HB3  TYR  31           HB1      TYR  31  -7.268   0.274  -0.089

  No H/Q in entry =           9
  In of MODEL   36
    1    HA   CYS  32           HA       CYS  32  -2.666   1.799   0.322
    2    HB2  CYS  32           HB2      CYS  32  -2.825   0.792  -2.145
    3    H    CYS  32           HN       CYS  32  -4.674   0.256  -0.993
    4    HB3  CYS  32           HB1      CYS  32  -3.431   2.408  -2.490

  No H/Q in entry =           4
  In of MODEL   36
    1    HA   THR  33           HA       THR  33  -4.983   5.532   0.227
    2    HB   THR  33           HB       THR  33  -3.720   7.307   1.272
    3    HG1  THR  33           HG1      THR  33  -1.610   7.508   1.079
    4   HG22  THR  33          HG21      THR  33  -2.139   5.238   2.523
    5   HG21  THR  33          HG22      THR  33  -3.822   4.753   2.311
    6   HG23  THR  33          HG23      THR  33  -3.434   6.234   3.187
    7    H    THR  33           HN       THR  33  -2.422   4.197  -0.340

  No H/Q in entry =           7
  In of MODEL   36
    1    HA3  GLY  34           HA2      GLY  34  -2.007   6.611  -3.859
    2    H    GLY  34           HN       GLY  34  -1.887   6.096  -1.457
    3    HA2  GLY  34           HA1      GLY  34  -3.413   7.599  -3.495

  No H/Q in entry =           3
  In of MODEL   36
    1    HA   ARG  35           HA       ARG  35   0.790   9.802  -3.143
    2    HB2  ARG  35           HB2      ARG  35  -0.821   9.913  -0.709
    3    HG2  ARG  35           HG2      ARG  35   0.317  12.375  -1.837
    4    HD2  ARG  35           HD2      ARG  35  -1.611  12.112  -0.182
    5    HE   ARG  35           HE       ARG  35  -2.782  10.657  -2.256
    6   HH11  ARG  35          HH11      ARG  35  -3.584  13.279  -0.098
    7   HH12  ARG  35          HH12      ARG  35  -5.279  12.927  -0.099
    8   HH21  ARG  35          HH21      ARG  35  -5.011  10.193  -2.260
    9   HH22  ARG  35          HH22      ARG  35  -6.090  11.175  -1.326
   10    H    ARG  35           HN       ARG  35  -0.106   7.329  -2.183
   11    HB3  ARG  35           HB1      ARG  35   0.774  10.623  -0.502
   12    HG3  ARG  35           HG1      ARG  35  -0.665  11.414  -2.945
   13    HD3  ARG  35           HD1      ARG  35  -1.849  13.202  -1.547

  No H/Q in entry =          13
  In of MODEL   36
    1    HA   SER  36           HA       SER  36   3.871   7.630  -0.620
    2    HB2  SER  36           HB2      SER  36   3.804   6.861   1.801
    3    HG   SER  36           HG       SER  36   1.170   7.871   1.785
    4    H    SER  36           HN       SER  36   0.931   7.479  -0.501
    5    HB3  SER  36           HB1      SER  36   3.254   8.511   1.509

  No H/Q in entry =           5
  In of MODEL   36
    1    HA   CYS  37           HA       CYS  37   3.338   3.221  -0.611
    2    HB2  CYS  37           HB2      CYS  37   5.220   3.920  -2.128
    3    H    CYS  37           HN       CYS  37   4.862   5.551   0.356
    4    HB3  CYS  37           HB1      CYS  37   6.334   3.559  -0.814

  No H/Q in entry =           4
  In of MODEL   36
    1    HA   GLU  38           HA       GLU  38   5.035   2.118   3.410
    2    HB2  GLU  38           HB2      GLU  38   4.227   4.823   4.494
    3    HG2  GLU  38           HG2      GLU  38   7.028   3.807   4.288
    4    H    GLU  38           HN       GLU  38   3.565   4.306   2.097
    5    HB3  GLU  38           HB1      GLU  38   5.024   3.565   5.428
    6    HG3  GLU  38           HG1      GLU  38   6.263   4.605   2.915

  No H/Q in entry =           6
  In of MODEL   36
    1    HA   CYS  39           HA       CYS  39   0.728   0.944   3.952
    2    HB2  CYS  39           HB2      CYS  39   2.075  -1.133   3.012
    3    H    CYS  39           HN       CYS  39   3.425   0.565   3.347
    4    HB3  CYS  39           HB1      CYS  39   2.053  -1.624   4.702

  No H/Q in entry =           4
  In of MODEL   36
    1    HA   PRO  40           HA       PRO  40   1.224   2.074   8.307
    2    HB2  PRO  40           HB2      PRO  40  -1.721   1.637   8.158
    3    HG2  PRO  40           HG2      PRO  40  -2.050   3.232   6.494
    4    HD2  PRO  40           HD2      PRO  40  -1.174   1.504   5.241
    5    HB3  PRO  40           HB1      PRO  40  -0.818   2.995   8.840
    6    HG3  PRO  40           HG1      PRO  40  -0.460   3.970   6.765
    7    HD3  PRO  40           HD1      PRO  40   0.077   2.718   4.905

  No H/Q in entry =           7
  In of MODEL   36
    1    HA   SER  41           HA       SER  41   0.460  -1.794  10.179
    2    HB2  SER  41           HB2      SER  41   0.472  -0.038  12.646
    3    HG   SER  41           HG       SER  41   2.826  -1.068  12.254
    4    H    SER  41           HN       SER  41   0.223   1.114  10.377
    5    HB3  SER  41           HB1      SER  41   0.870  -1.755  12.581

  No H/Q in entry =           5
  In of MODEL   36
    1    HA   TYR  42           HA       TYR  42  -3.685  -1.083  12.292
    2    HB2  TYR  42           HB2      TYR  42  -5.190   0.947  12.220
    3    HD1  TYR  42           HD1      TYR  42  -5.447   1.987   9.984
    4    HD2  TYR  42           HD2      TYR  42  -2.042   2.736  12.422
    5    HE1  TYR  42           HE1      TYR  42  -4.912   3.961   8.619
    6    HE2  TYR  42           HE2      TYR  42  -1.498   4.713  11.065
    7    HH   TYR  42           HH       TYR  42  -3.485   6.270   9.203
    8    H    TYR  42           HN       TYR  42  -1.787   0.718  11.099
    9    HB3  TYR  42           HB1      TYR  42  -3.690   1.154  13.118

  No H/Q in entry =           9
  In of MODEL   36
    1    HA   PRO  43           HA       PRO  43  -5.818  -2.366   8.652
    2    HB2  PRO  43           HB2      PRO  43  -8.333  -2.711   9.612
    3    HG2  PRO  43           HG2      PRO  43  -8.132  -1.573  11.626
    4    HD2  PRO  43           HD2      PRO  43  -6.078  -1.030  12.518
    5    HB3  PRO  43           HB1      PRO  43  -7.003  -3.812   9.990
    6    HG3  PRO  43           HG1      PRO  43  -7.651  -3.201  12.139
    7    HD3  PRO  43           HD1      PRO  43  -5.414  -2.650  12.223

  No H/Q in entry =           7
  In of MODEL   36
    1    HA3  GLY  44           HA2      GLY  44  -9.347   0.641   7.980
    2    H    GLY  44           HN       GLY  44  -8.263  -1.938   7.715
    3    HA2  GLY  44           HA1      GLY  44  -8.179   0.665   6.668

  No H/Q in entry =           3
  In of MODEL   36
    1    HA   ASN  45           HA       ASN  45 -13.096   0.064   5.811
    2    HB2  ASN  45           HB2      ASN  45 -10.982  -0.759   3.808
    3   HD21  ASN  45          HD21      ASN  45 -11.592   0.865   1.825
    4   HD22  ASN  45          HD22      ASN  45 -11.416   2.523   2.277
    5    H    ASN  45           HN       ASN  45 -11.291   0.682   7.048
    6    HB3  ASN  45           HB1      ASN  45 -12.700  -0.592   3.460

  No H/Q in entry =           6
  In of MODEL   36
    1    HA3  GLY  46           HA2      GLY  46 -14.513  -4.052   5.809
    2    H    GLY  46           HN       GLY  46 -14.206  -1.568   6.675
    3    HA2  GLY  46           HA1      GLY  46 -13.044  -4.245   6.753

  No H/Q in entry =           3
  In of MODEL   37
    1    H1   ALA   1           HT3      ALA   1  20.116  13.117   0.396
    2    H2   ALA   1           HT2      ALA   1  21.308  13.408  -0.804
    3    H3   ALA   1           HT1      ALA   1  19.862  14.332  -0.786
    4    HA   ALA   1           HA       ALA   1  19.770  12.729  -2.499
    5    HB1  ALA   1           HB1      ALA   1  19.692  10.289  -1.770
    6    HB2  ALA   1           HB2      ALA   1  20.446  10.833  -0.271
    7    HB3  ALA   1           HB3      ALA   1  21.274  11.066  -1.811

  No H/Q in entry =           7
  In of MODEL   37
    1    HA   MET   2           HA       MET   2  15.727  11.748  -0.909
    2    HB2  MET   2           HB2      MET   2  15.857  13.300  -3.099
    3    H    MET   2           HN       MET   2  17.846  11.336  -2.905
    4    HG2  MET   2           HG2      MET   2  14.044  13.058  -1.187
    5    HE2  MET   2           HE1      MET   2  11.046  13.265  -1.267
    6    HB3  MET   2           HB1      MET   2  14.971  11.939  -3.772
    7    HE1  MET   2           HE2      MET   2  12.077  12.206  -0.304
    8    HE3  MET   2           HE3      MET   2  10.683  11.542  -1.158
    9    HG3  MET   2           HG1      MET   2  13.753  13.994  -2.652

  No H/Q in entry =           9
  In of MODEL   37
    1    HA   ASP   3           HA       ASP   3  14.719   7.718  -2.286
    2    HB2  ASP   3           HB2      ASP   3  14.382   7.821   0.207
    3    H    ASP   3           HN       ASP   3  13.936  10.278  -1.072
    4    HB3  ASP   3           HB1      ASP   3  12.682   8.165  -0.099

  No H/Q in entry =           4
  In of MODEL   37
    1    HA   CYS   4           HA       CYS   4  11.512   8.555  -5.161
    2    HB2  CYS   4           HB2      CYS   4  13.297   6.725  -6.119
    3    H    CYS   4           HN       CYS   4  13.701   7.178  -4.089
    4    HB3  CYS   4           HB1      CYS   4  11.826   5.761  -6.047

  No H/Q in entry =           4
  In of MODEL   37
    1    HA   THR   5           HA       THR   5   8.240   6.114  -3.576
    2    HB   THR   5           HB       THR   5   6.378   5.750  -5.483
    3    HG1  THR   5           HG1      THR   5   8.041   7.780  -6.545
    4   HG21  THR   5          HG21      THR   5   6.466   7.440  -3.549
    5   HG23  THR   5          HG22      THR   5   5.475   7.812  -4.959
    6   HG22  THR   5          HG23      THR   5   7.056   8.569  -4.768
    7    H    THR   5           HN       THR   5   9.674   6.751  -6.050

  No H/Q in entry =           7
  In of MODEL   37
    1    HA   THR   6           HA       THR   6   8.307   1.908  -4.750
    2    HB   THR   6           HB       THR   6  10.410   0.749  -4.394
    3    HG1  THR   6           HG1      THR   6  10.990   1.573  -2.387
    4   HG21  THR   6          HG21      THR   6  10.795   3.554  -5.398
    5   HG23  THR   6          HG22      THR   6  10.476   2.099  -6.343
    6   HG22  THR   6          HG23      THR   6  12.019   2.290  -5.512
    7    H    THR   6           HN       THR   6   9.116   4.134  -3.022

  No H/Q in entry =           7
  In of MODEL   37
    1    HA3  GLY   7           HA2      GLY   7   8.440  -1.007  -1.173
    2    H    GLY   7           HN       GLY   7   8.150  -0.153  -3.606
    3    HA2  GLY   7           HA1      GLY   7   7.308   0.291  -0.826

  No H/Q in entry =           3
  In of MODEL   37
    1    HA   PRO   8           HA       PRO   8   4.761  -3.487  -1.542
    2    HB2  PRO   8           HB2      PRO   8   2.887  -2.881   0.325
    3    HG2  PRO   8           HG2      PRO   8   3.687  -0.813   1.014
    4    HD2  PRO   8           HD2      PRO   8   5.828  -0.113   0.527
    5    HB3  PRO   8           HB1      PRO   8   4.400  -3.706   0.718
    6    HG3  PRO   8           HG1      PRO   8   4.552  -1.873   2.142
    7    HD3  PRO   8           HD1      PRO   8   6.547  -1.663   1.006

  No H/Q in entry =           7
  In of MODEL   37
    1    HA   CYS   9           HA       CYS   9   1.571  -0.568  -3.028
    2    HB2  CYS   9           HB2      CYS   9   1.010   0.375  -0.770
    3    H    CYS   9           HN       CYS   9   3.786  -0.111  -1.145
    4    HB3  CYS   9           HB1      CYS   9   1.962   1.796  -1.185

  No H/Q in entry =           4
  In of MODEL   37
    1    HA   CYS  10           HA       CYS  10   3.944   1.831  -5.787
    2    HB2  CYS  10           HB2      CYS  10   5.923   1.981  -3.570
    3    H    CYS  10           HN       CYS  10   4.293  -0.316  -3.890
    4    HB3  CYS  10           HB1      CYS  10   6.448   2.519  -5.162

  No H/Q in entry =           4
  In of MODEL   37
    1    HA   ARG  11           HA       ARG  11   7.596  -0.258  -7.608
    2    HB2  ARG  11           HB2      ARG  11   6.481  -1.524  -9.471
    3    HG2  ARG  11           HG2      ARG  11   3.823  -0.722  -8.475
    4    HD2  ARG  11           HD2      ARG  11   4.873  -1.338 -11.233
    5    HE   ARG  11           HE       ARG  11   2.252  -0.642 -10.326
    6   HH11  ARG  11          HH11      ARG  11   4.021  -2.575 -12.632
    7   HH12  ARG  11          HH12      ARG  11   2.722  -2.624 -13.775
    8   HH21  ARG  11          HH21      ARG  11   0.542  -0.707 -11.829
    9   HH22  ARG  11          HH22      ARG  11   0.747  -1.564 -13.320
   10    H    ARG  11           HN       ARG  11   5.741   1.848  -7.414
   11    HB3  ARG  11           HB1      ARG  11   5.751  -1.748  -7.887
   12    HG3  ARG  11           HG1      ARG  11   4.627   0.402  -9.573
   13    HD3  ARG  11           HD1      ARG  11   4.201  -2.532 -10.124

  No H/Q in entry =          13
  In of MODEL   37
    1    HA   GLN  12           HA       GLN  12  10.206   1.587 -10.585
    2    HB2  GLN  12           HB2      GLN  12   7.540   1.064 -11.830
    3    HG2  GLN  12           HG2      GLN  12  10.272   0.044 -12.082
    4   HE21  GLN  12          HE21      GLN  12  11.368  -0.421 -13.885
    5   HE22  GLN  12          HE22      GLN  12  10.866  -0.001 -15.484
    6    H    GLN  12           HN       GLN  12   9.120   0.423  -8.962
    7    HB3  GLN  12           HB1      GLN  12   8.652   2.157 -12.642
    8    HG3  GLN  12           HG1      GLN  12   8.726  -0.752 -12.374

