*HEADER   TRANSCRIPTION INITIATION                27-MAR-96   1PFT    
*TITLE    N-TERMINAL DOMAIN OF TFIIB, NMR                             
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: TFIIB;                                           
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 FRAGMENT: N-TERMINAL DOMAIN;                               
*COMPND  5 SYNONYM: PFTFIIBN;                                         
*COMPND  6 ENGINEERED: YES                                            
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS;                  
*SOURCE  3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  4 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                       
*SOURCE  5 EXPRESSION_SYSTEM_PLASMID: PQZNTD;                         
*SOURCE  6 EXPRESSION_SYSTEM_GENE: PYROCOCCUS FURIOSUS TFIIB GENE     
*KEYWDS   N-TERMINAL DOMAIN, TFIIB, TRANSCRIPTION INITIATION FACTOR   
*EXPDTA   NMR, 25 STRUCTURES                                          
*AUTHOR   W.ZHU,Q.ZENG,C.M.COLANGELO,L.M.LEWIS,M.F.SUMMERS,R.A.SCOTT  
*REVDAT  1   17-AUG-96 1PFT    0                                      


;  Pyroccocus furiosis TFB-NTD (Zn)
;  Obtained from E. coli strain BL21 containing the NTD recombinant gene
;  Amino acid sequence:
;  MVNKQ  KVCPA  CESAE  LIYDP  ERGEI  VCAKC  GYVIE  ENIID  MGPEW  RAFDA
;      5     10     15     20     25     30     35     40     45     50
;NOE DISTANCE CONSTRAINTS
;Strong 1.8 - 2.7
;Medium 1.8 - 3.3
;Weak 1.8 - 5.0
; add +0.5 for methyls 
;
;Chirality Definitions
; For nochiral, upfield resonance = pro R
def/nochiral cb[1]      ; Met
def/nochiral cb[2]      ; Val       
def/nochiral cb[3]      ; Asn
def/nochiral cb[4]      ; Lys
def/nochiral cb[5]      ; Gln
def/nochiral cb[6]      ; Lys 
;def/nochiral cb[7]     ; Val    upfield methyl =pro S
;def/nochiral cb[8]     ; Cys    upfield =pro S
;def/nochiral cb[9]     ; Pro    upfield hb=pro R
;cd[9]                  ; Pro    upfield hd=pro S
def/equiv hgr[9] hgs[9]
; ala[10]
;def/nochiral cb[11]     ; Cys    upfield hb=pro R 
def/nochiral cb[12]     ; Glu
;def/nochiral cb[13]     ; Ser   upfield hb=pro R
; ala[14]
;def/nochiral cb[15]     ; Glu upfield hb=pro R
;def/nochiral cb[16]     ; Leu upfield hb=pro R
;def/nochiral cb[16]     ; Leu upfield hb=pro S
; ile[17]               ; Ile  upfield hg=pro R
def/nochiral cb[18]     ; Tyr
;def/nochiral cb[19]     ; Asp   upfield hd=pro S
def/nochiral cb[20]    ; Pro    upfield hd=pro R
def/equiv hgr[20] hgs[20] 
def/equiv hbr[20] hbs[20] 
;def/nochiral cb[21]     ; Glu   upfield hb=pro R 
;def/nochiral cb[22]     ; Arg   upfield hb=pro R
def/equiv hgr[22] hgs[22]
;def/nochiral ca[23]    ; Gly    upfield =pro R
def/nochiral cb[24]     ; Glu    upfield hg= pro S
def/nochiral cg[24]     ; Glu
; ile[25]               ; Ile
;def/nochiral cg[25]     ; Ile
; Val[26]               ; Val    upfield methyl =pro S
;def/upfield cb[27]     ; Cys    upfield = pro S
; ala[28]               ; Ala
def/nochiral cb[29]     ; Lys
def/nochiral cb[30]     ; Cys
;def/nochiral ca[31]     ; Gly   upfield ha = pro R 
;def/nochiral cb[32]     ; Tyr   upfield hb = pro S
; Val[33]               ; Val  upfield methyl =pro R
; ile[34]               ; Ile  upfield methyl = mg2; md1 and mg1? overlap
; ile[34]               ; Ile upfield methyl = pro ?
def/nochiral cb[35]     ; Glu
def/nochiral cb[36]     ; Glu
def/nochiral cb[37]     ; Asn
; ile[38]               ; Ile
; ile[39]               ; Ile
def/nochiral cb[40]     ; Asp
def/nochiral cb[41]     ; Gln
def/nochiral ca[42]     ; Gly
def/nochiral cb[43]     ; Pro
def/nochiral cb[44]     ; Glu
def/nochiral cb[45]     ; Trp
; ala[47]               ; Ala
def/nochiral cb[48]     ; Phe
def/nochiral cb[49]     ; Asp
; ala[50]               ; Ala
;
;........Zn ligands...................
set bound_mode 2
def/bou zn[51] sg[8] 2.34 
def/bou zn[51] sg[11] 2.34
def/bou zn[51] sg[27] 2.34
def/bou zn[51] sg[30] 2.34
def/bou zn[51] cb[8] 3.36
def/bou zn[51] cb[11] 3.36
def/bou zn[51] cb[27] 3.36
def/bou zn[51] cb[30] 3.36
;
;........H-BOND RESTRAINTS............
;........NH-S H-BONDS
;........Rd-Turn #1
def/hbond hn[10] sg[8] # 3.2
def/hbond hn[11] sg[8] # 3.2
def/hbond hn[13] sg[11] # 3.2
;
;........Rd-Turn #2
def/hbond hn[29] sg[27] # 3.2
def/hbond hn[30] sg[27] # 3.2
def/hbond hn[32] sg[30] # 3.2
;
;
;........NH-O H-BONDS
;........Rd-Turn #1, B-sheet #1
;def/hbond hn[15] o[6] # 2.2
def/hbond hn[8] o[13] # 2.2
def/hbond hn[12] o[8] # 2.2
def/hbond hn[17] o[26] # 2.2
def/hbond hn[26] o[17] # 2.2  ; CHECK!
def/hbond hn[19] o[24] # 2.2
;
;........Turn
def/hbond hn[24] o[19] # 2.2
;
;
;........NH-O H-BONDS
;........Rd-Turn #2, B-sheet #2
def/hbond hn[27] o[32] # 2.2
def/hbond hn[31] o[27] # 2.2
def/hbond hn[34] o[25] # 2.2
;;
;....Potential side chain h-bonds
;def/hbond hn[15] og[13] # 2.2
;........NOE Restraints..........
;				.	
;	Strong 1.8 - 2.7	.
;	Medium 1.8 - 3.3	.
; 	Weak   1.8 - 5.0	.
;	+0.5 for methlys	.
;................................
;
;
;...AMIDE TO ALPHA (n-ha)...
;
;...Seqential hn-ha....
def/bou hn[7] ha[6] 1.8 2.7
def/bou hn[8] ha[7] 1.8 2.7
def/bou hdr[9] ha[8] 1.8 2.7  
def/bou hds[9] ha[8] 1.8 2.7
def/bou hn[10] ha[9] 1.8 3.3
def/bou hn[11] ha[10] 1.8 5.0
def/bou hn[12] ha[11] 1.8 3.3
def/bou hn[13] ha[12] 1.8 3.3
def/bou hn[14] ha[13] 1.8 2.7
def/bou hn[15] ha[14] 1.8 3.3
def/bou hn[16] ha[15] 1.8 2.7
def/bou hn[17] ha[16] 1.8 2.7
def/bou hn[18] ha[17] 1.8 2.7
def/bou hn[19] ha[18] 1.8 2.7 
def/bou hdr[20] ha[19] 1.8 2.7  
def/bou hds[20] ha[19] 1.8 2.7
def/bou hn[21] ha[20] 1.8 3.3
def/bou hn[22] ha[21] 1.8 5.0
def/bou hn[23] ha[22] 1.8 5.0
def/bou hn[24] har[23] 1.8 5.0
def/bou hn[24] has[23] 1.8 5.0
def/bou hn[25] ha[24] 1.8 2.7
def/bou hn[26] ha[25] 1.8 2.7
def/bou hn[27] ha[26] 1.8 2.7
def/bou hn[28] ha[27] 1.8 2.7
def/bou hn[29] ha[28] 1.8 3.3
def/bou hn[30] ha[29] 1.8 5.0
def/bou hn[31] ha[30] 1.8 3.3
def/bou hn[32] har[31] 1.8 3.3
def/bou hn[32] has[31] 1.8 3.3
def/bou hn[33] ha[32] 1.8 2.7 
def/bou hn[34] ha[33] 1.8 2.7
def/bou hn[36] ha[35] 1.8 2.7
;..... long range hn-ha......
;
;....  Rd-turn, B-sheet # 1....
;def/bou hn[10] ha[8] 1.8 5.0
def/bou hn[11] ha[12] 1.8 5.0
def/bou hn[12] ha[9]  1.8 5.0
def/bou hn[15] ha[13] 1.8 5.0
def/bou hn[8] ha[14]  1.8 5.0
def/bou hn[8] ha[12]  1.8 5.0
def/bou hn[28] ha[16] 1.8 3.3
def/bou hn[19] ha[25] 1.8 5.0
def/bou hn[26] ha[18] 1.8 5.0
;
;.......B-sheet turn.......
;
def/bou hn[21] ha[19] 1.8 5.0
def/bou hn[23] ha[20] 1.8 3.3
def/bou hn[22] har[23] 1.8 5.0 
def/bou hn[22] ha[20] 1.8 5.0
def/bou ha[20] hn[24] 1.8 5.0
;
;....Rd-turn, B-sheet # 2......
def/bou hn[27] ha[33] 1.8 5.0
def/bou hn[17] ha[27] 1.8 5.0
def/bou hn[34] ha[26] 1.8 5.0      
;
;...AMIDE TO AMIDE (hn-hn)......
;
;
;.....long range..........
;
;....Rd-turn, B-sheet #1.....
def/bou hn[8] hn[12] 1.8 5.0
def/bou hn[8] hn[13] 1.8 3.3
def/bou hn[10] hn[12] 1.8 5.0
def/bou hn[11] hn[13] 1.8 5.0
def/bou hn[17] hn[26] 1.8 3.3
def/bou hn[17] hn[28] 1.8 5.0
;
;......B-sheet #1 turn.......
def/bou hn[21] hn[23] 1.8 3.3
def/bou hn[19] hn[24] 1.8 3.3
;
;....Rd-turn, B-sheet #2.....
def/bou hn[27] hn[31] 1.8 5.0
def/bou hn[27] hn[32] 1.8 3.3
def/bou hn[27] hn[34] 1.8 5.0
def/bou hn[29] hn[31] 1.8 3.3
def/bou hn[30] hn[32] 1.8 5.0
def/bou hn[35] hn[25] 1.8 3.3
;
;.... seqential hn-hn.......
def/bou hds[9] hn[10] 1.8 5.0
def/bou hn[10] hn[11] 1.8 2.7
def/bou hn[11] hn[12] 1.8 2.7
def/bou hn[12] hn[13] 1.8 2.7 
def/bou hn[14] hn[15] 1.8 3.3 
def/bou hn[15] hn[16] 1.8 5.0
def/bou hds[20] hn[21] 1.8 5.0 
def/bou hn[21] hn[22] 1.8 2.7
def/bou hn[22] hn[23] 1.8 2.7
def/bou hn[23] hn[24] 1.8 2.7
def/bou hn[28] hn[29] 1.8 3.3
def/bou hn[29] hn[30] 1.8 2.7
def/bou hn[30] hn[31] 1.8 2.7
def/bou hn[31] hn[32] 1.8 2.7
def/bou hn[32] hn[33] 1.8 5.0
def/bou hn[34] hn[35] 1.8 2.7
;
;.....B-sheet # 1........
def/bou ha[7] ha[14] 1.8 2.7 
def/bou ha[16] ha[27] 1.8 2.7
def/bou ha[18] ha[25] 1.8 2.7
def/bou ha[20] har[23] 1.8 5.0
;
;.....B-sheet # 2........
def/bou ha[26] ha[33] 1.8 2.7
;
;.......CC-Zn-CC......
def/bou hbr[11] hbs[30] 1.8 5.0
def/bou hbs[11] hbr[30] 1.8 5.0
def/bou hbs[8] hbr[27] 1.8 5.0
;
;......all others.......
;Val7
;def/bou hn[7] mgs[7] 1.8 3.8
;
def/bou hb[7] hn[8] 1.8 2.7
def/bou mgs[7] ha[9] 1.8 5.5
def/bou mgs[7] hdr[9] 1.8 3.8
def/bou mgs[7] ha[12] 1.8 5.5
def/bou mgr[7] mb[14] 1.8 6.0 
def/bou mgr[7] ha[14] 1.8 3.8 
;Cys8
def/bou hn[8] hbs[8] 1.8 2.7
def/bou hn[8] hbr[8] 1.8 2.7
;
def/bou hbr[8] hn[10] 1.8 5.0
def/bou hbr[8] hn[11] 1.8 5.0
def/bou hbr[8] hn[12] 1.8 3.3
def/bou hbs[8] hn[12] 1.8 5.0
def/bou hbr[8] hn[13] 1.8 2.7
def/bou hbs[8] hn[13] 1.8 3.3
def/bou hbr[8] hbs[13] 1.8 5.0
def/bou hbs[8] hbs[13] 1.8 5.0
def/bou hbs[8] mds[16] 1.8 3.8
def/bou hbs[8] md1[34] 1.8 5.5 
def/bou ha[8] md1[34] 1.8 3.8 
;Pro9
def/bou ha[9] hbs[9] 1.8 2.7
;
def/bou hbr[9] hn[10] 1.8 5.0 
def/bou hds[9] md1[34] 1.8 3.8
def/bou hdr[9] md1[34] 1.8 3.8 
;Ala10
def/bou hn[10] mb[10] 1.8 3.2
;
def/bou mb[10] hn[11] 1.8 3.2
def/bou mb[10] hn[12] 1.8 5.5
def/bou mb[10] hbs[32] 1.8 5.5
def/bou mb[10] hbr[32] 1.8 3.8
;Cys11
def/bou hbr[11] hn[12] 1.8 5.0
;Glu12
def/bou hn[12] ha[12] 1.8 2.7 
;
def/bou hbs[12] hn[13] 1.8 5.0
;Ser13
def/bou ha[13] hbr[13] 1.8 2.7
;
def/bou hbr[13] hn[14] 1.8 5.0
def/bou hbr[13] hn[15] 1.8 5.0
def/bou hbr[13] hgr[29] 1.8 5.0
def/bou hbr[13] hgs[29] 1.8 5.0
def/bou hbr[13] hbr[29] 1.8 3.3
def/bou hbr[13] hbs[29] 1.8 5.0
def/bou hbs[13] hbr[29] 1.8 5.0
def/bou hbs[13] hbs[29] 1.8 5.0
;Ala14
def/bou mb[14] hn[15] 1.8 3.8
;Glu15
def/bou hn[15] hbr[15] 1.8 2.7
;
def/bou hbs[15] hn[16] 1.8 5.0
def/bou hbr[15] hn[28] 1.8 5.0
def/bou hbs[15] hn[28] 1.8 5.0
def/bou hbr[15] mb[28] 1.8 3.8
def/bou hbs[15] mb[28] 1.8 3.8
;Leu16
def/bou ha[16] hbs[16] 1.8 2.7 
def/bou hbs[16] hn[17] 1.8 3.3
def/bou hg[16] hn[16] 1.8 2.7
;
def/bou mdr[16] md1[34] 1.8 4.3
def/bou mds[16] hn[28] 1.8 3.8
;Ile17
def/bou ha[17] mg2[17] 1.8 3.2
def/bou hg1s[17] hn[17] 1.8 3.3
def/bou hg1r[17] hn[17] 1.8 3.3
def/bou hb[17] hn[18] 1.8 3.3
def/bou hg1r[17] ha[28] 1.8 5.0
def/bou md1[17] hn[28] 1.8 5.5
def/bou md1[17] ha[28] 1.8 3.8
def/bou md1[17] mb[28] 1.8 4.2
def/bou mg2[17] mb[28] 1.8 4.2
def/bou hn[17] mg2[25] 1.8 3.8
;Tyr18
;def/bou ha[18] hb[25] 1.8 5.0
def/bou cb[18] mg2[25] 1.8 4.89
;Asp19
def/bou hbr[19] hn[22] 1.8 5.0
def/bou hbr[19] hn[23] 1.8 5.0
def/bou hbr[19] hn[24] 1.8 3.3
def/bou hbr[19] hbr[21] 1.8 5.0
def/bou hbr[19] hbr[22] 1.8 3.3
def/bou hbr[19] hbr[24] 1.8 3.3
def/bou hbs[19] mgs[26] 1.8 3.8
;Pro20
def/bou hgr[20] hn[21] 1.8 3.3
;Glu21
def/bou hbr[21] hn[21] 1.8 2.7
;
def/bou hbr[21] hn[22] 1.8 2.7 
def/bou hbr[21] hn[23] 1.8 5.0
;Arg22
def/bou hbr[22] hn[22] 1.8 2.7
def/bou hbr[22] hn[23] 1.8 3.3
def/bou hbr[22] hn[24] 1.8 3.3
def/bou hgs[22] hn[23] 1.8 5.0
;Gly23
;Glu24
def/bou ha[24] md1[25] 1.8 3.8
;def/bou hgr[24] ha[24] 1.8 2.7
def/bou hgs[24] hn[25] 1.8 3.3
;Ile25
def/bou hb[25] hn[34] 1.8 5.0
def/bou hb[25] hn[35] 1.8 5.0
def/bou mg2[25] hn[26] 1.8 3.8
;Val26
def/bou ha[26] md1[34] 1.8 5.5
def/bou hb[26] hn[27] 1.8 3.3
def/bou mgr[26] hn[27] 1.8 3.2
;Cys27
def/bou hn[27] hbr[27] 1.8 2.7
def/bou ha[27] mds[16] 1.8 3.2
def/bou hbs[27] mds[16] 1.8 3.8
def/bou hbs[27] md1[34] 1.8 5.5
def/bou hbs[27] hn[28] 1.8 5.0
def/bou hbr[27] hn[31] 1.8 5.0
def/bou hbr[27] hn[32] 1.8 3.3
def/bou hn[27] md1[34] 1.8 5.5
;Ala28
def/bou hn[28] mb[28] 1.8 3.2
;
def/bou mb[28] hn[16] 1.8 5.5
;Lys29
def/bou hbr[29] hn[29] 1.8 3.3
def/bou hbs[29] hn[29] 1.8 3.3
def/bou hbr[29] hn[30] 1.8 3.3
def/bou hbs[29] hn[30] 1.8 3.3
;Cys30
def/bou hbr[30] hn[31] 1.8 5.0
def/bou hbs[30] hn[31] 1.8 5.0
;Gly31
def/bou har[31] mgr[26] 1.8 3.8
;Tyr32
def/bou hbr[32] hn[33] 1.8 5.0
;Val33
def/bou mgs[33] hn[33] 1.8 3.2
def/bou mgs[33] ha[32] 1.8 5.5
;Ile34
def/bou hb[34] hn[35] 1.8 5.0
def/bou mg2[34] hn[35] 1.8 3.8
;.......Aromatics...........
;
;Tyr18
def/bou cz[18] ha[20] 1.8 5.44
def/bou cg[18] hbs[20] 1.8 7.14
def/bou cz[18] hbs[20] 1.8 5.44
def/bou cg[18] hdr[20] 1.8 7.14
def/bou cg[18] hgr[20] 1.8 7.14
def/bou cz[18] hgr[20] 1.8 5.44 
def/bou cz[18] har[23] 1.8 5.44
def/bou cg[18] ha[25] 1.8 7.14
def/bou cg[18] hg1s[25] 1.8 4.84
def/bou cg[18] md1[25] 1.8 5.34
def/bou cz[18] md1[25] 1.8 5.94
;
def/bou cg[18] hn[19] 1.8 5.44
def/bou cz[18] hn[23] 1.8 7.14
def/bou cg[18] hn[24] 1.8 7.14
def/bou cz[18] hn[24] 1.8 5.44
;Tyr32
def/bou cg[32] hds[9] 1.8 7.14
def/bou cz[32] hds[9] 1.8 7.14
def/bou cz[32] hbr[9] 1.8 7.14
def/bou cz[32] hgs[9] 1.8 7.14
def/bou cg[32] mb[10] 1.8 5.94
def/bou cz[32] mb[10] 1.8 7.64
def/bou cz[32] ha[34] 1.8 5.44
def/bou cg[32] hg1r[34] 1.8 5.44 
def/bou cg[32] md1[34] 1.8 5.94
def/bou cz[32] md1[34] 1.8 7.64
def/bou cg[32] hn[10] 1.8 7.14
def/bou cg[32] hn[34] 1.8 7.14
def/bou cg[32] hn[33] 1.8 5.44
;Val26
def/bou mgs[26] hn[26] 1.8 3.2
def/bou mgr[26] hn[32] 1.8 5.5
def/bou mgs[26] hgr[24] 1.8 3.8
def/bou mgs[26] hgs[24] 1.8 3.8
;Val33
def/bou mgr[33] hgr[24] 1.8 3.8
def/bou mgr[33] hgs[24] 1.8 3.8
def/bou mgr[33] hn[34] 1.8 3.2
;Ala10
def/bou mb[10] hbr[11] 1.8 5.5
;Leu16
def/bou hn[16] hn[28] 1.8 5.5
;Ile17
;Glu15
def/bou ha[15] hbs[15] 1.8 2.7
;Glu35
def/bou md1[25] hn[35] 1.8 3.8
def/bou mgr[33] hn[35] 1.8 3.8
def/bou hb[34] hn[35] 1.8 2.7
def/bou mg2[34] hn[35] 1.8 3.2
def/bou mg2[34] hbr[35] 1.8 3.8
;Glu36
def/bou hn[36] hn[37] 1.8 5.0
def/bou ha[24] ha[36] 1.8 3.3
def/bou ha[36] hn[37 1.8 2.7
def/bou hn[25] ha[36] 1.8 5.0
;Asn37
def/bou ha[37] hn[38] 1.8 2.7
;Ile38
def/bou ha[38] hn[39] 1.8 2.7
def/bou has[23] hn[38] 1.8 5.0
def/bou hb[38] cz[18] 1.8 4.84
def/bou md1[38] cz[18] 1.8 5.34
def/hbond hn[25] o[35] # 2.2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1           HNB      MET   1  -3.525   2.191 -11.989
    2   2H    MET   1           HNC      MET   1  -4.738   2.952 -11.204
    3   3H    MET   1           HN       MET   1  -3.460   2.374 -10.368
    4    HA   MET   1           HA       MET   1  -4.075   0.247 -10.456
    5   1HB   MET   1           HBR      MET   1  -6.470   0.130  -9.955
    6   2HB   MET   1           HBS      MET   1  -5.689   1.510  -9.131
    7   1HG   MET   1           HGS      MET   1  -6.525   3.022 -10.936
    8   2HG   MET   1           HGR      MET   1  -7.341   1.627 -11.684
    9   1HE   MET   1           HMEC     MET   1  -7.325   4.319  -9.039
   10   2HE   MET   1           HMEB     MET   1  -8.587   4.515 -10.281
   11   3HE   MET   1           HMEA     MET   1  -9.045   4.304  -8.572
   12    H    VAL   2           HN       VAL   2  -4.041  -1.326 -11.870
   13    HA   VAL   2           HA       VAL   2  -5.826  -1.374 -14.191
   14    HB   VAL   2           HB       VAL   2  -3.976   0.110 -14.849
   15   1HG1  VAL   2           HMGS     VAL   2  -2.229  -1.023 -13.444
   16   2HG1  VAL   2           HMGS     VAL   2  -2.153  -2.293 -14.689
   17   3HG1  VAL   2           HMGS     VAL   2  -1.733  -0.613 -15.103
   18   1HG2  VAL   2           HMGR     VAL   2  -5.085  -1.981 -16.297
   19   2HG2  VAL   2           HMGR     VAL   2  -4.197  -0.584 -16.951
   20   3HG2  VAL   2           HMGR     VAL   2  -3.340  -2.109 -16.623
   21    H    ASN   3           HN       ASN   3  -6.491  -3.341 -14.480
   22    HA   ASN   3           HA       ASN   3  -6.705  -5.594 -14.311
   23   1HB   ASN   3           HBR      ASN   3  -3.779  -5.810 -13.628
   24   2HB   ASN   3           HBS      ASN   3  -4.884  -7.078 -14.233
   25   1HD2  ASN   3           HD2Z     ASN   3  -4.783  -6.034 -17.626
   26   2HD2  ASN   3           HD2E     ASN   3  -5.719  -6.864 -16.427
   27    H    LYS   4           HN       LYS   4  -5.364  -7.281 -12.377
   28    HA   LYS   4           HA       LYS   4  -7.281  -7.009 -10.396
   29   1HB   LYS   4           HBR      LYS   4  -4.620  -8.466 -10.298
   30   2HB   LYS   4           HBS      LYS   4  -5.907  -8.625  -9.070
   31   1HG   LYS   4           HGR      LYS   4  -6.769  -9.066 -11.876
   32   2HG   LYS   4           HGS      LYS   4  -5.619 -10.270 -11.228
   33   1HD   LYS   4           HDS      LYS   4  -8.318  -9.522 -10.110
   34   2HD   LYS   4           HDR      LYS   4  -7.864 -11.006 -10.903
   35   1HE   LYS   4           HES      LYS   4  -6.748 -10.037  -8.273
   36   2HE   LYS   4           HER      LYS   4  -7.995 -11.294  -8.505
   37   1HZ   LYS   4           HZC      LYS   4  -6.032 -12.162 -10.058
   38   2HZ   LYS   4           HZA      LYS   4  -5.159 -11.449  -8.877
   39   3HZ   LYS   4           HZB      LYS   4  -6.233 -12.623  -8.505
   40    H    GLN   5           HN       GLN   5  -3.854  -6.029 -10.321
   41    HA   GLN   5           HA       GLN   5  -2.683  -4.642  -8.940
   42   1HB   GLN   5           HBR      GLN   5  -4.569  -3.055  -9.121
   43   2HB   GLN   5           HBS      GLN   5  -5.322  -3.833  -7.700
   44   1HG   GLN   5           HGS      GLN   5  -4.262  -2.156  -6.616
   45   2HG   GLN   5           HGR      GLN   5  -2.906  -3.318  -6.666
   46   1HE2  GLN   5           HE2Z     GLN   5  -1.636  -0.015  -7.683
   47   2HE2  GLN   5           HE2E     GLN   5  -2.417  -0.678  -6.287
   48    H    LYS   6           HN       LYS   6  -1.742  -6.485  -8.098
   49    HA   LYS   6           HA       LYS   6  -1.843  -6.446  -5.265
   50   1HB   LYS   6           HBR      LYS   6  -2.118  -9.071  -5.164
   51   2HB   LYS   6           HBS      LYS   6  -3.518  -7.969  -5.026
   52   1HG   LYS   6           HGR      LYS   6  -3.477  -8.355  -7.715
   53   2HG   LYS   6           HGS      LYS   6  -2.806  -9.916  -7.161
   54   1HD   LYS   6           HDS      LYS   6  -5.468  -8.693  -6.455
   55   2HD   LYS   6           HDR      LYS   6  -5.156 -10.107  -7.423
   56   1HE   LYS   6           HES      LYS   6  -5.645 -11.186  -5.517
   57   2HE   LYS   6           HER      LYS   6  -3.911 -10.890  -5.203
   58   1HZ   LYS   6           HZC      LYS   6  -6.046  -9.074  -4.329
   59   2HZ   LYS   6           HZA      LYS   6  -5.429 -10.257  -3.386
   60   3HZ   LYS   6           HZB      LYS   6  -4.472  -9.036  -3.898
   61    H    VAL   7           HN       VAL   7  -0.494  -8.618  -4.535
   62    HA   VAL   7           HA       VAL   7   1.636  -9.398  -4.387
   63    HB   VAL   7           HB       VAL   7   2.392 -10.639  -6.242
   64   1HG1  VAL   7           HMGR     VAL   7  -0.311 -10.777  -5.340
   65   2HG1  VAL   7           HMGR     VAL   7  -0.263 -11.237  -7.059
   66   3HG1  VAL   7           HMGR     VAL   7   0.765 -12.088  -5.881
   67   1HG2  VAL   7           HMGS     VAL   7   1.864  -8.622  -7.876
   68   2HG2  VAL   7           HMGS     VAL   7   2.006 -10.299  -8.454
   69   3HG2  VAL   7           HMGS     VAL   7   0.399  -9.582  -8.189
   70    H    CYS   8           HN       CYS   8   3.870  -9.328  -5.904
   71    HA   CYS   8           HA       CYS   8   4.452  -6.452  -6.343
   72   1HB   CYS   8           HBS      CYS   8   5.923  -7.908  -4.867
   73   2HB   CYS   8           HBR      CYS   8   6.393  -8.768  -6.360
   74    HA   PRO   9           HA       PRO   9   4.247  -7.121 -10.706
   75   1HB   PRO   9           HBR      PRO   9   4.360  -4.328 -10.830
   76   2HB   PRO   9           HBS      PRO   9   3.193  -5.326 -11.413
   77   1HG   PRO   9           HGS      PRO   9   2.909  -3.743  -9.313
   78   2HG   PRO   9           HGR      PRO   9   1.920  -5.041  -9.659
   79   1HD   PRO   9           HDS      PRO   9   3.887  -4.833  -7.668
   80   2HD   PRO   9           HDR      PRO   9   2.654  -5.930  -7.785
   81    H    ALA  10           HN       ALA  10   6.585  -6.180  -8.669
   82    HA   ALA  10           HA       ALA  10   8.402  -5.092 -10.746
   83   1HB   ALA  10           HMBC     ALA  10   8.044  -4.424  -8.105
   84   2HB   ALA  10           HMBB     ALA  10   9.477  -5.482  -8.046
   85   3HB   ALA  10           HMBA     ALA  10   9.472  -4.047  -9.101
   86    H    CYS  11           HN       CYS  11   8.933  -7.344  -8.010
   87    HA   CYS  11           HA       CYS  11  10.930  -8.571  -9.751
   88   1HB   CYS  11           HBS      CYS  11  12.061  -9.313  -7.847
   89   2HB   CYS  11           HBR      CYS  11  11.549  -7.628  -7.585
   90    H    GLU  12           HN       GLU  12   7.802  -9.321  -8.992
   91    HA   GLU  12           HA       GLU  12   6.490 -11.185  -9.025
   92   1HB   GLU  12           HBR      GLU  12   8.927 -12.107 -10.433
   93   2HB   GLU  12           HBS      GLU  12   8.117 -13.305  -9.582
   94   1HG   GLU  12           HGS      GLU  12   7.080 -13.535 -11.588
   95   2HG   GLU  12           HGR      GLU  12   5.891 -12.515 -10.735
   96    H    SER  13           HN       SER  13   6.855 -10.465  -6.734
   97    HA   SER  13           HA       SER  13   7.402 -12.945  -5.274
   98   1HB   SER  13           HBS      SER  13   8.590 -10.286  -4.463
   99   2HB   SER  13           HBR      SER  13   8.379 -11.657  -3.341
  100    HG   SER  13           HG       SER  13   9.681 -11.805  -5.932
  101    H    ALA  14           HN       ALA  14   5.396 -13.403  -4.750
  102    HA   ALA  14           HA       ALA  14   3.372 -11.449  -4.651
  103   1HB   ALA  14           HMBB     ALA  14   3.548 -14.386  -4.012
  104   2HB   ALA  14           HMBA     ALA  14   2.043 -13.486  -3.697
  105   3HB   ALA  14           HMBC     ALA  14   2.701 -13.572  -5.351
  106    H    GLU  15           HN       GLU  15   5.578 -12.238  -2.288
  107    HA   GLU  15           HA       GLU  15   3.794 -11.888   0.058
  108   1HB   GLU  15           HBR      GLU  15   6.731 -12.403  -0.388
  109   2HB   GLU  15           HBS      GLU  15   6.161 -11.802   1.072
  110   1HG   GLU  15           HGS      GLU  15   5.003 -14.308  -0.094
  111   2HG   GLU  15           HGR      GLU  15   6.379 -14.378   1.039
  112    H    LEU  16           HN       LEU  16   3.044  -9.866   0.098
  113    HA   LEU  16           HA       LEU  16   5.070  -7.684   0.211
  114   1HB   LEU  16           HBR      LEU  16   2.084  -7.359  -0.129
  115   2HB   LEU  16           HBS      LEU  16   3.378  -6.153  -0.381
  116    HG   LEU  16           HG       LEU  16   2.835  -8.577  -2.117
  117   1HD1  LEU  16           HMDR     LEU  16   1.515  -6.108  -2.014
  118   2HD1  LEU  16           HMDR     LEU  16   2.673  -5.957  -3.359
  119   3HD1  LEU  16           HMDR     LEU  16   1.490  -7.289  -3.349
  120   1HD2  LEU  16           HMDS     LEU  16   4.886  -6.353  -2.150
  121   2HD2  LEU  16           HMDS     LEU  16   5.152  -8.116  -2.169
  122   3HD2  LEU  16           HMDS     LEU  16   4.477  -7.301  -3.603
  123    H    ILE  17           HN       ILE  17   4.161  -5.902   1.769
  124    HA   ILE  17           HA       ILE  17   2.889  -6.985   4.194
  125    HB   ILE  17           HB       ILE  17   5.000  -6.157   5.492
  126   1HG1  ILE  17           HG1R     ILE  17   6.128  -6.537   2.699
  127   2HG1  ILE  17           HG1S     ILE  17   6.172  -5.072   3.719
  128   1HG2  ILE  17           HMG2     ILE  17   4.153  -8.631   4.826
  129   2HG2  ILE  17           HMG2     ILE  17   5.782  -8.643   4.100
  130   3HG2  ILE  17           HMG2     ILE  17   5.584  -8.298   5.839
  131   1HD1  ILE  17           HMD1     ILE  17   7.441  -7.097   5.213
  132   2HD1  ILE  17           HMD1     ILE  17   8.056  -7.247   3.546
  133   3HD1  ILE  17           HMD1     ILE  17   8.190  -5.691   4.409
  134    H    TYR  18           HN       TYR  18   2.410  -5.389   5.746
  135    HA   TYR  18           HA       TYR  18   1.844  -2.834   4.390
  136   1HB   TYR  18           HBS      TYR  18   0.135  -4.489   5.540
  137   2HB   TYR  18           HBR      TYR  18   0.637  -3.633   7.025
  138    HD1  TYR  18           HD2      TYR  18  -1.057  -3.286   3.769
  139    HD2  TYR  18           HD1      TYR  18  -0.030  -1.313   7.394
  140    HE1  TYR  18           HE2      TYR  18  -2.703  -1.534   3.272
  141    HE2  TYR  18           HE1      TYR  18  -1.653   0.463   6.894
  142    HH   TYR  18           HH       TYR  18  -3.955   0.406   5.617
  143    H    ASP  19           HN       ASP  19   1.779  -0.862   5.694
  144    HA   ASP  19           HA       ASP  19   3.880  -0.719   7.748
  145   1HB   ASP  19           HBS      ASP  19   4.492  -0.249   5.077
  146   2HB   ASP  19           HBR      ASP  19   4.278   1.374   5.795
  147    HA   PRO  20           HA       PRO  20   0.140   1.560   8.700
  148   1HB   PRO  20           HBS      PRO  20   0.445   1.243  11.367
  149   2HB   PRO  20           HBR      PRO  20  -0.542   0.347  10.408
  150   1HG   PRO  20           HGS      PRO  20   1.916  -0.346  11.534
  151   2HG   PRO  20           HGR      PRO  20   0.734  -1.359  10.933
  152   1HD   PRO  20           HDS      PRO  20   3.048  -0.829   9.706
  153   2HD   PRO  20           HDR      PRO  20   1.714  -1.470   8.967
  154    H    GLU  21           HN       GLU  21   3.302   2.202   9.364
  155    HA   GLU  21           HA       GLU  21   2.877   4.555  11.060
  156   1HB   GLU  21           HBR      GLU  21   5.393   3.896   9.581
  157   2HB   GLU  21           HBS      GLU  21   5.163   4.719  11.026
  158   1HG   GLU  21           HGS      GLU  21   4.502   1.803  10.804
  159   2HG   GLU  21           HGR      GLU  21   6.111   2.341  11.354
  160    H    ARG  22           HN       ARG  22   3.740   3.805   7.679
  161    HA   ARG  22           HA       ARG  22   3.407   6.646   6.967
  162   1HB   ARG  22           HBR      ARG  22   4.325   4.249   5.344
  163   2HB   ARG  22           HBS      ARG  22   4.221   5.932   4.747
  164   1HG   ARG  22           HGS      ARG  22   5.765   5.940   7.149
  165   2HG   ARG  22           HGR      ARG  22   6.379   4.630   6.100
  166   1HD   ARG  22           HDS      ARG  22   7.593   6.485   5.444
  167   2HD   ARG  22           HDR      ARG  22   6.294   6.368   4.224
  168    HE   ARG  22           HE       ARG  22   6.047   8.208   6.545
  169   1HH1  ARG  22           HH1Z     ARG  22   6.434   7.744   3.072
  170   2HH1  ARG  22           HH1E     ARG  22   5.806   9.309   2.682
  171   1HH2  ARG  22           HH2Z     ARG  22   5.114  10.198   5.990
  172   2HH2  ARG  22           HH2E     ARG  22   5.061  10.700   4.333
  173    H    GLY  23           HN       GLY  23   1.741   3.611   6.821
  174   1HA   GLY  23           HAR      GLY  23  -0.468   3.181   6.079
  175   2HA   GLY  23           HAS      GLY  23  -0.488   4.760   5.248
  176    H    GLU  24           HN       GLU  24   2.121   2.364   5.096
  177    HA   GLU  24           HA       GLU  24   1.836   2.416   2.142
  178   1HB   GLU  24           HBR      GLU  24   3.826   3.349   3.247
  179   2HB   GLU  24           HBS      GLU  24   4.041   1.914   4.090
  180   1HG   GLU  24           HGR      GLU  24   4.849   0.639   2.262
  181   2HG   GLU  24           HGS      GLU  24   4.037   1.744   1.121
  182    H    ILE  25           HN       ILE  25   2.636   0.480   0.992
  183    HA   ILE  25           HA       ILE  25   2.641  -2.025   2.520
  184    HB   ILE  25           HB       ILE  25   0.975  -1.827  -0.028
  185   1HG1  ILE  25           HG1R     ILE  25  -0.951  -2.161   1.783
  186   2HG1  ILE  25           HG1S     ILE  25   0.221  -1.308   2.829
  187   1HG2  ILE  25           HMG2     ILE  25   1.585  -3.983   1.937
  188   2HG2  ILE  25           HMG2     ILE  25  -0.029  -3.952   1.176
  189   3HG2  ILE  25           HMG2     ILE  25   1.435  -4.046   0.161
  190   1HD1  ILE  25           HMD1     ILE  25   0.232   0.271   0.599
  191   2HD1  ILE  25           HMD1     ILE  25  -1.458  -0.300   0.627
  192   3HD1  ILE  25           HMD1     ILE  25  -0.778   0.544   2.044
  193    H    VAL  26           HN       VAL  26   4.500  -2.914   2.083
  194    HA   VAL  26           HA       VAL  26   5.840  -2.168  -0.456
  195    HB   VAL  26           HB       VAL  26   7.196  -3.123   2.061
  196   1HG1  VAL  26           HMGR     VAL  26   8.150  -1.519  -0.322
  197   2HG1  VAL  26           HMGR     VAL  26   9.098  -1.789   1.161
  198   3HG1  VAL  26           HMGR     VAL  26   8.626  -3.171   0.145
  199   1HG2  VAL  26           HMGS     VAL  26   6.425  -0.278   1.373
  200   2HG2  VAL  26           HMGS     VAL  26   5.900  -1.239   2.777
  201   3HG2  VAL  26           HMGS     VAL  26   7.601  -0.738   2.627
  202    H    CYS  27           HN       CYS  27   7.538  -3.759  -1.162
  203    HA   CYS  27           HA       CYS  27   6.548  -6.499  -1.275
  204   1HB   CYS  27           HBS      CYS  27   7.822  -5.342  -3.110
  205   2HB   CYS  27           HBR      CYS  27   9.271  -5.456  -2.074
  206    H    ALA  28           HN       ALA  28   7.540  -8.294  -0.358
  207    HA   ALA  28           HA       ALA  28   9.154  -7.744   2.080
  208   1HB   ALA  28           HMBC     ALA  28   7.006  -9.078   2.221
  209   2HB   ALA  28           HMBB     ALA  28   7.840 -10.349   1.290
  210   3HB   ALA  28           HMBA     ALA  28   8.468  -9.852   2.883
  211    H    LYS  29           HN       LYS  29   9.950  -7.812  -0.872
  212    HA   LYS  29           HA       LYS  29  12.041  -9.914  -0.658
  213   1HB   LYS  29           HBS      LYS  29  10.038 -10.536  -2.184
  214   2HB   LYS  29           HBR      LYS  29  10.725  -9.335  -3.309
  215   1HG   LYS  29           HGR      LYS  29  11.890 -11.101  -4.104
  216   2HG   LYS  29           HGS      LYS  29  12.950 -10.800  -2.697
  217   1HD   LYS  29           HDS      LYS  29  11.588 -12.406  -1.386
  218   2HD   LYS  29           HDR      LYS  29  10.656 -12.743  -2.818
  219   1HE   LYS  29           HES      LYS  29  13.571 -13.332  -2.366
  220   2HE   LYS  29           HER      LYS  29  12.221 -14.476  -2.615
  221   1HZ   LYS  29           HZB      LYS  29  12.035 -13.151  -4.821
  222   2HZ   LYS  29           HZC      LYS  29  13.614 -12.831  -4.555
  223   3HZ   LYS  29           HZA      LYS  29  13.103 -14.377  -4.674
  224    H    CYS  30           HN       CYS  30  11.097  -7.579  -3.199
  225    HA   CYS  30           HA       CYS  30  13.835  -6.795  -3.390
  226   1HB   CYS  30           HBS      CYS  30  13.156  -5.494  -5.318
  227   2HB   CYS  30           HBR      CYS  30  12.512  -7.157  -5.353
  228    H    GLY  31           HN       GLY  31  11.500  -5.668  -1.339
  229   1HA   GLY  31           HAR      GLY  31  11.665  -3.890   0.125
  230   2HA   GLY  31           HAS      GLY  31  12.895  -3.155  -0.941
  231    H    TYR  32           HN       TYR  32  10.343  -3.925  -2.901
  232    HA   TYR  32           HA       TYR  32  10.109  -1.058  -3.473
  233   1HB   TYR  32           HBS      TYR  32  10.321  -2.583  -5.344
  234   2HB   TYR  32           HBR      TYR  32   8.898  -3.515  -4.801
  235    HD1  TYR  32           HD2      TYR  32   9.760   0.043  -5.629
  236    HD2  TYR  32           HD1      TYR  32   6.934  -3.114  -5.995
  237    HE1  TYR  32           HE2      TYR  32   8.386   1.454  -7.093
  238    HE2  TYR  32           HE1      TYR  32   5.534  -1.702  -7.440
  239    HH   TYR  32           HH       TYR  32   6.921   1.056  -8.976
  240    H    VAL  33           HN       VAL  33   8.622   0.223  -2.716
  241    HA   VAL  33           HA       VAL  33   6.355  -0.594  -1.161
  242    HB   VAL  33           HB       VAL  33   6.910   1.992  -2.633
  243   1HG1  VAL  33           HMGR     VAL  33   4.741   1.216  -0.700
  244   2HG1  VAL  33           HMGR     VAL  33   5.311   2.899  -0.817
  245   3HG1  VAL  33           HMGR     VAL  33   4.625   2.090  -2.247
  246   1HG2  VAL  33           HMGS     VAL  33   7.519   1.086   0.180
  247   2HG2  VAL  33           HMGS     VAL  33   8.633   1.713  -1.058
  248   3HG2  VAL  33           HMGS     VAL  33   7.454   2.803  -0.291
  249    H    ILE  34           HN       ILE  34   4.116  -0.203  -1.778
  250    HA   ILE  34           HA       ILE  34   3.591  -0.710  -4.664
  251    HB   ILE  34           HB       ILE  34   2.070  -1.475  -2.128
  252   1HG1  ILE  34           HG1R     ILE  34   4.066  -2.805  -2.685
  253   2HG1  ILE  34           HG1S     ILE  34   2.559  -3.762  -2.752
  254   1HG2  ILE  34           HMG2     ILE  34   0.456  -0.827  -3.846
  255   2HG2  ILE  34           HMG2     ILE  34   1.203  -1.977  -4.986
  256   3HG2  ILE  34           HMG2     ILE  34   0.403  -2.577  -3.509
  257   1HD1  ILE  34           HMD1     ILE  34   2.597  -3.421  -5.260
  258   2HD1  ILE  34           HMD1     ILE  34   4.238  -2.749  -5.057
  259   3HD1  ILE  34           HMD1     ILE  34   3.901  -4.438  -4.591
  260    H    GLU  35           HN       GLU  35   1.554   0.438  -1.986
  261    HA   GLU  35           HA       GLU  35   1.505   3.143  -3.228
  262   1HB   GLU  35           HBR      GLU  35  -0.622   1.557  -3.369
  263   2HB   GLU  35           HBS      GLU  35  -0.768   1.939  -1.741
  264   1HG   GLU  35           HGS      GLU  35  -2.179   3.402  -3.095
  265   2HG   GLU  35           HGR      GLU  35  -1.029   4.343  -2.107
  266    H    GLU  36           HN       GLU  36   0.912   4.795  -1.584
  267    HA   GLU  36           HA       GLU  36   1.534   4.170   1.185
  268   1HB   GLU  36           HBR      GLU  36   3.605   5.203   1.336
  269   2HB   GLU  36           HBS      GLU  36   3.677   4.141   0.040
  270   1HG   GLU  36           HGS      GLU  36   2.974   6.214  -1.423
  271   2HG   GLU  36           HGR      GLU  36   3.777   7.146  -0.129
  272    H    ASN  37           HN       ASN  37  -0.724   5.166   0.087
  273    HA   ASN  37           HA       ASN  37  -0.944   7.490   1.707
  274   1HB   ASN  37           HBR      ASN  37  -2.043   8.915  -0.107
  275   2HB   ASN  37           HBS      ASN  37  -0.261   8.868   0.019
  276   1HD2  ASN  37           HD2Z     ASN  37  -2.221   7.399  -3.285
  277   2HD2  ASN  37           HD2E     ASN  37  -3.080   7.752  -1.823
  278    H    ILE  38           HN       ILE  38  -1.991   5.266   2.288
  279    HA   ILE  38           HA       ILE  38  -4.391   4.567   0.895
  280    HB   ILE  38           HB       ILE  38  -4.691   2.946   2.793
  281   1HG1  ILE  38           HG1R     ILE  38  -2.125   3.262   4.068
  282   2HG1  ILE  38           HG1S     ILE  38  -3.006   4.815   4.130
  283   1HG2  ILE  38           HMG2     ILE  38  -2.273   3.098   1.107
  284   2HG2  ILE  38           HMG2     ILE  38  -2.194   1.959   2.476
  285   3HG2  ILE  38           HMG2     ILE  38  -3.498   1.812   1.267
  286   1HD1  ILE  38           HMD1     ILE  38  -4.763   2.617   4.809
  287   2HD1  ILE  38           HMD1     ILE  38  -3.303   2.605   5.834
  288   3HD1  ILE  38           HMD1     ILE  38  -4.325   4.065   5.755
  289    H    ILE  39           HN       ILE  39  -5.235   6.842   1.026
  290    HA   ILE  39           HA       ILE  39  -7.454   6.896   2.714
  291    HB   ILE  39           HB       ILE  39  -5.882   7.385   4.550
  292   1HG1  ILE  39           HG1R     ILE  39  -7.291   9.999   4.128
  293   2HG1  ILE  39           HG1S     ILE  39  -8.262   8.500   4.092
  294   1HG2  ILE  39           HMG2     ILE  39  -4.180   8.566   3.094
  295   2HG2  ILE  39           HMG2     ILE  39  -5.211  10.014   3.232
  296   3HG2  ILE  39           HMG2     ILE  39  -4.500   9.284   4.695
  297   1HD1  ILE  39           HMD1     ILE  39  -7.258   7.932   6.340
  298   2HD1  ILE  39           HMD1     ILE  39  -6.588   9.585   6.368
  299   3HD1  ILE  39           HMD1     ILE  39  -8.353   9.339   6.312
  300    H    ASP  40           HN       ASP  40  -8.852   8.625   2.273
  301    HA   ASP  40           HA       ASP  40  -7.996  10.940   0.882
  302   1HB   ASP  40           HBR      ASP  40  -9.295  10.661  -1.199
  303   2HB   ASP  40           HBS      ASP  40  -7.833   9.642  -1.073
  304    H    MET  41           HN       MET  41  -8.979  11.481   2.928
  305    HA   MET  41           HA       MET  41 -11.797  12.191   2.379
  306   1HB   MET  41           HBR      MET  41 -10.724  11.169   5.021
  307   2HB   MET  41           HBS      MET  41 -12.253  12.078   4.848
  308   1HG   MET  41           HGS      MET  41 -13.152  10.360   3.356
  309   2HG   MET  41           HGR      MET  41 -11.590   9.504   3.367
  310   1HE   MET  41           HMEC     MET  41 -11.690   7.494   4.342
  311   2HE   MET  41           HMEB     MET  41 -10.714   8.074   5.715
  312   3HE   MET  41           HMEA     MET  41 -12.139   7.047   6.007
  313    H    GLY  42           HN       GLY  42  -9.076  12.807   4.632
  314   1HA   GLY  42           HAS      GLY  42  -7.778  14.726   4.849
  315   2HA   GLY  42           HAR      GLY  42  -8.756  15.503   3.573
  316    HA   PRO  43           HA       PRO  43 -11.087  16.035   7.808
  317   1HB   PRO  43           HBS      PRO  43  -9.593  15.393   9.936
  318   2HB   PRO  43           HBR      PRO  43 -10.855  14.502   9.379
  319   1HG   PRO  43           HGS      PRO  43  -8.138  13.948   9.239
  320   2HG   PRO  43           HGR      PRO  43  -9.412  12.910   8.955
  321   1HD   PRO  43           HDS      PRO  43  -7.817  14.084   7.077
  322   2HD   PRO  43           HDR      PRO  43  -9.144  13.139   6.796
  323    H    GLU  44           HN       GLU  44  -7.756  16.314   8.777
  324    HA   GLU  44           HA       GLU  44  -7.820  19.239   8.295
  325   1HB   GLU  44           HBS      GLU  44  -8.845  18.908  10.376
  326   2HB   GLU  44           HBR      GLU  44  -7.726  17.787  10.930
  327   1HG   GLU  44           HGS      GLU  44  -6.411  19.443  11.774
  328   2HG   GLU  44           HGR      GLU  44  -6.378  20.336  10.230
  329    H    TRP  45           HN       TRP  45  -6.234  18.549   6.724
  330    HA   TRP  45           HA       TRP  45  -3.540  18.124   7.831
  331   1HB   TRP  45           HBS      TRP  45  -4.492  15.890   7.680
  332   2HB   TRP  45           HBR      TRP  45  -4.856  16.155   5.950
  333    HD1  TRP  45           HD1      TRP  45  -1.500  17.526   6.879
  334    HE1  TRP  45           HE1      TRP  45   0.373  15.956   6.089
  335    HE3  TRP  45           HE3      TRP  45  -4.359  13.482   5.715
  336    HZ2  TRP  45           HZ2      TRP  45   0.583  13.325   5.138
  337    HZ3  TRP  45           HZ3      TRP  45  -3.251  11.465   4.872
  338    HH2  TRP  45           HH2      TRP  45  -0.831  11.376   4.588
  339    H    ARG  46           HN       ARG  46  -5.657  18.550   5.019
  340    HA   ARG  46           HA       ARG  46  -3.481  20.142   3.742
  341   1HB   ARG  46           HBR      ARG  46  -5.448  18.270   2.631
  342   2HB   ARG  46           HBS      ARG  46  -5.462  19.872   1.838
  343   1HG   ARG  46           HGS      ARG  46  -3.183  19.679   1.197
  344   2HG   ARG  46           HGR      ARG  46  -2.933  18.256   2.249
  345   1HD   ARG  46           HDS      ARG  46  -4.905  17.303   0.754
  346   2HD   ARG  46           HDR      ARG  46  -4.241  18.487  -0.407
  347    HE   ARG  46           HE       ARG  46  -2.174  17.284  -0.401
  348   1HH1  ARG  46           HH1Z     ARG  46  -4.522  15.807   1.775
  349   2HH1  ARG  46           HH1E     ARG  46  -3.788  14.242   1.682
  350   1HH2  ARG  46           HH2Z     ARG  46  -1.318  15.195  -0.600
  351   2HH2  ARG  46           HH2E     ARG  46  -1.973  13.895   0.340
  352    H    ALA  47           HN       ALA  47  -3.905  22.210   3.154
  353    HA   ALA  47           HA       ALA  47  -4.940  24.253   3.023
  354   1HB   ALA  47           HMBC     ALA  47  -6.726  22.936   1.814
  355   2HB   ALA  47           HMBA     ALA  47  -7.584  22.832   3.372
  356   3HB   ALA  47           HMBB     ALA  47  -7.261  24.424   2.637
  357    H    PHE  48           HN       PHE  48  -5.180  25.770   4.526
  358    HA   PHE  48           HA       PHE  48  -6.321  25.028   7.139
  359   1HB   PHE  48           HBS      PHE  48  -3.519  26.040   6.752
  360   2HB   PHE  48           HBR      PHE  48  -4.481  26.706   8.104
  361    HD1  PHE  48           HD2      PHE  48  -3.252  23.434   6.670
  362    HD2  PHE  48           HD1      PHE  48  -4.855  25.545  10.006
  363    HE1  PHE  48           HE2      PHE  48  -2.758  21.496   8.125
  364    HE2  PHE  48           HE1      PHE  48  -4.372  23.638  11.471
  365    HZ   PHE  48           HZ       PHE  48  -3.269  21.635  10.547
  366    H    ASP  49           HN       ASP  49  -7.165  26.791   8.293
  367    HA   ASP  49           HA       ASP  49  -7.069  29.432   7.433
  368   1HB   ASP  49           HBR      ASP  49  -9.418  29.712   6.574
  369   2HB   ASP  49           HBS      ASP  49  -8.208  29.006   5.464
  370    H    ALA  50           HN       ALA  50  -7.568  30.643   9.073
  371    HA   ALA  50           HA       ALA  50  -8.469  31.397  11.036
  372   1HB   ALA  50           HMBA     ALA  50 -10.478  31.339   9.655
  373   2HB   ALA  50           HMBB     ALA  50 -10.770  29.646  10.128
  374   3HB   ALA  50           HMBC     ALA  50 -10.846  30.938  11.353
   
  No H/Q in entry =         374
  Start of MODEL    2
    1   1H    MET   1           HNC      MET   1 -12.226 -15.520  -5.416
    2   2H    MET   1           HNB      MET   1 -11.368 -16.908  -5.341
    3   3H    MET   1           HN       MET   1 -12.990 -16.938  -5.147
    4    HA   MET   1           HA       MET   1 -12.979 -16.277  -3.062
    5   1HB   MET   1           HBS      MET   1 -10.180 -17.386  -3.447
    6   2HB   MET   1           HBR      MET   1 -10.994 -17.175  -1.871
    7   1HG   MET   1           HGS      MET   1 -12.779 -18.723  -2.562
    8   2HG   MET   1           HGR      MET   1 -12.036 -18.870  -4.174
    9   1HE   MET   1           HMEC     MET   1 -10.485 -20.221  -4.823
   10   2HE   MET   1           HMEA     MET   1  -9.370 -21.289  -3.935
   11   3HE   MET   1           HMEB     MET   1 -11.098 -21.707  -4.054
   12    H    VAL   2           HN       VAL   2 -11.521 -15.205  -1.256
   13    HA   VAL   2           HA       VAL   2 -10.995 -12.477  -2.049
   14    HB   VAL   2           HB       VAL   2 -10.217 -12.196   0.242
   15   1HG1  VAL   2           HMGS     VAL   2 -12.849 -13.563  -0.239
   16   2HG1  VAL   2           HMGS     VAL   2 -12.383 -13.012   1.388
   17   3HG1  VAL   2           HMGS     VAL   2 -12.496 -11.842   0.051
   18   1HG2  VAL   2           HMGR     VAL   2  -9.580 -14.887   0.208
   19   2HG2  VAL   2           HMGR     VAL   2  -9.575 -13.815   1.629
   20   3HG2  VAL   2           HMGR     VAL   2 -11.006 -14.811   1.271
   21    H    ASN   3           HN       ASN   3  -9.260 -15.430  -2.119
   22    HA   ASN   3           HA       ASN   3  -7.096 -15.998  -2.512
   23   1HB   ASN   3           HBS      ASN   3  -6.133 -14.951  -4.348
   24   2HB   ASN   3           HBR      ASN   3  -7.901 -14.815  -4.561
   25   1HD2  ASN   3           HD2Z     ASN   3  -7.968 -11.330  -4.675
   26   2HD2  ASN   3           HD2E     ASN   3  -8.845 -12.824  -4.716
   27    H    LYS   4           HN       LYS   4  -4.792 -14.479  -2.928
   28    HA   LYS   4           HA       LYS   4  -4.121 -12.932  -0.570
   29   1HB   LYS   4           HBR      LYS   4  -4.638 -15.272   0.309
   30   2HB   LYS   4           HBS      LYS   4  -3.194 -15.812  -0.595
   31   1HG   LYS   4           HGR      LYS   4  -2.298 -13.595   0.847
   32   2HG   LYS   4           HGS      LYS   4  -3.395 -14.435   1.981
   33   1HD   LYS   4           HDS      LYS   4  -2.069 -16.559   1.128
   34   2HD   LYS   4           HDR      LYS   4  -0.859 -15.370   0.734
   35   1HE   LYS   4           HES      LYS   4  -0.368 -14.884   2.886
   36   2HE   LYS   4           HER      LYS   4  -2.041 -15.187   3.434
   37   1HZ   LYS   4           HZB      LYS   4  -0.118 -17.270   2.658
   38   2HZ   LYS   4           HZC      LYS   4  -0.493 -16.863   4.195
   39   3HZ   LYS   4           HZA      LYS   4  -1.630 -17.519   3.224
   40    H    GLN   5           HN       GLN   5  -3.725 -13.166  -3.543
   41    HA   GLN   5           HA       GLN   5  -0.767 -13.469  -3.593
   42   1HB   GLN   5           HBR      GLN   5  -1.051 -14.283  -5.921
   43   2HB   GLN   5           HBS      GLN   5  -1.725 -15.357  -4.663
   44   1HG   GLN   5           HGS      GLN   5  -3.969 -14.602  -5.163
   45   2HG   GLN   5           HGR      GLN   5  -3.338 -13.416  -6.341
   46   1HE2  GLN   5           HE2Z     GLN   5  -4.266 -15.825  -8.703
   47   2HE2  GLN   5           HE2E     GLN   5  -4.780 -14.411  -7.846
   48    H    LYS   6           HN       LYS   6  -2.078 -11.013  -3.089
   49    HA   LYS   6           HA       LYS   6  -1.921  -9.254  -5.347
   50   1HB   LYS   6           HBR      LYS   6  -2.615  -8.880  -2.785
   51   2HB   LYS   6           HBS      LYS   6  -0.908  -8.364  -2.687
   52   1HG   LYS   6           HGR      LYS   6  -2.382  -6.446  -3.086
   53   2HG   LYS   6           HGS      LYS   6  -1.300  -6.721  -4.482
   54   1HD   LYS   6           HDS      LYS   6  -3.430  -6.200  -5.344
   55   2HD   LYS   6           HDR      LYS   6  -3.084  -7.879  -5.651
   56   1HE   LYS   6           HES      LYS   6  -5.219  -8.109  -4.954
   57   2HE   LYS   6           HER      LYS   6  -4.379  -8.232  -3.383
   58   1HZ   LYS   6           HZB      LYS   6  -4.913  -5.555  -4.043
   59   2HZ   LYS   6           HZC      LYS   6  -6.296  -6.423  -4.079
   60   3HZ   LYS   6           HZA      LYS   6  -5.378  -6.405  -2.728
   61    H    VAL   7           HN       VAL   7  -0.253  -8.957  -6.608
   62    HA   VAL   7           HA       VAL   7   2.242 -10.244  -5.810
   63    HB   VAL   7           HB       VAL   7   2.715 -10.366  -8.157
   64   1HG1  VAL   7           HMGR     VAL   7   1.028 -11.943  -7.081
   65   2HG1  VAL   7           HMGR     VAL   7  -0.225 -11.012  -7.937
   66   3HG1  VAL   7           HMGR     VAL   7   1.042 -11.857  -8.859
   67   1HG2  VAL   7           HMGS     VAL   7   0.425  -8.442  -8.464
   68   2HG2  VAL   7           HMGS     VAL   7   2.078  -8.355  -9.119
   69   3HG2  VAL   7           HMGS     VAL   7   0.914  -9.520  -9.795
   70    H    CYS   8           HN       CYS   8   4.308  -9.416  -6.195
   71    HA   CYS   8           HA       CYS   8   4.639  -6.489  -6.410
   72   1HB   CYS   8           HBS      CYS   8   6.151  -7.885  -4.952
   73   2HB   CYS   8           HBR      CYS   8   6.740  -8.658  -6.451
   74    HA   PRO   9           HA       PRO   9   4.815  -6.854 -10.831
   75   1HB   PRO   9           HBR      PRO   9   5.080  -4.168 -11.076
   76   2HB   PRO   9           HBS      PRO   9   3.699  -5.025 -11.304
   77   1HG   PRO   9           HGS      PRO   9   4.379  -3.399  -9.159
   78   2HG   PRO   9           HGR      PRO   9   2.874  -3.978  -9.582
   79   1HD   PRO   9           HDS      PRO   9   4.353  -4.863  -7.521
   80   2HD   PRO   9           HDR      PRO   9   3.034  -5.635  -8.151
   81    H    ALA  10           HN       ALA  10   7.018  -5.877  -8.574
   82    HA   ALA  10           HA       ALA  10   8.952  -4.931 -10.539
   83   1HB   ALA  10           HMBB     ALA  10   8.296  -4.090  -8.078
   84   2HB   ALA  10           HMBC     ALA  10   9.675  -5.143  -7.667
   85   3HB   ALA  10           HMBA     ALA  10   9.888  -3.805  -8.826
   86    H    CYS  11           HN       CYS  11   8.780  -7.513  -8.067
   87    HA   CYS  11           HA       CYS  11  11.138  -8.740  -9.402
   88   1HB   CYS  11           HBS      CYS  11  11.662  -9.921  -7.371
   89   2HB   CYS  11           HBR      CYS  11  11.672  -8.153  -7.134
   90    H    GLU  12           HN       GLU  12   7.844  -8.913  -9.140
   91    HA   GLU  12           HA       GLU  12   6.211 -10.517  -9.299
   92   1HB   GLU  12           HBR      GLU  12   8.497 -12.074 -10.533
   93   2HB   GLU  12           HBS      GLU  12   6.892 -12.558 -10.497
   94   1HG   GLU  12           HGS      GLU  12   7.568  -9.903 -11.689
   95   2HG   GLU  12           HGR      GLU  12   7.655 -11.367 -12.707
   96    H    SER  13           HN       SER  13   7.429 -10.272  -6.842
   97    HA   SER  13           HA       SER  13   7.091 -13.053  -5.838
   98   1HB   SER  13           HBS      SER  13   8.055 -10.566  -4.406
   99   2HB   SER  13           HBR      SER  13   7.673 -12.115  -3.606
  100    HG   SER  13           HG       SER  13   9.420 -11.912  -5.901
  101    H    ALA  14           HN       ALA  14   5.304 -13.589  -4.751
  102    HA   ALA  14           HA       ALA  14   3.040 -11.868  -5.063
  103   1HB   ALA  14           HMBC     ALA  14   3.521 -14.637  -3.973
  104   2HB   ALA  14           HMBB     ALA  14   1.922 -13.862  -3.829
  105   3HB   ALA  14           HMBA     ALA  14   2.635 -14.144  -5.438
  106    H    GLU  15           HN       GLU  15   5.316 -12.058  -2.642
  107    HA   GLU  15           HA       GLU  15   3.439 -11.743  -0.409
  108   1HB   GLU  15           HBR      GLU  15   6.452 -11.763  -0.357
  109   2HB   GLU  15           HBS      GLU  15   5.374 -12.034   0.901
  110   1HG   GLU  15           HGS      GLU  15   4.498 -14.071  -0.034
  111   2HG   GLU  15           HGR      GLU  15   5.560 -13.954  -1.464
  112    H    LEU  16           HN       LEU  16   2.814  -9.854   0.312
  113    HA   LEU  16           HA       LEU  16   4.798  -7.638   0.424
  114   1HB   LEU  16           HBR      LEU  16   1.853  -7.250  -0.118
  115   2HB   LEU  16           HBS      LEU  16   3.196  -6.086  -0.303
  116    HG   LEU  16           HG       LEU  16   2.751  -8.529  -2.039
  117   1HD1  LEU  16           HMDR     LEU  16   1.628  -5.825  -2.091
  118   2HD1  LEU  16           HMDR     LEU  16   2.502  -6.244  -3.586
  119   3HD1  LEU  16           HMDR     LEU  16   1.168  -7.278  -3.015
  120   1HD2  LEU  16           HMDS     LEU  16   4.903  -6.578  -1.646
  121   2HD2  LEU  16           HMDS     LEU  16   4.916  -8.150  -2.485
  122   3HD2  LEU  16           HMDS     LEU  16   4.356  -6.690  -3.338
  123    H    ILE  17           HN       ILE  17   4.152  -5.967   2.024
  124    HA   ILE  17           HA       ILE  17   2.585  -6.960   4.277
  125    HB   ILE  17           HB       ILE  17   4.519  -6.526   5.894
  126   1HG1  ILE  17           HG1R     ILE  17   6.078  -6.641   3.292
  127   2HG1  ILE  17           HG1S     ILE  17   6.017  -5.314   4.485
  128   1HG2  ILE  17           HMG2     ILE  17   3.726  -8.784   5.445
  129   2HG2  ILE  17           HMG2     ILE  17   4.821  -8.901   4.041
  130   3HG2  ILE  17           HMG2     ILE  17   5.493  -8.756   5.687
  131   1HD1  ILE  17           HMD1     ILE  17   7.069  -6.989   6.123
  132   2HD1  ILE  17           HMD1     ILE  17   7.428  -7.973   4.680
  133   3HD1  ILE  17           HMD1     ILE  17   8.100  -6.328   4.827
  134    H    TYR  18           HN       TYR  18   2.207  -5.332   5.866
  135    HA   TYR  18           HA       TYR  18   2.086  -2.710   4.511
  136   1HB   TYR  18           HBS      TYR  18  -0.038  -3.765   5.035
  137   2HB   TYR  18           HBR      TYR  18   0.424  -3.917   6.754
  138    HD1  TYR  18           HD2      TYR  18   0.830  -1.004   4.457
  139    HD2  TYR  18           HD1      TYR  18  -1.188  -2.564   7.860
  140    HE1  TYR  18           HE2      TYR  18  -0.111   1.217   4.907
  141    HE2  TYR  18           HE1      TYR  18  -2.161  -0.352   8.305
  142    HH   TYR  18           HH       TYR  18  -1.466   1.972   7.966
  143    H    ASP  19           HN       ASP  19   2.573  -0.801   5.502
  144    HA   ASP  19           HA       ASP  19   3.907  -0.950   8.147
  145   1HB   ASP  19           HBS      ASP  19   5.351  -0.822   5.915
  146   2HB   ASP  19           HBR      ASP  19   5.013   0.920   6.130
  147    HA   PRO  20           HA       PRO  20   0.563   1.940   8.498
  148   1HB   PRO  20           HBR      PRO  20   0.493   1.791  11.189
  149   2HB   PRO  20           HBS      PRO  20  -0.457   0.930  10.163
  150   1HG   PRO  20           HGS      PRO  20   1.738   0.049  11.639
  151   2HG   PRO  20           HGR      PRO  20   0.508  -0.856  10.967
  152   1HD   PRO  20           HDS      PRO  20   2.997  -0.710   9.998
  153   2HD   PRO  20           HDR      PRO  20   1.683  -1.251   9.152
  154    H    GLU  21           HN       GLU  21   3.691   2.190   9.519
  155    HA   GLU  21           HA       GLU  21   3.479   4.715  10.981
  156   1HB   GLU  21           HBR      GLU  21   5.792   3.215   9.732
  157   2HB   GLU  21           HBS      GLU  21   5.922   4.652  10.589
  158   1HG   GLU  21           HGS      GLU  21   5.759   3.790  12.611
  159   2HG   GLU  21           HGR      GLU  21   4.431   2.674  12.196
  160    H    ARG  22           HN       ARG  22   4.323   3.582   7.708
  161    HA   ARG  22           HA       ARG  22   4.417   6.357   6.739
  162   1HB   ARG  22           HBR      ARG  22   4.919   3.686   5.394
  163   2HB   ARG  22           HBS      ARG  22   4.969   5.264   4.556
  164   1HG   ARG  22           HGS      ARG  22   6.636   5.299   6.929
  165   2HG   ARG  22           HGR      ARG  22   7.081   3.942   5.856
  166   1HD   ARG  22           HDS      ARG  22   8.170   5.359   4.577
  167   2HD   ARG  22           HDR      ARG  22   6.621   6.159   4.195
  168    HE   ARG  22           HE       ARG  22   7.729   7.060   6.702
  169   1HH1  ARG  22           HH1Z     ARG  22   7.609   7.583   3.217
  170   2HH1  ARG  22           HH1E     ARG  22   8.327   9.156   3.320
  171   1HH2  ARG  22           HH2Z     ARG  22   8.784   9.063   6.782
  172   2HH2  ARG  22           HH2E     ARG  22   8.992   9.995   5.337
  173    H    GLY  23           HN       GLY  23   2.199   3.755   7.026
  174   1HA   GLY  23           HAR      GLY  23   0.066   3.371   6.201
  175   2HA   GLY  23           HAS      GLY  23   0.069   5.002   5.476
  176    H    GLU  24           HN       GLU  24   2.159   2.105   5.132
  177    HA   GLU  24           HA       GLU  24   1.889   2.294   2.165
  178   1HB   GLU  24           HBS      GLU  24   3.618   3.703   3.055
  179   2HB   GLU  24           HBR      GLU  24   4.333   2.466   3.934
  180   1HG   GLU  24           HGR      GLU  24   5.501   1.687   2.007
  181   2HG   GLU  24           HGS      GLU  24   3.989   1.841   1.073
  182    H    ILE  25           HN       ILE  25   1.609   0.382   1.293
  183    HA   ILE  25           HA       ILE  25   2.501  -2.075   2.692
  184    HB   ILE  25           HB       ILE  25   0.955  -1.875   0.069
  185   1HG1  ILE  25           HG1R     ILE  25  -1.023  -2.482   1.746
  186   2HG1  ILE  25           HG1S     ILE  25   0.013  -1.600   2.906
  187   1HG2  ILE  25           HMG2     ILE  25   1.843  -4.072   1.798
  188   2HG2  ILE  25           HMG2     ILE  25   0.122  -4.150   1.334
  189   3HG2  ILE  25           HMG2     ILE  25   1.382  -4.063   0.074
  190   1HD1  ILE  25           HMD1     ILE  25  -0.291  -0.161   0.389
  191   2HD1  ILE  25           HMD1     ILE  25  -1.858  -0.497   1.174
  192   3HD1  ILE  25           HMD1     ILE  25  -0.583   0.377   2.064
  193    H    VAL  26           HN       VAL  26   4.217  -3.182   2.079
  194    HA   VAL  26           HA       VAL  26   5.718  -2.195  -0.291
  195    HB   VAL  26           HB       VAL  26   6.955  -3.140   2.291
  196   1HG1  VAL  26           HMGR     VAL  26   8.002  -1.515  -0.037
  197   2HG1  VAL  26           HMGR     VAL  26   8.867  -1.734   1.504
  198   3HG1  VAL  26           HMGR     VAL  26   8.504  -3.143   0.479
  199   1HG2  VAL  26           HMGS     VAL  26   5.396  -0.819   2.037
  200   2HG2  VAL  26           HMGS     VAL  26   6.498  -1.260   3.361
  201   3HG2  VAL  26           HMGS     VAL  26   7.091  -0.278   2.000
  202    H    CYS  27           HN       CYS  27   7.516  -3.721  -0.910
  203    HA   CYS  27           HA       CYS  27   6.594  -6.482  -1.037
  204   1HB   CYS  27           HBS      CYS  27   7.718  -5.255  -2.908
  205   2HB   CYS  27           HBR      CYS  27   9.228  -5.313  -1.959
  206    H    ALA  28           HN       ALA  28   7.370  -8.204   0.017
  207    HA   ALA  28           HA       ALA  28   9.395  -7.766   2.149
  208   1HB   ALA  28           HMBB     ALA  28   7.056  -9.025   2.364
  209   2HB   ALA  28           HMBC     ALA  28   8.036 -10.388   1.767
  210   3HB   ALA  28           HMBA     ALA  28   8.512  -9.534   3.257
  211    H    LYS  29           HN       LYS  29   9.926  -7.778  -0.756
  212    HA   LYS  29           HA       LYS  29  12.014  -9.885  -0.662
  213   1HB   LYS  29           HBR      LYS  29   9.943  -9.995  -2.487
  214   2HB   LYS  29           HBS      LYS  29  11.220  -9.120  -3.381
  215   1HG   LYS  29           HGR      LYS  29  12.348 -11.397  -1.985
  216   2HG   LYS  29           HGS      LYS  29  10.968 -11.910  -2.997
  217   1HD   LYS  29           HDS      LYS  29  12.235 -10.272  -4.722
  218   2HD   LYS  29           HDR      LYS  29  13.594 -10.796  -3.766
  219   1HE   LYS  29           HES      LYS  29  13.660 -12.779  -4.739
  220   2HE   LYS  29           HER      LYS  29  11.925 -13.044  -4.416
  221   1HZ   LYS  29           HZB      LYS  29  11.624 -11.471  -6.372
  222   2HZ   LYS  29           HZC      LYS  29  13.177 -11.813  -6.746
  223   3HZ   LYS  29           HZA      LYS  29  12.068 -13.010  -6.687
  224    H    CYS  30           HN       CYS  30  11.122  -7.299  -2.964
  225    HA   CYS  30           HA       CYS  30  13.887  -6.532  -3.005
  226   1HB   CYS  30           HBS      CYS  30  13.268  -5.126  -4.898
  227   2HB   CYS  30           HBR      CYS  30  12.684  -6.805  -5.051
  228    H    GLY  31           HN       GLY  31  11.438  -5.516  -1.030
  229   1HA   GLY  31           HAR      GLY  31  11.480  -3.793   0.499
  230   2HA   GLY  31           HAS      GLY  31  12.763  -3.002  -0.457
  231    H    TYR  32           HN       TYR  32  10.352  -3.724  -2.604
  232    HA   TYR  32           HA       TYR  32  10.045  -0.839  -3.048
  233   1HB   TYR  32           HBS      TYR  32  10.421  -2.260  -4.979
  234   2HB   TYR  32           HBR      TYR  32   9.002  -3.262  -4.568
  235    HD1  TYR  32           HD2      TYR  32   9.660   0.413  -4.969
  236    HD2  TYR  32           HD1      TYR  32   7.222  -2.906  -6.032
  237    HE1  TYR  32           HE2      TYR  32   8.323   1.870  -6.422
  238    HE2  TYR  32           HE1      TYR  32   5.855  -1.451  -7.465
  239    HH   TYR  32           HH       TYR  32   6.394   0.634  -8.859
  240    H    VAL  33           HN       VAL  33   8.354   0.354  -2.556
  241    HA   VAL  33           HA       VAL  33   6.143  -0.544  -1.013
  242    HB   VAL  33           HB       VAL  33   6.430   1.913  -2.756
  243   1HG1  VAL  33           HMGR     VAL  33   4.411   1.291  -0.589
  244   2HG1  VAL  33           HMGR     VAL  33   4.669   2.895  -1.316
  245   3HG1  VAL  33           HMGR     VAL  33   4.094   1.545  -2.322
  246   1HG2  VAL  33           HMGS     VAL  33   8.152   1.733  -1.013
  247   2HG2  VAL  33           HMGS     VAL  33   7.036   3.091  -0.728
  248   3HG2  VAL  33           HMGS     VAL  33   6.877   1.593   0.221
  249    H    ILE  34           HN       ILE  34   3.892  -0.515  -1.654
  250    HA   ILE  34           HA       ILE  34   3.448  -1.300  -4.491
  251    HB   ILE  34           HB       ILE  34   2.032  -2.065  -1.897
  252   1HG1  ILE  34           HG1R     ILE  34   4.227  -3.134  -2.586
  253   2HG1  ILE  34           HG1S     ILE  34   2.867  -4.240  -2.239
  254   1HG2  ILE  34           HMG2     ILE  34   0.312  -1.738  -3.575
  255   2HG2  ILE  34           HMG2     ILE  34   1.193  -2.790  -4.715
  256   3HG2  ILE  34           HMG2     ILE  34   0.519  -3.472  -3.212
  257   1HD1  ILE  34           HMD1     ILE  34   2.482  -4.230  -4.790
  258   2HD1  ILE  34           HMD1     ILE  34   4.124  -3.539  -4.888
  259   3HD1  ILE  34           HMD1     ILE  34   3.873  -5.141  -4.147
  260    H    GLU  35           HN       GLU  35   1.277  -0.188  -1.899
  261    HA   GLU  35           HA       GLU  35   0.396   2.031  -3.688
  262   1HB   GLU  35           HBR      GLU  35  -0.898  -0.112  -2.426
  263   2HB   GLU  35           HBS      GLU  35  -1.202   1.193  -1.416
  264   1HG   GLU  35           HGS      GLU  35  -2.827   1.959  -2.650
  265   2HG   GLU  35           HGR      GLU  35  -1.719   2.251  -4.018
  266    H    GLU  36           HN       GLU  36  -0.062   4.043  -2.820
  267    HA   GLU  36           HA       GLU  36   0.657   4.492   0.037
  268   1HB   GLU  36           HBR      GLU  36   1.945   5.537  -2.225
  269   2HB   GLU  36           HBS      GLU  36   0.849   6.734  -1.796
  270   1HG   GLU  36           HGS      GLU  36   1.637   6.971   0.434
  271   2HG   GLU  36           HGR      GLU  36   2.798   5.626   0.271
  272    H    ASN  37           HN       ASN  37  -1.814   3.687  -0.700
  273    HA   ASN  37           HA       ASN  37  -3.409   6.139  -0.282
  274   1HB   ASN  37           HBS      ASN  37  -3.429   4.417  -2.658
  275   2HB   ASN  37           HBR      ASN  37  -5.036   4.768  -1.957
  276   1HD2  ASN  37           HD2Z     ASN  37  -4.518   8.403  -2.344
  277   2HD2  ASN  37           HD2E     ASN  37  -4.842   7.305  -1.044
  278    H    ILE  38           HN       ILE  38  -3.349   5.347   1.886
  279    HA   ILE  38           HA       ILE  38  -5.733   3.625   2.264
  280    HB   ILE  38           HB       ILE  38  -3.755   2.309   2.967
  281   1HG1  ILE  38           HG1R     ILE  38  -5.098   3.060   5.544
  282   2HG1  ILE  38           HG1S     ILE  38  -6.118   2.526   4.179
  283   1HG2  ILE  38           HMG2     ILE  38  -2.323   4.268   3.601
  284   2HG2  ILE  38           HMG2     ILE  38  -3.263   4.378   5.113
  285   3HG2  ILE  38           HMG2     ILE  38  -2.315   2.910   4.757
  286   1HD1  ILE  38           HMD1     ILE  38  -3.750   0.899   5.091
  287   2HD1  ILE  38           HMD1     ILE  38  -5.337   0.769   5.896
  288   3HD1  ILE  38           HMD1     ILE  38  -5.182   0.386   4.160
  289    H    ILE  39           HN       ILE  39  -7.282   4.551   3.391
  290    HA   ILE  39           HA       ILE  39  -8.462   5.970   4.663
  291    HB   ILE  39           HB       ILE  39  -6.327   5.532   6.187
  292   1HG1  ILE  39           HG1R     ILE  39  -7.494   7.154   7.857
  293   2HG1  ILE  39           HG1S     ILE  39  -8.645   7.430   6.518
  294   1HG2  ILE  39           HMG2     ILE  39  -5.922   8.371   5.363
  295   2HG2  ILE  39           HMG2     ILE  39  -5.710   7.937   7.080
  296   3HG2  ILE  39           HMG2     ILE  39  -4.744   7.114   5.827
  297   1HD1  ILE  39           HMD1     ILE  39  -8.868   4.872   6.434
  298   2HD1  ILE  39           HMD1     ILE  39  -8.071   4.880   8.029
  299   3HD1  ILE  39           HMD1     ILE  39  -9.625   5.725   7.804
  300    H    ASP  40           HN       ASP  40  -5.547   7.713   3.461
  301    HA   ASP  40           HA       ASP  40  -6.775  10.185   3.367
  302   1HB   ASP  40           HBS      ASP  40  -4.265   9.108   2.654
  303   2HB   ASP  40           HBR      ASP  40  -4.836  10.103   1.283
  304    H    MET  41           HN       MET  41  -8.663  10.539   2.505
  305    HA   MET  41           HA       MET  41  -8.722  10.556  -0.429
  306   1HB   MET  41           HBR      MET  41 -10.845   9.225   1.266
  307   2HB   MET  41           HBS      MET  41 -11.165   9.858  -0.375
  308   1HG   MET  41           HGS      MET  41  -9.488   8.377  -1.333
  309   2HG   MET  41           HGR      MET  41  -8.958   7.873   0.290
  310   1HE   MET  41           HMEA     MET  41 -11.832   8.542  -1.884
  311   2HE   MET  41           HMEB     MET  41 -12.512   6.929  -2.215
  312   3HE   MET  41           HMEC     MET  41 -13.192   7.931  -0.909
  313    H    GLY  42           HN       GLY  42  -9.001  12.566  -0.965
  314   1HA   GLY  42           HAR      GLY  42 -10.717  14.448  -0.800
  315   2HA   GLY  42           HAS      GLY  42 -10.348  14.427   0.947
  316    HA   PRO  43           HA       PRO  43  -7.295  17.331   0.606
  317   1HB   PRO  43           HBS      PRO  43  -5.393  15.946   2.133
  318   2HB   PRO  43           HBR      PRO  43  -6.188  17.331   2.519
  319   1HG   PRO  43           HGS      PRO  43  -6.638  14.960   3.610
  320   2HG   PRO  43           HGR      PRO  43  -7.716  16.233   3.663
  321   1HD   PRO  43           HDS      PRO  43  -7.874  13.884   2.147
  322   2HD   PRO  43           HDR      PRO  43  -9.074  14.971   2.484
  323    H    GLU  44           HN       GLU  44  -5.871  18.180  -0.714
  324    HA   GLU  44           HA       GLU  44  -4.619  16.246  -2.596
  325   1HB   GLU  44           HBR      GLU  44  -5.263  19.182  -2.581
  326   2HB   GLU  44           HBS      GLU  44  -3.994  18.613  -3.519
  327   1HG   GLU  44           HGS      GLU  44  -5.589  18.483  -5.105
  328   2HG   GLU  44           HGR      GLU  44  -5.694  16.812  -4.487
  329    H    TRP  45           HN       TRP  45  -2.432  17.485  -3.406
  330    HA   TRP  45           HA       TRP  45  -0.699  17.125  -1.037
  331   1HB   TRP  45           HBS      TRP  45  -0.144  17.007  -4.002
  332   2HB   TRP  45           HBR      TRP  45   1.126  16.976  -2.744
  333    HD1  TRP  45           HD1      TRP  45  -0.726  14.638  -4.818
  334    HE1  TRP  45           HE1      TRP  45  -0.728  12.265  -3.833
  335    HE3  TRP  45           HE3      TRP  45   0.817  15.784  -0.108
  336    HZ2  TRP  45           HZ2      TRP  45  -0.159  11.066  -1.363
  337    HZ3  TRP  45           HZ3      TRP  45   1.065  13.969   1.520
  338    HH2  TRP  45           HH2      TRP  45   0.587  11.655   0.917
  339    H    ARG  46           HN       ARG  46  -0.162  19.037  -3.987
  340    HA   ARG  46           HA       ARG  46   0.159  21.453  -2.269
  341   1HB   ARG  46           HBR      ARG  46   1.350  21.268  -5.010
  342   2HB   ARG  46           HBS      ARG  46   1.887  22.185  -3.574
  343   1HG   ARG  46           HGS      ARG  46   2.020  19.306  -3.138
  344   2HG   ARG  46           HGR      ARG  46   2.975  19.811  -4.561
  345   1HD   ARG  46           HDS      ARG  46   3.989  21.588  -3.127
  346   2HD   ARG  46           HDR      ARG  46   3.171  20.833  -1.731
  347    HE   ARG  46           HE       ARG  46   4.569  18.908  -1.994
  348   1HH1  ARG  46           HH1Z     ARG  46   5.273  21.357  -4.431
  349   2HH1  ARG  46           HH1E     ARG  46   6.898  20.806  -4.671
  350   1HH2  ARG  46           HH2Z     ARG  46   6.739  18.299  -2.242
  351   2HH2  ARG  46           HH2E     ARG  46   7.727  19.074  -3.435
  352    H    ALA  47           HN       ALA  47  -0.424  23.479  -3.200
  353    HA   ALA  47           HA       ALA  47  -2.630  23.308  -5.189
  354   1HB   ALA  47           HMBB     ALA  47  -2.405  24.712  -2.795
  355   2HB   ALA  47           HMBA     ALA  47  -2.111  25.933  -4.059
  356   3HB   ALA  47           HMBC     ALA  47  -3.607  24.966  -4.086
  357    H    PHE  48           HN       PHE  48   0.390  23.117  -5.553
  358    HA   PHE  48           HA       PHE  48   1.054  25.658  -6.841
  359   1HB   PHE  48           HBR      PHE  48   2.698  23.166  -6.251
  360   2HB   PHE  48           HBS      PHE  48   3.310  24.536  -7.224
  361    HD1  PHE  48           HD1      PHE  48   1.381  24.071  -4.101
  362    HD2  PHE  48           HD2      PHE  48   4.734  25.960  -5.932
  363    HE1  PHE  48           HE1      PHE  48   1.856  25.226  -1.989
  364    HE2  PHE  48           HE2      PHE  48   5.236  27.133  -3.812
  365    HZ   PHE  48           HZ       PHE  48   3.748  26.804  -1.859
  366    H    ASP  49           HN       ASP  49   1.656  22.277  -7.847
  367    HA   ASP  49           HA       ASP  49   1.156  23.175 -10.628
  368   1HB   ASP  49           HBS      ASP  49   3.074  20.986  -9.895
  369   2HB   ASP  49           HBR      ASP  49   2.953  21.949 -11.396
  370    H    ALA  50           HN       ALA  50  -0.218  22.155 -11.855
  371    HA   ALA  50           HA       ALA  50  -1.104  19.412 -11.107
  372   1HB   ALA  50           HMBC     ALA  50  -2.832  21.841 -11.653
  373   2HB   ALA  50           HMBB     ALA  50  -3.426  20.165 -11.542
  374   3HB   ALA  50           HMBA     ALA  50  -2.677  20.942 -10.123
   