  No H/Q in entry =           8
  In of MODEL   37
    1    HA   CYS  13           HA       CYS  13   8.983   5.217  -7.740
    2    HB2  CYS  13           HB2      CYS  13   9.834   5.691 -10.593
    3    H    CYS  13           HN       CYS  13   9.282   3.072  -8.432
    4    HB3  CYS  13           HB1      CYS  13   9.496   7.017  -9.486

  No H/Q in entry =           4
  In of MODEL   37
    1    HA   LYS  14           HA       LYS  14   4.925   5.985  -9.245
    2    HB2  LYS  14           HB2      LYS  14   5.182   3.385 -10.675
    3    HG2  LYS  14           HG2      LYS  14   5.617   5.923 -11.464
    4    HD2  LYS  14           HD2      LYS  14   2.891   5.261 -12.553
    5    HE2  LYS  14           HE2      LYS  14   3.117   7.840 -12.966
    6    HZ3  LYS  14           HZ1      LYS  14   4.547   7.156 -15.052
    7    HZ2  LYS  14           HZ2      LYS  14   2.926   6.699 -14.899
    8    HZ1  LYS  14           HZ3      LYS  14   4.154   5.598 -14.524
    9    H    LYS  14           HN       LYS  14   6.694   3.745  -8.570
   10    HB3  LYS  14           HB1      LYS  14   3.567   4.052 -10.476
   11    HG3  LYS  14           HG1      LYS  14   5.172   4.608 -12.554
   12    HD3  LYS  14           HD1      LYS  14   3.139   6.371 -11.204
   13    HE3  LYS  14           HE1      LYS  14   4.842   7.497 -12.846

  No H/Q in entry =          13
  In of MODEL   37
    1    HA   LEU  15           HA       LEU  15   2.752   4.118  -5.962
    2    HB2  LEU  15           HB2      LEU  15   2.472   6.811  -6.026
    3    HG   LEU  15           HG       LEU  15   2.359   5.076  -4.018
    4   HD13  LEU  15          HD11      LEU  15   2.469   6.891  -2.692
    5   HD12  LEU  15          HD12      LEU  15   0.995   7.598  -3.354
    6   HD11  LEU  15          HD13      LEU  15   2.519   7.756  -4.228
    7   HD21  LEU  15          HD21      LEU  15  -0.184   4.810  -4.851
    8   HD23  LEU  15          HD22      LEU  15  -0.378   6.120  -3.686
    9   HD22  LEU  15          HD23      LEU  15   0.324   4.585  -3.177
   10    H    LEU  15           HN       LEU  15   3.021   6.032  -8.142
   11    HB3  LEU  15           HB1      LEU  15   0.802   6.319  -6.232

  No H/Q in entry =          11
  In of MODEL   37
    1    HA   LYS  16           HA       LYS  16  -0.447   2.053  -8.050
    2    HB2  LYS  16           HB2      LYS  16  -0.582   0.909  -5.254
    3    HG2  LYS  16           HG2      LYS  16   1.610   0.693  -6.663
    4    HD2  LYS  16           HD2      LYS  16  -0.360  -0.878  -8.180
    5    HE2  LYS  16           HE2      LYS  16   2.347  -2.050  -8.194
    6    HZ3  LYS  16           HZ1      LYS  16   0.900  -4.098  -8.342
    7    HZ2  LYS  16           HZ2      LYS  16   0.801  -3.016  -9.638
    8    HZ1  LYS  16           HZ3      LYS  16  -0.423  -3.051  -8.471
    9    H    LYS  16           HN       LYS  16   1.108   2.693  -5.732
   10    HB3  LYS  16           HB1      LYS  16  -1.332   0.215  -6.684
   11    HG3  LYS  16           HG1      LYS  16   0.943  -0.700  -5.809
   12    HD3  LYS  16           HD1      LYS  16   1.177  -0.180  -8.695
   13    HE3  LYS  16           HE1      LYS  16   1.347  -2.427  -6.792

  No H/Q in entry =          13
  In of MODEL   37
    1    HA   PRO  17           HA       PRO  17  -4.194   4.284  -7.477
    2    HB2  PRO  17           HB2      PRO  17  -5.592   1.660  -7.700
    3    HG2  PRO  17           HG2      PRO  17  -4.593   1.102  -9.728
    4    HD2  PRO  17           HD2      PRO  17  -2.845   0.677  -8.285
    5    HB3  PRO  17           HB1      PRO  17  -5.856   3.157  -8.603
    6    HG3  PRO  17           HG1      PRO  17  -4.067   2.769 -10.028
    7    HD3  PRO  17           HD1      PRO  17  -2.059   1.933  -9.264

  No H/Q in entry =           7
  In of MODEL   37
    1    HA   ALA  18           HA       ALA  18  -5.081   3.887  -3.249
    2    HB2  ALA  18           HB1      ALA  18  -7.230   5.213  -2.728
    3    HB3  ALA  18           HB2      ALA  18  -7.162   5.692  -4.424
    4    HB1  ALA  18           HB3      ALA  18  -5.826   6.087  -3.342
    5    H    ALA  18           HN       ALA  18  -5.526   4.876  -5.829

  No H/Q in entry =           5
  In of MODEL   37
    1    HA3  GLY  19           HA2      GLY  19  -8.066   1.168  -1.314
    2    H    GLY  19           HN       GLY  19  -6.186   2.501  -1.923
    3    HA2  GLY  19           HA1      GLY  19  -8.581   1.180  -2.993

  No H/Q in entry =           3
  In of MODEL   37
    1    HA   THR  20           HA       THR  20  -6.067  -2.228  -4.083
    2    HB   THR  20           HB       THR  20  -3.603  -0.527  -4.514
    3    HG1  THR  20           HG1      THR  20  -4.385  -0.089  -6.431
    4   HG23  THR  20          HG21      THR  20  -2.752  -2.234  -5.908
    5   HG22  THR  20          HG22      THR  20  -4.241  -3.171  -5.784
    6   HG21  THR  20          HG23      THR  20  -3.191  -2.993  -4.378
    7    H    THR  20           HN       THR  20  -5.831   0.559  -3.920

  No H/Q in entry =           7
  In of MODEL   37
    1    HA   THR  21           HA       THR  21  -4.571  -3.390  -0.166
    2    HB   THR  21           HB       THR  21  -4.067  -5.913  -0.243
    3    HG1  THR  21           HG1      THR  21  -3.844  -6.485  -2.278
    4   HG21  THR  21          HG21      THR  21  -6.509  -4.539  -0.110
    5   HG23  THR  21          HG22      THR  21  -6.132  -6.153   0.493
    6   HG22  THR  21          HG23      THR  21  -6.774  -5.947  -1.137
    7    H    THR  21           HN       THR  21  -5.455  -3.836  -2.785

  No H/Q in entry =           7
  In of MODEL   37
    1    HA   CYS  22           HA       CYS  22  -0.250  -4.058  -0.929
    2    HB2  CYS  22           HB2      CYS  22   0.905  -2.574   0.804
    3    H    CYS  22           HN       CYS  22  -2.583  -3.974   0.858
    4    HB3  CYS  22           HB1      CYS  22  -0.269  -1.797  -0.253

  No H/Q in entry =           4
  In of MODEL   37
    1    HA   TRP  23           HA       TRP  23   0.726  -7.359   1.729
    2    HB2  TRP  23           HB2      TRP  23  -0.797  -5.888   3.438
    3    HD1  TRP  23           HD1      TRP  23   2.225  -7.043   3.085
    4    HE1  TRP  23           HE1      TRP  23   3.425  -7.941   5.178
    5    HE3  TRP  23           HE3      TRP  23  -1.852  -7.946   6.036
    6    HZ2  TRP  23           HZ2      TRP  23   2.735  -8.904   7.740
    7    HZ3  TRP  23           HZ3      TRP  23  -1.495  -8.856   8.294
    8    HH2  TRP  23           HH2      TRP  23   0.752  -9.325   9.127
    9    H    TRP  23           HN       TRP  23  -1.545  -6.214   0.437
   10    HB3  TRP  23           HB1      TRP  23  -1.562  -7.467   3.585

  No H/Q in entry =          10
  In of MODEL   37
    1    HA   ARG  24           HA       ARG  24  -4.130  -9.597   1.566
    2    HB2  ARG  24           HB2      ARG  24  -2.114  -9.640  -0.626
    3    HG2  ARG  24           HG2      ARG  24  -5.004  -9.096  -0.334
    4    HD2  ARG  24           HD2      ARG  24  -5.024  -9.333  -2.945
    5    HE   ARG  24           HE       ARG  24  -5.840 -11.170  -0.925
    6   HH11  ARG  24          HH11      ARG  24  -5.533 -10.767  -4.378
    7   HH12  ARG  24          HH12      ARG  24  -6.789 -11.900  -4.748
    8   HH21  ARG  24          HH21      ARG  24  -7.493 -12.660  -1.409
    9   HH22  ARG  24          HH22      ARG  24  -7.903 -12.974  -3.062
   10    H    ARG  24           HN       ARG  24  -2.774  -7.838   2.058
   11    HB3  ARG  24           HB1      ARG  24  -3.168 -11.038  -0.459
   12    HG3  ARG  24           HG1      ARG  24  -3.787  -8.286  -1.322
   13    HD3  ARG  24           HD1      ARG  24  -3.793 -10.556  -2.634

  No H/Q in entry =          13
  In of MODEL   37
    1    HA   THR  25           HA       THR  25  -1.790 -12.800   3.541
    2    HB   THR  25           HB       THR  25  -2.899 -12.836   6.041
    3    HG1  THR  25           HG1      THR  25  -2.856 -10.131   5.192
    4   HG21  THR  25          HG21      THR  25  -0.464 -12.626   5.350
    5   HG23  THR  25          HG22      THR  25  -0.955 -11.827   6.843
    6   HG22  THR  25          HG23      THR  25  -0.730 -10.883   5.371
    7    H    THR  25           HN       THR  25  -3.822 -10.684   3.516

  No H/Q in entry =           7
  In of MODEL   37
    1    HA   SER  26           HA       SER  26  -5.934 -14.790   3.037
    2    HB2  SER  26           HB2      SER  26  -6.642 -14.431   5.943
    3    HG   SER  26           HG       SER  26  -4.874 -16.285   5.858
    4    H    SER  26           HN       SER  26  -5.232 -12.237   4.097
    5    HB3  SER  26           HB1      SER  26  -6.744 -15.892   4.962

  No H/Q in entry =           5
  In of MODEL   37
    1    HA   VAL  27           HA       VAL  27  -9.203 -11.589   3.283
    2    HB   VAL  27           HB       VAL  27 -10.151 -13.224   4.849
    3    H    VAL  27           HN       VAL  27  -6.956 -12.063   5.032

  No H/Q in entry =           3
  In of MODEL   37
    1    HA   SER  28           HA       SER  28  -8.606  -8.143   6.574
    2    HB2  SER  28           HB2      SER  28  -5.906  -9.174   7.479
    3    HG   SER  28           HG       SER  28  -7.604 -10.442   8.300
    4    H    SER  28           HN       SER  28  -7.604 -10.746   6.321
    5    HB3  SER  28           HB1      SER  28  -6.738  -7.746   8.097

  No H/Q in entry =           5
  In of MODEL   37
    1    HA   SER  29           HA       SER  29  -6.131  -6.651   3.198
    2    HB2  SER  29           HB2      SER  29  -8.890  -5.453   2.894
    3    HG   SER  29           HG       SER  29  -8.390  -7.727   2.312
    4    H    SER  29           HN       SER  29  -8.571  -6.922   4.740
    5    HB3  SER  29           HB1      SER  29  -7.546  -5.073   1.818

  No H/Q in entry =           5
  In of MODEL   37
    1    HA   HIS  30           HA       HIS  30  -4.954  -3.358   5.905
    2    HB2  HIS  30           HB2      HIS  30  -2.722  -4.253   4.156
    3    HD1  HIS  30           HD1      HIS  30  -0.947  -2.920   6.688
    4    HD2  HIS  30           HD2      HIS  30  -3.827  -5.916   6.702
    5    HE1  HIS  30           HE1      HIS  30  -0.512  -4.261   8.770
    6    HE2  HIS  30           HE2      HIS  30  -2.321  -6.014   8.803
    7    H    HIS  30           HN       HIS  30  -4.585  -5.396   4.018
    8    HB3  HIS  30           HB1      HIS  30  -2.599  -2.640   4.851

  No H/Q in entry =           8
  In of MODEL   37
    1    HA   TYR  31           HA       TYR  31  -5.592  -1.728   0.900
    2    HB2  TYR  31           HB2      TYR  31  -6.757  -0.397   3.353
    3    HD1  TYR  31           HD1      TYR  31  -7.394  -2.464   0.326
    4    HD2  TYR  31           HD2      TYR  31  -8.863  -1.098   4.078
    5    HE1  TYR  31           HE1      TYR  31  -9.290  -4.019   0.143
    6    HE2  TYR  31           HE2      TYR  31 -10.762  -2.650   3.906
    7    HH   TYR  31           HH       TYR  31 -11.800  -3.998   1.225
    8    H    TYR  31           HN       TYR  31  -5.022  -3.327   2.413
    9    HB3  TYR  31           HB1      TYR  31  -7.038   0.140   1.700

  No H/Q in entry =           9
  In of MODEL   37
    1    HA   CYS  32           HA       CYS  32  -2.648   1.468   1.485
    2    HB2  CYS  32           HB2      CYS  32  -2.239   0.406  -0.750
    3    H    CYS  32           HN       CYS  32  -4.972   0.346   0.069
    4    HB3  CYS  32           HB1      CYS  32  -3.264   1.644  -1.469

  No H/Q in entry =           4
  In of MODEL   37
    1    HA   THR  33           HA       THR  33  -4.658   5.247   1.959
    2    HB   THR  33           HB       THR  33  -3.103   7.192   2.053
    3    HG1  THR  33           HG1      THR  33  -1.098   5.297   1.414
    4   HG23  THR  33          HG21      THR  33  -2.525   6.632   4.111
    5   HG22  THR  33          HG22      THR  33  -1.443   5.367   3.530
    6   HG21  THR  33          HG23      THR  33  -3.154   5.018   3.778
    7    H    THR  33           HN       THR  33  -2.335   3.730   1.504

  No H/Q in entry =           7
  In of MODEL   37
    1    HA3  GLY  34           HA2      GLY  34  -3.374   5.660  -2.928
    2    H    GLY  34           HN       GLY  34  -2.232   5.648  -0.635
    3    HA2  GLY  34           HA1      GLY  34  -4.322   6.970  -2.240

  No H/Q in entry =           3
  In of MODEL   37
    1    HA   ARG  35           HA       ARG  35  -0.433   9.087  -3.001
    2    HB2  ARG  35           HB2      ARG  35  -1.750  10.449  -0.690
    3    HG2  ARG  35           HG2      ARG  35  -1.753  12.269  -2.605
    4    HD2  ARG  35           HD2      ARG  35  -3.594   9.905  -2.838
    5    HE   ARG  35           HE       ARG  35  -3.734  12.348  -4.048
    6   HH11  ARG  35          HH11      ARG  35  -5.711  10.625  -1.746
    7   HH12  ARG  35          HH12      ARG  35  -7.186  11.364  -2.270
    8   HH21  ARG  35          HH21      ARG  35  -5.673  13.322  -4.739
    9   HH22  ARG  35          HH22      ARG  35  -7.165  12.895  -3.970
   10    H    ARG  35           HN       ARG  35  -1.942   7.957  -0.737
   11    HB3  ARG  35           HB1      ARG  35  -0.264  11.131  -1.337
   12    HG3  ARG  35           HG1      ARG  35  -1.573  10.840  -3.625
   13    HD3  ARG  35           HD1      ARG  35  -3.693  11.054  -1.505

  No H/Q in entry =          13
  In of MODEL   37
    1    HA   SER  36           HA       SER  36   2.882   7.659  -0.547
    2    HB2  SER  36           HB2      SER  36   1.142   7.999   1.459
    3    HG   SER  36           HG       SER  36   3.525   6.729   2.179
    4    H    SER  36           HN       SER  36   0.222   6.828  -1.273
    5    HB3  SER  36           HB1      SER  36   1.480   6.283   1.690

  No H/Q in entry =           5
  In of MODEL   37
    1    HA   CYS  37           HA       CYS  37   3.511   3.557  -1.772
    2    HB2  CYS  37           HB2      CYS  37   6.142   4.327  -0.496
    3    H    CYS  37           HN       CYS  37   4.328   5.959  -0.465
    4    HB3  CYS  37           HB1      CYS  37   5.888   2.876  -1.460

  No H/Q in entry =           4
  In of MODEL   37
    1    HA   GLU  38           HA       GLU  38   3.725   1.756   2.443
    2    HB2  GLU  38           HB2      GLU  38   5.118   3.856   3.397
    3    HG2  GLU  38           HG2      GLU  38   4.893   2.630   5.722
    4    H    GLU  38           HN       GLU  38   3.706   4.535   1.502
    5    HB3  GLU  38           HB1      GLU  38   3.672   3.989   4.390
    6    HG3  GLU  38           HG1      GLU  38   4.112   1.403   4.727

  No H/Q in entry =           6
  In of MODEL   37
    1    HA   CYS  39           HA       CYS  39  -0.396   2.528   3.800
    2    HB2  CYS  39           HB2      CYS  39   0.155  -0.387   4.397
    3    H    CYS  39           HN       CYS  39   2.200   1.186   4.185
    4    HB3  CYS  39           HB1      CYS  39  -1.444   0.339   4.276

  No H/Q in entry =           4
  In of MODEL   37
    1    HA   PRO  40           HA       PRO  40  -0.514   3.323   8.136
    2    HB2  PRO  40           HB2      PRO  40  -3.183   3.285   8.611
    3    HG2  PRO  40           HG2      PRO  40  -3.905   2.241   6.667
    4    HD2  PRO  40           HD2      PRO  40  -2.551   2.053   4.813
    5    HB3  PRO  40           HB1      PRO  40  -2.388   4.594   7.729
    6    HG3  PRO  40           HG1      PRO  40  -3.966   3.937   6.152
    7    HD3  PRO  40           HD1      PRO  40  -2.048   3.754   4.889

  No H/Q in entry =           7
  In of MODEL   37
    1    HA   SER  41           HA       SER  41  -1.364  -0.464  10.145
    2    HB2  SER  41           HB2      SER  41  -0.769   1.569  12.280
    3    HG   SER  41           HG       SER  41   0.658  -0.715  11.392
    4    H    SER  41           HN       SER  41  -1.428   2.463  10.225
    5    HB3  SER  41           HB1      SER  41  -1.082  -0.114  12.703

  No H/Q in entry =           5
  In of MODEL   37
    1    HA   TYR  42           HA       TYR  42  -5.568  -0.150  11.410
    2    HB2  TYR  42           HB2      TYR  42  -5.951   2.605  10.221
    3    HD1  TYR  42           HD1      TYR  42  -5.603   0.914  13.543
    4    HD2  TYR  42           HD2      TYR  42  -4.662   4.281  11.119
    5    HE1  TYR  42           HE1      TYR  42  -4.348   1.902  15.413
    6    HE2  TYR  42           HE2      TYR  42  -3.403   5.278  12.981
    7    HH   TYR  42           HH       TYR  42  -2.287   4.600  15.022
    8    H    TYR  42           HN       TYR  42  -3.755   1.027   9.430
    9    HB3  TYR  42           HB1      TYR  42  -7.020   1.802  11.366

  No H/Q in entry =           9
  In of MODEL   37
    1    HA   PRO  43           HA       PRO  43  -6.557  -1.756   7.191
    2    HB2  PRO  43           HB2      PRO  43  -8.083  -3.564   9.006
    3    HG2  PRO  43           HG2      PRO  43  -6.180  -4.388  10.065
    4    HD2  PRO  43           HD2      PRO  43  -6.341  -2.323  11.078
    5    HB3  PRO  43           HB1      PRO  43  -7.087  -3.960   7.600
    6    HG3  PRO  43           HG1      PRO  43  -5.103  -3.786   8.791
    7    HD3  PRO  43           HD1      PRO  43  -4.747  -2.106  10.326

  No H/Q in entry =           7
  In of MODEL   37
    1    HA3  GLY  44           HA2      GLY  44 -10.392   0.667   9.600
    2    H    GLY  44           HN       GLY  44  -8.562  -0.865   9.923
    3    HA2  GLY  44           HA1      GLY  44 -10.666  -0.062   8.025

  No H/Q in entry =           3
  In of MODEL   37
    1    HA   ASN  45           HA       ASN  45 -13.255  -2.376  10.886
    2    HB2  ASN  45           HB2      ASN  45 -14.741   0.159  11.588
    3   HD21  ASN  45          HD21      ASN  45 -12.504  -2.189  13.036
    4   HD22  ASN  45          HD22      ASN  45 -11.575  -1.020  13.906
    5    H    ASN  45           HN       ASN  45 -12.711   0.332   9.878
    6    HB3  ASN  45           HB1      ASN  45 -14.833  -1.398  12.405

  No H/Q in entry =           6
  In of MODEL   37
    1    HA3  GLY  46           HA2      GLY  46 -15.647  -0.449   6.785
    2    H    GLY  46           HN       GLY  46 -14.407   0.147   8.759
    3    HA2  GLY  46           HA1      GLY  46 -16.385  -1.758   7.696

  No H/Q in entry =           3
  In of MODEL   38
    1    H1   ALA   1           HT3      ALA   1  19.259   8.549  -1.980
    2    H2   ALA   1           HT2      ALA   1  20.594   9.258  -1.167
    3    H3   ALA   1           HT1      ALA   1  19.617   8.097  -0.366
    4    HA   ALA   1           HA       ALA   1  18.917  10.060   0.499
    5    HB2  ALA   1           HB1      ALA   1  18.976  12.081  -0.527
    6    HB3  ALA   1           HB2      ALA   1  18.476  11.428  -2.088
    7    HB1  ALA   1           HB3      ALA   1  20.145  11.245  -1.550

  No H/Q in entry =           7
  In of MODEL   38
    1    HA   MET   2           HA       MET   2  15.014   8.234  -0.367
    2    HB2  MET   2           HB2      MET   2  15.277   8.563   2.232
    3    H    MET   2           HN       MET   2  16.940   9.582   1.164
    4    HG2  MET   2           HG2      MET   2  13.598   7.097   1.149
    5    HE2  MET   2           HE1      MET   2  10.174   7.843   2.137
    6    HB3  MET   2           HB1      MET   2  14.204   9.929   1.961
    7    HE1  MET   2           HE2      MET   2  11.064   6.553   1.328
    8    HE3  MET   2           HE3      MET   2   9.866   7.491   0.436
    9    HG3  MET   2           HG1      MET   2  13.041   7.856   2.639

  No H/Q in entry =           9
  In of MODEL   38
    1    HA   ASP   3           HA       ASP   3  12.958  11.718  -2.030
    2    HB2  ASP   3           HB2      ASP   3  15.371  11.276  -3.710
    3    H    ASP   3           HN       ASP   3  14.571   9.276  -2.287
    4    HB3  ASP   3           HB1      ASP   3  14.040  12.167  -4.441

  No H/Q in entry =           4
  In of MODEL   38
    1    HA   CYS   4           HA       CYS   4  10.391   9.206  -4.512
    2    HB2  CYS   4           HB2      CYS   4  12.736   7.910  -5.047
    3    H    CYS   4           HN       CYS   4  12.199   8.925  -2.274
    4    HB3  CYS   4           HB1      CYS   4  11.705   6.570  -4.559

  No H/Q in entry =           4
  In of MODEL   38
    1    HA   THR   5           HA       THR   5   8.604   6.036  -1.876
    2    HB   THR   5           HB       THR   5   6.258   5.727  -2.634
    3    HG1  THR   5           HG1      THR   5   7.143   7.015  -4.999
    4   HG21  THR   5          HG21      THR   5   7.444   8.095  -1.965
    5   HG23  THR   5          HG22      THR   5   5.709   7.820  -2.126
    6   HG22  THR   5          HG23      THR   5   6.625   8.487  -3.477
    7    H    THR   5           HN       THR   5   9.339   6.703  -4.645

  No H/Q in entry =           7
  In of MODEL   38
    1    HA   THR   6           HA       THR   6   8.682   2.005  -3.617
    2    HB   THR   6           HB       THR   6  10.936   1.696  -1.666
    3    HG1  THR   6           HG1      THR   6  11.905   3.328  -2.525
    4   HG22  THR   6          HG21      THR   6  11.976   0.586  -3.673
    5   HG21  THR   6          HG22      THR   6  10.391   0.692  -4.439
    6   HG23  THR   6          HG23      THR   6  10.593  -0.239  -2.955
    7    H    THR   6           HN       THR   6   9.111   3.993  -1.490

  No H/Q in entry =           7
  In of MODEL   38
    1    HA3  GLY   7           HA2      GLY   7   7.711  -1.206  -0.660
    2    H    GLY   7           HN       GLY   7   7.697   0.147  -3.009
    3    HA2  GLY   7           HA1      GLY   7   6.536   0.068  -0.367

  No H/Q in entry =           3
  In of MODEL   38
    1    HA   PRO   8           HA       PRO   8   4.372  -3.565  -2.343
    2    HB2  PRO   8           HB2      PRO   8   2.394  -3.782  -0.508
    3    HG2  PRO   8           HG2      PRO   8   2.969  -2.021   0.893
    4    HD2  PRO   8           HD2      PRO   8   5.047  -1.034   0.811
    5    HB3  PRO   8           HB1      PRO   8   3.962  -4.575  -0.316
    6    HG3  PRO   8           HG1      PRO   8   3.884  -3.337   1.653
    7    HD3  PRO   8           HD1      PRO   8   5.894  -2.594   0.809

  No H/Q in entry =           7
  In of MODEL   38
    1    HA   CYS   9           HA       CYS   9   0.949  -0.504  -2.778
    2    HB2  CYS   9           HB2      CYS   9   1.668   0.778  -0.277
    3    H    CYS   9           HN       CYS   9   3.328  -0.477  -1.073
    4    HB3  CYS   9           HB1      CYS   9   1.051   1.948  -1.437

  No H/Q in entry =           4
  In of MODEL   38
    1    HA   CYS  10           HA       CYS  10   3.225   1.665  -5.811
    2    HB2  CYS  10           HB2      CYS  10   4.936   3.307  -5.257
    3    H    CYS  10           HN       CYS  10   3.665  -0.308  -3.871
    4    HB3  CYS  10           HB1      CYS  10   3.748   3.217  -3.962

  No H/Q in entry =           4
  In of MODEL   38
    1    HA   ARG  11           HA       ARG  11   6.693  -0.655  -7.179
    2    HB2  ARG  11           HB2      ARG  11   4.389  -1.686  -8.107
    3    HG2  ARG  11           HG2      ARG  11   6.990  -2.452  -9.399
    4    HD2  ARG  11           HD2      ARG  11   4.878  -4.306  -8.391
    5    HE   ARG  11           HE       ARG  11   6.294  -4.867 -10.827
    6   HH11  ARG  11          HH11      ARG  11   6.400  -5.070  -7.345
    7   HH12  ARG  11          HH12      ARG  11   7.526  -6.386  -7.330
    8   HH21  ARG  11          HH21      ARG  11   7.775  -6.598 -10.810
    9   HH22  ARG  11          HH22      ARG  11   8.307  -7.253  -9.298
   10    H    ARG  11           HN       ARG  11   4.192   0.862  -7.542
   11    HB3  ARG  11           HB1      ARG  11   5.061  -1.088  -9.618
   12    HG3  ARG  11           HG1      ARG  11   6.575  -2.880  -7.738
   13    HD3  ARG  11           HD1      ARG  11   4.670  -3.510  -9.950

  No H/Q in entry =          13
  In of MODEL   38
    1    HA   GLN  12           HA       GLN  12   9.817   1.139  -9.676
    2    HB2  GLN  12           HB2      GLN  12   7.316   0.974 -11.314
    3    HG2  GLN  12           HG2      GLN  12   9.164  -0.846 -11.098
    4   HE21  GLN  12          HE21      GLN  12  10.709  -1.680 -12.916
    5   HE22  GLN  12          HE22      GLN  12  12.024  -0.620 -13.277
    6    H    GLN  12           HN       GLN  12   8.444  -0.078  -8.333
    7    HB3  GLN  12           HB1      GLN  12   8.642   1.989 -11.863
    8    HG3  GLN  12           HG1      GLN  12   8.457  -0.471 -12.669

  No H/Q in entry =           8
  In of MODEL   38
    1    HA   CYS  13           HA       CYS  13   8.370   4.581  -6.680
    2    HB2  CYS  13           HB2      CYS  13   9.926   5.018  -9.169
    3    H    CYS  13           HN       CYS  13   8.626   2.487  -7.530
    4    HB3  CYS  13           HB1      CYS  13   9.176   6.439  -8.450

  No H/Q in entry =           4
  In of MODEL   38
    1    HA   LYS  14           HA       LYS  14   4.748   5.775  -8.970
    2    HB2  LYS  14           HB2      LYS  14   5.327   3.995 -10.777
    3    HG2  LYS  14           HG2      LYS  14   2.404   4.628 -10.596
    4    HD2  LYS  14           HD2      LYS  14   3.191   5.237 -13.091
    5    HE2  LYS  14           HE2      LYS  14   1.362   3.786 -12.725
    6    HZ3  LYS  14           HZ1      LYS  14   1.809   1.418 -12.048
    7    HZ2  LYS  14           HZ2      LYS  14   1.959   2.574 -10.822
    8    HZ1  LYS  14           HZ3      LYS  14   3.343   1.928 -11.549
    9    H    LYS  14           HN       LYS  14   6.197   3.344  -8.150
   10    HB3  LYS  14           HB1      LYS  14   4.045   3.055 -10.026
   11    HG3  LYS  14           HG1      LYS  14   3.604   5.870 -10.959
   12    HD3  LYS  14           HD1      LYS  14   4.363   3.975 -12.708
   13    HE3  LYS  14           HE1      LYS  14   2.515   2.890 -13.712