  No H/Q in entry =         374
  Start of MODEL    3
    1   1H    MET   1           HN       MET   1   1.459  -6.900   5.067
    2   2H    MET   1           HNB      MET   1   0.505  -6.451   6.313
    3   3H    MET   1           HNC      MET   1   2.114  -6.617   6.536
    4    HA   MET   1           HA       MET   1   2.068  -8.912   6.245
    5   1HB   MET   1           HBS      MET   1   0.783  -7.534   8.352
    6   2HB   MET   1           HBR      MET   1  -0.256  -8.928   7.962
    7   1HG   MET   1           HGS      MET   1   1.260  -9.823   9.536
    8   2HG   MET   1           HGR      MET   1   1.930 -10.319   7.966
    9   1HE   MET   1           HMEC     MET   1   1.690  -7.676  10.562
   10   2HE   MET   1           HMEB     MET   1   3.350  -7.116  10.885
   11   3HE   MET   1           HMEA     MET   1   2.410  -6.396   9.553
   12    H    VAL   2           HN       VAL   2   0.885 -10.834   5.806
   13    HA   VAL   2           HA       VAL   2  -0.360 -12.101   4.386
   14    HB   VAL   2           HB       VAL   2  -2.692 -11.946   4.718
   15   1HG1  VAL   2           HMGR     VAL   2  -0.841 -11.849   6.886
   16   2HG1  VAL   2           HMGR     VAL   2  -2.342 -11.034   7.388
   17   3HG1  VAL   2           HMGR     VAL   2  -2.398 -12.704   6.773
   18   1HG2  VAL   2           HMGS     VAL   2  -2.603  -9.310   4.397
   19   2HG2  VAL   2           HMGS     VAL   2  -3.948 -10.130   5.225
   20   3HG2  VAL   2           HMGS     VAL   2  -2.660  -9.352   6.176
   21    H    ASN   3           HN       ASN   3  -2.443 -11.757   2.739
   22    HA   ASN   3           HA       ASN   3  -2.191  -9.525   1.034
   23   1HB   ASN   3           HBS      ASN   3  -1.134 -10.334  -0.893
   24   2HB   ASN   3           HBR      ASN   3  -0.036 -10.631   0.486
   25   1HD2  ASN   3           HD2Z     ASN   3   0.059 -14.109   0.127
   26   2HD2  ASN   3           HD2E     ASN   3   0.507 -12.720   1.059
   27    H    LYS   4           HN       LYS   4  -4.202  -9.251   0.578
   28    HA   LYS   4           HA       LYS   4  -5.720 -11.564  -0.549
   29   1HB   LYS   4           HBR      LYS   4  -6.481 -10.165   1.638
   30   2HB   LYS   4           HBS      LYS   4  -7.204  -9.156   0.352
   31   1HG   LYS   4           HGR      LYS   4  -8.848 -10.638  -0.011
   32   2HG   LYS   4           HGS      LYS   4  -7.699 -12.004  -0.086
   33   1HD   LYS   4           HDS      LYS   4  -9.190 -12.470   1.669
   34   2HD   LYS   4           HDR      LYS   4  -7.632 -12.084   2.346
   35   1HE   LYS   4           HES      LYS   4  -8.313 -10.062   3.220
   36   2HE   LYS   4           HER      LYS   4  -9.682  -9.936   2.081
   37   1HZ   LYS   4           HZA      LYS   4  -9.888 -12.221   3.717
   38   2HZ   LYS   4           HZB      LYS   4  -9.778 -10.870   4.627
   39   3HZ   LYS   4           HZC      LYS   4 -10.953 -11.003   3.502
   40    H    GLN   5           HN       GLN   5  -4.356  -8.446  -1.025
   41    HA   GLN   5           HA       GLN   5  -6.127  -7.925  -3.349
   42   1HB   GLN   5           HBS      GLN   5  -5.145  -6.241  -1.157
   43   2HB   GLN   5           HBR      GLN   5  -4.940  -5.523  -2.779
   44   1HG   GLN   5           HGS      GLN   5  -7.512  -6.523  -1.529
   45   2HG   GLN   5           HGR      GLN   5  -7.050  -4.826  -1.840
   46   1HE2  GLN   5           HE2Z     GLN   5  -9.406  -6.108  -4.452
   47   2HE2  GLN   5           HE2E     GLN   5  -9.418  -6.136  -2.720
   48    H    LYS   6           HN       LYS   6  -2.936  -6.677  -2.344
   49    HA   LYS   6           HA       LYS   6  -2.252  -6.576  -5.207
   50   1HB   LYS   6           HBS      LYS   6  -0.404  -5.068  -4.352
   51   2HB   LYS   6           HBR      LYS   6  -2.079  -4.479  -4.157
   52   1HG   LYS   6           HGR      LYS   6  -0.807  -5.963  -1.878
   53   2HG   LYS   6           HGS      LYS   6  -0.290  -4.283  -2.198
   54   1HD   LYS   6           HDS      LYS   6  -3.142  -4.407  -2.301
   55   2HD   LYS   6           HDR      LYS   6  -2.608  -5.237  -0.865
   56   1HE   LYS   6           HES      LYS   6  -1.044  -2.917  -0.961
   57   2HE   LYS   6           HER      LYS   6  -2.703  -2.427  -1.407
   58   1HZ   LYS   6           HZB      LYS   6  -3.478  -3.503   0.582
   59   2HZ   LYS   6           HZC      LYS   6  -1.965  -3.963   0.989
   60   3HZ   LYS   6           HZA      LYS   6  -2.357  -2.378   0.962
   61    H    VAL   7           HN       VAL   7  -0.495  -7.472  -6.110
   62    HA   VAL   7           HA       VAL   7   1.305  -9.118  -4.418
   63    HB   VAL   7           HB       VAL   7   2.102 -10.100  -6.466
   64   1HG1  VAL   7           HMGR     VAL   7  -0.470 -10.472  -5.415
   65   2HG1  VAL   7           HMGR     VAL   7  -0.670 -10.495  -7.183
   66   3HG1  VAL   7           HMGR     VAL   7   0.478 -11.610  -6.402
   67   1HG2  VAL   7           HMGS     VAL   7   0.488  -7.959  -7.761
   68   2HG2  VAL   7           HMGS     VAL   7   2.082  -8.628  -8.193
   69   3HG2  VAL   7           HMGS     VAL   7   0.600  -9.536  -8.580
   70    H    CYS   8           HN       CYS   8   3.588  -9.033  -5.860
   71    HA   CYS   8           HA       CYS   8   4.380  -6.182  -6.059
   72   1HB   CYS   8           HBS      CYS   8   5.805  -7.888  -4.824
   73   2HB   CYS   8           HBR      CYS   8   6.133  -8.614  -6.422
   74    HA   PRO   9           HA       PRO   9   3.922  -6.396 -10.448
   75   1HB   PRO   9           HBR      PRO   9   4.285  -3.626 -10.331
   76   2HB   PRO   9           HBS      PRO   9   3.000  -4.459 -10.925
   77   1HG   PRO   9           HGS      PRO   9   2.979  -3.058  -8.680
   78   2HG   PRO   9           HGR      PRO   9   1.855  -4.225  -9.078
   79   1HD   PRO   9           HDS      PRO   9   3.941  -4.379  -7.204
   80   2HD   PRO   9           HDR      PRO   9   2.604  -5.345  -7.336
   81    H    ALA  10           HN       ALA  10   6.434  -5.887  -8.478
   82    HA   ALA  10           HA       ALA  10   8.271  -4.876 -10.581
   83   1HB   ALA  10           HMBC     ALA  10   8.152  -4.195  -7.986
   84   2HB   ALA  10           HMBA     ALA  10   9.278  -5.572  -7.876
   85   3HB   ALA  10           HMBB     ALA  10   9.656  -4.194  -8.942
   86    H    CYS  11           HN       CYS  11   8.677  -7.314  -7.994
   87    HA   CYS  11           HA       CYS  11  10.494  -8.632  -9.813
   88   1HB   CYS  11           HBS      CYS  11  11.333  -9.821  -7.916
   89   2HB   CYS  11           HBR      CYS  11  11.170  -8.084  -7.559
   90    H    GLU  12           HN       GLU  12   7.264  -9.071  -9.251
   91    HA   GLU  12           HA       GLU  12   5.741 -10.766  -9.360
   92   1HB   GLU  12           HBR      GLU  12   7.986 -12.439 -10.503
   93   2HB   GLU  12           HBS      GLU  12   6.351 -12.809 -10.463
   94   1HG   GLU  12           HGS      GLU  12   6.039 -10.487 -11.687
   95   2HG   GLU  12           HGR      GLU  12   7.674 -10.841 -12.309
   96    H    SER  13           HN       SER  13   6.417 -10.296  -6.996
   97    HA   SER  13           HA       SER  13   6.397 -13.014  -5.882
   98   1HB   SER  13           HBS      SER  13   7.963 -10.768  -4.586
   99   2HB   SER  13           HBR      SER  13   7.616 -12.361  -3.860
  100    HG   SER  13           HG       SER  13   9.024 -13.354  -5.000
  101    H    ALA  14           HN       ALA  14   5.000 -13.268  -4.173
  102    HA   ALA  14           HA       ALA  14   2.888 -11.246  -4.180
  103   1HB   ALA  14           HMBB     ALA  14   2.666 -13.805  -4.589
  104   2HB   ALA  14           HMBA     ALA  14   2.777 -13.931  -2.815
  105   3HB   ALA  14           HMBC     ALA  14   1.457 -12.994  -3.559
  106    H    GLU  15           HN       GLU  15   5.477 -11.986  -2.224
  107    HA   GLU  15           HA       GLU  15   4.113 -11.713   0.395
  108   1HB   GLU  15           HBR      GLU  15   7.071 -11.793  -0.105
  109   2HB   GLU  15           HBS      GLU  15   6.203 -12.142   1.289
  110   1HG   GLU  15           HGS      GLU  15   5.134 -13.910  -0.596
  111   2HG   GLU  15           HGR      GLU  15   6.902 -14.052  -0.797
  112    H    LEU  16           HN       LEU  16   3.560  -9.742   0.956
  113    HA   LEU  16           HA       LEU  16   5.593  -7.581   0.664
  114   1HB   LEU  16           HBR      LEU  16   2.572  -7.339   0.658
  115   2HB   LEU  16           HBS      LEU  16   3.773  -6.062   0.314
  116    HG   LEU  16           HG       LEU  16   3.151  -8.483  -1.398
  117   1HD1  LEU  16           HMDR     LEU  16   1.972  -5.896  -1.206
  118   2HD1  LEU  16           HMDR     LEU  16   2.924  -5.948  -2.711
  119   3HD1  LEU  16           HMDR     LEU  16   1.663  -7.171  -2.413
  120   1HD2  LEU  16           HMDS     LEU  16   5.344  -6.459  -1.349
  121   2HD2  LEU  16           HMDS     LEU  16   5.367  -8.168  -1.852
  122   3HD2  LEU  16           HMDS     LEU  16   4.686  -6.929  -2.936
  123    H    ILE  17           HN       ILE  17   4.531  -5.666   2.200
  124    HA   ILE  17           HA       ILE  17   3.976  -6.638   4.853
  125    HB   ILE  17           HB       ILE  17   6.173  -5.576   5.785
  126   1HG1  ILE  17           HG1R     ILE  17   6.968  -6.136   2.906
  127   2HG1  ILE  17           HG1S     ILE  17   7.001  -4.573   3.772
  128   1HG2  ILE  17           HMG2     ILE  17   5.529  -8.011   5.842
  129   2HG2  ILE  17           HMG2     ILE  17   6.524  -8.224   4.377
  130   3HG2  ILE  17           HMG2     ILE  17   7.278  -7.664   5.894
  131   1HD1  ILE  17           HMD1     ILE  17   8.617  -6.324   5.274
  132   2HD1  ILE  17           HMD1     ILE  17   9.040  -6.603   3.564
  133   3HD1  ILE  17           HMD1     ILE  17   9.136  -4.959   4.249
  134    H    TYR  18           HN       TYR  18   2.905  -5.132   5.895
  135    HA   TYR  18           HA       TYR  18   2.496  -2.623   4.448
  136   1HB   TYR  18           HBR      TYR  18   0.725  -4.351   5.397
  137   2HB   TYR  18           HBS      TYR  18   0.926  -3.392   6.890
  138    HD1  TYR  18           HD1      TYR  18   0.436  -0.887   6.782
  139    HD2  TYR  18           HD2      TYR  18  -0.639  -3.564   3.656
  140    HE1  TYR  18           HE1      TYR  18  -1.263   0.710   6.005
  141    HE2  TYR  18           HE2      TYR  18  -2.326  -1.970   2.860
  142    HH   TYR  18           HH       TYR  18  -2.227   0.900   3.094
  143    H    ASP  19           HN       ASP  19   2.880  -0.629   5.160
  144    HA   ASP  19           HA       ASP  19   3.983  -0.318   7.899
  145   1HB   ASP  19           HBS      ASP  19   5.138   0.482   5.526
  146   2HB   ASP  19           HBR      ASP  19   4.366   1.970   6.148
  147    HA   PRO  20           HA       PRO  20  -0.242   1.026   8.123
  148   1HB   PRO  20           HBS      PRO  20  -0.322   0.816  10.823
  149   2HB   PRO  20           HBR      PRO  20  -0.887  -0.300   9.760
  150   1HG   PRO  20           HGS      PRO  20   1.444  -0.358  11.293
  151   2HG   PRO  20           HGR      PRO  20   0.666  -1.634  10.552
  152   1HD   PRO  20           HDS      PRO  20   2.951  -0.554   9.695
  153   2HD   PRO  20           HDR      PRO  20   1.949  -1.491   8.771
  154    H    GLU  21           HN       GLU  21   2.479   2.476   9.296
  155    HA   GLU  21           HA       GLU  21   1.214   4.740  10.658
  156   1HB   GLU  21           HBR      GLU  21   3.992   4.361   9.521
  157   2HB   GLU  21           HBS      GLU  21   3.463   5.639  10.470
  158   1HG   GLU  21           HGS      GLU  21   2.694   3.486  12.010
  159   2HG   GLU  21           HGR      GLU  21   4.313   2.994  11.443
  160    H    ARG  22           HN       ARG  22   3.103   4.326   7.627
  161    HA   ARG  22           HA       ARG  22   2.028   6.761   6.512
  162   1HB   ARG  22           HBR      ARG  22   3.915   4.616   5.594
  163   2HB   ARG  22           HBS      ARG  22   3.188   5.718   4.389
  164   1HG   ARG  22           HGS      ARG  22   5.201   6.759   4.897
  165   2HG   ARG  22           HGR      ARG  22   4.038   7.609   5.954
  166   1HD   ARG  22           HDS      ARG  22   4.833   6.638   7.850
  167   2HD   ARG  22           HDR      ARG  22   5.415   5.183   6.995
  168    HE   ARG  22           HE       ARG  22   7.200   6.764   6.055
  169   1HH1  ARG  22           HH1Z     ARG  22   5.852   6.918   9.308
  170   2HH1  ARG  22           HH1E     ARG  22   7.179   7.838   9.933
  171   1HH2  ARG  22           HH2Z     ARG  22   8.855   8.077   6.876
  172   2HH2  ARG  22           HH2E     ARG  22   8.880   8.493   8.558
  173    H    GLY  23           HN       GLY  23   1.036   3.474   6.592
  174   1HA   GLY  23           HAR      GLY  23  -0.813   2.410   5.621
  175   2HA   GLY  23           HAS      GLY  23  -1.158   3.883   4.676
  176    H    GLU  24           HN       GLU  24   2.079   2.556   4.843
  177    HA   GLU  24           HA       GLU  24   2.176   2.372   1.907
  178   1HB   GLU  24           HBR      GLU  24   3.964   3.346   3.339
  179   2HB   GLU  24           HBS      GLU  24   4.097   1.879   4.141
  180   1HG   GLU  24           HGR      GLU  24   5.096   0.676   2.330
  181   2HG   GLU  24           HGS      GLU  24   4.505   1.911   1.186
  182    H    ILE  25           HN       ILE  25   3.029   0.433   0.894
  183    HA   ILE  25           HA       ILE  25   2.900  -2.058   2.451
  184    HB   ILE  25           HB       ILE  25   1.465  -1.902  -0.234
  185   1HG1  ILE  25           HG1R     ILE  25  -0.622  -2.143   1.428
  186   2HG1  ILE  25           HG1S     ILE  25   0.464  -1.218   2.504
  187   1HG2  ILE  25           HMG2     ILE  25   1.913  -3.996   1.816
  188   2HG2  ILE  25           HMG2     ILE  25   0.308  -3.950   1.038
  189   3HG2  ILE  25           HMG2     ILE  25   1.777  -4.115   0.042
  190   1HD1  ILE  25           HMD1     ILE  25   0.711   0.438   0.587
  191   2HD1  ILE  25           HMD1     ILE  25  -0.656  -0.410  -0.185
  192   3HD1  ILE  25           HMD1     ILE  25  -0.876   0.380   1.398
  193    H    VAL  26           HN       VAL  26   4.775  -2.969   2.175
  194    HA   VAL  26           HA       VAL  26   6.307  -2.297  -0.277
  195    HB   VAL  26           HB       VAL  26   7.494  -3.111   2.369
  196   1HG1  VAL  26           HMGR     VAL  26   8.576  -1.596  -0.015
  197   2HG1  VAL  26           HMGR     VAL  26   9.424  -1.764   1.541
  198   3HG1  VAL  26           HMGR     VAL  26   9.054  -3.209   0.568
  199   1HG2  VAL  26           HMGS     VAL  26   6.272  -0.512   1.638
  200   2HG2  VAL  26           HMGS     VAL  26   6.508  -1.275   3.229
  201   3HG2  VAL  26           HMGS     VAL  26   7.867  -0.452   2.426
  202    H    CYS  27           HN       CYS  27   8.065  -3.876  -0.792
  203    HA   CYS  27           HA       CYS  27   7.008  -6.606  -0.676
  204   1HB   CYS  27           HBS      CYS  27   7.702  -5.441  -2.793
  205   2HB   CYS  27           HBR      CYS  27   9.390  -5.564  -2.223
  206    H    ALA  28           HN       ALA  28   7.924  -8.303   0.272
  207    HA   ALA  28           HA       ALA  28  10.326  -7.867   1.926
  208   1HB   ALA  28           HMBA     ALA  28   8.190  -8.926   2.775
  209   2HB   ALA  28           HMBB     ALA  28   8.592 -10.336   1.762
  210   3HB   ALA  28           HMBC     ALA  28   9.696  -9.832   3.068
  211    H    LYS  29           HN       LYS  29  10.189  -8.239  -1.127
  212    HA   LYS  29           HA       LYS  29  11.887 -10.679  -1.372
  213   1HB   LYS  29           HBS      LYS  29   9.190 -10.260  -2.216
  214   2HB   LYS  29           HBR      LYS  29  10.223 -10.343  -3.670
  215   1HG   LYS  29           HGR      LYS  29  10.434 -12.413  -1.474
  216   2HG   LYS  29           HGS      LYS  29   9.190 -12.535  -2.751
  217   1HD   LYS  29           HDS      LYS  29  10.812 -13.782  -3.700
  218   2HD   LYS  29           HDR      LYS  29  11.153 -12.213  -4.376
  219   1HE   LYS  29           HES      LYS  29  12.676 -12.116  -2.125
  220   2HE   LYS  29           HER      LYS  29  12.741 -13.850  -2.550
  221   1HZ   LYS  29           HZB      LYS  29  13.063 -12.240  -4.826
  222   2HZ   LYS  29           HZC      LYS  29  14.165 -11.824  -3.695
  223   3HZ   LYS  29           HZA      LYS  29  14.070 -13.370  -4.212
  224    H    CYS  30           HN       CYS  30  10.966  -7.501  -2.593
  225    HA   CYS  30           HA       CYS  30  13.762  -7.379  -3.590
  226   1HB   CYS  30           HBS      CYS  30  13.147  -5.847  -5.362
  227   2HB   CYS  30           HBR      CYS  30  12.394  -7.453  -5.552
  228    H    GLY  31           HN       GLY  31  11.549  -6.308  -1.382
  229   1HA   GLY  31           HAR      GLY  31  11.766  -4.674   0.215
  230   2HA   GLY  31           HAS      GLY  31  13.128  -3.995  -0.718
  231    H    TYR  32           HN       TYR  32  10.617  -4.263  -2.853
  232    HA   TYR  32           HA       TYR  32  10.654  -1.357  -3.168
  233   1HB   TYR  32           HBS      TYR  32  10.653  -2.727  -5.162
  234   2HB   TYR  32           HBR      TYR  32   9.170  -3.572  -4.636
  235    HD1  TYR  32           HD1      TYR  32  10.267   0.000  -5.181
  236    HD2  TYR  32           HD2      TYR  32   7.301  -2.979  -5.824
  237    HE1  TYR  32           HE1      TYR  32   8.977   1.587  -6.544
  238    HE2  TYR  32           HE2      TYR  32   6.011  -1.409  -7.200
  239    HH   TYR  32           HH       TYR  32   6.840   0.640  -8.794
  240    H    VAL  33           HN       VAL  33   9.165   0.045  -2.542
  241    HA   VAL  33           HA       VAL  33   6.667  -0.832  -1.255
  242    HB   VAL  33           HB       VAL  33   7.669   1.931  -1.986
  243   1HG1  VAL  33           HMGR     VAL  33   5.216   1.820  -1.955
  244   2HG1  VAL  33           HMGR     VAL  33   5.272   1.169  -0.299
  245   3HG1  VAL  33           HMGR     VAL  33   5.865   2.815  -0.629
  246   1HG2  VAL  33           HMGS     VAL  33   8.914   0.653  -0.175
  247   2HG2  VAL  33           HMGS     VAL  33   8.268   2.253   0.261
  248   3HG2  VAL  33           HMGS     VAL  33   7.423   0.778   0.790
  249    H    ILE  34           HN       ILE  34   4.633  -0.488  -2.119
  250    HA   ILE  34           HA       ILE  34   4.513   0.309  -4.983
  251    HB   ILE  34           HB       ILE  34   2.710  -1.378  -3.198
  252   1HG1  ILE  34           HG1R     ILE  34   3.496  -2.344  -5.873
  253   2HG1  ILE  34           HG1S     ILE  34   4.871  -1.982  -4.793
  254   1HG2  ILE  34           HMG2     ILE  34   1.896   0.196  -5.521
  255   2HG2  ILE  34           HMG2     ILE  34   1.553  -1.545  -5.690
  256   3HG2  ILE  34           HMG2     ILE  34   0.919  -0.644  -4.288
  257   1HD1  ILE  34           HMD1     ILE  34   3.141  -3.397  -3.161
  258   2HD1  ILE  34           HMD1     ILE  34   2.975  -4.208  -4.741
  259   3HD1  ILE  34           HMD1     ILE  34   4.584  -4.044  -3.987
  260    H    GLU  35           HN       GLU  35   2.205   0.475  -2.266
  261    HA   GLU  35           HA       GLU  35   1.574   3.256  -3.136
  262   1HB   GLU  35           HBR      GLU  35  -0.009   1.341  -3.507
  263   2HB   GLU  35           HBS      GLU  35  -0.008   1.069  -1.851
  264   1HG   GLU  35           HGS      GLU  35  -0.884   3.313  -1.363
  265   2HG   GLU  35           HGR      GLU  35  -1.110   3.625  -3.104
  266    H    GLU  36           HN       GLU  36   0.438   4.534  -1.401
  267    HA   GLU  36           HA       GLU  36   1.379   4.003   1.317
  268   1HB   GLU  36           HBS      GLU  36   2.290   6.256   1.496
  269   2HB   GLU  36           HBR      GLU  36   3.268   5.171   0.670
  270   1HG   GLU  36           HGS      GLU  36   1.646   6.377  -1.309
  271   2HG   GLU  36           HGR      GLU  36   2.064   7.735  -0.230
  272    H    ASN  37           HN       ASN  37  -1.134   3.821   0.346
  273    HA   ASN  37           HA       ASN  37  -2.481   5.806   1.953
  274   1HB   ASN  37           HBR      ASN  37  -2.119   6.723  -0.499
  275   2HB   ASN  37           HBS      ASN  37  -3.585   5.745  -0.801
  276   1HD2  ASN  37           HD2Z     ASN  37  -4.230   9.367   0.363
  277   2HD2  ASN  37           HD2E     ASN  37  -2.993   8.747  -0.680
  278    H    ILE  38           HN       ILE  38  -4.710   5.326   2.302
  279    HA   ILE  38           HA       ILE  38  -5.516   2.593   1.439
  280    HB   ILE  38           HB       ILE  38  -4.948   2.760   3.913
  281   1HG1  ILE  38           HG1R     ILE  38  -7.186   1.643   4.587
  282   2HG1  ILE  38           HG1S     ILE  38  -7.683   1.951   2.899
  283   1HG2  ILE  38           HMG2     ILE  38  -6.939   4.909   3.776
  284   2HG2  ILE  38           HMG2     ILE  38  -7.215   3.734   5.089
  285   3HG2  ILE  38           HMG2     ILE  38  -5.655   4.592   4.972
  286   1HD1  ILE  38           HMD1     ILE  38  -5.320   0.760   2.440
  287   2HD1  ILE  38           HMD1     ILE  38  -5.730  -0.001   4.001
  288   3HD1  ILE  38           HMD1     ILE  38  -6.850  -0.140   2.620
  289    H    ILE  39           HN       ILE  39  -7.519   2.379   0.628
  290    HA   ILE  39           HA       ILE  39  -8.517   4.598  -0.746
  291    HB   ILE  39           HB       ILE  39 -10.420   3.095  -1.376
  292   1HG1  ILE  39           HG1R     ILE  39  -9.150   1.103   0.543
  293   2HG1  ILE  39           HG1S     ILE  39 -10.632   2.046   0.874
  294   1HG2  ILE  39           HMG2     ILE  39  -8.098   2.972  -2.425
  295   2HG2  ILE  39           HMG2     ILE  39  -7.879   1.479  -1.475
  296   3HG2  ILE  39           HMG2     ILE  39  -9.192   1.587  -2.677
  297   1HD1  ILE  39           HMD1     ILE  39 -11.497   0.945  -1.331
  298   2HD1  ILE  39           HMD1     ILE  39 -10.201  -0.243  -1.025
  299   3HD1  ILE  39           HMD1     ILE  39 -11.486   0.010   0.187
  300    H    ASP  40           HN       ASP  40 -10.147   5.996  -0.482
  301    HA   ASP  40           HA       ASP  40 -12.168   5.813   1.435
  302   1HB   ASP  40           HBS      ASP  40  -9.730   6.554   2.640
  303   2HB   ASP  40           HBR      ASP  40 -10.768   8.009   2.596
  304    H    MET  41           HN       MET  41 -13.494   6.504  -0.080
  305    HA   MET  41           HA       MET  41 -13.243   9.385  -0.782
  306   1HB   MET  41           HBR      MET  41 -13.193   7.931  -2.787
  307   2HB   MET  41           HBS      MET  41 -14.772   7.254  -2.309
  308   1HG   MET  41           HGS      MET  41 -15.369   8.945  -3.850
  309   2HG   MET  41           HGR      MET  41 -15.598   9.710  -2.261
  310   1HE   MET  41           HMEC     MET  41 -14.957  10.489  -5.371
  311   2HE   MET  41           HMEA     MET  41 -13.590  11.620  -5.532
  312   3HE   MET  41           HMEB     MET  41 -13.312   9.864  -5.648
  313    H    GLY  42           HN       GLY  42 -14.794  10.694  -0.109
  314   1HA   GLY  42           HAR      GLY  42 -17.349  10.842   0.110
  315   2HA   GLY  42           HAS      GLY  42 -17.156   9.518   1.292
  316    HA   PRO  43           HA       PRO  43 -16.041  11.602   4.689
  317   1HB   PRO  43           HBR      PRO  43 -13.259  11.758   4.816
  318   2HB   PRO  43           HBS      PRO  43 -14.259  10.810   5.707
  319   1HG   PRO  43           HGS      PRO  43 -12.697  10.054   3.596
  320   2HG   PRO  43           HGR      PRO  43 -13.652   9.077   4.552
  321   1HD   PRO  43           HDS      PRO  43 -14.140   9.680   1.980
  322   2HD   PRO  43           HDR      PRO  43 -15.232   9.013   3.027
  323    H    GLU  44           HN       GLU  44 -13.124  13.052   3.572
  324    HA   GLU  44           HA       GLU  44 -14.113  15.539   4.720
  325   1HB   GLU  44           HBR      GLU  44 -11.779  16.180   4.521
  326   2HB   GLU  44           HBS      GLU  44 -12.044  14.735   5.331
  327   1HG   GLU  44           HGS      GLU  44 -11.309  13.329   3.616
  328   2HG   GLU  44           HGR      GLU  44 -11.250  14.631   2.397
  329    H    TRP  45           HN       TRP  45 -15.522  16.511   3.351
  330    HA   TRP  45           HA       TRP  45 -16.094  18.080   1.805
  331   1HB   TRP  45           HBR      TRP  45 -13.263  18.632   1.101
  332   2HB   TRP  45           HBS      TRP  45 -14.606  19.739   1.502
  333    HD1  TRP  45           HD1      TRP  45 -15.136  18.362   4.458
  334    HE1  TRP  45           HE1      TRP  45 -13.438  18.730   6.351
  335    HE3  TRP  45           HE3      TRP  45 -11.163  19.805   1.626
  336    HZ2  TRP  45           HZ2      TRP  45 -10.753  19.506   6.578
  337    HZ3  TRP  45           HZ3      TRP  45  -9.061  20.370   2.754
  338    HH2  TRP  45           HH2      TRP  45  -8.842  20.202   5.176
  339    H    ARG  46           HN       ARG  46 -17.091  17.290   0.129
  340    HA   ARG  46           HA       ARG  46 -15.694  17.520  -2.336
  341   1HB   ARG  46           HBR      ARG  46 -16.444  14.744  -1.461
  342   2HB   ARG  46           HBS      ARG  46 -16.593  15.209  -3.181
  343   1HG   ARG  46           HGS      ARG  46 -14.044  16.084  -2.412
  344   2HG   ARG  46           HGR      ARG  46 -14.236  14.484  -1.641
  345   1HD   ARG  46           HDS      ARG  46 -14.608  13.421  -3.680
  346   2HD   ARG  46           HDR      ARG  46 -14.936  14.960  -4.523
  347    HE   ARG  46           HE       ARG  46 -12.429  13.716  -4.323
  348   1HH1  ARG  46           HH1Z     ARG  46 -13.890  16.913  -4.059
  349   2HH1  ARG  46           HH1E     ARG  46 -12.385  17.739  -4.286
  350   1HH2  ARG  46           HH2Z     ARG  46 -10.460  14.829  -4.481
  351   2HH2  ARG  46           HH2E     ARG  46 -10.443  16.560  -4.522
  352    H    ALA  47           HN       ALA  47 -18.473  15.408  -1.664
  353    HA   ALA  47           HA       ALA  47 -20.714  15.607  -2.085
  354   1HB   ALA  47           HMBC     ALA  47 -19.833  18.318  -1.193
  355   2HB   ALA  47           HMBB     ALA  47 -21.482  18.125  -1.839
  356   3HB   ALA  47           HMBA     ALA  47 -20.956  17.159  -0.437
  357    H    PHE  48           HN       PHE  48 -22.386  16.994  -3.395
  358    HA   PHE  48           HA       PHE  48 -21.260  18.414  -5.661
  359   1HB   PHE  48           HBR      PHE  48 -22.867  17.177  -7.281
  360   2HB   PHE  48           HBS      PHE  48 -21.286  16.432  -6.903
  361    HD1  PHE  48           HD2      PHE  48 -24.968  16.132  -6.342
  362    HD2  PHE  48           HD1      PHE  48 -21.096  14.504  -5.623
  363    HE1  PHE  48           HE2      PHE  48 -26.002  14.001  -5.632
  364    HE2  PHE  48           HE1      PHE  48 -22.097  12.378  -4.918
  365    HZ   PHE  48           HZ       PHE  48 -24.548  12.102  -4.984
  366    H    ASP  49           HN       ASP  49 -22.249  20.103  -4.511
  367    HA   ASP  49           HA       ASP  49 -24.978  20.690  -5.100
  368   1HB   ASP  49           HBR      ASP  49 -26.043  20.408  -3.033
  369   2HB   ASP  49           HBS      ASP  49 -25.274  18.852  -3.458
  370    H    ALA  50           HN       ALA  50 -22.405  21.186  -2.678
  371    HA   ALA  50           HA       ALA  50 -23.268  23.895  -2.185
  372   1HB   ALA  50           HMBB     ALA  50 -21.351  21.967  -1.080
  373   2HB   ALA  50           HMBC     ALA  50 -20.792  23.658  -1.031
  374   3HB   ALA  50           HMBA     ALA  50 -22.342  23.209  -0.274
   
  No H/Q in entry =         374
  Start of MODEL    4
    1   1H    MET   1           HNC      MET   1  -5.632 -23.095  -0.794
    2   2H    MET   1           HN       MET   1  -4.576 -22.987   0.449
    3   3H    MET   1           HNB      MET   1  -6.165 -22.707   0.700
    4    HA   MET   1           HA       MET   1  -6.187 -20.691  -0.232
    5   1HB   MET   1           HBS      MET   1  -4.144 -21.257   1.617
    6   2HB   MET   1           HBR      MET   1  -3.386 -20.237   0.369
    7   1HG   MET   1           HGS      MET   1  -4.262 -18.651   1.884
    8   2HG   MET   1           HGR      MET   1  -5.482 -18.729   0.593
    9   1HE   MET   1           HMEA     MET   1  -4.366 -19.728   4.075
   10   2HE   MET   1           HMEC     MET   1  -5.756 -20.540   4.837
   11   3HE   MET   1           HMEB     MET   1  -4.779 -21.402   3.622
   12    H    VAL   2           HN       VAL   2  -6.468 -20.929  -2.427
   13    HA   VAL   2           HA       VAL   2  -4.008 -20.409  -3.989
   14    HB   VAL   2           HB       VAL   2  -6.315 -22.135  -4.917
   15   1HG1  VAL   2           HMGS     VAL   2  -3.978 -20.928  -6.328
   16   2HG1  VAL   2           HMGS     VAL   2  -4.524 -22.554  -6.807
   17   3HG1  VAL   2           HMGS     VAL   2  -5.652 -21.178  -6.877
   18   1HG2  VAL   2           HMGR     VAL   2  -3.767 -22.802  -3.626
   19   2HG2  VAL   2           HMGR     VAL   2  -5.245 -23.773  -3.841
   20   3HG2  VAL   2           HMGR     VAL   2  -4.051 -23.664  -5.156
   21    H    ASN   3           HN       ASN   3  -4.883 -18.279  -3.152
   22    HA   ASN   3           HA       ASN   3  -6.407 -16.938  -5.210
   23   1HB   ASN   3           HBS      ASN   3  -8.229 -18.063  -4.132
   24   2HB   ASN   3           HBR      ASN   3  -7.723 -17.430  -2.539
   25   1HD2  ASN   3           HD2Z     ASN   3  -9.643 -14.562  -2.827
   26   2HD2  ASN   3           HD2E     ASN   3  -8.877 -15.762  -1.838
   27    H    LYS   4           HN       LYS   4  -4.990 -15.389  -5.443
   28    HA   LYS   4           HA       LYS   4  -5.027 -13.330  -3.396
   29   1HB   LYS   4           HBR      LYS   4  -2.945 -14.844  -2.968
   30   2HB   LYS   4           HBS      LYS   4  -2.288 -14.038  -4.421
   31   1HG   LYS   4           HGR      LYS   4  -1.464 -12.667  -2.756
   32   2HG   LYS   4           HGS      LYS   4  -3.000 -11.840  -3.137
   33   1HD   LYS   4           HDS      LYS   4  -3.981 -13.346  -1.263
   34   2HD   LYS   4           HDR      LYS   4  -2.319 -13.570  -0.794
   35   1HE   LYS   4           HES      LYS   4  -3.494 -10.825  -1.150
   36   2HE   LYS   4           HER      LYS   4  -3.595 -11.744   0.379
   37   1HZ   LYS   4           HZB      LYS   4  -1.025 -11.942  -0.206
   38   2HZ   LYS   4           HZC      LYS   4  -1.334 -10.467  -0.835
   39   3HZ   LYS   4           HZA      LYS   4  -1.649 -10.765   0.740
   40    H    GLN   5           HN       GLN   5  -4.378 -11.290  -4.217
   41    HA   GLN   5           HA       GLN   5  -3.870 -11.089  -7.078
   42   1HB   GLN   5           HBR      GLN   5  -6.550 -10.802  -6.140
   43   2HB   GLN   5           HBS      GLN   5  -5.939  -9.198  -6.637
   44   1HG   GLN   5           HGS      GLN   5  -5.514 -11.579  -8.415
   45   2HG   GLN   5           HGR      GLN   5  -7.111 -10.782  -8.365
   46   1HE2  GLN   5           HE2Z     GLN   5  -5.138  -9.334 -11.131
   47   2HE2  GLN   5           HE2E     GLN   5  -5.676 -10.918 -10.685
   48    H    LYS   6           HN       LYS   6  -2.668 -10.502  -4.410
   49    HA   LYS   6           HA       LYS   6  -1.908  -7.709  -5.113
   50   1HB   LYS   6           HBR      LYS   6  -2.837  -8.645  -2.575
   51   2HB   LYS   6           HBS      LYS   6  -1.089  -8.292  -2.445
   52   1HG   LYS   6           HGR      LYS   6  -2.444  -6.332  -1.844
   53   2HG   LYS   6           HGS      LYS   6  -1.475  -6.024  -3.314
   54   1HD   LYS   6           HDS      LYS   6  -3.283  -6.021  -4.707
   55   2HD   LYS   6           HDR      LYS   6  -4.227  -7.053  -3.669
   56   1HE   LYS   6           HES      LYS   6  -5.152  -4.813  -3.724
   57   2HE   LYS   6           HER      LYS   6  -4.581  -5.256  -2.090
   58   1HZ   LYS   6           HZB      LYS   6  -2.559  -4.021  -2.587
   59   2HZ   LYS   6           HZC      LYS   6  -3.171  -3.551  -4.026
   60   3HZ   LYS   6           HZA      LYS   6  -3.882  -3.064  -2.639
   61    H    VAL   7           HN       VAL   7   0.082  -7.595  -5.823
   62    HA   VAL   7           HA       VAL   7   2.064  -9.664  -5.069
   63    HB   VAL   7           HB       VAL   7   2.544 -10.154  -7.362
   64   1HG1  VAL   7           HMGR     VAL   7   0.403 -11.120  -6.043
   65   2HG1  VAL   7           HMGR     VAL   7  -0.397 -10.482  -7.499
   66   3HG1  VAL   7           HMGR     VAL   7   0.910 -11.680  -7.655
   67   1HG2  VAL   7           HMGS     VAL   7   1.677  -7.769  -8.088
   68   2HG2  VAL   7           HMGS     VAL   7   1.708  -9.141  -9.221
   69   3HG2  VAL   7           HMGS     VAL   7   0.183  -8.676  -8.429
   70    H    CYS   8           HN       CYS   8   4.230  -9.166  -5.974
   71    HA   CYS   8           HA       CYS   8   4.797  -6.270  -6.188
   72   1HB   CYS   8           HBS      CYS   8   6.267  -7.812  -4.830
   73   2HB   CYS   8           HBR      CYS   8   6.740  -8.571  -6.377
   74    HA   PRO   9           HA       PRO   9   4.643  -6.636 -10.603
   75   1HB   PRO   9           HBR      PRO   9   4.962  -3.967 -10.897
   76   2HB   PRO   9           HBS      PRO   9   3.539  -4.781 -10.981
   77   1HG   PRO   9           HGS      PRO   9   4.487  -3.170  -8.920
   78   2HG   PRO   9           HGR      PRO   9   2.920  -3.662  -9.214
   79   1HD   PRO   9           HDS      PRO   9   4.495  -4.629  -7.271
   80   2HD   PRO   9           HDR      PRO   9   3.108  -5.348  -7.813
   81    H    ALA  10           HN       ALA  10   7.052  -6.014  -8.530
   82    HA   ALA  10           HA       ALA  10   9.025  -5.294 -10.629
   83   1HB   ALA  10           HMBA     ALA  10   8.744  -4.537  -7.955
   84   2HB   ALA  10           HMBB     ALA  10  10.106  -5.688  -7.969
   85   3HB   ALA  10           HMBC     ALA  10  10.140  -4.254  -9.026
   86    H    CYS  11           HN       CYS  11   9.231  -7.410  -7.758
   87    HA   CYS  11           HA       CYS  11  11.104  -9.025  -9.263
   88   1HB   CYS  11           HBS      CYS  11  11.631 -10.093  -7.171
   89   2HB   CYS  11           HBR      CYS  11  11.654  -8.314  -7.042
   90    H    GLU  12           HN       GLU  12   7.816  -9.184  -9.016
   91    HA   GLU  12           HA       GLU  12   6.178 -10.743  -9.096
   92   1HB   GLU  12           HBS      GLU  12   6.455 -12.485 -10.483
   93   2HB   GLU  12           HBR      GLU  12   7.416 -11.292 -11.157
   94   1HG   GLU  12           HGS      GLU  12   9.409 -12.461 -10.697
   95   2HG   GLU  12           HGR      GLU  12   8.723 -13.375  -9.327
   96    H    SER  13           HN       SER  13   7.219 -10.381  -6.669
   97    HA   SER  13           HA       SER  13   7.035 -13.118  -5.512
   98   1HB   SER  13           HBS      SER  13   7.932 -10.511  -4.270
   99   2HB   SER  13           HBR      SER  13   7.525 -11.970  -3.324
  100    HG   SER  13           HG       SER  13   9.142 -13.123  -4.126
  101    H    ALA  14           HN       ALA  14   5.356 -13.594  -4.152
  102    HA   ALA  14           HA       ALA  14   2.990 -11.943  -4.515
  103   1HB   ALA  14           HMBA     ALA  14   3.482 -14.674  -3.290
  104   2HB   ALA  14           HMBC     ALA  14   1.874 -13.922  -3.435
  105   3HB   ALA  14           HMBB     ALA  14   2.808 -14.316  -4.901
  106    H    GLU  15           HN       GLU  15   5.377 -12.110  -2.201
  107    HA   GLU  15           HA       GLU  15   3.594 -11.768   0.162
  108   1HB   GLU  15           HBR      GLU  15   6.603 -11.949  -0.106
  109   2HB   GLU  15           HBS      GLU  15   5.749 -11.720   1.321
  110   1HG   GLU  15           HGS      GLU  15   6.505 -14.119   0.764
  111   2HG   GLU  15           HGR      GLU  15   4.891 -13.900   1.493
  112    H    LEU  16           HN       LEU  16   2.812  -9.781   0.246
  113    HA   LEU  16           HA       LEU  16   4.802  -7.563   0.271
  114   1HB   LEU  16           HBR      LEU  16   1.856  -7.284  -0.356
  115   2HB   LEU  16           HBS      LEU  16   3.162  -6.082  -0.561
  116    HG   LEU  16           HG       LEU  16   2.782  -8.611  -2.187
  117   1HD1  LEU  16           HMDR     LEU  16   1.678  -5.950  -2.392
  118   2HD1  LEU  16           HMDR     LEU  16   2.751  -6.280  -3.774
  119   3HD1  LEU  16           HMDR     LEU  16   1.394  -7.377  -3.420
  120   1HD2  LEU  16           HMDS     LEU  16   5.130  -7.968  -1.837
  121   2HD2  LEU  16           HMDS     LEU  16   4.623  -7.709  -3.525
  122   3HD2  LEU  16           HMDS     LEU  16   4.764  -6.322  -2.415
  123    H    ILE  17           HN       ILE  17   4.062  -5.754   1.706
  124    HA   ILE  17           HA       ILE  17   2.771  -6.763   4.178
  125    HB   ILE  17           HB       ILE  17   4.855  -5.788   5.398
  126   1HG1  ILE  17           HG1R     ILE  17   6.061  -6.278   2.646
  127   2HG1  ILE  17           HG1S     ILE  17   5.810  -4.689   3.423
  128   1HG2  ILE  17           HMG2     ILE  17   5.124  -8.381   3.861
  129   2HG2  ILE  17           HMG2     ILE  17   6.082  -7.907   5.289
  130   3HG2  ILE  17           HMG2     ILE  17   4.323  -8.154   5.438
  131   1HD1  ILE  17           HMD1     ILE  17   7.355  -5.454   5.259
  132   2HD1  ILE  17           HMD1     ILE  17   7.722  -6.883   4.256
  133   3HD1  ILE  17           HMD1     ILE  17   8.114  -5.249   3.657
  134    H    TYR  18           HN       TYR  18   1.600  -5.295   5.163
  135    HA   TYR  18           HA       TYR  18   1.474  -2.546   4.198
  136   1HB   TYR  18           HBS      TYR  18  -0.465  -4.008   5.106
  137   2HB   TYR  18           HBR      TYR  18   0.172  -3.583   6.720
  138    HD1  TYR  18           HD1      TYR  18  -1.401  -2.210   3.643
  139    HD2  TYR  18           HD2      TYR  18  -0.119  -1.377   7.612
  140    HE1  TYR  18           HE1      TYR  18  -2.679  -0.112   3.609
  141    HE2  TYR  18           HE2      TYR  18  -1.414   0.706   7.602
  142    HH   TYR  18           HH       TYR  18  -3.867   1.211   6.039
  143    H    ASP  19           HN       ASP  19   1.505  -0.774   5.869
  144    HA   ASP  19           HA       ASP  19   3.672  -1.033   7.822
  145   1HB   ASP  19           HBS      ASP  19   4.442  -0.594   5.272
  146   2HB   ASP  19           HBR      ASP  19   4.188   1.082   5.838
  147    HA   PRO  20           HA       PRO  20   0.370   1.583   9.194
  148   1HB   PRO  20           HBR      PRO  20   1.156   1.059  11.812
  149   2HB   PRO  20           HBS      PRO  20  -0.241   0.617  11.070
  150   1HG   PRO  20           HGS      PRO  20   1.712  -1.045  11.759
  151   2HG   PRO  20           HGR      PRO  20   0.480  -1.410  10.693
  152   1HD   PRO  20           HDS      PRO  20   3.173  -0.842  10.125
  153   2HD   PRO  20           HDR      PRO  20   2.056  -1.597   9.167
  154    H    GLU  21           HN       GLU  21   3.613   1.996   9.451
  155    HA   GLU  21           HA       GLU  21   3.576   4.316  11.258
  156   1HB   GLU  21           HBR      GLU  21   5.567   2.679   9.749
  157   2HB   GLU  21           HBS      GLU  21   5.945   4.290  10.027
  158   1HG   GLU  21           HGS      GLU  21   6.726   3.833  12.015
  159   2HG   GLU  21           HGR      GLU  21   5.065   3.515  12.584
  160    H    ARG  22           HN       ARG  22   3.942   3.573   7.789
  161    HA   ARG  22           HA       ARG  22   3.806   6.467   7.190
  162   1HB   ARG  22           HBR      ARG  22   4.745   4.043   5.651
  163   2HB   ARG  22           HBS      ARG  22   4.413   5.606   4.850
  164   1HG   ARG  22           HGS      ARG  22   6.098   6.017   7.158
  165   2HG   ARG  22           HGR      ARG  22   6.801   4.758   6.103
  166   1HD   ARG  22           HDS      ARG  22   7.571   7.009   5.535
  167   2HD   ARG  22           HDR      ARG  22   6.675   6.227   4.203
  168    HE   ARG  22           HE       ARG  22   4.836   7.758   5.680
  169   1HH1  ARG  22           HH1Z     ARG  22   7.833   8.421   3.945
  170   2HH1  ARG  22           HH1E     ARG  22   7.267   9.938   3.327
  171   1HH2  ARG  22           HH2Z     ARG  22   4.084   9.683   4.748
  172   2HH2  ARG  22           HH2E     ARG  22   5.147  10.653   3.782
  173    H    GLY  23           HN       GLY  23   1.940   3.580   7.088
  174   1HA   GLY  23           HAR      GLY  23  -0.238   3.190   6.319
  175   2HA   GLY  23           HAS      GLY  23  -0.274   4.827   5.611
  176    H    GLU  24           HN       GLU  24   2.072   2.153   5.230
  177    HA   GLU  24           HA       GLU  24   1.781   2.459   2.279
  178   1HB   GLU  24           HBR      GLU  24   3.819   3.286   3.410
  179   2HB   GLU  24           HBS      GLU  24   4.023   1.785   4.132
  180   1HG   GLU  24           HGS      GLU  24   4.784   0.672   2.324
  181   2HG   GLU  24           HGR      GLU  24   3.962   1.708   1.126
  182    H    ILE  25           HN       ILE  25   2.461   0.550   1.020
  183    HA   ILE  25           HA       ILE  25   2.473  -2.013   2.495
  184    HB   ILE  25           HB       ILE  25   1.004  -1.723  -0.162
  185   1HG1  ILE  25           HG1R     ILE  25  -1.042  -2.113   1.549
  186   2HG1  ILE  25           HG1S     ILE  25   0.055  -1.199   2.623
  187   1HG2  ILE  25           HMG2     ILE  25   1.580  -3.941   1.693
  188   2HG2  ILE  25           HMG2     ILE  25  -0.095  -3.864   1.082
  189   3HG2  ILE  25           HMG2     ILE  25   1.270  -3.944  -0.064
  190   1HD1  ILE  25           HMD1     ILE  25   0.085   0.240   0.241
  191   2HD1  ILE  25           HMD1     ILE  25  -1.615  -0.272   0.425
  192   3HD1  ILE  25           HMD1     ILE  25  -0.813   0.648   1.727
  193    H    VAL  26           HN       VAL  26   4.353  -2.897   2.162
  194    HA   VAL  26           HA       VAL  26   5.891  -2.049  -0.239
  195    HB   VAL  26           HB       VAL  26   7.083  -3.047   2.343
  196   1HG1  VAL  26           HMGR     VAL  26   8.189  -1.476   0.008
  197   2HG1  VAL  26           HMGR     VAL  26   9.046  -1.701   1.552
  198   3HG1  VAL  26           HMGR     VAL  26   8.638  -3.112   0.547
  199   1HG2  VAL  26           HMGS     VAL  26   6.250  -0.234   1.646
  200   2HG2  VAL  26           HMGS     VAL  26   5.876  -1.185   3.102
  201   3HG2  VAL  26           HMGS     VAL  26   7.531  -0.591   2.830
  202    H    CYS  27           HN       CYS  27   7.611  -3.625  -0.866
  203    HA   CYS  27           HA       CYS  27   6.610  -6.364  -1.096
  204   1HB   CYS  27           HBS      CYS  27   7.919  -5.161  -2.876
  205   2HB   CYS  27           HBR      CYS  27   9.342  -5.282  -1.803
  206    H    ALA  28           HN       ALA  28   7.685  -8.172  -0.227
  207    HA   ALA  28           HA       ALA  28   9.325  -7.607   2.200
  208   1HB   ALA  28           HMBA     ALA  28   7.024  -9.127   1.988
  209   2HB   ALA  28           HMBC     ALA  28   8.332 -10.334   1.908
  210   3HB   ALA  28           HMBB     ALA  28   8.240  -9.211   3.288
  211    H    LYS  29           HN       LYS  29  10.094  -7.676  -0.683
  212    HA   LYS  29           HA       LYS  29  12.060  -9.898  -0.556
  213   1HB   LYS  29           HBR      LYS  29   9.896  -9.898  -2.330
  214   2HB   LYS  29           HBS      LYS  29  11.275  -9.292  -3.290
  215   1HG   LYS  29           HGR      LYS  29  11.079 -11.920  -1.776
  216   2HG   LYS  29           HGS      LYS  29  11.176 -11.682  -3.543
  217   1HD   LYS  29           HDS      LYS  29  13.394 -11.313  -3.545
  218   2HD   LYS  29           HDR      LYS  29  13.376 -10.512  -1.998
  219   1HE   LYS  29           HES      LYS  29  13.223 -13.490  -2.442
  220   2HE   LYS  29           HER      LYS  29  14.622 -12.551  -1.847
  221   1HZ   LYS  29           HZA      LYS  29  12.845 -11.823  -0.105
  222   2HZ   LYS  29           HZB      LYS  29  12.175 -13.266  -0.477
  223   3HZ   LYS  29           HZC      LYS  29  13.707 -13.197   0.088
  224    H    CYS  30           HN       CYS  30  11.310  -7.504  -3.088
  225    HA   CYS  30           HA       CYS  30  14.155  -7.241  -3.292
  226   1HB   CYS  30           HBR      CYS  30  13.764  -6.280  -5.475
  227   2HB   CYS  30           HBS      CYS  30  12.793  -7.753  -5.230
  228    H    GLY  31           HN       GLY  31  11.886  -5.375  -1.737
  229   1HA   GLY  31           HAR      GLY  31  11.878  -3.325  -0.765
  230   2HA   GLY  31           HAS      GLY  31  13.465  -2.897  -1.418
  231    H    TYR  32           HN       TYR  32  10.152  -3.289  -1.909
  232    HA   TYR  32           HA       TYR  32  10.131  -1.025  -3.689
  233   1HB   TYR  32           HBS      TYR  32  10.382  -2.687  -5.433
  234   2HB   TYR  32           HBR      TYR  32   9.032  -3.648  -4.767
  235    HD1  TYR  32           HD2      TYR  32   9.630  -0.107  -5.859
  236    HD2  TYR  32           HD1      TYR  32   7.045  -3.481  -5.980
  237    HE1  TYR  32           HE2      TYR  32   8.061   1.156  -7.262
  238    HE2  TYR  32           HE1      TYR  32   5.479  -2.239  -7.410
  239    HH   TYR  32           HH       TYR  32   5.628   1.185  -7.524
  240    H    VAL  33           HN       VAL  33   8.554   0.221  -3.038
  241    HA   VAL  33           HA       VAL  33   6.289  -0.833  -1.502
  242    HB   VAL  33           HB       VAL  33   6.913   1.975  -2.446
  243   1HG1  VAL  33           HMGR     VAL  33   4.727   0.934  -0.635
  244   2HG1  VAL  33           HMGR     VAL  33   5.220   2.643  -0.715
  245   3HG1  VAL  33           HMGR     VAL  33   4.559   1.839  -2.159
  246   1HG2  VAL  33           HMGS     VAL  33   8.553   1.183  -0.839
  247   2HG2  VAL  33           HMGS     VAL  33   7.502   2.420  -0.109
  248   3HG2  VAL  33           HMGS     VAL  33   7.255   0.701   0.279
  249    H    ILE  34           HN       ILE  34   4.094  -0.374  -2.132
  250    HA   ILE  34           HA       ILE  34   3.698   0.063  -5.050
  251    HB   ILE  34           HB       ILE  34   2.359  -1.851  -3.104
  252   1HG1  ILE  34           HG1R     ILE  34   3.052  -2.558  -5.920
  253   2HG1  ILE  34           HG1S     ILE  34   4.402  -2.192  -4.809
  254   1HG2  ILE  34           HMG2     ILE  34   1.113  -0.667  -5.560
  255   2HG2  ILE  34           HMG2     ILE  34   0.800  -2.368  -5.127
  256   3HG2  ILE  34           HMG2     ILE  34   0.390  -1.066  -3.980
  257   1HD1  ILE  34           HMD1     ILE  34   2.677  -3.920  -3.399
  258   2HD1  ILE  34           HMD1     ILE  34   2.822  -4.594  -5.045
  259   3HD1  ILE  34           HMD1     ILE  34   4.287  -4.288  -4.074
  260    H    GLU  35           HN       GLU  35   1.637   0.017  -2.131
  261    HA   GLU  35           HA       GLU  35   0.162   2.275  -3.319
  262   1HB   GLU  35           HBR      GLU  35  -0.331  -0.028  -1.503
  263   2HB   GLU  35           HBS      GLU  35  -1.190   1.373  -1.162
  264   1HG   GLU  35           HGS      GLU  35  -1.192   0.188  -3.916
  265   2HG   GLU  35           HGR      GLU  35  -2.469  -0.205  -2.732
  266    H    GLU  36           HN       GLU  36  -0.237   4.173  -2.327
  267    HA   GLU  36           HA       GLU  36   1.296   4.722   0.180
  268   1HB   GLU  36           HBR      GLU  36   0.617   6.854  -1.791
  269   2HB   GLU  36           HBS      GLU  36   1.790   6.801  -0.591
  270   1HG   GLU  36           HGS      GLU  36   2.779   4.780  -1.976
  271   2HG   GLU  36           HGR      GLU  36   2.030   5.634  -3.353
  272    H    ASN  37           HN       ASN  37   0.121   5.427   1.813
  273    HA   ASN  37           HA       ASN  37  -1.478   6.434   3.043
  274   1HB   ASN  37           HBS      ASN  37  -1.171   8.013   0.752
  275   2HB   ASN  37           HBR      ASN  37  -2.930   7.899   1.049
  276   1HD2  ASN  37           HD2Z     ASN  37  -2.930   9.843   3.972
  277   2HD2  ASN  37           HD2E     ASN  37  -3.806   8.723   2.982
  278    H    ILE  38           HN       ILE  38  -3.684   6.398   3.631
  279    HA   ILE  38           HA       ILE  38  -5.302   4.397   2.136
  280    HB   ILE  38           HB       ILE  38  -4.818   3.997   4.603
  281   1HG1  ILE  38           HG1R     ILE  38  -7.734   4.163   4.615
  282   2HG1  ILE  38           HG1S     ILE  38  -7.108   3.614   3.034
  283   1HG2  ILE  38           HMG2     ILE  38  -4.967   6.272   5.438
  284   2HG2  ILE  38           HMG2     ILE  38  -6.693   6.340   4.994
  285   3HG2  ILE  38           HMG2     ILE  38  -6.144   5.215   6.264
  286   1HD1  ILE  38           HMD1     ILE  38  -5.898   2.312   5.398
  287   2HD1  ILE  38           HMD1     ILE  38  -7.629   1.977   5.134
  288   3HD1  ILE  38           HMD1     ILE  38  -6.446   1.619   3.849
  289    H    ILE  39           HN       ILE  39  -6.600   5.266   0.719
  290    HA   ILE  39           HA       ILE  39  -7.063   8.111   0.717
  291    HB   ILE  39           HB       ILE  39  -7.974   5.877  -1.160
  292   1HG1  ILE  39           HG1R     ILE  39  -6.151   7.090  -2.613
  293   2HG1  ILE  39           HG1S     ILE  39  -5.580   7.704  -1.035
  294   1HG2  ILE  39           HMG2     ILE  39  -8.318   8.855  -1.341
  295   2HG2  ILE  39           HMG2     ILE  39  -8.190   7.849  -2.808
  296   3HG2  ILE  39           HMG2     ILE  39  -9.501   7.554  -1.635
  297   1HD1  ILE  39           HMD1     ILE  39  -6.054   4.762  -1.380
  298   2HD1  ILE  39           HMD1     ILE  39  -4.583   5.505  -2.066
  299   3HD1  ILE  39           HMD1     ILE  39  -4.908   5.622  -0.317
  300    H    ASP  40           HN       ASP  40  -8.958   9.231   0.843
  301    HA   ASP  40           HA       ASP  40 -11.458   7.788   1.137
  302   1HB   ASP  40           HBR      ASP  40 -12.058   9.336   3.142
  303   2HB   ASP  40           HBS      ASP  40 -11.233   7.768   3.378
  304    H    MET  41           HN       MET  41 -10.945  11.102   2.185
  305    HA   MET  41           HA       MET  41 -12.766  11.956   0.013
  306   1HB   MET  41           HBS      MET  41 -11.862  13.313   2.569
  307   2HB   MET  41           HBR      MET  41 -12.873  14.089   1.323
  308   1HG   MET  41           HGS      MET  41 -13.650  11.416   2.563
  309   2HG   MET  41           HGR      MET  41 -14.041  12.955   3.365
  310   1HE   MET  41           HMEA     MET  41 -15.434  10.351   1.571
  311   2HE   MET  41           HMEB     MET  41 -16.593  11.252   2.580
  312   3HE   MET  41           HMEC     MET  41 -16.898  11.051   0.836
  313    H    GLY  42           HN       GLY  42 -12.228  13.439  -1.487
  314   1HA   GLY  42           HAR      GLY  42  -9.607  13.299  -2.475
  315   2HA   GLY  42           HAS      GLY  42 -10.848  14.453  -3.036
  316    HA   PRO  43           HA       PRO  43  -7.848  16.292   0.376
  317   1HB   PRO  43           HBS      PRO  43  -5.351  15.620  -0.474
  318   2HB   PRO  43           HBR      PRO  43  -6.045  15.167   0.942
  319   1HG   PRO  43           HGS      PRO  43  -5.452  13.583  -1.172
  320   2HG   PRO  43           HGR      PRO  43  -6.263  13.120   0.210
  321   1HD   PRO  43           HDS      PRO  43  -7.318  13.647  -2.329
  322   2HD   PRO  43           HDR      PRO  43  -8.039  12.869  -1.060
  323    H    GLU  44           HN       GLU  44  -8.221  18.285  -0.113
  324    HA   GLU  44           HA       GLU  44  -6.304  19.453  -1.998
  325   1HB   GLU  44           HBR      GLU  44  -8.120  20.830  -3.021
  326   2HB   GLU  44           HBS      GLU  44  -7.964  19.227  -3.492
  327   1HG   GLU  44           HGS      GLU  44 -10.125  18.951  -3.218
  328   2HG   GLU  44           HGR      GLU  44  -9.821  18.879  -1.461
  329    H    TRP  45           HN       TRP  45  -9.262  20.298  -0.138
  330    HA   TRP  45           HA       TRP  45  -8.031  21.836   1.830
  331   1HB   TRP  45           HBR      TRP  45  -7.973  23.169  -0.690
  332   2HB   TRP  45           HBS      TRP  45  -9.110  24.024   0.393
  333    HD1  TRP  45           HD1      TRP  45  -5.385  23.326  -0.094
  334    HE1  TRP  45           HE1      TRP  45  -4.026  24.748   1.559
  335    HE3  TRP  45           HE3      TRP  45  -9.245  25.148   2.674
  336    HZ2  TRP  45           HZ2      TRP  45  -4.560  26.471   3.706
  337    HZ3  TRP  45           HZ3      TRP  45  -8.748  26.699   4.505
  338    HH2  TRP  45           HH2      TRP  45  -6.455  27.347   5.024
  339    H    ARG  46           HN       ARG  46 -10.150  20.020   1.482
  340    HA   ARG  46           HA       ARG  46 -12.090  21.558   3.041
  341   1HB   ARG  46           HBR      ARG  46 -12.714  20.706   0.370
  342   2HB   ARG  46           HBS      ARG  46 -13.670  19.744   1.535
  343   1HG   ARG  46           HGS      ARG  46 -15.106  21.432   1.698
  344   2HG   ARG  46           HGR      ARG  46 -13.807  22.437   2.402
  345   1HD   ARG  46           HDS      ARG  46 -14.125  23.751   0.645
  346   2HD   ARG  46           HDR      ARG  46 -13.217  22.509  -0.262
  347    HE   ARG  46           HE       ARG  46 -16.101  23.021  -0.364
  348   1HH1  ARG  46           HH1Z     ARG  46 -13.349  21.075  -1.401
  349   2HH1  ARG  46           HH1E     ARG  46 -14.274  20.191  -2.567
  350   1HH2  ARG  46           HH2Z     ARG  46 -17.305  21.756  -1.809
  351   2HH2  ARG  46           HH2E     ARG  46 -16.513  20.577  -2.801
  352    H    ALA  47           HN       ALA  47 -12.210  20.534   4.879
  353    HA   ALA  47           HA       ALA  47 -11.699  17.596   4.919
  354   1HB   ALA  47           HMBC     ALA  47 -10.149  19.644   5.934
  355   2HB   ALA  47           HMBB     ALA  47 -11.069  19.083   7.353
  356   3HB   ALA  47           HMBA     ALA  47 -10.088  17.930   6.415
  357    H    PHE  48           HN       PHE  48 -13.253  20.304   6.665
  358    HA   PHE  48           HA       PHE  48 -14.843  18.331   8.190
  359   1HB   PHE  48           HBR      PHE  48 -13.394  20.308   9.239
  360   2HB   PHE  48           HBS      PHE  48 -14.866  21.257   8.882
  361    HD1  PHE  48           HD1      PHE  48 -14.196  17.812  10.041
  362    HD2  PHE  48           HD2      PHE  48 -16.226  21.473  10.841
  363    HE1  PHE  48           HE1      PHE  48 -15.145  16.817  12.074
  364    HE2  PHE  48           HE2      PHE  48 -17.194  20.493  12.895
  365    HZ   PHE  48           HZ       PHE  48 -16.595  18.175  13.536
  366    H    ASP  49           HN       ASP  49 -16.735  17.877   7.374
  367    HA   ASP  49           HA       ASP  49 -18.324  20.059   6.150
  368   1HB   ASP  49           HBS      ASP  49 -17.599  17.386   5.010
  369   2HB   ASP  49           HBR      ASP  49 -19.098  18.229   4.524
  370    H    ALA  50           HN       ALA  50 -18.725  16.598   6.972
  371    HA   ALA  50           HA       ALA  50 -21.499  16.782   7.250
  372   1HB   ALA  50           HMBB     ALA  50 -19.471  14.809   8.303
  373   2HB   ALA  50           HMBA     ALA  50 -21.226  14.607   8.538
  374   3HB   ALA  50           HMBC     ALA  50 -20.548  14.664   6.891
   