  No H/Q in entry =          13
  In of MODEL   38
    1    HA   LEU  15           HA       LEU  15   2.384   4.594  -5.458
    2    HB2  LEU  15           HB2      LEU  15   1.579   7.227  -6.542
    3    HG   LEU  15           HG       LEU  15   3.115   6.614  -4.444
    4   HD12  LEU  15          HD11      LEU  15   2.549   8.858  -3.537
    5   HD11  LEU  15          HD12      LEU  15   1.191   8.921  -4.661
    6   HD13  LEU  15          HD13      LEU  15   2.842   8.842  -5.276
    7   HD22  LEU  15          HD21      LEU  15   1.830   5.600  -2.891
    8   HD21  LEU  15          HD22      LEU  15   0.333   6.277  -3.531
    9   HD23  LEU  15          HD23      LEU  15   1.372   7.256  -2.496
   10    H    LEU  15           HN       LEU  15   3.251   6.273  -7.523
   11    HB3  LEU  15           HB1      LEU  15   0.377   6.391  -5.577

  No H/Q in entry =          11
  In of MODEL   38
    1    HA   LYS  16           HA       LYS  16  -0.722   2.401  -7.567
    2    HB2  LYS  16           HB2      LYS  16  -0.696   1.480  -4.704
    3    HG2  LYS  16           HG2      LYS  16   0.500   0.568  -7.227
    4    HD2  LYS  16           HD2      LYS  16  -1.168  -1.196  -5.568
    5    HE2  LYS  16           HE2      LYS  16   1.717  -1.656  -5.900
    6    HZ2  LYS  16           HZ1      LYS  16   1.141  -3.254  -7.472
    7    HZ1  LYS  16           HZ2      LYS  16  -0.287  -3.684  -6.674
    8    HZ3  LYS  16           HZ3      LYS  16   1.210  -4.131  -6.026
    9    H    LYS  16           HN       LYS  16   0.577   3.348  -5.153
   10    HB3  LYS  16           HB1      LYS  16  -1.830   0.810  -5.867
   11    HG3  LYS  16           HG1      LYS  16   1.051   0.362  -5.563
   12    HD3  LYS  16           HD1      LYS  16  -0.622  -1.386  -7.236
   13    HE3  LYS  16           HE1      LYS  16   0.589  -2.326  -4.723

  No H/Q in entry =          13
  In of MODEL   38
    1    HA   PRO  17           HA       PRO  17  -4.532   4.569  -7.174
    2    HB2  PRO  17           HB2      PRO  17  -6.372   2.639  -7.764
    3    HG2  PRO  17           HG2      PRO  17  -5.003   0.770  -7.651
    4    HD2  PRO  17           HD2      PRO  17  -2.700   0.938  -7.658
    5    HB3  PRO  17           HB1      PRO  17  -5.361   3.428  -8.979
    6    HG3  PRO  17           HG1      PRO  17  -4.778   1.211  -9.354
    7    HD3  PRO  17           HD1      PRO  17  -2.694   2.134  -8.970

  No H/Q in entry =           7
  In of MODEL   38
    1    HA   ALA  18           HA       ALA  18  -5.888   3.976  -3.098
    2    HB1  ALA  18           HB1      ALA  18  -6.673   6.274  -3.644
    3    HB2  ALA  18           HB2      ALA  18  -7.717   5.412  -2.513
    4    HB3  ALA  18           HB3      ALA  18  -8.192   5.574  -4.204
    5    H    ALA  18           HN       ALA  18  -6.043   5.082  -5.661

  No H/Q in entry =           5
  In of MODEL   38
    1    HA3  GLY  19           HA2      GLY  19  -8.419   0.611  -1.955
    2    H    GLY  19           HN       GLY  19  -6.480   1.983  -2.544
    3    HA2  GLY  19           HA1      GLY  19  -9.080   0.992  -3.538

  No H/Q in entry =           3
  In of MODEL   38
    1    HA   THR  20           HA       THR  20  -6.084  -2.126  -4.814
    2    HB   THR  20           HB       THR  20  -3.492  -0.799  -4.005
    3    HG1  THR  20           HG1      THR  20  -3.797   0.580  -5.550
    4   HG21  THR  20          HG21      THR  20  -4.186  -2.975  -5.899
    5   HG23  THR  20          HG22      THR  20  -2.785  -2.794  -4.843
    6   HG22  THR  20          HG23      THR  20  -2.896  -1.852  -6.330
    7    H    THR  20           HN       THR  20  -5.699   0.274  -3.201

  No H/Q in entry =           7
  In of MODEL   38
    1    HA   THR  21           HA       THR  21  -5.189  -4.864  -1.606
    2    HB   THR  21           HB       THR  21  -3.789  -6.918  -2.535
    3    HG1  THR  21           HG1      THR  21  -3.519  -6.937  -4.631
    4   HG21  THR  21          HG21      THR  21  -6.574  -6.201  -3.396
    5   HG23  THR  21          HG22      THR  21  -6.082  -7.215  -2.039
    6   HG22  THR  21          HG23      THR  21  -5.833  -7.774  -3.693
    7    H    THR  21           HN       THR  21  -4.743  -4.055  -4.312

  No H/Q in entry =           7
  In of MODEL   38
    1    HA   CYS  22           HA       CYS  22  -1.283  -3.155  -0.383
    2    HB2  CYS  22           HB2      CYS  22  -2.869  -2.574   1.500
    3    H    CYS  22           HN       CYS  22  -3.921  -4.032  -0.063
    4    HB3  CYS  22           HB1      CYS  22  -2.489  -4.142   2.203

  No H/Q in entry =           4
  In of MODEL   38
    1    HA   TRP  23           HA       TRP  23  -0.131  -7.559   0.354
    2    HB2  TRP  23           HB2      TRP  23   0.427  -6.237   2.642
    3    HD1  TRP  23           HD1      TRP  23   2.091  -7.367   0.250
    4    HE1  TRP  23           HE1      TRP  23   4.156  -8.844   0.676
    5    HE3  TRP  23           HE3      TRP  23   0.980  -8.975   4.975
    6    HZ2  TRP  23           HZ2      TRP  23   5.178 -10.474   2.741
    7    HZ3  TRP  23           HZ3      TRP  23   2.554 -10.491   6.105
    8    HH2  TRP  23           HH2      TRP  23   4.609 -11.225   5.010
    9    H    TRP  23           HN       TRP  23  -2.309  -6.007   1.501
   10    HB3  TRP  23           HB1      TRP  23  -0.270  -7.710   3.309

  No H/Q in entry =          10
  In of MODEL   38
    1    HA   ARG  24           HA       ARG  24  -3.248 -10.487   1.389
    2    HB2  ARG  24           HB2      ARG  24  -3.244 -10.271  -1.621
    3    HG2  ARG  24           HG2      ARG  24  -4.366  -8.568   0.150
    4    HD2  ARG  24           HD2      ARG  24  -6.143 -10.900  -0.091
    5    HE   ARG  24           HE       ARG  24  -7.684  -8.485   0.047
    6   HH11  ARG  24          HH11      ARG  24  -6.378 -10.909  -2.097
    7   HH12  ARG  24          HH12      ARG  24  -7.566 -10.639  -3.328
    8   HH21  ARG  24          HH21      ARG  24  -9.247  -8.129  -1.571
    9   HH22  ARG  24          HH22      ARG  24  -9.195  -9.061  -3.030
   10    H    ARG  24           HN       ARG  24  -1.337  -9.179  -0.433
   11    HB3  ARG  24           HB1      ARG  24  -4.294 -11.371  -0.739
   12    HG3  ARG  24           HG1      ARG  24  -4.990  -8.877  -1.471
   13    HD3  ARG  24           HD1      ARG  24  -6.063  -9.657   1.157

  No H/Q in entry =          13
  In of MODEL   38
    1    HA   THR  25           HA       THR  25  -0.409 -13.783   0.582
    2    HB   THR  25           HB       THR  25   0.616 -14.593   2.705
    3    HG1  THR  25           HG1      THR  25  -0.811 -12.462   3.907
    4   HG23  THR  25          HG21      THR  25   2.109 -13.061   2.092
    5   HG22  THR  25          HG22      THR  25   1.391 -12.064   3.357
    6   HG21  THR  25          HG23      THR  25   0.869 -11.876   1.683
    7    H    THR  25           HN       THR  25  -1.954 -12.008   2.330

  No H/Q in entry =           7
  In of MODEL   38
    1    HA   SER  26           HA       SER  26  -4.307 -15.987   1.901
    2    HB2  SER  26           HB2      SER  26  -2.488 -17.356   2.710
    3    HG   SER  26           HG       SER  26  -3.679 -18.768   3.837
    4    H    SER  26           HN       SER  26  -2.982 -13.776   2.978
    5    HB3  SER  26           HB1      SER  26  -2.586 -16.618   4.308

  No H/Q in entry =           5
  In of MODEL   38
    1    HA   VAL  27           HA       VAL  27  -6.441 -14.264   5.529
    2    HB   VAL  27           HB       VAL  27  -4.172 -13.720   7.442
    3    H    VAL  27           HN       VAL  27  -3.577 -14.186   4.838

  No H/Q in entry =           3
  In of MODEL   38
    1    HA   SER  28           HA       SER  28  -4.675  -9.838   6.168
    2    HB2  SER  28           HB2      SER  28  -2.261 -10.155   5.847
    3    HG   SER  28           HG       SER  28  -2.175  -8.084   5.594
    4    H    SER  28           HN       SER  28  -3.576 -12.249   5.237
    5    HB3  SER  28           HB1      SER  28  -2.500 -10.261   4.103

  No H/Q in entry =           5
  In of MODEL   38
    1    HA   SER  29           HA       SER  29  -5.959  -7.977   2.237
    2    HB2  SER  29           HB2      SER  29  -8.569  -8.062   2.664
    3    HG   SER  29           HG       SER  29  -9.159  -9.093   4.405
    4    H    SER  29           HN       SER  29  -5.393  -7.988   4.984
    5    HB3  SER  29           HB1      SER  29  -7.653  -9.540   2.369

  No H/Q in entry =           5
  In of MODEL   38
    1    HA   HIS  30           HA       HIS  30  -6.866  -4.039   4.077
    2    HB2  HIS  30           HB2      HIS  30  -3.899  -4.186   3.900
    3    HD1  HIS  30           HD1      HIS  30  -3.572  -2.152   6.263
    4    HD2  HIS  30           HD2      HIS  30  -6.296  -5.288   6.144
    5    HE1  HIS  30           HE1      HIS  30  -4.109  -2.667   8.665
    6    HE2  HIS  30           HE2      HIS  30  -5.825  -4.509   8.565
    7    H    HIS  30           HN       HIS  30  -4.999  -5.916   2.797
    8    HB3  HIS  30           HB1      HIS  30  -4.629  -2.584   3.918

  No H/Q in entry =           8
  In of MODEL   38
    1    HA   TYR  31           HA       TYR  31  -6.233  -1.806   0.214
    2    HB2  TYR  31           HB2      TYR  31  -8.307  -0.477   1.950
    3    HD1  TYR  31           HD1      TYR  31  -7.691  -2.447  -1.167
    4    HD2  TYR  31           HD2      TYR  31 -10.283  -1.656   2.113
    5    HE1  TYR  31           HE1      TYR  31  -9.179  -4.256  -1.914
    6    HE2  TYR  31           HE2      TYR  31 -11.778  -3.463   1.375
    7    HH   TYR  31           HH       TYR  31 -11.179  -5.792  -0.267
    8    H    TYR  31           HN       TYR  31  -6.231  -1.665   3.143
    9    HB3  TYR  31           HB1      TYR  31  -8.049   0.000   0.275

  No H/Q in entry =           9
  In of MODEL   38
    1    HA   CYS  32           HA       CYS  32  -3.784   1.737   0.828
    2    HB2  CYS  32           HB2      CYS  32  -3.332   0.529  -1.575
    3    H    CYS  32           HN       CYS  32  -5.496   0.067  -0.842
    4    HB3  CYS  32           HB1      CYS  32  -3.760   2.156  -2.090

  No H/Q in entry =           4
  In of MODEL   38
    1    HA   THR  33           HA       THR  33  -6.599   5.032   0.518
    2    HB   THR  33           HB       THR  33  -5.445   5.533   2.622
    3    HG1  THR  33           HG1      THR  33  -6.447   7.353   2.540
    4   HG23  THR  33          HG21      THR  33  -3.443   6.597   2.846
    5   HG22  THR  33          HG22      THR  33  -3.536   7.348   1.253
    6   HG21  THR  33          HG23      THR  33  -3.132   5.638   1.399
    7    H    THR  33           HN       THR  33  -4.057   3.878   1.140

  No H/Q in entry =           7
  In of MODEL   38
    1    HA3  GLY  34           HA2      GLY  34  -2.898   6.060  -2.937
    2    H    GLY  34           HN       GLY  34  -3.282   5.522  -0.615
    3    HA2  GLY  34           HA1      GLY  34  -4.395   6.979  -2.923

  No H/Q in entry =           3
  In of MODEL   38
    1    HA   ARG  35           HA       ARG  35  -1.472   9.946  -1.181
    2    HB2  ARG  35           HB2      ARG  35  -1.768   8.828   1.608
    3    HG2  ARG  35           HG2      ARG  35  -3.384  10.660  -0.070
    4    HD2  ARG  35           HD2      ARG  35  -2.365  11.596   2.333
    5    HE   ARG  35           HE       ARG  35  -5.125  11.221   3.053
    6   HH11  ARG  35          HH11      ARG  35  -1.879   9.984   3.387
    7   HH12  ARG  35          HH12      ARG  35  -2.211   9.166   4.877
    8   HH21  ARG  35          HH21      ARG  35  -5.562  10.146   5.012
    9   HH22  ARG  35          HH22      ARG  35  -4.301   9.257   5.799
   10    H    ARG  35           HN       ARG  35  -2.155   7.228  -0.277
   11    HB3  ARG  35           HB1      ARG  35  -1.100  10.417   1.264
   12    HG3  ARG  35           HG1      ARG  35  -3.896   9.457   1.114
   13    HD3  ARG  35           HD1      ARG  35  -3.780  12.207   1.478

  No H/Q in entry =          13
  In of MODEL   38
    1    HA   SER  36           HA       SER  36   2.391   7.525  -0.801
    2    HB2  SER  36           HB2      SER  36   2.331   8.737   1.408
    3    HG   SER  36           HG       SER  36   4.221   7.275   2.208
    4    H    SER  36           HN       SER  36  -0.243   6.965   0.194
    5    HB3  SER  36           HB1      SER  36   2.094   7.173   2.189

  No H/Q in entry =           5
  In of MODEL   38
    1    HA   CYS  37           HA       CYS  37   2.655   3.225  -0.804
    2    HB2  CYS  37           HB2      CYS  37   5.144   4.146  -1.189
    3    H    CYS  37           HN       CYS  37   3.929   5.687  -0.139
    4    HB3  CYS  37           HB1      CYS  37   5.424   3.208   0.274

  No H/Q in entry =           4
  In of MODEL   38
    1    HA   GLU  38           HA       GLU  38   3.820   2.439   3.805
    2    HB2  GLU  38           HB2      GLU  38   3.482   5.372   4.283
    3    HG2  GLU  38           HG2      GLU  38   5.714   4.010   4.039
    4    H    GLU  38           HN       GLU  38   3.755   4.710   2.158
    5    HB3  GLU  38           HB1      GLU  38   3.202   4.254   5.611
    6    HG3  GLU  38           HG1      GLU  38   5.558   5.322   5.207