  No H/Q in entry =         374
  Start of MODEL    5
    1   1H    MET   1           HN       MET   1  -8.363  -3.981  -8.451
    2   2H    MET   1           HNC      MET   1  -7.228  -4.274  -7.313
    3   3H    MET   1           HNB      MET   1  -8.813  -4.437  -6.948
    4    HA   MET   1           HA       MET   1  -9.173  -2.321  -6.601
    5   1HB   MET   1           HBR      MET   1  -6.468  -3.081  -5.932
    6   2HB   MET   1           HBS      MET   1  -6.543  -1.342  -6.333
    7   1HG   MET   1           HGS      MET   1  -8.276  -0.971  -4.677
    8   2HG   MET   1           HGR      MET   1  -8.451  -2.723  -4.410
    9   1HE   MET   1           HMEA     MET   1  -6.694  -4.225  -3.550
   10   2HE   MET   1           HMEC     MET   1  -5.609  -3.751  -2.219
   11   3HE   MET   1           HMEB     MET   1  -7.370  -3.531  -2.055
   12    H    VAL   2           HN       VAL   2  -7.543  -0.054  -7.094
   13    HA   VAL   2           HA       VAL   2  -8.488   0.396  -9.811
   14    HB   VAL   2           HB       VAL   2  -7.361   2.377  -7.822
   15   1HG1  VAL   2           HMGR     VAL   2  -8.538   2.625 -10.499
   16   2HG1  VAL   2           HMGR     VAL   2  -9.285   3.682  -9.277
   17   3HG1  VAL   2           HMGR     VAL   2  -7.532   3.760  -9.568
   18   1HG2  VAL   2           HMGS     VAL   2 -10.010   1.042  -7.953
   19   2HG2  VAL   2           HMGS     VAL   2  -9.098   1.671  -6.561
   20   3HG2  VAL   2           HMGS     VAL   2  -9.994   2.790  -7.617
   21    H    ASN   3           HN       ASN   3  -5.468   1.159  -8.037
   22    HA   ASN   3           HA       ASN   3  -4.235   2.267 -10.269
   23   1HB   ASN   3           HBR      ASN   3  -3.500   1.667  -7.535
   24   2HB   ASN   3           HBS      ASN   3  -2.125   1.476  -8.660
   25   1HD2  ASN   3           HD2Z     ASN   3  -3.832   5.170  -7.976
   26   2HD2  ASN   3           HD2E     ASN   3  -4.571   3.713  -7.402
   27    H    LYS   4           HN       LYS   4  -2.336  -0.299  -8.879
   28    HA   LYS   4           HA       LYS   4  -2.161  -1.526 -11.593
   29   1HB   LYS   4           HBR      LYS   4  -0.133  -0.121  -9.966
   30   2HB   LYS   4           HBS      LYS   4   0.384  -1.703 -10.618
   31   1HG   LYS   4           HGR      LYS   4  -0.466  -0.850 -12.891
   32   2HG   LYS   4           HGS      LYS   4  -0.514   0.766 -12.131
   33   1HD   LYS   4           HDS      LYS   4   1.905   0.390 -11.487
   34   2HD   LYS   4           HDR      LYS   4   1.875  -1.014 -12.518
   35   1HE   LYS   4           HES      LYS   4   2.186   0.189 -14.342
   36   2HE   LYS   4           HER      LYS   4   0.797   1.235 -13.933
   37   1HZ   LYS   4           HZC      LYS   4   2.504   2.216 -12.285
   38   2HZ   LYS   4           HZA      LYS   4   3.611   1.599 -13.314
   39   3HZ   LYS   4           HZB      LYS   4   2.515   2.685 -13.849
   40    H    GLN   5           HN       GLN   5  -3.466  -3.234 -10.756
   41    HA   GLN   5           HA       GLN   5  -3.696  -5.396 -10.053
   42   1HB   GLN   5           HBR      GLN   5  -0.692  -5.538 -10.238
   43   2HB   GLN   5           HBS      GLN   5  -1.914  -6.785 -10.614
   44   1HG   GLN   5           HGS      GLN   5  -2.100  -6.100 -12.721
   45   2HG   GLN   5           HGR      GLN   5  -2.277  -4.392 -12.225
   46   1HE2  GLN   5           HE2Z     GLN   5   0.683  -3.736 -13.888
   47   2HE2  GLN   5           HE2E     GLN   5  -1.037  -3.547 -13.826
   48    H    LYS   6           HN       LYS   6  -2.130  -7.154  -8.677
   49    HA   LYS   6           HA       LYS   6  -1.713  -5.880  -6.008
   50   1HB   LYS   6           HBR      LYS   6  -2.147  -8.040  -4.986
   51   2HB   LYS   6           HBS      LYS   6  -3.564  -7.472  -5.914
   52   1HG   LYS   6           HGR      LYS   6  -3.026  -9.009  -7.734
   53   2HG   LYS   6           HGS      LYS   6  -1.547  -9.537  -6.881
   54   1HD   LYS   6           HDS      LYS   6  -4.414 -10.016  -6.089
   55   2HD   LYS   6           HDR      LYS   6  -3.232 -11.180  -6.619
   56   1HE   LYS   6           HES      LYS   6  -1.845 -10.581  -4.598
   57   2HE   LYS   6           HER      LYS   6  -3.268  -9.661  -4.032
   58   1HZ   LYS   6           HZA      LYS   6  -3.564 -12.446  -4.830
   59   2HZ   LYS   6           HZB      LYS   6  -2.978 -12.092  -3.347
   60   3HZ   LYS   6           HZC      LYS   6  -4.462 -11.569  -3.785
   61    H    VAL   7           HN       VAL   7  -0.365  -7.881  -4.788
   62    HA   VAL   7           HA       VAL   7   1.706  -8.776  -4.493
   63    HB   VAL   7           HB       VAL   7   2.475 -10.268  -6.149
   64   1HG1  VAL   7           HMGR     VAL   7  -0.179 -10.267  -5.228
   65   2HG1  VAL   7           HMGR     VAL   7  -0.250 -10.789  -6.928
   66   3HG1  VAL   7           HMGR     VAL   7   0.793 -11.655  -5.773
   67   1HG2  VAL   7           HMGS     VAL   7   2.095  -8.486  -8.047
   68   2HG2  VAL   7           HMGS     VAL   7   2.118 -10.229  -8.403
   69   3HG2  VAL   7           HMGS     VAL   7   0.565  -9.370  -8.265
   70    H    CYS   8           HN       CYS   8   3.970  -8.987  -5.951
   71    HA   CYS   8           HA       CYS   8   4.769  -6.179  -6.437
   72   1HB   CYS   8           HBS      CYS   8   6.085  -7.768  -4.914
   73   2HB   CYS   8           HBR      CYS   8   6.568  -8.600  -6.417
   74    HA   PRO   9           HA       PRO   9   4.526  -6.842 -10.818
   75   1HB   PRO   9           HBR      PRO   9   4.877  -4.049 -10.795
   76   2HB   PRO   9           HBS      PRO   9   3.706  -4.926 -11.542
   77   1HG   PRO   9           HGS      PRO   9   3.336  -3.462  -9.369
   78   2HG   PRO   9           HGR      PRO   9   2.303  -4.665  -9.886
   79   1HD   PRO   9           HDS      PRO   9   4.030  -4.704  -7.696
   80   2HD   PRO   9           HDR      PRO   9   2.821  -5.771  -8.062
   81    H    ALA  10           HN       ALA  10   6.866  -5.890  -8.696
   82    HA   ALA  10           HA       ALA  10   8.808  -5.183 -10.755
   83   1HB   ALA  10           HMBC     ALA  10   8.419  -4.349  -8.212
   84   2HB   ALA  10           HMBB     ALA  10   9.709  -5.551  -7.962
   85   3HB   ALA  10           HMBA     ALA  10   9.958  -4.203  -9.100
   86    H    CYS  11           HN       CYS  11   8.907  -7.527  -8.029
   87    HA   CYS  11           HA       CYS  11  10.892  -9.003  -9.587
   88   1HB   CYS  11           HBS      CYS  11  11.510 -10.090  -7.539
   89   2HB   CYS  11           HBR      CYS  11  11.457  -8.319  -7.344
   90    H    GLU  12           HN       GLU  12   7.611  -9.224  -9.225
   91    HA   GLU  12           HA       GLU  12   6.000 -10.847  -9.266
   92   1HB   GLU  12           HBR      GLU  12   8.034 -12.847 -10.179
   93   2HB   GLU  12           HBS      GLU  12   6.386 -12.756 -10.473
   94   1HG   GLU  12           HGS      GLU  12   7.626 -10.354 -11.461
   95   2HG   GLU  12           HGR      GLU  12   8.356 -11.777 -12.254
   96    H    SER  13           HN       SER  13   6.848 -10.315  -6.874
   97    HA   SER  13           HA       SER  13   6.699 -13.014  -5.635
   98   1HB   SER  13           HBS      SER  13   7.812 -10.468  -4.442
   99   2HB   SER  13           HBR      SER  13   7.333 -11.887  -3.471
  100    HG   SER  13           HG       SER  13   8.807 -13.184  -4.393
  101    H    ALA  14           HN       ALA  14   5.314 -12.974  -3.647
  102    HA   ALA  14           HA       ALA  14   3.114 -10.991  -3.858
  103   1HB   ALA  14           HMBB     ALA  14   2.894 -13.469  -4.830
  104   2HB   ALA  14           HMBA     ALA  14   2.540 -13.828  -3.122
  105   3HB   ALA  14           HMBC     ALA  14   1.539 -12.652  -4.010
  106    H    GLU  15           HN       GLU  15   5.413 -12.408  -1.913
  107    HA   GLU  15           HA       GLU  15   4.009 -12.192   0.663
  108   1HB   GLU  15           HBR      GLU  15   6.973 -12.121   0.168
  109   2HB   GLU  15           HBS      GLU  15   6.132 -12.514   1.566
  110   1HG   GLU  15           HGS      GLU  15   6.890 -14.578   0.763
  111   2HG   GLU  15           HGR      GLU  15   5.129 -14.584   0.472
  112    H    LEU  16           HN       LEU  16   3.083 -10.091   0.119
  113    HA   LEU  16           HA       LEU  16   4.975  -7.805   0.113
  114   1HB   LEU  16           HBR      LEU  16   1.966  -7.977  -0.234
  115   2HB   LEU  16           HBS      LEU  16   2.939  -6.479  -0.291
  116    HG   LEU  16           HG       LEU  16   3.040  -8.791  -2.247
  117   1HD1  LEU  16           HMDR     LEU  16   1.588  -6.238  -2.108
  118   2HD1  LEU  16           HMDR     LEU  16   2.516  -6.459  -3.613
  119   3HD1  LEU  16           HMDR     LEU  16   1.303  -7.671  -3.128
  120   1HD2  LEU  16           HMDS     LEU  16   5.232  -7.692  -1.741
  121   2HD2  LEU  16           HMDS     LEU  16   4.687  -7.487  -3.425
  122   3HD2  LEU  16           HMDS     LEU  16   4.523  -6.144  -2.266
  123    H    ILE  17           HN       ILE  17   3.876  -5.935   1.522
  124    HA   ILE  17           HA       ILE  17   2.991  -6.938   4.109
  125    HB   ILE  17           HB       ILE  17   4.846  -5.524   5.271
  126   1HG1  ILE  17           HG1R     ILE  17   6.081  -5.960   2.531
  127   2HG1  ILE  17           HG1S     ILE  17   5.770  -4.413   3.370
  128   1HG2  ILE  17           HMG2     ILE  17   4.578  -8.114   5.122
  129   2HG2  ILE  17           HMG2     ILE  17   6.011  -8.007   4.066
  130   3HG2  ILE  17           HMG2     ILE  17   6.090  -7.399   5.741
  131   1HD1  ILE  17           HMD1     ILE  17   7.413  -5.476   5.164
  132   2HD1  ILE  17           HMD1     ILE  17   7.975  -6.394   3.741
  133   3HD1  ILE  17           HMD1     ILE  17   8.017  -4.610   3.726
  134    H    TYR  18           HN       TYR  18   2.972  -4.862   5.647
  135    HA   TYR  18           HA       TYR  18   2.136  -2.495   4.135
  136   1HB   TYR  18           HBR      TYR  18   0.037  -3.709   4.277
  137   2HB   TYR  18           HBS      TYR  18   0.251  -3.939   6.036
  138    HD1  TYR  18           HD1      TYR  18   0.801  -0.821   4.024
  139    HD2  TYR  18           HD2      TYR  18  -1.514  -2.772   7.011
  140    HE1  TYR  18           HE1      TYR  18  -0.408   1.276   4.448
  141    HE2  TYR  18           HE2      TYR  18  -2.711  -0.678   7.462
  142    HH   TYR  18           HH       TYR  18  -1.577   2.090   7.001
  143    H    ASP  19           HN       ASP  19   2.349  -0.624   5.275
  144    HA   ASP  19           HA       ASP  19   3.876  -0.944   7.800
  145   1HB   ASP  19           HBS      ASP  19   5.030  -0.335   5.506
  146   2HB   ASP  19           HBR      ASP  19   4.469   1.304   5.944
  147    HA   PRO  20           HA       PRO  20   0.226   1.307   8.874
  148   1HB   PRO  20           HBR      PRO  20   0.508   0.818  11.532
  149   2HB   PRO  20           HBS      PRO  20  -0.471   0.003  10.497
  150   1HG   PRO  20           HGS      PRO  20   1.961  -0.814  11.573
  151   2HG   PRO  20           HGR      PRO  20   0.770  -1.749  10.873
  152   1HD   PRO  20           HDS      PRO  20   3.102  -1.168   9.717
  153   2HD   PRO  20           HDR      PRO  20   1.755  -1.683   8.905
  154    H    GLU  21           HN       GLU  21   3.353   1.992   9.630
  155    HA   GLU  21           HA       GLU  21   2.809   4.214  11.452
  156   1HB   GLU  21           HBR      GLU  21   5.397   3.601  10.055
  157   2HB   GLU  21           HBS      GLU  21   5.122   4.434  11.486
  158   1HG   GLU  21           HGS      GLU  21   4.935   2.671  12.832
  159   2HG   GLU  21           HGR      GLU  21   4.130   1.627  11.629
  160    H    ARG  22           HN       ARG  22   3.714   3.700   8.056
  161    HA   ARG  22           HA       ARG  22   3.365   6.607   7.569
  162   1HB   ARG  22           HBR      ARG  22   4.497   4.581   5.633
  163   2HB   ARG  22           HBS      ARG  22   4.672   6.360   5.635
  164   1HG   ARG  22           HGS      ARG  22   6.316   6.335   7.250
  165   2HG   ARG  22           HGR      ARG  22   5.764   4.784   7.944
  166   1HD   ARG  22           HDS      ARG  22   6.537   3.662   5.869
  167   2HD   ARG  22           HDR      ARG  22   7.226   5.223   5.341
  168    HE   ARG  22           HE       ARG  22   8.443   3.385   7.110
  169   1HH1  ARG  22           HH1Z     ARG  22   8.016   6.843   6.574
  170   2HH1  ARG  22           HH1E     ARG  22   9.352   7.276   7.589
  171   1HH2  ARG  22           HH2Z     ARG  22  10.101   3.995   8.530
  172   2HH2  ARG  22           HH2E     ARG  22  10.534   5.664   8.694
  173    H    GLY  23           HN       GLY  23   1.894   3.541   7.108
  174   1HA   GLY  23           HAR      GLY  23  -0.058   2.910   5.996
  175   2HA   GLY  23           HAS      GLY  23  -0.244   4.579   5.397
  176    H    GLU  24           HN       GLU  24   2.356   2.116   5.155
  177    HA   GLU  24           HA       GLU  24   2.356   2.523   2.192
  178   1HB   GLU  24           HBR      GLU  24   4.136   3.612   3.609
  179   2HB   GLU  24           HBS      GLU  24   4.551   2.087   4.173
  180   1HG   GLU  24           HGS      GLU  24   5.221   1.247   2.040
  181   2HG   GLU  24           HGR      GLU  24   4.765   2.757   1.204
  182    H    ILE  25           HN       ILE  25   2.118   0.775   1.018
  183    HA   ILE  25           HA       ILE  25   2.590  -1.902   2.233
  184    HB   ILE  25           HB       ILE  25   1.207  -1.300  -0.420
  185   1HG1  ILE  25           HG1R     ILE  25  -0.901  -1.874   1.117
  186   2HG1  ILE  25           HG1S     ILE  25   0.153  -1.183   2.384
  187   1HG2  ILE  25           HMG2     ILE  25   2.131  -3.659   0.401
  188   2HG2  ILE  25           HMG2     ILE  25   0.550  -3.684   1.228
  189   3HG2  ILE  25           HMG2     ILE  25   0.628  -3.484  -0.542
  190   1HD1  ILE  25           HMD1     ILE  25   0.126   0.494   0.018
  191   2HD1  ILE  25           HMD1     ILE  25  -1.525   0.205   0.629
  192   3HD1  ILE  25           HMD1     ILE  25  -0.282   0.891   1.709
  193    H    VAL  26           HN       VAL  26   4.408  -2.862   1.797
  194    HA   VAL  26           HA       VAL  26   5.923  -2.038  -0.628
  195    HB   VAL  26           HB       VAL  26   7.146  -2.834   2.009
  196   1HG1  VAL  26           HMGR     VAL  26   8.213  -1.363  -0.410
  197   2HG1  VAL  26           HMGR     VAL  26   9.075  -1.500   1.143
  198   3HG1  VAL  26           HMGR     VAL  26   8.696  -2.964   0.202
  199   1HG2  VAL  26           HMGS     VAL  26   6.279  -0.080   1.127
  200   2HG2  VAL  26           HMGS     VAL  26   5.845  -0.958   2.613
  201   3HG2  VAL  26           HMGS     VAL  26   7.507  -0.364   2.384
  202    H    CYS  27           HN       CYS  27   7.705  -3.630  -1.145
  203    HA   CYS  27           HA       CYS  27   6.740  -6.367  -1.077
  204   1HB   CYS  27           HBS      CYS  27   7.906  -5.257  -3.010
  205   2HB   CYS  27           HBR      CYS  27   9.416  -5.360  -2.061
  206    H    ALA  28           HN       ALA  28   7.481  -8.056   0.052
  207    HA   ALA  28           HA       ALA  28   9.525  -7.561   2.156
  208   1HB   ALA  28           HMBB     ALA  28   7.101  -8.835   2.309
  209   2HB   ALA  28           HMBA     ALA  28   8.230 -10.192   2.060
  210   3HB   ALA  28           HMBC     ALA  28   8.474  -9.067   3.420
  211    H    LYS  29           HN       LYS  29  10.000  -7.775  -0.760
  212    HA   LYS  29           HA       LYS  29  11.988  -9.971  -0.586
  213   1HB   LYS  29           HBR      LYS  29   9.868 -10.091  -2.358
  214   2HB   LYS  29           HBS      LYS  29  11.166  -9.338  -3.329
  215   1HG   LYS  29           HGR      LYS  29  11.217 -12.023  -1.907
  216   2HG   LYS  29           HGS      LYS  29  11.293 -11.707  -3.665
  217   1HD   LYS  29           HDS      LYS  29  13.463 -10.832  -3.543
  218   2HD   LYS  29           HDR      LYS  29  13.381 -10.636  -1.814
  219   1HE   LYS  29           HES      LYS  29  14.743 -12.478  -2.029
  220   2HE   LYS  29           HER      LYS  29  13.134 -13.189  -1.711
  221   1HZ   LYS  29           HZB      LYS  29  14.308 -12.840  -4.383
  222   2HZ   LYS  29           HZC      LYS  29  14.310 -14.241  -3.544
  223   3HZ   LYS  29           HZA      LYS  29  12.897 -13.584  -4.032
  224    H    CYS  30           HN       CYS  30  11.178  -7.526  -3.061
  225    HA   CYS  30           HA       CYS  30  13.966  -6.870  -3.179
  226   1HB   CYS  30           HBS      CYS  30  13.387  -5.559  -5.143
  227   2HB   CYS  30           HBR      CYS  30  12.708  -7.209  -5.187
  228    H    GLY  31           HN       GLY  31  11.597  -5.638  -1.229
  229   1HA   GLY  31           HAR      GLY  31  11.772  -3.843   0.211
  230   2HA   GLY  31           HAS      GLY  31  13.044  -3.151  -0.835
  231    H    TYR  32           HN       TYR  32  10.524  -3.902  -2.845
  232    HA   TYR  32           HA       TYR  32  10.370  -1.033  -3.449
  233   1HB   TYR  32           HBS      TYR  32  10.655  -2.555  -5.304
  234   2HB   TYR  32           HBR      TYR  32   9.199  -3.476  -4.838
  235    HD1  TYR  32           HD2      TYR  32  10.188   0.035  -5.702
  236    HD2  TYR  32           HD1      TYR  32   7.256  -3.025  -6.055
  237    HE1  TYR  32           HE2      TYR  32   8.914   1.447  -7.253
  238    HE2  TYR  32           HE1      TYR  32   5.954  -1.608  -7.585
  239    HH   TYR  32           HH       TYR  32   7.140   0.501  -9.393
  240    H    VAL  33           HN       VAL  33   8.805   0.278  -2.904
  241    HA   VAL  33           HA       VAL  33   6.543  -0.489  -1.311
  242    HB   VAL  33           HB       VAL  33   7.087   2.025  -2.905
  243   1HG1  VAL  33           HMGR     VAL  33   4.858   1.288  -1.043
  244   2HG1  VAL  33           HMGR     VAL  33   5.445   2.967  -1.101
  245   3HG1  VAL  33           HMGR     VAL  33   4.819   2.192  -2.576
  246   1HG2  VAL  33           HMGS     VAL  33   8.718   1.432  -1.075
  247   2HG2  VAL  33           HMGS     VAL  33   7.908   3.009  -0.920
  248   3HG2  VAL  33           HMGS     VAL  33   7.375   1.634   0.075
  249    H    ILE  34           HN       ILE  34   4.307  -0.189  -1.959
  250    HA   ILE  34           HA       ILE  34   3.815  -0.919  -4.798
  251    HB   ILE  34           HB       ILE  34   2.311  -1.500  -2.206
  252   1HG1  ILE  34           HG1R     ILE  34   4.396  -2.785  -2.797
  253   2HG1  ILE  34           HG1S     ILE  34   2.928  -3.764  -2.517
  254   1HG2  ILE  34           HMG2     ILE  34   1.175  -1.261  -4.798
  255   2HG2  ILE  34           HMG2     ILE  34   1.199  -2.991  -4.364
  256   3HG2  ILE  34           HMG2     ILE  34   0.413  -1.810  -3.281
  257   1HD1  ILE  34           HMD1     ILE  34   3.551  -2.981  -5.326
  258   2HD1  ILE  34           HMD1     ILE  34   4.589  -4.210  -4.555
  259   3HD1  ILE  34           HMD1     ILE  34   2.829  -4.479  -4.680
  260    H    GLU  35           HN       GLU  35   1.737   0.424  -2.241
  261    HA   GLU  35           HA       GLU  35   1.523   2.996  -3.728
  262   1HB   GLU  35           HBS      GLU  35  -0.798   2.888  -3.633
  263   2HB   GLU  35           HBR      GLU  35  -0.246   1.573  -4.518
  264   1HG   GLU  35           HGS      GLU  35  -0.729   0.046  -2.688
  265   2HG   GLU  35           HGR      GLU  35  -1.002   1.379  -1.533
  266    H    GLU  36           HN       GLU  36  -0.053   4.438  -2.349
  267    HA   GLU  36           HA       GLU  36   0.043   3.852   0.532
  268   1HB   GLU  36           HBR      GLU  36   0.842   6.577  -0.439
  269   2HB   GLU  36           HBS      GLU  36   0.893   5.931   1.109
  270   1HG   GLU  36           HGS      GLU  36   2.734   4.600   0.816
  271   2HG   GLU  36           HGR      GLU  36   2.638   4.586  -0.966
  272    H    ASN  37           HN       ASN  37  -2.180   3.434  -0.034
  273    HA   ASN  37           HA       ASN  37  -3.736   5.825  -0.823
  274   1HB   ASN  37           HBR      ASN  37  -3.722   3.267  -1.886
  275   2HB   ASN  37           HBS      ASN  37  -5.220   3.344  -0.914
  276   1HD2  ASN  37           HD2Z     ASN  37  -4.851   6.344  -3.727
  277   2HD2  ASN  37           HD2E     ASN  37  -3.533   5.967  -2.668
  278    H    ILE  38           HN       ILE  38  -2.856   5.832   1.730
  279    HA   ILE  38           HA       ILE  38  -5.493   5.945   3.018
  280    HB   ILE  38           HB       ILE  38  -3.056   4.712   4.397
  281   1HG1  ILE  38           HG1R     ILE  38  -5.673   3.534   3.405
  282   2HG1  ILE  38           HG1S     ILE  38  -4.012   3.129   2.888
  283   1HG2  ILE  38           HMG2     ILE  38  -5.160   6.146   5.557
  284   2HG2  ILE  38           HMG2     ILE  38  -5.542   4.426   5.837
  285   3HG2  ILE  38           HMG2     ILE  38  -3.977   5.091   6.374
  286   1HD1  ILE  38           HMD1     ILE  38  -4.254   2.700   5.718
  287   2HD1  ILE  38           HMD1     ILE  38  -5.589   1.871   4.873
  288   3HD1  ILE  38           HMD1     ILE  38  -3.898   1.528   4.421
  289    H    ILE  39           HN       ILE  39  -5.169   8.131   2.297
  290    HA   ILE  39           HA       ILE  39  -2.932   9.620   2.724
  291    HB   ILE  39           HB       ILE  39  -4.302  11.618   2.310
  292   1HG1  ILE  39           HG1R     ILE  39  -6.106  11.154   3.883
  293   2HG1  ILE  39           HG1S     ILE  39  -6.749  11.552   2.264
  294   1HG2  ILE  39           HMG2     ILE  39  -4.703   9.156   0.717
  295   2HG2  ILE  39           HMG2     ILE  39  -5.801  10.518   0.370
  296   3HG2  ILE  39           HMG2     ILE  39  -4.034  10.743   0.256
  297   1HD1  ILE  39           HMD1     ILE  39  -6.804   8.942   1.976
  298   2HD1  ILE  39           HMD1     ILE  39  -6.794   8.953   3.759
  299   3HD1  ILE  39           HMD1     ILE  39  -8.095   9.789   2.871
  300    H    ASP  40           HN       ASP  40  -1.903  10.475   4.357
  301    HA   ASP  40           HA       ASP  40  -3.373  11.655   6.538
  302   1HB   ASP  40           HBR      ASP  40  -1.512   9.358   7.124
  303   2HB   ASP  40           HBS      ASP  40  -2.024  10.573   8.331
  304    H    MET  41           HN       MET  41  -2.028  12.762   4.458
  305    HA   MET  41           HA       MET  41   0.703  13.355   5.428
  306   1HB   MET  41           HBR      MET  41  -0.114  12.352   3.044
  307   2HB   MET  41           HBS      MET  41  -0.058  14.098   2.668
  308   1HG   MET  41           HGS      MET  41   2.259  14.245   3.311
  309   2HG   MET  41           HGR      MET  41   2.214  12.621   4.041
  310   1HE   MET  41           HMEC     MET  41   1.516  14.658   0.849
  311   2HE   MET  41           HMEA     MET  41   1.673  13.491  -0.489
  312   3HE   MET  41           HMEB     MET  41   0.265  13.413   0.601
  313    H    GLY  42           HN       GLY  42   1.336  15.303   5.976
  314   1HA   GLY  42           HAR      GLY  42  -0.720  17.409   6.096
  315   2HA   GLY  42           HAS      GLY  42   0.799  17.331   7.031
  316    HA   PRO  43           HA       PRO  43   3.115  19.702   4.442
  317   1HB   PRO  43           HBS      PRO  43   4.972  18.210   3.157
  318   2HB   PRO  43           HBR      PRO  43   5.137  18.861   4.656
  319   1HG   PRO  43           HGS      PRO  43   4.643  16.209   3.937
  320   2HG   PRO  43           HGR      PRO  43   5.227  16.794   5.387
  321   1HD   PRO  43           HDS      PRO  43   2.751  15.870   5.018
  322   2HD   PRO  43           HDR      PRO  43   3.214  16.839   6.276
  323    H    GLU  44           HN       GLU  44   1.350  17.565   2.733
  324    HA   GLU  44           HA       GLU  44   1.918  18.668   0.140
  325   1HB   GLU  44           HBS      GLU  44   1.114  16.405   1.000
  326   2HB   GLU  44           HBR      GLU  44  -0.446  17.023   1.051
  327   1HG   GLU  44           HGS      GLU  44  -0.385  16.002  -1.050
  328   2HG   GLU  44           HGR      GLU  44   0.041  17.663  -1.541
  329    H    TRP  45           HN       TRP  45   1.384  20.832   1.657
  330    HA   TRP  45           HA       TRP  45   0.362  22.834   1.381
  331   1HB   TRP  45           HBR      TRP  45  -0.385  21.312  -1.046
  332   2HB   TRP  45           HBS      TRP  45  -1.345  22.774  -0.683
  333    HD1  TRP  45           HD1      TRP  45   0.473  25.011  -0.092
  334    HE1  TRP  45           HE1      TRP  45   2.368  25.807  -1.633
  335    HE3  TRP  45           HE3      TRP  45   1.110  20.728  -2.763
  336    HZ2  TRP  45           HZ2      TRP  45   3.944  24.717  -3.681
  337    HZ3  TRP  45           HZ3      TRP  45   2.837  20.675  -4.501
  338    HH2  TRP  45           HH2      TRP  45   4.234  22.620  -4.957
  339    H    ARG  46           HN       ARG  46  -0.910  23.459   2.925
  340    HA   ARG  46           HA       ARG  46  -3.731  22.682   3.069
  341   1HB   ARG  46           HBR      ARG  46  -1.604  21.495   4.817
  342   2HB   ARG  46           HBS      ARG  46  -3.181  21.926   5.540
  343   1HG   ARG  46           HGS      ARG  46  -2.677  19.993   3.254
  344   2HG   ARG  46           HGR      ARG  46  -3.190  19.590   4.916
  345   1HD   ARG  46           HDS      ARG  46  -4.957  21.545   3.789
  346   2HD   ARG  46           HDR      ARG  46  -4.792  20.156   2.678
  347    HE   ARG  46           HE       ARG  46  -5.594  18.716   4.439
  348   1HH1  ARG  46           HH1Z     ARG  46  -5.579  22.113   5.384
  349   2HH1  ARG  46           HH1E     ARG  46  -6.854  21.910   6.539
  350   1HH2  ARG  46           HH2Z     ARG  46  -7.346  18.516   5.865
  351   2HH2  ARG  46           HH2E     ARG  46  -7.852  19.875   6.813
  352    H    ALA  47           HN       ALA  47  -1.919  25.082   2.914
  353    HA   ALA  47           HA       ALA  47  -1.985  26.264   5.550
  354   1HB   ALA  47           HMBA     ALA  47  -0.919  26.956   2.857
  355   2HB   ALA  47           HMBB     ALA  47  -1.213  28.290   4.000
  356   3HB   ALA  47           HMBC     ALA  47  -0.125  26.953   4.451
  357    H    PHE  48           HN       PHE  48  -3.773  26.659   2.516
  358    HA   PHE  48           HA       PHE  48  -4.805  29.204   3.085
  359   1HB   PHE  48           HBR      PHE  48  -5.055  27.317   0.935
  360   2HB   PHE  48           HBS      PHE  48  -6.693  27.865   1.396
  361    HD1  PHE  48           HD1      PHE  48  -6.777  30.422   1.969
  362    HD2  PHE  48           HD2      PHE  48  -3.925  28.685  -0.677
  363    HE1  PHE  48           HE1      PHE  48  -6.536  32.588   0.841
  364    HE2  PHE  48           HE2      PHE  48  -3.660  30.858  -1.829
  365    HZ   PHE  48           HZ       PHE  48  -5.023  32.794  -1.095
  366    H    ASP  49           HN       ASP  49  -7.043  26.501   2.584
  367    HA   ASP  49           HA       ASP  49  -8.898  25.819   3.650
  368   1HB   ASP  49           HBS      ASP  49  -8.632  25.534   6.168
  369   2HB   ASP  49           HBR      ASP  49  -7.585  24.624   5.043
  370    H    ALA  50           HN       ALA  50  -8.389  27.680   6.530
  371    HA   ALA  50           HA       ALA  50 -10.326  29.722   5.556
  372   1HB   ALA  50           HMBC     ALA  50 -10.128  28.513   8.328
  373   2HB   ALA  50           HMBB     ALA  50 -11.128  29.919   7.881
  374   3HB   ALA  50           HMBA     ALA  50 -11.463  28.323   7.163
   
  No H/Q in entry =         374
  Start of MODEL    6
    1   1H    MET   1           HNB      MET   1  -5.956  -7.986  -1.167
    2   2H    MET   1           HNC      MET   1  -6.276  -7.726   0.413
    3   3H    MET   1           HN       MET   1  -4.760  -7.517  -0.159
    4    HA   MET   1           HA       MET   1  -4.517  -9.798  -0.651
    5   1HB   MET   1           HBS      MET   1  -4.736 -10.668   1.749
    6   2HB   MET   1           HBR      MET   1  -3.692  -9.245   1.470
    7   1HG   MET   1           HGS      MET   1  -5.388  -7.746   2.321
    8   2HG   MET   1           HGR      MET   1  -6.600  -9.050   2.333
    9   1HE   MET   1           HMEB     MET   1  -7.304  -8.971   4.526
   10   2HE   MET   1           HMEA     MET   1  -6.857 -10.694   4.607
   11   3HE   MET   1           HMEC     MET   1  -6.468  -9.609   5.964
   12    H    VAL   2           HN       VAL   2  -6.270 -10.204  -2.159
   13    HA   VAL   2           HA       VAL   2  -8.758 -11.343  -1.114
   14    HB   VAL   2           HB       VAL   2  -8.964 -12.097  -3.547
   15   1HG1  VAL   2           HMGR     VAL   2  -9.087  -9.283  -2.545
   16   2HG1  VAL   2           HMGR     VAL   2  -9.370  -9.596  -4.274
   17   3HG1  VAL   2           HMGR     VAL   2 -10.393 -10.383  -3.047
   18   1HG2  VAL   2           HMGS     VAL   2  -6.464 -11.709  -3.963
   19   2HG2  VAL   2           HMGS     VAL   2  -7.616 -11.184  -5.213
   20   3HG2  VAL   2           HMGS     VAL   2  -6.892  -9.988  -4.112
   21    H    ASN   3           HN       ASN   3  -9.026 -13.619  -2.591
   22    HA   ASN   3           HA       ASN   3  -7.004 -15.420  -1.460
   23   1HB   ASN   3           HBR      ASN   3  -8.502 -17.222  -2.298
   24   2HB   ASN   3           HBS      ASN   3  -9.186 -16.140  -1.050
   25   1HD2  ASN   3           HD2Z     ASN   3 -11.743 -16.772  -3.705
   26   2HD2  ASN   3           HD2E     ASN   3 -10.819 -17.760  -2.623
   27    H    LYS   4           HN       LYS   4  -6.660 -13.493  -3.806
   28    HA   LYS   4           HA       LYS   4  -5.176 -15.519  -5.424
   29   1HB   LYS   4           HBR      LYS   4  -7.040 -13.627  -6.324
   30   2HB   LYS   4           HBS      LYS   4  -5.440 -12.924  -6.699
   31   1HG   LYS   4           HGR      LYS   4  -5.473 -14.177  -8.559
   32   2HG   LYS   4           HGS      LYS   4  -5.190 -15.583  -7.492
   33   1HD   LYS   4           HDS      LYS   4  -7.184 -16.427  -7.873
   34   2HD   LYS   4           HDR      LYS   4  -7.967 -14.917  -7.501
   35   1HE   LYS   4           HES      LYS   4  -6.704 -15.474 -10.177
   36   2HE   LYS   4           HER      LYS   4  -8.413 -15.810  -9.779
   37   1HZ   LYS   4           HZB      LYS   4  -7.659 -13.192  -9.054
   38   2HZ   LYS   4           HZC      LYS   4  -7.389 -13.451 -10.644
   39   3HZ   LYS   4           HZA      LYS   4  -8.879 -13.689 -10.019
   40    H    GLN   5           HN       GLN   5  -5.069 -12.779  -3.357
   41    HA   GLN   5           HA       GLN   5  -3.292 -11.900  -2.229
   42   1HB   GLN   5           HBS      GLN   5  -2.105 -14.283  -3.429
   43   2HB   GLN   5           HBR      GLN   5  -0.944 -12.939  -3.234
   44   1HG   GLN   5           HGS      GLN   5  -1.304 -12.834  -0.899
   45   2HG   GLN   5           HGR      GLN   5  -2.749 -13.879  -1.001
   46   1HE2  GLN   5           HE2Z     GLN   5  -0.964 -16.925  -1.283
   47   2HE2  GLN   5           HE2E     GLN   5  -2.431 -16.106  -1.699
   48    H    LYS   6           HN       LYS   6  -2.788  -9.905  -2.597
   49    HA   LYS   6           HA       LYS   6  -2.138  -8.743  -5.155
   50   1HB   LYS   6           HBS      LYS   6  -2.902  -7.617  -2.908
   51   2HB   LYS   6           HBR      LYS   6  -1.153  -7.623  -2.546
   52   1HG   LYS   6           HGR      LYS   6  -0.813  -5.841  -3.855
   53   2HG   LYS   6           HGS      LYS   6  -1.640  -6.626  -5.231
   54   1HD   LYS   6           HDS      LYS   6  -3.510  -5.713  -3.202
   55   2HD   LYS   6           HDR      LYS   6  -2.480  -4.422  -3.759
   56   1HE   LYS   6           HES      LYS   6  -3.730  -6.196  -5.804
   57   2HE   LYS   6           HER      LYS   6  -4.724  -4.968  -4.967
   58   1HZ   LYS   6           HZC      LYS   6  -3.056  -3.339  -5.645
   59   2HZ   LYS   6           HZA      LYS   6  -2.270  -4.480  -6.509
   60   3HZ   LYS   6           HZB      LYS   6  -3.788  -4.043  -6.924
   61    H    VAL   7           HN       VAL   7  -0.179  -8.281  -6.033
   62    HA   VAL   7           HA       VAL   7   2.021 -10.001  -5.010
   63    HB   VAL   7           HB       VAL   7   2.479 -10.611  -7.287
   64   1HG1  VAL   7           HMGR     VAL   7   0.819 -11.946  -6.057
   65   2HG1  VAL   7           HMGR     VAL   7  -0.484 -10.948  -6.745
   66   3HG1  VAL   7           HMGR     VAL   7   0.526 -11.952  -7.813
   67   1HG2  VAL   7           HMGS     VAL   7   0.723  -8.367  -7.928
   68   2HG2  VAL   7           HMGS     VAL   7   2.006  -9.145  -8.888
   69   3HG2  VAL   7           HMGS     VAL   7   0.366  -9.835  -8.869
   70    H    CYS   8           HN       CYS   8   4.076  -9.500  -6.467
   71    HA   CYS   8           HA       CYS   8   4.492  -6.566  -6.535
   72   1HB   CYS   8           HBS      CYS   8   5.986  -8.101  -5.169
   73   2HB   CYS   8           HBR      CYS   8   6.570  -8.748  -6.729
   74    HA   PRO   9           HA       PRO   9   4.586  -6.711 -10.950
   75   1HB   PRO   9           HBR      PRO   9   4.716  -3.919 -10.750
   76   2HB   PRO   9           HBS      PRO   9   3.589  -4.836 -11.517
   77   1HG   PRO   9           HGS      PRO   9   3.158  -3.505  -9.278
   78   2HG   PRO   9           HGR      PRO   9   2.212  -4.769  -9.818
   79   1HD   PRO   9           HDS      PRO   9   4.075  -4.757  -7.713
   80   2HD   PRO   9           HDR      PRO   9   2.854  -5.836  -7.999
   81    H    ALA  10           HN       ALA  10   6.829  -6.060  -8.719
   82    HA   ALA  10           HA       ALA  10   8.837  -5.010 -10.648
   83   1HB   ALA  10           HMBB     ALA  10   8.393  -4.375  -8.007
   84   2HB   ALA  10           HMBA     ALA  10   9.727  -5.552  -7.912
   85   3HB   ALA  10           HMBC     ALA  10   9.896  -4.094  -8.920
   86    H    CYS  11           HN       CYS  11   9.092  -7.299  -7.920
   87    HA   CYS  11           HA       CYS  11  10.992  -8.762  -9.503
   88   1HB   CYS  11           HBS      CYS  11  11.530  -9.948  -7.473
   89   2HB   CYS  11           HBR      CYS  11  11.467  -8.184  -7.218
   90    H    GLU  12           HN       GLU  12   7.705  -9.074  -9.277
   91    HA   GLU  12           HA       GLU  12   6.142 -10.692  -9.541
   92   1HB   GLU  12           HBS      GLU  12   6.510 -12.258 -11.100
   93   2HB   GLU  12           HBR      GLU  12   7.429 -10.961 -11.629
   94   1HG   GLU  12           HGS      GLU  12   8.871 -12.948  -9.948
   95   2HG   GLU  12           HGR      GLU  12   8.286 -13.629 -11.490
   96    H    SER  13           HN       SER  13   7.141 -10.537  -7.075
   97    HA   SER  13           HA       SER  13   6.489 -13.300  -6.288
   98   1HB   SER  13           HBS      SER  13   8.905 -11.867  -5.412
   99   2HB   SER  13           HBR      SER  13   7.902 -12.556  -4.102
  100    HG   SER  13           HG       SER  13   9.117 -14.206  -4.508
  101    H    ALA  14           HN       ALA  14   5.184 -13.445  -4.481
  102    HA   ALA  14           HA       ALA  14   3.338 -11.243  -4.607
  103   1HB   ALA  14           HMBC     ALA  14   3.289 -14.082  -4.231
  104   2HB   ALA  14           HMBB     ALA  14   2.404 -13.317  -2.887
  105   3HB   ALA  14           HMBA     ALA  14   1.928 -12.982  -4.571
  106    H    GLU  15           HN       GLU  15   5.770 -11.985  -2.460
  107    HA   GLU  15           HA       GLU  15   4.372 -11.687   0.086
  108   1HB   GLU  15           HBR      GLU  15   7.317 -11.355  -0.338
  109   2HB   GLU  15           HBS      GLU  15   6.467 -11.884   1.009
  110   1HG   GLU  15           HGS      GLU  15   7.316 -13.880   0.313
  111   2HG   GLU  15           HGR      GLU  15   5.676 -13.961  -0.385
  112    H    LEU  16           HN       LEU  16   3.420  -9.774   0.367
  113    HA   LEU  16           HA       LEU  16   5.237  -7.410   0.438
  114   1HB   LEU  16           HBR      LEU  16   2.256  -7.278   0.013
  115   2HB   LEU  16           HBS      LEU  16   3.512  -6.060  -0.349
  116    HG   LEU  16           HG       LEU  16   2.970  -8.625  -1.867
  117   1HD1  LEU  16           HMDR     LEU  16   1.444  -6.544  -2.102
  118   2HD1  LEU  16           HMDR     LEU  16   2.847  -5.800  -2.910
  119   3HD1  LEU  16           HMDR     LEU  16   2.118  -7.283  -3.577
  120   1HD2  LEU  16           HMDS     LEU  16   5.398  -7.536  -1.503
  121   2HD2  LEU  16           HMDS     LEU  16   4.890  -8.281  -3.040
  122   3HD2  LEU  16           HMDS     LEU  16   4.825  -6.512  -2.844
  123    H    ILE  17           HN       ILE  17   4.357  -5.697   1.944
  124    HA   ILE  17           HA       ILE  17   3.115  -6.760   4.389
  125    HB   ILE  17           HB       ILE  17   5.212  -5.958   5.690
  126   1HG1  ILE  17           HG1R     ILE  17   6.452  -6.365   2.941
  127   2HG1  ILE  17           HG1S     ILE  17   6.290  -4.817   3.819
  128   1HG2  ILE  17           HMG2     ILE  17   4.558  -8.298   5.597
  129   2HG2  ILE  17           HMG2     ILE  17   5.414  -8.491   4.045
  130   3HG2  ILE  17           HMG2     ILE  17   6.332  -8.128   5.530
  131   1HD1  ILE  17           HMD1     ILE  17   7.665  -6.188   5.660
  132   2HD1  ILE  17           HMD1     ILE  17   8.221  -7.052   4.201
  133   3HD1  ILE  17           HMD1     ILE  17   8.452  -5.288   4.337
  134    H    TYR  18           HN       TYR  18   2.559  -5.166   5.877
  135    HA   TYR  18           HA       TYR  18   2.130  -2.579   4.509
  136   1HB   TYR  18           HBS      TYR  18   0.251  -4.198   5.293
  137   2HB   TYR  18           HBR      TYR  18   0.604  -3.559   6.924
  138    HD1  TYR  18           HD2      TYR  18   0.451  -1.034   7.256
  139    HD2  TYR  18           HD1      TYR  18  -1.188  -2.984   3.850
  140    HE1  TYR  18           HE2      TYR  18  -1.037   0.882   6.885
  141    HE2  TYR  18           HE1      TYR  18  -2.667  -1.062   3.454
  142    HH   TYR  18           HH       TYR  18  -2.161   1.941   5.159
  143    H    ASP  19           HN       ASP  19   2.021  -0.634   5.773
  144    HA   ASP  19           HA       ASP  19   3.759  -0.598   8.149
  145   1HB   ASP  19           HBS      ASP  19   4.765  -0.092   5.580
  146   2HB   ASP  19           HBR      ASP  19   4.586   1.498   6.375
  147    HA   PRO  20           HA       PRO  20  -0.001   1.834   8.466
  148   1HB   PRO  20           HBR      PRO  20   0.025   1.330  11.209
  149   2HB   PRO  20           HBS      PRO  20  -1.105   0.877  10.107
  150   1HG   PRO  20           HGS      PRO  20   0.587  -0.772  11.311
  151   2HG   PRO  20           HGR      PRO  20  -0.280  -1.139   9.933
  152   1HD   PRO  20           HDS      PRO  20   2.454  -0.545  10.171
  153   2HD   PRO  20           HDR      PRO  20   1.669  -1.296   8.924
  154    H    GLU  21           HN       GLU  21   3.008   2.324   9.719
  155    HA   GLU  21           HA       GLU  21   2.350   4.757  11.251
  156   1HB   GLU  21           HBR      GLU  21   5.007   3.563  10.444
  157   2HB   GLU  21           HBS      GLU  21   4.747   4.845  11.495
  158   1HG   GLU  21           HGS      GLU  21   4.870   3.395  13.156
  159   2HG   GLU  21           HGR      GLU  21   3.159   3.034  12.799
  160    H    ARG  22           HN       ARG  22   3.967   3.764   8.226
  161    HA   ARG  22           HA       ARG  22   4.172   6.513   7.287
  162   1HB   ARG  22           HBR      ARG  22   4.737   3.815   6.041
  163   2HB   ARG  22           HBS      ARG  22   4.803   5.339   5.111
  164   1HG   ARG  22           HGS      ARG  22   6.334   5.647   7.520
  165   2HG   ARG  22           HGR      ARG  22   6.835   4.142   6.699
  166   1HD   ARG  22           HDS      ARG  22   8.181   5.614   5.638
  167   2HD   ARG  22           HDR      ARG  22   6.749   5.702   4.575
  168    HE   ARG  22           HE       ARG  22   6.311   7.670   6.441
  169   1HH1  ARG  22           HH1Z     ARG  22   9.160   6.898   4.513
  170   2HH1  ARG  22           HH1E     ARG  22   9.560   8.561   4.242
  171   1HH2  ARG  22           HH2Z     ARG  22   6.793   9.830   5.957
  172   2HH2  ARG  22           HH2E     ARG  22   8.222  10.222   5.060
  173    H    GLY  23           HN       GLY  23   1.992   3.777   6.935
  174   1HA   GLY  23           HAR      GLY  23  -0.150   3.688   5.961
  175   2HA   GLY  23           HAS      GLY  23   0.071   5.343   5.332
  176    H    GLU  24           HN       GLU  24   1.963   2.304   5.086
  177    HA   GLU  24           HA       GLU  24   1.934   2.556   2.111
  178   1HB   GLU  24           HBR      GLU  24   3.908   3.444   3.798
  179   2HB   GLU  24           HBS      GLU  24   4.368   1.845   3.591
  180   1HG   GLU  24           HGR      GLU  24   5.596   2.821   1.821
  181   2HG   GLU  24           HGS      GLU  24   4.126   2.143   1.070
  182    H    ILE  25           HN       ILE  25   2.145   0.671   1.001
  183    HA   ILE  25           HA       ILE  25   2.613  -1.821   2.563
  184    HB   ILE  25           HB       ILE  25   1.103  -1.694  -0.084
  185   1HG1  ILE  25           HG1R     ILE  25  -0.912  -2.182   1.603
  186   2HG1  ILE  25           HG1S     ILE  25   0.122  -1.236   2.711
  187   1HG2  ILE  25           HMG2     ILE  25   2.198  -3.835   1.218
  188   2HG2  ILE  25           HMG2     ILE  25   0.512  -3.859   1.800
  189   3HG2  ILE  25           HMG2     ILE  25   0.853  -3.903   0.050
  190   1HD1  ILE  25           HMD1     ILE  25   0.019   0.158   0.233
  191   2HD1  ILE  25           HMD1     ILE  25  -1.648  -0.308   0.666
  192   3HD1  ILE  25           HMD1     ILE  25  -0.660   0.637   1.812
  193    H    VAL  26           HN       VAL  26   4.283  -3.018   1.968
  194    HA   VAL  26           HA       VAL  26   5.827  -2.133  -0.417
  195    HB   VAL  26           HB       VAL  26   7.019  -2.979   2.220
  196   1HG1  VAL  26           HMGR     VAL  26   8.109  -1.448  -0.150
  197   2HG1  VAL  26           HMGR     VAL  26   8.950  -1.616   1.410
  198   3HG1  VAL  26           HMGR     VAL  26   8.592  -3.060   0.430
  199   1HG2  VAL  26           HMGS     VAL  26   6.044  -0.251   1.403
  200   2HG2  VAL  26           HMGS     VAL  26   5.777  -1.140   2.922
  201   3HG2  VAL  26           HMGS     VAL  26   7.382  -0.461   2.560
  202    H    CYS  27           HN       CYS  27   7.623  -3.698  -0.944
  203    HA   CYS  27           HA       CYS  27   6.654  -6.463  -0.788
  204   1HB   CYS  27           HBS      CYS  27   7.325  -5.392  -2.926
  205   2HB   CYS  27           HBR      CYS  27   8.998  -5.298  -2.317
  206    H    ALA  28           HN       ALA  28   7.559  -8.061   0.308
  207    HA   ALA  28           HA       ALA  28   9.856  -7.459   2.054
  208   1HB   ALA  28           HMBC     ALA  28   7.500  -8.869   2.392
  209   2HB   ALA  28           HMBA     ALA  28   8.728 -10.145   2.194
  210   3HB   ALA  28           HMBB     ALA  28   8.925  -8.906   3.460
  211    H    LYS  29           HN       LYS  29   9.862  -8.037  -0.991
  212    HA   LYS  29           HA       LYS  29  11.615 -10.451  -0.984
  213   1HB   LYS  29           HBS      LYS  29   8.996 -10.073  -2.083
  214   2HB   LYS  29           HBR      LYS  29  10.161 -10.245  -3.427
  215   1HG   LYS  29           HGR      LYS  29   9.659 -12.190  -1.146
  216   2HG   LYS  29           HGS      LYS  29   9.302 -12.426  -2.881
  217   1HD   LYS  29           HDS      LYS  29  11.673 -12.369  -3.407
  218   2HD   LYS  29           HDR      LYS  29  12.058 -12.058  -1.736
  219   1HE   LYS  29           HES      LYS  29  10.754 -14.566  -2.789
  220   2HE   LYS  29           HER      LYS  29  12.456 -14.368  -2.281
  221   1HZ   LYS  29           HZC      LYS  29  10.671 -13.521  -0.277
  222   2HZ   LYS  29           HZA      LYS  29  10.358 -15.066  -0.699
  223   3HZ   LYS  29           HZB      LYS  29  11.854 -14.643  -0.200
  224    H    CYS  30           HN       CYS  30  10.807  -7.330  -2.409
  225    HA   CYS  30           HA       CYS  30  13.690  -7.249  -3.117
  226   1HB   CYS  30           HBS      CYS  30  13.289  -5.756  -4.972
  227   2HB   CYS  30           HBR      CYS  30  12.524  -7.350  -5.207
  228    H    GLY  31           HN       GLY  31  11.274  -6.114  -1.169
  229   1HA   GLY  31           HAR      GLY  31  11.411  -4.463   0.431
  230   2HA   GLY  31           HAS      GLY  31  12.791  -3.755  -0.454
  231    H    TYR  32           HN       TYR  32  10.389  -4.154  -2.693
  232    HA   TYR  32           HA       TYR  32  10.396  -1.237  -3.028
  233   1HB   TYR  32           HBS      TYR  32  10.689  -2.591  -5.011
  234   2HB   TYR  32           HBR      TYR  32   9.183  -3.489  -4.679
  235    HD1  TYR  32           HD2      TYR  32  10.140   0.135  -4.893
  236    HD2  TYR  32           HD1      TYR  32   7.485  -2.929  -6.177
  237    HE1  TYR  32           HE2      TYR  32   8.949   1.764  -6.290
  238    HE2  TYR  32           HE1      TYR  32   6.263  -1.302  -7.556
  239    HH   TYR  32           HH       TYR  32   6.856   0.747  -8.796
  240    H    VAL  33           HN       VAL  33   8.817   0.104  -2.544
  241    HA   VAL  33           HA       VAL  33   6.502  -0.603  -1.081
  242    HB   VAL  33           HB       VAL  33   7.031   1.844  -2.783
  243   1HG1  VAL  33           HMGR     VAL  33   4.910   1.317  -0.694
  244   2HG1  VAL  33           HMGR     VAL  33   5.362   2.942  -1.263
  245   3HG1  VAL  33           HMGR     VAL  33   4.686   1.756  -2.405
  246   1HG2  VAL  33           HMGS     VAL  33   8.443   1.052  -0.595
  247   2HG2  VAL  33           HMGS     VAL  33   8.225   2.739  -1.118
  248   3HG2  VAL  33           HMGS     VAL  33   7.175   2.057   0.147
  249    H    ILE  34           HN       ILE  34   4.272  -0.353  -1.741
  250    HA   ILE  34           HA       ILE  34   3.786  -1.129  -4.571
  251    HB   ILE  34           HB       ILE  34   2.343  -1.777  -1.963
  252   1HG1  ILE  34           HG1R     ILE  34   4.447  -2.996  -2.672
  253   2HG1  ILE  34           HG1S     ILE  34   3.018  -4.006  -2.305
  254   1HG2  ILE  34           HMG2     ILE  34   1.193  -1.631  -4.611
  255   2HG2  ILE  34           HMG2     ILE  34   1.133  -3.295  -3.973
  256   3HG2  ILE  34           HMG2     ILE  34   0.420  -1.955  -3.037
  257   1HD1  ILE  34           HMD1     ILE  34   2.642  -3.868  -4.905
  258   2HD1  ILE  34           HMD1     ILE  34   4.383  -3.482  -4.921
  259   3HD1  ILE  34           HMD1     ILE  34   3.818  -5.018  -4.212
  260    H    GLU  35           HN       GLU  35   1.717   0.164  -1.979
  261    HA   GLU  35           HA       GLU  35   0.888   2.358  -3.835
  262   1HB   GLU  35           HBR      GLU  35  -0.483   0.130  -3.138
  263   2HB   GLU  35           HBS      GLU  35  -0.841   1.088  -1.806
  264   1HG   GLU  35           HGS      GLU  35  -1.259   2.862  -3.884
  265   2HG   GLU  35           HGR      GLU  35  -2.003   1.359  -4.493
  266    H    GLU  36           HN       GLU  36  -0.832   3.674  -2.223
  267    HA   GLU  36           HA       GLU  36   0.994   4.769  -0.149
  268   1HB   GLU  36           HBS      GLU  36  -0.104   5.760  -2.374
  269   2HB   GLU  36           HBR      GLU  36  -1.341   6.206  -1.332
  270   1HG   GLU  36           HGS      GLU  36   0.340   7.998  -1.672
  271   2HG   GLU  36           HGR      GLU  36   0.318   7.555   0.056
  272    H    ASN  37           HN       ASN  37  -0.678   6.407   1.195
  273    HA   ASN  37           HA       ASN  37  -1.400   4.573   3.170
  274   1HB   ASN  37           HBS      ASN  37  -1.997   6.419   4.537
  275   2HB   ASN  37           HBR      ASN  37  -0.539   6.823   3.584
  276   1HD2  ASN  37           HD2Z     ASN  37  -1.973   9.516   1.850
  277   2HD2  ASN  37           HD2E     ASN  37  -0.625   8.440   2.018
  278    H    ILE  38           HN       ILE  38  -2.917   3.130   2.761
  279    HA   ILE  38           HA       ILE  38  -5.000   2.219   2.617
  280    HB   ILE  38           HB       ILE  38  -5.059   3.225   4.820
  281   1HG1  ILE  38           HG1R     ILE  38  -7.658   3.695   4.853
  282   2HG1  ILE  38           HG1S     ILE  38  -7.550   3.209   3.136
  283   1HG2  ILE  38           HMG2     ILE  38  -6.154   5.727   3.515
  284   2HG2  ILE  38           HMG2     ILE  38  -6.178   5.387   5.266
  285   3HG2  ILE  38           HMG2     ILE  38  -4.622   5.548   4.410
  286   1HD1  ILE  38           HMD1     ILE  38  -6.398   1.489   5.329
  287   2HD1  ILE  38           HMD1     ILE  38  -8.126   1.410   4.889
  288   3HD1  ILE  38           HMD1     ILE  38  -6.877   1.035   3.671
  289    H    ILE  39           HN       ILE  39  -5.478   2.068   0.517
  290    HA   ILE  39           HA       ILE  39  -6.864   4.216  -0.921
  291    HB   ILE  39           HB       ILE  39  -5.398   2.602  -2.120
  292   1HG1  ILE  39           HG1R     ILE  39  -7.949   1.881  -3.363
  293   2HG1  ILE  39           HG1S     ILE  39  -7.920   3.581  -2.814
  294   1HG2  ILE  39           HMG2     ILE  39  -6.055   0.621  -0.656
  295   2HG2  ILE  39           HMG2     ILE  39  -7.492   0.476  -1.701
  296   3HG2  ILE  39           HMG2     ILE  39  -5.859   0.325  -2.403
  297   1HD1  ILE  39           HMD1     ILE  39  -5.522   3.455  -4.043
  298   2HD1  ILE  39           HMD1     ILE  39  -6.420   2.243  -4.996
  299   3HD1  ILE  39           HMD1     ILE  39  -7.036   3.912  -4.869
  300    H    ASP  40           HN       ASP  40  -8.853   4.728  -0.460
  301    HA   ASP  40           HA       ASP  40 -10.738   2.557   0.271
  302   1HB   ASP  40           HBS      ASP  40 -12.220   4.580   0.954
  303   2HB   ASP  40           HBR      ASP  40 -10.966   3.928   2.048
  304    H    MET  41           HN       MET  41 -11.172   5.788  -1.170
  305    HA   MET  41           HA       MET  41 -11.297   4.937  -3.820
  306   1HB   MET  41           HBS      MET  41 -13.748   4.370  -2.392
  307   2HB   MET  41           HBR      MET  41 -14.029   5.558  -3.696
  308   1HG   MET  41           HGS      MET  41 -13.106   4.067  -5.354
  309   2HG   MET  41           HGR      MET  41 -12.484   2.973  -4.095
  310   1HE   MET  41           HMEA     MET  41 -13.561   1.362  -2.979
  311   2HE   MET  41           HMEC     MET  41 -15.221   0.743  -3.170
  312   3HE   MET  41           HMEB     MET  41 -14.049   0.577  -4.502
  313    H    GLY  42           HN       GLY  42 -10.096   6.783  -4.006
  314   1HA   GLY  42           HAR      GLY  42 -11.501   9.325  -4.241
  315   2HA   GLY  42           HAS      GLY  42 -10.381   9.255  -2.852
  316    HA   PRO  43           HA       PRO  43  -7.812  10.656  -6.379
  317   1HB   PRO  43           HBR      PRO  43  -6.453  12.210  -4.553
  318   2HB   PRO  43           HBS      PRO  43  -7.347  12.727  -5.829
  319   1HG   PRO  43           HGS      PRO  43  -7.989  13.022  -3.250
  320   2HG   PRO  43           HGR      PRO  43  -9.007  13.302  -4.542
  321   1HD   PRO  43           HDS      PRO  43  -8.985  11.118  -2.775
  322   2HD   PRO  43           HDR      PRO  43 -10.204  11.620  -3.775
  323    H    GLU  44           HN       GLU  44  -5.178  11.262  -5.612
  324    HA   GLU  44           HA       GLU  44  -4.308   8.672  -4.409
  325   1HB   GLU  44           HBS      GLU  44  -3.720   9.884  -6.895
  326   2HB   GLU  44           HBR      GLU  44  -2.296   9.983  -6.011
  327   1HG   GLU  44           HGS      GLU  44  -2.517   7.481  -5.557
  328   2HG   GLU  44           HGR      GLU  44  -3.916   7.433  -6.664
  329    H    TRP  45           HN       TRP  45  -2.594  11.660  -5.333
  330    HA   TRP  45           HA       TRP  45  -2.219  12.285  -2.450
  331   1HB   TRP  45           HBR      TRP  45  -0.282  11.422  -4.371
  332   2HB   TRP  45           HBS      TRP  45   0.072  13.104  -3.880
  333    HD1  TRP  45           HD1      TRP  45  -0.766   9.763  -2.018
  334    HE1  TRP  45           HE1      TRP  45   0.623   9.682   0.141
  335    HE3  TRP  45           HE3      TRP  45   1.591  14.248  -2.479
  336    HZ2  TRP  45           HZ2      TRP  45   2.467  11.334   1.460
  337    HZ3  TRP  45           HZ3      TRP  45   3.170  14.929  -0.734
  338    HH2  TRP  45           HH2      TRP  45   3.601  13.513   1.204
  339    H    ARG  46           HN       ARG  46  -0.929  14.532  -2.430
  340    HA   ARG  46           HA       ARG  46  -1.275  16.798  -2.490
  341   1HB   ARG  46           HBR      ARG  46  -1.091  16.524  -5.005
  342   2HB   ARG  46           HBS      ARG  46  -2.875  16.428  -5.035
  343   1HG   ARG  46           HGS      ARG  46  -2.738  18.650  -5.375
  344   2HG   ARG  46           HGR      ARG  46  -2.519  18.712  -3.603
  345   1HD   ARG  46           HDS      ARG  46  -0.181  18.866  -3.801
  346   2HD   ARG  46           HDR      ARG  46  -0.226  18.440  -5.535
  347    HE   ARG  46           HE       ARG  46  -1.096  21.029  -4.363
  348   1HH1  ARG  46           HH1Z     ARG  46  -0.479  19.044  -7.211
  349   2HH1  ARG  46           HH1E     ARG  46  -0.264  20.413  -8.252
  350   1HH2  ARG  46           HH2Z     ARG  46  -0.677  22.792  -5.726
  351   2HH2  ARG  46           HH2E     ARG  46  -0.376  22.533  -7.412
  352    H    ALA  47           HN       ALA  47  -4.239  15.679  -4.134
  353    HA   ALA  47           HA       ALA  47  -6.425  15.532  -3.461
  354   1HB   ALA  47           HMBC     ALA  47  -4.989  14.919  -0.862
  355   2HB   ALA  47           HMBB     ALA  47  -6.700  14.563  -1.213
  356   3HB   ALA  47           HMBA     ALA  47  -5.412  13.765  -2.152
  357    H    PHE  48           HN       PHE  48  -7.857  16.098  -1.295
  358    HA   PHE  48           HA       PHE  48  -7.042  18.248   0.299
  359   1HB   PHE  48           HBR      PHE  48  -8.589  20.050  -0.369
  360   2HB   PHE  48           HBS      PHE  48  -7.349  19.740  -1.618
  361    HD1  PHE  48           HD1      PHE  48  -8.004  18.017  -3.395
  362    HD2  PHE  48           HD2      PHE  48 -10.876  20.173  -1.103
  363    HE1  PHE  48           HE1      PHE  48  -9.658  17.658  -5.171
  364    HE2  PHE  48           HE2      PHE  48 -12.563  19.823  -2.876
  365    HZ   PHE  48           HZ       PHE  48 -11.921  18.612  -4.942
  366    H    ASP  49           HN       ASP  49  -7.831  17.115   1.953
  367    HA   ASP  49           HA       ASP  49 -10.737  16.550   1.993
  368   1HB   ASP  49           HBS      ASP  49  -8.525  14.629   1.952
  369   2HB   ASP  49           HBR      ASP  49  -9.727  14.365   3.248
  370    H    ALA  50           HN       ALA  50 -11.739  17.104   3.750
  371    HA   ALA  50           HA       ALA  50 -10.672  16.741   6.403
  372   1HB   ALA  50           HMBA     ALA  50  -9.505  18.842   5.398
  373   2HB   ALA  50           HMBC     ALA  50 -11.081  19.626   5.678
  374   3HB   ALA  50           HMBB     ALA  50 -10.192  18.902   7.041
   