  No H/Q in entry =           6
  In of MODEL   38
    1    HA   CYS  39           HA       CYS  39  -0.537   1.667   3.465
    2    HB2  CYS  39           HB2      CYS  39   0.924  -0.646   3.746
    3    H    CYS  39           HN       CYS  39   2.161   1.046   3.855
    4    HB3  CYS  39           HB1      CYS  39  -0.059  -0.646   5.206

  No H/Q in entry =           4
  In of MODEL   38
    1    HA   PRO  40           HA       PRO  40  -1.995   3.571   7.163
    2    HB2  PRO  40           HB2      PRO  40  -4.253   1.634   6.997
    3    HG2  PRO  40           HG2      PRO  40  -4.820   2.209   4.814
    4    HD2  PRO  40           HD2      PRO  40  -2.951   0.915   4.424
    5    HB3  PRO  40           HB1      PRO  40  -4.289   3.395   7.136
    6    HG3  PRO  40           HG1      PRO  40  -3.884   3.714   4.874
    7    HD3  PRO  40           HD1      PRO  40  -2.359   2.431   3.715

  No H/Q in entry =           7
  In of MODEL   38
    1    HA   SER  41           HA       SER  41  -1.532   0.513  10.296
    2    HB2  SER  41           HB2      SER  41  -1.136   3.039  11.157
    3    HG   SER  41           HG       SER  41  -0.926   1.514  13.316
    4    H    SER  41           HN       SER  41  -2.957   2.916   9.368
    5    HB3  SER  41           HB1      SER  41  -2.411   2.545  12.270

  No H/Q in entry =           5
  In of MODEL   38
    1    HA   TYR  42           HA       TYR  42  -5.818   0.366  12.156
    2    HB2  TYR  42           HB2      TYR  42  -6.609   2.869  10.779
    3    HD1  TYR  42           HD1      TYR  42  -4.830   2.701  13.036
    4    HD2  TYR  42           HD2      TYR  42  -9.081   2.547  12.968
    5    HE1  TYR  42           HE1      TYR  42  -4.891   3.535  15.348
    6    HE2  TYR  42           HE2      TYR  42  -9.154   3.382  15.279
    7    HH   TYR  42           HH       TYR  42  -6.523   3.414  17.307
    8    H    TYR  42           HN       TYR  42  -4.580   2.220  10.312
    9    HB3  TYR  42           HB1      TYR  42  -7.908   1.740  11.147

  No H/Q in entry =           9
  In of MODEL   38
    1    HA   PRO  43           HA       PRO  43  -7.285  -2.549   9.193
    2    HB2  PRO  43           HB2      PRO  43  -9.643  -3.317  10.290
    3    HG2  PRO  43           HG2      PRO  43  -9.933  -1.595  11.821
    4    HD2  PRO  43           HD2      PRO  43  -8.201  -0.201  12.426
    5    HB3  PRO  43           HB1      PRO  43  -8.078  -3.783  10.965
    6    HG3  PRO  43           HG1      PRO  43  -9.030  -2.751  12.819
    7    HD3  PRO  43           HD1      PRO  43  -7.070  -1.550  12.661

  No H/Q in entry =           7
  In of MODEL   38
    1    HA3  GLY  44           HA2      GLY  44  -8.820   0.776   6.324
    2    H    GLY  44           HN       GLY  44  -7.591  -0.290   7.943
    3    HA2  GLY  44           HA1      GLY  44  -9.924  -0.590   6.391

  No H/Q in entry =           3
  In of MODEL   38
    1    HA   ASN  45           HA       ASN  45 -11.808   3.339   8.035
    2    HB2  ASN  45           HB2      ASN  45 -11.699   1.542   9.868
    3   HD21  ASN  45          HD21      ASN  45 -13.854   2.172   9.314
    4   HD22  ASN  45          HD22      ASN  45 -14.699   3.317  10.294
    5    H    ASN  45           HN       ASN  45  -9.132   2.511   7.875
    6    HB3  ASN  45           HB1      ASN  45 -10.702   2.686  10.761

  No H/Q in entry =           6
  In of MODEL   38
    1    HA3  GLY  46           HA2      GLY  46 -11.116   7.384  10.051
    2    H    GLY  46           HN       GLY  46 -12.043   5.458   8.954
    3    HA2  GLY  46           HA1      GLY  46  -9.511   6.788   9.654

  No H/Q in entry =           3
  In of MODEL   39
    1    H1   ALA   1           HT1      ALA   1  16.257  13.086  -8.538
    2    H2   ALA   1           HT3      ALA   1  17.012  14.097  -7.378
    3    H3   ALA   1           HT2      ALA   1  17.891  12.808  -8.093
    4    HA   ALA   1           HA       ALA   1  16.593  11.209  -7.038
    5    HB2  ALA   1           HB1      ALA   1  18.309  11.811  -5.609
    6    HB3  ALA   1           HB2      ALA   1  16.884  12.018  -4.590
    7    HB1  ALA   1           HB3      ALA   1  17.651  13.423  -5.330

  No H/Q in entry =           7
  In of MODEL   39
    1    HA   MET   2           HA       MET   2  12.687  12.584  -5.528
    2    HB2  MET   2           HB2      MET   2  12.299  10.172  -7.303
    3    H    MET   2           HN       MET   2  14.675  10.536  -6.246
    4    HG2  MET   2           HG2      MET   2  11.283  12.859  -8.000
    5    HE1  MET   2           HE1      MET   2  10.815  13.431 -10.034
    6    HB3  MET   2           HB1      MET   2  10.967  11.091  -6.616
    7    HE3  MET   2           HE2      MET   2  10.339  12.286 -11.288
    8    HE2  MET   2           HE3      MET   2  11.934  13.036 -11.339
    9    HG3  MET   2           HG1      MET   2  13.023  12.599  -8.117

  No H/Q in entry =           9
  In of MODEL   39
    1    HA   ASP   3           HA       ASP   3  11.773  10.316  -1.996
    2    HB2  ASP   3           HB2      ASP   3   9.284  10.126  -1.459
    3    H    ASP   3           HN       ASP   3  10.865  11.715  -4.244
    4    HB3  ASP   3           HB1      ASP   3   9.917  11.753  -1.691

  No H/Q in entry =           4
  In of MODEL   39
    1    HA   CYS   4           HA       CYS   4   9.170   7.171  -5.460
    2    HB2  CYS   4           HB2      CYS   4  11.860   6.795  -4.259
    3    H    CYS   4           HN       CYS   4   9.641   9.233  -4.634
    4    HB3  CYS   4           HB1      CYS   4  10.952   5.340  -4.657

  No H/Q in entry =           4
  In of MODEL   39
    1    HA   THR   5           HA       THR   5   9.785   5.083  -0.577
    2    HB   THR   5           HB       THR   5   6.949   5.569  -1.297
    3    HG1  THR   5           HG1      THR   5   8.830   7.637  -0.886
    4   HG22  THR   5          HG21      THR   5   8.379   6.430   1.187
    5   HG21  THR   5          HG22      THR   5   7.832   4.769   0.958
    6   HG23  THR   5          HG23      THR   5   6.664   6.090   0.952
    7    H    THR   5           HN       THR   5  10.636   6.130  -2.412

  No H/Q in entry =           7
  In of MODEL   39
    1    HA   THR   6           HA       THR   6   8.014   1.423  -2.253
    2    HB   THR   6           HB       THR   6   9.640  -0.422  -1.876
    3    HG1  THR   6           HG1      THR   6  10.457   0.140   0.126
    4   HG23  THR   6          HG21      THR   6  10.260   0.622  -3.800
    5   HG22  THR   6          HG22      THR   6  11.701   0.898  -2.820
    6   HG21  THR   6          HG23      THR   6  10.504   2.180  -3.011
    7    H    THR   6           HN       THR   6   9.491   2.969  -0.227

  No H/Q in entry =           7
  In of MODEL   39
    1    HA3  GLY   7           HA2      GLY   7   6.860  -1.386   1.077
    2    H    GLY   7           HN       GLY   7   6.822  -0.347  -1.530
    3    HA2  GLY   7           HA1      GLY   7   5.651  -0.113   1.014

  No H/Q in entry =           3
  In of MODEL   39
    1    HA   PRO   8           HA       PRO   8   3.860  -4.212  -0.480
    2    HB2  PRO   8           HB2      PRO   8   1.924  -4.444   1.406
    3    HG2  PRO   8           HG2      PRO   8   2.377  -2.541   2.656
    4    HD2  PRO   8           HD2      PRO   8   4.371  -1.402   2.460
    5    HB3  PRO   8           HB1      PRO   8   3.554  -5.092   1.622
    6    HG3  PRO   8           HG1      PRO   8   3.411  -3.715   3.491
    7    HD3  PRO   8           HD1      PRO   8   5.338  -2.889   2.534

  No H/Q in entry =           7
  In of MODEL   39
    1    HA   CYS   9           HA       CYS   9   0.634  -2.126  -2.464
    2    HB2  CYS   9           HB2      CYS   9   0.632  -0.515  -0.607
    3    H    CYS   9           HN       CYS   9   3.432  -2.098  -1.921
    4    HB3  CYS   9           HB1      CYS   9   1.821   0.468  -1.455

  No H/Q in entry =           4
  In of MODEL   39
    1    HA   CYS  10           HA       CYS  10   2.681   0.613  -5.667
    2    HB2  CYS  10           HB2      CYS  10   4.871   1.845  -5.690
    3    H    CYS  10           HN       CYS  10   3.273   0.234  -2.913
    4    HB3  CYS  10           HB1      CYS  10   3.733   2.404  -4.469

  No H/Q in entry =           4
  In of MODEL   39
    1    HA   ARG  11           HA       ARG  11   6.000  -2.153  -6.923
    2    HB2  ARG  11           HB2      ARG  11   4.053  -1.381  -9.031
    3    HG2  ARG  11           HG2      ARG  11   3.821  -3.234  -7.223
    4    HD2  ARG  11           HD2      ARG  11   5.475  -4.600  -9.340
    5    HE   ARG  11           HE       ARG  11   4.146  -6.374  -8.766
    6   HH11  ARG  11          HH11      ARG  11   4.941  -4.574  -5.883
    7   HH12  ARG  11          HH12      ARG  11   4.269  -5.755  -4.810
    8   HH21  ARG  11          HH21      ARG  11   3.261  -7.928  -7.356
    9   HH22  ARG  11          HH22      ARG  11   3.315  -7.659  -5.645
   10    H    ARG  11           HN       ARG  11   4.679   0.443  -7.253
   11    HB3  ARG  11           HB1      ARG  11   5.458  -2.307  -9.542
   12    HG3  ARG  11           HG1      ARG  11   3.281  -3.537  -8.875
   13    HD3  ARG  11           HD1      ARG  11   5.895  -4.393  -7.640

  No H/Q in entry =          13
  In of MODEL   39
    1    HA   GLN  12           HA       GLN  12  10.016  -0.396  -7.323
    2    HB2  GLN  12           HB2      GLN  12   9.728  -1.876  -9.271
    3    HG2  GLN  12           HG2      GLN  12  11.107   0.725  -9.555
    4   HE21  GLN  12          HE21      GLN  12  11.047  -2.211 -11.535
    5   HE22  GLN  12          HE22      GLN  12  11.048  -1.393 -13.057
    6    H    GLN  12           HN       GLN  12   8.018  -1.288  -6.707
    7    HB3  GLN  12           HB1      GLN  12   8.862  -0.596 -10.111
    8    HG3  GLN  12           HG1      GLN  12  11.754  -0.915  -9.594

  No H/Q in entry =           8
  In of MODEL   39
    1    HA   CYS  13           HA       CYS  13   8.697   3.771  -6.023
    2    HB2  CYS  13           HB2      CYS  13  10.923   3.851  -7.031
    3    H    CYS  13           HN       CYS  13   8.999   1.524  -6.199
    4    HB3  CYS  13           HB1      CYS  13  10.215   3.774  -8.640

  No H/Q in entry =           4
  In of MODEL   39
    1    HA   LYS  14           HA       LYS  14   5.255   4.812  -8.427
    2    HB2  LYS  14           HB2      LYS  14   5.799   2.391  -9.459
    3    HG2  LYS  14           HG2      LYS  14   4.503   4.492 -10.419
    4    HD2  LYS  14           HD2      LYS  14   2.324   2.489 -10.664
    5    HE2  LYS  14           HE2      LYS  14   1.082   4.798 -10.463
    6    HZ3  LYS  14           HZ1      LYS  14   2.565   4.640 -12.959
    7    HZ2  LYS  14           HZ2      LYS  14   0.897   4.739 -12.694
    8    HZ1  LYS  14           HZ3      LYS  14   1.693   3.256 -12.524
    9    H    LYS  14           HN       LYS  14   6.391   2.964  -6.518
   10    HB3  LYS  14           HB1      LYS  14   4.223   2.049  -8.758
   11    HG3  LYS  14           HG1      LYS  14   4.495   2.926 -11.232
   12    HD3  LYS  14           HD1      LYS  14   2.407   3.441  -9.181
   13    HE3  LYS  14           HE1      LYS  14   2.673   5.440 -10.867

  No H/Q in entry =          13
  In of MODEL   39
    1    HA   LEU  15           HA       LEU  15   2.945   4.259  -4.541
    2    HB2  LEU  15           HB2      LEU  15   3.305   7.123  -5.261
    3    HG   LEU  15           HG       LEU  15   4.692   5.818  -3.507
    4   HD11  LEU  15          HD11      LEU  15   3.451   8.517  -3.194
    5   HD13  LEU  15          HD12      LEU  15   5.110   8.085  -3.611
    6   HD12  LEU  15          HD13      LEU  15   4.538   7.892  -1.954
    7   HD23  LEU  15          HD21      LEU  15   3.413   6.276  -1.218
    8   HD22  LEU  15          HD22      LEU  15   3.287   4.744  -2.082
    9   HD21  LEU  15          HD23      LEU  15   2.016   5.955  -2.245
   10    H    LEU  15           HN       LEU  15   4.514   5.652  -6.378
   11    HB3  LEU  15           HB1      LEU  15   1.926   6.704  -4.263

  No H/Q in entry =          11
  In of MODEL   39
    1    HA   LYS  16           HA       LYS  16  -0.509   3.644  -7.213
    2    HB2  LYS  16           HB2      LYS  16  -1.245   2.086  -4.734
    3    HG2  LYS  16           HG2      LYS  16   0.992   1.540  -6.171
    4    HD2  LYS  16           HD2      LYS  16  -0.814  -0.558  -7.191
    5    HE2  LYS  16           HE2      LYS  16   1.682  -0.480  -7.475
    6    HZ1  LYS  16           HZ1      LYS  16   1.003   1.718  -9.353
    7    HZ3  LYS  16           HZ2      LYS  16   2.504   0.944  -9.260
    8    HZ2  LYS  16           HZ3      LYS  16   1.943   1.859  -7.953
    9    H    LYS  16           HN       LYS  16   1.154   3.160  -4.973
   10    HB3  LYS  16           HB1      LYS  16  -1.913   1.899  -6.350
   11    HG3  LYS  16           HG1      LYS  16   0.034   0.344  -5.295
   12    HD3  LYS  16           HD1      LYS  16  -0.885   0.996  -8.024
   13    HE3  LYS  16           HE1      LYS  16   0.755  -0.670  -8.962