  No H/Q in entry =         374
  Start of MODEL    7
    1   1H    MET   1           HNB      MET   1  -0.795 -21.518   2.289
    2   2H    MET   1           HN       MET   1  -1.509 -21.287   3.739
    3   3H    MET   1           HNC      MET   1  -1.963 -22.541   2.796
    4    HA   MET   1           HA       MET   1  -2.876 -21.156   1.165
    5   1HB   MET   1           HBR      MET   1  -4.624 -19.971   2.613
    6   2HB   MET   1           HBS      MET   1  -4.466 -21.742   2.783
    7   1HG   MET   1           HGS      MET   1  -3.146 -21.467   4.825
    8   2HG   MET   1           HGR      MET   1  -3.139 -19.700   4.608
    9   1HE   MET   1           HMEA     MET   1  -5.008 -18.287   4.500
   10   2HE   MET   1           HMEC     MET   1  -6.596 -18.501   5.279
   11   3HE   MET   1           HMEB     MET   1  -5.125 -18.373   6.277
   12    H    VAL   2           HN       VAL   2  -3.929 -18.728   1.279
   13    HA   VAL   2           HA       VAL   2  -2.258 -16.644   2.108
   14    HB   VAL   2           HB       VAL   2  -0.679 -17.747   0.509
   15   1HG1  VAL   2           HMGR     VAL   2  -2.875 -17.634  -1.275
   16   2HG1  VAL   2           HMGR     VAL   2  -1.623 -16.540  -1.911
   17   3HG1  VAL   2           HMGR     VAL   2  -1.231 -18.244  -1.577
   18   1HG2  VAL   2           HMGS     VAL   2  -1.036 -15.121   1.118
   19   2HG2  VAL   2           HMGS     VAL   2   0.342 -15.781   0.206
   20   3HG2  VAL   2           HMGS     VAL   2  -1.041 -15.071  -0.662
   21    H    ASN   3           HN       ASN   3  -4.555 -17.931  -0.208
   22    HA   ASN   3           HA       ASN   3  -6.654 -17.250  -0.696
   23   1HB   ASN   3           HBS      ASN   3  -6.817 -16.807   1.692
   24   2HB   ASN   3           HBR      ASN   3  -6.231 -15.140   1.421
   25   1HD2  ASN   3           HD2Z     ASN   3  -9.939 -15.060   1.666
   26   2HD2  ASN   3           HD2E     ASN   3  -8.638 -15.558   2.695
   27    H    LYS   4           HN       LYS   4  -5.928 -13.929   0.067
   28    HA   LYS   4           HA       LYS   4  -6.994 -13.129  -2.419
   29   1HB   LYS   4           HBR      LYS   4  -6.423 -10.867  -1.777
   30   2HB   LYS   4           HBS      LYS   4  -7.104 -11.757  -0.386
   31   1HG   LYS   4           HGR      LYS   4  -5.226 -11.515   0.838
   32   2HG   LYS   4           HGS      LYS   4  -4.161 -11.869  -0.551
   33   1HD   LYS   4           HDS      LYS   4  -3.623  -9.754  -0.697
   34   2HD   LYS   4           HDR      LYS   4  -5.274  -9.392  -1.117
   35   1HE   LYS   4           HES      LYS   4  -5.721  -8.430   0.835
   36   2HE   LYS   4           HER      LYS   4  -4.914  -9.737   1.746
   37   1HZ   LYS   4           HZA      LYS   4  -2.805  -8.650   0.959
   38   2HZ   LYS   4           HZB      LYS   4  -3.710  -7.351   0.557
   39   3HZ   LYS   4           HZC      LYS   4  -3.650  -7.855   2.109
   40    H    GLN   5           HN       GLN   5  -5.922 -11.563  -3.907
   41    HA   GLN   5           HA       GLN   5  -3.284 -12.695  -4.666
   42   1HB   GLN   5           HBS      GLN   5  -5.238 -13.346  -6.079
   43   2HB   GLN   5           HBR      GLN   5  -5.398 -11.630  -6.547
   44   1HG   GLN   5           HGS      GLN   5  -3.602 -11.691  -7.913
   45   2HG   GLN   5           HGR      GLN   5  -2.702 -12.818  -6.859
   46   1HE2  GLN   5           HE2Z     GLN   5  -4.283 -14.133 -10.222
   47   2HE2  GLN   5           HE2E     GLN   5  -3.899 -12.490  -9.834
   48    H    LYS   6           HN       LYS   6  -2.314 -11.014  -3.378
   49    HA   LYS   6           HA       LYS   6  -2.120  -8.479  -4.926
   50   1HB   LYS   6           HBS      LYS   6  -2.999  -8.593  -2.300
   51   2HB   LYS   6           HBR      LYS   6  -1.248  -8.275  -2.137
   52   1HG   LYS   6           HGR      LYS   6  -1.930  -6.113  -2.311
   53   2HG   LYS   6           HGS      LYS   6  -1.851  -6.474  -4.060
   54   1HD   LYS   6           HDS      LYS   6  -4.348  -6.709  -2.379
   55   2HD   LYS   6           HDR      LYS   6  -3.892  -5.285  -3.272
   56   1HE   LYS   6           HES      LYS   6  -3.965  -6.480  -5.372
   57   2HE   LYS   6           HER      LYS   6  -4.323  -7.996  -4.498
   58   1HZ   LYS   6           HZB      LYS   6  -6.299  -6.727  -3.626
   59   2HZ   LYS   6           HZC      LYS   6  -6.028  -5.641  -4.816
   60   3HZ   LYS   6           HZA      LYS   6  -6.357  -7.197  -5.189
   61    H    VAL   7           HN       VAL   7  -0.235  -8.396  -5.874
   62    HA   VAL   7           HA       VAL   7   1.949 -10.100  -4.801
   63    HB   VAL   7           HB       VAL   7   2.587 -10.550  -7.057
   64   1HG1  VAL   7           HMGR     VAL   7   0.305 -11.526  -5.902
   65   2HG1  VAL   7           HMGR     VAL   7  -0.278 -11.012  -7.504
   66   3HG1  VAL   7           HMGR     VAL   7   1.075 -12.163  -7.375
   67   1HG2  VAL   7           HMGS     VAL   7   0.548  -8.473  -7.796
   68   2HG2  VAL   7           HMGS     VAL   7   2.242  -8.639  -8.312
   69   3HG2  VAL   7           HMGS     VAL   7   1.007  -9.755  -8.943
   70    H    CYS   8           HN       CYS   8   4.135  -9.489  -5.715
   71    HA   CYS   8           HA       CYS   8   4.609  -6.573  -5.805
   72   1HB   CYS   8           HBS      CYS   8   6.216  -8.140  -4.646
   73   2HB   CYS   8           HBR      CYS   8   6.564  -8.834  -6.256
   74    HA   PRO   9           HA       PRO   9   4.083  -6.674 -10.199
   75   1HB   PRO   9           HBR      PRO   9   4.431  -3.974 -10.308
   76   2HB   PRO   9           HBS      PRO   9   3.005  -4.780 -10.420
   77   1HG   PRO   9           HGS      PRO   9   3.992  -3.331  -8.273
   78   2HG   PRO   9           HGR      PRO   9   2.433  -3.862  -8.531
   79   1HD   PRO   9           HDS      PRO   9   4.136  -4.906  -6.741
   80   2HD   PRO   9           HDR      PRO   9   2.748  -5.635  -7.268
   81    H    ALA  10           HN       ALA  10   6.677  -6.145  -8.311
   82    HA   ALA  10           HA       ALA  10   8.401  -5.192 -10.511
   83   1HB   ALA  10           HMBB     ALA  10   8.250  -4.339  -8.002
   84   2HB   ALA  10           HMBC     ALA  10   9.424  -5.657  -7.749
   85   3HB   ALA  10           HMBA     ALA  10   9.781  -4.357  -8.914
   86    H    CYS  11           HN       CYS  11   8.979  -7.468  -7.812
   87    HA   CYS  11           HA       CYS  11  10.988  -8.723  -9.483
   88   1HB   CYS  11           HBS      CYS  11  11.723  -9.852  -7.492
   89   2HB   CYS  11           HBR      CYS  11  11.498  -8.106  -7.211
   90    H    GLU  12           HN       GLU  12   7.746  -9.275  -9.167
   91    HA   GLU  12           HA       GLU  12   6.291 -11.034  -9.233
   92   1HB   GLU  12           HBS      GLU  12   7.554 -11.485 -11.231
   93   2HB   GLU  12           HBR      GLU  12   8.732 -12.366 -10.426
   94   1HG   GLU  12           HGS      GLU  12   7.345 -14.230 -10.172
   95   2HG   GLU  12           HGR      GLU  12   5.838 -13.276 -10.116
   96    H    SER  13           HN       SER  13   7.075 -10.458  -6.835
   97    HA   SER  13           HA       SER  13   7.413 -13.120  -5.552
   98   1HB   SER  13           HBS      SER  13   7.474 -11.898  -3.415
   99   2HB   SER  13           HBR      SER  13   8.823 -11.472  -4.506
  100    HG   SER  13           HG       SER  13   6.793  -9.993  -3.336
  101    H    ALA  14           HN       ALA  14   5.852 -13.445  -3.707
  102    HA   ALA  14           HA       ALA  14   3.150 -12.499  -4.499
  103   1HB   ALA  14           HMBC     ALA  14   4.069 -15.107  -4.289
  104   2HB   ALA  14           HMBA     ALA  14   3.265 -14.826  -2.723
  105   3HB   ALA  14           HMBB     ALA  14   2.364 -14.591  -4.242
  106    H    GLU  15           HN       GLU  15   5.581 -12.218  -2.244
  107    HA   GLU  15           HA       GLU  15   3.743 -11.890   0.053
  108   1HB   GLU  15           HBR      GLU  15   6.727 -12.248  -0.273
  109   2HB   GLU  15           HBS      GLU  15   6.005 -11.836   1.185
  110   1HG   GLU  15           HGS      GLU  15   5.046 -14.260  -0.281
  111   2HG   GLU  15           HGR      GLU  15   6.425 -14.397   0.844
  112    H    LEU  16           HN       LEU  16   2.927  -9.862  -0.097
  113    HA   LEU  16           HA       LEU  16   4.885  -7.632   0.169
  114   1HB   LEU  16           HBR      LEU  16   1.911  -7.526  -0.410
  115   2HB   LEU  16           HBS      LEU  16   3.063  -6.160  -0.399
  116    HG   LEU  16           HG       LEU  16   2.954  -8.440  -2.391
  117   1HD1  LEU  16           HMDR     LEU  16   1.914  -5.671  -2.287
  118   2HD1  LEU  16           HMDR     LEU  16   2.784  -6.107  -3.780
  119   3HD1  LEU  16           HMDR     LEU  16   1.380  -7.069  -3.255
  120   1HD2  LEU  16           HMDS     LEU  16   4.892  -6.171  -1.916
  121   2HD2  LEU  16           HMDS     LEU  16   5.229  -7.910  -2.108
  122   3HD2  LEU  16           HMDS     LEU  16   4.713  -6.941  -3.512
  123    H    ILE  17           HN       ILE  17   3.783  -5.869   1.662
  124    HA   ILE  17           HA       ILE  17   2.684  -6.942   4.123
  125    HB   ILE  17           HB       ILE  17   4.873  -6.298   5.395
  126   1HG1  ILE  17           HG1R     ILE  17   5.922  -6.720   2.578
  127   2HG1  ILE  17           HG1S     ILE  17   6.097  -5.280   3.619
  128   1HG2  ILE  17           HMG2     ILE  17   3.837  -8.644   4.943
  129   2HG2  ILE  17           HMG2     ILE  17   5.231  -8.839   3.849
  130   3HG2  ILE  17           HMG2     ILE  17   5.496  -8.504   5.581
  131   1HD1  ILE  17           HMD1     ILE  17   7.516  -6.608   5.155
  132   2HD1  ILE  17           HMD1     ILE  17   7.397  -7.989   4.031
  133   3HD1  ILE  17           HMD1     ILE  17   8.194  -6.480   3.510
  134    H    TYR  18           HN       TYR  18   1.784  -5.379   5.261
  135    HA   TYR  18           HA       TYR  18   1.840  -2.721   4.056
  136   1HB   TYR  18           HBS      TYR  18  -0.255  -4.047   4.676
  137   2HB   TYR  18           HBR      TYR  18   0.121  -3.646   6.377
  138    HD1  TYR  18           HD2      TYR  18   0.568  -1.055   6.782
  139    HD2  TYR  18           HD1      TYR  18  -1.702  -2.600   3.536
  140    HE1  TYR  18           HE2      TYR  18  -0.645   1.073   6.630
  141    HE2  TYR  18           HE1      TYR  18  -2.918  -0.471   3.363
  142    HH   TYR  18           HH       TYR  18  -1.658   2.365   5.028
  143    H    ASP  19           HN       ASP  19   2.450  -0.857   4.978
  144    HA   ASP  19           HA       ASP  19   4.010  -1.117   7.491
  145   1HB   ASP  19           HBS      ASP  19   4.726   0.002   4.918
  146   2HB   ASP  19           HBR      ASP  19   4.890   1.194   6.239
  147    HA   PRO  20           HA       PRO  20   0.448   1.207   8.683
  148   1HB   PRO  20           HBS      PRO  20   1.074   0.604  11.328
  149   2HB   PRO  20           HBR      PRO  20  -0.244   0.125  10.474
  150   1HG   PRO  20           HGS      PRO  20   1.760  -1.448  11.234
  151   2HG   PRO  20           HGR      PRO  20   0.650  -1.839  10.051
  152   1HD   PRO  20           HDS      PRO  20   3.332  -1.062   9.744
  153   2HD   PRO  20           HDR      PRO  20   2.356  -1.841   8.660
  154    H    GLU  21           HN       GLU  21   3.616   1.840   9.215
  155    HA   GLU  21           HA       GLU  21   3.351   4.015  11.148
  156   1HB   GLU  21           HBR      GLU  21   5.475   2.792   9.428
  157   2HB   GLU  21           HBS      GLU  21   5.674   4.380   9.932
  158   1HG   GLU  21           HGS      GLU  21   4.828   2.939  12.226
  159   2HG   GLU  21           HGR      GLU  21   6.225   2.061  11.544
  160    H    ARG  22           HN       ARG  22   3.995   3.705   7.633
  161    HA   ARG  22           HA       ARG  22   3.381   6.557   7.281
  162   1HB   ARG  22           HBR      ARG  22   4.600   4.408   5.553
  163   2HB   ARG  22           HBS      ARG  22   3.993   5.933   4.843
  164   1HG   ARG  22           HGS      ARG  22   6.083   6.675   5.201
  165   2HG   ARG  22           HGR      ARG  22   5.544   6.867   6.894
  166   1HD   ARG  22           HDS      ARG  22   6.974   5.344   7.582
  167   2HD   ARG  22           HDR      ARG  22   6.346   4.156   6.407
  168    HE   ARG  22           HE       ARG  22   8.215   4.535   5.130
  169   1HH1  ARG  22           HH1Z     ARG  22   7.564   7.486   6.947
  170   2HH1  ARG  22           HH1E     ARG  22   9.078   8.212   6.521
  171   1HH2  ARG  22           HH2Z     ARG  22  10.237   5.463   4.700
  172   2HH2  ARG  22           HH2E     ARG  22  10.590   7.069   5.247
  173    H    GLY  23           HN       GLY  23   1.891   3.470   6.922
  174   1HA   GLY  23           HAR      GLY  23  -0.333   2.992   6.248
  175   2HA   GLY  23           HAS      GLY  23  -0.451   4.614   5.514
  176    H    GLU  24           HN       GLU  24   2.162   2.221   5.150
  177    HA   GLU  24           HA       GLU  24   1.897   2.530   2.220
  178   1HB   GLU  24           HBR      GLU  24   3.940   2.837   3.976
  179   2HB   GLU  24           HBS      GLU  24   4.106   1.198   3.652
  180   1HG   GLU  24           HGS      GLU  24   5.438   1.769   1.981
  181   2HG   GLU  24           HGR      GLU  24   3.937   2.008   1.048
  182    H    ILE  25           HN       ILE  25   2.560   0.634   0.897
  183    HA   ILE  25           HA       ILE  25   2.395  -1.979   2.249
  184    HB   ILE  25           HB       ILE  25   0.970  -1.509  -0.410
  185   1HG1  ILE  25           HG1R     ILE  25  -1.111  -1.926   1.202
  186   2HG1  ILE  25           HG1S     ILE  25  -0.006  -1.217   2.412
  187   1HG2  ILE  25           HMG2     ILE  25   0.945  -3.831   1.529
  188   2HG2  ILE  25           HMG2     ILE  25  -0.112  -3.675   0.100
  189   3HG2  ILE  25           HMG2     ILE  25   1.656  -3.792  -0.106
  190   1HD1  ILE  25           HMD1     ILE  25   0.169   0.484   0.198
  191   2HD1  ILE  25           HMD1     ILE  25  -1.563   0.074   0.332
  192   3HD1  ILE  25           HMD1     ILE  25  -0.703   0.782   1.726
  193    H    VAL  26           HN       VAL  26   4.250  -2.913   1.921
  194    HA   VAL  26           HA       VAL  26   5.815  -2.140  -0.487
  195    HB   VAL  26           HB       VAL  26   6.959  -2.992   2.168
  196   1HG1  VAL  26           HMGR     VAL  26   8.065  -2.104  -0.394
  197   2HG1  VAL  26           HMGR     VAL  26   8.713  -1.221   1.010
  198   3HG1  VAL  26           HMGR     VAL  26   8.823  -2.997   0.947
  199   1HG2  VAL  26           HMGS     VAL  26   5.854  -0.344   1.384
  200   2HG2  VAL  26           HMGS     VAL  26   5.946  -1.134   2.977
  201   3HG2  VAL  26           HMGS     VAL  26   7.392  -0.368   2.278
  202    H    CYS  27           HN       CYS  27   7.587  -3.735  -0.987
  203    HA   CYS  27           HA       CYS  27   6.607  -6.482  -1.058
  204   1HB   CYS  27           HBS      CYS  27   7.897  -5.381  -2.898
  205   2HB   CYS  27           HBR      CYS  27   9.329  -5.412  -1.832
  206    H    ALA  28           HN       ALA  28   7.554  -8.239  -0.046
  207    HA   ALA  28           HA       ALA  28   9.084  -7.646   2.423
  208   1HB   ALA  28           HMBA     ALA  28   6.981  -9.219   2.179
  209   2HB   ALA  28           HMBC     ALA  28   8.209 -10.395   1.645
  210   3HB   ALA  28           HMBB     ALA  28   8.341  -9.636   3.252
  211    H    LYS  29           HN       LYS  29  10.008  -7.608  -0.503
  212    HA   LYS  29           HA       LYS  29  12.289  -9.483  -0.193
  213   1HB   LYS  29           HBR      LYS  29  10.225  -9.905  -2.043
  214   2HB   LYS  29           HBS      LYS  29  11.547  -9.150  -2.979
  215   1HG   LYS  29           HGR      LYS  29  11.868 -11.508  -3.122
  216   2HG   LYS  29           HGS      LYS  29  13.097 -10.894  -1.980
  217   1HD   LYS  29           HDS      LYS  29  12.412 -12.279  -0.432
  218   2HD   LYS  29           HDR      LYS  29  10.854 -11.499  -0.434
  219   1HE   LYS  29           HES      LYS  29  10.107 -13.552  -0.926
  220   2HE   LYS  29           HER      LYS  29  10.523 -13.043  -2.587
  221   1HZ   LYS  29           HZC      LYS  29  12.661 -14.103  -2.278
  222   2HZ   LYS  29           HZA      LYS  29  12.241 -14.602  -0.781
  223   3HZ   LYS  29           HZB      LYS  29  11.445 -15.178  -2.087
  224    H    CYS  30           HN       CYS  30  11.247  -7.366  -2.862
  225    HA   CYS  30           HA       CYS  30  14.004  -6.686  -3.148
  226   1HB   CYS  30           HBR      CYS  30  13.357  -5.683  -5.260
  227   2HB   CYS  30           HBS      CYS  30  12.663  -7.310  -5.034
  228    H    GLY  31           HN       GLY  31  11.701  -5.220  -1.286
  229   1HA   GLY  31           HAR      GLY  31  12.081  -3.247  -0.076
  230   2HA   GLY  31           HAS      GLY  31  13.078  -2.626  -1.421
  231    H    TYR  32           HN       TYR  32  10.341  -3.864  -2.811
  232    HA   TYR  32           HA       TYR  32   9.890  -1.156  -3.828
  233   1HB   TYR  32           HBS      TYR  32  10.008  -2.992  -5.412
  234   2HB   TYR  32           HBR      TYR  32   8.676  -3.843  -4.579
  235    HD1  TYR  32           HD2      TYR  32   9.541  -0.981  -6.744
  236    HD2  TYR  32           HD1      TYR  32   6.370  -3.211  -4.993
  237    HE1  TYR  32           HE2      TYR  32   7.958   0.058  -8.305
  238    HE2  TYR  32           HE1      TYR  32   4.772  -2.162  -6.537
  239    HH   TYR  32           HH       TYR  32   5.771   0.584  -8.525
  240    H    VAL  33           HN       VAL  33   8.538   0.191  -2.943
  241    HA   VAL  33           HA       VAL  33   6.146  -0.669  -1.469
  242    HB   VAL  33           HB       VAL  33   7.043   2.061  -2.423
  243   1HG1  VAL  33           HMGR     VAL  33   4.495   1.147  -1.327
  244   2HG1  VAL  33           HMGR     VAL  33   5.230   2.467  -0.385
  245   3HG1  VAL  33           HMGR     VAL  33   4.927   2.679  -2.127
  246   1HG2  VAL  33           HMGS     VAL  33   8.324   0.785  -0.545
  247   2HG2  VAL  33           HMGS     VAL  33   7.888   2.497  -0.330
  248   3HG2  VAL  33           HMGS     VAL  33   6.918   1.227   0.452
  249    H    ILE  34           HN       ILE  34   4.052  -0.418  -2.215
  250    HA   ILE  34           HA       ILE  34   3.730   0.135  -5.124
  251    HB   ILE  34           HB       ILE  34   2.069  -1.465  -3.134
  252   1HG1  ILE  34           HG1R     ILE  34   2.650  -2.555  -5.811
  253   2HG1  ILE  34           HG1S     ILE  34   4.105  -2.135  -4.866
  254   1HG2  ILE  34           HMG2     ILE  34   1.114  -0.095  -5.576
  255   2HG2  ILE  34           HMG2     ILE  34   0.655  -1.809  -5.401
  256   3HG2  ILE  34           HMG2     ILE  34   0.232  -0.639  -4.125
  257   1HD1  ILE  34           HMD1     ILE  34   2.536  -3.475  -3.028
  258   2HD1  ILE  34           HMD1     ILE  34   2.230  -4.360  -4.546
  259   3HD1  ILE  34           HMD1     ILE  34   3.899  -4.163  -3.949
  260    H    GLU  35           HN       GLU  35   1.620   0.443  -2.261
  261    HA   GLU  35           HA       GLU  35   0.789   3.087  -3.313
  262   1HB   GLU  35           HBR      GLU  35  -0.414   0.819  -1.791
  263   2HB   GLU  35           HBS      GLU  35  -0.951   2.363  -1.415
  264   1HG   GLU  35           HGS      GLU  35  -1.183   1.001  -4.063
  265   2HG   GLU  35           HGR      GLU  35  -2.522   1.683  -3.100
  266    H    GLU  36           HN       GLU  36   1.377   4.861  -2.324
  267    HA   GLU  36           HA       GLU  36   2.230   4.801   0.529
  268   1HB   GLU  36           HBR      GLU  36   3.373   5.930  -1.615
  269   2HB   GLU  36           HBS      GLU  36   2.230   7.121  -1.314
  270   1HG   GLU  36           HGS      GLU  36   3.219   6.720   1.219
  271   2HG   GLU  36           HGR      GLU  36   4.701   6.654   0.227
  272    H    ASN  37           HN       ASN  37   1.034   5.686   2.074
  273    HA   ASN  37           HA       ASN  37  -0.526   6.883   3.179
  274   1HB   ASN  37           HBR      ASN  37  -0.594   8.542   0.657
  275   2HB   ASN  37           HBS      ASN  37  -1.244   9.005   2.257
  276   1HD2  ASN  37           HD2Z     ASN  37   2.345   8.758   3.522
  277   2HD2  ASN  37           HD2E     ASN  37   0.968   7.728   3.725
  278    H    ILE  38           HN       ILE  38  -2.149   5.621   3.634
  279    HA   ILE  38           HA       ILE  38  -4.459   5.703   1.754
  280    HB   ILE  38           HB       ILE  38  -3.850   3.515   3.803
  281   1HG1  ILE  38           HG1R     ILE  38  -3.468   3.614   0.792
  282   2HG1  ILE  38           HG1S     ILE  38  -2.230   3.360   2.057
  283   1HG2  ILE  38           HMG2     ILE  38  -6.295   4.228   2.757
  284   2HG2  ILE  38           HMG2     ILE  38  -5.767   2.904   1.685
  285   3HG2  ILE  38           HMG2     ILE  38  -5.865   2.640   3.447
  286   1HD1  ILE  38           HMD1     ILE  38  -4.345   1.353   2.162
  287   2HD1  ILE  38           HMD1     ILE  38  -3.524   1.398   0.578
  288   3HD1  ILE  38           HMD1     ILE  38  -2.574   1.155   2.068
  289    H    ILE  39           HN       ILE  39  -3.926   7.838   3.318
  290    HA   ILE  39           HA       ILE  39  -5.937   7.599   5.507
  291    HB   ILE  39           HB       ILE  39  -3.599   9.549   5.214
  292   1HG1  ILE  39           HG1R     ILE  39  -3.129   7.138   5.853
  293   2HG1  ILE  39           HG1S     ILE  39  -2.529   8.394   6.973
  294   1HG2  ILE  39           HMG2     ILE  39  -5.862   9.447   7.191
  295   2HG2  ILE  39           HMG2     ILE  39  -4.279  10.148   7.622
  296   3HG2  ILE  39           HMG2     ILE  39  -5.220  10.834   6.271
  297   1HD1  ILE  39           HMD1     ILE  39  -5.039   6.735   7.355
  298   2HD1  ILE  39           HMD1     ILE  39  -3.474   6.471   8.168
  299   3HD1  ILE  39           HMD1     ILE  39  -4.401   7.962   8.481
  300    H    ASP  40           HN       ASP  40  -5.142   8.920   2.450
  301    HA   ASP  40           HA       ASP  40  -6.490   9.945   0.935
  302   1HB   ASP  40           HBR      ASP  40  -8.725  10.210   2.912
  303   2HB   ASP  40           HBS      ASP  40  -8.771  10.045   1.133
  304    H    MET  41           HN       MET  41  -8.393  12.046   1.487
  305    HA   MET  41           HA       MET  41  -8.381  14.326   1.627
  306   1HB   MET  41           HBR      MET  41  -6.013  14.001   3.498
  307   2HB   MET  41           HBS      MET  41  -6.929  15.503   3.186
  308   1HG   MET  41           HGS      MET  41  -8.998  14.364   4.032
  309   2HG   MET  41           HGR      MET  41  -8.006  12.937   4.418
  310   1HE   MET  41           HMEB     MET  41  -5.795  13.203   5.374
  311   2HE   MET  41           HMEC     MET  41  -5.137  14.600   6.264
  312   3HE   MET  41           HMEA     MET  41  -6.083  13.361   7.126
  313    H    GLY  42           HN       GLY  42  -7.171  12.839  -0.424
  314   1HA   GLY  42           HAS      GLY  42  -6.495  14.225  -2.397
  315   2HA   GLY  42           HAR      GLY  42  -5.182  14.867  -1.372
  316    HA   PRO  43           HA       PRO  43  -4.770  10.104  -2.309
  317   1HB   PRO  43           HBS      PRO  43  -5.304   9.726  -4.976
  318   2HB   PRO  43           HBR      PRO  43  -6.115   9.072  -3.708
  319   1HG   PRO  43           HGS      PRO  43  -6.864  11.180  -5.349
  320   2HG   PRO  43           HGR      PRO  43  -7.812  10.333  -4.269
  321   1HD   PRO  43           HDS      PRO  43  -6.988  12.841  -3.902
  322   2HD   PRO  43           HDR      PRO  43  -7.517  11.841  -2.693
  323    H    GLU  44           HN       GLU  44  -4.138  10.962  -5.571
  324    HA   GLU  44           HA       GLU  44  -1.297  11.424  -5.225
  325   1HB   GLU  44           HBS      GLU  44  -2.362   8.844  -5.005
  326   2HB   GLU  44           HBR      GLU  44  -1.664   8.849  -6.531
  327   1HG   GLU  44           HGS      GLU  44  -0.039  10.069  -4.360
  328   2HG   GLU  44           HGR      GLU  44  -0.316   8.323  -4.120
  329    H    TRP  45           HN       TRP  45  -0.577  10.024  -7.631
  330    HA   TRP  45           HA       TRP  45  -0.313  10.557  -9.834
  331   1HB   TRP  45           HBR      TRP  45  -2.224  10.235 -11.146
  332   2HB   TRP  45           HBS      TRP  45  -2.403   9.207  -9.695
  333    HD1  TRP  45           HD1      TRP  45  -3.580  12.830 -10.608
  334    HE1  TRP  45           HE1      TRP  45  -6.045  13.060  -9.923
  335    HE3  TRP  45           HE3      TRP  45  -4.304   8.114  -8.843
  336    HZ2  TRP  45           HZ2      TRP  45  -8.045  11.399  -8.869
  337    HZ3  TRP  45           HZ3      TRP  45  -6.533   7.494  -8.037
  338    HH2  TRP  45           HH2      TRP  45  -8.374   9.092  -8.051
  339    H    ARG  46           HN       ARG  46  -0.605  12.841  -7.819
  340    HA   ARG  46           HA       ARG  46  -0.286  15.106  -7.920
  341   1HB   ARG  46           HBR      ARG  46   1.072  13.777 -10.026
  342   2HB   ARG  46           HBS      ARG  46   0.441  15.311 -10.692
  343   1HG   ARG  46           HGS      ARG  46   2.063  16.461  -9.698
  344   2HG   ARG  46           HGR      ARG  46   1.618  15.788  -8.105
  345   1HD   ARG  46           HDS      ARG  46   2.990  13.853  -9.770
  346   2HD   ARG  46           HDR      ARG  46   3.952  15.338  -9.526
  347    HE   ARG  46           HE       ARG  46   3.602  13.298  -7.632
  348   1HH1  ARG  46           HH1Z     ARG  46   3.637  16.817  -7.860
  349   2HH1  ARG  46           HH1E     ARG  46   3.912  17.032  -6.163
  350   1HH2  ARG  46           HH2Z     ARG  46   3.831  13.623  -5.400
  351   2HH2  ARG  46           HH2E     ARG  46   4.024  15.225  -4.771
  352    H    ALA  47           HN       ALA  47  -2.112  16.225  -7.714
  353    HA   ALA  47           HA       ALA  47  -2.836  17.873  -9.836
  354   1HB   ALA  47           HMBA     ALA  47  -4.018  15.960 -10.773
  355   2HB   ALA  47           HMBC     ALA  47  -4.948  15.776  -9.266
  356   3HB   ALA  47           HMBB     ALA  47  -5.157  17.234 -10.268
  357    H    PHE  48           HN       PHE  48  -4.438  19.449  -9.246
  358    HA   PHE  48           HA       PHE  48  -4.974  19.618  -6.335
  359   1HB   PHE  48           HBR      PHE  48  -5.211  21.666  -8.569
  360   2HB   PHE  48           HBS      PHE  48  -6.001  21.883  -6.980
  361    HD1  PHE  48           HD2      PHE  48  -2.709  21.801  -8.720
  362    HD2  PHE  48           HD1      PHE  48  -4.800  22.287  -5.039
  363    HE1  PHE  48           HE2      PHE  48  -0.659  22.713  -7.682
  364    HE2  PHE  48           HE1      PHE  48  -2.776  23.187  -3.984
  365    HZ   PHE  48           HZ       PHE  48  -0.688  23.344  -5.285
  366    H    ASP  49           HN       ASP  49  -6.444  17.880  -6.316
  367    HA   ASP  49           HA       ASP  49  -9.109  18.574  -7.273
  368   1HB   ASP  49           HBR      ASP  49  -7.608  16.948  -8.896
  369   2HB   ASP  49           HBS      ASP  49  -8.575  15.791  -7.935
  370    H    ALA  50           HN       ALA  50 -10.226  18.554  -5.517
  371    HA   ALA  50           HA       ALA  50  -9.393  16.760  -3.318
  372   1HB   ALA  50           HMBC     ALA  50 -11.022  19.313  -3.391
  373   2HB   ALA  50           HMBA     ALA  50 -10.685  18.359  -1.924
  374   3HB   ALA  50           HMBB     ALA  50  -9.344  19.109  -2.827
   
  No H/Q in entry =         374
  Start of MODEL    8
    1   1H    MET   1           HNC      MET   1  -7.955 -18.361   2.068
    2   2H    MET   1           HN       MET   1  -6.496 -19.094   2.042
    3   3H    MET   1           HNB      MET   1  -7.734 -19.765   2.871
    4    HA   MET   1           HA       MET   1  -7.813 -17.959   4.388
    5   1HB   MET   1           HBR      MET   1  -5.293 -19.549   4.009
    6   2HB   MET   1           HBS      MET   1  -5.381 -18.317   5.300
    7   1HG   MET   1           HGS      MET   1  -7.307 -19.418   6.296
    8   2HG   MET   1           HGR      MET   1  -7.423 -20.537   4.916
    9   1HE   MET   1           HMEA     MET   1  -7.300 -21.771   7.737
   10   2HE   MET   1           HMEC     MET   1  -7.189 -22.743   6.247
   11   3HE   MET   1           HMEB     MET   1  -6.035 -23.015   7.576
   12    H    VAL   2           HN       VAL   2  -4.929 -17.780   2.271
   13    HA   VAL   2           HA       VAL   2  -5.006 -14.823   2.580
   14    HB   VAL   2           HB       VAL   2  -2.648 -16.439   1.615
   15   1HG1  VAL   2           HMGS     VAL   2  -3.074 -13.572   2.413
   16   2HG1  VAL   2           HMGS     VAL   2  -1.458 -14.318   2.459
   17   3HG1  VAL   2           HMGS     VAL   2  -2.360 -14.242   0.926
   18   1HG2  VAL   2           HMGR     VAL   2  -3.387 -16.992   4.012
   19   2HG2  VAL   2           HMGR     VAL   2  -1.692 -16.520   3.741
   20   3HG2  VAL   2           HMGR     VAL   2  -2.847 -15.344   4.414
   21    H    ASN   3           HN       ASN   3  -6.661 -14.588   1.097
   22    HA   ASN   3           HA       ASN   3  -5.749 -14.940  -1.704
   23   1HB   ASN   3           HBS      ASN   3  -8.046 -15.934  -0.801
   24   2HB   ASN   3           HBR      ASN   3  -8.592 -14.284  -1.215
   25   1HD2  ASN   3           HD2Z     ASN   3  -8.101 -14.646  -4.728
   26   2HD2  ASN   3           HD2E     ASN   3  -8.067 -13.502  -3.427
   27    H    LYS   4           HN       LYS   4  -5.288 -13.231  -2.848
   28    HA   LYS   4           HA       LYS   4  -5.785 -10.559  -1.614
   29   1HB   LYS   4           HBR      LYS   4  -3.217 -11.539  -2.904
   30   2HB   LYS   4           HBS      LYS   4  -3.520  -9.929  -2.191
   31   1HG   LYS   4           HGR      LYS   4  -3.059 -10.648  -0.113
   32   2HG   LYS   4           HGS      LYS   4  -4.052 -12.120  -0.313
   33   1HD   LYS   4           HDS      LYS   4  -1.728 -12.657   0.157
   34   2HD   LYS   4           HDR      LYS   4  -2.303 -13.288  -1.362
   35   1HE   LYS   4           HES      LYS   4  -1.274 -10.970  -2.248
   36   2HE   LYS   4           HER      LYS   4  -0.234 -11.268  -0.826
   37   1HZ   LYS   4           HZA      LYS   4  -0.741 -13.296  -2.885
   38   2HZ   LYS   4           HZB      LYS   4   0.523 -12.265  -2.951
   39   3HZ   LYS   4           HZC      LYS   4   0.396 -13.323  -1.713
   40    H    GLN   5           HN       GLN   5  -4.387 -12.065  -4.557
   41    HA   GLN   5           HA       GLN   5  -4.567 -11.538  -6.773
   42   1HB   GLN   5           HBS      GLN   5  -6.830  -9.633  -6.193
   43   2HB   GLN   5           HBR      GLN   5  -6.415 -10.470  -7.716
   44   1HG   GLN   5           HGS      GLN   5  -6.836 -12.596  -6.106
   45   2HG   GLN   5           HGR      GLN   5  -7.944 -11.412  -5.356
   46   1HE2  GLN   5           HE2Z     GLN   5  -9.798 -13.344  -7.902
   47   2HE2  GLN   5           HE2E     GLN   5  -8.867 -13.734  -6.494
   48    H    LYS   6           HN       LYS   6  -3.249  -9.983  -4.507
   49    HA   LYS   6           HA       LYS   6  -2.300  -7.849  -6.343
   50   1HB   LYS   6           HBS      LYS   6  -1.542  -6.727  -4.083
   51   2HB   LYS   6           HBR      LYS   6  -3.155  -6.417  -4.786
   52   1HG   LYS   6           HGR      LYS   6  -3.821  -8.482  -3.232
   53   2HG   LYS   6           HGS      LYS   6  -2.386  -7.937  -2.317
   54   1HD   LYS   6           HDS      LYS   6  -3.572  -6.376  -1.346
   55   2HD   LYS   6           HDR      LYS   6  -3.800  -5.617  -2.898
   56   1HE   LYS   6           HES      LYS   6  -5.974  -5.875  -2.475
   57   2HE   LYS   6           HER      LYS   6  -5.680  -7.537  -3.059
   58   1HZ   LYS   6           HZB      LYS   6  -5.129  -7.973  -0.630
   59   2HZ   LYS   6           HZC      LYS   6  -5.932  -6.588  -0.311
   60   3HZ   LYS   6           HZA      LYS   6  -6.701  -7.826  -1.045
   61    H    VAL   7           HN       VAL   7  -0.072  -7.474  -6.245
   62    HA   VAL   7           HA       VAL   7   1.613  -9.483  -4.904
   63    HB   VAL   7           HB       VAL   7   2.405 -10.431  -6.957
   64   1HG1  VAL   7           HMGR     VAL   7   0.330 -11.358  -5.836
   65   2HG1  VAL   7           HMGR     VAL   7  -0.607 -10.570  -7.128
   66   3HG1  VAL   7           HMGR     VAL   7   0.590 -11.824  -7.534
   67   1HG2  VAL   7           HMGS     VAL   7   2.180  -8.525  -8.442
   68   2HG2  VAL   7           HMGS     VAL   7   1.396  -9.963  -9.138
   69   3HG2  VAL   7           HMGS     VAL   7   0.406  -8.679  -8.403
   70    H    CYS   8           HN       CYS   8   3.907  -9.271  -6.117
   71    HA   CYS   8           HA       CYS   8   4.569  -6.396  -6.383
   72   1HB   CYS   8           HBS      CYS   8   5.979  -7.970  -4.974
   73   2HB   CYS   8           HBR      CYS   8   6.452  -8.752  -6.509
   74    HA   PRO   9           HA       PRO   9   4.401  -6.759 -10.796
   75   1HB   PRO   9           HBR      PRO   9   4.888  -3.998 -10.676
   76   2HB   PRO   9           HBS      PRO   9   3.639  -4.781 -11.398
   77   1HG   PRO   9           HGS      PRO   9   3.445  -3.369  -9.169
   78   2HG   PRO   9           HGR      PRO   9   2.320  -4.490  -9.680
   79   1HD   PRO   9           HDS      PRO   9   4.152  -4.711  -7.578
   80   2HD   PRO   9           HDR      PRO   9   2.835  -5.660  -7.893
   81    H    ALA  10           HN       ALA  10   6.798  -6.035  -8.649
   82    HA   ALA  10           HA       ALA  10   8.740  -5.171 -10.693
   83   1HB   ALA  10           HMBC     ALA  10   8.375  -4.439  -8.100
   84   2HB   ALA  10           HMBA     ALA  10   9.669  -5.654  -7.936
   85   3HB   ALA  10           HMBB     ALA  10   9.894  -4.254  -9.015
   86    H    CYS  11           HN       CYS  11   8.958  -7.513  -7.983
   87    HA   CYS  11           HA       CYS  11  10.895  -8.954  -9.582
   88   1HB   CYS  11           HBS      CYS  11  11.469 -10.122  -7.552
   89   2HB   CYS  11           HBR      CYS  11  11.414  -8.356  -7.311
   90    H    GLU  12           HN       GLU  12   7.610  -9.253  -9.292
   91    HA   GLU  12           HA       GLU  12   6.034 -10.904  -9.399
   92   1HB   GLU  12           HBR      GLU  12   7.620 -11.438 -11.384
   93   2HB   GLU  12           HBS      GLU  12   8.280 -12.610 -10.380
   94   1HG   GLU  12           HGS      GLU  12   6.429 -13.335 -12.027
   95   2HG   GLU  12           HGR      GLU  12   6.445 -14.068 -10.400
   96    H    SER  13           HN       SER  13   6.871 -10.437  -6.979
   97    HA   SER  13           HA       SER  13   6.626 -13.174  -5.865
   98   1HB   SER  13           HBS      SER  13   7.928 -10.825  -4.464
   99   2HB   SER  13           HBR      SER  13   7.538 -12.400  -3.721
  100    HG   SER  13           HG       SER  13   9.246 -13.239  -4.433
  101    H    ALA  14           HN       ALA  14   5.139 -13.360  -4.140
  102    HA   ALA  14           HA       ALA  14   2.999 -11.342  -4.349
  103   1HB   ALA  14           HMBB     ALA  14   3.052 -14.086  -4.716
  104   2HB   ALA  14           HMBA     ALA  14   2.365 -13.908  -3.082
  105   3HB   ALA  14           HMBC     ALA  14   1.592 -13.095  -4.467
  106    H    GLU  15           HN       GLU  15   5.359 -12.291  -2.204
  107    HA   GLU  15           HA       GLU  15   3.869 -11.730   0.216
  108   1HB   GLU  15           HBR      GLU  15   6.857 -11.757  -0.057
  109   2HB   GLU  15           HBS      GLU  15   5.893 -12.120   1.268
  110   1HG   GLU  15           HGS      GLU  15   5.226 -14.194   0.600
  111   2HG   GLU  15           HGR      GLU  15   5.542 -13.917  -1.134
  112    H    LEU  16           HN       LEU  16   3.160  -9.734   0.535
  113    HA   LEU  16           HA       LEU  16   5.169  -7.533   0.443
  114   1HB   LEU  16           HBR      LEU  16   2.153  -7.312   0.275
  115   2HB   LEU  16           HBS      LEU  16   3.373  -6.042  -0.024
  116    HG   LEU  16           HG       LEU  16   2.814  -8.468  -1.749
  117   1HD1  LEU  16           HMDR     LEU  16   1.605  -5.911  -1.614
  118   2HD1  LEU  16           HMDR     LEU  16   2.659  -5.908  -3.050
  119   3HD1  LEU  16           HMDR     LEU  16   1.404  -7.159  -2.869
  120   1HD2  LEU  16           HMDS     LEU  16   5.233  -7.373  -1.394
  121   2HD2  LEU  16           HMDS     LEU  16   4.664  -7.954  -2.979
  122   3HD2  LEU  16           HMDS     LEU  16   4.583  -6.218  -2.585
  123    H    ILE  17           HN       ILE  17   4.285  -5.686   1.977
  124    HA   ILE  17           HA       ILE  17   3.389  -6.687   4.544
  125    HB   ILE  17           HB       ILE  17   5.539  -5.839   5.707
  126   1HG1  ILE  17           HG1R     ILE  17   6.624  -6.267   2.896
  127   2HG1  ILE  17           HG1S     ILE  17   6.526  -4.722   3.789
  128   1HG2  ILE  17           HMG2     ILE  17   4.823  -8.236   5.529
  129   2HG2  ILE  17           HMG2     ILE  17   5.899  -8.382   4.115
  130   3HG2  ILE  17           HMG2     ILE  17   6.577  -7.974   5.713
  131   1HD1  ILE  17           HMD1     ILE  17   7.986  -6.583   5.388
  132   2HD1  ILE  17           HMD1     ILE  17   8.648  -6.623   3.733
  133   3HD1  ILE  17           HMD1     ILE  17   8.554  -5.077   4.618
  134    H    TYR  18           HN       TYR  18   2.318  -5.146   5.527
  135    HA   TYR  18           HA       TYR  18   2.312  -2.507   4.215
  136   1HB   TYR  18           HBS      TYR  18   0.206  -3.726   4.301
  137   2HB   TYR  18           HBR      TYR  18   0.319  -3.854   6.079
  138    HD1  TYR  18           HD1      TYR  18   1.101  -0.805   4.074
  139    HD2  TYR  18           HD2      TYR  18  -1.704  -2.729   6.627
  140    HE1  TYR  18           HE1      TYR  18  -0.206   1.273   4.195
  141    HE2  TYR  18           HE2      TYR  18  -2.999  -0.651   6.785
  142    HH   TYR  18           HH       TYR  18  -2.322   2.099   4.728
  143    H    ASP  19           HN       ASP  19   2.569  -0.601   5.238
  144    HA   ASP  19           HA       ASP  19   3.816  -0.794   7.926
  145   1HB   ASP  19           HBS      ASP  19   5.223  -0.183   5.797
  146   2HB   ASP  19           HBR      ASP  19   4.505   1.431   6.066
  147    HA   PRO  20           HA       PRO  20  -0.048   1.265   8.519
  148   1HB   PRO  20           HBS      PRO  20   0.206   0.729  11.247
  149   2HB   PRO  20           HBR      PRO  20  -0.938   0.166  10.213
  150   1HG   PRO  20           HGS      PRO  20   1.014  -1.281  11.277
  151   2HG   PRO  20           HGR      PRO  20   0.135  -1.734   9.933
  152   1HD   PRO  20           HDS      PRO  20   2.778  -0.793  10.057
  153   2HD   PRO  20           HDR      PRO  20   2.037  -1.620   8.831
  154    H    GLU  21           HN       GLU  21   2.927   2.128   9.659
  155    HA   GLU  21           HA       GLU  21   2.017   4.351  11.300
  156   1HB   GLU  21           HBR      GLU  21   4.609   3.113  10.445
  157   2HB   GLU  21           HBS      GLU  21   4.616   4.701  10.987
  158   1HG   GLU  21           HGS      GLU  21   3.331   4.006  13.048
  159   2HG   GLU  21           HGR      GLU  21   3.752   2.315  12.667
  160    H    ARG  22           HN       ARG  22   3.508   3.885   8.104
  161    HA   ARG  22           HA       ARG  22   3.078   6.752   7.491
  162   1HB   ARG  22           HBR      ARG  22   4.737   4.559   6.333
  163   2HB   ARG  22           HBS      ARG  22   4.079   5.782   5.207
  164   1HG   ARG  22           HGS      ARG  22   5.088   7.525   6.807
  165   2HG   ARG  22           HGR      ARG  22   6.002   6.161   7.510
  166   1HD   ARG  22           HDS      ARG  22   6.853   5.635   5.251
  167   2HD   ARG  22           HDR      ARG  22   6.032   7.100   4.642
  168    HE   ARG  22           HE       ARG  22   7.752   8.359   5.505
  169   1HH1  ARG  22           HH1Z     ARG  22   7.606   5.361   7.353
  170   2HH1  ARG  22           HH1E     ARG  22   9.136   5.630   8.117
  171   1HH2  ARG  22           HH2Z     ARG  22   9.809   8.613   6.425
  172   2HH2  ARG  22           HH2E     ARG  22  10.383   7.470   7.593
  173    H    GLY  23           HN       GLY  23   1.743   3.595   7.018
  174   1HA   GLY  23           HAR      GLY  23  -0.181   2.895   5.890
  175   2HA   GLY  23           HAS      GLY  23  -0.422   4.556   5.287
  176    H    GLU  24           HN       GLU  24   2.482   2.491   5.096
  177    HA   GLU  24           HA       GLU  24   2.272   2.588   2.122
  178   1HB   GLU  24           HBR      GLU  24   4.086   3.712   3.725
  179   2HB   GLU  24           HBS      GLU  24   4.701   2.151   3.767
  180   1HG   GLU  24           HGR      GLU  24   5.980   2.881   1.956
  181   2HG   GLU  24           HGS      GLU  24   4.541   2.180   1.167
  182    H    ILE  25           HN       ILE  25   2.041   0.756   1.086
  183    HA   ILE  25           HA       ILE  25   2.706  -1.823   2.382
  184    HB   ILE  25           HB       ILE  25   1.461  -1.347  -0.365
  185   1HG1  ILE  25           HG1R     ILE  25  -0.714  -1.967   0.947
  186   2HG1  ILE  25           HG1S     ILE  25   0.205  -1.428   2.381
  187   1HG2  ILE  25           HMG2     ILE  25   1.844  -3.749   1.382
  188   2HG2  ILE  25           HMG2     ILE  25   0.449  -3.669   0.274
  189   3HG2  ILE  25           HMG2     ILE  25   2.108  -3.551  -0.370
  190   1HD1  ILE  25           HMD1     ILE  25   0.225   0.428   0.073
  191   2HD1  ILE  25           HMD1     ILE  25  -1.353   0.192   0.872
  192   3HD1  ILE  25           HMD1     ILE  25   0.052   0.751   1.819
  193    H    VAL  26           HN       VAL  26   4.446  -2.956   1.883
  194    HA   VAL  26           HA       VAL  26   6.099  -2.077  -0.428
  195    HB   VAL  26           HB       VAL  26   7.164  -3.085   2.206
  196   1HG1  VAL  26           HMGR     VAL  26   8.347  -2.142  -0.296
  197   2HG1  VAL  26           HMGR     VAL  26   8.991  -1.317   1.144
  198   3HG1  VAL  26           HMGR     VAL  26   9.055  -3.092   1.032
  199   1HG2  VAL  26           HMGS     VAL  26   6.475  -0.244   1.449
  200   2HG2  VAL  26           HMGS     VAL  26   5.942  -1.178   2.868
  201   3HG2  VAL  26           HMGS     VAL  26   7.640  -0.660   2.731
  202    H    CYS  27           HN       CYS  27   7.820  -3.728  -0.965
  203    HA   CYS  27           HA       CYS  27   6.734  -6.454  -0.916
  204   1HB   CYS  27           HBS      CYS  27   7.677  -5.379  -2.970
  205   2HB   CYS  27           HBR      CYS  27   9.284  -5.441  -2.194
  206    H    ALA  28           HN       ALA  28   7.514  -8.123   0.189
  207    HA   ALA  28           HA       ALA  28   9.788  -7.676   2.044
  208   1HB   ALA  28           HMBA     ALA  28   7.342  -9.199   2.135
  209   2HB   ALA  28           HMBB     ALA  28   8.751 -10.268   2.353
  210   3HB   ALA  28           HMBC     ALA  28   8.529  -8.859   3.421
  211    H    LYS  29           HN       LYS  29   9.991  -7.935  -0.909
  212    HA   LYS  29           HA       LYS  29  11.902 -10.208  -0.888
  213   1HB   LYS  29           HBR      LYS  29   9.706 -10.202  -2.549
  214   2HB   LYS  29           HBS      LYS  29  10.958  -9.433  -3.564
  215   1HG   LYS  29           HGR      LYS  29  10.793 -11.920  -3.834
  216   2HG   LYS  29           HGS      LYS  29  12.411 -11.344  -3.337
  217   1HD   LYS  29           HDS      LYS  29  12.040 -12.001  -1.073
  218   2HD   LYS  29           HDR      LYS  29  10.362 -12.348  -1.388
  219   1HE   LYS  29           HES      LYS  29  10.803 -14.427  -1.973
  220   2HE   LYS  29           HER      LYS  29  11.979 -13.864  -3.195
  221   1HZ   LYS  29           HZB      LYS  29  13.610 -13.728  -1.441
  222   2HZ   LYS  29           HZC      LYS  29  12.535 -14.269  -0.336
  223   3HZ   LYS  29           HZA      LYS  29  13.018 -15.246  -1.553
  224    H    CYS  30           HN       CYS  30  11.015  -7.490  -3.057
  225    HA   CYS  30           HA       CYS  30  13.870  -6.999  -3.373
  226   1HB   CYS  30           HBS      CYS  30  13.233  -5.649  -5.296
  227   2HB   CYS  30           HBR      CYS  30  12.551  -7.298  -5.341
  228    H    GLY  31           HN       GLY  31  11.592  -5.763  -1.321
  229   1HA   GLY  31           HAR      GLY  31  11.840  -3.984   0.134
  230   2HA   GLY  31           HAS      GLY  31  13.088  -3.301  -0.945
  231    H    TYR  32           HN       TYR  32  10.497  -3.999  -2.882
  232    HA   TYR  32           HA       TYR  32  10.339  -1.130  -3.476
  233   1HB   TYR  32           HBS      TYR  32  10.474  -2.656  -5.345
  234   2HB   TYR  32           HBR      TYR  32   9.057  -3.573  -4.764
  235    HD1  TYR  32           HD1      TYR  32   9.739   0.090  -5.376
  236    HD2  TYR  32           HD2      TYR  32   7.273  -3.279  -6.187
  237    HE1  TYR  32           HE1      TYR  32   8.268   1.504  -6.746
  238    HE2  TYR  32           HE2      TYR  32   5.776  -1.871  -7.528
  239    HH   TYR  32           HH       TYR  32   5.514   1.251  -7.151
  240    H    VAL  33           HN       VAL  33   8.817   0.202  -2.854
  241    HA   VAL  33           HA       VAL  33   6.561  -0.526  -1.219
  242    HB   VAL  33           HB       VAL  33   7.121   1.957  -2.857
  243   1HG1  VAL  33           HMGR     VAL  33   5.027   1.494  -0.719
  244   2HG1  VAL  33           HMGR     VAL  33   5.447   3.070  -1.432
  245   3HG1  VAL  33           HMGR     VAL  33   4.743   1.791  -2.451
  246   1HG2  VAL  33           HMGS     VAL  33   8.726   1.348  -0.981
  247   2HG2  VAL  33           HMGS     VAL  33   7.984   2.965  -0.925
  248   3HG2  VAL  33           HMGS     VAL  33   7.375   1.669   0.132
  249    H    ILE  34           HN       ILE  34   4.328  -0.263  -1.865
  250    HA   ILE  34           HA       ILE  34   3.831  -0.968  -4.707
  251    HB   ILE  34           HB       ILE  34   2.283  -1.497  -2.130
  252   1HG1  ILE  34           HG1R     ILE  34   4.294  -2.858  -2.540
  253   2HG1  ILE  34           HG1S     ILE  34   2.793  -3.827  -2.530
  254   1HG2  ILE  34           HMG2     ILE  34   1.349  -1.575  -4.925
  255   2HG2  ILE  34           HMG2     ILE  34   0.992  -3.028  -3.955
  256   3HG2  ILE  34           HMG2     ILE  34   0.440  -1.426  -3.398
  257   1HD1  ILE  34           HMD1     ILE  34   3.878  -2.855  -5.148
  258   2HD1  ILE  34           HMD1     ILE  34   4.673  -4.228  -4.331
  259   3HD1  ILE  34           HMD1     ILE  34   2.947  -4.329  -4.768
  260    H    GLU  35           HN       GLU  35   1.749   0.425  -2.183
  261    HA   GLU  35           HA       GLU  35   1.874   3.050  -3.509
  262   1HB   GLU  35           HBR      GLU  35  -0.545   1.331  -3.222
  263   2HB   GLU  35           HBS      GLU  35  -0.702   2.936  -2.757
  264   1HG   GLU  35           HGS      GLU  35  -1.401   2.953  -4.978
  265   2HG   GLU  35           HGR      GLU  35   0.202   3.738  -5.011
  266    H    GLU  36           HN       GLU  36   0.206   4.454  -1.958
  267    HA   GLU  36           HA       GLU  36   0.345   3.555   0.829
  268   1HB   GLU  36           HBR      GLU  36   1.217   5.778   1.534
  269   2HB   GLU  36           HBS      GLU  36   2.289   4.682   0.850
  270   1HG   GLU  36           HGS      GLU  36   2.263   5.734  -1.321
  271   2HG   GLU  36           HGR      GLU  36   1.132   6.998  -0.766
  272    H    ASN  37           HN       ASN  37  -1.891   3.337   0.487
  273    HA   ASN  37           HA       ASN  37  -3.465   5.648   1.129
  274   1HB   ASN  37           HBS      ASN  37  -4.804   5.682  -0.947
  275   2HB   ASN  37           HBR      ASN  37  -3.138   6.307  -1.105
  276   1HD2  ASN  37           HD2Z     ASN  37  -2.092   3.956  -3.479
  277   2HD2  ASN  37           HD2E     ASN  37  -1.644   5.228  -2.391
  278    H    ILE  38           HN       ILE  38  -4.242   4.471   2.768
  279    HA   ILE  38           HA       ILE  38  -6.128   2.299   1.985
  280    HB   ILE  38           HB       ILE  38  -6.220   1.745   4.422
  281   1HG1  ILE  38           HG1R     ILE  38  -3.810   3.541   4.813
  282   2HG1  ILE  38           HG1S     ILE  38  -5.481   4.129   5.047
  283   1HG2  ILE  38           HMG2     ILE  38  -4.725   0.467   2.990
  284   2HG2  ILE  38           HMG2     ILE  38  -3.418   1.644   3.285
  285   3HG2  ILE  38           HMG2     ILE  38  -4.046   0.653   4.628
  286   1HD1  ILE  38           HMD1     ILE  38  -4.587   1.645   6.472
  287   2HD1  ILE  38           HMD1     ILE  38  -4.072   3.243   7.076
  288   3HD1  ILE  38           HMD1     ILE  38  -5.808   2.858   6.939
  289    H    ILE  39           HN       ILE  39  -8.212   2.701   2.081
  290    HA   ILE  39           HA       ILE  39 -10.012   4.046   1.710
  291    HB   ILE  39           HB       ILE  39 -10.923   5.112   3.671
  292   1HG1  ILE  39           HG1R     ILE  39  -8.539   6.044   4.291
  293   2HG1  ILE  39           HG1S     ILE  39  -9.824   5.853   5.512
  294   1HG2  ILE  39           HMG2     ILE  39  -9.898   2.394   3.717
  295   2HG2  ILE  39           HMG2     ILE  39 -10.188   3.045   5.351
  296   3HG2  ILE  39           HMG2     ILE  39 -11.501   3.047   4.146
  297   1HD1  ILE  39           HMD1     ILE  39  -8.214   3.452   5.371
  298   2HD1  ILE  39           HMD1     ILE  39  -7.193   4.894   5.616
  299   3HD1  ILE  39           HMD1     ILE  39  -8.530   4.545   6.744
  300    H    ASP  40           HN       ASP  40  -7.306   5.177   0.987
  301    HA   ASP  40           HA       ASP  40  -7.941   8.061   1.236
  302   1HB   ASP  40           HBS      ASP  40  -5.858   6.867   2.357
  303   2HB   ASP  40           HBR      ASP  40  -5.148   7.193   0.750
  304    H    MET  41           HN       MET  41  -5.926   8.946  -0.525
  305    HA   MET  41           HA       MET  41  -7.416   8.530  -3.028
  306   1HB   MET  41           HBS      MET  41  -6.232  10.762  -1.797
  307   2HB   MET  41           HBR      MET  41  -5.236  10.412  -3.239
  308   1HG   MET  41           HGS      MET  41  -7.178  10.517  -4.685
  309   2HG   MET  41           HGR      MET  41  -8.272  10.582  -3.282
  310   1HE   MET  41           HMEC     MET  41  -5.764  11.972  -5.445
  311   2HE   MET  41           HMEA     MET  41  -6.754  13.398  -5.843
  312   3HE   MET  41           HMEB     MET  41  -5.281  13.583  -4.859
  313    H    GLY  42           HN       GLY  42  -3.948   9.170  -2.559
  314   1HA   GLY  42           HAR      GLY  42  -2.776   6.724  -2.986
  315   2HA   GLY  42           HAS      GLY  42  -3.192   7.273  -4.633
  316    HA   PRO  43           HA       PRO  43   0.972   8.686  -3.758
  317   1HB   PRO  43           HBR      PRO  43   1.637   8.908  -6.371
  318   2HB   PRO  43           HBS      PRO  43   1.978   7.630  -5.401
  319   1HG   PRO  43           HGS      PRO  43   0.037   7.819  -7.390
  320   2HG   PRO  43           HGR      PRO  43   0.696   6.445  -6.710
  321   1HD   PRO  43           HDS      PRO  43  -1.760   7.360  -6.197
  322   2HD   PRO  43           HDR      PRO  43  -0.937   6.286  -5.246
  323    H    GLU  44           HN       GLU  44   2.426  10.483  -4.379
  324    HA   GLU  44           HA       GLU  44   0.786  12.913  -4.940
  325   1HB   GLU  44           HBR      GLU  44   2.326  12.608  -2.883
  326   2HB   GLU  44           HBS      GLU  44   3.597  12.629  -3.978
  327   1HG   GLU  44           HGS      GLU  44   3.128  14.842  -2.866
  328   2HG   GLU  44           HGR      GLU  44   3.347  14.908  -4.636
  329    H    TRP  45           HN       TRP  45   2.198  14.569  -6.181
  330    HA   TRP  45           HA       TRP  45   2.981  15.190  -8.228
  331   1HB   TRP  45           HBS      TRP  45   4.316  12.490  -8.098
  332   2HB   TRP  45           HBR      TRP  45   4.444  13.579  -9.509
  333    HD1  TRP  45           HD1      TRP  45   6.139  12.833  -6.297
  334    HE1  TRP  45           HE1      TRP  45   7.892  14.630  -5.752
  335    HE3  TRP  45           HE3      TRP  45   4.718  16.321  -9.717
  336    HZ2  TRP  45           HZ2      TRP  45   8.588  17.175  -6.704
  337    HZ3  TRP  45           HZ3      TRP  45   5.976  18.419  -9.844
  338    HH2  TRP  45           HH2      TRP  45   7.876  18.846  -8.378
  339    H    ARG  46           HN       ARG  46   2.576  14.843 -10.510
  340    HA   ARG  46           HA       ARG  46   1.021  14.544 -12.168
  341   1HB   ARG  46           HBR      ARG  46   1.481  11.879 -10.947
  342   2HB   ARG  46           HBS      ARG  46   0.015  12.042 -11.956
  343   1HG   ARG  46           HGS      ARG  46   2.843  12.703 -12.843
  344   2HG   ARG  46           HGR      ARG  46   1.964  11.194 -13.221
  345   1HD   ARG  46           HDS      ARG  46   0.157  13.036 -14.008
  346   2HD   ARG  46           HDR      ARG  46   1.681  13.911 -14.327
  347    HE   ARG  46           HE       ARG  46   0.809  11.375 -15.585
  348   1HH1  ARG  46           HH1Z     ARG  46   3.338  13.803 -15.199
  349   2HH1  ARG  46           HH1E     ARG  46   4.025  13.491 -16.758
  350   1HH2  ARG  46           HH2Z     ARG  46   1.658  11.087 -17.667
  351   2HH2  ARG  46           HH2E     ARG  46   3.077  11.954 -18.154
  352    H    ALA  47           HN       ALA  47  -0.435  16.072 -11.316
  353    HA   ALA  47           HA       ALA  47  -3.053  15.200 -10.960
  354   1HB   ALA  47           HMBA     ALA  47  -1.593  15.698  -8.376
  355   2HB   ALA  47           HMBC     ALA  47  -3.339  16.022  -8.530
  356   3HB   ALA  47           HMBB     ALA  47  -2.708  14.380  -8.819
  357    H    PHE  48           HN       PHE  48  -4.541  16.964 -10.486
  358    HA   PHE  48           HA       PHE  48  -3.337  19.505 -11.454
  359   1HB   PHE  48           HBR      PHE  48  -5.373  17.908 -12.609
  360   2HB   PHE  48           HBS      PHE  48  -6.196  19.339 -11.923
  361    HD1  PHE  48           HD1      PHE  48  -3.742  18.098 -14.283
  362    HD2  PHE  48           HD2      PHE  48  -5.774  21.584 -12.913
  363    HE1  PHE  48           HE1      PHE  48  -2.880  19.335 -16.219
  364    HE2  PHE  48           HE2      PHE  48  -4.920  22.852 -14.857
  365    HZ   PHE  48           HZ       PHE  48  -3.417  21.729 -16.476
  366    H    ASP  49           HN       ASP  49  -5.126  18.024  -8.935
  367    HA   ASP  49           HA       ASP  49  -6.132  20.590  -7.966
  368   1HB   ASP  49           HBS      ASP  49  -7.030  19.100  -6.086
  369   2HB   ASP  49           HBR      ASP  49  -7.741  18.993  -7.721
  370    H    ALA  50           HN       ALA  50  -4.099  21.582  -7.698
  371    HA   ALA  50           HA       ALA  50  -3.498  21.710  -4.955
  372   1HB   ALA  50           HMBA     ALA  50  -2.173  19.591  -5.872
  373   2HB   ALA  50           HMBB     ALA  50  -1.007  20.852  -6.346
  374   3HB   ALA  50           HMBC     ALA  50  -1.498  20.688  -4.640
   
  No H/Q in entry =         374
  Start of MODEL    9
    1   1H    MET   1           HNB      MET   1  -1.704  -1.562 -16.684
    2   2H    MET   1           HN       MET   1  -0.150  -2.065 -16.657
    3   3H    MET   1           HNC      MET   1  -0.777  -1.422 -18.021
    4    HA   MET   1           HA       MET   1  -1.907  -3.217 -18.621
    5   1HB   MET   1           HBR      MET   1   0.711  -3.612 -17.911
    6   2HB   MET   1           HBS      MET   1  -0.115  -4.922 -17.021
    7   1HG   MET   1           HGS      MET   1  -1.087  -5.793 -19.052
    8   2HG   MET   1           HGR      MET   1  -0.582  -4.352 -19.969
    9   1HE   MET   1           HMEC     MET   1   1.544  -3.565 -20.236
   10   2HE   MET   1           HMEB     MET   1   2.914  -4.070 -19.214
   11   3HE   MET   1           HMEA     MET   1   2.802  -4.640 -20.899
   12    H    VAL   2           HN       VAL   2  -3.170  -5.079 -18.101
   13    HA   VAL   2           HA       VAL   2  -4.107  -5.096 -15.280
   14    HB   VAL   2           HB       VAL   2  -6.307  -5.943 -16.382
   15   1HG1  VAL   2           HMGS     VAL   2  -5.460  -3.043 -16.285
   16   2HG1  VAL   2           HMGS     VAL   2  -7.142  -3.585 -16.502
   17   3HG1  VAL   2           HMGS     VAL   2  -6.259  -4.000 -15.013
   18   1HG2  VAL   2           HMGR     VAL   2  -4.959  -4.576 -18.692
   19   2HG2  VAL   2           HMGR     VAL   2  -5.913  -6.078 -18.654
   20   3HG2  VAL   2           HMGR     VAL   2  -6.728  -4.503 -18.504
   21    H    ASN   3           HN       ASN   3  -3.187  -6.795 -14.426
   22    HA   ASN   3           HA       ASN   3  -4.207  -9.330 -15.250
   23   1HB   ASN   3           HBS      ASN   3  -2.381  -9.373 -16.773
   24   2HB   ASN   3           HBR      ASN   3  -1.223  -8.954 -15.477
   25   1HD2  ASN   3           HD2Z     ASN   3  -2.986 -12.683 -15.158
   26   2HD2  ASN   3           HD2E     ASN   3  -3.951 -11.277 -15.468
   27    H    LYS   4           HN       LYS   4  -4.563 -10.580 -13.578
   28    HA   LYS   4           HA       LYS   4  -4.855 -11.164 -11.390
   29   1HB   LYS   4           HBR      LYS   4  -2.873 -11.616 -10.169
   30   2HB   LYS   4           HBS      LYS   4  -2.575 -11.985 -11.890
   31   1HG   LYS   4           HGR      LYS   4  -1.284  -9.926 -12.143
   32   2HG   LYS   4           HGS      LYS   4  -1.642  -9.468 -10.453
   33   1HD   LYS   4           HDS      LYS   4   0.167 -10.505  -9.797
   34   2HD   LYS   4           HDR      LYS   4  -0.589 -12.009 -10.250
   35   1HE   LYS   4           HES      LYS   4   0.429 -10.883 -12.635
   36   2HE   LYS   4           HER      LYS   4   1.692 -10.757 -11.378
   37   1HZ   LYS   4           HZB      LYS   4   0.306 -13.265 -11.500
   38   2HZ   LYS   4           HZC      LYS   4   1.239 -12.933 -12.799
   39   3HZ   LYS   4           HZA      LYS   4   1.897 -12.956 -11.304
   40    H    GLN   5           HN       GLN   5  -3.703 -10.429  -9.032
   41    HA   GLN   5           HA       GLN   5  -3.934  -7.551  -8.736
   42   1HB   GLN   5           HBR      GLN   5  -6.249  -9.160  -8.209
   43   2HB   GLN   5           HBS      GLN   5  -5.620  -8.491  -6.677
   44   1HG   GLN   5           HGS      GLN   5  -5.504  -6.367  -8.488
   45   2HG   GLN   5           HGR      GLN   5  -7.051  -7.188  -8.845
   46   1HE2  GLN   5           HE2Z     GLN   5  -6.874  -4.609  -5.883
   47   2HE2  GLN   5           HE2E     GLN   5  -5.738  -4.738  -7.184
   48    H    LYS   6           HN       LYS   6  -2.718  -6.824  -7.140
   49    HA   LYS   6           HA       LYS   6  -1.468  -6.705  -5.236
   50   1HB   LYS   6           HBS      LYS   6  -3.732  -8.210  -4.587
   51   2HB   LYS   6           HBR      LYS   6  -2.358  -9.153  -3.941
   52   1HG   LYS   6           HGR      LYS   6  -1.568  -7.142  -2.730
   53   2HG   LYS   6           HGS      LYS   6  -2.974  -6.231  -3.350
   54   1HD   LYS   6           HDS      LYS   6  -4.143  -6.873  -1.615
   55   2HD   LYS   6           HDR      LYS   6  -4.084  -8.498  -2.240
   56   1HE   LYS   6           HES      LYS   6  -3.144  -9.036  -0.301
   57   2HE   LYS   6           HER      LYS   6  -1.664  -8.345  -1.024
   58   1HZ   LYS   6           HZA      LYS   6  -3.592  -6.810   0.577
   59   2HZ   LYS   6           HZB      LYS   6  -2.214  -7.452   1.171
   60   3HZ   LYS   6           HZC      LYS   6  -2.146  -6.291   0.023
   61    H    VAL   7           HN       VAL   7   0.353  -7.210  -6.605
   62    HA   VAL   7           HA       VAL   7   1.786  -9.403  -5.382
   63    HB   VAL   7           HB       VAL   7   2.730 -10.349  -7.372
   64   1HG1  VAL   7           HMGR     VAL   7  -0.296 -10.347  -7.491
   65   2HG1  VAL   7           HMGR     VAL   7   0.762 -11.487  -8.356
   66   3HG1  VAL   7           HMGR     VAL   7   0.750 -11.459  -6.576
   67   1HG2  VAL   7           HMGS     VAL   7   2.528  -8.244  -8.753
   68   2HG2  VAL   7           HMGS     VAL   7   2.188  -9.776  -9.594
   69   3HG2  VAL   7           HMGS     VAL   7   0.846  -8.725  -9.082
   70    H    CYS   8           HN       CYS   8   4.181  -9.222  -6.547
   71    HA   CYS   8           HA       CYS   8   4.866  -6.344  -6.747
   72   1HB   CYS   8           HBS      CYS   8   6.137  -7.915  -5.218
   73   2HB   CYS   8           HBR      CYS   8   6.751  -8.700  -6.701
   74    HA   PRO   9           HA       PRO   9   5.183  -6.767 -11.142
   75   1HB   PRO   9           HBR      PRO   9   5.494  -3.994 -11.133
   76   2HB   PRO   9           HBS      PRO   9   4.317  -4.880 -11.856
   77   1HG   PRO   9           HGS      PRO   9   3.961  -3.345  -9.727
   78   2HG   PRO   9           HGR      PRO   9   2.908  -4.541 -10.220
   79   1HD   PRO   9           HDS      PRO   9   4.698  -4.573  -8.054
   80   2HD   PRO   9           HDR      PRO   9   3.383  -5.543  -8.317
   81    H    ALA  10           HN       ALA  10   7.321  -6.067  -8.804
   82    HA   ALA  10           HA       ALA  10   9.448  -5.087 -10.627
   83   1HB   ALA  10           HMBA     ALA  10   8.863  -4.252  -8.161
   84   2HB   ALA  10           HMBB     ALA  10   9.970  -5.583  -7.740
   85   3HB   ALA  10           HMBC     ALA  10  10.521  -4.273  -8.814
   86    H    CYS  11           HN       CYS  11   9.492  -7.375  -7.873
   87    HA   CYS  11           HA       CYS  11  11.640  -8.709  -9.275
   88   1HB   CYS  11           HBS      CYS  11  12.152  -9.788  -7.197
   89   2HB   CYS  11           HBR      CYS  11  11.898  -8.038  -6.972
   90    H    GLU  12           HN       GLU  12   8.374  -9.234  -9.272
   91    HA   GLU  12           HA       GLU  12   6.937 -10.985  -9.548
   92   1HB   GLU  12           HBR      GLU  12   9.341 -12.698 -10.177
   93   2HB   GLU  12           HBS      GLU  12   7.723 -12.995 -10.504
   94   1HG   GLU  12           HGS      GLU  12   7.508 -11.635 -12.274
   95   2HG   GLU  12           HGR      GLU  12   8.737 -10.458 -11.738
   96    H    SER  13           HN       SER  13   7.215 -10.387  -7.121
   97    HA   SER  13           HA       SER  13   7.032 -13.048  -5.903
   98   1HB   SER  13           HBS      SER  13   8.347 -10.745  -4.438
   99   2HB   SER  13           HBR      SER  13   7.948 -12.349  -3.762
  100    HG   SER  13           HG       SER  13   9.624 -13.212  -4.540
  101    H    ALA  14           HN       ALA  14   5.367 -13.242  -4.455
  102    HA   ALA  14           HA       ALA  14   3.302 -11.245  -4.994
  103   1HB   ALA  14           HMBC     ALA  14   3.008 -13.643  -5.572
  104   2HB   ALA  14           HMBB     ALA  14   3.117 -14.046  -3.839
  105   3HB   ALA  14           HMBA     ALA  14   1.765 -13.055  -4.440
  106    H    GLU  15           HN       GLU  15   5.340 -11.949  -2.459
  107    HA   GLU  15           HA       GLU  15   3.430 -11.681  -0.223
  108   1HB   GLU  15           HBR      GLU  15   6.449 -11.761  -0.421
  109   2HB   GLU  15           HBS      GLU  15   5.595 -11.512   1.002
  110   1HG   GLU  15           HGS      GLU  15   4.284 -13.717   0.164
  111   2HG   GLU  15           HGR      GLU  15   5.922 -14.107  -0.428
  112    H    LEU  16           HN       LEU  16   2.754  -9.807   0.490
  113    HA   LEU  16           HA       LEU  16   4.602  -7.482   0.429
  114   1HB   LEU  16           HBR      LEU  16   1.651  -7.236  -0.140
  115   2HB   LEU  16           HBS      LEU  16   2.962  -6.055  -0.422
  116    HG   LEU  16           HG       LEU  16   2.766  -8.651  -1.950
  117   1HD1  LEU  16           HMDR     LEU  16   1.370  -6.019  -2.382
  118   2HD1  LEU  16           HMDR     LEU  16   1.873  -7.017  -3.771
  119   3HD1  LEU  16           HMDR     LEU  16   0.744  -7.678  -2.561
  120   1HD2  LEU  16           HMDS     LEU  16   4.393  -6.167  -1.948
  121   2HD2  LEU  16           HMDS     LEU  16   4.831  -7.832  -2.409
  122   3HD2  LEU  16           HMDS     LEU  16   3.923  -6.802  -3.545
  123    H    ILE  17           HN       ILE  17   3.675  -5.699   1.863
  124    HA   ILE  17           HA       ILE  17   2.360  -6.686   4.299
  125    HB   ILE  17           HB       ILE  17   4.484  -6.017   5.622
  126   1HG1  ILE  17           HG1R     ILE  17   5.650  -6.337   2.837
  127   2HG1  ILE  17           HG1S     ILE  17   5.723  -4.910   3.907
  128   1HG2  ILE  17           HMG2     ILE  17   3.651  -8.338   5.396
  129   2HG2  ILE  17           HMG2     ILE  17   4.689  -8.535   3.959
  130   3HG2  ILE  17           HMG2     ILE  17   5.423  -8.227   5.555
  131   1HD1  ILE  17           HMD1     ILE  17   6.892  -7.074   5.322
  132   2HD1  ILE  17           HMD1     ILE  17   7.564  -7.094   3.669
  133   3HD1  ILE  17           HMD1     ILE  17   7.686  -5.618   4.664
  134    H    TYR  18           HN       TYR  18   1.634  -5.088   5.598
  135    HA   TYR  18           HA       TYR  18   1.690  -2.407   4.435
  136   1HB   TYR  18           HBS      TYR  18  -0.454  -3.400   5.002
  137   2HB   TYR  18           HBR      TYR  18   0.060  -3.623   6.698
  138    HD1  TYR  18           HD2      TYR  18   0.717  -1.448   7.972
  139    HD2  TYR  18           HD1      TYR  18  -1.712  -1.488   4.480
  140    HE1  TYR  18           HE2      TYR  18  -0.255   0.706   8.633
  141    HE2  TYR  18           HE1      TYR  18  -2.675   0.681   5.118
  142    HH   TYR  18           HH       TYR  18  -1.529   2.730   6.666
  143    H    ASP  19           HN       ASP  19   2.044  -0.505   5.629
  144    HA   ASP  19           HA       ASP  19   3.824  -0.823   7.971
  145   1HB   ASP  19           HBS      ASP  19   4.892  -0.530   5.519
  146   2HB   ASP  19           HBR      ASP  19   4.674   1.182   5.984
  147    HA   PRO  20           HA       PRO  20   0.755   2.138   9.119
  148   1HB   PRO  20           HBR      PRO  20   1.566   1.690  11.758
  149   2HB   PRO  20           HBS      PRO  20   0.092   1.417  11.089
  150   1HG   PRO  20           HGS      PRO  20   1.797  -0.477  11.807
  151   2HG   PRO  20           HGR      PRO  20   0.510  -0.705  10.769
  152   1HD   PRO  20           HDS      PRO  20   3.244  -0.568  10.154
  153   2HD   PRO  20           HDR      PRO  20   2.011  -1.168   9.229
  154    H    GLU  21           HN       GLU  21   4.026   2.273   9.335
  155    HA   GLU  21           HA       GLU  21   4.295   4.701  10.948
  156   1HB   GLU  21           HBR      GLU  21   6.007   2.876   9.320
  157   2HB   GLU  21           HBS      GLU  21   6.499   4.475   9.452
  158   1HG   GLU  21           HGS      GLU  21   5.764   3.757  12.071
  159   2HG   GLU  21           HGR      GLU  21   6.826   2.443  11.495
  160    H    ARG  22           HN       ARG  22   4.222   3.767   7.506
  161    HA   ARG  22           HA       ARG  22   4.387   6.650   6.756
  162   1HB   ARG  22           HBR      ARG  22   5.209   4.141   5.277
  163   2HB   ARG  22           HBS      ARG  22   4.940   5.705   4.457
  164   1HG   ARG  22           HGS      ARG  22   6.655   6.231   6.643
  165   2HG   ARG  22           HGR      ARG  22   7.269   4.747   5.861
  166   1HD   ARG  22           HDS      ARG  22   8.178   6.925   4.997
  167   2HD   ARG  22           HDR      ARG  22   7.484   5.815   3.781
  168    HE   ARG  22           HE       ARG  22   5.807   7.361   3.358
  169   1HH1  ARG  22           HH1Z     ARG  22   7.286   8.167   6.455
  170   2HH1  ARG  22           HH1E     ARG  22   6.617   9.765   6.482
  171   1HH2  ARG  22           HH2Z     ARG  22   5.056   9.498   3.366
  172   2HH2  ARG  22           HH2E     ARG  22   5.354  10.518   4.735
  173    H    GLY  23           HN       GLY  23   2.459   3.813   6.873
  174   1HA   GLY  23           HAR      GLY  23   0.221   3.484   6.198
  175   2HA   GLY  23           HAS      GLY  23   0.279   5.011   5.278
  176    H    GLU  24           HN       GLU  24   2.865   2.647   5.101
  177    HA   GLU  24           HA       GLU  24   2.328   2.482   2.179
  178   1HB   GLU  24           HBR      GLU  24   4.418   3.465   3.616
  179   2HB   GLU  24           HBS      GLU  24   4.886   1.858   3.502
  180   1HG   GLU  24           HGR      GLU  24   5.956   2.577   1.556
  181   2HG   GLU  24           HGS      GLU  24   4.364   2.031   0.962
  182    H    ILE  25           HN       ILE  25   1.749   0.618   1.367
  183    HA   ILE  25           HA       ILE  25   2.519  -1.933   2.670
  184    HB   ILE  25           HB       ILE  25   0.884  -1.560   0.121
  185   1HG1  ILE  25           HG1R     ILE  25  -1.084  -2.042   1.807
  186   2HG1  ILE  25           HG1S     ILE  25   0.049  -1.358   3.007
  187   1HG2  ILE  25           HMG2     ILE  25   1.551  -3.858   1.881
  188   2HG2  ILE  25           HMG2     ILE  25  -0.092  -3.796   1.189
  189   3HG2  ILE  25           HMG2     ILE  25   1.331  -3.776   0.113
  190   1HD1  ILE  25           HMD1     ILE  25   0.055   0.405   0.797
  191   2HD1  ILE  25           HMD1     ILE  25  -1.650  -0.005   1.124
  192   3HD1  ILE  25           HMD1     ILE  25  -0.631   0.673   2.421
  193    H    VAL  26           HN       VAL  26   4.180  -3.071   2.004
  194    HA   VAL  26           HA       VAL  26   5.596  -2.165  -0.451
  195    HB   VAL  26           HB       VAL  26   6.927  -3.183   2.054
  196   1HG1  VAL  26           HMGR     VAL  26   7.895  -1.692  -0.384
  197   2HG1  VAL  26           HMGR     VAL  26   8.836  -1.789   1.124
  198   3HG1  VAL  26           HMGR     VAL  26   8.417  -3.276   0.239
  199   1HG2  VAL  26           HMGS     VAL  26   5.561  -0.678   1.752
  200   2HG2  VAL  26           HMGS     VAL  26   6.453  -1.325   3.151
  201   3HG2  VAL  26           HMGS     VAL  26   7.312  -0.394   1.901
  202    H    CYS  27           HN       CYS  27   7.265  -3.784  -1.174
  203    HA   CYS  27           HA       CYS  27   6.268  -6.503  -1.333
  204   1HB   CYS  27           HBS      CYS  27   7.655  -5.337  -3.071
  205   2HB   CYS  27           HBR      CYS  27   9.044  -5.476  -1.957
  206    H    ALA  28           HN       ALA  28   7.062  -8.309  -0.321
  207    HA   ALA  28           HA       ALA  28   8.600  -7.861   2.179
  208   1HB   ALA  28           HMBA     ALA  28   6.650  -9.867   1.218
  209   2HB   ALA  28           HMBC     ALA  28   8.014 -10.498   2.174
  210   3HB   ALA  28           HMBB     ALA  28   6.957  -9.235   2.856
  211    H    LYS  29           HN       LYS  29   9.566  -7.815  -0.713
  212    HA   LYS  29           HA       LYS  29  11.698  -9.858  -0.396
  213   1HB   LYS  29           HBR      LYS  29   9.784  -9.943  -2.446
  214   2HB   LYS  29           HBS      LYS  29  11.235  -9.208  -3.186
  215   1HG   LYS  29           HGR      LYS  29  11.379 -11.570  -3.534
  216   2HG   LYS  29           HGS      LYS  29  12.566 -11.153  -2.265
  217   1HD   LYS  29           HDS      LYS  29  10.266 -11.717  -0.840
  218   2HD   LYS  29           HDR      LYS  29  10.200 -12.851  -2.160
  219   1HE   LYS  29           HES      LYS  29  12.640 -13.413  -1.599
  220   2HE   LYS  29           HER      LYS  29  12.310 -12.562  -0.063
  221   1HZ   LYS  29           HZC      LYS  29  10.285 -14.117  -0.039
  222   2HZ   LYS  29           HZA      LYS  29  11.159 -15.037  -1.068
  223   3HZ   LYS  29           HZB      LYS  29  11.743 -14.694   0.418
  224    H    CYS  30           HN       CYS  30  10.959  -7.341  -2.825
  225    HA   CYS  30           HA       CYS  30  13.780  -6.738  -2.768
  226   1HB   CYS  30           HBR      CYS  30  13.375  -5.547  -4.848
  227   2HB   CYS  30           HBS      CYS  30  12.697  -7.197  -4.852
  228    H    GLY  31           HN       GLY  31  11.260  -5.403  -1.096
  229   1HA   GLY  31           HAR      GLY  31  11.404  -3.507   0.258
  230   2HA   GLY  31           HAS      GLY  31  12.622  -2.820  -0.851
  231    H    TYR  32           HN       TYR  32  10.156  -3.908  -2.771
  232    HA   TYR  32           HA       TYR  32   9.777  -1.132  -3.649
  233   1HB   TYR  32           HBS      TYR  32  10.061  -2.782  -5.375
  234   2HB   TYR  32           HBR      TYR  32   8.768  -3.806  -4.694
  235    HD1  TYR  32           HD1      TYR  32   9.388  -0.518  -6.370
  236    HD2  TYR  32           HD2      TYR  32   6.566  -3.558  -5.433
  237    HE1  TYR  32           HE1      TYR  32   7.797   0.480  -7.954
  238    HE2  TYR  32           HE2      TYR  32   4.978  -2.587  -7.032
  239    HH   TYR  32           HH       TYR  32   4.433  -0.660  -8.041
  240    H    VAL  33           HN       VAL  33   8.297   0.131  -2.859
  241    HA   VAL  33           HA       VAL  33   6.086  -0.637  -1.266
  242    HB   VAL  33           HB       VAL  33   6.440   1.827  -2.989
  243   1HG1  VAL  33           HMGR     VAL  33   4.452   1.193  -0.806
  244   2HG1  VAL  33           HMGR     VAL  33   4.845   2.853  -1.314
  245   3HG1  VAL  33           HMGR     VAL  33   4.139   1.709  -2.481
  246   1HG2  VAL  33           HMGS     VAL  33   7.533   1.024  -0.372
  247   2HG2  VAL  33           HMGS     VAL  33   8.124   2.209  -1.561
  248   3HG2  VAL  33           HMGS     VAL  33   6.821   2.654  -0.434
  249    H    ILE  34           HN       ILE  34   4.051  -1.172  -1.652
  250    HA   ILE  34           HA       ILE  34   3.156  -1.620  -4.434
  251    HB   ILE  34           HB       ILE  34   2.025  -2.331  -1.689
  252   1HG1  ILE  34           HG1R     ILE  34   3.958  -3.615  -2.553
  253   2HG1  ILE  34           HG1S     ILE  34   2.496  -4.612  -2.299
  254   1HG2  ILE  34           HMG2     ILE  34   0.487  -1.886  -4.001
  255   2HG2  ILE  34           HMG2     ILE  34   0.610  -3.655  -3.815
  256   3HG2  ILE  34           HMG2     ILE  34  -0.012  -2.659  -2.474
  257   1HD1  ILE  34           HMD1     ILE  34   3.263  -3.507  -5.006
  258   2HD1  ILE  34           HMD1     ILE  34   3.870  -5.069  -4.395
  259   3HD1  ILE  34           HMD1     ILE  34   2.119  -4.820  -4.622
  260    H    GLU  35           HN       GLU  35   1.469  -0.385  -1.551
  261    HA   GLU  35           HA       GLU  35   0.336   1.781  -3.269
  262   1HB   GLU  35           HBR      GLU  35  -0.785  -0.053  -1.153
  263   2HB   GLU  35           HBS      GLU  35  -1.518   1.408  -1.531
  264   1HG   GLU  35           HGS      GLU  35  -2.303   0.848  -3.545
  265   2HG   GLU  35           HGR      GLU  35  -0.958  -0.251  -3.953
  266    H    GLU  36           HN       GLU  36  -1.063   3.170  -1.447
  267    HA   GLU  36           HA       GLU  36   0.434   3.554   1.027
  268   1HB   GLU  36           HBR      GLU  36   1.057   5.150  -1.148
  269   2HB   GLU  36           HBS      GLU  36  -0.170   6.025  -0.410
  270   1HG   GLU  36           HGS      GLU  36   1.705   5.094   1.588
  271   2HG   GLU  36           HGR      GLU  36   2.516   6.162   0.411
  272    H    ASN  37           HN       ASN  37  -0.804   4.609   2.603
  273    HA   ASN  37           HA       ASN  37  -3.505   5.541   2.006
  274   1HB   ASN  37           HBR      ASN  37  -4.708   3.853   3.064
  275   2HB   ASN  37           HBS      ASN  37  -3.599   3.045   1.918
  276   1HD2  ASN  37           HD2Z     ASN  37  -3.638   2.036   5.809
  277   2HD2  ASN  37           HD2E     ASN  37  -4.895   2.876   4.964
  278    H    ILE  38           HN       ILE  38  -4.640   5.356   4.449
  279    HA   ILE  38           HA       ILE  38  -4.873   6.654   6.301
  280    HB   ILE  38           HB       ILE  38  -3.102   4.866   6.936
  281   1HG1  ILE  38           HG1R     ILE  38  -2.810   7.103   8.853
  282   2HG1  ILE  38           HG1S     ILE  38  -4.482   6.798   8.298
  283   1HG2  ILE  38           HMG2     ILE  38  -1.312   7.034   6.191
  284   2HG2  ILE  38           HMG2     ILE  38  -1.064   6.490   7.870
  285   3HG2  ILE  38           HMG2     ILE  38  -0.977   5.316   6.531
  286   1HD1  ILE  38           HMD1     ILE  38  -4.040   4.343   8.897
  287   2HD1  ILE  38           HMD1     ILE  38  -2.613   4.948   9.779
  288   3HD1  ILE  38           HMD1     ILE  38  -4.246   5.501  10.239
  289    H    ILE  39           HN       ILE  39  -3.869   8.559   7.566
  290    HA   ILE  39           HA       ILE  39  -3.609  10.837   7.501
  291    HB   ILE  39           HB       ILE  39  -2.281  10.437   4.774
  292   1HG1  ILE  39           HG1R     ILE  39  -0.886  10.777   7.450
  293   2HG1  ILE  39           HG1S     ILE  39  -1.262   9.183   6.735
  294   1HG2  ILE  39           HMG2     ILE  39  -2.831  12.803   6.422
  295   2HG2  ILE  39           HMG2     ILE  39  -1.139  12.659   5.876
  296   3HG2  ILE  39           HMG2     ILE  39  -2.465  12.660   4.683
  297   1HD1  ILE  39           HMD1     ILE  39   0.288  11.220   5.157
  298   2HD1  ILE  39           HMD1     ILE  39   1.098  10.228   6.399
  299   3HD1  ILE  39           HMD1     ILE  39   0.279   9.441   5.024
  300    H    ASP  40           HN       ASP  40  -5.824  10.998   7.488
  301    HA   ASP  40           HA       ASP  40  -7.924  11.412   6.721
  302   1HB   ASP  40           HBR      ASP  40  -6.878  11.708   3.915
  303   2HB   ASP  40           HBS      ASP  40  -8.411  12.303   4.614
  304    H    MET  41           HN       MET  41  -7.990   9.215   7.463
  305    HA   MET  41           HA       MET  41  -7.195   7.038   5.929
  306   1HB   MET  41           HBS      MET  41  -8.094   7.410   8.489
  307   2HB   MET  41           HBR      MET  41  -9.420   6.457   7.765
  308   1HG   MET  41           HGS      MET  41  -7.893   4.697   7.114
  309   2HG   MET  41           HGR      MET  41  -6.485   5.703   7.528
  310   1HE   MET  41           HMEA     MET  41  -7.693   2.762   8.453
  311   2HE   MET  41           HMEC     MET  41  -6.071   3.141   9.089
  312   3HE   MET  41           HMEB     MET  41  -7.367   2.627  10.199
  313    H    GLY  42           HN       GLY  42 -10.414   8.520   6.215
  314   1HA   GLY  42           HAS      GLY  42 -11.335   7.046   3.811
  315   2HA   GLY  42           HAR      GLY  42 -12.236   6.832   5.338
  316    HA   PRO  43           HA       PRO  43 -14.493  10.029   3.248
  317   1HB   PRO  43           HBS      PRO  43 -16.384   9.802   5.303
  318   2HB   PRO  43           HBR      PRO  43 -16.598   9.522   3.699
  319   1HG   PRO  43           HGS      PRO  43 -16.510   7.655   5.576
  320   2HG   PRO  43           HGR      PRO  43 -16.280   7.359   3.950
  321   1HD   PRO  43           HDS      PRO  43 -14.372   7.385   6.003
  322   2HD   PRO  43           HDR      PRO  43 -14.240   6.740   4.485
  323    H    GLU  44           HN       GLU  44 -13.853  10.112   6.627
  324    HA   GLU  44           HA       GLU  44 -13.698  11.810   8.158
  325   1HB   GLU  44           HBR      GLU  44 -13.076  13.534   5.755
  326   2HB   GLU  44           HBS      GLU  44 -12.796  13.879   7.373
  327   1HG   GLU  44           HGS      GLU  44 -11.375  11.827   5.728
  328   2HG   GLU  44           HGR      GLU  44 -10.622  13.184   6.608
  329    H    TRP  45           HN       TRP  45 -14.481  14.196   8.528
  330    HA   TRP  45           HA       TRP  45 -17.361  13.891   8.232
  331   1HB   TRP  45           HBR      TRP  45 -17.480  15.682   9.920
  332   2HB   TRP  45           HBS      TRP  45 -16.531  14.253  10.424
  333    HD1  TRP  45           HD1      TRP  45 -16.156  17.998   9.693
  334    HE1  TRP  45           HE1      TRP  45 -13.882  18.795  10.583
  335    HE3  TRP  45           HE3      TRP  45 -14.176  13.458  10.858
  336    HZ2  TRP  45           HZ2      TRP  45 -11.573  17.624  11.660
  337    HZ3  TRP  45           HZ3      TRP  45 -11.924  13.372  11.820
  338    HH2  TRP  45           HH2      TRP  45 -10.642  15.407  12.221
  339    H    ARG  46           HN       ARG  46 -17.759  14.415   6.112
  340    HA   ARG  46           HA       ARG  46 -17.474  17.292   5.406
  341   1HB   ARG  46           HBR      ARG  46 -17.006  15.197   3.797
  342   2HB   ARG  46           HBS      ARG  46 -18.766  15.361   3.541
  343   1HG   ARG  46           HGS      ARG  46 -18.534  17.221   2.304
  344   2HG   ARG  46           HGR      ARG  46 -17.283  17.902   3.382
  345   1HD   ARG  46           HDS      ARG  46 -15.960  15.814   2.255
  346   2HD   ARG  46           HDR      ARG  46 -17.036  16.321   0.922
  347    HE   ARG  46           HE       ARG  46 -15.499  18.435   2.270
  348   1HH1  ARG  46           HH1Z     ARG  46 -16.077  16.463  -0.594
  349   2HH1  ARG  46           HH1E     ARG  46 -14.926  17.330  -1.556
  350   1HH2  ARG  46           HH2Z     ARG  46 -13.911  19.461   1.020
  351   2HH2  ARG  46           HH2E     ARG  46 -13.701  19.028  -0.644
  352    H    ALA  47           HN       ALA  47 -19.617  17.750   3.914
  353    HA   ALA  47           HA       ALA  47 -21.917  17.592   5.746
  354   1HB   ALA  47           HMBC     ALA  47 -21.581  18.836   3.003
  355   2HB   ALA  47           HMBB     ALA  47 -23.038  18.939   4.025
  356   3HB   ALA  47           HMBA     ALA  47 -21.510  19.676   4.572
  357    H    PHE  48           HN       PHE  48 -22.451  15.458   5.824
  358    HA   PHE  48           HA       PHE  48 -23.445  14.253   3.291
  359   1HB   PHE  48           HBS      PHE  48 -21.944  12.787   4.706
  360   2HB   PHE  48           HBR      PHE  48 -23.199  12.842   5.978
  361    HD1  PHE  48           HD2      PHE  48 -22.815  11.933   2.316
  362    HD2  PHE  48           HD1      PHE  48 -24.888  11.389   5.998
  363    HE1  PHE  48           HE2      PHE  48 -24.047  10.027   1.333
  364    HE2  PHE  48           HE1      PHE  48 -26.121   9.492   5.048
  365    HZ   PHE  48           HZ       PHE  48 -25.659   8.771   2.735
  366    H    ASP  49           HN       ASP  49 -24.298  14.857   6.712
  367    HA   ASP  49           HA       ASP  49 -26.961  15.636   5.766
  368   1HB   ASP  49           HBR      ASP  49 -26.621  13.207   7.075
  369   2HB   ASP  49           HBS      ASP  49 -27.255  14.327   8.316
  370    H    ALA  50           HN       ALA  50 -24.596  15.544   8.405
  371    HA   ALA  50           HA       ALA  50 -25.425  18.281   9.211
  372   1HB   ALA  50           HMBB     ALA  50 -26.607  16.354  10.472
  373   2HB   ALA  50           HMBA     ALA  50 -25.023  16.106  11.251
  374   3HB   ALA  50           HMBC     ALA  50 -25.856  17.674  11.404
   
  No H/Q in entry =         374
  Start of MODEL   10
    1   1H    MET   1           HN       MET   1  -8.948  -7.554 -16.340
    2   2H    MET   1           HNB      MET   1 -10.363  -8.004 -17.022
    3   3H    MET   1           HNC      MET   1  -9.668  -6.588 -17.443
    4    HA   MET   1           HA       MET   1  -9.996  -5.651 -15.338
    5   1HB   MET   1           HBS      MET   1 -11.991  -6.253 -17.187
    6   2HB   MET   1           HBR      MET   1 -12.702  -6.696 -15.609
    7   1HG   MET   1           HGS      MET   1 -11.943  -4.414 -14.756
    8   2HG   MET   1           HGR      MET   1 -11.533  -4.018 -16.442
    9   1HE   MET   1           HMEA     MET   1 -14.003  -5.584 -14.141
   10   2HE   MET   1           HMEC     MET   1 -14.757  -3.984 -13.926
   11   3HE   MET   1           HMEB     MET   1 -15.631  -5.272 -14.793
   12    H    VAL   2           HN       VAL   2  -9.016  -6.566 -13.610
   13    HA   VAL   2           HA       VAL   2 -10.701  -7.733 -11.722
   14    HB   VAL   2           HB       VAL   2 -10.597  -9.781 -12.919
   15   1HG1  VAL   2           HMGS     VAL   2  -7.978  -9.027 -13.599
   16   2HG1  VAL   2           HMGS     VAL   2  -7.831 -10.538 -12.670
   17   3HG1  VAL   2           HMGS     VAL   2  -8.871 -10.479 -14.113
   18   1HG2  VAL   2           HMGR     VAL   2  -8.824  -9.934 -10.467
   19   2HG2  VAL   2           HMGR     VAL   2 -10.600 -10.031 -10.517
   20   3HG2  VAL   2           HMGR     VAL   2  -9.617 -11.321 -11.253
   21    H    ASN   3           HN       ASN   3  -9.856  -5.936 -10.691
   22    HA   ASN   3           HA       ASN   3  -8.575  -4.948  -9.105
   23   1HB   ASN   3           HBS      ASN   3  -8.098  -7.674  -8.647
   24   2HB   ASN   3           HBR      ASN   3  -6.507  -6.862  -8.609
   25   1HD2  ASN   3           HD2Z     ASN   3  -7.960  -4.496  -6.032
   26   2HD2  ASN   3           HD2E     ASN   3  -7.533  -4.300  -7.700
   27    H    LYS   4           HN       LYS   4  -6.008  -4.598  -8.669
   28    HA   LYS   4           HA       LYS   4  -4.775  -4.121 -11.343
   29   1HB   LYS   4           HBR      LYS   4  -5.113  -2.126  -9.803
   30   2HB   LYS   4           HBS      LYS   4  -3.911  -2.884  -8.718
   31   1HG   LYS   4           HGR      LYS   4  -2.594  -1.420  -9.950
   32   2HG   LYS   4           HGS      LYS   4  -2.409  -2.943 -10.866
   33   1HD   LYS   4           HDS      LYS   4  -4.684  -1.588 -11.889
   34   2HD   LYS   4           HDR      LYS   4  -3.414  -0.408 -11.715
   35   1HE   LYS   4           HES      LYS   4  -2.366  -1.141 -13.510
   36   2HE   LYS   4           HER      LYS   4  -2.302  -2.791 -12.825
   37   1HZ   LYS   4           HZB      LYS   4  -4.773  -1.815 -14.016
   38   2HZ   LYS   4           HZC      LYS   4  -3.576  -2.355 -14.987
   39   3HZ   LYS   4           HZA      LYS   4  -4.231  -3.348 -13.869
   40    H    GLN   5           HN       GLN   5  -4.109  -6.287 -11.515
   41    HA   GLN   5           HA       GLN   5  -2.786  -8.122 -11.213
   42   1HB   GLN   5           HBR      GLN   5  -0.907  -6.057 -10.044
   43   2HB   GLN   5           HBS      GLN   5  -0.472  -7.683 -10.642
   44   1HG   GLN   5           HGS      GLN   5  -1.779  -6.625 -12.799
   45   2HG   GLN   5           HGR      GLN   5  -0.991  -5.179 -12.106
   46   1HE2  GLN   5           HE2Z     GLN   5   1.066  -7.529 -14.489
   47   2HE2  GLN   5           HE2E     GLN   5  -0.657  -7.373 -14.415
   48    H    LYS   6           HN       LYS   6  -0.956  -8.923  -9.385
   49    HA   LYS   6           HA       LYS   6  -1.995  -8.760  -6.653
   50   1HB   LYS   6           HBR      LYS   6  -3.644 -10.180  -7.911
   51   2HB   LYS   6           HBS      LYS   6  -2.314 -11.322  -8.258
   52   1HG   LYS   6           HGR      LYS   6  -2.102 -11.097  -5.544
   53   2HG   LYS   6           HGS      LYS   6  -3.862 -10.880  -5.766
   54   1HD   LYS   6           HDS      LYS   6  -3.275 -13.207  -5.359
   55   2HD   LYS   6           HDR      LYS   6  -4.087 -12.935  -6.876
   56   1HE   LYS   6           HES      LYS   6  -1.110 -12.964  -6.893
   57   2HE   LYS   6           HER      LYS   6  -1.999 -14.502  -6.708
   58   1HZ   LYS   6           HZC      LYS   6  -3.268 -13.247  -8.719
   59   2HZ   LYS   6           HZA      LYS   6  -1.707 -12.856  -9.002
   60   3HZ   LYS   6           HZB      LYS   6  -2.149 -14.425  -8.894
   61    H    VAL   7           HN       VAL   7   0.480  -8.140  -7.552
   62    HA   VAL   7           HA       VAL   7   2.191 -10.153  -6.345
   63    HB   VAL   7           HB       VAL   7   3.591 -10.555  -8.261
   64   1HG1  VAL   7           HMGR     VAL   7   1.591 -12.038  -7.786
   65   2HG1  VAL   7           HMGR     VAL   7   0.778 -11.221  -9.143
   66   3HG1  VAL   7           HMGR     VAL   7   2.279 -12.137  -9.424
   67   1HG2  VAL   7           HMGS     VAL   7   1.917  -8.495  -9.524
   68   2HG2  VAL   7           HMGS     VAL   7   3.603  -8.970  -9.834
   69   3HG2  VAL   7           HMGS     VAL   7   2.269  -9.905 -10.552
   70    H    CYS   8           HN       CYS   8   4.550  -9.433  -6.607
   71    HA   CYS   8           HA       CYS   8   4.909  -6.503  -6.707
   72   1HB   CYS   8           HBS      CYS   8   6.275  -7.940  -5.162
   73   2HB   CYS   8           HBR      CYS   8   6.991  -8.694  -6.614
   74    HA   PRO   9           HA       PRO   9   5.415  -6.735 -11.096
   75   1HB   PRO   9           HBR      PRO   9   5.590  -4.038 -11.274
   76   2HB   PRO   9           HBS      PRO   9   4.258  -4.942 -11.597
   77   1HG   PRO   9           HGS      PRO   9   4.769  -3.357  -9.366
   78   2HG   PRO   9           HGR      PRO   9   3.303  -3.931  -9.916
   79   1HD   PRO   9           HDS      PRO   9   4.593  -4.878  -7.777
   80   2HD   PRO   9           HDR      PRO   9   3.394  -5.683  -8.585
   81    H    ALA  10           HN       ALA  10   7.475  -6.049  -8.704
   82    HA   ALA  10           HA       ALA  10   9.652  -5.081 -10.484
   83   1HB   ALA  10           HMBA     ALA  10   9.003  -4.356  -7.922
   84   2HB   ALA  10           HMBB     ALA  10  10.280  -5.569  -7.657
   85   3HB   ALA  10           HMBC     ALA  10  10.597  -4.154  -8.693
   86    H    CYS  11           HN       CYS  11   9.634  -7.323  -7.699
   87    HA   CYS  11           HA       CYS  11  11.692  -8.796  -9.090
   88   1HB   CYS  11           HBS      CYS  11  12.110  -9.906  -6.998
   89   2HB   CYS  11           HBR      CYS  11  11.999  -8.138  -6.797
   90    H    GLU  12           HN       GLU  12   8.403  -9.130  -9.116
   91    HA   GLU  12           HA       GLU  12   6.859 -10.810  -9.325
   92   1HB   GLU  12           HBS      GLU  12   9.174 -11.472 -10.779
   93   2HB   GLU  12           HBR      GLU  12   8.704 -12.921 -10.076
   94   1HG   GLU  12           HGS      GLU  12   6.873 -13.112 -11.448
   95   2HG   GLU  12           HGR      GLU  12   6.428 -11.389 -11.311
   96    H    SER  13           HN       SER  13   7.714 -10.349  -6.808
   97    HA   SER  13           HA       SER  13   7.403 -13.087  -5.676
   98   1HB   SER  13           HBS      SER  13   8.170 -10.495  -4.319
   99   2HB   SER  13           HBR      SER  13   7.672 -11.968  -3.443
  100    HG   SER  13           HG       SER  13   9.538 -12.746  -3.595
  101    H    ALA  14           HN       ALA  14   5.602 -13.516  -4.429
  102    HA   ALA  14           HA       ALA  14   3.292 -12.039  -5.418
  103   1HB   ALA  14           HMBB     ALA  14   3.952 -14.768  -4.571
  104   2HB   ALA  14           HMBC     ALA  14   2.361 -14.216  -3.990
  105   3HB   ALA  14           HMBA     ALA  14   2.728 -14.196  -5.733
  106    H    GLU  15           HN       GLU  15   5.098 -11.998  -2.623
  107    HA   GLU  15           HA       GLU  15   2.773 -11.570  -0.838
  108   1HB   GLU  15           HBR      GLU  15   5.668 -12.329  -0.547
  109   2HB   GLU  15           HBS      GLU  15   4.855 -11.630   0.744
  110   1HG   GLU  15           HGS      GLU  15   4.895 -14.216   0.576
  111   2HG   GLU  15           HGR      GLU  15   3.414 -13.422   1.177
  112    H    LEU  16           HN       LEU  16   2.428  -9.737   0.268
  113    HA   LEU  16           HA       LEU  16   4.525  -7.625   0.270
  114   1HB   LEU  16           HBR      LEU  16   1.581  -7.102  -0.167
  115   2HB   LEU  16           HBS      LEU  16   2.967  -5.998  -0.400
  116    HG   LEU  16           HG       LEU  16   2.491  -8.450  -2.104
  117   1HD1  LEU  16           HMDR     LEU  16   1.389  -5.665  -2.273
  118   2HD1  LEU  16           HMDR     LEU  16   1.845  -6.514  -3.772
  119   3HD1  LEU  16           HMDR     LEU  16   0.627  -7.222  -2.682
  120   1HD2  LEU  16           HMDS     LEU  16   4.464  -6.269  -1.892
  121   2HD2  LEU  16           HMDS     LEU  16   4.612  -7.890  -2.615
  122   3HD2  LEU  16           HMDS     LEU  16   3.862  -6.567  -3.542
  123    H    ILE  17           HN       ILE  17   3.819  -5.821   1.817
  124    HA   ILE  17           HA       ILE  17   2.500  -6.741   4.257
  125    HB   ILE  17           HB       ILE  17   4.746  -6.420   5.538
  126   1HG1  ILE  17           HG1R     ILE  17   5.805  -7.013   2.748
  127   2HG1  ILE  17           HG1S     ILE  17   6.020  -5.503   3.678
  128   1HG2  ILE  17           HMG2     ILE  17   3.426  -8.616   4.966
  129   2HG2  ILE  17           HMG2     ILE  17   4.847  -8.943   3.941
  130   3HG2  ILE  17           HMG2     ILE  17   5.053  -8.680   5.693
  131   1HD1  ILE  17           HMD1     ILE  17   7.209  -6.948   5.424
  132   2HD1  ILE  17           HMD1     ILE  17   7.252  -8.215   4.168
  133   3HD1  ILE  17           HMD1     ILE  17   8.059  -6.650   3.884
  134    H    TYR  18           HN       TYR  18   2.174  -5.117   5.729
  135    HA   TYR  18           HA       TYR  18   2.245  -2.484   4.431
  136   1HB   TYR  18           HBR      TYR  18   0.117  -3.594   5.235
  137   2HB   TYR  18           HBS      TYR  18   0.697  -3.325   6.904
  138    HD1  TYR  18           HD2      TYR  18   1.551  -0.763   7.242
  139    HD2  TYR  18           HD1      TYR  18  -1.478  -2.037   4.544
  140    HE1  TYR  18           HE2      TYR  18   0.609   1.503   7.244
  141    HE2  TYR  18           HE1      TYR  18  -2.452   0.220   4.562
  142    HH   TYR  18           HH       TYR  18  -1.995   2.372   6.799
  143    H    ASP  19           HN       ASP  19   3.193  -0.717   5.203
  144    HA   ASP  19           HA       ASP  19   4.631  -0.939   7.788
  145   1HB   ASP  19           HBS      ASP  19   5.707  -0.404   5.344
  146   2HB   ASP  19           HBR      ASP  19   5.431   1.236   5.999
  147    HA   PRO  20           HA       PRO  20   1.245   1.652   8.922
  148   1HB   PRO  20           HBR      PRO  20   2.079   1.256  11.572
  149   2HB   PRO  20           HBS      PRO  20   0.640   0.860  10.887
  150   1HG   PRO  20           HGS      PRO  20   2.506  -0.882  11.579
  151   2HG   PRO  20           HGR      PRO  20   1.260  -1.205  10.517
  152   1HD   PRO  20           HDS      PRO  20   3.975  -0.817   9.946
  153   2HD   PRO  20           HDR      PRO  20   2.806  -1.475   8.977
  154    H    GLU  21           HN       GLU  21   4.484   2.165   9.295
  155    HA   GLU  21           HA       GLU  21   4.295   4.540  10.937
  156   1HB   GLU  21           HBR      GLU  21   6.486   3.178   9.365
  157   2HB   GLU  21           HBS      GLU  21   6.712   4.644  10.149
  158   1HG   GLU  21           HGS      GLU  21   7.449   3.376  11.840
  159   2HG   GLU  21           HGR      GLU  21   5.732   3.419  12.325
  160    H    ARG  22           HN       ARG  22   4.706   3.813   7.490
  161    HA   ARG  22           HA       ARG  22   4.523   6.700   6.831
  162   1HB   ARG  22           HBR      ARG  22   5.215   4.225   5.264
  163   2HB   ARG  22           HBS      ARG  22   4.597   5.682   4.433
  164   1HG   ARG  22           HGS      ARG  22   6.827   6.124   6.340
  165   2HG   ARG  22           HGR      ARG  22   7.223   5.179   4.877
  166   1HD   ARG  22           HDS      ARG  22   5.585   7.409   4.162
  167   2HD   ARG  22           HDR      ARG  22   6.956   7.971   5.157
  168    HE   ARG  22           HE       ARG  22   7.092   6.717   2.501
  169   1HH1  ARG  22           HH1Z     ARG  22   8.739   8.214   5.236
  170   2HH1  ARG  22           HH1E     ARG  22  10.278   8.224   4.442
  171   1HH2  ARG  22           HH2Z     ARG  22   9.147   6.624   1.549
  172   2HH2  ARG  22           HH2E     ARG  22  10.511   7.324   2.357
  173    H    GLY  23           HN       GLY  23   2.725   3.720   6.975
  174   1HA   GLY  23           HAR      GLY  23   0.395   3.398   6.706
  175   2HA   GLY  23           HAS      GLY  23   0.265   5.015   5.964
  176    H    GLU  24           HN       GLU  24   2.510   2.334   5.233
  177    HA   GLU  24           HA       GLU  24   1.650   2.535   2.386
  178   1HB   GLU  24           HBR      GLU  24   4.034   3.044   3.695
  179   2HB   GLU  24           HBS      GLU  24   4.231   1.446   3.222
  180   1HG   GLU  24           HGR      GLU  24   5.196   2.734   1.398
  181   2HG   GLU  24           HGS      GLU  24   3.679   1.949   0.879
  182    H    ILE  25           HN       ILE  25   1.904   0.633   1.076
  183    HA   ILE  25           HA       ILE  25   2.247  -1.918   2.559
  184    HB   ILE  25           HB       ILE  25   0.578  -1.674   0.017
  185   1HG1  ILE  25           HG1R     ILE  25  -1.349  -2.108   1.810
  186   2HG1  ILE  25           HG1S     ILE  25  -0.208  -1.243   2.879
  187   1HG2  ILE  25           HMG2     ILE  25   1.661  -3.886   1.188
  188   2HG2  ILE  25           HMG2     ILE  25   0.029  -3.850   1.906
  189   3HG2  ILE  25           HMG2     ILE  25   0.223  -3.871   0.133
  190   1HD1  ILE  25           HMD1     ILE  25  -0.335   0.272   0.513
  191   2HD1  ILE  25           HMD1     ILE  25  -2.016  -0.199   0.884
  192   3HD1  ILE  25           HMD1     ILE  25  -1.041   0.665   2.103
  193    H    VAL  26           HN       VAL  26   3.861  -3.125   1.870
  194    HA   VAL  26           HA       VAL  26   5.324  -2.197  -0.548
  195    HB   VAL  26           HB       VAL  26   6.612  -3.100   2.022
  196   1HG1  VAL  26           HMGR     VAL  26   7.614  -1.503  -0.343
  197   2HG1  VAL  26           HMGR     VAL  26   8.515  -1.728   1.175
  198   3HG1  VAL  26           HMGR     VAL  26   8.111  -3.135   0.164
  199   1HG2  VAL  26           HMGS     VAL  26   5.780  -0.289   1.282
  200   2HG2  VAL  26           HMGS     VAL  26   5.268  -1.245   2.692
  201   3HG2  VAL  26           HMGS     VAL  26   6.953  -0.688   2.560
  202    H    CYS  27           HN       CYS  27   7.084  -3.748  -1.181
  203    HA   CYS  27           HA       CYS  27   6.189  -6.497  -1.429
  204   1HB   CYS  27           HBS      CYS  27   7.668  -5.294  -3.051
  205   2HB   CYS  27           HBR      CYS  27   8.963  -5.355  -1.825
  206    H    ALA  28           HN       ALA  28   6.985  -8.278  -0.359
  207    HA   ALA  28           HA       ALA  28   8.247  -7.778   2.278
  208   1HB   ALA  28           HMBA     ALA  28   6.918 -10.203   1.045
  209   2HB   ALA  28           HMBB     ALA  28   7.757 -10.209   2.616
  210   3HB   ALA  28           HMBC     ALA  28   6.322  -9.180   2.376
  211    H    LYS  29           HN       LYS  29   9.494  -7.650  -0.515
  212    HA   LYS  29           HA       LYS  29  11.697  -9.577  -0.014
  213   1HB   LYS  29           HBR      LYS  29   9.930  -9.985  -2.077
  214   2HB   LYS  29           HBS      LYS  29  11.205  -9.007  -2.860
  215   1HG   LYS  29           HGR      LYS  29  11.843 -11.465  -1.205
  216   2HG   LYS  29           HGS      LYS  29  11.450 -11.562  -2.945
  217   1HD   LYS  29           HDS      LYS  29  13.557  -9.645  -2.066
  218   2HD   LYS  29           HDR      LYS  29  13.921 -11.349  -2.022
  219   1HE   LYS  29           HES      LYS  29  12.723 -11.026  -4.501
  220   2HE   LYS  29           HER      LYS  29  13.733  -9.568  -4.282
  221   1HZ   LYS  29           HZC      LYS  29  15.567 -11.042  -3.754
  222   2HZ   LYS  29           HZA      LYS  29  14.638 -12.354  -4.038
  223   3HZ   LYS  29           HZB      LYS  29  14.993 -11.325  -5.257
  224    H    CYS  30           HN       CYS  30  11.010  -7.233  -2.620
  225    HA   CYS  30           HA       CYS  30  13.739  -6.407  -2.410
  226   1HB   CYS  30           HBS      CYS  30  13.323  -5.158  -4.461
  227   2HB   CYS  30           HBR      CYS  30  12.765  -6.851  -4.546
  228    H    GLY  31           HN       GLY  31  11.088  -5.273  -0.792
  229   1HA   GLY  31           HAR      GLY  31  11.000  -3.430   0.607
  230   2HA   GLY  31           HAS      GLY  31  12.318  -2.675  -0.331
  231    H    TYR  32           HN       TYR  32  10.086  -3.680  -2.557
  232    HA   TYR  32           HA       TYR  32   9.712  -0.853  -3.272
  233   1HB   TYR  32           HBS      TYR  32  10.303  -2.379  -5.052
  234   2HB   TYR  32           HBR      TYR  32   8.925  -3.444  -4.662
  235    HD1  TYR  32           HD1      TYR  32   9.710   0.041  -5.823
  236    HD2  TYR  32           HD2      TYR  32   6.873  -3.125  -5.726
  237    HE1  TYR  32           HE1      TYR  32   8.310   1.255  -7.437
  238    HE2  TYR  32           HE2      TYR  32   5.480  -1.938  -7.360
  239    HH   TYR  32           HH       TYR  32   6.309   1.374  -8.390
  240    H    VAL  33           HN       VAL  33   8.030   0.296  -2.733
  241    HA   VAL  33           HA       VAL  33   5.841  -0.630  -1.265
  242    HB   VAL  33           HB       VAL  33   6.026   1.831  -3.019
  243   1HG1  VAL  33           HMGR     VAL  33   4.101   1.191  -0.770
  244   2HG1  VAL  33           HMGR     VAL  33   4.290   2.783  -1.547
  245   3HG1  VAL  33           HMGR     VAL  33   3.710   1.392  -2.496
  246   1HG2  VAL  33           HMGS     VAL  33   6.771   1.333  -0.137
  247   2HG2  VAL  33           HMGS     VAL  33   7.794   1.936  -1.463
  248   3HG2  VAL  33           HMGS     VAL  33   6.494   2.960  -0.804
  249    H    ILE  34           HN       ILE  34   3.559  -0.576  -1.854
  250    HA   ILE  34           HA       ILE  34   3.040  -1.349  -4.683
  251    HB   ILE  34           HB       ILE  34   1.835  -2.340  -2.062
  252   1HG1  ILE  34           HG1R     ILE  34   3.987  -3.285  -2.943
  253   2HG1  ILE  34           HG1S     ILE  34   2.679  -4.471  -2.670
  254   1HG2  ILE  34           HMG2     ILE  34   0.417  -2.022  -4.502
  255   2HG2  ILE  34           HMG2     ILE  34   0.702  -3.764  -4.252
  256   3HG2  ILE  34           HMG2     ILE  34  -0.109  -2.803  -2.988
  257   1HD1  ILE  34           HMD1     ILE  34   3.424  -3.302  -5.367
  258   2HD1  ILE  34           HMD1     ILE  34   3.983  -4.877  -4.744
  259   3HD1  ILE  34           HMD1     ILE  34   2.246  -4.603  -5.046
  260    H    GLU  35           HN       GLU  35   0.995  -0.453  -1.905
  261    HA   GLU  35           HA       GLU  35  -0.127   1.784  -3.541
  262   1HB   GLU  35           HBR      GLU  35  -1.722  -0.006  -3.014
  263   2HB   GLU  35           HBS      GLU  35  -1.257   0.039  -1.402
  264   1HG   GLU  35           HGS      GLU  35  -2.080   2.279  -1.040
  265   2HG   GLU  35           HGR      GLU  35  -2.658   2.407  -2.723
  266    H    GLU  36           HN       GLU  36  -0.958   3.552  -2.050
  267    HA   GLU  36           HA       GLU  36   1.226   4.144  -0.098
  268   1HB   GLU  36           HBR      GLU  36   1.308   6.306  -1.110
  269   2HB   GLU  36           HBS      GLU  36   1.553   5.072  -2.221
  270   1HG   GLU  36           HGS      GLU  36  -1.210   5.479  -2.320
  271   2HG   GLU  36           HGR      GLU  36  -0.514   7.121  -2.388
  272    H    ASN  37           HN       ASN  37   0.774   5.613   1.557
  273    HA   ASN  37           HA       ASN  37  -0.443   6.488   3.259
  274   1HB   ASN  37           HBS      ASN  37  -1.925   8.166   2.645
  275   2HB   ASN  37           HBR      ASN  37  -0.731   8.043   1.321
  276   1HD2  ASN  37           HD2Z     ASN  37  -4.673   6.946   0.706
  277   2HD2  ASN  37           HD2E     ASN  37  -4.021   7.027   2.309
  278    H    ILE  38           HN       ILE  38  -2.867   6.812   4.073
  279    HA   ILE  38           HA       ILE  38  -3.820   4.001   4.310
  280    HB   ILE  38           HB       ILE  38  -2.759   4.858   6.347
  281   1HG1  ILE  38           HG1R     ILE  38  -4.676   4.490   7.920
  282   2HG1  ILE  38           HG1S     ILE  38  -5.785   4.601   6.526
  283   1HG2  ILE  38           HMG2     ILE  38  -3.214   7.281   5.931
  284   2HG2  ILE  38           HMG2     ILE  38  -4.887   7.001   6.483
  285   3HG2  ILE  38           HMG2     ILE  38  -3.523   6.734   7.600
  286   1HD1  ILE  38           HMD1     ILE  38  -3.735   2.690   5.928
  287   2HD1  ILE  38           HMD1     ILE  38  -4.428   2.320   7.530
  288   3HD1  ILE  38           HMD1     ILE  38  -5.493   2.442   6.103
  289    H    ILE  39           HN       ILE  39  -5.922   3.526   4.126
  290    HA   ILE  39           HA       ILE  39  -7.705   5.729   3.203
  291    HB   ILE  39           HB       ILE  39  -6.677   4.557   1.295
  292   1HG1  ILE  39           HG1R     ILE  39  -8.931   3.679   0.289
  293   2HG1  ILE  39           HG1S     ILE  39  -9.628   4.229   1.839
  294   1HG2  ILE  39           HMG2     ILE  39  -6.255   2.382   2.382
  295   2HG2  ILE  39           HMG2     ILE  39  -8.001   2.029   2.300
  296   3HG2  ILE  39           HMG2     ILE  39  -7.060   2.230   0.798
  297   1HD1  ILE  39           HMD1     ILE  39  -8.513   6.483   1.332
  298   2HD1  ILE  39           HMD1     ILE  39  -8.307   5.863  -0.327
  299   3HD1  ILE  39           HMD1     ILE  39  -9.942   6.027   0.367
  300    H    ASP  40           HN       ASP  40  -7.627   2.280   4.171
  301    HA   ASP  40           HA       ASP  40 -10.460   2.553   4.945
  302   1HB   ASP  40           HBR      ASP  40  -8.965   0.583   3.481
  303   2HB   ASP  40           HBS      ASP  40  -9.805  -0.160   4.872
  304    H    MET  41           HN       MET  41  -7.614   0.676   6.040
  305    HA   MET  41           HA       MET  41  -8.845  -0.216   8.374
  306   1HB   MET  41           HBR      MET  41  -6.347  -0.545   7.105
  307   2HB   MET  41           HBS      MET  41  -5.992  -0.004   8.766
  308   1HG   MET  41           HGS      MET  41  -6.147  -2.351   8.999
  309   2HG   MET  41           HGR      MET  41  -7.744  -1.762   9.512
  310   1HE   MET  41           HMEC     MET  41  -5.531  -2.882   6.742
  311   2HE   MET  41           HMEA     MET  41  -6.177  -4.516   7.036
  312   3HE   MET  41           HMEB     MET  41  -6.552  -3.670   5.513
  313    H    GLY  42           HN       GLY  42  -8.403   0.228  10.595
  314   1HA   GLY  42           HAR      GLY  42  -6.851   1.875  11.929
  315   2HA   GLY  42           HAS      GLY  42  -7.943   3.096  11.216
  316    HA   PRO  43           HA       PRO  43 -10.640   2.861  14.414
  317   1HB   PRO  43           HBS      PRO  43 -12.999   2.875  12.920
  318   2HB   PRO  43           HBR      PRO  43 -12.360   4.101  13.804
  319   1HG   PRO  43           HGS      PRO  43 -12.452   4.004  11.154
  320   2HG   PRO  43           HGR      PRO  43 -11.448   5.016  12.022
  321   1HD   PRO  43           HDS      PRO  43 -10.779   2.687  10.602
  322   2HD   PRO  43           HDR      PRO  43  -9.782   3.905  11.107
  323    H    GLU  44           HN       GLU  44 -11.536   1.678  15.942
  324    HA   GLU  44           HA       GLU  44 -12.628  -0.965  15.075
  325   1HB   GLU  44           HBR      GLU  44 -10.769  -0.978  16.696
  326   2HB   GLU  44           HBS      GLU  44 -11.592   0.126  17.654
  327   1HG   GLU  44           HGS      GLU  44 -13.520  -1.532  17.840
  328   2HG   GLU  44           HGR      GLU  44 -12.373  -2.790  17.303
  329    H    TRP  45           HN       TRP  45 -14.739  -1.024  14.935
  330    HA   TRP  45           HA       TRP  45 -16.277   1.167  16.212
  331   1HB   TRP  45           HBS      TRP  45 -16.225  -0.015  13.513
  332   2HB   TRP  45           HBR      TRP  45 -17.849   0.327  14.174
  333    HD1  TRP  45           HD1      TRP  45 -14.855   2.642  14.902
  334    HE1  TRP  45           HE1      TRP  45 -15.308   4.938  13.842
  335    HE3  TRP  45           HE3      TRP  45 -19.060   1.445  12.300
  336    HZ2  TRP  45           HZ2      TRP  45 -17.202   6.059  12.103
  337    HZ3  TRP  45           HZ3      TRP  45 -20.144   3.185  10.958
  338    HH2  TRP  45           HH2      TRP  45 -19.246   5.450  10.859
  339    H    ARG  46           HN       ARG  46 -15.792  -1.062  17.747
  340    HA   ARG  46           HA       ARG  46 -18.550  -1.606  18.436
  341   1HB   ARG  46           HBR      ARG  46 -17.829  -4.143  18.769
  342   2HB   ARG  46           HBS      ARG  46 -18.626  -3.548  17.285
  343   1HG   ARG  46           HGS      ARG  46 -15.829  -3.234  16.911
  344   2HG   ARG  46           HGR      ARG  46 -16.091  -4.867  17.588
  345   1HD   ARG  46           HDS      ARG  46 -16.180  -4.989  15.208
  346   2HD   ARG  46           HDR      ARG  46 -17.822  -5.245  15.865
  347    HE   ARG  46           HE       ARG  46 -16.986  -2.585  14.834
  348   1HH1  ARG  46           HH1Z     ARG  46 -18.981  -5.472  14.508
  349   2HH1  ARG  46           HH1E     ARG  46 -20.175  -4.671  13.542
  350   1HH2  ARG  46           HH2Z     ARG  46 -18.626  -1.540  13.669
  351   2HH2  ARG  46           HH2E     ARG  46 -19.972  -2.447  13.063
  352    H    ALA  47           HN       ALA  47 -18.289  -3.442  20.361
  353    HA   ALA  47           HA       ALA  47 -17.838  -3.558  22.603
  354   1HB   ALA  47           HMBA     ALA  47 -15.452  -3.868  21.820
  355   2HB   ALA  47           HMBC     ALA  47 -15.234  -2.117  22.071
  356   3HB   ALA  47           HMBB     ALA  47 -15.667  -3.168  23.444
  357    H    PHE  48           HN       PHE  48 -19.629  -2.096  22.680
  358    HA   PHE  48           HA       PHE  48 -19.099   0.800  22.758
  359   1HB   PHE  48           HBS      PHE  48 -21.214  -0.016  21.702
  360   2HB   PHE  48           HBR      PHE  48 -21.722  -0.660  23.291
  361    HD1  PHE  48           HD2      PHE  48 -20.757   2.583  21.599
  362    HD2  PHE  48           HD1      PHE  48 -22.742   0.626  24.821
  363    HE1  PHE  48           HE2      PHE  48 -21.796   4.729  22.254
  364    HE2  PHE  48           HE1      PHE  48 -23.788   2.742  25.489
  365    HZ   PHE  48           HZ       PHE  48 -23.366   4.783  24.170
  366    H    ASP  49           HN       ASP  49 -20.366  -1.773  24.902
  367    HA   ASP  49           HA       ASP  49 -19.368  -0.176  27.195
  368   1HB   ASP  49           HBR      ASP  49 -21.809  -1.714  26.859
  369   2HB   ASP  49           HBS      ASP  49 -20.875  -2.193  28.306
  370    H    ALA  50           HN       ALA  50 -18.264  -1.307  28.863
  371    HA   ALA  50           HA       ALA  50 -17.198  -3.924  28.336
  372   1HB   ALA  50           HMBA     ALA  50 -15.857  -2.019  26.948
  373   2HB   ALA  50           HMBC     ALA  50 -14.962  -2.003  28.488
  374   3HB   ALA  50           HMBB     ALA  50 -15.130  -3.521  27.571
   
  No H/Q in entry =         374
  Start of MODEL   11
    1   1H    MET   1           HN       MET   1  -1.170  -6.049 -18.699
    2   2H    MET   1           HNC      MET   1  -0.518  -6.212 -17.211
    3   3H    MET   1           HNB      MET   1   0.447  -5.943 -18.501
    4    HA   MET   1           HA       MET   1  -0.150  -8.020 -19.472
    5   1HB   MET   1           HBR      MET   1   0.940  -9.478 -17.691
    6   2HB   MET   1           HBS      MET   1   1.866  -8.060 -18.257
    7   1HG   MET   1           HGS      MET   1   0.961  -6.791 -16.248
    8   2HG   MET   1           HGR      MET   1   0.290  -8.336 -15.673
    9   1HE   MET   1           HMEC     MET   1   3.159  -6.741 -17.348
   10   2HE   MET   1           HMEA     MET   1   4.068  -6.392 -15.857
   11   3HE   MET   1           HMEB     MET   1   4.607  -7.697 -16.945
   12    H    VAL   2           HN       VAL   2  -1.388  -7.608 -16.143
   13    HA   VAL   2           HA       VAL   2  -3.185  -8.487 -15.056
   14    HB   VAL   2           HB       VAL   2  -5.234  -8.230 -16.202
   15   1HG1  VAL   2           HMGR     VAL   2  -3.437  -6.228 -15.947
   16   2HG1  VAL   2           HMGR     VAL   2  -3.793  -6.118 -17.687
   17   3HG1  VAL   2           HMGR     VAL   2  -5.114  -6.007 -16.499
   18   1HG2  VAL   2           HMGS     VAL   2  -4.209  -9.462 -18.341
   19   2HG2  VAL   2           HMGS     VAL   2  -5.666  -8.443 -18.409
   20   3HG2  VAL   2           HMGS     VAL   2  -4.091  -7.779 -18.905
   21    H    ASN   3           HN       ASN   3  -1.308 -10.448 -15.866
   22    HA   ASN   3           HA       ASN   3  -3.138 -12.765 -16.149
   23   1HB   ASN   3           HBR      ASN   3  -0.770 -12.313 -17.494
   24   2HB   ASN   3           HBS      ASN   3  -0.323 -13.454 -16.193
   25   1HD2  ASN   3           HD2Z     ASN   3  -2.114 -14.799 -19.495
   26   2HD2  ASN   3           HD2E     ASN   3  -1.313 -13.272 -19.335
   27    H    LYS   4           HN       LYS   4  -1.107 -10.934 -14.072
   28    HA   LYS   4           HA       LYS   4  -1.594 -12.892 -11.876
   29   1HB   LYS   4           HBS      LYS   4   0.030 -10.395 -11.514
   30   2HB   LYS   4           HBR      LYS   4   0.106 -11.956 -10.648
   31   1HG   LYS   4           HGR      LYS   4   1.170 -11.311 -13.422
   32   2HG   LYS   4           HGS      LYS   4   2.106 -11.744 -11.963
   33   1HD   LYS   4           HDS      LYS   4   1.810 -13.925 -12.233
   34   2HD   LYS   4           HDR      LYS   4   0.124 -13.744 -12.633
   35   1HE   LYS   4           HES      LYS   4   1.009 -14.648 -14.563
   36   2HE   LYS   4           HER      LYS   4   0.916 -12.898 -14.912
   37   1HZ   LYS   4           HZA      LYS   4   3.253 -12.773 -14.262
   38   2HZ   LYS   4           HZB      LYS   4   3.310 -14.396 -14.101
   39   3HZ   LYS   4           HZC      LYS   4   3.022 -13.732 -15.564
   40    H    GLN   5           HN       GLN   5  -2.007 -11.649  -9.749
   41    HA   GLN   5           HA       GLN   5  -4.309  -9.864 -10.335
   42   1HB   GLN   5           HBR      GLN   5  -4.447 -12.397  -9.377
   43   2HB   GLN   5           HBS      GLN   5  -4.378 -11.461  -7.856
   44   1HG   GLN   5           HGS      GLN   5  -6.685 -11.923  -8.643
   45   2HG   GLN   5           HGR      GLN   5  -6.312 -10.183  -8.484
   46   1HE2  GLN   5           HE2Z     GLN   5  -6.867 -11.907 -12.193
   47   2HE2  GLN   5           HE2E     GLN   5  -6.279 -12.846 -10.861
   48    H    LYS   6           HN       LYS   6  -2.125 -10.807  -7.655
   49    HA   LYS   6           HA       LYS   6  -1.942  -7.991  -6.774
   50   1HB   LYS   6           HBR      LYS   6  -2.488  -8.993  -4.403
   51   2HB   LYS   6           HBS      LYS   6  -3.781  -8.404  -5.486
   52   1HG   LYS   6           HGR      LYS   6  -4.783 -10.393  -5.348
   53   2HG   LYS   6           HGS      LYS   6  -3.351 -11.157  -6.093
   54   1HD   LYS   6           HDS      LYS   6  -2.471 -10.882  -3.562
   55   2HD   LYS   6           HDR      LYS   6  -4.182 -11.006  -3.261
   56   1HE   LYS   6           HES      LYS   6  -3.394 -13.012  -5.168
   57   2HE   LYS   6           HER      LYS   6  -2.388 -13.086  -3.695
   58   1HZ   LYS   6           HZC      LYS   6  -4.821 -12.773  -2.696
   59   2HZ   LYS   6           HZA      LYS   6  -5.174 -13.650  -4.027
   60   3HZ   LYS   6           HZB      LYS   6  -4.113 -14.226  -2.927
   61    H    VAL   7           HN       VAL   7   0.234  -7.992  -7.019
   62    HA   VAL   7           HA       VAL   7   1.873  -9.837  -5.399
   63    HB   VAL   7           HB       VAL   7   3.076 -10.652  -7.309
   64   1HG1  VAL   7           HMGR     VAL   7   1.112 -11.935  -6.585
   65   2HG1  VAL   7           HMGR     VAL   7   0.106 -11.054  -7.760
   66   3HG1  VAL   7           HMGR     VAL   7   1.421 -12.111  -8.329
   67   1HG2  VAL   7           HMGS     VAL   7   2.490  -8.503  -8.678
   68   2HG2  VAL   7           HMGS     VAL   7   2.802 -10.049  -9.504
   69   3HG2  VAL   7           HMGS     VAL   7   1.129  -9.490  -9.264
   70    H    CYS   8           HN       CYS   8   4.302  -9.383  -6.275
   71    HA   CYS   8           HA       CYS   8   4.732  -6.462  -6.493
   72   1HB   CYS   8           HBS      CYS   8   6.151  -7.906  -4.973
   73   2HB   CYS   8           HBR      CYS   8   6.792  -8.673  -6.452
   74    HA   PRO   9           HA       PRO   9   4.953  -6.809 -10.904
   75   1HB   PRO   9           HBR      PRO   9   5.264  -4.022 -10.742
   76   2HB   PRO   9           HBS      PRO   9   4.133  -4.876 -11.573
   77   1HG   PRO   9           HGS      PRO   9   3.650  -3.496  -9.373
   78   2HG   PRO   9           HGR      PRO   9   2.657  -4.697  -9.969
   79   1HD   PRO   9           HDS      PRO   9   4.331  -4.785  -7.726
   80   2HD   PRO   9           HDR      PRO   9   3.107  -5.820  -8.135
   81    H    ALA  10           HN       ALA  10   7.137  -5.955  -8.586
   82    HA   ALA  10           HA       ALA  10   9.173  -4.976 -10.487
   83   1HB   ALA  10           HMBC     ALA  10   8.580  -4.217  -7.962
   84   2HB   ALA  10           HMBB     ALA  10   9.880  -5.393  -7.644
   85   3HB   ALA  10           HMBA     ALA  10  10.173  -4.010  -8.730
   86    H    CYS  11           HN       CYS  11   9.332  -7.282  -7.742
   87    HA   CYS  11           HA       CYS  11  11.452  -8.629  -9.192
   88   1HB   CYS  11           HBS      CYS  11  11.945  -9.766  -7.123
   89   2HB   CYS  11           HBR      CYS  11  11.791  -8.004  -6.892
   90    H    GLU  12           HN       GLU  12   8.173  -9.081  -9.117
   91    HA   GLU  12           HA       GLU  12   6.685 -10.807  -9.312
   92   1HB   GLU  12           HBS      GLU  12   8.508 -11.192 -11.113
   93   2HB   GLU  12           HBR      GLU  12   9.006 -12.510 -10.203
   94   1HG   GLU  12           HGS      GLU  12   6.467 -11.985 -11.710
   95   2HG   GLU  12           HGR      GLU  12   7.419 -13.493 -11.758
   96    H    SER  13           HN       SER  13   7.418 -10.319  -6.837
   97    HA   SER  13           HA       SER  13   7.505 -13.048  -5.654
   98   1HB   SER  13           HBS      SER  13   7.728 -12.050  -3.482
   99   2HB   SER  13           HBR      SER  13   9.034 -11.451  -4.544
  100    HG   SER  13           HG       SER  13   7.458  -9.655  -5.063
  101    H    ALA  14           HN       ALA  14   5.908 -12.790  -3.548
  102    HA   ALA  14           HA       ALA  14   3.281 -11.940  -4.635
  103   1HB   ALA  14           HMBA     ALA  14   3.975 -14.373  -5.070
  104   2HB   ALA  14           HMBB     ALA  14   3.808 -14.605  -3.310
  105   3HB   ALA  14           HMBC     ALA  14   2.400 -14.105  -4.281
  106    H    GLU  15           HN       GLU  15   5.395 -11.908  -2.066
  107    HA   GLU  15           HA       GLU  15   3.271 -12.095  -0.006
  108   1HB   GLU  15           HBR      GLU  15   6.276 -12.438  -0.028
  109   2HB   GLU  15           HBS      GLU  15   5.380 -12.325   1.386
  110   1HG   GLU  15           HGS      GLU  15   5.293 -14.542   1.332
  111   2HG   GLU  15           HGR      GLU  15   3.870 -14.290   0.286
  112    H    LEU  16           HN       LEU  16   3.203  -9.707  -1.265
  113    HA   LEU  16           HA       LEU  16   4.679  -7.617  -0.120
  114   1HB   LEU  16           HBR      LEU  16   1.750  -7.519  -0.871
  115   2HB   LEU  16           HBS      LEU  16   2.966  -6.211  -0.945
  116    HG   LEU  16           HG       LEU  16   2.821  -8.653  -2.732
  117   1HD1  LEU  16           HMDR     LEU  16   1.782  -5.904  -2.880
  118   2HD1  LEU  16           HMDR     LEU  16   2.747  -6.397  -4.294
  119   3HD1  LEU  16           HMDR     LEU  16   1.329  -7.357  -3.806
  120   1HD2  LEU  16           HMDS     LEU  16   5.096  -7.547  -1.979
  121   2HD2  LEU  16           HMDS     LEU  16   4.810  -7.987  -3.682
  122   3HD2  LEU  16           HMDS     LEU  16   4.622  -6.295  -3.156
  123    H    ILE  17           HN       ILE  17   3.576  -5.897   1.304
  124    HA   ILE  17           HA       ILE  17   2.255  -6.989   3.677
  125    HB   ILE  17           HB       ILE  17   4.352  -6.339   5.075
  126   1HG1  ILE  17           HG1R     ILE  17   5.661  -6.777   2.362
  127   2HG1  ILE  17           HG1S     ILE  17   5.555  -5.232   3.253
  128   1HG2  ILE  17           HMG2     ILE  17   3.493  -8.653   4.784
  129   2HG2  ILE  17           HMG2     ILE  17   4.586  -8.838   3.387
  130   3HG2  ILE  17           HMG2     ILE  17   5.259  -8.556   5.015
  131   1HD1  ILE  17           HMD1     ILE  17   6.764  -6.795   5.113
  132   2HD1  ILE  17           HMD1     ILE  17   7.389  -7.525   3.610
  133   3HD1  ILE  17           HMD1     ILE  17   7.633  -5.786   3.926
  134    H    TYR  18           HN       TYR  18   2.653  -5.262   5.527
  135    HA   TYR  18           HA       TYR  18   2.088  -2.606   4.297
  136   1HB   TYR  18           HBR      TYR  18   0.069  -4.064   4.949
  137   2HB   TYR  18           HBS      TYR  18   0.556  -3.759   6.641
  138    HD1  TYR  18           HD1      TYR  18   0.912  -1.171   7.215
  139    HD2  TYR  18           HD2      TYR  18  -1.510  -2.653   4.048
  140    HE1  TYR  18           HE1      TYR  18  -0.350   0.937   7.202
  141    HE2  TYR  18           HE2      TYR  18  -2.779  -0.553   4.025
  142    HH   TYR  18           HH       TYR  18  -1.712   2.115   4.837
  143    H    ASP  19           HN       ASP  19   2.332  -0.799   5.665
  144    HA   ASP  19           HA       ASP  19   4.019  -1.165   8.047
  145   1HB   ASP  19           HBS      ASP  19   5.367  -1.076   5.806
  146   2HB   ASP  19           HBR      ASP  19   5.042   0.677   5.934
  147    HA   PRO  20           HA       PRO  20   0.796   1.790   8.708
  148   1HB   PRO  20           HBS      PRO  20   0.987   1.617  11.406
  149   2HB   PRO  20           HBR      PRO  20  -0.110   0.832  10.471
  150   1HG   PRO  20           HGS      PRO  20   2.174  -0.174  11.717
  151   2HG   PRO  20           HGR      PRO  20   0.862  -1.021  11.131
  152   1HD   PRO  20           HDS      PRO  20   3.260  -0.951   9.963
  153   2HD   PRO  20           HDR      PRO  20   1.860  -1.400   9.207
  154    H    GLU  21           HN       GLU  21   3.996   2.012   9.482
  155    HA   GLU  21           HA       GLU  21   3.786   4.518  10.952
  156   1HB   GLU  21           HBR      GLU  21   6.110   2.866   9.937
  157   2HB   GLU  21           HBS      GLU  21   6.261   4.288  10.816
  158   1HG   GLU  21           HGS      GLU  21   4.672   3.208  12.568
  159   2HG   GLU  21           HGR      GLU  21   5.234   1.655  11.891
  160    H    ARG  22           HN       ARG  22   4.686   3.427   7.712
  161    HA   ARG  22           HA       ARG  22   5.152   6.223   6.856
  162   1HB   ARG  22           HBR      ARG  22   5.340   3.632   5.283
  163   2HB   ARG  22           HBS      ARG  22   5.771   5.267   4.704
  164   1HG   ARG  22           HGS      ARG  22   7.173   4.568   7.167
  165   2HG   ARG  22           HGR      ARG  22   7.482   3.393   5.857
  166   1HD   ARG  22           HDS      ARG  22   8.788   4.814   4.798
  167   2HD   ARG  22           HDR      ARG  22   7.536   6.087   4.848
  168    HE   ARG  22           HE       ARG  22   8.483   6.914   6.858
  169   1HH1  ARG  22           HH1Z     ARG  22  10.125   3.960   5.852
  170   2HH1  ARG  22           HH1E     ARG  22  11.567   4.331   6.736
  171   1HH2  ARG  22           HH2Z     ARG  22  10.432   7.427   7.894
  172   2HH2  ARG  22           HH2E     ARG  22  11.742   6.293   7.893
  173    H    GLY  23           HN       GLY  23   2.723   3.800   7.017
  174   1HA   GLY  23           HAR      GLY  23   0.537   3.709   6.232
  175   2HA   GLY  23           HAS      GLY  23   0.738   5.336   5.528
  176    H    GLU  24           HN       GLU  24   2.386   2.172   5.121
  177    HA   GLU  24           HA       GLU  24   2.093   2.461   2.160
  178   1HB   GLU  24           HBR      GLU  24   4.297   3.002   3.714
  179   2HB   GLU  24           HBS      GLU  24   4.507   1.365   3.413
  180   1HG   GLU  24           HGR      GLU  24   5.595   1.946   1.478
  181   2HG   GLU  24           HGS      GLU  24   3.914   2.094   0.899
  182    H    ILE  25           HN       ILE  25   1.927   0.601   1.007
  183    HA   ILE  25           HA       ILE  25   2.157  -1.980   2.478
  184    HB   ILE  25           HB       ILE  25   0.609  -1.590  -0.120
  185   1HG1  ILE  25           HG1R     ILE  25  -1.424  -1.833   1.577
  186   2HG1  ILE  25           HG1S     ILE  25  -0.258  -1.099   2.713
  187   1HG2  ILE  25           HMG2     ILE  25   1.440  -3.884   0.734
  188   2HG2  ILE  25           HMG2     ILE  25   0.116  -3.735   1.921
  189   3HG2  ILE  25           HMG2     ILE  25  -0.245  -3.715   0.175
  190   1HD1  ILE  25           HMD1     ILE  25  -0.113   0.448   0.371
  191   2HD1  ILE  25           HMD1     ILE  25  -1.848   0.142   0.648
  192   3HD1  ILE  25           HMD1     ILE  25  -0.859   0.891   1.929
  193    H    VAL  26           HN       VAL  26   3.977  -2.952   2.047
  194    HA   VAL  26           HA       VAL  26   5.455  -2.096  -0.389
  195    HB   VAL  26           HB       VAL  26   6.718  -2.993   2.195
  196   1HG1  VAL  26           HMGR     VAL  26   7.741  -1.416  -0.174
  197   2HG1  VAL  26           HMGR     VAL  26   8.628  -1.623   1.355
  198   3HG1  VAL  26           HMGR     VAL  26   8.236  -3.043   0.356
  199   1HG2  VAL  26           HMGS     VAL  26   5.377  -0.448   1.635
  200   2HG2  VAL  26           HMGS     VAL  26   5.889  -1.173   3.179
  201   3HG2  VAL  26           HMGS     VAL  26   7.062  -0.275   2.186
  202    H    CYS  27           HN       CYS  27   7.220  -3.647  -1.003
  203    HA   CYS  27           HA       CYS  27   6.284  -6.402  -1.194
  204   1HB   CYS  27           HBS      CYS  27   7.625  -5.230  -2.952
  205   2HB   CYS  27           HBR      CYS  27   9.014  -5.261  -1.833
  206    H    ALA  28           HN       ALA  28   7.276  -8.183  -0.229
  207    HA   ALA  28           HA       ALA  28   8.785  -7.604   2.267
  208   1HB   ALA  28           HMBB     ALA  28   6.694  -8.937   2.412
  209   2HB   ALA  28           HMBA     ALA  28   7.448 -10.172   1.372
  210   3HB   ALA  28           HMBC     ALA  28   8.145  -9.808   2.972
  211    H    LYS  29           HN       LYS  29   9.779  -7.613  -0.595
  212    HA   LYS  29           HA       LYS  29  11.835  -9.743  -0.323
  213   1HB   LYS  29           HBS      LYS  29   9.902 -10.248  -2.021
  214   2HB   LYS  29           HBR      LYS  29  10.761  -9.066  -3.050
  215   1HG   LYS  29           HGR      LYS  29  11.805 -11.696  -1.944
  216   2HG   LYS  29           HGS      LYS  29  11.541 -11.248  -3.654
  217   1HD   LYS  29           HDS      LYS  29  13.764 -10.953  -3.588
  218   2HD   LYS  29           HDR      LYS  29  13.236  -9.356  -3.136
  219   1HE   LYS  29           HES      LYS  29  14.565  -9.510  -1.377
  220   2HE   LYS  29           HER      LYS  29  13.367 -10.656  -0.713
  221   1HZ   LYS  29           HZB      LYS  29  15.522 -11.542  -2.483
  222   2HZ   LYS  29           HZC      LYS  29  15.743 -11.414  -0.870
  223   3HZ   LYS  29           HZA      LYS  29  14.613 -12.435  -1.461
  224    H    CYS  30           HN       CYS  30  11.012  -7.246  -2.760
  225    HA   CYS  30           HA       CYS  30  13.780  -6.426  -2.706
  226   1HB   CYS  30           HBS      CYS  30  13.240  -5.109  -4.674
  227   2HB   CYS  30           HBR      CYS  30  12.690  -6.802  -4.805
  228    H    GLY  31           HN       GLY  31  11.194  -5.436  -0.899
  229   1HA   GLY  31           HAR      GLY  31  11.118  -3.680   0.592
  230   2HA   GLY  31           HAS      GLY  31  12.424  -2.876  -0.323
  231    H    TYR  32           HN       TYR  32  10.133  -3.710  -2.560
  232    HA   TYR  32           HA       TYR  32   9.872  -0.854  -3.134
  233   1HB   TYR  32           HBS      TYR  32  10.302  -2.358  -4.976
  234   2HB   TYR  32           HBR      TYR  32   8.857  -3.332  -4.583
  235    HD1  TYR  32           HD2      TYR  32   9.731   0.237  -5.348
  236    HD2  TYR  32           HD1      TYR  32   6.957  -2.941  -5.889
  237    HE1  TYR  32           HE2      TYR  32   8.447   1.633  -6.904
  238    HE2  TYR  32           HE1      TYR  32   5.643  -1.542  -7.424
  239    HH   TYR  32           HH       TYR  32   6.241   0.286  -9.066
  240    H    VAL  33           HN       VAL  33   8.246   0.404  -2.649
  241    HA   VAL  33           HA       VAL  33   5.955  -0.431  -1.156
  242    HB   VAL  33           HB       VAL  33   6.451   2.089  -2.757
  243   1HG1  VAL  33           HMGR     VAL  33   4.298   1.440  -0.735
  244   2HG1  VAL  33           HMGR     VAL  33   4.713   3.091  -1.257
  245   3HG1  VAL  33           HMGR     VAL  33   4.097   1.912  -2.440
  246   1HG2  VAL  33           HMGS     VAL  33   7.570   1.160  -0.301
  247   2HG2  VAL  33           HMGS     VAL  33   7.835   2.703  -1.150
  248   3HG2  VAL  33           HMGS     VAL  33   6.517   2.555   0.037
  249    H    ILE  34           HN       ILE  34   3.728  -0.205  -1.864
  250    HA   ILE  34           HA       ILE  34   3.336  -0.956  -4.715
  251    HB   ILE  34           HB       ILE  34   1.818  -1.641  -2.158
  252   1HG1  ILE  34           HG1R     ILE  34   3.962  -2.825  -2.750
  253   2HG1  ILE  34           HG1S     ILE  34   2.534  -3.871  -2.502
  254   1HG2  ILE  34           HMG2     ILE  34   0.832  -1.635  -4.916
  255   2HG2  ILE  34           HMG2     ILE  34   0.650  -3.201  -4.084
  256   3HG2  ILE  34           HMG2     ILE  34  -0.046  -1.724  -3.367
  257   1HD1  ILE  34           HMD1     ILE  34   2.275  -3.947  -5.002
  258   2HD1  ILE  34           HMD1     ILE  34   3.840  -3.099  -5.125
  259   3HD1  ILE  34           HMD1     ILE  34   3.756  -4.716  -4.375
  260    H    GLU  35           HN       GLU  35   1.155   0.273  -2.185
  261    HA   GLU  35           HA       GLU  35   0.552   2.721  -3.744
  262   1HB   GLU  35           HBR      GLU  35  -0.661   0.386  -4.353
  263   2HB   GLU  35           HBS      GLU  35  -1.583   0.812  -3.017
  264   1HG   GLU  35           HGS      GLU  35  -1.192   2.813  -5.202
  265   2HG   GLU  35           HGR      GLU  35  -2.520   1.628  -5.328
  266    H    GLU  36           HN       GLU  36   1.033   4.004  -2.033
  267    HA   GLU  36           HA       GLU  36   0.410   3.513   0.640
  268   1HB   GLU  36           HBS      GLU  36   0.881   5.794   0.964
  269   2HB   GLU  36           HBR      GLU  36   2.034   5.113  -0.046
  270   1HG   GLU  36           HGS      GLU  36   0.285   6.072  -1.909
  271   2HG   GLU  36           HGR      GLU  36  -0.055   7.243  -0.607
  272    H    ASN  37           HN       ASN  37  -1.263   3.912   1.955
  273    HA   ASN  37           HA       ASN  37  -3.094   5.969   1.614
  274   1HB   ASN  37           HBR      ASN  37  -5.191   4.863   1.137
  275   2HB   ASN  37           HBS      ASN  37  -4.039   4.749  -0.225
  276   1HD2  ASN  37           HD2Z     ASN  37  -5.519   1.417   1.615
  277   2HD2  ASN  37           HD2E     ASN  37  -5.914   3.017   2.147
  278    H    ILE  38           HN       ILE  38  -3.468   6.542   3.577
  279    HA   ILE  38           HA       ILE  38  -4.917   4.961   5.371
  280    HB   ILE  38           HB       ILE  38  -2.763   3.713   5.631
  281   1HG1  ILE  38           HG1R     ILE  38  -3.275   5.089   8.256
  282   2HG1  ILE  38           HG1S     ILE  38  -4.624   4.252   7.436
  283   1HG2  ILE  38           HMG2     ILE  38  -1.162   5.511   5.317
  284   2HG2  ILE  38           HMG2     ILE  38  -1.715   6.288   6.826
  285   3HG2  ILE  38           HMG2     ILE  38  -0.906   4.700   6.885
  286   1HD1  ILE  38           HMD1     ILE  38  -1.975   2.941   8.103
  287   2HD1  ILE  38           HMD1     ILE  38  -3.416   2.882   9.153
  288   3HD1  ILE  38           HMD1     ILE  38  -3.469   2.157   7.524
  289    H    ILE  39           HN       ILE  39  -5.230   7.433   4.329
  290    HA   ILE  39           HA       ILE  39  -4.844   9.215   6.684
  291    HB   ILE  39           HB       ILE  39  -5.560   9.863   3.782
  292   1HG1  ILE  39           HG1R     ILE  39  -3.091  10.382   5.479
  293   2HG1  ILE  39           HG1S     ILE  39  -3.232   9.318   4.050
  294   1HG2  ILE  39           HMG2     ILE  39  -6.781  11.337   5.310
  295   2HG2  ILE  39           HMG2     ILE  39  -5.246  11.784   6.100
  296   3HG2  ILE  39           HMG2     ILE  39  -5.528  12.213   4.393
  297   1HD1  ILE  39           HMD1     ILE  39  -3.973  11.645   2.931
  298   2HD1  ILE  39           HMD1     ILE  39  -2.915  12.268   4.224
  299   3HD1  ILE  39           HMD1     ILE  39  -2.276  11.105   3.033
  300    H    ASP  40           HN       ASP  40  -7.243   8.174   4.239
  301    HA   ASP  40           HA       ASP  40  -9.054   7.291   6.144
  302   1HB   ASP  40           HBR      ASP  40  -9.149  10.005   6.209
  303   2HB   ASP  40           HBS      ASP  40 -10.463   9.618   5.061
  304    H    MET  41           HN       MET  41 -10.787   6.224   5.272
  305    HA   MET  41           HA       MET  41 -10.461   5.332   2.632
  306   1HB   MET  41           HBS      MET  41 -12.866   5.072   4.462
  307   2HB   MET  41           HBR      MET  41 -12.594   4.146   2.958
  308   1HG   MET  41           HGS      MET  41 -10.524   3.192   3.910
  309   2HG   MET  41           HGR      MET  41 -10.759   4.158   5.387
  310   1HE   MET  41           HMEA     MET  41 -11.797   1.487   3.083
  311   2HE   MET  41           HMEB     MET  41 -11.246   0.448   4.421
  312   3HE   MET  41           HMEC     MET  41 -12.961   0.441   3.936
  313    H    GLY  42           HN       GLY  42 -10.492   6.851   1.084
  314   1HA   GLY  42           HAS      GLY  42 -11.567   8.130  -0.573
  315   2HA   GLY  42           HAR      GLY  42 -13.055   8.140   0.413
  316    HA   PRO  43           HA       PRO  43 -10.240  12.021   0.931
  317   1HB   PRO  43           HBR      PRO  43 -11.490  13.280  -1.226
  318   2HB   PRO  43           HBS      PRO  43  -9.882  13.152  -0.919
  319   1HG   PRO  43           HGS      PRO  43 -11.161  11.871  -2.854
  320   2HG   PRO  43           HGR      PRO  43  -9.649  11.458  -2.279
  321   1HD   PRO  43           HDS      PRO  43 -12.098  10.159  -1.840
  322   2HD   PRO  43           HDR      PRO  43 -10.568   9.568  -1.627
  323    H    GLU  44           HN       GLU  44 -13.524  11.491   0.152
  324    HA   GLU  44           HA       GLU  44 -15.437  12.000   1.308
  325   1HB   GLU  44           HBR      GLU  44 -13.398  11.387   3.099
  326   2HB   GLU  44           HBS      GLU  44 -13.938  12.878   3.647
  327   1HG   GLU  44           HGS      GLU  44 -15.732  12.110   4.623
  328   2HG   GLU  44           HGR      GLU  44 -16.327  11.320   3.137
  329    H    TRP  45           HN       TRP  45 -13.846  14.125  -0.105
  330    HA   TRP  45           HA       TRP  45 -15.681  16.265   0.471
  331   1HB   TRP  45           HBS      TRP  45 -13.269  16.166   2.011
  332   2HB   TRP  45           HBR      TRP  45 -13.215  17.566   0.901
  333    HD1  TRP  45           HD1      TRP  45 -16.430  18.186   1.101
  334    HE1  TRP  45           HE1      TRP  45 -17.327  19.321   3.224
  335    HE3  TRP  45           HE3      TRP  45 -12.574  17.073   4.226
  336    HZ2  TRP  45           HZ2      TRP  45 -16.473  19.694   5.869
  337    HZ3  TRP  45           HZ3      TRP  45 -12.682  17.849   6.547
  338    HH2  TRP  45           HH2      TRP  45 -14.591  19.127   7.366
  339    H    ARG  46           HN       ARG  46 -16.153  16.787  -1.508
  340    HA   ARG  46           HA       ARG  46 -14.271  18.267  -3.019
  341   1HB   ARG  46           HBR      ARG  46 -14.170  15.527  -3.636
  342   2HB   ARG  46           HBS      ARG  46 -15.142  16.278  -4.934
  343   1HG   ARG  46           HGS      ARG  46 -13.384  17.527  -5.724
  344   2HG   ARG  46           HGR      ARG  46 -12.559  17.573  -4.140
  345   1HD   ARG  46           HDS      ARG  46 -11.462  15.669  -4.509
  346   2HD   ARG  46           HDR      ARG  46 -12.861  14.896  -5.308
  347    HE   ARG  46           HE       ARG  46 -11.574  16.968  -6.895
  348   1HH1  ARG  46           HH1Z     ARG  46 -11.897  13.525  -6.212
  349   2HH1  ARG  46           HH1E     ARG  46 -11.015  13.050  -7.625
  350   1HH2  ARG  46           HH2Z     ARG  46 -10.315  16.313  -8.663
  351   2HH2  ARG  46           HH2E     ARG  46 -10.121  14.627  -9.013
  352    H    ALA  47           HN       ALA  47 -17.065  16.160  -3.808
  353    HA   ALA  47           HA       ALA  47 -18.451  18.583  -4.857
  354   1HB   ALA  47           HMBC     ALA  47 -17.444  16.655  -6.380
  355   2HB   ALA  47           HMBA     ALA  47 -18.988  15.869  -5.966
  356   3HB   ALA  47           HMBB     ALA  47 -18.984  17.465  -6.759
  357    H    PHE  48           HN       PHE  48 -18.553  17.015  -2.211
  358    HA   PHE  48           HA       PHE  48 -20.158  16.616  -0.638
  359   1HB   PHE  48           HBR      PHE  48 -21.053  18.822  -2.264
  360   2HB   PHE  48           HBS      PHE  48 -22.468  17.846  -1.776
  361    HD1  PHE  48           HD2      PHE  48 -22.210  17.065   0.907
  362    HD2  PHE  48           HD1      PHE  48 -20.468  20.486  -0.945
  363    HE1  PHE  48           HE2      PHE  48 -22.117  18.200   3.104
  364    HE2  PHE  48           HE1      PHE  48 -20.367  21.633   1.221
  365    HZ   PHE  48           HZ       PHE  48 -21.245  20.517   3.238
  366    H    ASP  49           HN       ASP  49 -22.824  16.250  -0.617
  367    HA   ASP  49           HA       ASP  49 -24.571  14.901  -1.080
  368   1HB   ASP  49           HBR      ASP  49 -23.949  15.967  -3.403
  369   2HB   ASP  49           HBS      ASP  49 -23.587  14.266  -3.814
  370    H    ALA  50           HN       ALA  50 -25.246  12.668  -1.642
  371    HA   ALA  50           HA       ALA  50 -23.302  10.950  -0.269
  372   1HB   ALA  50           HMBB     ALA  50 -26.253  11.093  -0.583
  373   2HB   ALA  50           HMBC     ALA  50 -25.537   9.476  -0.365
  374   3HB   ALA  50           HMBA     ALA  50 -25.254  10.747   0.852
   