  No H/Q in entry =          13
  In of MODEL   39
    1    HA   PRO  17           HA       PRO  17  -3.255   6.862  -5.996
    2    HB2  PRO  17           HB2      PRO  17  -5.448   5.032  -6.852
    3    HG2  PRO  17           HG2      PRO  17  -4.564   4.685  -8.978
    4    HD2  PRO  17           HD2      PRO  17  -3.169   3.333  -7.734
    5    HB3  PRO  17           HB1      PRO  17  -5.122   6.701  -7.334
    6    HG3  PRO  17           HG1      PRO  17  -3.480   6.083  -8.851
    7    HD3  PRO  17           HD1      PRO  17  -1.937   4.439  -8.374

  No H/Q in entry =           7
  In of MODEL   39
    1    HA   ALA  18           HA       ALA  18  -4.499   5.778  -1.982
    2    HB3  ALA  18           HB1      ALA  18  -5.964   8.342  -2.573
    3    HB1  ALA  18           HB2      ALA  18  -4.460   8.140  -1.674
    4    HB2  ALA  18           HB3      ALA  18  -5.978   7.546  -0.999
    5    H    ALA  18           HN       ALA  18  -4.407   7.451  -4.215

  No H/Q in entry =           5
  In of MODEL   39
    1    HA3  GLY  19           HA2      GLY  19  -8.146   3.494  -1.574
    2    H    GLY  19           HN       GLY  19  -5.580   3.871  -2.215
    3    HA2  GLY  19           HA1      GLY  19  -8.282   3.844  -3.290

  No H/Q in entry =           3
  In of MODEL   39
    1    HA   THR  20           HA       THR  20  -6.593  -0.006  -4.505
    2    HB   THR  20           HB       THR  20  -3.728   0.912  -4.187
    3    HG1  THR  20           HG1      THR  20  -3.964   1.888  -6.027
    4   HG22  THR  20          HG21      THR  20  -4.734  -1.206  -6.053
    5   HG21  THR  20          HG22      THR  20  -4.110  -1.575  -4.446
    6   HG23  THR  20          HG23      THR  20  -3.068  -0.802  -5.640
    7    H    THR  20           HN       THR  20  -5.664   2.547  -3.830

  No H/Q in entry =           7
  In of MODEL   39
    1    HA   THR  21           HA       THR  21  -6.080  -2.030  -0.696
    2    HB   THR  21           HB       THR  21  -6.716  -4.412  -0.893
    3    HG1  THR  21           HG1      THR  21  -6.941  -3.902  -3.669
    4   HG23  THR  21          HG21      THR  21  -8.713  -3.425  -0.686
    5   HG22  THR  21          HG22      THR  21  -8.895  -3.873  -2.382
    6   HG21  THR  21          HG23      THR  21  -8.380  -2.242  -1.951
    7    H    THR  21           HN       THR  21  -6.521  -1.957  -3.525

  No H/Q in entry =           7
  In of MODEL   39
    1    HA   CYS  22           HA       CYS  22  -1.825  -2.952  -0.942
    2    HB2  CYS  22           HB2      CYS  22  -2.786  -3.049   1.868
    3    H    CYS  22           HN       CYS  22  -4.272  -2.525   0.352
    4    HB3  CYS  22           HB1      CYS  22  -1.254  -3.845   1.522

  No H/Q in entry =           4
  In of MODEL   39
    1    HA   TRP  23           HA       TRP  23  -4.304  -7.473   0.420
    2    HB2  TRP  23           HB2      TRP  23  -4.349  -7.091  -1.991
    3    HD1  TRP  23           HD1      TRP  23  -1.926  -9.264  -3.255
    4    HE1  TRP  23           HE1      TRP  23  -2.571 -11.749  -3.082
    5    HE3  TRP  23           HE3      TRP  23  -5.649  -8.898   0.233
    6    HZ2  TRP  23           HZ2      TRP  23  -4.413 -13.344  -1.657
    7    HZ3  TRP  23           HZ3      TRP  23  -6.801 -10.951   0.946
    8    HH2  TRP  23           HH2      TRP  23  -6.196 -13.127   0.019
    9    H    TRP  23           HN       TRP  23  -4.099  -5.212   0.537
   10    HB3  TRP  23           HB1      TRP  23  -2.590  -7.110  -2.046

  No H/Q in entry =          10
  In of MODEL   39
    1    HA   ARG  24           HA       ARG  24  -0.509  -8.199   2.650
    2    HB2  ARG  24           HB2      ARG  24  -2.655  -8.654   4.225
    3    HG2  ARG  24           HG2      ARG  24   0.209  -9.404   4.663
    4    HD2  ARG  24           HD2      ARG  24  -1.092 -10.924   6.049
    5    HE   ARG  24           HE       ARG  24  -2.814  -8.718   6.487
    6   HH11  ARG  24          HH11      ARG  24  -1.476 -11.519   8.080
    7   HH12  ARG  24          HH12      ARG  24  -2.807 -11.688   9.174
    8   HH21  ARG  24          HH21      ARG  24  -4.566  -8.938   7.926
    9   HH22  ARG  24          HH22      ARG  24  -4.562 -10.223   9.087
   10    H    ARG  24           HN       ARG  24  -3.288  -8.191   2.225
   11    HB3  ARG  24           HB1      ARG  24  -2.106 -10.307   3.981
   12    HG3  ARG  24           HG1      ARG  24  -0.691  -8.028   5.304
   13    HD3  ARG  24           HD1      ARG  24  -0.296  -9.698   7.035

  No H/Q in entry =          13
  In of MODEL   39
    1    HA   THR  25           HA       THR  25  -2.213 -12.248  -0.280
    2    HB   THR  25           HB       THR  25   0.727 -12.103  -0.146
    3    HG1  THR  25           HG1      THR  25  -0.836  -9.898  -0.964
    4   HG22  THR  25          HG21      THR  25  -0.265 -11.575  -2.728
    5   HG21  THR  25          HG22      THR  25  -1.267 -12.847  -2.028
    6   HG23  THR  25          HG23      THR  25   0.483 -13.052  -2.121
    7    H    THR  25           HN       THR  25  -2.616 -10.410   0.993

  No H/Q in entry =           7
  In of MODEL   39
    1    HA   SER  26           HA       SER  26  -1.130 -15.121   2.826
    2    HB2  SER  26           HB2      SER  26  -0.254 -14.656   4.953
    3    HG   SER  26           HG       SER  26  -1.942 -13.636   5.955
    4    H    SER  26           HN       SER  26  -2.530 -12.588   2.481
    5    HB3  SER  26           HB1      SER  26   0.089 -13.187   4.040

  No H/Q in entry =           5
  In of MODEL   39
    1    HA   VAL  27           HA       VAL  27  -5.631 -14.660   4.139
    2    HB   VAL  27           HB       VAL  27  -4.370 -15.902   5.857
    3    H    VAL  27           HN       VAL  27  -3.477 -12.879   4.241

  No H/Q in entry =           3
  In of MODEL   39
    1    HA   SER  28           HA       SER  28  -7.409 -10.733   4.705
    2    HB2  SER  28           HB2      SER  28  -5.516 -10.743   6.633
    3    HG   SER  28           HG       SER  28  -6.986  -8.384   6.423
    4    H    SER  28           HN       SER  28  -5.113 -11.922   3.629
    5    HB3  SER  28           HB1      SER  28  -5.112  -9.230   5.824

  No H/Q in entry =           5
  In of MODEL   39
    1    HA   SER  29           HA       SER  29  -5.512  -7.502   2.155
    2    HB2  SER  29           HB2      SER  29  -7.526  -8.437   1.092
    3    HG   SER  29           HG       SER  29  -8.061  -6.571  -0.138
    4    H    SER  29           HN       SER  29  -7.249  -8.198   4.390
    5    HB3  SER  29           HB1      SER  29  -8.529  -7.297   1.989

  No H/Q in entry =           5
  In of MODEL   39
    1    HA   HIS  30           HA       HIS  30  -6.091  -3.735   4.320
    2    HB2  HIS  30           HB2      HIS  30  -3.257  -4.156   3.519
    3    HD1  HIS  30           HD1      HIS  30  -2.840  -2.229   6.269
    4    HD2  HIS  30           HD2      HIS  30  -4.728  -5.899   5.789
    5    HE1  HIS  30           HE1      HIS  30  -2.852  -3.283   8.552
    6    HE2  HIS  30           HE2      HIS  30  -3.923  -5.539   8.220
    7    H    HIS  30           HN       HIS  30  -4.746  -5.509   2.404
    8    HB3  HIS  30           HB1      HIS  30  -3.731  -2.523   3.973

  No H/Q in entry =           8
  In of MODEL   39
    1    HA   TYR  31           HA       TYR  31  -5.969  -0.841   0.903
    2    HB2  TYR  31           HB2      TYR  31  -7.261   0.329   3.343
    3    HD1  TYR  31           HD1      TYR  31  -8.745  -1.532   3.575
    4    HD2  TYR  31           HD2      TYR  31  -8.371   0.454  -0.169
    5    HE1  TYR  31           HE1      TYR  31 -10.742  -2.711   2.757
    6    HE2  TYR  31           HE2      TYR  31 -10.368  -0.718  -0.997
    7    HH   TYR  31           HH       TYR  31 -11.564  -3.349   0.150
    8    H    TYR  31           HN       TYR  31  -5.315  -1.299   3.735
    9    HB3  TYR  31           HB1      TYR  31  -7.197   1.265   1.854

  No H/Q in entry =           9
  In of MODEL   39
    1    HA   CYS  32           HA       CYS  32  -2.386   1.611   1.202
    2    HB2  CYS  32           HB2      CYS  32  -2.957   1.010  -1.375
    3    H    CYS  32           HN       CYS  32  -4.669   0.555  -0.111
    4    HB3  CYS  32           HB1      CYS  32  -3.143   2.760  -1.418

  No H/Q in entry =           4
  In of MODEL   39
    1    HA   THR  33           HA       THR  33  -4.046   5.478   2.264
    2    HB   THR  33           HB       THR  33  -1.963   6.956   3.018
    3    HG1  THR  33           HG1      THR  33  -0.152   5.858   3.259
    4   HG21  THR  33          HG21      THR  33  -3.202   4.610   4.359
    5   HG23  THR  33          HG22      THR  33  -3.282   6.323   4.771
    6   HG22  THR  33          HG23      THR  33  -1.817   5.402   5.110
    7    H    THR  33           HN       THR  33  -1.802   3.772   1.575

  No H/Q in entry =           7
  In of MODEL   39
    1    HA3  GLY  34           HA2      GLY  34  -1.362   6.908  -1.796
    2    H    GLY  34           HN       GLY  34  -0.942   6.050   0.589
    3    HA2  GLY  34           HA1      GLY  34  -2.292   8.152  -0.974

  No H/Q in entry =           3
  In of MODEL   39
    1    HA   ARG  35           HA       ARG  35   1.474  10.096   0.095
    2    HB2  ARG  35           HB2      ARG  35   0.220  10.390   2.317
    3    HG2  ARG  35           HG2      ARG  35   3.193  10.838   2.204
    4    HD2  ARG  35           HD2      ARG  35   1.422  12.473   3.927
    5    HE   ARG  35           HE       ARG  35   4.122  12.359   3.610
    6   HH11  ARG  35          HH11      ARG  35   1.962  11.850   6.304
    7   HH12  ARG  35          HH12      ARG  35   3.111  12.376   7.487
    8   HH21  ARG  35          HH21      ARG  35   5.635  13.051   5.165
    9   HH22  ARG  35          HH22      ARG  35   5.197  13.059   6.841
   10    H    ARG  35           HN       ARG  35  -0.368   8.209   1.284
   11    HB3  ARG  35           HB1      ARG  35   1.405   9.281   2.992
   12    HG3  ARG  35           HG1      ARG  35   1.919  11.977   1.762
   13    HD3  ARG  35           HD1      ARG  35   1.853  10.865   4.508

  No H/Q in entry =          13
  In of MODEL   39
    1    HA   SER  36           HA       SER  36   4.287   6.572   0.552
    2    HB2  SER  36           HB2      SER  36   3.632   5.655   3.344
    3    HG   SER  36           HG       SER  36   3.952   7.588   4.084
    4    H    SER  36           HN       SER  36   1.563   6.907   1.540
    5    HB3  SER  36           HB1      SER  36   5.215   5.850   2.591

  No H/Q in entry =           5
  In of MODEL   39
    1    HA   CYS  37           HA       CYS  37   2.823   2.654  -0.489
    2    HB2  CYS  37           HB2      CYS  37   5.738   2.003  -0.003
    3    H    CYS  37           HN       CYS  37   4.947   4.314   0.439
    4    HB3  CYS  37           HB1      CYS  37   4.600   0.982  -0.876

  No H/Q in entry =           4
  In of MODEL   39
    1    HA   GLU  38           HA       GLU  38   3.936   0.441   3.604
    2    HB2  GLU  38           HB2      GLU  38   5.570   2.362   4.395
    3    HG2  GLU  38           HG2      GLU  38   5.071   0.007   5.434
    4    H    GLU  38           HN       GLU  38   4.520   2.990   2.518
    5    HB3  GLU  38           HB1      GLU  38   4.182   2.845   5.359
    6    HG3  GLU  38           HG1      GLU  38   5.996   1.222   6.315

  No H/Q in entry =           6
  In of MODEL   39
    1    HA   CYS  39           HA       CYS  39  -0.357   1.324   4.089
    2    HB2  CYS  39           HB2      CYS  39   0.217  -1.465   3.769
    3    H    CYS  39           HN       CYS  39   1.948  -0.321   3.878
    4    HB3  CYS  39           HB1      CYS  39  -0.956  -1.274   5.067

  No H/Q in entry =           4
  In of MODEL   39
    1    HA   PRO  40           HA       PRO  40  -0.569   2.104   8.422
    2    HB2  PRO  40           HB2      PRO  40  -3.250   2.102   8.848
    3    HG2  PRO  40           HG2      PRO  40  -3.950   1.096   6.876
    4    HD2  PRO  40           HD2      PRO  40  -2.563   0.911   5.045
    5    HB3  PRO  40           HB1      PRO  40  -2.414   3.407   7.999
    6    HG3  PRO  40           HG1      PRO  40  -3.968   2.799   6.380
    7    HD3  PRO  40           HD1      PRO  40  -2.019   2.596   5.165

  No H/Q in entry =           7
  In of MODEL   39
    1    HA   SER  41           HA       SER  41  -1.231  -1.567  10.613
    2    HB2  SER  41           HB2      SER  41  -0.566   0.092  12.410
    3    HG   SER  41           HG       SER  41  -2.157  -2.164  13.032
    4    H    SER  41           HN       SER  41  -1.660   1.270  10.483
    5    HB3  SER  41           HB1      SER  41  -2.278   0.217  12.817

  No H/Q in entry =           5
  In of MODEL   39
    1    HA   TYR  42           HA       TYR  42  -5.834  -1.568  11.235
    2    HB2  TYR  42           HB2      TYR  42  -7.566   0.249  10.975
    3    HD1  TYR  42           HD1      TYR  42  -7.467   1.552   8.881
    4    HD2  TYR  42           HD2      TYR  42  -4.844   2.361  12.131
    5    HE1  TYR  42           HE1      TYR  42  -6.932   3.740   7.895
    6    HE2  TYR  42           HE2      TYR  42  -4.302   4.552  11.155
    7    HH   TYR  42           HH       TYR  42  -4.383   5.491   8.579
    8    H    TYR  42           HN       TYR  42  -3.986   0.591  10.615
    9    HB3  TYR  42           HB1      TYR  42  -6.380   0.524  12.246

  No H/Q in entry =           9
  In of MODEL   39
    1    HA   PRO  43           HA       PRO  43  -6.757  -2.592   7.045
    2    HB2  PRO  43           HB2      PRO  43  -9.334  -3.408   7.266
    3    HG2  PRO  43           HG2      PRO  43  -9.830  -2.547   9.364
    4    HD2  PRO  43           HD2      PRO  43  -8.181  -1.860  10.819
    5    HB3  PRO  43           HB1      PRO  43  -7.973  -4.360   7.871
    6    HG3  PRO  43           HG1      PRO  43  -9.225  -4.151   9.820
    7    HD3  PRO  43           HD1      PRO  43  -7.205  -3.319  10.554

  No H/Q in entry =           7
  In of MODEL   39
    1    HA3  GLY  44           HA2      GLY  44  -9.565   1.718   7.907
    2    H    GLY  44           HN       GLY  44  -8.835  -0.348   8.756
    3    HA2  GLY  44           HA1      GLY  44  -9.206   1.152   6.283

  No H/Q in entry =           3
  In of MODEL   39
    1    HA   ASN  45           HA       ASN  45 -13.561   0.465   6.502
    2    HB2  ASN  45           HB2      ASN  45 -15.151   1.136   8.319
    3   HD21  ASN  45          HD21      ASN  45 -14.999   1.530  10.769
    4   HD22  ASN  45          HD22      ASN  45 -14.184   2.980  11.235
    5    H    ASN  45           HN       ASN  45 -11.632   2.410   7.557
    6    HB3  ASN  45           HB1      ASN  45 -13.747   0.239   8.890

  No H/Q in entry =           6
  In of MODEL   39
    1    HA3  GLY  46           HA2      GLY  46 -14.841   4.325   4.814
    2    H    GLY  46           HN       GLY  46 -12.386   2.752   5.239
    3    HA2  GLY  46           HA1      GLY  46 -13.302   5.143   5.040

  No H/Q in entry =           3
  In of MODEL   40
    1    H1   ALA   1           HT2      ALA   1  20.360  11.860  -3.317
    2    H2   ALA   1           HT1      ALA   1  21.585  11.539  -4.475
    3    H3   ALA   1           HT3      ALA   1  21.942  12.487  -3.093
    4    HA   ALA   1           HA       ALA   1  20.782  14.272  -3.831
    5    HB3  ALA   1           HB1      ALA   1  21.939  14.856  -5.703
    6    HB2  ALA   1           HB2      ALA   1  21.621  13.323  -6.515
    7    HB1  ALA   1           HB3      ALA   1  22.846  13.413  -5.249

  No H/Q in entry =           7
  In of MODEL   40
    1    HA   MET   2           HA       MET   2  17.226  12.627  -6.085
    2    HB2  MET   2           HB2      MET   2  18.761  12.241  -8.091
    3    H    MET   2           HN       MET   2  19.771  11.323  -5.405
    4    HG2  MET   2           HG2      MET   2  16.167  10.739  -8.273
    5    HE3  MET   2           HE1      MET   2  15.683  12.704 -11.859
    6    HB3  MET   2           HB1      MET   2  18.489  10.523  -7.833
    7    HE2  MET   2           HE2      MET   2  16.429  13.838 -10.732
    8    HE1  MET   2           HE3      MET   2  15.066  12.845 -10.213
    9    HG3  MET   2           HG1      MET   2  16.265  12.499  -8.251

  No H/Q in entry =           9
  In of MODEL   40
    1    HA   ASP   3           HA       ASP   3  15.715   8.820  -4.533
    2    HB2  ASP   3           HB2      ASP   3  15.791  10.712  -2.185
    3    H    ASP   3           HN       ASP   3  15.902  11.752  -4.606
    4    HB3  ASP   3           HB1      ASP   3  15.121   9.088  -2.061

  No H/Q in entry =           4
  In of MODEL   40
    1    HA   CYS   4           HA       CYS   4  11.409   9.979  -3.570
    2    HB2  CYS   4           HB2      CYS   4  10.189   8.928  -5.398
    3    H    CYS   4           HN       CYS   4  13.598   8.128  -3.466
    4    HB3  CYS   4           HB1      CYS   4  11.740   9.529  -5.975

  No H/Q in entry =           4
  In of MODEL   40
    1    HA   THR   5           HA       THR   5   9.409   6.911  -1.270
    2    HB   THR   5           HB       THR   5   7.414   8.212  -1.876
    3    HG1  THR   5           HG1      THR   5   7.261   6.277  -0.556
    4   HG23  THR   5          HG21      THR   5   6.410   8.098  -3.836
    5   HG22  THR   5          HG22      THR   5   6.148   6.365  -3.641
    6   HG21  THR   5          HG23      THR   5   7.641   6.954  -4.371
    7    H    THR   5           HN       THR   5   9.264   8.399  -3.712

  No H/Q in entry =           7
  In of MODEL   40
    1    HA   THR   6           HA       THR   6   8.433   2.898  -3.253
    2    HB   THR   6           HB       THR   6  10.736   3.141  -3.651
    3    HG1  THR   6           HG1      THR   6  10.404   0.991  -3.570
    4   HG22  THR   6          HG21      THR   6  11.291   2.858  -0.709
    5   HG21  THR   6          HG22      THR   6  11.312   4.378  -1.603
    6   HG23  THR   6          HG23      THR   6  12.472   3.109  -1.995
    7    H    THR   6           HN       THR   6   8.543   4.676  -1.090

  No H/Q in entry =           7
  In of MODEL   40
    1    HA3  GLY   7           HA2      GLY   7   8.418  -0.530  -0.225
    2    H    GLY   7           HN       GLY   7   8.123   0.699  -2.596
    3    HA2  GLY   7           HA1      GLY   7   7.046   0.522   0.091

  No H/Q in entry =           3
  In of MODEL   40
    1    HA   PRO   8           HA       PRO   8   5.312  -3.395  -1.611
    2    HB2  PRO   8           HB2      PRO   8   3.291  -3.639   0.150
    3    HG2  PRO   8           HG2      PRO   8   3.515  -1.639   1.307
    4    HD2  PRO   8           HD2      PRO   8   5.415  -0.365   1.143
    5    HB3  PRO   8           HB1      PRO   8   4.936  -4.158   0.535
    6    HG3  PRO   8           HG1      PRO   8   4.552  -2.685   2.294
    7    HD3  PRO   8           HD1      PRO   8   6.481  -1.742   1.486

  No H/Q in entry =           7
  In of MODEL   40
    1    HA   CYS   9           HA       CYS   9   1.410  -0.944  -2.354
    2    HB2  CYS   9           HB2      CYS   9   1.005   0.067  -0.142
    3    H    CYS   9           HN       CYS   9   3.606  -0.479  -0.526
    4    HB3  CYS   9           HB1      CYS   9   2.009   1.442  -0.591

  No H/Q in entry =           4
  In of MODEL   40
    1    HA   CYS  10           HA       CYS  10   2.950   1.078  -5.828
    2    HB2  CYS  10           HB2      CYS  10   5.286   2.196  -5.655
    3    H    CYS  10           HN       CYS  10   3.418  -0.943  -3.993
    4    HB3  CYS  10           HB1      CYS  10   4.005   2.738  -4.578

  No H/Q in entry =           4
  In of MODEL   40
    1    HA   ARG  11           HA       ARG  11   5.994  -1.495  -7.764
    2    HB2  ARG  11           HB2      ARG  11   3.894  -1.094  -9.211
    3    HG2  ARG  11           HG2      ARG  11   5.996  -2.717  -9.628
    4    HD2  ARG  11           HD2      ARG  11   5.792  -0.940 -12.054
    5    HE   ARG  11           HE       ARG  11   6.343  -3.645 -12.081
    6   HH11  ARG  11          HH11      ARG  11   7.979  -0.702 -12.996
    7   HH12  ARG  11          HH12      ARG  11   8.893  -1.455 -14.260
    8   HH21  ARG  11          HH21      ARG  11   7.543  -4.637 -13.743
    9   HH22  ARG  11          HH22      ARG  11   8.645  -3.689 -14.684
   10    H    ARG  11           HN       ARG  11   4.673   1.134  -7.589
   11    HB3  ARG  11           HB1      ARG  11   4.920  -0.024 -10.158
   12    HG3  ARG  11           HG1      ARG  11   4.592  -2.628 -10.694
   13    HD3  ARG  11           HD1      ARG  11   7.208  -1.164 -11.028

  No H/Q in entry =          13
  In of MODEL   40
    1    HA   GLN  12           HA       GLN  12  10.013   0.363  -7.295
    2    HB2  GLN  12           HB2      GLN  12   9.985  -0.939  -9.392
    3    HG2  GLN  12           HG2      GLN  12  11.202   1.729 -10.017
    4   HE21  GLN  12          HE21      GLN  12  11.987   1.573 -11.981
    5   HE22  GLN  12          HE22      GLN  12  12.705   0.169 -12.688
    6    H    GLN  12           HN       GLN  12   7.953  -0.565  -7.034
    7    HB3  GLN  12           HB1      GLN  12   9.253   0.427 -10.221
    8    HG3  GLN  12           HG1      GLN  12  11.906   0.626  -8.835

  No H/Q in entry =           8
  In of MODEL   40
    1    HA   CYS  13           HA       CYS  13   8.695   4.426  -5.794
    2    HB2  CYS  13           HB2      CYS  13  10.946   4.548  -6.786
    3    H    CYS  13           HN       CYS  13   8.948   2.193  -6.138
    4    HB3  CYS  13           HB1      CYS  13  10.231   4.666  -8.390

  No H/Q in entry =           4
  In of MODEL   40
    1    HA   LYS  14           HA       LYS  14   5.164   5.790  -7.827
    2    HB2  LYS  14           HB2      LYS  14   6.130   3.940  -9.528
    3    HG2  LYS  14           HG2      LYS  14   3.388   5.003 -10.074
    4    HD2  LYS  14           HD2      LYS  14   5.839   4.999 -11.815
    5    HE2  LYS  14           HE2      LYS  14   2.879   5.193 -12.339
    6    HZ3  LYS  14           HZ1      LYS  14   3.515   5.392 -14.676
    7    HZ2  LYS  14           HZ2      LYS  14   3.889   3.862 -14.060
    8    HZ1  LYS  14           HZ3      LYS  14   5.115   5.005 -14.284
    9    H    LYS  14           HN       LYS  14   6.394   3.793  -6.296
   10    HB3  LYS  14           HB1      LYS  14   4.570   3.213  -9.168
   11    HG3  LYS  14           HG1      LYS  14   4.784   6.081 -10.000
   12    HD3  LYS  14           HD1      LYS  14   4.733   3.626 -11.737
   13    HE3  LYS  14           HE1      LYS  14   4.097   6.441 -12.602

  No H/Q in entry =          13
  In of MODEL   40
    1    HA   LEU  15           HA       LEU  15   2.531   4.040  -4.672
    2    HB2  LEU  15           HB2      LEU  15   0.791   5.873  -4.209
    3    HG   LEU  15           HG       LEU  15   1.809   7.156  -6.394
    4   HD12  LEU  15          HD11      LEU  15   0.825   9.245  -5.082
    5   HD11  LEU  15          HD12      LEU  15   0.248   7.968  -4.011
    6   HD13  LEU  15          HD13      LEU  15  -0.202   7.960  -5.716
    7   HD21  LEU  15          HD21      LEU  15   3.871   7.465  -4.744
    8   HD23  LEU  15          HD22      LEU  15   2.892   8.829  -4.201
    9   HD22  LEU  15          HD23      LEU  15   3.384   8.714  -5.891
   10    H    LEU  15           HN       LEU  15   3.773   6.051  -6.152
   11    HB3  LEU  15           HB1      LEU  15   2.447   6.147  -3.704

  No H/Q in entry =          11
  In of MODEL   40
    1    HA   LYS  16           HA       LYS  16  -0.384   2.601  -7.556
    2    HB2  LYS  16           HB2      LYS  16  -1.373   1.267  -5.037
    3    HG2  LYS  16           HG2      LYS  16   1.045   0.852  -5.279
    4    HD2  LYS  16           HD2      LYS  16   0.212   0.294  -8.046
    5    HE2  LYS  16           HE2      LYS  16   1.853  -1.418  -8.434
    6    HZ2  LYS  16           HZ1      LYS  16   0.668  -3.172  -7.653
    7    HZ1  LYS  16           HZ2      LYS  16  -0.465  -1.952  -7.354
    8    HZ3  LYS  16           HZ3      LYS  16   0.502  -2.535  -6.094
    9    H    LYS  16           HN       LYS  16   0.767   2.804  -4.950
   10    HB3  LYS  16           HB1      LYS  16  -1.609   0.734  -6.695
   11    HG3  LYS  16           HG1      LYS  16   0.066  -0.600  -5.494
   12    HD3  LYS  16           HD1      LYS  16   1.767   0.842  -7.416
   13    HE3  LYS  16           HE1      LYS  16   2.342  -1.391  -6.741

  No H/Q in entry =          13
  In of MODEL   40
    1    HA   PRO  17           HA       PRO  17  -3.905   5.232  -7.455
    2    HB2  PRO  17           HB2      PRO  17  -5.544   2.829  -8.107
    3    HG2  PRO  17           HG2      PRO  17  -4.279   2.254  -9.974
    4    HD2  PRO  17           HD2      PRO  17  -2.875   1.528  -8.294
    5    HB3  PRO  17           HB1      PRO  17  -5.465   4.393  -8.926
    6    HG3  PRO  17           HG1      PRO  17  -3.512   3.852 -10.055
    7    HD3  PRO  17           HD1      PRO  17  -1.785   2.720  -9.031

  No H/Q in entry =           7
  In of MODEL   40
    1    HA   ALA  18           HA       ALA  18  -5.567   4.749  -3.479
    2    HB1  ALA  18           HB1      ALA  18  -6.101   7.139  -4.162
    3    HB2  ALA  18           HB2      ALA  18  -7.137   6.414  -2.933
    4    HB3  ALA  18           HB3      ALA  18  -7.702   6.543  -4.598
    5    H    ALA  18           HN       ALA  18  -5.442   5.896  -6.023

  No H/Q in entry =           5
  In of MODEL   40
    1    HA3  GLY  19           HA2      GLY  19  -8.820   1.959  -2.638
    2    H    GLY  19           HN       GLY  19  -6.442   2.864  -2.938
    3    HA2  GLY  19           HA1      GLY  19  -8.837   1.953  -4.395

  No H/Q in entry =           3
  In of MODEL   40
    1    HA   THR  20           HA       THR  20  -6.299  -1.600  -4.698
    2    HB   THR  20           HB       THR  20  -3.615  -0.337  -4.219
    3    HG1  THR  20           HG1      THR  20  -5.087  -0.208  -6.637
    4   HG23  THR  20          HG21      THR  20  -3.482  -2.666  -4.645
    5   HG22  THR  20          HG22      THR  20  -2.976  -1.827  -6.111
    6   HG21  THR  20          HG23      THR  20  -4.586  -2.540  -6.014
    7    H    THR  20           HN       THR  20  -5.966   1.169  -4.475