  No H/Q in entry =         374
  Start of MODEL   12
    1   1H    MET   1           HN       MET   1  -0.914 -13.797 -18.016
    2   2H    MET   1           HNC      MET   1   0.128 -12.547 -17.873
    3   3H    MET   1           HNB      MET   1  -0.258 -13.124 -19.351
    4    HA   MET   1           HA       MET   1   0.985 -14.961 -19.205
    5   1HB   MET   1           HBR      MET   1   2.300 -12.707 -17.686
    6   2HB   MET   1           HBS      MET   1   3.153 -14.242 -18.015
    7   1HG   MET   1           HGS      MET   1   2.854 -13.940 -20.423
    8   2HG   MET   1           HGR      MET   1   1.847 -12.499 -20.140
    9   1HE   MET   1           HMEA     MET   1   2.860 -10.527 -18.418
   10   2HE   MET   1           HMEB     MET   1   4.250  -9.735 -19.202
   11   3HE   MET   1           HMEC     MET   1   2.825 -10.193 -20.169
   12    H    VAL   2           HN       VAL   2   0.528 -13.548 -15.962
   13    HA   VAL   2           HA       VAL   2   0.125 -16.293 -14.917
   14    HB   VAL   2           HB       VAL   2   1.417 -15.423 -12.858
   15   1HG1  VAL   2           HMGR     VAL   2   2.229 -16.846 -15.207
   16   2HG1  VAL   2           HMGR     VAL   2   3.602 -15.889 -14.600
   17   3HG1  VAL   2           HMGR     VAL   2   2.773 -17.040 -13.524
   18   1HG2  VAL   2           HMGS     VAL   2   1.852 -13.239 -14.686
   19   2HG2  VAL   2           HMGS     VAL   2   2.295 -13.396 -12.969
   20   3HG2  VAL   2           HMGS     VAL   2   3.401 -13.990 -14.231
   21    H    ASN   3           HN       ASN   3  -0.533 -16.013 -12.468
   22    HA   ASN   3           HA       ASN   3  -2.971 -14.503 -12.338
   23   1HB   ASN   3           HBS      ASN   3  -1.525 -15.508  -9.916
   24   2HB   ASN   3           HBR      ASN   3  -3.276 -15.339 -10.227
   25   1HD2  ASN   3           HD2Z     ASN   3  -1.239 -18.742 -11.216
   26   2HD2  ASN   3           HD2E     ASN   3  -0.436 -17.344 -10.579
   27    H    LYS   4           HN       LYS   4  -3.267 -13.002 -10.363
   28    HA   LYS   4           HA       LYS   4  -0.894 -11.353  -9.818
   29   1HB   LYS   4           HBS      LYS   4  -2.971 -10.452 -11.569
   30   2HB   LYS   4           HBR      LYS   4  -3.086  -9.547 -10.032
   31   1HG   LYS   4           HGR      LYS   4  -1.001  -8.564 -10.296
   32   2HG   LYS   4           HGS      LYS   4  -0.405  -9.866 -11.366
   33   1HD   LYS   4           HDS      LYS   4  -0.696  -7.826 -12.609
   34   2HD   LYS   4           HDR      LYS   4  -1.740  -9.101 -13.174
   35   1HE   LYS   4           HES      LYS   4  -3.230  -7.703 -11.236
   36   2HE   LYS   4           HER      LYS   4  -2.428  -6.491 -12.273
   37   1HZ   LYS   4           HZA      LYS   4  -3.306  -7.751 -14.173
   38   2HZ   LYS   4           HZB      LYS   4  -4.163  -8.692 -13.150
   39   3HZ   LYS   4           HZC      LYS   4  -4.477  -7.093 -13.243
   40    H    GLN   5           HN       GLN   5  -4.337 -10.673  -9.284
   41    HA   GLN   5           HA       GLN   5  -5.624 -10.579  -7.407
   42   1HB   GLN   5           HBR      GLN   5  -4.008 -12.903  -6.891
   43   2HB   GLN   5           HBS      GLN   5  -4.236 -11.962  -5.389
   44   1HG   GLN   5           HGS      GLN   5  -6.298 -12.743  -5.178
   45   2HG   GLN   5           HGR      GLN   5  -6.731 -12.094  -6.785
   46   1HE2  GLN   5           HE2Z     GLN   5  -6.501 -15.130  -8.508
   47   2HE2  GLN   5           HE2E     GLN   5  -6.431 -13.404  -8.640
   48    H    LYS   6           HN       LYS   6  -2.383 -10.923  -5.944
   49    HA   LYS   6           HA       LYS   6  -2.012  -8.081  -5.730
   50   1HB   LYS   6           HBR      LYS   6  -1.893  -7.922  -3.297
   51   2HB   LYS   6           HBS      LYS   6  -3.550  -8.294  -3.855
   52   1HG   LYS   6           HGR      LYS   6  -3.049 -10.732  -3.326
   53   2HG   LYS   6           HGS      LYS   6  -1.561 -10.161  -2.519
   54   1HD   LYS   6           HDS      LYS   6  -4.064  -8.812  -1.718
   55   2HD   LYS   6           HDR      LYS   6  -3.964 -10.507  -1.328
   56   1HE   LYS   6           HES      LYS   6  -2.679 -10.095   0.410
   57   2HE   LYS   6           HER      LYS   6  -1.470  -9.332  -0.662
   58   1HZ   LYS   6           HZC      LYS   6  -3.831  -7.842   0.176
   59   2HZ   LYS   6           HZA      LYS   6  -2.551  -7.964   1.182
   60   3HZ   LYS   6           HZB      LYS   6  -2.370  -7.282  -0.291
   61    H    VAL   7           HN       VAL   7   0.019  -8.072  -6.352
   62    HA   VAL   7           HA       VAL   7   1.915 -10.052  -5.204
   63    HB   VAL   7           HB       VAL   7   2.763 -10.535  -7.395
   64   1HG1  VAL   7           HMGR     VAL   7  -0.062 -11.061  -6.741
   65   2HG1  VAL   7           HMGR     VAL   7   0.380 -11.315  -8.445
   66   3HG1  VAL   7           HMGR     VAL   7   1.258 -12.180  -7.160
   67   1HG2  VAL   7           HMGS     VAL   7   0.664  -8.636  -8.463
   68   2HG2  VAL   7           HMGS     VAL   7   2.431  -8.434  -8.520
   69   3HG2  VAL   7           HMGS     VAL   7   1.654  -9.735  -9.453
   70    H    CYS   8           HN       CYS   8   4.202  -9.499  -6.159
   71    HA   CYS   8           HA       CYS   8   4.705  -6.582  -6.129
   72   1HB   CYS   8           HBS      CYS   8   6.233  -8.204  -4.933
   73   2HB   CYS   8           HBR      CYS   8   6.682  -8.827  -6.546
   74    HA   PRO   9           HA       PRO   9   4.400  -6.494 -10.555
   75   1HB   PRO   9           HBR      PRO   9   4.933  -3.761 -10.191
   76   2HB   PRO   9           HBS      PRO   9   3.645  -4.458 -10.933
   77   1HG   PRO   9           HGS      PRO   9   3.559  -3.267  -8.574
   78   2HG   PRO   9           HGR      PRO   9   2.402  -4.329  -9.139
   79   1HD   PRO   9           HDS      PRO   9   4.324  -4.758  -7.151
   80   2HD   PRO   9           HDR      PRO   9   2.983  -5.664  -7.493
   81    H    ALA  10           HN       ALA  10   6.902  -6.051  -8.468
   82    HA   ALA  10           HA       ALA  10   8.751  -5.011 -10.523
   83   1HB   ALA  10           HMBB     ALA  10   8.438  -4.347  -7.927
   84   2HB   ALA  10           HMBC     ALA  10   9.713  -5.583  -7.781
   85   3HB   ALA  10           HMBA     ALA  10   9.963  -4.164  -8.831
   86    H    CYS  11           HN       CYS  11   9.168  -7.405  -7.895
   87    HA   CYS  11           HA       CYS  11  11.270  -8.587  -9.503
   88   1HB   CYS  11           HBS      CYS  11  11.896  -9.800  -7.520
   89   2HB   CYS  11           HBR      CYS  11  11.662  -8.065  -7.187
   90    H    GLU  12           HN       GLU  12   8.018  -9.164  -9.373
   91    HA   GLU  12           HA       GLU  12   6.585 -10.920  -9.632
   92   1HB   GLU  12           HBR      GLU  12   8.560 -11.348 -11.426
   93   2HB   GLU  12           HBS      GLU  12   8.849 -12.655 -10.414
   94   1HG   GLU  12           HGS      GLU  12   7.347 -13.142 -12.379
   95   2HG   GLU  12           HGR      GLU  12   6.779 -13.765 -10.807
   96    H    SER  13           HN       SER  13   7.128 -10.455  -7.175
   97    HA   SER  13           HA       SER  13   7.485 -13.162  -5.987
   98   1HB   SER  13           HBS      SER  13   7.460 -12.036  -3.796
   99   2HB   SER  13           HBR      SER  13   8.843 -11.557  -4.821
  100    HG   SER  13           HG       SER  13   6.538 -10.181  -3.869
  101    H    ALA  14           HN       ALA  14   5.887 -12.955  -3.821
  102    HA   ALA  14           HA       ALA  14   3.187 -12.302  -4.867
  103   1HB   ALA  14           HMBB     ALA  14   4.026 -14.755  -5.019
  104   2HB   ALA  14           HMBC     ALA  14   3.806 -14.771  -3.251
  105   3HB   ALA  14           HMBA     ALA  14   2.417 -14.445  -4.318
  106    H    GLU  15           HN       GLU  15   5.391 -11.908  -2.404
  107    HA   GLU  15           HA       GLU  15   3.308 -11.744  -0.287
  108   1HB   GLU  15           HBR      GLU  15   6.315 -11.965  -0.086
  109   2HB   GLU  15           HBS      GLU  15   5.204 -12.001   1.171
  110   1HG   GLU  15           HGS      GLU  15   4.648 -13.994  -0.909
  111   2HG   GLU  15           HGR      GLU  15   6.123 -14.332   0.035
  112    H    LEU  16           HN       LEU  16   2.791  -9.867   0.560
  113    HA   LEU  16           HA       LEU  16   4.786  -7.654   0.547
  114   1HB   LEU  16           HBR      LEU  16   1.816  -7.350   0.069
  115   2HB   LEU  16           HBS      LEU  16   3.116  -6.148  -0.168
  116    HG   LEU  16           HG       LEU  16   2.656  -8.635  -1.839
  117   1HD1  LEU  16           HMDR     LEU  16   1.546  -5.963  -1.923
  118   2HD1  LEU  16           HMDR     LEU  16   2.530  -6.281  -3.374
  119   3HD1  LEU  16           HMDR     LEU  16   1.189  -7.375  -2.950
  120   1HD2  LEU  16           HMDS     LEU  16   5.025  -7.489  -1.355
  121   2HD2  LEU  16           HMDS     LEU  16   4.580  -8.131  -2.957
  122   3HD2  LEU  16           HMDS     LEU  16   4.447  -6.385  -2.629
  123    H    ILE  17           HN       ILE  17   3.736  -5.790   1.963
  124    HA   ILE  17           HA       ILE  17   2.621  -6.770   4.484
  125    HB   ILE  17           HB       ILE  17   4.776  -6.006   5.703
  126   1HG1  ILE  17           HG1R     ILE  17   5.875  -6.427   2.900
  127   2HG1  ILE  17           HG1S     ILE  17   5.877  -4.919   3.855
  128   1HG2  ILE  17           HMG2     ILE  17   3.900  -8.473   5.018
  129   2HG2  ILE  17           HMG2     ILE  17   5.526  -8.483   4.286
  130   3HG2  ILE  17           HMG2     ILE  17   5.334  -8.154   6.029
  131   1HD1  ILE  17           HMD1     ILE  17   7.339  -6.155   5.533
  132   2HD1  ILE  17           HMD1     ILE  17   7.516  -7.422   4.289
  133   3HD1  ILE  17           HMD1     ILE  17   8.081  -5.762   3.958
  134    H    TYR  18           HN       TYR  18   1.842  -5.169   5.722
  135    HA   TYR  18           HA       TYR  18   1.832  -2.507   4.427
  136   1HB   TYR  18           HBR      TYR  18  -0.321  -3.651   4.616
  137   2HB   TYR  18           HBS      TYR  18  -0.111  -3.791   6.385
  138    HD1  TYR  18           HD2      TYR  18   0.655  -0.835   4.261
  139    HD2  TYR  18           HD1      TYR  18  -1.958  -2.497   7.177
  140    HE1  TYR  18           HE2      TYR  18  -0.483   1.330   4.462
  141    HE2  TYR  18           HE1      TYR  18  -3.088  -0.328   7.409
  142    HH   TYR  18           HH       TYR  18  -2.463   2.236   5.010
  143    H    ASP  19           HN       ASP  19   2.308  -0.668   5.467
  144    HA   ASP  19           HA       ASP  19   3.444  -0.917   8.194
  145   1HB   ASP  19           HBS      ASP  19   4.935  -0.709   5.810
  146   2HB   ASP  19           HBR      ASP  19   5.032   0.874   6.633
  147    HA   PRO  20           HA       PRO  20   0.372   2.341   7.963
  148   1HB   PRO  20           HBR      PRO  20  -0.046   1.945  10.700
  149   2HB   PRO  20           HBS      PRO  20  -1.122   1.769   9.472
  150   1HG   PRO  20           HGS      PRO  20  -0.073  -0.228  10.857
  151   2HG   PRO  20           HGR      PRO  20  -0.822  -0.394   9.375
  152   1HD   PRO  20           HDS      PRO  20   1.918  -0.519   9.969
  153   2HD   PRO  20           HDR      PRO  20   1.132  -1.064   8.619
  154    H    GLU  21           HN       GLU  21   3.227   2.158   9.609
  155    HA   GLU  21           HA       GLU  21   3.134   4.637  11.101
  156   1HB   GLU  21           HBR      GLU  21   5.183   2.678  10.138
  157   2HB   GLU  21           HBS      GLU  21   5.689   4.230  10.525
  158   1HG   GLU  21           HGS      GLU  21   3.927   3.215  12.591
  159   2HG   GLU  21           HGR      GLU  21   5.390   2.205  12.445
  160    H    ARG  22           HN       ARG  22   4.135   3.627   7.838
  161    HA   ARG  22           HA       ARG  22   4.363   6.486   7.051
  162   1HB   ARG  22           HBR      ARG  22   5.138   3.941   5.589
  163   2HB   ARG  22           HBS      ARG  22   5.226   5.590   4.904
  164   1HG   ARG  22           HGS      ARG  22   6.804   6.184   6.772
  165   2HG   ARG  22           HGR      ARG  22   6.824   4.455   7.220
  166   1HD   ARG  22           HDS      ARG  22   7.433   4.062   4.750
  167   2HD   ARG  22           HDR      ARG  22   7.845   5.800   4.742
  168    HE   ARG  22           HE       ARG  22   9.160   3.712   6.400
  169   1HH1  ARG  22           HH1Z     ARG  22   9.012   7.056   5.293
  170   2HH1  ARG  22           HH1E     ARG  22  10.683   7.358   5.636
  171   1HH2  ARG  22           HH2Z     ARG  22  11.370   4.106   6.715
  172   2HH2  ARG  22           HH2E     ARG  22  12.017   5.690   6.443
  173    H    GLY  23           HN       GLY  23   2.414   3.617   6.828
  174   1HA   GLY  23           HAR      GLY  23   0.266   3.331   5.909
  175   2HA   GLY  23           HAS      GLY  23   0.377   4.948   5.162
  176    H    GLU  24           HN       GLU  24   2.485   2.047   5.073
  177    HA   GLU  24           HA       GLU  24   2.498   2.256   2.091
  178   1HB   GLU  24           HBR      GLU  24   4.448   2.811   4.026
  179   2HB   GLU  24           HBS      GLU  24   4.813   1.252   3.521
  180   1HG   GLU  24           HGR      GLU  24   6.137   2.715   2.077
  181   2HG   GLU  24           HGS      GLU  24   4.855   1.879   1.160
  182    H    ILE  25           HN       ILE  25   2.124   0.462   1.009
  183    HA   ILE  25           HA       ILE  25   2.394  -2.164   2.389
  184    HB   ILE  25           HB       ILE  25   0.925  -1.632  -0.233
  185   1HG1  ILE  25           HG1R     ILE  25  -1.144  -1.941   1.412
  186   2HG1  ILE  25           HG1S     ILE  25   0.011  -1.283   2.607
  187   1HG2  ILE  25           HMG2     ILE  25   1.372  -3.989   1.479
  188   2HG2  ILE  25           HMG2     ILE  25  -0.302  -3.764   0.907
  189   3HG2  ILE  25           HMG2     ILE  25   1.036  -3.866  -0.269
  190   1HD1  ILE  25           HMD1     ILE  25   0.250   0.414   0.408
  191   2HD1  ILE  25           HMD1     ILE  25  -1.498   0.072   0.522
  192   3HD1  ILE  25           HMD1     ILE  25  -0.625   0.740   1.928
  193    H    VAL  26           HN       VAL  26   4.204  -3.164   1.992
  194    HA   VAL  26           HA       VAL  26   5.751  -2.343  -0.412
  195    HB   VAL  26           HB       VAL  26   6.940  -3.156   2.235
  196   1HG1  VAL  26           HMGR     VAL  26   8.010  -1.709  -0.190
  197   2HG1  VAL  26           HMGR     VAL  26   8.841  -1.720   1.384
  198   3HG1  VAL  26           HMGR     VAL  26   8.554  -3.248   0.519
  199   1HG2  VAL  26           HMGS     VAL  26   5.453  -0.765   1.716
  200   2HG2  VAL  26           HMGS     VAL  26   6.302  -1.272   3.197
  201   3HG2  VAL  26           HMGS     VAL  26   7.170  -0.352   1.943
  202    H    CYS  27           HN       CYS  27   7.553  -3.882  -0.928
  203    HA   CYS  27           HA       CYS  27   6.587  -6.650  -1.035
  204   1HB   CYS  27           HBS      CYS  27   7.725  -5.515  -2.948
  205   2HB   CYS  27           HBR      CYS  27   9.220  -5.489  -1.975
  206    H    ALA  28           HN       ALA  28   7.503  -8.356   0.014
  207    HA   ALA  28           HA       ALA  28   9.311  -7.727   2.288
  208   1HB   ALA  28           HMBB     ALA  28   7.120  -9.086   2.509
  209   2HB   ALA  28           HMBC     ALA  28   8.050 -10.404   1.753
  210   3HB   ALA  28           HMBA     ALA  28   8.604  -9.689   3.288
  211    H    LYS  29           HN       LYS  29   9.978  -7.819  -0.643
  212    HA   LYS  29           HA       LYS  29  12.181  -9.796  -0.410
  213   1HB   LYS  29           HBR      LYS  29  10.133 -10.021  -2.300
  214   2HB   LYS  29           HBS      LYS  29  11.478  -9.238  -3.178
  215   1HG   LYS  29           HGR      LYS  29  12.389 -11.259  -3.455
  216   2HG   LYS  29           HGS      LYS  29  12.656 -11.327  -1.689
  217   1HD   LYS  29           HDS      LYS  29  10.913 -12.696  -1.306
  218   2HD   LYS  29           HDR      LYS  29   9.945 -12.008  -2.581
  219   1HE   LYS  29           HES      LYS  29  12.120 -13.286  -3.851
  220   2HE   LYS  29           HER      LYS  29  11.485 -14.394  -2.602
  221   1HZ   LYS  29           HZC      LYS  29   9.288 -14.017  -3.548
  222   2HZ   LYS  29           HZA      LYS  29   9.934 -13.108  -4.742
  223   3HZ   LYS  29           HZB      LYS  29  10.309 -14.694  -4.629
  224    H    CYS  30           HN       CYS  30  11.188  -7.376  -2.847
  225    HA   CYS  30           HA       CYS  30  13.992  -6.756  -3.094
  226   1HB   CYS  30           HBR      CYS  30  13.367  -5.642  -5.160
  227   2HB   CYS  30           HBS      CYS  30  12.696  -7.289  -5.033
  228    H    GLY  31           HN       GLY  31  11.646  -5.390  -1.208
  229   1HA   GLY  31           HAR      GLY  31  11.995  -3.492   0.115
  230   2HA   GLY  31           HAS      GLY  31  13.042  -2.808  -1.160
  231    H    TYR  32           HN       TYR  32  10.337  -3.922  -2.707
  232    HA   TYR  32           HA       TYR  32   9.919  -1.141  -3.534
  233   1HB   TYR  32           HBS      TYR  32  10.125  -2.837  -5.256
  234   2HB   TYR  32           HBR      TYR  32   8.773  -3.768  -4.553
  235    HD1  TYR  32           HD2      TYR  32   9.196  -0.139  -5.388
  236    HD2  TYR  32           HD1      TYR  32   6.991  -3.710  -6.079
  237    HE1  TYR  32           HE2      TYR  32   7.713   1.083  -6.914
  238    HE2  TYR  32           HE1      TYR  32   5.469  -2.488  -7.573
  239    HH   TYR  32           HH       TYR  32   5.518   1.022  -7.630
  240    H    VAL  33           HN       VAL  33   8.428   0.134  -2.775
  241    HA   VAL  33           HA       VAL  33   6.050  -0.852  -1.372
  242    HB   VAL  33           HB       VAL  33   6.813   1.929  -2.294
  243   1HG1  VAL  33           HMGR     VAL  33   4.474   0.966  -0.639
  244   2HG1  VAL  33           HMGR     VAL  33   5.030   2.658  -0.673
  245   3HG1  VAL  33           HMGR     VAL  33   4.446   1.882  -2.166
  246   1HG2  VAL  33           HMGS     VAL  33   8.249   0.882  -0.507
  247   2HG2  VAL  33           HMGS     VAL  33   7.449   2.409  -0.067
  248   3HG2  VAL  33           HMGS     VAL  33   6.804   0.862   0.532
  249    H    ILE  34           HN       ILE  34   3.944  -0.637  -2.132
  250    HA   ILE  34           HA       ILE  34   3.639  -0.044  -5.034
  251    HB   ILE  34           HB       ILE  34   2.073  -1.808  -3.109
  252   1HG1  ILE  34           HG1R     ILE  34   2.809  -2.725  -5.832
  253   2HG1  ILE  34           HG1S     ILE  34   4.178  -2.317  -4.761
  254   1HG2  ILE  34           HMG2     ILE  34   0.964  -0.335  -5.355
  255   2HG2  ILE  34           HMG2     ILE  34   0.811  -2.100  -5.563
  256   3HG2  ILE  34           HMG2     ILE  34   0.157  -1.315  -4.102
  257   1HD1  ILE  34           HMD1     ILE  34   2.882  -3.821  -3.038
  258   2HD1  ILE  34           HMD1     ILE  34   2.132  -4.495  -4.510
  259   3HD1  ILE  34           HMD1     ILE  34   3.904  -4.555  -4.302
  260    H    GLU  35           HN       GLU  35   1.468   0.062  -2.202
  261    HA   GLU  35           HA       GLU  35   0.419   2.625  -3.287
  262   1HB   GLU  35           HBS      GLU  35  -0.997   0.769  -3.364
  263   2HB   GLU  35           HBR      GLU  35  -0.698   0.267  -1.790
  264   1HG   GLU  35           HGS      GLU  35  -1.860   2.294  -0.924
  265   2HG   GLU  35           HGR      GLU  35  -2.127   2.893  -2.584
  266    H    GLU  36           HN       GLU  36  -0.714   3.979  -1.598
  267    HA   GLU  36           HA       GLU  36   1.020   4.274   0.814
  268   1HB   GLU  36           HBR      GLU  36   1.911   5.424  -1.186
  269   2HB   GLU  36           HBS      GLU  36   0.421   6.157  -1.424
  270   1HG   GLU  36           HGS      GLU  36   1.217   7.931  -0.376
  271   2HG   GLU  36           HGR      GLU  36   0.830   7.062   1.134
  272    H    ASN  37           HN       ASN  37   0.156   5.532   2.458
  273    HA   ASN  37           HA       ASN  37  -1.465   6.344   3.826
  274   1HB   ASN  37           HBS      ASN  37  -2.608   8.236   2.980
  275   2HB   ASN  37           HBR      ASN  37  -0.965   8.172   2.280
  276   1HD2  ASN  37           HD2Z     ASN  37  -4.306   8.086  -0.071
  277   2HD2  ASN  37           HD2E     ASN  37  -4.400   8.076   1.658
  278    H    ILE  38           HN       ILE  38  -2.615   4.736   4.618
  279    HA   ILE  38           HA       ILE  38  -5.390   4.780   3.741
  280    HB   ILE  38           HB       ILE  38  -4.008   2.078   4.097
  281   1HG1  ILE  38           HG1R     ILE  38  -4.889   3.491   1.550
  282   2HG1  ILE  38           HG1S     ILE  38  -3.211   3.164   2.068
  283   1HG2  ILE  38           HMG2     ILE  38  -6.445   2.262   4.712
  284   2HG2  ILE  38           HMG2     ILE  38  -6.766   2.617   2.994
  285   3HG2  ILE  38           HMG2     ILE  38  -6.041   1.055   3.463
  286   1HD1  ILE  38           HMD1     ILE  38  -4.910   0.766   1.904
  287   2HD1  ILE  38           HMD1     ILE  38  -4.671   1.611   0.351
  288   3HD1  ILE  38           HMD1     ILE  38  -3.260   1.059   1.293
  289    H    ILE  39           HN       ILE  39  -4.969   6.145   5.721
  290    HA   ILE  39           HA       ILE  39  -4.688   4.540   8.207
  291    HB   ILE  39           HB       ILE  39  -4.329   7.528   7.673
  292   1HG1  ILE  39           HG1R     ILE  39  -2.569   6.026   6.792
  293   2HG1  ILE  39           HG1S     ILE  39  -1.976   7.142   8.056
  294   1HG2  ILE  39           HMG2     ILE  39  -4.796   6.111  10.168
  295   2HG2  ILE  39           HMG2     ILE  39  -3.242   6.988  10.166
  296   3HG2  ILE  39           HMG2     ILE  39  -4.760   7.860   9.825
  297   1HD1  ILE  39           HMD1     ILE  39  -2.802   4.692   9.295
  298   2HD1  ILE  39           HMD1     ILE  39  -1.719   4.318   7.927
  299   3HD1  ILE  39           HMD1     ILE  39  -1.178   5.427   9.217
  300    H    ASP  40           HN       ASP  40  -6.232   7.694   7.743
  301    HA   ASP  40           HA       ASP  40  -8.574   6.657   9.135
  302   1HB   ASP  40           HBR      ASP  40  -7.164   9.120   9.083
  303   2HB   ASP  40           HBS      ASP  40  -8.860   9.421   8.604
  304    H    MET  41           HN       MET  41  -8.224   5.723   6.498
  305    HA   MET  41           HA       MET  41  -9.557   5.186   4.730
  306   1HB   MET  41           HBS      MET  41 -11.603   6.333   6.644
  307   2HB   MET  41           HBR      MET  41 -12.025   5.533   5.103
  308   1HG   MET  41           HGS      MET  41 -10.695   3.518   5.900
  309   2HG   MET  41           HGR      MET  41 -10.555   4.332   7.478
  310   1HE   MET  41           HMEA     MET  41 -11.619   2.127   8.304
  311   2HE   MET  41           HMEC     MET  41 -13.345   1.698   8.203
  312   3HE   MET  41           HMEB     MET  41 -12.268   1.389   6.817
  313    H    GLY  42           HN       GLY  42  -8.505   6.583   3.309
  314   1HA   GLY  42           HAS      GLY  42  -8.850   7.869   1.392
  315   2HA   GLY  42           HAR      GLY  42 -10.377   8.477   2.091
  316    HA   PRO  43           HA       PRO  43  -6.858  11.223   3.970
  317   1HB   PRO  43           HBS      PRO  43  -4.381  10.274   3.329
  318   2HB   PRO  43           HBR      PRO  43  -5.020  10.385   4.836
  319   1HG   PRO  43           HGS      PRO  43  -4.489   8.123   3.456
  320   2HG   PRO  43           HGR      PRO  43  -5.276   8.215   4.924
  321   1HD   PRO  43           HDS      PRO  43  -6.378   7.783   2.385
  322   2HD   PRO  43           HDR      PRO  43  -7.069   7.518   3.864
  323    H    GLU  44           HN       GLU  44  -4.408  11.976   2.744
  324    HA   GLU  44           HA       GLU  44  -3.777  13.465   1.127
  325   1HB   GLU  44           HBR      GLU  44  -4.834  11.213  -0.182
  326   2HB   GLU  44           HBS      GLU  44  -5.655  12.511  -0.859
  327   1HG   GLU  44           HGS      GLU  44  -4.020  12.948  -2.237
  328   2HG   GLU  44           HGR      GLU  44  -2.987  13.457  -0.873
  329    H    TRP  45           HN       TRP  45  -5.013  14.832  -0.799
  330    HA   TRP  45           HA       TRP  45  -6.743  16.472   0.921
  331   1HB   TRP  45           HBS      TRP  45  -6.038  18.334  -0.349
  332   2HB   TRP  45           HBR      TRP  45  -4.600  17.352   0.054
  333    HD1  TRP  45           HD1      TRP  45  -6.722  18.455  -2.962
  334    HE1  TRP  45           HE1      TRP  45  -5.415  17.979  -5.122
  335    HE3  TRP  45           HE3      TRP  45  -2.815  15.912  -0.924
  336    HZ2  TRP  45           HZ2      TRP  45  -3.015  16.716  -5.832
  337    HZ3  TRP  45           HZ3      TRP  45  -1.040  15.105  -2.408
  338    HH2  TRP  45           HH2      TRP  45  -1.129  15.490  -4.813
  339    H    ARG  46           HN       ARG  46  -8.034  14.303  -0.202
  340    HA   ARG  46           HA       ARG  46  -9.889  15.655  -2.104
  341   1HB   ARG  46           HBR      ARG  46 -10.838  13.510  -2.595
  342   2HB   ARG  46           HBS      ARG  46  -9.069  13.441  -2.846
  343   1HG   ARG  46           HGS      ARG  46  -8.763  11.893  -1.225
  344   2HG   ARG  46           HGR      ARG  46 -10.033  12.582  -0.174
  345   1HD   ARG  46           HDS      ARG  46 -10.308  10.717  -2.512
  346   2HD   ARG  46           HDR      ARG  46 -10.842  10.497  -0.822
  347    HE   ARG  46           HE       ARG  46 -12.224  11.978  -2.936
  348   1HH1  ARG  46           HH1Z     ARG  46 -12.080  11.010   0.452
  349   2HH1  ARG  46           HH1E     ARG  46 -13.648  11.650   0.814
  350   1HH2  ARG  46           HH2Z     ARG  46 -14.213  12.918  -2.393
  351   2HH2  ARG  46           HH2E     ARG  46 -14.856  12.729  -0.795
  352    H    ALA  47           HN       ALA  47  -9.404  15.879   0.922
  353    HA   ALA  47           HA       ALA  47 -11.861  14.701   2.014
  354   1HB   ALA  47           HMBB     ALA  47  -9.243  15.585   3.018
  355   2HB   ALA  47           HMBA     ALA  47 -10.616  15.978   4.084
  356   3HB   ALA  47           HMBC     ALA  47 -10.328  14.291   3.586
  357    H    PHE  48           HN       PHE  48 -12.365  16.401   4.112
  358    HA   PHE  48           HA       PHE  48 -12.510  19.149   3.216
  359   1HB   PHE  48           HBS      PHE  48 -14.953  17.489   3.071
  360   2HB   PHE  48           HBR      PHE  48 -15.124  18.955   4.080
  361    HD1  PHE  48           HD1      PHE  48 -13.993  21.060   3.053
  362    HD2  PHE  48           HD2      PHE  48 -15.386  17.770   0.729
  363    HE1  PHE  48           HE1      PHE  48 -14.235  22.554   1.122
  364    HE2  PHE  48           HE2      PHE  48 -15.635  19.255  -1.233
  365    HZ   PHE  48           HZ       PHE  48 -15.113  21.668  -1.006
  366    H    ASP  49           HN       ASP  49 -14.503  17.282   5.515
  367    HA   ASP  49           HA       ASP  49 -14.584  17.218   7.774
  368   1HB   ASP  49           HBR      ASP  49 -11.798  17.095   7.017
  369   2HB   ASP  49           HBS      ASP  49 -12.016  17.786   8.650
  370    H    ALA  50           HN       ALA  50 -11.994  19.600   7.876
  371    HA   ALA  50           HA       ALA  50 -13.997  21.693   8.569
  372   1HB   ALA  50           HMBC     ALA  50 -12.332  20.725  10.420
  373   2HB   ALA  50           HMBA     ALA  50 -11.239  21.910   9.661
  374   3HB   ALA  50           HMBB     ALA  50 -12.799  22.443  10.336
   
  No H/Q in entry =         374
  Start of MODEL   13
    1   1H    MET   1           HNB      MET   1  -7.108   5.442  -7.688
    2   2H    MET   1           HN       MET   1  -7.091   6.318  -9.065
    3   3H    MET   1           HNC      MET   1  -8.341   6.458  -8.024
    4    HA   MET   1           HA       MET   1  -9.070   4.278  -8.408
    5   1HB   MET   1           HBR      MET   1  -8.895   6.326 -10.469
    6   2HB   MET   1           HBS      MET   1  -8.979   4.691 -11.172
    7   1HG   MET   1           HGS      MET   1 -11.254   5.276 -10.925
    8   2HG   MET   1           HGR      MET   1 -10.912   4.273  -9.496
    9   1HE   MET   1           HMEC     MET   1 -11.834   4.892  -7.438
   10   2HE   MET   1           HMEA     MET   1 -10.211   5.502  -7.028
   11   3HE   MET   1           HMEB     MET   1 -11.655   6.453  -6.598
   12    H    VAL   2           HN       VAL   2  -8.877   2.615 -10.398
   13    HA   VAL   2           HA       VAL   2  -7.707   0.938 -11.396
   14    HB   VAL   2           HB       VAL   2  -5.437   2.936 -11.333
   15   1HG1  VAL   2           HMGR     VAL   2  -4.781   0.488 -11.602
   16   2HG1  VAL   2           HMGR     VAL   2  -5.624   0.548 -13.169
   17   3HG1  VAL   2           HMGR     VAL   2  -4.236   1.620 -12.863
   18   1HG2  VAL   2           HMGS     VAL   2  -7.526   3.586 -12.584
   19   2HG2  VAL   2           HMGS     VAL   2  -6.025   3.549 -13.539
   20   3HG2  VAL   2           HMGS     VAL   2  -7.200   2.220 -13.676
   21    H    ASN   3           HN       ASN   3  -5.051   2.335  -9.473
   22    HA   ASN   3           HA       ASN   3  -3.623   1.372  -7.995
   23   1HB   ASN   3           HBR      ASN   3  -4.602   0.644  -6.021
   24   2HB   ASN   3           HBS      ASN   3  -5.736   1.823  -6.738
   25   1HD2  ASN   3           HD2Z     ASN   3  -8.440  -0.337  -6.619
   26   2HD2  ASN   3           HD2E     ASN   3  -7.812   1.277  -6.666
   27    H    LYS   4           HN       LYS   4  -3.243  -0.867  -6.715
   28    HA   LYS   4           HA       LYS   4  -3.379  -3.054  -8.700
   29   1HB   LYS   4           HBS      LYS   4  -0.908  -1.741  -7.768
   30   2HB   LYS   4           HBR      LYS   4  -0.935  -3.514  -7.553
   31   1HG   LYS   4           HGR      LYS   4  -0.054  -3.396  -9.670
   32   2HG   LYS   4           HGS      LYS   4  -1.794  -3.445 -10.075
   33   1HD   LYS   4           HDS      LYS   4  -1.870  -1.305 -10.763
   34   2HD   LYS   4           HDR      LYS   4  -0.687  -0.771  -9.602
   35   1HE   LYS   4           HES      LYS   4   1.097  -1.193 -10.944
   36   2HE   LYS   4           HER      LYS   4   0.265  -2.533 -11.784
   37   1HZ   LYS   4           HZA      LYS   4  -1.140  -0.809 -12.808
   38   2HZ   LYS   4           HZB      LYS   4  -0.175   0.343 -12.169
   39   3HZ   LYS   4           HZC      LYS   4   0.429  -0.721 -13.251
   40    H    GLN   5           HN       GLN   5  -1.589  -2.647  -5.645
   41    HA   GLN   5           HA       GLN   5  -1.844  -3.536  -3.566
   42   1HB   GLN   5           HBR      GLN   5  -4.078  -2.429  -3.687
   43   2HB   GLN   5           HBS      GLN   5  -4.755  -3.982  -4.255
   44   1HG   GLN   5           HGS      GLN   5  -4.671  -4.922  -2.208
   45   2HG   GLN   5           HGR      GLN   5  -3.137  -4.113  -1.781
   46   1HE2  GLN   5           HE2Z     GLN   5  -6.505  -1.762  -1.450
   47   2HE2  GLN   5           HE2E     GLN   5  -6.233  -2.730  -2.860
   48    H    LYS   6           HN       LYS   6  -1.468  -5.146  -6.135
   49    HA   LYS   6           HA       LYS   6  -2.009  -7.815  -4.952
   50   1HB   LYS   6           HBS      LYS   6  -2.251  -8.565  -7.435
   51   2HB   LYS   6           HBR      LYS   6  -3.657  -7.916  -6.544
   52   1HG   LYS   6           HGR      LYS   6  -2.843  -5.624  -7.614
   53   2HG   LYS   6           HGS      LYS   6  -2.093  -6.718  -8.812
   54   1HD   LYS   6           HDS      LYS   6  -4.857  -7.420  -8.204
   55   2HD   LYS   6           HDR      LYS   6  -4.696  -5.783  -8.777
   56   1HE   LYS   6           HES      LYS   6  -4.695  -6.584 -10.834
   57   2HE   LYS   6           HER      LYS   6  -3.054  -7.196 -10.483
   58   1HZ   LYS   6           HZB      LYS   6  -5.506  -8.709  -9.916
   59   2HZ   LYS   6           HZC      LYS   6  -4.640  -8.877 -11.290
   60   3HZ   LYS   6           HZA      LYS   6  -3.968  -9.254  -9.851
   61    H    VAL   7           HN       VAL   7  -0.176  -8.828  -4.699
   62    HA   VAL   7           HA       VAL   7   1.970  -9.546  -4.954
   63    HB   VAL   7           HB       VAL   7   2.453 -10.403  -7.101
   64   1HG1  VAL   7           HMGR     VAL   7  -0.466 -10.487  -6.371
   65   2HG1  VAL   7           HMGR     VAL   7   0.172 -11.401  -7.760
   66   3HG1  VAL   7           HMGR     VAL   7   0.801 -11.713  -6.124
   67   1HG2  VAL   7           HMGS     VAL   7   1.944  -8.276  -8.360
   68   2HG2  VAL   7           HMGS     VAL   7   1.460  -9.794  -9.153
   69   3HG2  VAL   7           HMGS     VAL   7   0.237  -8.779  -8.352
   70    H    CYS   8           HN       CYS   8   3.999  -9.187  -6.645
   71    HA   CYS   8           HA       CYS   8   4.556  -6.271  -6.589
   72   1HB   CYS   8           HBS      CYS   8   5.913  -7.932  -5.208
   73   2HB   CYS   8           HBR      CYS   8   6.540  -8.543  -6.765
   74    HA   PRO   9           HA       PRO   9   4.665  -6.358 -11.011
   75   1HB   PRO   9           HBR      PRO   9   4.775  -3.570 -10.739
   76   2HB   PRO   9           HBS      PRO   9   3.670  -4.472 -11.553
   77   1HG   PRO   9           HGS      PRO   9   3.189  -3.204  -9.287
   78   2HG   PRO   9           HGR      PRO   9   2.259  -4.455  -9.882
   79   1HD   PRO   9           HDS      PRO   9   4.067  -4.495  -7.734
   80   2HD   PRO   9           HDR      PRO   9   2.866  -5.576  -8.086
   81    H    ALA  10           HN       ALA  10   6.842  -5.618  -8.701
   82    HA   ALA  10           HA       ALA  10   8.908  -4.757 -10.587
   83   1HB   ALA  10           HMBA     ALA  10   8.397  -4.147  -8.000
   84   2HB   ALA  10           HMBC     ALA  10   9.637  -5.410  -7.798
   85   3HB   ALA  10           HMBB     ALA  10   9.986  -3.969  -8.787
   86    H    CYS  11           HN       CYS  11   8.859  -7.288  -8.040
   87    HA   CYS  11           HA       CYS  11  11.022  -8.561  -9.536
   88   1HB   CYS  11           HBS      CYS  11  11.589  -9.696  -7.505
   89   2HB   CYS  11           HBR      CYS  11  11.378  -7.949  -7.225
   90    H    GLU  12           HN       GLU  12   7.744  -8.994  -9.407
   91    HA   GLU  12           HA       GLU  12   6.252 -10.702  -9.698
   92   1HB   GLU  12           HBR      GLU  12   8.727 -12.054 -10.800
   93   2HB   GLU  12           HBS      GLU  12   7.198 -12.746 -10.775
   94   1HG   GLU  12           HGS      GLU  12   6.184 -11.047 -12.123
   95   2HG   GLU  12           HGR      GLU  12   7.700 -10.111 -12.228
   96    H    SER  13           HN       SER  13   6.970 -10.345  -7.198
   97    HA   SER  13           HA       SER  13   6.280 -13.060  -6.345
   98   1HB   SER  13           HBS      SER  13   8.634 -11.632  -5.291
   99   2HB   SER  13           HBR      SER  13   7.504 -12.275  -4.064
  100    HG   SER  13           HG       SER  13   9.366 -13.468  -5.710
  101    H    ALA  14           HN       ALA  14   5.125 -13.030  -4.267
  102    HA   ALA  14           HA       ALA  14   3.225 -10.787  -4.500
  103   1HB   ALA  14           HMBB     ALA  14   2.524 -13.133  -5.031
  104   2HB   ALA  14           HMBC     ALA  14   2.836 -13.557  -3.328
  105   3HB   ALA  14           HMBA     ALA  14   1.569 -12.372  -3.733
  106    H    GLU  15           HN       GLU  15   5.591 -11.872  -2.425
  107    HA   GLU  15           HA       GLU  15   4.194 -11.709   0.092
  108   1HB   GLU  15           HBR      GLU  15   7.165 -11.500  -0.263
  109   2HB   GLU  15           HBS      GLU  15   6.271 -12.119   1.015
  110   1HG   GLU  15           HGS      GLU  15   5.982 -13.456  -1.630
  111   2HG   GLU  15           HGR      GLU  15   7.397 -13.880  -0.628
  112    H    LEU  16           HN       LEU  16   3.336  -9.798   0.605
  113    HA   LEU  16           HA       LEU  16   5.156  -7.439   0.670
  114   1HB   LEU  16           HBR      LEU  16   2.177  -7.331   0.216
  115   2HB   LEU  16           HBS      LEU  16   3.432  -6.119  -0.174
  116    HG   LEU  16           HG       LEU  16   2.910  -8.733  -1.616
  117   1HD1  LEU  16           HMDR     LEU  16   1.849  -6.077  -1.882
  118   2HD1  LEU  16           HMDR     LEU  16   2.864  -6.449  -3.299
  119   3HD1  LEU  16           HMDR     LEU  16   1.514  -7.527  -2.863
  120   1HD2  LEU  16           HMDS     LEU  16   5.333  -7.634  -1.268
  121   2HD2  LEU  16           HMDS     LEU  16   4.835  -8.413  -2.792
  122   3HD2  LEU  16           HMDS     LEU  16   4.769  -6.639  -2.635
  123    H    ILE  17           HN       ILE  17   4.146  -5.667   2.093
  124    HA   ILE  17           HA       ILE  17   2.976  -6.643   4.592
  125    HB   ILE  17           HB       ILE  17   5.120  -5.912   5.845
  126   1HG1  ILE  17           HG1R     ILE  17   6.271  -6.340   3.062
  127   2HG1  ILE  17           HG1S     ILE  17   6.242  -4.820   4.000
  128   1HG2  ILE  17           HMG2     ILE  17   4.230  -8.328   5.324
  129   2HG2  ILE  17           HMG2     ILE  17   5.698  -8.413   4.316
  130   3HG2  ILE  17           HMG2     ILE  17   5.834  -8.074   6.062
  131   1HD1  ILE  17           HMD1     ILE  17   7.574  -6.412   5.730
  132   2HD1  ILE  17           HMD1     ILE  17   8.064  -7.150   4.181
  133   3HD1  ILE  17           HMD1     ILE  17   8.367  -5.418   4.479
  134    H    TYR  18           HN       TYR  18   2.084  -5.053   5.721
  135    HA   TYR  18           HA       TYR  18   2.097  -2.427   4.400
  136   1HB   TYR  18           HBS      TYR  18  -0.038  -3.557   4.654
  137   2HB   TYR  18           HBR      TYR  18   0.204  -3.687   6.420
  138    HD1  TYR  18           HD1      TYR  18   0.661  -0.773   4.080
  139    HD2  TYR  18           HD2      TYR  18  -1.413  -2.372   7.430
  140    HE1  TYR  18           HE1      TYR  18  -0.568   1.343   4.321
  141    HE2  TYR  18           HE2      TYR  18  -2.602  -0.245   7.720
  142    HH   TYR  18           HH       TYR  18  -3.320   1.592   6.408
  143    H    ASP  19           HN       ASP  19   2.201  -0.474   5.512
  144    HA   ASP  19           HA       ASP  19   3.770  -0.635   8.026
  145   1HB   ASP  19           HBS      ASP  19   5.143  -0.389   5.944
  146   2HB   ASP  19           HBR      ASP  19   4.383   1.213   5.725
  147    HA   PRO  20           HA       PRO  20   0.311   1.898   9.016
  148   1HB   PRO  20           HBS      PRO  20   0.764   1.714  11.687
  149   2HB   PRO  20           HBR      PRO  20  -0.328   0.835  10.833
  150   1HG   PRO  20           HGS      PRO  20   2.153   0.052  11.840
  151   2HG   PRO  20           HGR      PRO  20   0.887  -0.917  11.347
  152   1HD   PRO  20           HDS      PRO  20   3.144  -0.585   9.974
  153   2HD   PRO  20           HDR      PRO  20   1.727  -1.134   9.322
  154    H    GLU  21           HN       GLU  21   3.497   2.542   9.431
  155    HA   GLU  21           HA       GLU  21   3.236   5.005  11.015
  156   1HB   GLU  21           HBR      GLU  21   5.406   3.496   9.587
  157   2HB   GLU  21           HBS      GLU  21   5.611   5.128   9.919
  158   1HG   GLU  21           HGS      GLU  21   4.644   4.137  12.334
  159   2HG   GLU  21           HGR      GLU  21   5.879   2.945  11.845
  160    H    ARG  22           HN       ARG  22   3.590   3.951   7.641
  161    HA   ARG  22           HA       ARG  22   3.534   6.801   6.764
  162   1HB   ARG  22           HBR      ARG  22   4.900   4.361   5.673
  163   2HB   ARG  22           HBS      ARG  22   4.353   5.641   4.551
  164   1HG   ARG  22           HGS      ARG  22   6.692   5.964   5.128
  165   2HG   ARG  22           HGR      ARG  22   5.700   7.289   5.799
  166   1HD   ARG  22           HDS      ARG  22   6.716   6.874   7.719
  167   2HD   ARG  22           HDR      ARG  22   5.684   5.420   7.811
  168    HE   ARG  22           HE       ARG  22   7.573   4.147   7.531
  169   1HH1  ARG  22           HH1Z     ARG  22   8.147   7.244   5.946
  170   2HH1  ARG  22           HH1E     ARG  22   9.835   6.934   5.711
  171   1HH2  ARG  22           HH2Z     ARG  22   9.808   3.834   7.323
  172   2HH2  ARG  22           HH2E     ARG  22  10.775   5.004   6.489
  173    H    GLY  23           HN       GLY  23   1.901   3.784   6.824
  174   1HA   GLY  23           HAR      GLY  23  -0.139   3.108   5.911
  175   2HA   GLY  23           HAS      GLY  23  -0.273   4.675   5.069
  176    H    GLU  24           HN       GLU  24   2.395   2.300   5.068
  177    HA   GLU  24           HA       GLU  24   2.250   2.302   2.090
  178   1HB   GLU  24           HBR      GLU  24   4.082   3.485   3.350
  179   2HB   GLU  24           HBS      GLU  24   4.481   2.016   4.057
  180   1HG   GLU  24           HGS      GLU  24   5.045   0.952   1.969
  181   2HG   GLU  24           HGR      GLU  24   4.676   2.430   1.039
  182    H    ILE  25           HN       ILE  25   1.896   0.458   1.111
  183    HA   ILE  25           HA       ILE  25   2.460  -2.114   2.490
  184    HB   ILE  25           HB       ILE  25   1.090  -1.747  -0.210
  185   1HG1  ILE  25           HG1R     ILE  25  -1.046  -2.189   1.290
  186   2HG1  ILE  25           HG1S     ILE  25  -0.033  -1.451   2.564
  187   1HG2  ILE  25           HMG2     ILE  25   1.936  -3.992   0.330
  188   2HG2  ILE  25           HMG2     ILE  25   0.921  -4.004   1.796
  189   3HG2  ILE  25           HMG2     ILE  25   0.159  -3.937   0.185
  190   1HD1  ILE  25           HMD1     ILE  25  -0.359  -0.067  -0.083
  191   2HD1  ILE  25           HMD1     ILE  25  -1.647   0.033   1.147
  192   3HD1  ILE  25           HMD1     ILE  25  -0.004   0.616   1.526
  193    H    VAL  26           HN       VAL  26   4.230  -3.169   2.048
  194    HA   VAL  26           HA       VAL  26   5.838  -2.312  -0.303
  195    HB   VAL  26           HB       VAL  26   6.945  -3.068   2.398
  196   1HG1  VAL  26           HMGR     VAL  26   8.101  -1.592   0.025
  197   2HG1  VAL  26           HMGR     VAL  26   8.884  -1.692   1.621
  198   3HG1  VAL  26           HMGR     VAL  26   8.591  -3.173   0.679
  199   1HG2  VAL  26           HMGS     VAL  26   5.407  -1.156   2.675
  200   2HG2  VAL  26           HMGS     VAL  26   7.108  -0.737   2.995
  201   3HG2  VAL  26           HMGS     VAL  26   6.345  -0.252   1.462
  202    H    CYS  27           HN       CYS  27   7.687  -3.853  -0.722
  203    HA   CYS  27           HA       CYS  27   6.682  -6.601  -0.625
  204   1HB   CYS  27           HBS      CYS  27   7.308  -5.429  -2.734
  205   2HB   CYS  27           HBR      CYS  27   9.003  -5.419  -2.177
  206    H    ALA  28           HN       ALA  28   7.495  -8.181   0.527
  207    HA   ALA  28           HA       ALA  28   9.915  -7.746   2.106
  208   1HB   ALA  28           HMBB     ALA  28   7.504  -9.133   2.427
  209   2HB   ALA  28           HMBA     ALA  28   8.762 -10.389   2.310
  210   3HB   ALA  28           HMBC     ALA  28   8.900  -9.100   3.532
  211    H    LYS  29           HN       LYS  29  10.066  -8.067  -0.851
  212    HA   LYS  29           HA       LYS  29  11.705 -10.553  -1.019
  213   1HB   LYS  29           HBR      LYS  29   9.128 -10.175  -2.100
  214   2HB   LYS  29           HBS      LYS  29  10.266  -9.997  -3.465
  215   1HG   LYS  29           HGR      LYS  29   9.738 -12.286  -3.440
  216   2HG   LYS  29           HGS      LYS  29  11.326 -12.191  -2.626
  217   1HD   LYS  29           HDS      LYS  29  10.112 -12.168  -0.437
  218   2HD   LYS  29           HDR      LYS  29   8.633 -12.455  -1.312
  219   1HE   LYS  29           HES      LYS  29   9.005 -14.627  -1.466
  220   2HE   LYS  29           HER      LYS  29  10.646 -14.349  -2.114
  221   1HZ   LYS  29           HZA      LYS  29  11.363 -14.000   0.173
  222   2HZ   LYS  29           HZB      LYS  29   9.873 -14.383   0.721
  223   3HZ   LYS  29           HZC      LYS  29  10.771 -15.504  -0.058
  224    H    CYS  30           HN       CYS  30  10.858  -7.379  -2.379
  225    HA   CYS  30           HA       CYS  30  13.725  -7.197  -3.123
  226   1HB   CYS  30           HBR      CYS  30  13.260  -5.725  -4.965
  227   2HB   CYS  30           HBS      CYS  30  12.500  -7.323  -5.187
  228    H    GLY  31           HN       GLY  31  11.304  -6.174  -1.120
  229   1HA   GLY  31           HAR      GLY  31  11.423  -4.567   0.528
  230   2HA   GLY  31           HAS      GLY  31  12.795  -3.820  -0.338
  231    H    TYR  32           HN       TYR  32  10.394  -4.183  -2.586
  232    HA   TYR  32           HA       TYR  32  10.379  -1.260  -2.839
  233   1HB   TYR  32           HBS      TYR  32  10.690  -2.576  -4.850
  234   2HB   TYR  32           HBR      TYR  32   9.173  -3.470  -4.552
  235    HD1  TYR  32           HD1      TYR  32   9.865   0.222  -4.379
  236    HD2  TYR  32           HD2      TYR  32   7.811  -2.931  -6.363
  237    HE1  TYR  32           HE1      TYR  32   8.688   1.871  -5.770
  238    HE2  TYR  32           HE2      TYR  32   6.648  -1.296  -7.774
  239    HH   TYR  32           HH       TYR  32   6.348   1.840  -7.056
  240    H    VAL  33           HN       VAL  33   8.723   0.066  -2.484
  241    HA   VAL  33           HA       VAL  33   6.394  -0.713  -1.005
  242    HB   VAL  33           HB       VAL  33   6.939   1.769  -2.650
  243   1HG1  VAL  33           HMGR     VAL  33   4.754   1.169  -0.650
  244   2HG1  VAL  33           HMGR     VAL  33   5.192   2.811  -1.181
  245   3HG1  VAL  33           HMGR     VAL  33   4.584   1.625  -2.362
  246   1HG2  VAL  33           HMGS     VAL  33   7.392   1.137   0.267
  247   2HG2  VAL  33           HMGS     VAL  33   8.579   1.655  -0.954
  248   3HG2  VAL  33           HMGS     VAL  33   7.337   2.794  -0.379
  249    H    ILE  34           HN       ILE  34   4.184  -0.448  -1.784
  250    HA   ILE  34           HA       ILE  34   3.860  -1.321  -4.610
  251    HB   ILE  34           HB       ILE  34   2.328  -1.939  -2.045
  252   1HG1  ILE  34           HG1R     ILE  34   4.474  -3.124  -2.570
  253   2HG1  ILE  34           HG1S     ILE  34   3.052  -4.182  -2.338
  254   1HG2  ILE  34           HMG2     ILE  34   1.447  -2.303  -4.880
  255   2HG2  ILE  34           HMG2     ILE  34   1.020  -3.535  -3.664
  256   3HG2  ILE  34           HMG2     ILE  34   0.516  -1.840  -3.432
  257   1HD1  ILE  34           HMD1     ILE  34   3.520  -3.425  -5.138
  258   2HD1  ILE  34           HMD1     ILE  34   4.862  -4.342  -4.401
  259   3HD1  ILE  34           HMD1     ILE  34   3.214  -5.025  -4.410
  260    H    GLU  35           HN       GLU  35   1.646  -0.021  -2.144
  261    HA   GLU  35           HA       GLU  35   1.457   2.521  -3.608
  262   1HB   GLU  35           HBR      GLU  35  -0.738   0.526  -3.266
  263   2HB   GLU  35           HBS      GLU  35  -1.099   2.132  -2.936
  264   1HG   GLU  35           HGS      GLU  35   0.347   2.243  -5.341
  265   2HG   GLU  35           HGR      GLU  35  -0.874   0.966  -5.587
  266    H    GLU  36           HN       GLU  36  -0.416   3.778  -2.188
  267    HA   GLU  36           HA       GLU  36  -0.543   3.041   0.590
  268   1HB   GLU  36           HBS      GLU  36   0.455   5.217   1.296
  269   2HB   GLU  36           HBR      GLU  36   1.505   3.942   0.995
  270   1HG   GLU  36           HGS      GLU  36   2.429   4.979  -0.877
  271   2HG   GLU  36           HGR      GLU  36   0.921   5.819  -1.328
  272    H    ASN  37           HN       ASN  37  -2.440   3.702   1.281
  273    HA   ASN  37           HA       ASN  37  -3.727   6.046   0.028
  274   1HB   ASN  37           HBS      ASN  37  -4.343   3.313  -0.575
  275   2HB   ASN  37           HBR      ASN  37  -5.739   4.102   0.215
  276   1HD2  ASN  37           HD2Z     ASN  37  -4.866   4.822  -3.652
  277   2HD2  ASN  37           HD2E     ASN  37  -4.145   3.563  -2.707
  278    H    ILE  38           HN       ILE  38  -2.592   6.076   2.476
  279    HA   ILE  38           HA       ILE  38  -5.000   6.798   3.974
  280    HB   ILE  38           HB       ILE  38  -2.795   5.090   5.229
  281   1HG1  ILE  38           HG1R     ILE  38  -5.043   3.703   5.720
  282   2HG1  ILE  38           HG1S     ILE  38  -5.554   4.526   4.219
  283   1HG2  ILE  38           HMG2     ILE  38  -5.170   6.478   6.472
  284   2HG2  ILE  38           HMG2     ILE  38  -4.298   5.132   7.253
  285   3HG2  ILE  38           HMG2     ILE  38  -3.441   6.651   6.879
  286   1HD1  ILE  38           HMD1     ILE  38  -2.990   3.547   3.668
  287   2HD1  ILE  38           HMD1     ILE  38  -3.798   2.247   4.585
  288   3HD1  ILE  38           HMD1     ILE  38  -4.547   2.889   3.098
  289    H    ILE  39           HN       ILE  39  -4.746   8.890   4.061
  290    HA   ILE  39           HA       ILE  39  -3.819  10.967   4.064
  291    HB   ILE  39           HB       ILE  39  -3.808  10.447   6.429
  292   1HG1  ILE  39           HG1R     ILE  39  -1.881  11.968   7.119
  293   2HG1  ILE  39           HG1S     ILE  39  -1.387  11.960   5.401
  294   1HG2  ILE  39           HMG2     ILE  39  -1.037   9.293   6.037
  295   2HG2  ILE  39           HMG2     ILE  39  -1.771   9.686   7.613
  296   3HG2  ILE  39           HMG2     ILE  39  -2.505   8.437   6.575
  297   1HD1  ILE  39           HMD1     ILE  39  -3.612  12.867   4.795
  298   2HD1  ILE  39           HMD1     ILE  39  -4.022  12.953   6.529
  299   3HD1  ILE  39           HMD1     ILE  39  -2.690  13.945   5.876
  300    H    ASP  40           HN       ASP  40  -2.988  10.915   1.981
  301    HA   ASP  40           HA       ASP  40  -0.073  10.401   1.797
  302   1HB   ASP  40           HBS      ASP  40  -1.636   8.639   0.870
  303   2HB   ASP  40           HBR      ASP  40  -2.028   9.822  -0.411
  304    H    MET  41           HN       MET  41  -2.694  12.526   1.119
  305    HA   MET  41           HA       MET  41  -1.810  13.726  -1.224
  306   1HB   MET  41           HBR      MET  41  -3.687  14.502   0.962
  307   2HB   MET  41           HBS      MET  41  -3.171  15.768  -0.189
  308   1HG   MET  41           HGS      MET  41  -3.812  14.152  -2.063
  309   2HG   MET  41           HGR      MET  41  -4.550  13.132  -0.805
  310   1HE   MET  41           HMEC     MET  41  -4.857  15.423  -3.265
  311   2HE   MET  41           HMEB     MET  41  -6.528  16.032  -3.154
  312   3HE   MET  41           HMEA     MET  41  -5.178  17.020  -2.541
  313    H    GLY  42           HN       GLY  42  -1.907  15.762   1.664
  314   1HA   GLY  42           HAR      GLY  42   0.701  16.940   0.795
  315   2HA   GLY  42           HAS      GLY  42  -0.694  17.879   1.394
  316    HA   PRO  43           HA       PRO  43   2.180  16.368   4.930
  317   1HB   PRO  43           HBR      PRO  43   4.098  18.273   4.655
  318   2HB   PRO  43           HBS      PRO  43   4.312  16.654   4.498
  319   1HG   PRO  43           HGS      PRO  43   4.440  18.509   2.527
  320   2HG   PRO  43           HGR      PRO  43   4.597  16.857   2.355
  321   1HD   PRO  43           HDS      PRO  43   2.393  18.459   1.734
  322   2HD   PRO  43           HDR      PRO  43   2.679  16.892   1.289
  323    H    GLU  44           HN       GLU  44   3.404  18.498   6.314
  324    HA   GLU  44           HA       GLU  44   0.889  19.941   7.040
  325   1HB   GLU  44           HBS      GLU  44   1.607  19.711   9.262
  326   2HB   GLU  44           HBR      GLU  44   1.427  18.192   8.571
  327   1HG   GLU  44           HGS      GLU  44   4.142  19.022   8.166
  328   2HG   GLU  44           HGR      GLU  44   3.776  19.393   9.873
  329    H    TRP  45           HN       TRP  45   2.681  21.035   5.183
  330    HA   TRP  45           HA       TRP  45   4.325  23.041   6.464
  331   1HB   TRP  45           HBR      TRP  45   3.690  22.216   3.782
  332   2HB   TRP  45           HBS      TRP  45   3.506  23.986   3.953
  333    HD1  TRP  45           HD1      TRP  45   6.071  21.531   3.093
  334    HE1  TRP  45           HE1      TRP  45   8.430  22.531   3.275
  335    HE3  TRP  45           HE3      TRP  45   4.915  25.676   5.806
  336    HZ2  TRP  45           HZ2      TRP  45   9.622  24.776   4.460
  337    HZ3  TRP  45           HZ3      TRP  45   6.721  27.208   6.436
  338    HH2  TRP  45           HH2      TRP  45   9.030  26.779   5.778
  339    H    ARG  46           HN       ARG  46   1.040  22.947   5.073
  340    HA   ARG  46           HA       ARG  46   0.392  25.546   6.328
  341   1HB   ARG  46           HBR      ARG  46  -1.979  24.697   5.422
  342   2HB   ARG  46           HBS      ARG  46  -0.802  25.599   4.426
  343   1HG   ARG  46           HGS      ARG  46  -1.800  23.699   3.217
  344   2HG   ARG  46           HGR      ARG  46  -0.032  23.529   3.405
  345   1HD   ARG  46           HDS      ARG  46  -0.894  21.420   3.871
  346   2HD   ARG  46           HDR      ARG  46  -0.550  22.143   5.468
  347    HE   ARG  46           HE       ARG  46  -3.257  22.652   4.693
  348   1HH1  ARG  46           HH1Z     ARG  46  -1.221  19.915   5.578
  349   2HH1  ARG  46           HH1E     ARG  46  -2.487  19.111   6.445
  350   1HH2  ARG  46           HH2Z     ARG  46  -4.854  21.633   5.937
  351   2HH2  ARG  46           HH2E     ARG  46  -4.545  20.081   6.644
  352    H    ALA  47           HN       ALA  47   0.690  24.958   8.481
  353    HA   ALA  47           HA       ALA  47  -0.517  22.573   9.544
  354   1HB   ALA  47           HMBC     ALA  47   1.614  23.432  10.348
  355   2HB   ALA  47           HMBA     ALA  47   0.819  24.921  10.921
  356   3HB   ALA  47           HMBB     ALA  47   0.419  23.353  11.668
  357    H    PHE  48           HN       PHE  48  -0.802  25.780  11.041
  358    HA   PHE  48           HA       PHE  48  -3.342  24.949  12.142
  359   1HB   PHE  48           HBS      PHE  48  -1.292  26.667  13.010
  360   2HB   PHE  48           HBR      PHE  48  -2.686  27.741  12.691
  361    HD1  PHE  48           HD2      PHE  48  -5.038  26.297  13.552
  362    HD2  PHE  48           HD1      PHE  48  -1.086  26.128  15.137
  363    HE1  PHE  48           HE2      PHE  48  -5.954  25.631  15.751
  364    HE2  PHE  48           HE1      PHE  48  -1.970  25.471  17.328
  365    HZ   PHE  48           HZ       PHE  48  -4.407  25.281  17.656
  366    H    ASP  49           HN       ASP  49  -2.579  28.208  10.941
  367    HA   ASP  49           HA       ASP  49  -5.126  28.180   9.430
  368   1HB   ASP  49           HBS      ASP  49  -5.750  30.312  10.443
  369   2HB   ASP  49           HBR      ASP  49  -5.675  28.960  11.610
  370    H    ALA  50           HN       ALA  50  -4.259  28.259   7.465
  371    HA   ALA  50           HA       ALA  50  -2.659  30.662   6.755
  372   1HB   ALA  50           HMBB     ALA  50  -1.622  28.067   7.149
  373   2HB   ALA  50           HMBC     ALA  50  -1.680  28.333   5.388
  374   3HB   ALA  50           HMBA     ALA  50  -0.815  29.485   6.435
   