  No H/Q in entry =           7
  In of MODEL   40
    1    HA   THR  21           HA       THR  21  -5.174  -2.742  -0.626
    2    HB   THR  21           HB       THR  21  -5.026  -5.379  -0.649
    3    HG1  THR  21           HG1      THR  21  -5.280  -6.251  -2.526
    4   HG22  THR  21          HG21      THR  21  -7.653  -5.065  -1.522
    5   HG21  THR  21          HG22      THR  21  -7.230  -3.546  -0.733
    6   HG23  THR  21          HG23      THR  21  -7.065  -5.069   0.140
    7    H    THR  21           HN       THR  21  -5.019  -3.264  -3.514

  No H/Q in entry =           7
  In of MODEL   40
    1    HA   CYS  22           HA       CYS  22  -0.892  -3.464  -0.469
    2    HB2  CYS  22           HB2      CYS  22  -1.922  -3.144   2.327
    3    H    CYS  22           HN       CYS  22  -3.527  -3.518   0.766
    4    HB3  CYS  22           HB1      CYS  22  -0.226  -3.538   2.064

  No H/Q in entry =           4
  In of MODEL   40
    1    HA   TRP  23           HA       TRP  23  -0.593  -7.653   1.275
    2    HB2  TRP  23           HB2      TRP  23  -0.098  -6.758   3.590
    3    HD1  TRP  23           HD1      TRP  23   0.663  -9.346   1.818
    4    HE1  TRP  23           HE1      TRP  23   1.223 -11.544   3.034
    5    HE3  TRP  23           HE3      TRP  23  -1.623  -8.404   6.293
    6    HZ2  TRP  23           HZ2      TRP  23   0.757 -12.723   5.556
    7    HZ3  TRP  23           HZ3      TRP  23  -1.519 -10.119   8.055
    8    HH2  TRP  23           HH2      TRP  23  -0.354 -12.233   7.692
    9    H    TRP  23           HN       TRP  23  -2.068  -5.338   2.314
   10    HB3  TRP  23           HB1      TRP  23  -1.707  -7.296   4.060

  No H/Q in entry =          10
  In of MODEL   40
    1    HA   ARG  24           HA       ARG  24  -4.362 -10.019   1.805
    2    HB2  ARG  24           HB2      ARG  24  -4.351  -9.010  -0.455
    3    HG2  ARG  24           HG2      ARG  24  -5.360 -11.764  -0.027
    4    HD2  ARG  24           HD2      ARG  24  -5.889 -10.440  -2.645
    5    HE   ARG  24           HE       ARG  24  -7.104 -12.363  -2.736
    6   HH11  ARG  24          HH11      ARG  24  -4.059 -13.069  -1.183
    7   HH12  ARG  24          HH12      ARG  24  -4.359 -14.772  -1.090
    8   HH21  ARG  24          HH21      ARG  24  -7.500 -14.602  -2.615
    9   HH22  ARG  24          HH22      ARG  24  -6.311 -15.643  -1.904
   10    H    ARG  24           HN       ARG  24  -1.543  -9.724   1.240
   11    HB3  ARG  24           HB1      ARG  24  -3.353 -10.339  -1.027
   12    HG3  ARG  24           HG1      ARG  24  -6.238 -10.274  -0.375
   13    HD3  ARG  24           HD1      ARG  24  -4.436 -11.420  -2.456

  No H/Q in entry =          13
  In of MODEL   40
    1    HA   THR  25           HA       THR  25  -2.264 -13.939   2.061
    2    HB   THR  25           HB       THR  25  -1.136 -13.153   4.019
    3    HG1  THR  25           HG1      THR  25  -2.728 -15.356   4.820
    4   HG21  THR  25          HG21      THR  25  -3.825 -13.198   5.350
    5   HG23  THR  25          HG22      THR  25  -2.726 -11.832   5.152
    6   HG22  THR  25          HG23      THR  25  -2.303 -13.154   6.241
    7    H    THR  25           HN       THR  25  -3.527 -11.586   3.258

  No H/Q in entry =           7
  In of MODEL   40
    1    HA   SER  26           HA       SER  26  -6.796 -14.880   2.709
    2    HB2  SER  26           HB2      SER  26  -5.700 -16.595   3.931
    3    HG   SER  26           HG       SER  26  -7.650 -16.167   5.840
    4    H    SER  26           HN       SER  26  -5.129 -12.951   3.847
    5    HB3  SER  26           HB1      SER  26  -5.652 -15.620   5.400

  No H/Q in entry =           5
  In of MODEL   40
    1    HA   VAL  27           HA       VAL  27  -8.957 -12.127   5.596
    2    HB   VAL  27           HB       VAL  27  -8.402 -13.459   7.589
    3    H    VAL  27           HN       VAL  27  -6.128 -12.949   5.576

  No H/Q in entry =           3
  In of MODEL   40
    1    HA   SER  28           HA       SER  28  -6.297  -8.365   6.480
    2    HB2  SER  28           HB2      SER  28  -3.586  -9.631   6.019
    3    HG   SER  28           HG       SER  28  -4.020 -10.401   7.943
    4    H    SER  28           HN       SER  28  -5.618 -11.143   6.159
    5    HB3  SER  28           HB1      SER  28  -3.889  -7.992   6.594

  No H/Q in entry =           5
  In of MODEL   40
    1    HA   SER  29           HA       SER  29  -5.956  -7.909   2.095
    2    HB2  SER  29           HB2      SER  29  -7.986  -6.743   1.210
    3    HG   SER  29           HG       SER  29  -9.211  -5.732   2.566
    4    H    SER  29           HN       SER  29  -7.214  -7.483   4.702
    5    HB3  SER  29           HB1      SER  29  -8.354  -8.212   2.113

  No H/Q in entry =           5
  In of MODEL   40
    1    HA   HIS  30           HA       HIS  30  -5.896  -3.271   4.692
    2    HB2  HIS  30           HB2      HIS  30  -3.738  -4.565   3.087
    3    HD1  HIS  30           HD1      HIS  30  -1.836  -2.520   4.918
    4    HD2  HIS  30           HD2      HIS  30  -4.559  -5.416   6.129
    5    HE1  HIS  30           HE1      HIS  30  -1.147  -3.157   7.252
    6    HE2  HIS  30           HE2      HIS  30  -2.862  -4.846   7.996
    7    H    HIS  30           HN       HIS  30  -6.637  -5.408   4.455
    8    HB3  HIS  30           HB1      HIS  30  -3.697  -2.815   3.281

  No H/Q in entry =           8
  In of MODEL   40
    1    HA   TYR  31           HA       TYR  31  -6.377  -1.104   0.771
    2    HB2  TYR  31           HB2      TYR  31  -8.094   0.103   2.949
    3    HD1  TYR  31           HD1      TYR  31  -9.683  -1.330   3.785
    4    HD2  TYR  31           HD2      TYR  31  -8.282  -1.937  -0.186
    5    HE1  TYR  31           HE1      TYR  31 -11.167  -3.278   3.566
    6    HE2  TYR  31           HE2      TYR  31  -9.763  -3.886  -0.416
    7    HH   TYR  31           HH       TYR  31 -12.298  -4.513   1.537
    8    H    TYR  31           HN       TYR  31  -5.601  -1.184   3.567
    9    HB3  TYR  31           HB1      TYR  31  -8.279   0.444   1.232

  No H/Q in entry =           9
  In of MODEL   40
    1    HA   CYS  32           HA       CYS  32  -3.372   2.070   1.583
    2    HB2  CYS  32           HB2      CYS  32  -2.986   0.788  -0.873
    3    H    CYS  32           HN       CYS  32  -4.664   0.062   0.112
    4    HB3  CYS  32           HB1      CYS  32  -3.158   2.492  -1.279

  No H/Q in entry =           4
  In of MODEL   40
    1    HA   THR  33           HA       THR  33  -5.854   5.455   0.287
    2    HB   THR  33           HB       THR  33  -4.828   6.193   2.354
    3    HG1  THR  33           HG1      THR  33  -4.692   8.305   0.471
    4   HG21  THR  33          HG21      THR  33  -2.429   6.227   0.908
    5   HG23  THR  33          HG22      THR  33  -2.683   6.643   2.603
    6   HG22  THR  33          HG23      THR  33  -2.762   7.898   1.366
    7    H    THR  33           HN       THR  33  -3.139   4.377   0.648

  No H/Q in entry =           7
  In of MODEL   40
    1    HA3  GLY  34           HA2      GLY  34  -2.114   5.824  -3.250
    2    H    GLY  34           HN       GLY  34  -2.584   5.459  -0.947
    3    HA2  GLY  34           HA1      GLY  34  -3.564   6.810  -3.361

  No H/Q in entry =           3
  In of MODEL   40
    1    HA   ARG  35           HA       ARG  35  -0.515   9.804  -1.903
    2    HB2  ARG  35           HB2      ARG  35  -1.893   9.573   0.345
    3    HG2  ARG  35           HG2      ARG  35  -0.981  11.695  -0.621
    4    HD2  ARG  35           HD2      ARG  35   1.382  10.807   0.984
    5    HE   ARG  35           HE       ARG  35   0.389  13.411   1.159
    6   HH11  ARG  35          HH11      ARG  35   3.356  11.770   0.330
    7   HH12  ARG  35          HH12      ARG  35   4.368  13.082   0.832
    8   HH21  ARG  35          HH21      ARG  35   1.720  15.138   1.820
    9   HH22  ARG  35          HH22      ARG  35   3.440  14.993   1.679
   10    H    ARG  35           HN       ARG  35  -1.322   7.225  -0.732
   11    HB3  ARG  35           HB1      ARG  35  -0.301   9.273   1.027
   12    HG3  ARG  35           HG1      ARG  35  -1.068  11.643   1.141
   13    HD3  ARG  35           HD1      ARG  35   1.331  11.484  -0.643

  No H/Q in entry =          13
  In of MODEL   40
    1    HA   SER  36           HA       SER  36   3.249   7.305  -1.257
    2    HB2  SER  36           HB2      SER  36   2.895   8.509   1.103
    3    HG   SER  36           HG       SER  36   4.974   8.648   0.919
    4    H    SER  36           HN       SER  36   0.580   6.918  -0.242
    5    HB3  SER  36           HB1      SER  36   3.202   6.875   1.690

  No H/Q in entry =           5
  In of MODEL   40
    1    HA   CYS  37           HA       CYS  37   3.351   3.004  -1.026
    2    HB2  CYS  37           HB2      CYS  37   6.181   3.568  -0.126
    3    H    CYS  37           HN       CYS  37   4.702   5.445  -0.435
    4    HB3  CYS  37           HB1      CYS  37   5.598   1.972  -0.587

  No H/Q in entry =           4
  In of MODEL   40
    1    HA   GLU  38           HA       GLU  38   4.354   2.448   3.672
    2    HB2  GLU  38           HB2      GLU  38   4.015   5.395   3.929
    3    HG2  GLU  38           HG2      GLU  38   5.721   3.619   5.622
    4    H    GLU  38           HN       GLU  38   4.370   4.607   1.897
    5    HB3  GLU  38           HB1      GLU  38   3.553   4.399   5.302
    6    HG3  GLU  38           HG1      GLU  38   6.228   4.085   3.999

  No H/Q in entry =           6
  In of MODEL   40
    1    HA   CYS  39           HA       CYS  39   0.020   1.607   3.114
    2    HB2  CYS  39           HB2      CYS  39   1.242  -0.695   4.649
    3    H    CYS  39           HN       CYS  39   2.707   1.025   3.628
    4    HB3  CYS  39           HB1      CYS  39  -0.438  -0.629   4.127

  No H/Q in entry =           4
  In of MODEL   40
    1    HA   PRO  40           HA       PRO  40  -1.668   3.502   6.711
    2    HB2  PRO  40           HB2      PRO  40  -3.815   1.441   6.540
    3    HG2  PRO  40           HG2      PRO  40  -4.345   1.920   4.325
    4    HD2  PRO  40           HD2      PRO  40  -2.398   0.720   4.027
    5    HB3  PRO  40           HB1      PRO  40  -3.948   3.202   6.623
    6    HG3  PRO  40           HG1      PRO  40  -3.493   3.475   4.365
    7    HD3  PRO  40           HD1      PRO  40  -1.866   2.245   3.291

  No H/Q in entry =           7
  In of MODEL   40
    1    HA   SER  41           HA       SER  41  -1.361   0.409   9.900
    2    HB2  SER  41           HB2      SER  41  -1.119   1.755  12.088
    3    HG   SER  41           HG       SER  41  -1.749   3.743  12.007
    4    H    SER  41           HN       SER  41  -2.678   2.849   8.903
    5    HB3  SER  41           HB1      SER  41  -0.017   2.140  10.765

  No H/Q in entry =           5
  In of MODEL   40
    1    HA   TYR  42           HA       TYR  42  -5.432  -0.475  11.184
    2    HB2  TYR  42           HB2      TYR  42  -5.790   2.453  10.847
    3    HD1  TYR  42           HD1      TYR  42  -4.822   3.376  12.716
    4    HD2  TYR  42           HD2      TYR  42  -6.870  -0.333  13.103
    5    HE1  TYR  42           HE1      TYR  42  -4.338   3.368  15.127
    6    HE2  TYR  42           HE2      TYR  42  -6.393  -0.351  15.516
    7    HH   TYR  42           HH       TYR  42  -4.779   0.623  17.081
    8    H    TYR  42           HN       TYR  42  -4.107   0.785   9.022
    9    HB3  TYR  42           HB1      TYR  42  -7.248   1.507  11.131

  No H/Q in entry =           9
  In of MODEL   40
    1    HA   PRO  43           HA       PRO  43  -6.961  -1.578   6.964
    2    HB2  PRO  43           HB2      PRO  43  -7.874  -3.855   8.659
    3    HG2  PRO  43           HG2      PRO  43  -5.718  -4.513   9.239
    4    HD2  PRO  43           HD2      PRO  43  -5.959  -2.672  10.607
    5    HB3  PRO  43           HB1      PRO  43  -7.112  -3.874   7.064
    6    HG3  PRO  43           HG1      PRO  43  -4.983  -3.565   7.933
    7    HD3  PRO  43           HD1      PRO  43  -4.573  -2.095   9.659

  No H/Q in entry =           7
  In of MODEL   40
    1    HA3  GLY  44           HA2      GLY  44 -10.649  -0.810  10.705
    2    H    GLY  44           HN       GLY  44  -8.527  -1.440  10.097
    3    HA2  GLY  44           HA1      GLY  44 -10.811  -0.123   9.096

  No H/Q in entry =           3
  In of MODEL   40
    1    HA   ASN  45           HA       ASN  45 -13.126  -4.022   9.067
    2    HB2  ASN  45           HB2      ASN  45 -13.516  -3.725  12.020
    3   HD21  ASN  45          HD21      ASN  45 -13.311  -6.244   9.529
    4   HD22  ASN  45          HD22      ASN  45 -11.937  -7.041  10.209
    5    H    ASN  45           HN       ASN  45 -12.532  -1.864  10.974
    6    HB3  ASN  45           HB1      ASN  45 -14.585  -4.794  11.117

  No H/Q in entry =           6
  In of MODEL   40
    1    HA3  GLY  46           HA2      GLY  46 -16.833  -1.373   9.118
    2    H    GLY  46           HN       GLY  46 -14.822  -1.741  11.228
    3    HA2  GLY  46           HA1      GLY  46 -17.370  -1.846  10.723

  No H/Q in entry =           3