  No H/Q in entry =         374
  Start of MODEL   14
    1   1H    MET   1           HNC      MET   1  -1.078  -8.579 -18.579
    2   2H    MET   1           HN       MET   1   0.347  -9.311 -18.263
    3   3H    MET   1           HNB      MET   1  -0.684  -8.969 -17.043
    4    HA   MET   1           HA       MET   1   1.023  -7.419 -16.925
    5   1HB   MET   1           HBS      MET   1   1.595  -6.004 -18.835
    6   2HB   MET   1           HBR      MET   1   1.835  -7.734 -19.211
    7   1HG   MET   1           HGS      MET   1  -0.473  -7.704 -20.293
    8   2HG   MET   1           HGR      MET   1  -0.452  -5.935 -20.089
    9   1HE   MET   1           HMEA     MET   1  -0.054  -4.673 -21.639
   10   2HE   MET   1           HMEB     MET   1   1.379  -4.527 -22.690
   11   3HE   MET   1           HMEC     MET   1  -0.052  -5.428 -23.253
   12    H    VAL   2           HN       VAL   2   0.488  -4.832 -18.036
   13    HA   VAL   2           HA       VAL   2  -0.711  -2.986 -17.453
   14    HB   VAL   2           HB       VAL   2  -2.904  -2.944 -18.294
   15   1HG1  VAL   2           HMGS     VAL   2  -0.749  -4.092 -19.741
   16   2HG1  VAL   2           HMGS     VAL   2  -2.253  -4.866 -20.296
   17   3HG1  VAL   2           HMGS     VAL   2  -2.095  -3.094 -20.341
   18   1HG2  VAL   2           HMGR     VAL   2  -3.425  -5.306 -17.104
   19   2HG2  VAL   2           HMGR     VAL   2  -4.438  -4.594 -18.384
   20   3HG2  VAL   2           HMGR     VAL   2  -3.240  -5.846 -18.791
   21    H    ASN   3           HN       ASN   3   0.006  -4.586 -15.241
   22    HA   ASN   3           HA       ASN   3  -0.374  -4.725 -13.008
   23   1HB   ASN   3           HBR      ASN   3  -1.147  -2.727 -12.009
   24   2HB   ASN   3           HBS      ASN   3  -0.199  -2.327 -13.470
   25   1HD2  ASN   3           HD2Z     ASN   3  -4.148  -1.287 -13.115
   26   2HD2  ASN   3           HD2E     ASN   3  -3.351  -2.268 -11.930
   27    H    LYS   4           HN       LYS   4  -1.388  -6.537 -12.557
   28    HA   LYS   4           HA       LYS   4  -3.982  -6.181 -11.372
   29   1HB   LYS   4           HBR      LYS   4  -4.106  -7.092 -13.994
   30   2HB   LYS   4           HBS      LYS   4  -4.162  -8.589 -13.019
   31   1HG   LYS   4           HGR      LYS   4  -5.914  -6.704 -11.789
   32   2HG   LYS   4           HGS      LYS   4  -6.255  -6.688 -13.542
   33   1HD   LYS   4           HDS      LYS   4  -5.976  -9.386 -12.877
   34   2HD   LYS   4           HDR      LYS   4  -6.842  -8.690 -11.535
   35   1HE   LYS   4           HES      LYS   4  -8.350  -9.554 -13.261
   36   2HE   LYS   4           HER      LYS   4  -8.542  -7.802 -12.967
   37   1HZ   LYS   4           HZA      LYS   4  -6.653  -8.332 -14.993
   38   2HZ   LYS   4           HZB      LYS   4  -8.098  -8.999 -15.360
   39   3HZ   LYS   4           HZC      LYS   4  -7.993  -7.400 -15.044
   40    H    GLN   5           HN       GLN   5  -4.663  -8.190 -10.233
   41    HA   GLN   5           HA       GLN   5  -4.209  -9.811  -8.690
   42   1HB   GLN   5           HBR      GLN   5  -1.451 -10.322  -9.734
   43   2HB   GLN   5           HBS      GLN   5  -2.629 -11.431  -8.976
   44   1HG   GLN   5           HGS      GLN   5  -3.730 -10.423 -11.422
   45   2HG   GLN   5           HGR      GLN   5  -2.079 -11.032 -11.733
   46   1HE2  GLN   5           HE2Z     GLN   5  -5.095 -13.562 -11.603
   47   2HE2  GLN   5           HE2E     GLN   5  -5.191 -11.858 -11.891
   48    H    LYS   6           HN       LYS   6  -3.479  -9.694  -6.659
   49    HA   LYS   6           HA       LYS   6  -2.055  -7.236  -5.908
   50   1HB   LYS   6           HBR      LYS   6  -3.628  -9.340  -4.508
   51   2HB   LYS   6           HBS      LYS   6  -2.294  -8.581  -3.593
   52   1HG   LYS   6           HGR      LYS   6  -4.410  -6.948  -5.026
   53   2HG   LYS   6           HGS      LYS   6  -4.628  -7.540  -3.354
   54   1HD   LYS   6           HDS      LYS   6  -3.500  -5.842  -2.562
   55   2HD   LYS   6           HDR      LYS   6  -2.089  -6.384  -3.427
   56   1HE   LYS   6           HES      LYS   6  -4.123  -4.809  -4.930
   57   2HE   LYS   6           HER      LYS   6  -3.039  -3.981  -3.776
   58   1HZ   LYS   6           HZB      LYS   6  -1.229  -5.218  -5.003
   59   2HZ   LYS   6           HZC      LYS   6  -2.326  -5.478  -6.184
   60   3HZ   LYS   6           HZA      LYS   6  -1.918  -3.952  -5.771
   61    H    VAL   7           HN       VAL   7   0.025  -7.453  -6.581
   62    HA   VAL   7           HA       VAL   7   1.718  -9.484  -5.292
   63    HB   VAL   7           HB       VAL   7   2.542 -10.362  -7.376
   64   1HG1  VAL   7           HMGR     VAL   7   0.541 -11.404  -6.247
   65   2HG1  VAL   7           HMGR     VAL   7  -0.470 -10.602  -7.473
   66   3HG1  VAL   7           HMGR     VAL   7   0.752 -11.797  -7.970
   67   1HG2  VAL   7           HMGS     VAL   7   1.968  -8.228  -8.682
   68   2HG2  VAL   7           HMGS     VAL   7   1.827  -9.795  -9.515
   69   3HG2  VAL   7           HMGS     VAL   7   0.367  -8.970  -8.919
   70    H    CYS   8           HN       CYS   8   3.992  -9.221  -6.636
   71    HA   CYS   8           HA       CYS   8   4.569  -6.318  -6.793
   72   1HB   CYS   8           HBS      CYS   8   5.871  -7.860  -5.253
   73   2HB   CYS   8           HBR      CYS   8   6.540  -8.605  -6.732
   74    HA   PRO   9           HA       PRO   9   4.881  -6.725 -11.188
   75   1HB   PRO   9           HBR      PRO   9   4.922  -3.933 -11.179
   76   2HB   PRO   9           HBS      PRO   9   3.837  -4.930 -11.904
   77   1HG   PRO   9           HGS      PRO   9   3.316  -3.441  -9.786
   78   2HG   PRO   9           HGR      PRO   9   2.409  -4.761 -10.255
   79   1HD   PRO   9           HDS      PRO   9   4.240  -4.554  -8.123
   80   2HD   PRO   9           HDR      PRO   9   3.011  -5.644  -8.321
   81    H    ALA  10           HN       ALA  10   6.946  -5.843  -8.859
   82    HA   ALA  10           HA       ALA  10   9.072  -4.872 -10.676
   83   1HB   ALA  10           HMBC     ALA  10   8.472  -4.335  -8.031
   84   2HB   ALA  10           HMBA     ALA  10   9.835  -5.476  -7.924
   85   3HB   ALA  10           HMBB     ALA  10  10.002  -3.975  -8.870
   86    H    CYS  11           HN       CYS  11   9.078  -7.273  -8.023
   87    HA   CYS  11           HA       CYS  11  11.192  -8.613  -9.490
   88   1HB   CYS  11           HBS      CYS  11  11.717  -9.735  -7.439
   89   2HB   CYS  11           HBR      CYS  11  11.517  -7.982  -7.182
   90    H    GLU  12           HN       GLU  12   7.912  -9.047  -9.418
   91    HA   GLU  12           HA       GLU  12   6.415 -10.761  -9.630
   92   1HB   GLU  12           HBS      GLU  12   8.794 -12.362 -10.465
   93   2HB   GLU  12           HBR      GLU  12   7.200 -12.783 -10.779
   94   1HG   GLU  12           HGS      GLU  12   8.103 -10.097 -11.719
   95   2HG   GLU  12           HGR      GLU  12   8.872 -11.461 -12.575
   96    H    SER  13           HN       SER  13   7.078 -10.270  -7.158
   97    HA   SER  13           HA       SER  13   6.806 -13.015  -6.077
   98   1HB   SER  13           HBS      SER  13   8.031 -10.692  -4.567
   99   2HB   SER  13           HBR      SER  13   7.654 -12.305  -3.902
  100    HG   SER  13           HG       SER  13   9.092 -13.310  -5.230
  101    H    ALA  14           HN       ALA  14   5.375 -13.093  -4.199
  102    HA   ALA  14           HA       ALA  14   3.114 -11.258  -4.689
  103   1HB   ALA  14           HMBC     ALA  14   2.791 -13.646  -5.175
  104   2HB   ALA  14           HMBB     ALA  14   3.230 -14.048  -3.495
  105   3HB   ALA  14           HMBA     ALA  14   1.748 -13.118  -3.831
  106    H    GLU  15           HN       GLU  15   5.480 -11.805  -2.413
  107    HA   GLU  15           HA       GLU  15   3.801 -11.591  -0.048
  108   1HB   GLU  15           HBR      GLU  15   6.805 -11.463  -0.200
  109   2HB   GLU  15           HBS      GLU  15   5.825 -11.889   1.095
  110   1HG   GLU  15           HGS      GLU  15   4.903 -13.830  -0.210
  111   2HG   GLU  15           HGR      GLU  15   6.233 -13.615  -1.380
  112    H    LEU  16           HN       LEU  16   3.099  -9.757   0.738
  113    HA   LEU  16           HA       LEU  16   4.854  -7.355   0.651
  114   1HB   LEU  16           HBR      LEU  16   1.886  -7.278   0.116
  115   2HB   LEU  16           HBS      LEU  16   3.132  -6.043  -0.223
  116    HG   LEU  16           HG       LEU  16   2.712  -8.657  -1.697
  117   1HD1  LEU  16           HMDR     LEU  16   1.897  -5.830  -2.122
  118   2HD1  LEU  16           HMDR     LEU  16   2.543  -6.693  -3.540
  119   3HD1  LEU  16           HMDR     LEU  16   1.133  -7.345  -2.667
  120   1HD2  LEU  16           HMDS     LEU  16   4.998  -6.906  -1.390
  121   2HD2  LEU  16           HMDS     LEU  16   4.860  -8.453  -2.262
  122   3HD2  LEU  16           HMDS     LEU  16   4.443  -6.928  -3.083
  123    H    ILE  17           HN       ILE  17   4.207  -5.684   2.165
  124    HA   ILE  17           HA       ILE  17   2.806  -6.638   4.582
  125    HB   ILE  17           HB       ILE  17   4.928  -6.094   5.923
  126   1HG1  ILE  17           HG1R     ILE  17   6.120  -6.258   3.135
  127   2HG1  ILE  17           HG1S     ILE  17   6.185  -4.893   4.286
  128   1HG2  ILE  17           HMG2     ILE  17   4.043  -8.475   4.855
  129   2HG2  ILE  17           HMG2     ILE  17   5.774  -8.450   4.424
  130   3HG2  ILE  17           HMG2     ILE  17   5.277  -8.279   6.128
  131   1HD1  ILE  17           HMD1     ILE  17   7.334  -7.152   5.575
  132   2HD1  ILE  17           HMD1     ILE  17   8.032  -7.050   3.937
  133   3HD1  ILE  17           HMD1     ILE  17   8.132  -5.650   5.038
  134    H    TYR  18           HN       TYR  18   2.286  -5.030   6.026
  135    HA   TYR  18           HA       TYR  18   2.080  -2.421   4.682
  136   1HB   TYR  18           HBS      TYR  18   0.150  -3.935   5.684
  137   2HB   TYR  18           HBR      TYR  18   0.598  -3.107   7.202
  138    HD1  TYR  18           HD1      TYR  18   0.522  -0.533   7.215
  139    HD2  TYR  18           HD2      TYR  18  -1.215  -2.859   4.107
  140    HE1  TYR  18           HE1      TYR  18  -0.903   1.370   6.594
  141    HE2  TYR  18           HE2      TYR  18  -2.663  -0.975   3.494
  142    HH   TYR  18           HH       TYR  18  -3.736   0.901   4.930
  143    H    ASP  19           HN       ASP  19   2.978  -0.618   5.361
  144    HA   ASP  19           HA       ASP  19   4.140  -0.555   8.093
  145   1HB   ASP  19           HBS      ASP  19   5.395  -0.011   5.657
  146   2HB   ASP  19           HBR      ASP  19   5.088   1.580   6.409
  147    HA   PRO  20           HA       PRO  20   0.421   1.837   8.432
  148   1HB   PRO  20           HBR      PRO  20   0.430   1.709  11.137
  149   2HB   PRO  20           HBS      PRO  20  -0.451   0.758  10.132
  150   1HG   PRO  20           HGS      PRO  20   1.851   0.102  11.554
  151   2HG   PRO  20           HGR      PRO  20   0.717  -0.923  10.887
  152   1HD   PRO  20           HDS      PRO  20   3.158  -0.515   9.889
  153   2HD   PRO  20           HDR      PRO  20   1.891  -1.156   9.041
  154    H    GLU  21           HN       GLU  21   3.491   2.539   9.419
  155    HA   GLU  21           HA       GLU  21   3.024   4.969  10.918
  156   1HB   GLU  21           HBR      GLU  21   5.463   4.379   9.282
  157   2HB   GLU  21           HBS      GLU  21   5.295   5.271  10.693
  158   1HG   GLU  21           HGS      GLU  21   5.267   2.293  10.458
  159   2HG   GLU  21           HGR      GLU  21   6.342   3.266  11.499
  160    H    ARG  22           HN       ARG  22   4.036   4.266   7.547
  161    HA   ARG  22           HA       ARG  22   3.298   6.976   6.682
  162   1HB   ARG  22           HBR      ARG  22   4.881   4.778   5.623
  163   2HB   ARG  22           HBS      ARG  22   3.702   5.381   4.423
  164   1HG   ARG  22           HGS      ARG  22   5.672   6.615   4.041
  165   2HG   ARG  22           HGR      ARG  22   4.594   7.715   4.945
  166   1HD   ARG  22           HDS      ARG  22   5.857   7.642   6.824
  167   2HD   ARG  22           HDR      ARG  22   6.463   5.995   6.488
  168    HE   ARG  22           HE       ARG  22   7.610   8.520   5.570
  169   1HH1  ARG  22           HH1Z     ARG  22   7.332   5.082   4.838
  170   2HH1  ARG  22           HH1E     ARG  22   8.918   4.991   4.148
  171   1HH2  ARG  22           HH2Z     ARG  22   9.725   8.331   4.779
  172   2HH2  ARG  22           HH2E     ARG  22  10.272   6.828   4.113
  173    H    GLY  23           HN       GLY  23   2.011   3.725   6.784
  174   1HA   GLY  23           HAR      GLY  23  -0.265   3.097   6.350
  175   2HA   GLY  23           HAS      GLY  23  -0.470   4.579   5.379
  176    H    GLU  24           HN       GLU  24   2.428   2.623   5.143
  177    HA   GLU  24           HA       GLU  24   1.960   2.422   2.265
  178   1HB   GLU  24           HBR      GLU  24   4.041   3.147   3.700
  179   2HB   GLU  24           HBS      GLU  24   4.277   1.496   3.888
  180   1HG   GLU  24           HGR      GLU  24   5.410   1.328   1.924
  181   2HG   GLU  24           HGS      GLU  24   3.861   1.749   1.143
  182    H    ILE  25           HN       ILE  25   2.561   0.454   1.094
  183    HA   ILE  25           HA       ILE  25   2.599  -2.039   2.667
  184    HB   ILE  25           HB       ILE  25   0.974  -1.891   0.093
  185   1HG1  ILE  25           HG1R     ILE  25  -0.981  -2.113   1.949
  186   2HG1  ILE  25           HG1S     ILE  25   0.179  -1.103   2.858
  187   1HG2  ILE  25           HMG2     ILE  25   1.570  -3.966   2.113
  188   2HG2  ILE  25           HMG2     ILE  25  -0.106  -3.908   1.506
  189   3HG2  ILE  25           HMG2     ILE  25   1.250  -4.100   0.364
  190   1HD1  ILE  25           HMD1     ILE  25  -0.476  -0.309   0.054
  191   2HD1  ILE  25           HMD1     ILE  25  -1.708  -0.047   1.317
  192   3HD1  ILE  25           HMD1     ILE  25  -0.094   0.695   1.478
  193    H    VAL  26           HN       VAL  26   4.443  -2.957   2.237
  194    HA   VAL  26           HA       VAL  26   5.813  -2.193  -0.289
  195    HB   VAL  26           HB       VAL  26   7.184  -2.989   2.272
  196   1HG1  VAL  26           HMGR     VAL  26   8.077  -1.424  -0.157
  197   2HG1  VAL  26           HMGR     VAL  26   9.027  -1.598   1.337
  198   3HG1  VAL  26           HMGR     VAL  26   8.626  -3.035   0.367
  199   1HG2  VAL  26           HMGS     VAL  26   5.632  -1.070   2.692
  200   2HG2  VAL  26           HMGS     VAL  26   7.355  -0.722   2.974
  201   3HG2  VAL  26           HMGS     VAL  26   6.560  -0.135   1.494
  202    H    CYS  27           HN       CYS  27   7.578  -3.731  -0.921
  203    HA   CYS  27           HA       CYS  27   6.633  -6.483  -0.767
  204   1HB   CYS  27           HBS      CYS  27   7.333  -5.327  -2.872
  205   2HB   CYS  27           HBR      CYS  27   9.011  -5.359  -2.266
  206    H    ALA  28           HN       ALA  28   7.434  -8.073   0.379
  207    HA   ALA  28           HA       ALA  28   9.772  -7.600   2.075
  208   1HB   ALA  28           HMBA     ALA  28   7.440  -8.765   2.583
  209   2HB   ALA  28           HMBB     ALA  28   8.321 -10.205   2.012
  210   3HB   ALA  28           HMBC     ALA  28   8.950  -9.263   3.388
  211    H    LYS  29           HN       LYS  29   9.959  -7.991  -0.913
  212    HA   LYS  29           HA       LYS  29  11.598 -10.479  -1.022
  213   1HB   LYS  29           HBS      LYS  29   8.969 -10.022  -2.041
  214   2HB   LYS  29           HBR      LYS  29  10.089 -10.125  -3.428
  215   1HG   LYS  29           HGR      LYS  29  10.026 -12.190  -1.205
  216   2HG   LYS  29           HGS      LYS  29   9.005 -12.304  -2.666
  217   1HD   LYS  29           HDS      LYS  29  10.641 -13.224  -3.790
  218   2HD   LYS  29           HDR      LYS  29  11.590 -11.779  -3.578
  219   1HE   LYS  29           HES      LYS  29  11.537 -14.144  -1.708
  220   2HE   LYS  29           HER      LYS  29  12.837 -13.686  -2.845
  221   1HZ   LYS  29           HZB      LYS  29  12.976 -11.587  -1.585
  222   2HZ   LYS  29           HZC      LYS  29  11.951 -12.201  -0.472
  223   3HZ   LYS  29           HZA      LYS  29  13.405 -12.903  -0.718
  224    H    CYS  30           HN       CYS  30  10.813  -7.299  -2.339
  225    HA   CYS  30           HA       CYS  30  13.688  -7.209  -3.080
  226   1HB   CYS  30           HBR      CYS  30  13.258  -5.742  -4.943
  227   2HB   CYS  30           HBS      CYS  30  12.486  -7.337  -5.153
  228    H    GLY  31           HN       GLY  31  11.286  -6.073  -1.114
  229   1HA   GLY  31           HAR      GLY  31  11.430  -4.410   0.469
  230   2HA   GLY  31           HAS      GLY  31  12.795  -3.698  -0.436
  231    H    TYR  32           HN       TYR  32  10.369  -4.126  -2.645
  232    HA   TYR  32           HA       TYR  32  10.332  -1.201  -2.952
  233   1HB   TYR  32           HBS      TYR  32  10.717  -2.553  -4.938
  234   2HB   TYR  32           HBR      TYR  32   9.186  -3.435  -4.674
  235    HD1  TYR  32           HD2      TYR  32  10.317   0.133  -4.948
  236    HD2  TYR  32           HD1      TYR  32   7.476  -2.805  -6.123
  237    HE1  TYR  32           HE2      TYR  32   9.248   1.772  -6.430
  238    HE2  TYR  32           HE1      TYR  32   6.380  -1.167  -7.592
  239    HH   TYR  32           HH       TYR  32   6.204   0.984  -8.112
  240    H    VAL  33           HN       VAL  33   8.688   0.094  -2.539
  241    HA   VAL  33           HA       VAL  33   6.376  -0.699  -1.117
  242    HB   VAL  33           HB       VAL  33   6.802   1.777  -2.806
  243   1HG1  VAL  33           HMGR     VAL  33   4.687   1.034  -0.804
  244   2HG1  VAL  33           HMGR     VAL  33   5.148   2.733  -1.065
  245   3HG1  VAL  33           HMGR     VAL  33   4.516   1.764  -2.418
  246   1HG2  VAL  33           HMGS     VAL  33   8.421   1.165  -0.834
  247   2HG2  VAL  33           HMGS     VAL  33   7.806   2.823  -1.036
  248   3HG2  VAL  33           HMGS     VAL  33   7.070   1.742   0.172
  249    H    ILE  34           HN       ILE  34   4.145  -0.482  -1.818
  250    HA   ILE  34           HA       ILE  34   3.721  -1.270  -4.657
  251    HB   ILE  34           HB       ILE  34   2.373  -2.082  -2.046
  252   1HG1  ILE  34           HG1R     ILE  34   4.507  -3.164  -2.779
  253   2HG1  ILE  34           HG1S     ILE  34   3.134  -4.280  -2.529
  254   1HG2  ILE  34           HMG2     ILE  34   1.111  -1.907  -4.627
  255   2HG2  ILE  34           HMG2     ILE  34   1.212  -3.606  -4.097
  256   3HG2  ILE  34           HMG2     ILE  34   0.436  -2.391  -3.049
  257   1HD1  ILE  34           HMD1     ILE  34   3.320  -3.376  -5.292
  258   2HD1  ILE  34           HMD1     ILE  34   4.819  -4.168  -4.739
  259   3HD1  ILE  34           HMD1     ILE  34   3.263  -5.030  -4.627
  260    H    GLU  35           HN       GLU  35   1.617  -0.158  -2.008
  261    HA   GLU  35           HA       GLU  35   1.343   2.467  -3.273
  262   1HB   GLU  35           HBS      GLU  35  -0.372   1.249  -4.311
  263   2HB   GLU  35           HBR      GLU  35  -0.916   0.510  -2.906
  264   1HG   GLU  35           HGS      GLU  35  -1.746   2.674  -2.053
  265   2HG   GLU  35           HGR      GLU  35  -1.042   3.552  -3.439
  266    H    GLU  36           HN       GLU  36   0.040   3.905  -1.781
  267    HA   GLU  36           HA       GLU  36   0.484   3.241   1.081
  268   1HB   GLU  36           HBR      GLU  36   2.126   4.861   1.323
  269   2HB   GLU  36           HBS      GLU  36   2.541   3.926  -0.006
  270   1HG   GLU  36           HGS      GLU  36   1.327   6.666  -0.171
  271   2HG   GLU  36           HGR      GLU  36   3.011   6.275  -0.612
  272    H    ASN  37           HN       ASN  37   0.247   5.620   2.209
  273    HA   ASN  37           HA       ASN  37  -0.991   7.461   2.673
  274   1HB   ASN  37           HBS      ASN  37  -0.750   7.562  -0.086
  275   2HB   ASN  37           HBR      ASN  37  -2.496   7.782   0.227
  276   1HD2  ASN  37           HD2Z     ASN  37  -0.094  10.432   2.280
  277   2HD2  ASN  37           HD2E     ASN  37   0.234   8.732   2.320
  278    H    ILE  38           HN       ILE  38  -1.998   6.058   4.149
  279    HA   ILE  38           HA       ILE  38  -4.868   6.351   3.791
  280    HB   ILE  38           HB       ILE  38  -3.665   3.606   4.398
  281   1HG1  ILE  38           HG1R     ILE  38  -5.331   4.701   2.108
  282   2HG1  ILE  38           HG1S     ILE  38  -3.669   4.048   2.052
  283   1HG2  ILE  38           HMG2     ILE  38  -6.525   4.557   4.610
  284   2HG2  ILE  38           HMG2     ILE  38  -6.051   2.840   4.520
  285   3HG2  ILE  38           HMG2     ILE  38  -5.500   3.847   5.885
  286   1HD1  ILE  38           HMD1     ILE  38  -4.702   1.829   2.803
  287   2HD1  ILE  38           HMD1     ILE  38  -6.274   2.560   2.387
  288   3HD1  ILE  38           HMD1     ILE  38  -5.022   2.364   1.132
  289    H    ILE  39           HN       ILE  39  -3.930   8.049   5.245
  290    HA   ILE  39           HA       ILE  39  -3.329   7.051   7.982
  291    HB   ILE  39           HB       ILE  39  -2.614   9.545   8.279
  292   1HG1  ILE  39           HG1R     ILE  39  -2.607   9.333   5.243
  293   2HG1  ILE  39           HG1S     ILE  39  -3.652  10.384   6.240
  294   1HG2  ILE  39           HMG2     ILE  39  -1.132   7.445   8.027
  295   2HG2  ILE  39           HMG2     ILE  39  -0.811   8.064   6.386
  296   3HG2  ILE  39           HMG2     ILE  39  -0.398   9.056   7.810
  297   1HD1  ILE  39           HMD1     ILE  39  -1.118  11.105   7.050
  298   2HD1  ILE  39           HMD1     ILE  39  -0.902  10.785   5.308
  299   3HD1  ILE  39           HMD1     ILE  39  -2.122  11.968   5.854
  300    H    ASP  40           HN       ASP  40  -5.505   6.591   8.450
  301    HA   ASP  40           HA       ASP  40  -7.557   8.623   8.111
  302   1HB   ASP  40           HBS      ASP  40  -7.481   5.793   8.732
  303   2HB   ASP  40           HBR      ASP  40  -8.607   6.698   9.785
  304    H    MET  41           HN       MET  41  -6.059  10.151   9.255
  305    HA   MET  41           HA       MET  41  -5.821  11.593  11.012
  306   1HB   MET  41           HBS      MET  41  -8.395  10.879  11.292
  307   2HB   MET  41           HBR      MET  41  -7.735  10.193  12.805
  308   1HG   MET  41           HGS      MET  41  -6.889  12.344  13.498
  309   2HG   MET  41           HGR      MET  41  -7.206  13.043  11.893
  310   1HE   MET  41           HMEA     MET  41  -8.670  10.768  14.395
  311   2HE   MET  41           HMEC     MET  41 -10.028  11.649  15.139
  312   3HE   MET  41           HMEB     MET  41 -10.304  10.642  13.696
  313    H    GLY  42           HN       GLY  42  -3.922  11.387  11.891
  314   1HA   GLY  42           HAS      GLY  42  -3.076   9.931  14.083
  315   2HA   GLY  42           HAR      GLY  42  -2.889   8.807  12.708
  316    HA   PRO  43           HA       PRO  43  -0.368  12.955  12.234
  317   1HB   PRO  43           HBR      PRO  43   0.882  13.522  14.577
  318   2HB   PRO  43           HBS      PRO  43  -0.342  14.384  13.903
  319   1HG   PRO  43           HGS      PRO  43  -0.449  12.634  16.067
  320   2HG   PRO  43           HGR      PRO  43  -1.541  13.820  15.635
  321   1HD   PRO  43           HDS      PRO  43  -1.957  11.205  15.323
  322   2HD   PRO  43           HDR      PRO  43  -2.782  12.389  14.513
  323    H    GLU  44           HN       GLU  44   1.194  11.076  14.719
  324    HA   GLU  44           HA       GLU  44   3.335  10.276  14.887
  325   1HB   GLU  44           HBR      GLU  44   2.346   9.024  12.855
  326   2HB   GLU  44           HBS      GLU  44   3.165  10.141  11.909
  327   1HG   GLU  44           HGS      GLU  44   5.318   9.524  12.567
  328   2HG   GLU  44           HGR      GLU  44   4.754   8.507  13.921
  329    H    TRP  45           HN       TRP  45   2.655  13.163  14.264
  330    HA   TRP  45           HA       TRP  45   5.274  14.022  13.152
  331   1HB   TRP  45           HBS      TRP  45   2.638  14.345  12.035
  332   2HB   TRP  45           HBR      TRP  45   3.372  15.933  12.397
  333    HD1  TRP  45           HD1      TRP  45   6.368  15.381  11.582
  334    HE1  TRP  45           HE1      TRP  45   6.993  15.103   9.106
  335    HE3  TRP  45           HE3      TRP  45   1.795  14.034   9.803
  336    HZ2  TRP  45           HZ2      TRP  45   5.684  14.425   6.720
  337    HZ3  TRP  45           HZ3      TRP  45   1.556  13.575   7.408
  338    HH2  TRP  45           HH2      TRP  45   3.452  13.773   5.887
  339    H    ARG  46           HN       ARG  46   2.504  14.708  15.225
  340    HA   ARG  46           HA       ARG  46   3.815  17.192  16.167
  341   1HB   ARG  46           HBR      ARG  46   0.996  16.379  16.836
  342   2HB   ARG  46           HBS      ARG  46   1.723  18.008  16.720
  343   1HG   ARG  46           HGS      ARG  46   1.396  16.252  14.286
  344   2HG   ARG  46           HGR      ARG  46   0.056  17.263  14.894
  345   1HD   ARG  46           HDS      ARG  46   2.812  18.309  14.261
  346   2HD   ARG  46           HDR      ARG  46   1.458  18.289  13.097
  347    HE   ARG  46           HE       ARG  46   0.249  19.685  14.874
  348   1HH1  ARG  46           HH1Z     ARG  46   3.689  19.875  14.128
  349   2HH1  ARG  46           HH1E     ARG  46   3.869  21.443  14.841
  350   1HH2  ARG  46           HH2Z     ARG  46   0.550  21.680  15.908
  351   2HH2  ARG  46           HH2E     ARG  46   2.092  22.465  15.847
  352    H    ALA  47           HN       ALA  47   2.361  17.469  18.537
  353    HA   ALA  47           HA       ALA  47   3.609  15.345  20.217
  354   1HB   ALA  47           HMBC     ALA  47   4.704  17.682  20.241
  355   2HB   ALA  47           HMBA     ALA  47   3.258  18.184  21.152
  356   3HB   ALA  47           HMBB     ALA  47   4.310  16.896  21.791
  357    H    PHE  48           HN       PHE  48   0.920  15.644  19.004
  358    HA   PHE  48           HA       PHE  48  -1.259  15.240  19.621
  359   1HB   PHE  48           HBS      PHE  48  -0.792  15.686  22.557
  360   2HB   PHE  48           HBR      PHE  48  -1.921  14.581  21.722
  361    HD1  PHE  48           HD2      PHE  48  -0.336  12.825  20.092
  362    HD2  PHE  48           HD1      PHE  48   0.718  14.661  23.789
  363    HE1  PHE  48           HE2      PHE  48   1.256  10.987  20.544
  364    HE2  PHE  48           HE1      PHE  48   2.302  12.848  24.262
  365    HZ   PHE  48           HZ       PHE  48   2.530  10.979  22.669
  366    H    ASP  49           HN       ASP  49  -0.164  17.366  22.273
  367    HA   ASP  49           HA       ASP  49  -0.856  19.729  20.812
  368   1HB   ASP  49           HBS      ASP  49  -2.619  20.612  22.078
  369   2HB   ASP  49           HBR      ASP  49  -3.101  18.973  21.551
  370    H    ALA  50           HN       ALA  50  -0.829  21.658  22.553
  371    HA   ALA  50           HA       ALA  50   1.557  21.184  24.276
  372   1HB   ALA  50           HMBC     ALA  50   1.126  23.159  22.406
  373   2HB   ALA  50           HMBA     ALA  50   0.662  23.950  23.934
  374   3HB   ALA  50           HMBB     ALA  50   2.281  23.225  23.762
   
  No H/Q in entry =         374
  Start of MODEL   15
    1   1H    MET   1           HN       MET   1  -3.159 -15.202 -15.438
    2   2H    MET   1           HNC      MET   1  -1.596 -14.979 -15.017
    3   3H    MET   1           HNB      MET   1  -1.973 -15.959 -16.269
    4    HA   MET   1           HA       MET   1  -2.924 -17.571 -14.943
    5   1HB   MET   1           HBS      MET   1  -0.213 -16.565 -14.366
    6   2HB   MET   1           HBR      MET   1  -0.899 -17.626 -13.102
    7   1HG   MET   1           HGS      MET   1  -1.487 -19.270 -14.963
    8   2HG   MET   1           HGR      MET   1  -0.526 -18.241 -16.054
    9   1HE   MET   1           HMEB     MET   1   1.196 -19.641 -16.709
   10   2HE   MET   1           HMEA     MET   1   2.428 -20.484 -15.736
   11   3HE   MET   1           HMEC     MET   1   0.786 -21.162 -15.875
   12    H    VAL   2           HN       VAL   2  -4.026 -18.160 -13.144
   13    HA   VAL   2           HA       VAL   2  -4.737 -15.908 -11.357
   14    HB   VAL   2           HB       VAL   2  -6.825 -17.400 -11.035
   15   1HG1  VAL   2           HMGR     VAL   2  -6.490 -15.195 -12.400
   16   2HG1  VAL   2           HMGR     VAL   2  -6.676 -16.267 -13.808
   17   3HG1  VAL   2           HMGR     VAL   2  -7.974 -16.158 -12.594
   18   1HG2  VAL   2           HMGS     VAL   2  -5.636 -19.306 -12.343
   19   2HG2  VAL   2           HMGS     VAL   2  -7.373 -19.010 -12.590
   20   3HG2  VAL   2           HMGS     VAL   2  -6.191 -18.421 -13.783
   21    H    ASN   3           HN       ASN   3  -4.213 -15.954  -9.327
   22    HA   ASN   3           HA       ASN   3  -4.254 -18.504  -7.858
   23   1HB   ASN   3           HBS      ASN   3  -2.040 -17.736  -6.776
   24   2HB   ASN   3           HBR      ASN   3  -2.041 -18.608  -8.335
   25   1HD2  ASN   3           HD2Z     ASN   3  -0.132 -15.135  -8.032
   26   2HD2  ASN   3           HD2E     ASN   3  -0.610 -16.138  -6.703
   27    H    LYS   4           HN       LYS   4  -3.009 -15.261  -7.068
   28    HA   LYS   4           HA       LYS   4  -4.990 -15.181  -4.836
   29   1HB   LYS   4           HBS      LYS   4  -2.066 -14.363  -4.778
   30   2HB   LYS   4           HBR      LYS   4  -3.237 -14.247  -3.433
   31   1HG   LYS   4           HGR      LYS   4  -2.110 -16.763  -4.712
   32   2HG   LYS   4           HGS      LYS   4  -1.867 -16.177  -3.041
   33   1HD   LYS   4           HDS      LYS   4  -4.628 -16.365  -3.312
   34   2HD   LYS   4           HDR      LYS   4  -4.026 -17.740  -4.198
   35   1HE   LYS   4           HES      LYS   4  -3.062 -17.128  -1.417
   36   2HE   LYS   4           HER      LYS   4  -4.534 -18.084  -1.751
   37   1HZ   LYS   4           HZB      LYS   4  -2.120 -18.843  -3.143
   38   2HZ   LYS   4           HZC      LYS   4  -2.175 -19.168  -1.543
   39   3HZ   LYS   4           HZA      LYS   4  -3.317 -19.776  -2.539
   40    H    GLN   5           HN       GLN   5  -2.910 -13.374  -7.072
   41    HA   GLN   5           HA       GLN   5  -2.973 -11.221  -7.836
   42   1HB   GLN   5           HBR      GLN   5  -5.559 -11.599  -7.721
   43   2HB   GLN   5           HBS      GLN   5  -5.443 -10.539  -6.287
   44   1HG   GLN   5           HGS      GLN   5  -4.678  -8.723  -7.541
   45   2HG   GLN   5           HGR      GLN   5  -4.219  -9.753  -8.925
   46   1HE2  GLN   5           HE2Z     GLN   5  -7.118  -8.212 -10.264
   47   2HE2  GLN   5           HE2E     GLN   5  -5.402  -8.061 -10.092
   48    H    LYS   6           HN       LYS   6  -2.992  -8.913  -6.905
   49    HA   LYS   6           HA       LYS   6  -1.831  -7.469  -5.553
   50   1HB   LYS   6           HBS      LYS   6  -3.398  -8.077  -3.756
   51   2HB   LYS   6           HBR      LYS   6  -2.376  -9.484  -3.347
   52   1HG   LYS   6           HGR      LYS   6  -1.021  -6.829  -3.386
   53   2HG   LYS   6           HGS      LYS   6  -2.218  -7.094  -2.085
   54   1HD   LYS   6           HDS      LYS   6   0.168  -8.844  -2.690
   55   2HD   LYS   6           HDR      LYS   6   0.064  -7.645  -1.429
   56   1HE   LYS   6           HES      LYS   6  -2.188  -9.225  -1.018
   57   2HE   LYS   6           HER      LYS   6  -0.880 -10.363  -1.453
   58   1HZ   LYS   6           HZC      LYS   6   0.032  -8.405   0.343
   59   2HZ   LYS   6           HZA      LYS   6  -1.273  -9.166   0.964
   60   3HZ   LYS   6           HZB      LYS   6   0.032 -10.031   0.502
   61    H    VAL   7           HN       VAL   7   0.118  -7.629  -6.500
   62    HA   VAL   7           HA       VAL   7   2.029  -9.657  -5.485
   63    HB   VAL   7           HB       VAL   7   2.611 -10.325  -7.710
   64   1HG1  VAL   7           HMGR     VAL   7   0.835 -11.594  -6.633
   65   2HG1  VAL   7           HMGR     VAL   7  -0.389 -10.503  -7.325
   66   3HG1  VAL   7           HMGR     VAL   7   0.591 -11.533  -8.395
   67   1HG2  VAL   7           HMGS     VAL   7   1.003  -8.014  -8.512
   68   2HG2  VAL   7           HMGS     VAL   7   2.340  -8.840  -9.347
   69   3HG2  VAL   7           HMGS     VAL   7   0.684  -9.480  -9.470
   70    H    CYS   8           HN       CYS   8   4.221  -9.266  -6.656
   71    HA   CYS   8           HA       CYS   8   4.765  -6.355  -6.787
   72   1HB   CYS   8           HBS      CYS   8   6.021  -7.882  -5.194
   73   2HB   CYS   8           HBR      CYS   8   6.765  -8.612  -6.644
   74    HA   PRO   9           HA       PRO   9   5.267  -6.757 -11.176
   75   1HB   PRO   9           HBR      PRO   9   5.458  -3.972 -11.147
   76   2HB   PRO   9           HBS      PRO   9   4.347  -4.905 -11.918
   77   1HG   PRO   9           HGS      PRO   9   3.843  -3.397  -9.801
   78   2HG   PRO   9           HGR      PRO   9   2.865  -4.640 -10.331
   79   1HD   PRO   9           HDS      PRO   9   4.582  -4.593  -8.107
   80   2HD   PRO   9           HDR      PRO   9   3.317  -5.615  -8.408
   81    H    ALA  10           HN       ALA  10   7.257  -5.820  -8.748
   82    HA   ALA  10           HA       ALA  10   9.485  -4.944 -10.475
   83   1HB   ALA  10           HMBA     ALA  10   8.760  -4.326  -7.901
   84   2HB   ALA  10           HMBC     ALA  10  10.053  -5.527  -7.659
   85   3HB   ALA  10           HMBB     ALA  10  10.365  -4.066  -8.630
   86    H    CYS  11           HN       CYS  11   9.291  -7.329  -7.812
   87    HA   CYS  11           HA       CYS  11  11.360  -8.856  -9.198
   88   1HB   CYS  11           HBS      CYS  11  11.635 -10.077  -7.144
   89   2HB   CYS  11           HBR      CYS  11  11.684  -8.314  -6.879
   90    H    GLU  12           HN       GLU  12   8.054  -8.913  -9.273
   91    HA   GLU  12           HA       GLU  12   6.392 -10.407  -9.635
   92   1HB   GLU  12           HBR      GLU  12   6.762 -11.900 -11.289
   93   2HB   GLU  12           HBS      GLU  12   7.973 -10.767 -11.515
   94   1HG   GLU  12           HGS      GLU  12   8.946 -12.888  -9.798
   95   2HG   GLU  12           HGR      GLU  12   8.456 -13.529 -11.390
   96    H    SER  13           HN       SER  13   7.237 -10.290  -7.095
   97    HA   SER  13           HA       SER  13   6.961 -13.103  -6.172
   98   1HB   SER  13           HBS      SER  13   7.335 -12.343  -3.955
   99   2HB   SER  13           HBR      SER  13   8.629 -11.671  -4.987
  100    HG   SER  13           HG       SER  13   6.483 -10.514  -3.538
  101    H    ALA  14           HN       ALA  14   5.431 -12.856  -4.007
  102    HA   ALA  14           HA       ALA  14   3.031 -11.277  -4.754
  103   1HB   ALA  14           HMBC     ALA  14   3.319 -14.155  -3.951
  104   2HB   ALA  14           HMBB     ALA  14   1.852 -13.260  -3.478
  105   3HB   ALA  14           HMBA     ALA  14   2.281 -13.422  -5.200
  106    H    GLU  15           HN       GLU  15   5.430 -11.845  -2.518
  107    HA   GLU  15           HA       GLU  15   3.794 -11.625  -0.107
  108   1HB   GLU  15           HBR      GLU  15   6.789 -11.494  -0.254
  109   2HB   GLU  15           HBS      GLU  15   5.794 -11.987   1.002
  110   1HG   GLU  15           HGS      GLU  15   5.181 -13.639  -1.246
  111   2HG   GLU  15           HGR      GLU  15   6.934 -13.749  -0.938
  112    H    LEU  16           HN       LEU  16   3.026  -9.727   0.457
  113    HA   LEU  16           HA       LEU  16   4.925  -7.436   0.609
  114   1HB   LEU  16           HBR      LEU  16   1.991  -7.279  -0.117
  115   2HB   LEU  16           HBS      LEU  16   3.229  -5.995  -0.211
  116    HG   LEU  16           HG       LEU  16   3.225  -8.485  -1.932
  117   1HD1  LEU  16           HMDR     LEU  16   1.741  -5.950  -2.135
  118   2HD1  LEU  16           HMDR     LEU  16   2.712  -6.347  -3.575
  119   3HD1  LEU  16           HMDR     LEU  16   1.493  -7.500  -2.977
  120   1HD2  LEU  16           HMDS     LEU  16   4.775  -5.883  -1.873
  121   2HD2  LEU  16           HMDS     LEU  16   5.400  -7.544  -1.708
  122   3HD2  LEU  16           HMDS     LEU  16   4.765  -6.984  -3.275
  123    H    ILE  17           HN       ILE  17   4.086  -5.706   2.078
  124    HA   ILE  17           HA       ILE  17   2.608  -6.723   4.417
  125    HB   ILE  17           HB       ILE  17   4.626  -6.059   5.875
  126   1HG1  ILE  17           HG1R     ILE  17   6.005  -6.287   3.176
  127   2HG1  ILE  17           HG1S     ILE  17   5.911  -4.854   4.239
  128   1HG2  ILE  17           HMG2     ILE  17   3.855  -8.410   5.423
  129   2HG2  ILE  17           HMG2     ILE  17   5.119  -8.500   4.166
  130   3HG2  ILE  17           HMG2     ILE  17   5.572  -8.229   5.870
  131   1HD1  ILE  17           HMD1     ILE  17   7.308  -7.429   5.006
  132   2HD1  ILE  17           HMD1     ILE  17   8.123  -6.041   4.239
  133   3HD1  ILE  17           HMD1     ILE  17   7.369  -5.857   5.846
  134    H    TYR  18           HN       TYR  18   1.490  -5.176   5.341
  135    HA   TYR  18           HA       TYR  18   1.673  -2.470   4.386
  136   1HB   TYR  18           HBR      TYR  18  -0.462  -3.595   4.966
  137   2HB   TYR  18           HBS      TYR  18   0.030  -3.598   6.683
  138    HD1  TYR  18           HD2      TYR  18   0.216  -1.449   7.904
  139    HD2  TYR  18           HD1      TYR  18  -1.394  -1.610   3.971
  140    HE1  TYR  18           HE2      TYR  18  -0.822   0.747   8.248
  141    HE2  TYR  18           HE1      TYR  18  -2.389   0.616   4.280
  142    HH   TYR  18           HH       TYR  18  -1.474   2.707   6.616
  143    H    ASP  19           HN       ASP  19   1.678  -0.603   5.892
  144    HA   ASP  19           HA       ASP  19   3.645  -0.866   8.061
  145   1HB   ASP  19           HBS      ASP  19   4.365  -0.210   5.364
  146   2HB   ASP  19           HBR      ASP  19   4.647   1.191   6.437
  147    HA   PRO  20           HA       PRO  20   0.798   2.248   9.414
  148   1HB   PRO  20           HBS      PRO  20   1.823   1.716  11.954
  149   2HB   PRO  20           HBR      PRO  20   0.271   1.562  11.442
  150   1HG   PRO  20           HGS      PRO  20   1.913  -0.448  12.002
  151   2HG   PRO  20           HGR      PRO  20   0.513  -0.598  11.108
  152   1HD   PRO  20           HDS      PRO  20   3.170  -0.640  10.209
  153   2HD   PRO  20           HDR      PRO  20   1.812  -1.169   9.427
  154    H    GLU  21           HN       GLU  21   4.072   2.085   9.295
  155    HA   GLU  21           HA       GLU  21   4.743   4.431  10.899
  156   1HB   GLU  21           HBR      GLU  21   6.393   3.315   8.666
  157   2HB   GLU  21           HBS      GLU  21   6.856   4.107  10.071
  158   1HG   GLU  21           HGS      GLU  21   6.545   2.345  11.519
  159   2HG   GLU  21           HGR      GLU  21   5.518   1.409  10.400
  160    H    ARG  22           HN       ARG  22   4.144   3.639   7.477
  161    HA   ARG  22           HA       ARG  22   4.417   6.534   6.802
  162   1HB   ARG  22           HBR      ARG  22   4.832   4.129   4.996
  163   2HB   ARG  22           HBS      ARG  22   4.907   5.847   4.509
  164   1HG   ARG  22           HGS      ARG  22   6.837   6.165   6.024
  165   2HG   ARG  22           HGR      ARG  22   6.781   4.427   6.433
  166   1HD   ARG  22           HDS      ARG  22   7.097   3.900   4.047
  167   2HD   ARG  22           HDR      ARG  22   7.267   5.646   3.715
  168    HE   ARG  22           HE       ARG  22   9.089   4.560   5.731
  169   1HH1  ARG  22           HH1Z     ARG  22   8.598   5.698   2.431
  170   2HH1  ARG  22           HH1E     ARG  22  10.288   5.672   2.054
  171   1HH2  ARG  22           HH2Z     ARG  22  11.278   4.415   5.161
  172   2HH2  ARG  22           HH2E     ARG  22  11.806   4.947   3.599
  173    H    GLY  23           HN       GLY  23   2.414   3.751   6.978
  174   1HA   GLY  23           HAR      GLY  23   0.172   3.407   6.412
  175   2HA   GLY  23           HAS      GLY  23   0.104   5.048   5.715
  176    H    GLU  24           HN       GLU  24   2.175   2.176   5.138
  177    HA   GLU  24           HA       GLU  24   1.579   2.385   2.218
  178   1HB   GLU  24           HBS      GLU  24   3.473   3.672   2.955
  179   2HB   GLU  24           HBR      GLU  24   4.197   2.370   3.726
  180   1HG   GLU  24           HGR      GLU  24   5.142   1.620   1.678
  181   2HG   GLU  24           HGS      GLU  24   3.533   1.795   0.926
  182    H    ILE  25           HN       ILE  25   1.746   0.518   1.059
  183    HA   ILE  25           HA       ILE  25   2.359  -1.981   2.564
  184    HB   ILE  25           HB       ILE  25   0.823  -1.804  -0.066
  185   1HG1  ILE  25           HG1R     ILE  25  -1.156  -2.339   1.680
  186   2HG1  ILE  25           HG1S     ILE  25  -0.111  -1.348   2.735
  187   1HG2  ILE  25           HMG2     ILE  25   1.160  -3.979   2.001
  188   2HG2  ILE  25           HMG2     ILE  25  -0.072  -4.022   0.712
  189   3HG2  ILE  25           HMG2     ILE  25   1.660  -3.987   0.289
  190   1HD1  ILE  25           HMD1     ILE  25  -0.683  -0.282   0.016
  191   2HD1  ILE  25           HMD1     ILE  25  -2.030  -0.306   1.184
  192   3HD1  ILE  25           HMD1     ILE  25  -0.523   0.563   1.579
  193    H    VAL  26           HN       VAL  26   4.044  -3.137   1.969
  194    HA   VAL  26           HA       VAL  26   5.589  -2.211  -0.398
  195    HB   VAL  26           HB       VAL  26   6.761  -2.994   2.267
  196   1HG1  VAL  26           HMGR     VAL  26   7.847  -1.451  -0.098
  197   2HG1  VAL  26           HMGR     VAL  26   8.662  -1.575   1.479
  198   3HG1  VAL  26           HMGR     VAL  26   8.373  -3.039   0.509
  199   1HG2  VAL  26           HMGS     VAL  26   5.444  -0.457   1.509
  200   2HG2  VAL  26           HMGS     VAL  26   5.714  -1.192   3.108
  201   3HG2  VAL  26           HMGS     VAL  26   7.032  -0.312   2.300
  202    H    CYS  27           HN       CYS  27   7.451  -3.718  -0.879
  203    HA   CYS  27           HA       CYS  27   6.561  -6.501  -0.786
  204   1HB   CYS  27           HBS      CYS  27   7.388  -5.358  -2.852
  205   2HB   CYS  27           HBR      CYS  27   9.012  -5.311  -2.113
  206    H    ALA  28           HN       ALA  28   7.333  -8.058   0.420
  207    HA   ALA  28           HA       ALA  28   9.510  -7.522   2.274
  208   1HB   ALA  28           HMBC     ALA  28   7.234  -8.807   2.589
  209   2HB   ALA  28           HMBB     ALA  28   8.190 -10.192   2.002
  210   3HB   ALA  28           HMBA     ALA  28   8.708  -9.304   3.457
  211    H    LYS  29           HN       LYS  29  10.088  -7.741  -0.633
  212    HA   LYS  29           HA       LYS  29  11.913 -10.093  -0.650
  213   1HB   LYS  29           HBS      LYS  29   9.387  -9.939  -1.908
  214   2HB   LYS  29           HBR      LYS  29  10.606  -9.728  -3.196
  215   1HG   LYS  29           HGR      LYS  29  10.987 -11.948  -1.210
  216   2HG   LYS  29           HGS      LYS  29   9.740 -12.135  -2.477
  217   1HD   LYS  29           HDS      LYS  29  11.329 -12.885  -3.796
  218   2HD   LYS  29           HDR      LYS  29  11.838 -11.223  -3.922
  219   1HE   LYS  29           HES      LYS  29  13.213 -11.757  -1.754
  220   2HE   LYS  29           HER      LYS  29  13.019 -13.437  -2.332
  221   1HZ   LYS  29           HZA      LYS  29  13.873 -12.570  -4.493
  222   2HZ   LYS  29           HZB      LYS  29  14.304 -11.197  -3.718
  223   3HZ   LYS  29           HZC      LYS  29  14.964 -12.625  -3.280
  224    H    CYS  30           HN       CYS  30  10.895  -7.006  -2.071
  225    HA   CYS  30           HA       CYS  30  13.755  -6.613  -2.756
  226   1HB   CYS  30           HBS      CYS  30  13.197  -5.258  -4.674
  227   2HB   CYS  30           HBR      CYS  30  12.617  -6.937  -4.842
  228    H    GLY  31           HN       GLY  31  11.197  -5.699  -0.872
  229   1HA   GLY  31           HAR      GLY  31  11.033  -3.983   0.642
  230   2HA   GLY  31           HAS      GLY  31  12.448  -3.220  -0.135
  231    H    TYR  32           HN       TYR  32  10.287  -3.807  -2.570
  232    HA   TYR  32           HA       TYR  32  10.022  -0.917  -2.988
  233   1HB   TYR  32           HBS      TYR  32  10.477  -2.335  -4.915
  234   2HB   TYR  32           HBR      TYR  32   9.013  -3.305  -4.586
  235    HD1  TYR  32           HD2      TYR  32   9.879   0.320  -5.029
  236    HD2  TYR  32           HD1      TYR  32   7.269  -2.875  -6.065
  237    HE1  TYR  32           HE2      TYR  32   8.681   1.808  -6.570
  238    HE2  TYR  32           HE1      TYR  32   6.044  -1.388  -7.590
  239    HH   TYR  32           HH       TYR  32   7.038   0.779  -9.050
  240    H    VAL  33           HN       VAL  33   8.274   0.277  -2.666
  241    HA   VAL  33           HA       VAL  33   6.041  -0.611  -1.144
  242    HB   VAL  33           HB       VAL  33   6.324   1.805  -2.947
  243   1HG1  VAL  33           HMGR     VAL  33   4.276   1.221  -0.796
  244   2HG1  VAL  33           HMGR     VAL  33   4.508   2.792  -1.599
  245   3HG1  VAL  33           HMGR     VAL  33   3.983   1.378  -2.544
  246   1HG2  VAL  33           HMGS     VAL  33   8.000   1.647  -1.121
  247   2HG2  VAL  33           HMGS     VAL  33   6.912   3.050  -0.987
  248   3HG2  VAL  33           HMGS     VAL  33   6.663   1.627   0.053
  249    H    ILE  34           HN       ILE  34   3.810  -0.644  -1.830
  250    HA   ILE  34           HA       ILE  34   3.435  -1.520  -4.651
  251    HB   ILE  34           HB       ILE  34   2.104  -2.335  -2.031
  252   1HG1  ILE  34           HG1R     ILE  34   4.311  -3.308  -2.726
  253   2HG1  ILE  34           HG1S     ILE  34   3.004  -4.493  -2.437
  254   1HG2  ILE  34           HMG2     ILE  34   0.862  -2.276  -4.619
  255   2HG2  ILE  34           HMG2     ILE  34   1.074  -3.965  -4.086
  256   3HG2  ILE  34           HMG2     ILE  34   0.205  -2.805  -3.047
  257   1HD1  ILE  34           HMD1     ILE  34   2.672  -4.316  -5.033
  258   2HD1  ILE  34           HMD1     ILE  34   4.344  -3.697  -5.001
  259   3HD1  ILE  34           HMD1     ILE  34   3.982  -5.320  -4.358
  260    H    GLU  35           HN       GLU  35   1.239  -0.461  -2.052
  261    HA   GLU  35           HA       GLU  35   0.342   1.792  -3.797
  262   1HB   GLU  35           HBS      GLU  35  -1.216   0.061  -3.931
  263   2HB   GLU  35           HBR      GLU  35  -1.208  -0.300  -2.291
  264   1HG   GLU  35           HGS      GLU  35  -1.911   2.450  -2.506
  265   2HG   GLU  35           HGR      GLU  35  -2.846   1.651  -3.799
  266    H    GLU  36           HN       GLU  36  -0.399   3.618  -2.679
  267    HA   GLU  36           HA       GLU  36   1.017   3.906  -0.076
  268   1HB   GLU  36           HBR      GLU  36   0.286   6.168  -1.877
  269   2HB   GLU  36           HBS      GLU  36   1.534   6.009  -0.766
  270   1HG   GLU  36           HGS      GLU  36   2.941   4.769  -2.064
  271   2HG   GLU  36           HGR      GLU  36   1.665   4.169  -3.158
  272    H    ASN  37           HN       ASN  37   0.211   5.643   1.333
  273    HA   ASN  37           HA       ASN  37  -1.322   6.862   2.452
  274   1HB   ASN  37           HBS      ASN  37  -1.551   7.944   0.276
  275   2HB   ASN  37           HBR      ASN  37  -2.874   6.815  -0.136
  276   1HD2  ASN  37           HD2Z     ASN  37  -5.035   9.351   0.965
  277   2HD2  ASN  37           HD2E     ASN  37  -4.412   8.453  -0.379
  278    H    ILE  38           HN       ILE  38  -2.444   6.171   4.062
  279    HA   ILE  38           HA       ILE  38  -4.161   3.841   4.021
  280    HB   ILE  38           HB       ILE  38  -3.016   4.652   6.079
  281   1HG1  ILE  38           HG1R     ILE  38  -5.950   4.903   6.666
  282   2HG1  ILE  38           HG1S     ILE  38  -5.363   3.426   5.850
  283   1HG2  ILE  38           HMG2     ILE  38  -4.116   7.168   5.364
  284   2HG2  ILE  38           HMG2     ILE  38  -4.811   6.691   6.935
  285   3HG2  ILE  38           HMG2     ILE  38  -3.042   6.761   6.728
  286   1HD1  ILE  38           HMD1     ILE  38  -3.823   4.249   8.237
  287   2HD1  ILE  38           HMD1     ILE  38  -5.505   3.743   8.542
  288   3HD1  ILE  38           HMD1     ILE  38  -4.378   2.635   7.716
  289    H    ILE  39           HN       ILE  39  -6.023   3.721   3.052
  290    HA   ILE  39           HA       ILE  39  -7.786   4.290   1.735
  291    HB   ILE  39           HB       ILE  39  -8.491   4.851   4.165
  292   1HG1  ILE  39           HG1R     ILE  39 -10.681   5.561   3.416
  293   2HG1  ILE  39           HG1S     ILE  39 -10.008   6.153   1.872
  294   1HG2  ILE  39           HMG2     ILE  39  -7.653   7.514   3.291
  295   2HG2  ILE  39           HMG2     ILE  39  -9.318   7.456   3.925
  296   3HG2  ILE  39           HMG2     ILE  39  -7.963   6.868   4.924
  297   1HD1  ILE  39           HMD1     ILE  39  -9.296   3.384   2.259
  298   2HD1  ILE  39           HMD1     ILE  39 -11.057   3.599   2.446
  299   3HD1  ILE  39           HMD1     ILE  39 -10.246   4.140   0.952
  300    H    ASP  40           HN       ASP  40  -8.888   6.015   0.471
  301    HA   ASP  40           HA       ASP  40  -6.869   7.949  -0.515
  302   1HB   ASP  40           HBR      ASP  40  -6.894   5.814  -1.795
  303   2HB   ASP  40           HBS      ASP  40  -8.561   6.208  -2.300
  304    H    MET  41           HN       MET  41  -7.521   9.914  -0.859
  305    HA   MET  41           HA       MET  41  -9.883  10.587  -2.160
  306   1HB   MET  41           HBR      MET  41 -10.670   9.931   0.316
  307   2HB   MET  41           HBS      MET  41 -10.220  11.629   0.612
  308   1HG   MET  41           HGS      MET  41 -12.493  11.789  -0.018
  309   2HG   MET  41           HGR      MET  41 -11.605  12.169  -1.511
  310   1HE   MET  41           HMEB     MET  41 -13.995  11.846  -2.114
  311   2HE   MET  41           HMEA     MET  41 -14.276  10.493  -3.239
  312   3HE   MET  41           HMEC     MET  41 -14.957  10.440  -1.593
  313    H    GLY  42           HN       GLY  42  -8.531  12.250   0.688
  314   1HA   GLY  42           HAR      GLY  42  -6.381  13.580   0.233
  315   2HA   GLY  42           HAS      GLY  42  -7.301  14.274  -1.131
  316    HA   PRO  43           HA       PRO  43  -9.663  15.420   2.906
  317   1HB   PRO  43           HBR      PRO  43  -8.002  15.062   5.106
  318   2HB   PRO  43           HBS      PRO  43  -9.484  14.406   4.845
  319   1HG   PRO  43           HGS      PRO  43  -7.190  13.066   4.811
  320   2HG   PRO  43           HGR      PRO  43  -8.638  12.498   4.208
  321   1HD   PRO  43           HDS      PRO  43  -6.401  13.432   2.791
  322   2HD   PRO  43           HDR      PRO  43  -7.655  12.506   2.238
  323    H    GLU  44           HN       GLU  44  -9.905  17.448   2.496
  324    HA   GLU  44           HA       GLU  44  -9.672  19.704   2.820
  325   1HB   GLU  44           HBR      GLU  44  -7.590  19.276   4.905
  326   2HB   GLU  44           HBS      GLU  44  -8.799  20.431   4.769
  327   1HG   GLU  44           HGS      GLU  44 -10.183  19.370   6.075
  328   2HG   GLU  44           HGR      GLU  44 -10.239  17.962   4.980
  329    H    TRP  45           HN       TRP  45  -6.378  18.639   3.737
  330    HA   TRP  45           HA       TRP  45  -5.202  19.689   1.336
  331   1HB   TRP  45           HBS      TRP  45  -3.815  21.417   2.633
  332   2HB   TRP  45           HBR      TRP  45  -5.460  21.839   2.072
  333    HD1  TRP  45           HD1      TRP  45  -7.394  21.932   4.039
  334    HE1  TRP  45           HE1      TRP  45  -7.218  22.504   6.538
  335    HE3  TRP  45           HE3      TRP  45  -2.379  21.290   4.599
  336    HZ2  TRP  45           HZ2      TRP  45  -5.200  22.610   8.482
  337    HZ3  TRP  45           HZ3      TRP  45  -1.391  21.634   6.815
  338    HH2  TRP  45           HH2      TRP  45  -2.763  22.280   8.724
  339    H    ARG  46           HN       ARG  46  -3.114  19.073   1.084
  340    HA   ARG  46           HA       ARG  46  -2.003  17.122   2.961
  341   1HB   ARG  46           HBR      ARG  46  -1.789  17.245   0.330
  342   2HB   ARG  46           HBS      ARG  46  -0.419  18.325   0.720
  343   1HG   ARG  46           HGS      ARG  46   0.589  16.238   0.512
  344   2HG   ARG  46           HGR      ARG  46   0.360  16.405   2.275
  345   1HD   ARG  46           HDS      ARG  46  -2.003  15.273   1.249
  346   2HD   ARG  46           HDR      ARG  46  -0.640  14.414   0.479
  347    HE   ARG  46           HE       ARG  46   0.021  13.604   2.580
  348   1HH1  ARG  46           HH1Z     ARG  46  -2.899  15.571   2.782
  349   2HH1  ARG  46           HH1E     ARG  46  -3.171  15.189   4.449
  350   1HH2  ARG  46           HH2Z     ARG  46  -0.297  13.232   4.794
  351   2HH2  ARG  46           HH2E     ARG  46  -1.700  13.863   5.588
  352    H    ALA  47           HN       ALA  47   0.151  17.367   3.833
  353    HA   ALA  47           HA       ALA  47   0.258  19.974   5.168
  354   1HB   ALA  47           HMBB     ALA  47   0.255  17.560   6.199
  355   2HB   ALA  47           HMBA     ALA  47   2.006  17.650   5.881
  356   3HB   ALA  47           HMBC     ALA  47   1.227  18.867   6.923
  357    H    PHE  48           HN       PHE  48   1.836  21.412   5.034
  358    HA   PHE  48           HA       PHE  48   4.536  20.702   4.536
  359   1HB   PHE  48           HBR      PHE  48   3.192  21.141   2.108
  360   2HB   PHE  48           HBS      PHE  48   4.023  22.685   2.453
  361    HD1  PHE  48           HD1      PHE  48   6.401  22.707   2.913
  362    HD2  PHE  48           HD2      PHE  48   4.504  19.238   1.323
  363    HE1  PHE  48           HE1      PHE  48   8.597  21.833   2.258
  364    HE2  PHE  48           HE2      PHE  48   6.706  18.336   0.650
  365    HZ   PHE  48           HZ       PHE  48   8.758  19.620   1.181
  366    H    ASP  49           HN       ASP  49   2.903  23.670   3.460
  367    HA   ASP  49           HA       ASP  49   2.763  24.924   5.923
  368   1HB   ASP  49           HBS      ASP  49   5.445  24.905   5.008
  369   2HB   ASP  49           HBR      ASP  49   4.832  26.581   4.914
  370    H    ALA  50           HN       ALA  50   1.725  26.851   5.835
  371    HA   ALA  50           HA       ALA  50   0.504  28.583   4.969
  372   1HB   ALA  50           HMBA     ALA  50   2.701  28.424   2.887
  373   2HB   ALA  50           HMBC     ALA  50   1.571  29.786   3.103
  374   3HB   ALA  50           HMBB     ALA  50   2.720  29.367   4.399
   
  No H/Q in entry =         374
  Start of MODEL   16
    1   1H    MET   1           HN       MET   1  -5.701 -12.966  -9.633
    2   2H    MET   1           HNB      MET   1  -4.172 -12.393  -9.563
    3   3H    MET   1           HNC      MET   1  -4.496 -13.757 -10.401
    4    HA   MET   1           HA       MET   1  -4.469 -15.076  -8.677
    5   1HB   MET   1           HBR      MET   1  -2.743 -12.787  -8.303
    6   2HB   MET   1           HBS      MET   1  -3.252 -13.440  -6.725
    7   1HG   MET   1           HGS      MET   1  -2.250 -15.262  -8.952
    8   2HG   MET   1           HGR      MET   1  -1.122 -14.423  -7.864
    9   1HE   MET   1           HMEC     MET   1  -0.432 -15.313  -5.687
   10   2HE   MET   1           HMEB     MET   1  -0.829 -16.982  -5.208
   11   3HE   MET   1           HMEA     MET   1  -0.161 -16.656  -6.827
   12    H    VAL   2           HN       VAL   2  -5.856 -15.822  -7.243
   13    HA   VAL   2           HA       VAL   2  -7.607 -13.858  -5.861
   14    HB   VAL   2           HB       VAL   2  -9.363 -15.614  -6.075
   15   1HG1  VAL   2           HMGS     VAL   2  -8.861 -13.604  -7.675
   16   2HG1  VAL   2           HMGS     VAL   2  -8.483 -14.892  -8.842
   17   3HG1  VAL   2           HMGS     VAL   2 -10.096 -14.814  -8.094
   18   1HG2  VAL   2           HMGR     VAL   2  -7.200 -17.180  -7.125
   19   2HG2  VAL   2           HMGR     VAL   2  -8.873 -17.661  -6.758
   20   3HG2  VAL   2           HMGR     VAL   2  -8.467 -17.007  -8.363
   21    H    ASN   3           HN       ASN   3  -8.269 -14.226  -3.799
   22    HA   ASN   3           HA       ASN   3  -8.245 -14.997  -1.676
   23   1HB   ASN   3           HBR      ASN   3  -8.055 -17.539  -3.251
   24   2HB   ASN   3           HBS      ASN   3  -8.055 -17.547  -1.464
   25   1HD2  ASN   3           HD2Z     ASN   3 -11.446 -16.544  -1.117
   26   2HD2  ASN   3           HD2E     ASN   3  -9.890 -16.560  -0.354
   27    H    LYS   4           HN       LYS   4  -5.733 -14.142  -3.006
   28    HA   LYS   4           HA       LYS   4  -3.975 -15.136  -0.819
   29   1HB   LYS   4           HBS      LYS   4  -3.442 -15.434  -3.569
   30   2HB   LYS   4           HBR      LYS   4  -2.456 -14.046  -3.028
   31   1HG   LYS   4           HGR      LYS   4  -1.069 -15.940  -2.746
   32   2HG   LYS   4           HGS      LYS   4  -1.672 -15.557  -1.108
   33   1HD   LYS   4           HDS      LYS   4  -3.474 -17.269  -1.482
   34   2HD   LYS   4           HDR      LYS   4  -2.658 -17.717  -2.954
   35   1HE   LYS   4           HES      LYS   4  -0.710 -18.443  -1.799
   36   2HE   LYS   4           HER      LYS   4  -1.315 -17.753  -0.266
   37   1HZ   LYS   4           HZC      LYS   4  -3.135 -19.337  -0.398
   38   2HZ   LYS   4           HZA      LYS   4  -2.497 -20.002  -1.747
   39   3HZ   LYS   4           HZB      LYS   4  -1.688 -20.091  -0.331
   40    H    GLN   5           HN       GLN   5  -1.934 -13.370  -1.110
   41    HA   GLN   5           HA       GLN   5  -3.190 -11.181   0.255
   42   1HB   GLN   5           HBS      GLN   5  -1.149 -12.197   1.102
   43   2HB   GLN   5           HBR      GLN   5  -0.259 -11.653  -0.347
   44   1HG   GLN   5           HGS      GLN   5  -1.109  -9.284   0.381
   45   2HG   GLN   5           HGR      GLN   5  -1.307 -10.066   1.975
   46   1HE2  GLN   5           HE2Z     GLN   5   2.346 -10.973   1.827
   47   2HE2  GLN   5           HE2E     GLN   5   0.870 -11.875   1.761
   48    H    LYS   6           HN       LYS   6  -0.434 -10.700  -1.906
   49    HA   LYS   6           HA       LYS   6  -1.717  -8.989  -3.826
   50   1HB   LYS   6           HBS      LYS   6  -1.506  -7.874  -1.255
   51   2HB   LYS   6           HBR      LYS   6  -0.137  -7.198  -2.183
   52   1HG   LYS   6           HGR      LYS   6  -3.083  -7.083  -2.942
   53   2HG   LYS   6           HGS      LYS   6  -2.076  -5.729  -2.353
   54   1HD   LYS   6           HDS      LYS   6  -0.791  -5.664  -4.304
   55   2HD   LYS   6           HDR      LYS   6  -1.318  -7.244  -4.814
   56   1HE   LYS   6           HES      LYS   6  -2.321  -5.436  -6.143
   57   2HE   LYS   6           HER      LYS   6  -3.519  -6.467  -5.310
   58   1HZ   LYS   6           HZC      LYS   6  -3.601  -4.751  -3.587
   59   2HZ   LYS   6           HZA      LYS   6  -2.624  -3.794  -4.480
   60   3HZ   LYS   6           HZB      LYS   6  -4.103  -4.203  -5.041
   61    H    VAL   7           HN       VAL   7  -0.364  -8.769  -5.453
   62    HA   VAL   7           HA       VAL   7   2.195 -10.102  -5.098
   63    HB   VAL   7           HB       VAL   7   2.154 -10.440  -7.459
   64   1HG1  VAL   7           HMGR     VAL   7   0.015 -11.257  -5.740
   65   2HG1  VAL   7           HMGR     VAL   7  -0.608 -11.057  -7.396
   66   3HG1  VAL   7           HMGR     VAL   7   0.778 -12.130  -7.091
   67   1HG2  VAL   7           HMGS     VAL   7  -0.205  -8.546  -7.562
   68   2HG2  VAL   7           HMGS     VAL   7   1.416  -8.291  -8.253
   69   3HG2  VAL   7           HMGS     VAL   7   0.358  -9.563  -8.910
   70    H    CYS   8           HN       CYS   8   4.094  -9.431  -6.363
   71    HA   CYS   8           HA       CYS   8   4.402  -6.490  -6.454
   72   1HB   CYS   8           HBS      CYS   8   5.893  -7.927  -5.021
   73   2HB   CYS   8           HBR      CYS   8   6.523  -8.643  -6.532
   74    HA   PRO   9           HA       PRO   9   4.474  -6.695 -10.884
   75   1HB   PRO   9           HBR      PRO   9   4.705  -3.905 -10.702
   76   2HB   PRO   9           HBS      PRO   9   3.546  -4.783 -11.464
   77   1HG   PRO   9           HGS      PRO   9   3.173  -3.434  -9.224
   78   2HG   PRO   9           HGR      PRO   9   2.176  -4.659  -9.762
   79   1HD   PRO   9           HDS      PRO   9   4.021  -4.715  -7.650
   80   2HD   PRO   9           HDR      PRO   9   2.778  -5.763  -7.956
   81    H    ALA  10           HN       ALA  10   6.729  -5.776  -8.655
   82    HA   ALA  10           HA       ALA  10   8.773  -4.929 -10.607
   83   1HB   ALA  10           HMBB     ALA  10   8.339  -4.384  -7.930
   84   2HB   ALA  10           HMBC     ALA  10   9.677  -5.559  -7.905
   85   3HB   ALA  10           HMBA     ALA  10   9.825  -4.060  -8.858
   86    H    CYS  11           HN       CYS  11   8.805  -7.355  -7.970
   87    HA   CYS  11           HA       CYS  11  10.657  -8.903  -9.611
   88   1HB   CYS  11           HBS      CYS  11  11.202 -10.103  -7.598
   89   2HB   CYS  11           HBR      CYS  11  11.289  -8.337  -7.361
   90    H    GLU  12           HN       GLU  12   7.371  -8.940  -9.226
   91    HA   GLU  12           HA       GLU  12   5.667 -10.429  -9.357
   92   1HB   GLU  12           HBR      GLU  12   5.803 -11.914 -11.060
   93   2HB   GLU  12           HBS      GLU  12   6.952 -10.758 -11.447
   94   1HG   GLU  12           HGS      GLU  12   8.795 -12.041 -11.148
   95   2HG   GLU  12           HGR      GLU  12   8.031 -13.178 -10.005
   96    H    SER  13           HN       SER  13   6.971 -10.367  -6.965
   97    HA   SER  13           HA       SER  13   6.989 -13.147  -5.994
   98   1HB   SER  13           HBS      SER  13   7.223 -12.165  -3.773
   99   2HB   SER  13           HBR      SER  13   8.489 -11.587  -4.894
  100    HG   SER  13           HG       SER  13   6.259 -10.329  -3.629
  101    H    ALA  14           HN       ALA  14   5.588 -13.122  -3.749
  102    HA   ALA  14           HA       ALA  14   2.937 -11.910  -4.308
  103   1HB   ALA  14           HMBA     ALA  14   3.665 -14.686  -3.811
  104   2HB   ALA  14           HMBB     ALA  14   2.506 -14.079  -2.601
  105   3HB   ALA  14           HMBC     ALA  14   2.108 -13.995  -4.336
  106    H    GLU  15           HN       GLU  15   5.608 -12.022  -2.325
  107    HA   GLU  15           HA       GLU  15   4.151 -11.765   0.238
  108   1HB   GLU  15           HBR      GLU  15   7.119 -11.624  -0.122
  109   2HB   GLU  15           HBS      GLU  15   6.207 -12.077   1.211
  110   1HG   GLU  15           HGS      GLU  15   6.896 -14.142   0.603
  111   2HG   GLU  15           HGR      GLU  15   5.318 -14.113  -0.228
  112    H    LEU  16           HN       LEU  16   3.346  -9.803   0.531
  113    HA   LEU  16           HA       LEU  16   5.311  -7.566   0.576
  114   1HB   LEU  16           HBR      LEU  16   2.354  -7.254   0.038
  115   2HB   LEU  16           HBS      LEU  16   3.670  -6.065  -0.187
  116    HG   LEU  16           HG       LEU  16   3.189  -8.549  -1.855
  117   1HD1  LEU  16           HMDR     LEU  16   2.365  -5.710  -2.057
  118   2HD1  LEU  16           HMDR     LEU  16   3.065  -6.418  -3.534
  119   3HD1  LEU  16           HMDR     LEU  16   1.643  -7.173  -2.771
  120   1HD2  LEU  16           HMDS     LEU  16   5.584  -7.621  -1.379
  121   2HD2  LEU  16           HMDS     LEU  16   5.098  -7.985  -3.054
  122   3HD2  LEU  16           HMDS     LEU  16   5.093  -6.301  -2.470
  123    H    ILE  17           HN       ILE  17   4.097  -5.718   1.956
  124    HA   ILE  17           HA       ILE  17   2.998  -6.770   4.457
  125    HB   ILE  17           HB       ILE  17   5.098  -5.819   5.686
  126   1HG1  ILE  17           HG1R     ILE  17   6.198  -6.262   2.890
  127   2HG1  ILE  17           HG1S     ILE  17   6.191  -4.754   3.846
  128   1HG2  ILE  17           HMG2     ILE  17   4.344  -8.356   5.077
  129   2HG2  ILE  17           HMG2     ILE  17   5.990  -8.309   4.393
  130   3HG2  ILE  17           HMG2     ILE  17   5.728  -7.923   6.114
  131   1HD1  ILE  17           HMD1     ILE  17   7.663  -6.077   5.518
  132   2HD1  ILE  17           HMD1     ILE  17   7.922  -7.198   4.154
  133   3HD1  ILE  17           HMD1     ILE  17   8.394  -5.484   4.002
  134    H    TYR  18           HN       TYR  18   2.277  -5.186   5.828
  135    HA   TYR  18           HA       TYR  18   1.936  -2.576   4.460
  136   1HB   TYR  18           HBR      TYR  18  -0.007  -4.233   4.983
  137   2HB   TYR  18           HBS      TYR  18   0.153  -3.630   6.657
  138    HD1  TYR  18           HD2      TYR  18  -0.002  -1.082   6.988
  139    HD2  TYR  18           HD1      TYR  18  -1.301  -3.004   3.425
  140    HE1  TYR  18           HE2      TYR  18  -1.416   0.855   6.470
  141    HE2  TYR  18           HE1      TYR  18  -2.700  -1.060   2.878
  142    HH   TYR  18           HH       TYR  18  -3.986   0.668   4.542
  143    H    ASP  19           HN       ASP  19   2.761  -0.825   5.293
  144    HA   ASP  19           HA       ASP  19   3.743  -0.919   8.093
  145   1HB   ASP  19           HBS      ASP  19   5.209  -0.371   5.808
  146   2HB   ASP  19           HBR      ASP  19   4.852   1.235   6.503
  147    HA   PRO  20           HA       PRO  20   0.050   1.592   8.104
  148   1HB   PRO  20           HBR      PRO  20  -0.388   1.191  10.746
  149   2HB   PRO  20           HBS      PRO  20  -1.128   0.394   9.516
  150   1HG   PRO  20           HGS      PRO  20   0.890  -0.522  11.205
  151   2HG   PRO  20           HGR      PRO  20  -0.164  -1.414  10.269
  152   1HD   PRO  20           HDS      PRO  20   2.416  -1.053   9.703
  153   2HD   PRO  20           HDR      PRO  20   1.272  -1.527   8.606
  154    H    GLU  21           HN       GLU  21   2.948   2.018   9.613
  155    HA   GLU  21           HA       GLU  21   2.332   4.391  11.194
  156   1HB   GLU  21           HBR      GLU  21   4.837   3.097  10.109
  157   2HB   GLU  21           HBS      GLU  21   4.848   4.598  10.861
  158   1HG   GLU  21           HGS      GLU  21   4.782   3.839  12.911
  159   2HG   GLU  21           HGR      GLU  21   3.374   2.785  12.606
  160    H    ARG  22           HN       ARG  22   4.088   3.779   8.119
  161    HA   ARG  22           HA       ARG  22   3.844   6.508   7.249
  162   1HB   ARG  22           HBR      ARG  22   4.893   3.958   6.122
  163   2HB   ARG  22           HBS      ARG  22   4.395   5.223   4.961
  164   1HG   ARG  22           HGS      ARG  22   6.108   6.140   7.199
  165   2HG   ARG  22           HGR      ARG  22   6.880   5.019   6.042
  166   1HD   ARG  22           HDS      ARG  22   7.284   7.206   5.265
  167   2HD   ARG  22           HDR      ARG  22   6.036   6.492   4.205
  168    HE   ARG  22           HE       ARG  22   4.543   8.093   4.940
  169   1HH1  ARG  22           HH1Z     ARG  22   7.464   8.229   6.907
  170   2HH1  ARG  22           HH1E     ARG  22   6.901   9.572   7.845
  171   1HH2  ARG  22           HH2Z     ARG  22   3.787   9.765   6.271
  172   2HH2  ARG  22           HH2E     ARG  22   4.821  10.443   7.485
  173    H    GLY  23           HN       GLY  23   1.920   3.607   6.910
  174   1HA   GLY  23           HAR      GLY  23  -0.264   3.386   6.029
  175   2HA   GLY  23           HAS      GLY  23  -0.137   5.017   5.321
  176    H    GLU  24           HN       GLU  24   2.199   2.335   5.122
  177    HA   GLU  24           HA       GLU  24   2.035   2.548   2.151
  178   1HB   GLU  24           HBR      GLU  24   4.046   3.116   3.929
  179   2HB   GLU  24           HBS      GLU  24   4.349   1.496   3.619
  180   1HG   GLU  24           HGR      GLU  24   5.675   2.310   1.889
  181   2HG   GLU  24           HGS      GLU  24   4.091   2.114   1.090
  182    H    ILE  25           HN       ILE  25   2.514   0.658   0.928
  183    HA   ILE  25           HA       ILE  25   2.697  -1.890   2.437
  184    HB   ILE  25           HB       ILE  25   1.214  -1.653  -0.220
  185   1HG1  ILE  25           HG1R     ILE  25  -0.810  -2.138   1.479
  186   2HG1  ILE  25           HG1S     ILE  25   0.253  -1.214   2.578
  187   1HG2  ILE  25           HMG2     ILE  25   2.152  -3.865   1.275
  188   2HG2  ILE  25           HMG2     ILE  25   0.373  -3.852   1.399
  189   3HG2  ILE  25           HMG2     ILE  25   1.155  -3.859  -0.204
  190   1HD1  ILE  25           HMD1     ILE  25   0.011   0.081  -0.013
  191   2HD1  ILE  25           HMD1     ILE  25  -1.581  -0.184   0.746
  192   3HD1  ILE  25           HMD1     ILE  25  -0.315   0.716   1.623
  193    H    VAL  26           HN       VAL  26   4.382  -3.070   1.906
  194    HA   VAL  26           HA       VAL  26   5.986  -2.222  -0.451
  195    HB   VAL  26           HB       VAL  26   7.116  -2.963   2.243
  196   1HG1  VAL  26           HMGR     VAL  26   8.235  -1.461  -0.133
  197   2HG1  VAL  26           HMGR     VAL  26   9.036  -1.578   1.453
  198   3HG1  VAL  26           HMGR     VAL  26   8.739  -3.049   0.495
  199   1HG2  VAL  26           HMGS     VAL  26   5.586  -1.077   2.583
  200   2HG2  VAL  26           HMGS     VAL  26   7.288  -0.612   2.817
  201   3HG2  VAL  26           HMGS     VAL  26   6.440  -0.160   1.319
  202    H    CYS  27           HN       CYS  27   7.819  -3.762  -0.883
  203    HA   CYS  27           HA       CYS  27   6.846  -6.516  -0.728
  204   1HB   CYS  27           HBS      CYS  27   7.494  -5.403  -2.854
  205   2HB   CYS  27           HBR      CYS  27   9.177  -5.337  -2.270
  206    H    ALA  28           HN       ALA  28   7.499  -7.899   0.705
  207    HA   ALA  28           HA       ALA  28   9.763  -7.491   2.391
  208   1HB   ALA  28           HMBC     ALA  28   7.527  -8.876   2.650
  209   2HB   ALA  28           HMBB     ALA  28   8.559 -10.200   2.050
  210   3HB   ALA  28           HMBA     ALA  28   9.020  -9.310   3.524
  211    H    LYS  29           HN       LYS  29   9.737  -8.345  -0.801
  212    HA   LYS  29           HA       LYS  29  12.198 -10.003  -0.579
  213   1HB   LYS  29           HBR      LYS  29  10.037 -10.161  -2.352
  214   2HB   LYS  29           HBS      LYS  29  11.338  -9.367  -3.282
  215   1HG   LYS  29           HGR      LYS  29  12.867 -11.234  -2.683
  216   2HG   LYS  29           HGS      LYS  29  11.517 -12.037  -1.831
  217   1HD   LYS  29           HDS      LYS  29  10.377 -11.611  -4.239
  218   2HD   LYS  29           HDR      LYS  29  12.046 -11.733  -4.722
  219   1HE   LYS  29           HES      LYS  29  11.115 -13.820  -2.849
  220   2HE   LYS  29           HER      LYS  29  10.425 -13.835  -4.497
  221   1HZ   LYS  29           HZB      LYS  29  13.307 -13.725  -3.945
  222   2HZ   LYS  29           HZC      LYS  29  12.494 -15.114  -4.225
  223   3HZ   LYS  29           HZA      LYS  29  12.583 -13.971  -5.388
  224    H    CYS  30           HN       CYS  30  11.135  -7.600  -2.985
  225    HA   CYS  30           HA       CYS  30  13.880  -6.893  -3.267
  226   1HB   CYS  30           HBS      CYS  30  13.205  -5.607  -5.193
  227   2HB   CYS  30           HBR      CYS  30  12.457  -7.225  -5.179
  228    H    GLY  31           HN       GLY  31  11.639  -5.672  -1.162
  229   1HA   GLY  31           HAR      GLY  31  11.883  -3.899   0.284
  230   2HA   GLY  31           HAS      GLY  31  13.147  -3.231  -0.785
  231    H    TYR  32           HN       TYR  32  10.550  -3.857  -2.738
  232    HA   TYR  32           HA       TYR  32  10.439  -0.970  -3.263
  233   1HB   TYR  32           HBS      TYR  32  10.633  -2.467  -5.165
  234   2HB   TYR  32           HBR      TYR  32   9.148  -3.336  -4.681
  235    HD1  TYR  32           HD1      TYR  32   9.887   0.347  -4.947
  236    HD2  TYR  32           HD2      TYR  32   7.591  -2.946  -6.352
  237    HE1  TYR  32           HE1      TYR  32   8.589   1.868  -6.375
  238    HE2  TYR  32           HE2      TYR  32   6.302  -1.441  -7.799
  239    HH   TYR  32           HH       TYR  32   5.645   0.967  -7.733
  240    H    VAL  33           HN       VAL  33   8.742   0.335  -2.956
  241    HA   VAL  33           HA       VAL  33   6.536  -0.397  -1.233
  242    HB   VAL  33           HB       VAL  33   6.952   1.984  -3.056
  243   1HG1  VAL  33           HMGR     VAL  33   4.783   1.374  -1.056
  244   2HG1  VAL  33           HMGR     VAL  33   5.223   3.044  -1.491
  245   3HG1  VAL  33           HMGR     VAL  33   4.640   1.921  -2.744
  246   1HG2  VAL  33           HMGS     VAL  33   8.460   1.457  -0.933
  247   2HG2  VAL  33           HMGS     VAL  33   7.946   3.108  -1.355
  248   3HG2  VAL  33           HMGS     VAL  33   7.081   2.202  -0.090
  249    H    ILE  34           HN       ILE  34   4.302  -0.357  -1.901
  250    HA   ILE  34           HA       ILE  34   3.859  -1.181  -4.724
  251    HB   ILE  34           HB       ILE  34   2.343  -1.751  -2.135
  252   1HG1  ILE  34           HG1R     ILE  34   4.485  -2.968  -2.626
  253   2HG1  ILE  34           HG1S     ILE  34   3.052  -4.005  -2.378
  254   1HG2  ILE  34           HMG2     ILE  34   1.507  -2.204  -4.978
  255   2HG2  ILE  34           HMG2     ILE  34   1.010  -3.346  -3.701
  256   3HG2  ILE  34           HMG2     ILE  34   0.563  -1.623  -3.582
  257   1HD1  ILE  34           HMD1     ILE  34   4.104  -3.233  -5.110
  258   2HD1  ILE  34           HMD1     ILE  34   4.604  -4.706  -4.236
  259   3HD1  ILE  34           HMD1     ILE  34   2.898  -4.485  -4.707
  260    H    GLU  35           HN       GLU  35   1.694   0.126  -2.224
  261    HA   GLU  35           HA       GLU  35   1.623   2.732  -3.609
  262   1HB   GLU  35           HBS      GLU  35  -0.143   1.568  -4.578
  263   2HB   GLU  35           HBR      GLU  35  -0.692   0.871  -3.155
  264   1HG   GLU  35           HGS      GLU  35  -2.228   2.619  -3.755
  265   2HG   GLU  35           HGR      GLU  35  -1.336   3.297  -2.367
  266    H    GLU  36           HN       GLU  36   0.390   4.318  -2.222
  267    HA   GLU  36           HA       GLU  36   0.663   3.838   0.684
  268   1HB   GLU  36           HBR      GLU  36   2.473   5.267   0.932
  269   2HB   GLU  36           HBS      GLU  36   2.853   4.184  -0.291
  270   1HG   GLU  36           HGS      GLU  36   1.615   6.580  -1.379
  271   2HG   GLU  36           HGR      GLU  36   3.171   6.944  -0.585
  272    H    ASN  37           HN       ASN  37   0.748   6.398   1.539
  273    HA   ASN  37           HA       ASN  37  -0.641   8.091   2.109
  274   1HB   ASN  37           HBS      ASN  37   0.113   8.537  -0.373
  275   2HB   ASN  37           HBR      ASN  37  -1.638   8.360  -0.680
  276   1HD2  ASN  37           HD2Z     ASN  37  -2.291  11.642   0.210
  277   2HD2  ASN  37           HD2E     ASN  37  -2.645  10.254  -0.764
  278    H    ILE  38           HN       ILE  38  -1.691   5.925   2.973
  279    HA   ILE  38           HA       ILE  38  -4.549   5.890   2.196
  280    HB   ILE  38           HB       ILE  38  -4.656   4.119   4.050
  281   1HG1  ILE  38           HG1R     ILE  38  -1.849   3.399   3.904
  282   2HG1  ILE  38           HG1S     ILE  38  -2.035   5.066   4.518
  283   1HG2  ILE  38           HMG2     ILE  38  -2.960   3.619   1.600
  284   2HG2  ILE  38           HMG2     ILE  38  -3.581   2.331   2.666
  285   3HG2  ILE  38           HMG2     ILE  38  -4.719   3.388   1.788
  286   1HD1  ILE  38           HMD1     ILE  38  -3.798   2.973   5.695
  287   2HD1  ILE  38           HMD1     ILE  38  -2.064   2.921   6.112
  288   3HD1  ILE  38           HMD1     ILE  38  -3.020   4.389   6.452
  289    H    ILE  39           HN       ILE  39  -6.163   6.231   3.809
  290    HA   ILE  39           HA       ILE  39  -7.211   7.565   5.349
  291    HB   ILE  39           HB       ILE  39  -4.480   7.977   6.653
  292   1HG1  ILE  39           HG1R     ILE  39  -4.746   5.618   6.401
  293   2HG1  ILE  39           HG1S     ILE  39  -5.084   6.027   8.107
  294   1HG2  ILE  39           HMG2     ILE  39  -7.268   8.594   7.418
  295   2HG2  ILE  39           HMG2     ILE  39  -6.238   7.892   8.695
  296   3HG2  ILE  39           HMG2     ILE  39  -5.737   9.391   7.867
  297   1HD1  ILE  39           HMD1     ILE  39  -7.484   6.007   6.422
  298   2HD1  ILE  39           HMD1     ILE  39  -6.640   4.436   6.481
  299   3HD1  ILE  39           HMD1     ILE  39  -7.168   5.222   7.993
  300    H    ASP  40           HN       ASP  40  -7.937   9.288   4.359
  301    HA   ASP  40           HA       ASP  40  -6.568  11.794   4.660
  302   1HB   ASP  40           HBR      ASP  40  -5.553  10.521   2.585
  303   2HB   ASP  40           HBS      ASP  40  -6.995  11.204   1.780
  304    H    MET  41           HN       MET  41  -7.847  13.572   4.210
  305    HA   MET  41           HA       MET  41 -10.737  12.893   3.974
  306   1HB   MET  41           HBR      MET  41  -9.584  14.916   5.906
  307   2HB   MET  41           HBS      MET  41 -11.239  14.245   5.840
  308   1HG   MET  41           HGS      MET  41 -10.217  11.961   6.317
  309   2HG   MET  41           HGR      MET  41  -8.677  12.805   6.612
  310   1HE   MET  41           HMEB     MET  41  -8.648  14.943   7.773
  311   2HE   MET  41           HMEC     MET  41 -10.052  15.703   8.564
  312   3HE   MET  41           HMEA     MET  41  -8.882  14.771   9.531
  313    H    GLY  42           HN       GLY  42 -11.846  14.033   2.592
  314   1HA   GLY  42           HAR      GLY  42 -12.604  15.783   1.286
  315   2HA   GLY  42           HAS      GLY  42 -11.699  16.865   2.382
  316    HA   PRO  43           HA       PRO  43  -8.511  15.605  -1.025
  317   1HB   PRO  43           HBS      PRO  43  -9.552  13.756  -2.754
  318   2HB   PRO  43           HBR      PRO  43  -8.266  13.547  -1.755
  319   1HG   PRO  43           HGS      PRO  43 -10.683  12.368  -1.551
  320   2HG   PRO  43           HGR      PRO  43  -9.455  12.280  -0.427
  321   1HD   PRO  43           HDS      PRO  43 -11.805  13.802  -0.321
  322   2HD   PRO  43           HDR      PRO  43 -10.775  13.416   0.914
  323    H    GLU  44           HN       GLU  44  -9.265  17.753  -1.284
  324    HA   GLU  44           HA       GLU  44  -9.481  18.230  -4.042
  325   1HB   GLU  44           HBS      GLU  44 -11.663  19.467  -3.886
  326   2HB   GLU  44           HBR      GLU  44 -11.705  17.817  -4.195
  327   1HG   GLU  44           HGS      GLU  44 -11.903  17.680  -1.526
  328   2HG   GLU  44           HGR      GLU  44 -12.493  19.358  -1.675
  329    H    TRP  45           HN       TRP  45  -8.716  20.206  -4.447
  330    HA   TRP  45           HA       TRP  45  -7.556  22.118  -4.041
  331   1HB   TRP  45           HBR      TRP  45  -9.473  22.488  -1.731
  332   2HB   TRP  45           HBS      TRP  45  -8.340  23.707  -2.379
  333    HD1  TRP  45           HD1      TRP  45 -11.838  23.237  -2.433
  334    HE1  TRP  45           HE1      TRP  45 -12.964  24.080  -4.582
  335    HE3  TRP  45           HE3      TRP  45  -7.711  23.452  -5.400
  336    HZ2  TRP  45           HZ2      TRP  45 -12.177  24.719  -7.198
  337    HZ3  TRP  45           HZ3      TRP  45  -7.973  24.193  -7.721
  338    HH2  TRP  45           HH2      TRP  45 -10.153  24.824  -8.610
  339    H    ARG  46           HN       ARG  46  -5.713  20.934  -3.656
  340    HA   ARG  46           HA       ARG  46  -5.225  20.044  -0.873
  341   1HB   ARG  46           HBR      ARG  46  -5.228  18.319  -2.608
  342   2HB   ARG  46           HBS      ARG  46  -3.942  19.192  -3.490
  343   1HG   ARG  46           HGS      ARG  46  -2.309  18.413  -2.143
  344   2HG   ARG  46           HGR      ARG  46  -3.315  18.542  -0.672
  345   1HD   ARG  46           HDS      ARG  46  -4.486  16.519  -1.257
  346   2HD   ARG  46           HDR      ARG  46  -3.576  16.407  -2.790
  347    HE   ARG  46           HE       ARG  46  -2.452  16.008  -0.070
  348   1HH1  ARG  46           HH1Z     ARG  46  -2.006  15.965  -3.566
  349   2HH1  ARG  46           HH1E     ARG  46  -0.679  14.854  -3.493
  350   1HH2  ARG  46           HH2Z     ARG  46  -0.800  14.456  -0.023
  351   2HH2  ARG  46           HH2E     ARG  46   0.004  14.000  -1.489
  352    H    ALA  47           HN       ALA  47  -2.926  20.710  -3.502
  353    HA   ALA  47           HA       ALA  47  -1.501  22.803  -2.036
  354   1HB   ALA  47           HMBA     ALA  47  -1.201  20.379  -0.977
  355   2HB   ALA  47           HMBC     ALA  47  -0.009  20.237  -2.294
  356   3HB   ALA  47           HMBB     ALA  47   0.140  21.547  -1.095
  357    H    PHE  48           HN       PHE  48   1.050  22.096  -3.042
  358    HA   PHE  48           HA       PHE  48   2.353  22.477  -4.895
  359   1HB   PHE  48           HBR      PHE  48   0.015  21.259  -6.182
  360   2HB   PHE  48           HBS      PHE  48   0.737  22.562  -7.171
  361    HD1  PHE  48           HD1      PHE  48   1.890  19.835  -4.954
  362    HD2  PHE  48           HD2      PHE  48   2.319  21.715  -8.753
  363    HE1  PHE  48           HE1      PHE  48   3.687  18.260  -5.506
  364    HE2  PHE  48           HE2      PHE  48   4.132  20.137  -9.336
  365    HZ   PHE  48           HZ       PHE  48   4.848  18.443  -7.674
  366    H    ASP  49           HN       ASP  49  -0.867  23.729  -5.849
  367    HA   ASP  49           HA       ASP  49  -0.226  26.369  -5.011
  368   1HB   ASP  49           HBS      ASP  49  -0.545  27.342  -7.401
  369   2HB   ASP  49           HBR      ASP  49   1.061  26.842  -6.797
  370    H    ALA  50           HN       ALA  50  -1.979  27.908  -6.251
  371    HA   ALA  50           HA       ALA  50  -4.200  28.449  -6.429
  372   1HB   ALA  50           HMBB     ALA  50  -4.069  26.238  -7.936
  373   2HB   ALA  50           HMBC     ALA  50  -5.122  25.631  -6.633
  374   3HB   ALA  50           HMBA     ALA  50  -5.595  27.078  -7.560
   
  No H/Q in entry =         374
  Start of MODEL   17
    1   1H    MET   1           HNC      MET   1  -6.924   1.717  -0.681
    2   2H    MET   1           HN       MET   1  -5.587   1.387  -1.560
    3   3H    MET   1           HNB      MET   1  -7.046   1.463  -2.290
    4    HA   MET   1           HA       MET   1  -7.839  -0.432  -1.189
    5   1HB   MET   1           HBR      MET   1  -5.226  -0.603  -2.667
    6   2HB   MET   1           HBS      MET   1  -5.979  -2.079  -1.998
    7   1HG   MET   1           HGS      MET   1  -7.979  -1.740  -3.308
    8   2HG   MET   1           HGR      MET   1  -7.453  -0.105  -3.777
    9   1HE   MET   1           HMEB     MET   1  -6.991  -3.694  -3.700
   10   2HE   MET   1           HMEC     MET   1  -7.151  -3.939  -5.457
   11   3HE   MET   1           HMEA     MET   1  -5.559  -4.108  -4.676
   12    H    VAL   2           HN       VAL   2  -7.903  -1.546   0.632
   13    HA   VAL   2           HA       VAL   2  -5.624  -1.215   2.509
   14    HB   VAL   2           HB       VAL   2  -7.516   0.096   3.141
   15   1HG1  VAL   2           HMGR     VAL   2  -9.132  -1.737   1.966
   16   2HG1  VAL   2           HMGR     VAL   2  -9.381  -2.128   3.685
   17   3HG1  VAL   2           HMGR     VAL   2  -9.688  -0.476   3.093
   18   1HG2  VAL   2           HMGS     VAL   2  -6.184  -1.138   4.881
   19   2HG2  VAL   2           HMGS     VAL   2  -7.808  -0.608   5.384
   20   3HG2  VAL   2           HMGS     VAL   2  -7.518  -2.313   4.963
   21    H    ASN   3           HN       ASN   3  -4.487  -2.995   2.578
   22    HA   ASN   3           HA       ASN   3  -3.918  -5.091   3.224
   23   1HB   ASN   3           HBR      ASN   3  -6.003  -4.575   4.839
   24   2HB   ASN   3           HBS      ASN   3  -6.612  -6.014   3.971
   25   1HD2  ASN   3           HD2Z     ASN   3  -3.350  -7.693   5.071
   26   2HD2  ASN   3           HD2E     ASN   3  -3.867  -7.064   3.542
   27    H    LYS   4           HN       LYS   4  -5.562  -7.471   2.967
   28    HA   LYS   4           HA       LYS   4  -6.063  -9.069   1.387
   29   1HB   LYS   4           HBR      LYS   4  -6.211  -6.900  -0.720
   30   2HB   LYS   4           HBS      LYS   4  -6.881  -8.556  -0.768
   31   1HG   LYS   4           HGR      LYS   4  -8.360  -7.822   1.209
   32   2HG   LYS   4           HGS      LYS   4  -7.873  -6.155   0.791
   33   1HD   LYS   4           HDS      LYS   4  -8.765  -6.403  -1.439
   34   2HD   LYS   4           HDR      LYS   4  -9.136  -8.079  -1.142
   35   1HE   LYS   4           HES      LYS   4 -11.129  -7.553  -0.371
   36   2HE   LYS   4           HER      LYS   4 -10.367  -6.577   0.916
   37   1HZ   LYS   4           HZC      LYS   4 -10.199  -5.072  -1.338
   38   2HZ   LYS   4           HZA      LYS   4 -11.697  -5.718  -1.416
   39   3HZ   LYS   4           HZB      LYS   4 -11.247  -4.856  -0.104
   40    H    GLN   5           HN       GLN   5  -5.142  -9.777  -0.867
   41    HA   GLN   5           HA       GLN   5  -2.411 -10.097  -0.138
   42   1HB   GLN   5           HBR      GLN   5  -2.366 -11.470  -2.345
   43   2HB   GLN   5           HBS      GLN   5  -3.289 -12.050  -0.930
   44   1HG   GLN   5           HGS      GLN   5  -4.977 -10.388  -2.551
   45   2HG   GLN   5           HGR      GLN   5  -4.195 -11.621  -3.580
   46   1HE2  GLN   5           HE2Z     GLN   5  -5.505 -14.258  -1.259
   47   2HE2  GLN   5           HE2E     GLN   5  -3.930 -13.654  -1.650
   48    H    LYS   6           HN       LYS   6  -3.642  -9.278  -3.391
   49    HA   LYS   6           HA       LYS   6  -2.520  -8.529  -5.231
   50   1HB   LYS   6           HBS      LYS   6  -1.596  -6.357  -5.100
   51   2HB   LYS   6           HBR      LYS   6  -3.012  -6.422  -4.017
   52   1HG   LYS   6           HGR      LYS   6  -1.694  -6.291  -2.079
   53   2HG   LYS   6           HGS      LYS   6  -0.211  -6.799  -2.935
   54   1HD   LYS   6           HDS      LYS   6  -0.142  -4.448  -2.351
   55   2HD   LYS   6           HDR      LYS   6  -0.035  -4.742  -4.065
   56   1HE   LYS   6           HES      LYS   6  -2.787  -4.335  -3.217
   57   2HE   LYS   6           HER      LYS   6  -1.713  -2.960  -2.832
   58   1HZ   LYS   6           HZA      LYS   6  -1.350  -4.043  -5.447
   59   2HZ   LYS   6           HZB      LYS   6  -2.833  -3.400  -5.209
   60   3HZ   LYS   6           HZC      LYS   6  -1.499  -2.488  -4.970
   61    H    VAL   7           HN       VAL   7  -0.220  -7.522  -5.903
   62    HA   VAL   7           HA       VAL   7   1.774  -9.532  -5.007
   63    HB   VAL   7           HB       VAL   7   2.153 -10.242  -7.252
   64   1HG1  VAL   7           HMGR     VAL   7  -0.732 -10.359  -6.381
   65   2HG1  VAL   7           HMGR     VAL   7  -0.146 -11.208  -7.832
   66   3HG1  VAL   7           HMGR     VAL   7   0.539 -11.596  -6.236
   67   1HG2  VAL   7           HMGS     VAL   7   1.674  -8.114  -8.399
   68   2HG2  VAL   7           HMGS     VAL   7   0.889  -9.512  -9.172
   69   3HG2  VAL   7           HMGS     VAL   7  -0.068  -8.399  -8.165
   70    H    CYS   8           HN       CYS   8   3.842  -9.184  -6.445
   71    HA   CYS   8           HA       CYS   8   4.446  -6.287  -6.548
   72   1HB   CYS   8           HBS      CYS   8   5.814  -7.886  -5.137
   73   2HB   CYS   8           HBR      CYS   8   6.366  -8.616  -6.671
   74    HA   PRO   9           HA       PRO   9   4.426  -6.537 -10.976
   75   1HB   PRO   9           HBR      PRO   9   4.771  -3.760 -10.822
   76   2HB   PRO   9           HBS      PRO   9   3.563  -4.596 -11.556
   77   1HG   PRO   9           HGS      PRO   9   3.281  -3.207  -9.328
   78   2HG   PRO   9           HGR      PRO   9   2.227  -4.398  -9.833
   79   1HD   PRO   9           HDS      PRO   9   4.119  -4.505  -7.760
   80   2HD   PRO   9           HDR      PRO   9   2.814  -5.491  -8.013
   81    H    ALA  10           HN       ALA  10   6.734  -5.833  -8.766
   82    HA   ALA  10           HA       ALA  10   8.781  -4.969 -10.718
   83   1HB   ALA  10           HMBB     ALA  10   8.435  -4.213  -8.189
   84   2HB   ALA  10           HMBA     ALA  10   9.455  -5.644  -7.896
   85   3HB   ALA  10           HMBC     ALA  10  10.041  -4.332  -8.949
   86    H    CYS  11           HN       CYS  11   8.831  -7.392  -8.084
   87    HA   CYS  11           HA       CYS  11  10.777  -8.841  -9.676
   88   1HB   CYS  11           HBS      CYS  11  11.300 -10.046  -7.659
   89   2HB   CYS  11           HBR      CYS  11  11.256  -8.286  -7.381
   90    H    GLU  12           HN       GLU  12   7.483  -9.047  -9.472
   91    HA   GLU  12           HA       GLU  12   5.861 -10.648  -9.654
   92   1HB   GLU  12           HBR      GLU  12   8.231 -11.963 -10.959
   93   2HB   GLU  12           HBS      GLU  12   6.857 -12.861 -10.619
   94   1HG   GLU  12           HGS      GLU  12   5.569 -10.827 -11.738
   95   2HG   GLU  12           HGR      GLU  12   7.084 -10.680 -12.670
   96    H    SER  13           HN       SER  13   6.748 -10.296  -7.192
   97    HA   SER  13           HA       SER  13   6.491 -13.070  -6.140
   98   1HB   SER  13           HBS      SER  13   7.244 -12.387  -4.023
   99   2HB   SER  13           HBR      SER  13   8.421 -11.736  -5.201
  100    HG   SER  13           HG       SER  13   6.219 -10.451  -3.804
  101    H    ALA  14           HN       ALA  14   5.255 -12.619  -3.808
  102    HA   ALA  14           HA       ALA  14   2.837 -11.002  -4.396
  103   1HB   ALA  14           HMBC     ALA  14   2.888 -13.629  -4.838
  104   2HB   ALA  14           HMBB     ALA  14   2.610 -13.676  -3.079
  105   3HB   ALA  14           HMBA     ALA  14   1.459 -12.826  -4.140
  106    H    GLU  15           HN       GLU  15   5.282 -11.713  -2.253
  107    HA   GLU  15           HA       GLU  15   3.675 -11.500   0.240
  108   1HB   GLU  15           HBR      GLU  15   6.667 -11.647  -0.025
  109   2HB   GLU  15           HBS      GLU  15   5.701 -11.917   1.320
  110   1HG   GLU  15           HGS      GLU  15   4.887 -13.692  -0.808
  111   2HG   GLU  15           HGR      GLU  15   6.596 -13.982  -0.380
  112    H    LEU  16           HN       LEU  16   3.171  -9.558   0.900
  113    HA   LEU  16           HA       LEU  16   5.219  -7.402   0.722
  114   1HB   LEU  16           HBR      LEU  16   2.246  -6.998   0.368
  115   2HB   LEU  16           HBS      LEU  16   3.587  -5.881  -0.012
  116    HG   LEU  16           HG       LEU  16   2.829  -8.401  -1.513
  117   1HD1  LEU  16           HMDR     LEU  16   1.845  -5.774  -1.661
  118   2HD1  LEU  16           HMDR     LEU  16   3.000  -5.924  -3.010
  119   3HD1  LEU  16           HMDR     LEU  16   1.647  -7.075  -2.864
  120   1HD2  LEU  16           HMDS     LEU  16   5.345  -7.380  -1.167
  121   2HD2  LEU  16           HMDS     LEU  16   4.802  -8.298  -2.594
  122   3HD2  LEU  16           HMDS     LEU  16   4.804  -6.516  -2.628
  123    H    ILE  17           HN       ILE  17   4.847  -5.640   2.246
  124    HA   ILE  17           HA       ILE  17   3.757  -6.647   4.825
  125    HB   ILE  17           HB       ILE  17   5.955  -5.741   5.832
  126   1HG1  ILE  17           HG1R     ILE  17   6.739  -5.884   2.901
  127   2HG1  ILE  17           HG1S     ILE  17   6.763  -4.460   3.979
  128   1HG2  ILE  17           HMG2     ILE  17   5.907  -8.245   4.149
  129   2HG2  ILE  17           HMG2     ILE  17   7.256  -7.828   5.238
  130   3HG2  ILE  17           HMG2     ILE  17   5.618  -8.072   5.900
  131   1HD1  ILE  17           HMD1     ILE  17   8.473  -5.889   5.356
  132   2HD1  ILE  17           HMD1     ILE  17   8.666  -6.776   3.821
  133   3HD1  ILE  17           HMD1     ILE  17   8.997  -5.025   3.887
  134    H    TYR  18           HN       TYR  18   2.793  -5.185   6.044
  135    HA   TYR  18           HA       TYR  18   2.272  -2.623   4.762
  136   1HB   TYR  18           HBR      TYR  18   0.606  -4.332   5.881
  137   2HB   TYR  18           HBS      TYR  18   1.042  -3.458   7.378
  138    HD1  TYR  18           HD2      TYR  18  -0.532  -3.130   4.047
  139    HD2  TYR  18           HD1      TYR  18   0.242  -1.190   7.752
  140    HE1  TYR  18           HE2      TYR  18  -2.206  -1.424   3.494
  141    HE2  TYR  18           HE1      TYR  18  -1.410   0.542   7.198
  142    HH   TYR  18           HH       TYR  18  -3.541   0.572   5.888
  143    H    ASP  19           HN       ASP  19   2.946  -0.695   5.355
  144    HA   ASP  19           HA       ASP  19   4.174  -0.381   8.040
  145   1HB   ASP  19           HBS      ASP  19   5.274   0.308   5.561
  146   2HB   ASP  19           HBR      ASP  19   4.728   1.841   6.299
  147    HA   PRO  20           HA       PRO  20   0.013   1.237   8.088
  148   1HB   PRO  20           HBS      PRO  20  -0.223   0.984  10.780
  149   2HB   PRO  20           HBR      PRO  20  -0.829  -0.053   9.660
  150   1HG   PRO  20           HGS      PRO  20   1.407  -0.353  11.301
  151   2HG   PRO  20           HGR      PRO  20   0.565  -1.536  10.480
  152   1HD   PRO  20           HDS      PRO  20   2.974  -0.641   9.773
  153   2HD   PRO  20           HDR      PRO  20   1.941  -1.449   8.765
  154    H    GLU  21           HN       GLU  21   2.758   2.466   9.447
  155    HA   GLU  21           HA       GLU  21   1.634   4.747  10.863
  156   1HB   GLU  21           HBR      GLU  21   4.299   3.800   9.889
  157   2HB   GLU  21           HBS      GLU  21   4.092   5.444  10.144
  158   1HG   GLU  21           HGS      GLU  21   3.416   3.450  12.281
  159   2HG   GLU  21           HGR      GLU  21   5.018   4.236  12.215
  160    H    ARG  22           HN       ARG  22   3.407   4.356   7.761
  161    HA   ARG  22           HA       ARG  22   2.431   6.900   6.792
  162   1HB   ARG  22           HBR      ARG  22   3.913   4.710   5.302
  163   2HB   ARG  22           HBS      ARG  22   3.686   6.405   4.783
  164   1HG   ARG  22           HGS      ARG  22   5.230   5.515   7.242
  165   2HG   ARG  22           HGR      ARG  22   5.956   5.952   5.670
  166   1HD   ARG  22           HDS      ARG  22   4.270   7.747   7.417
  167   2HD   ARG  22           HDR      ARG  22   6.049   7.789   7.268
  168    HE   ARG  22           HE       ARG  22   4.096   8.587   5.186
  169   1HH1  ARG  22           HH1Z     ARG  22   7.464   8.134   6.123
  170   2HH1  ARG  22           HH1E     ARG  22   8.050   9.310   4.995
  171   1HH2  ARG  22           HH2Z     ARG  22   4.886  10.210   3.814
  172   2HH2  ARG  22           HH2E     ARG  22   6.593  10.483   3.686
  173    H    GLY  23           HN       GLY  23   1.309   3.656   6.731
  174   1HA   GLY  23           HAR      GLY  23  -0.597   2.716   5.747
  175   2HA   GLY  23           HAS      GLY  23  -0.904   4.250   4.889
  176    H    GLU  24           HN       GLU  24   2.175   2.492   4.987
  177    HA   GLU  24           HA       GLU  24   2.161   2.383   2.008
  178   1HB   GLU  24           HBR      GLU  24   4.025   3.396   3.479
  179   2HB   GLU  24           HBS      GLU  24   4.308   1.829   4.007
  180   1HG   GLU  24           HGR      GLU  24   5.671   1.337   2.257
  181   2HG   GLU  24           HGS      GLU  24   4.247   1.595   1.211
  182    H    ILE  25           HN       ILE  25   2.887   0.401   1.022
  183    HA   ILE  25           HA       ILE  25   3.042  -1.985   2.741
  184    HB   ILE  25           HB       ILE  25   1.360  -2.043   0.199
  185   1HG1  ILE  25           HG1R     ILE  25  -0.561  -2.275   2.022
  186   2HG1  ILE  25           HG1S     ILE  25   0.582  -1.320   3.008
  187   1HG2  ILE  25           HMG2     ILE  25   1.749  -3.986   2.477
  188   2HG2  ILE  25           HMG2     ILE  25   0.446  -4.127   1.267
  189   3HG2  ILE  25           HMG2     ILE  25   2.152  -4.202   0.753
  190   1HD1  ILE  25           HMD1     ILE  25   0.466  -0.040   0.503
  191   2HD1  ILE  25           HMD1     ILE  25  -1.217  -0.455   0.925
  192   3HD1  ILE  25           HMD1     ILE  25  -0.228   0.514   2.051
  193    H    VAL  26           HN       VAL  26   4.928  -2.840   2.348
  194    HA   VAL  26           HA       VAL  26   6.224  -2.222  -0.247
  195    HB   VAL  26           HB       VAL  26   7.618  -3.039   2.298
  196   1HG1  VAL  26           HMGR     VAL  26   8.529  -1.576  -0.188
  197   2HG1  VAL  26           HMGR     VAL  26   9.498  -1.730   1.297
  198   3HG1  VAL  26           HMGR     VAL  26   9.032  -3.185   0.383
  199   1HG2  VAL  26           HMGS     VAL  26   6.135  -1.032   2.662
  200   2HG2  VAL  26           HMGS     VAL  26   7.870  -0.791   2.982
  201   3HG2  VAL  26           HMGS     VAL  26   7.148  -0.170   1.477
  202    H    CYS  27           HN       CYS  27   7.937  -3.829  -0.893
  203    HA   CYS  27           HA       CYS  27   6.866  -6.536  -0.708
  204   1HB   CYS  27           HBS      CYS  27   7.490  -5.422  -2.848
  205   2HB   CYS  27           HBR      CYS  27   9.197  -5.486  -2.335
  206    H    ALA  28           HN       ALA  28   7.519  -8.001   0.632
  207    HA   ALA  28           HA       ALA  28   9.863  -7.700   2.267
  208   1HB   ALA  28           HMBB     ALA  28   7.569  -9.495   2.040
  209   2HB   ALA  28           HMBA     ALA  28   9.075 -10.324   2.512
  210   3HB   ALA  28           HMBC     ALA  28   8.480  -8.943   3.469
  211    H    LYS  29           HN       LYS  29   9.642  -8.512  -0.926
  212    HA   LYS  29           HA       LYS  29  11.953 -10.387  -0.843
  213   1HB   LYS  29           HBR      LYS  29   9.741 -10.112  -2.648
  214   2HB   LYS  29           HBS      LYS  29  11.247  -9.691  -3.510
  215   1HG   LYS  29           HGR      LYS  29  11.946 -11.829  -3.562
  216   2HG   LYS  29           HGS      LYS  29  11.489 -12.114  -1.858
  217   1HD   LYS  29           HDS      LYS  29   9.046 -12.024  -2.937
  218   2HD   LYS  29           HDR      LYS  29   9.934 -12.521  -4.350
  219   1HE   LYS  29           HES      LYS  29  10.288 -13.966  -1.745
  220   2HE   LYS  29           HER      LYS  29   8.940 -14.328  -2.860
  221   1HZ   LYS  29           HZA      LYS  29  11.188 -14.258  -4.396
  222   2HZ   LYS  29           HZB      LYS  29  11.644 -15.070  -3.054
  223   3HZ   LYS  29           HZC      LYS  29  10.366 -15.590  -3.927
  224    H    CYS  30           HN       CYS  30  11.027  -7.813  -3.125
  225    HA   CYS  30           HA       CYS  30  13.831  -7.334  -3.437
  226   1HB   CYS  30           HBR      CYS  30  13.236  -6.036  -5.380
  227   2HB   CYS  30           HBS      CYS  30  12.373  -7.595  -5.336
  228    H    GLY  31           HN       GLY  31  11.688  -5.954  -1.330
  229   1HA   GLY  31           HAR      GLY  31  12.128  -4.200   0.115
  230   2HA   GLY  31           HAS      GLY  31  13.333  -3.568  -1.040
  231    H    TYR  32           HN       TYR  32  10.604  -4.155  -2.814
  232    HA   TYR  32           HA       TYR  32  10.502  -1.258  -3.323
  233   1HB   TYR  32           HBS      TYR  32  10.642  -2.732  -5.246
  234   2HB   TYR  32           HBR      TYR  32   9.185  -3.621  -4.721
  235    HD1  TYR  32           HD2      TYR  32  10.084  -0.012  -5.236
  236    HD2  TYR  32           HD1      TYR  32   7.376  -3.170  -6.126
  237    HE1  TYR  32           HE2      TYR  32   8.800   1.504  -6.676
  238    HE2  TYR  32           HE1      TYR  32   6.066  -1.654  -7.548
  239    HH   TYR  32           HH       TYR  32   6.948   0.510  -9.047
  240    H    VAL  33           HN       VAL  33   8.948   0.060  -2.723
  241    HA   VAL  33           HA       VAL  33   6.707  -0.709  -1.093
  242    HB   VAL  33           HB       VAL  33   7.212   1.798  -2.713
  243   1HG1  VAL  33           HMGR     VAL  33   5.117   1.210  -0.612
  244   2HG1  VAL  33           HMGR     VAL  33   5.553   2.847  -1.161
  245   3HG1  VAL  33           HMGR     VAL  33   4.865   1.675  -2.312
  246   1HG2  VAL  33           HMGS     VAL  33   8.706   0.984  -0.644
  247   2HG2  VAL  33           HMGS     VAL  33   8.340   2.693  -0.978
  248   3HG2  VAL  33           HMGS     VAL  33   7.400   1.804   0.245
  249    H    ILE  34           HN       ILE  34   4.465  -0.448  -1.719
  250    HA   ILE  34           HA       ILE  34   3.944  -1.092  -4.577
  251    HB   ILE  34           HB       ILE  34   2.483  -1.807  -1.994
  252   1HG1  ILE  34           HG1R     ILE  34   4.508  -3.089  -2.516
  253   2HG1  ILE  34           HG1S     ILE  34   3.036  -4.103  -2.559
  254   1HG2  ILE  34           HMG2     ILE  34   1.497  -1.875  -4.799
  255   2HG2  ILE  34           HMG2     ILE  34   1.114  -3.264  -3.746
  256   3HG2  ILE  34           HMG2     ILE  34   0.624  -1.619  -3.265
  257   1HD1  ILE  34           HMD1     ILE  34   3.203  -3.459  -5.165
  258   2HD1  ILE  34           HMD1     ILE  34   4.930  -3.361  -4.726
  259   3HD1  ILE  34           HMD1     ILE  34   4.024  -4.873  -4.451
  260    H    GLU  35           HN       GLU  35   1.897   0.104  -1.926
  261    HA   GLU  35           HA       GLU  35   1.705   2.739  -3.262
  262   1HB   GLU  35           HBR      GLU  35  -0.544   0.883  -2.524
  263   2HB   GLU  35           HBS      GLU  35  -0.735   2.545  -2.376
  264   1HG   GLU  35           HGS      GLU  35  -1.354   2.705  -4.468
  265   2HG   GLU  35           HGR      GLU  35   0.334   2.404  -4.962
  266    H    GLU  36           HN       GLU  36   0.256   4.135  -1.628
  267    HA   GLU  36           HA       GLU  36   1.282   3.711   1.138
  268   1HB   GLU  36           HBR      GLU  36   2.491   5.698   1.050
  269   2HB   GLU  36           HBS      GLU  36   2.893   4.791  -0.304
  270   1HG   GLU  36           HGS      GLU  36   0.934   6.168  -1.463
  271   2HG   GLU  36           HGR      GLU  36   1.449   7.419  -0.300
  272    H    ASN  37           HN       ASN  37   0.694   6.030   2.264
  273    HA   ASN  37           HA       ASN  37  -0.832   7.544   2.948
  274   1HB   ASN  37           HBR      ASN  37  -0.741   7.943   0.375
  275   2HB   ASN  37           HBS      ASN  37  -2.410   7.306   0.428
  276   1HD2  ASN  37           HD2Z     ASN  37  -3.826  10.124   1.987
  277   2HD2  ASN  37           HD2E     ASN  37  -4.031   8.466   1.532
  278    H    ILE  38           HN       ILE  38  -1.989   6.973   4.579
  279    HA   ILE  38           HA       ILE  38  -4.678   6.020   4.042
  280    HB   ILE  38           HB       ILE  38  -3.312   3.899   4.409
  281   1HG1  ILE  38           HG1R     ILE  38  -5.280   3.926   6.628
  282   2HG1  ILE  38           HG1S     ILE  38  -5.869   4.593   5.079
  283   1HG2  ILE  38           HMG2     ILE  38  -2.082   5.152   6.433
  284   2HG2  ILE  38           HMG2     ILE  38  -3.366   4.313   7.342
  285   3HG2  ILE  38           HMG2     ILE  38  -2.240   3.379   6.322
  286   1HD1  ILE  38           HMD1     ILE  38  -4.635   2.282   4.270
  287   2HD1  ILE  38           HMD1     ILE  38  -5.301   1.816   5.859
  288   3HD1  ILE  38           HMD1     ILE  38  -6.379   2.466   4.595
  289    H    ILE  39           HN       ILE  39  -5.993   6.098   6.081
  290    HA   ILE  39           HA       ILE  39  -6.940   7.468   7.631
  291    HB   ILE  39           HB       ILE  39  -4.988   6.288   8.856
  292   1HG1  ILE  39           HG1R     ILE  39  -5.777   8.808  10.282
  293   2HG1  ILE  39           HG1S     ILE  39  -7.062   7.729   9.670
  294   1HG2  ILE  39           HMG2     ILE  39  -3.648   8.785   8.149
  295   2HG2  ILE  39           HMG2     ILE  39  -3.612   8.432   9.896
  296   3HG2  ILE  39           HMG2     ILE  39  -2.987   7.234   8.731
  297   1HD1  ILE  39           HMD1     ILE  39  -5.699   5.868  10.905
  298   2HD1  ILE  39           HMD1     ILE  39  -5.009   7.244  11.808
  299   3HD1  ILE  39           HMD1     ILE  39  -6.770   6.957  11.828
  300    H    ASP  40           HN       ASP  40  -6.777   9.674   8.744
  301    HA   ASP  40           HA       ASP  40  -6.352  11.523   6.484
  302   1HB   ASP  40           HBR      ASP  40  -8.488  11.246   8.546
  303   2HB   ASP  40           HBS      ASP  40  -8.169  12.842   7.809
  304    H    MET  41           HN       MET  41  -7.134  12.662   9.681
  305    HA   MET  41           HA       MET  41  -4.494  14.002   9.865
  306   1HB   MET  41           HBS      MET  41  -5.593  16.186   9.999
  307   2HB   MET  41           HBR      MET  41  -5.859  15.394   8.420
  308   1HG   MET  41           HGS      MET  41  -8.096  14.574   9.347
  309   2HG   MET  41           HGR      MET  41  -7.811  15.655  10.733
  310   1HE   MET  41           HMEC     MET  41 -10.288  16.225   9.462
  311   2HE   MET  41           HMEB     MET  41 -10.409  17.332   8.070
  312   3HE   MET  41           HMEA     MET  41  -9.964  15.625   7.815
  313    H    GLY  42           HN       GLY  42  -5.225  15.893  11.749
  314   1HA   GLY  42           HAR      GLY  42  -5.932  14.219  14.111
  315   2HA   GLY  42           HAS      GLY  42  -5.003  15.744  14.142
  316    HA   PRO  43           HA       PRO  43  -8.245  18.335  14.901
  317   1HB   PRO  43           HBS      PRO  43  -8.351  19.759  12.483
  318   2HB   PRO  43           HBR      PRO  43  -7.916  20.315  13.966
  319   1HG   PRO  43           HGS      PRO  43  -6.251  19.879  11.953
  320   2HG   PRO  43           HGR      PRO  43  -5.778  20.001  13.549
  321   1HD   PRO  43           HDS      PRO  43  -5.906  17.711  11.945
  322   2HD   PRO  43           HDR      PRO  43  -5.134  17.907  13.395
  323    H    GLU  44           HN       GLU  44  -9.997  17.245  15.348
  324    HA   GLU  44           HA       GLU  44 -11.934  16.880  13.107
  325   1HB   GLU  44           HBS      GLU  44 -13.129  15.557  14.698
  326   2HB   GLU  44           HBR      GLU  44 -11.635  14.892  14.320
  327   1HG   GLU  44           HGS      GLU  44 -10.762  15.986  16.486
  328   2HG   GLU  44           HGR      GLU  44 -12.453  16.375  16.900
  329    H    TRP  45           HN       TRP  45 -11.064  18.756  15.873
  330    HA   TRP  45           HA       TRP  45 -12.069  20.422  17.064
  331   1HB   TRP  45           HBS      TRP  45 -13.095  22.075  15.767
  332   2HB   TRP  45           HBR      TRP  45 -11.879  21.282  14.725
  333    HD1  TRP  45           HD1      TRP  45 -15.628  21.938  14.987
  334    HE1  TRP  45           HE1      TRP  45 -16.748  21.271  12.773
  335    HE3  TRP  45           HE3      TRP  45 -11.615  19.757  12.749
  336    HZ2  TRP  45           HZ2      TRP  45 -15.987  20.014  10.385
  337    HZ3  TRP  45           HZ3      TRP  45 -11.877  18.860  10.483
  338    HH2  TRP  45           HH2      TRP  45 -14.015  18.979   9.317
  339    H    ARG  46           HN       ARG  46 -14.359  21.566  17.396
  340    HA   ARG  46           HA       ARG  46 -15.431  19.688  19.189
  341   1HB   ARG  46           HBR      ARG  46 -15.355  22.111  19.605
  342   2HB   ARG  46           HBS      ARG  46 -16.606  22.360  18.352
  343   1HG   ARG  46           HGS      ARG  46 -17.548  22.454  20.617
  344   2HG   ARG  46           HGR      ARG  46 -18.214  21.087  19.679
  345   1HD   ARG  46           HDS      ARG  46 -17.740  20.355  21.901
  346   2HD   ARG  46           HDR      ARG  46 -16.579  19.600  20.774
  347    HE   ARG  46           HE       ARG  46 -15.663  22.058  22.068
  348   1HH1  ARG  46           HH1Z     ARG  46 -15.548  18.539  21.886
  349   2HH1  ARG  46           HH1E     ARG  46 -14.229  18.415  23.000
  350   1HH2  ARG  46           HH2Z     ARG  46 -14.025  21.849  23.621
  351   2HH2  ARG  46           HH2E     ARG  46 -13.364  20.288  23.982
  352    H    ALA  47           HN       ALA  47 -16.547  20.805  16.040
  353    HA   ALA  47           HA       ALA  47 -19.262  20.207  16.342
  354   1HB   ALA  47           HMBB     ALA  47 -18.099  21.616  14.575
  355   2HB   ALA  47           HMBA     ALA  47 -17.776  20.089  13.715
  356   3HB   ALA  47           HMBC     ALA  47 -19.456  20.595  14.032
  357    H    PHE  48           HN       PHE  48 -19.993  18.687  14.144
  358    HA   PHE  48           HA       PHE  48 -20.514  16.518  13.580
  359   1HB   PHE  48           HBR      PHE  48 -18.311  15.428  15.361
  360   2HB   PHE  48           HBS      PHE  48 -19.132  14.651  13.977
  361    HD1  PHE  48           HD2      PHE  48 -18.915  16.884  11.928
  362    HD2  PHE  48           HD1      PHE  48 -16.138  15.317  14.755
  363    HE1  PHE  48           HE2      PHE  48 -17.043  17.669  10.516
  364    HE2  PHE  48           HE1      PHE  48 -14.264  16.088  13.373
  365    HZ   PHE  48           HZ       PHE  48 -14.712  17.318  11.283
  366    H    ASP  49           HN       ASP  49 -19.133  16.051  16.838
  367    HA   ASP  49           HA       ASP  49 -21.871  15.468  17.814
  368   1HB   ASP  49           HBR      ASP  49 -21.181  13.437  18.806
  369   2HB   ASP  49           HBS      ASP  49 -20.731  13.417  17.076
  370    H    ALA  50           HN       ALA  50 -22.248  15.667  20.005
  371    HA   ALA  50           HA       ALA  50 -20.137  17.114  21.539
  372   1HB   ALA  50           HMBA     ALA  50 -23.154  17.272  21.713
  373   2HB   ALA  50           HMBB     ALA  50 -22.047  17.918  22.951
  374   3HB   ALA  50           HMBC     ALA  50 -22.005  18.567  21.292
   
  No H/Q in entry =         374
  Start of MODEL   18
    1   1H    MET   1           HNB      MET   1  -9.426  -3.174  -1.767
    2   2H    MET   1           HNC      MET   1 -10.459  -2.048  -1.188
    3   3H    MET   1           HN       MET   1 -10.115  -2.097  -2.784
    4    HA   MET   1           HA       MET   1  -8.002  -1.320  -2.556
    5   1HB   MET   1           HBS      MET   1 -10.048   0.247  -2.023
    6   2HB   MET   1           HBR      MET   1  -9.330   0.273  -0.387
    7   1HG   MET   1           HGS      MET   1  -7.159   0.998  -1.382
    8   2HG   MET   1           HGR      MET   1  -7.929   1.010  -2.988
    9   1HE   MET   1           HMEA     MET   1  -9.927   2.036  -3.516
   10   2HE   MET   1           HMEC     MET   1 -10.851   3.283  -2.641
   11   3HE   MET   1           HMEB     MET   1  -9.451   3.748  -3.639
   12    H    VAL   2           HN       VAL   2  -9.343  -2.839   0.229
   13    HA   VAL   2           HA       VAL   2  -6.945  -2.548   1.888
   14    HB   VAL   2           HB       VAL   2  -9.015  -2.713   3.033
   15   1HG1  VAL   2           HMGS     VAL   2  -9.544  -5.023   1.222
   16   2HG1  VAL   2           HMGS     VAL   2 -10.242  -5.050   2.860
   17   3HG1  VAL   2           HMGS     VAL   2 -10.616  -3.704   1.756
   18   1HG2  VAL   2           HMGR     VAL   2  -7.107  -4.974   3.303
   19   2HG2  VAL   2           HMGR     VAL   2  -7.591  -3.721   4.473
   20   3HG2  VAL   2           HMGR     VAL   2  -8.657  -5.114   4.167
   21    H    ASN   3           HN       ASN   3  -5.301  -3.917   2.031
   22    HA   ASN   3           HA       ASN   3  -4.650  -5.271  -0.314
   23   1HB   ASN   3           HBR      ASN   3  -2.599  -5.860   0.681
   24   2HB   ASN   3           HBS      ASN   3  -3.057  -4.231   1.255
   25   1HD2  ASN   3           HD2Z     ASN   3  -1.994  -6.960   3.910
   26   2HD2  ASN   3           HD2E     ASN   3  -1.554  -6.919   2.235
   27    H    LYS   4           HN       LYS   4  -5.750  -6.900  -1.069
   28    HA   LYS   4           HA       LYS   4  -5.940  -9.326   0.640
   29   1HB   LYS   4           HBS      LYS   4  -7.935  -9.980  -0.775
   30   2HB   LYS   4           HBR      LYS   4  -8.203  -8.717   0.460
   31   1HG   LYS   4           HGR      LYS   4  -7.755  -7.063  -1.529
   32   2HG   LYS   4           HGS      LYS   4  -8.148  -8.479  -2.546
   33   1HD   LYS   4           HDS      LYS   4 -10.155  -7.335  -2.329
   34   2HD   LYS   4           HDR      LYS   4 -10.261  -8.729  -1.288
   35   1HE   LYS   4           HES      LYS   4  -9.736  -7.349   0.670
   36   2HE   LYS   4           HER      LYS   4  -9.660  -5.920  -0.398
   37   1HZ   LYS   4           HZB      LYS   4 -12.048  -7.592  -0.343
   38   2HZ   LYS   4           HZC      LYS   4 -11.822  -6.457   0.808
   39   3HZ   LYS   4           HZA      LYS   4 -11.901  -6.021  -0.764
   40    H    GLN   5           HN       GLN   5  -3.951  -9.962  -0.223
   41    HA   GLN   5           HA       GLN   5  -2.541 -10.997  -1.685
   42   1HB   GLN   5           HBS      GLN   5  -4.707 -12.441  -1.566
   43   2HB   GLN   5           HBR      GLN   5  -4.921 -11.915  -3.260
   44   1HG   GLN   5           HGS      GLN   5  -3.603 -13.597  -3.855
   45   2HG   GLN   5           HGR      GLN   5  -2.251 -12.710  -3.096
   46   1HE2  GLN   5           HE2Z     GLN   5  -3.572 -16.222  -1.637
   47   2HE2  GLN   5           HE2E     GLN   5  -4.191 -15.495  -3.082
   48    H    LYS   6           HN       LYS   6  -1.634  -9.113  -2.525
   49    HA   LYS   6           HA       LYS   6  -2.117  -8.995  -5.442
   50   1HB   LYS   6           HBS      LYS   6  -2.453  -6.758  -3.718
   51   2HB   LYS   6           HBR      LYS   6  -0.913  -6.533  -4.595
   52   1HG   LYS   6           HGR      LYS   6  -3.509  -7.235  -6.001
   53   2HG   LYS   6           HGS      LYS   6  -3.011  -5.550  -5.676
   54   1HD   LYS   6           HDS      LYS   6  -1.873  -5.558  -7.546
   55   2HD   LYS   6           HDR      LYS   6  -0.766  -6.668  -6.788
   56   1HE   LYS   6           HES      LYS   6  -1.243  -7.870  -8.644
   57   2HE   LYS   6           HER      LYS   6  -2.520  -8.469  -7.549
   58   1HZ   LYS   6           HZA      LYS   6  -2.986  -6.183  -9.309
   59   2HZ   LYS   6           HZB      LYS   6  -3.180  -7.712  -9.851
   60   3HZ   LYS   6           HZC      LYS   6  -4.081  -7.169  -8.601
   61    H    VAL   7           HN       VAL   7  -0.182  -8.452  -6.631
   62    HA   VAL   7           HA       VAL   7   2.042  -9.878  -5.320
   63    HB   VAL   7           HB       VAL   7   2.664 -10.600  -7.518
   64   1HG1  VAL   7           HMGR     VAL   7   0.874 -11.842  -6.350
   65   2HG1  VAL   7           HMGR     VAL   7  -0.339 -10.889  -7.241
   66   3HG1  VAL   7           HMGR     VAL   7   0.769 -11.968  -8.124
   67   1HG2  VAL   7           HMGS     VAL   7   0.698  -8.548  -8.453
   68   2HG2  VAL   7           HMGS     VAL   7   2.340  -8.915  -9.034
   69   3HG2  VAL   7           HMGS     VAL   7   0.989 -10.001  -9.440
   70    H    CYS   8           HN       CYS   8   4.225  -9.444  -6.485
   71    HA   CYS   8           HA       CYS   8   4.661  -6.528  -6.760
   72   1HB   CYS   8           HBS      CYS   8   6.022  -7.928  -5.157
   73   2HB   CYS   8           HBR      CYS   8   6.722  -8.728  -6.593
   74    HA   PRO   9           HA       PRO   9   4.995  -7.099 -11.144
   75   1HB   PRO   9           HBR      PRO   9   5.063  -4.311 -11.255
   76   2HB   PRO   9           HBS      PRO   9   3.961  -5.326 -11.926
   77   1HG   PRO   9           HGS      PRO   9   3.481  -3.739  -9.867
   78   2HG   PRO   9           HGR      PRO   9   2.548  -5.061 -10.276
   79   1HD   PRO   9           HDS      PRO   9   4.390  -4.801  -8.163
   80   2HD   PRO   9           HDR      PRO   9   3.148  -5.883  -8.318
   81    H    ALA  10           HN       ALA  10   7.070  -6.091  -8.860
   82    HA   ALA  10           HA       ALA  10   9.188  -5.193 -10.727
   83   1HB   ALA  10           HMBC     ALA  10   8.596  -4.387  -8.211
   84   2HB   ALA  10           HMBB     ALA  10   9.809  -5.648  -7.873
   85   3HB   ALA  10           HMBA     ALA  10  10.214  -4.288  -8.951
   86    H    CYS  11           HN       CYS  11   9.228  -7.422  -7.929
   87    HA   CYS  11           HA       CYS  11  11.329  -8.860  -9.323
   88   1HB   CYS  11           HBS      CYS  11  11.825  -9.894  -7.216
   89   2HB   CYS  11           HBR      CYS  11  11.669  -8.126  -7.056
   90    H    GLU  12           HN       GLU  12   8.048  -9.253  -9.272
   91    HA   GLU  12           HA       GLU  12   6.528 -10.963  -9.386
   92   1HB   GLU  12           HBS      GLU  12   7.956 -11.460 -11.275
   93   2HB   GLU  12           HBR      GLU  12   9.006 -12.401 -10.365
   94   1HG   GLU  12           HGS      GLU  12   7.403 -13.732 -11.713
   95   2HG   GLU  12           HGR      GLU  12   7.154 -14.105  -9.987
   96    H    SER  13           HN       SER  13   7.360 -10.380  -6.915
   97    HA   SER  13           HA       SER  13   7.535 -12.977  -5.516
   98   1HB   SER  13           HBS      SER  13   7.184 -11.592  -3.472
   99   2HB   SER  13           HBR      SER  13   8.679 -11.218  -4.376
  100    HG   SER  13           HG       SER  13   6.663  -9.645  -3.543
  101    H    ALA  14           HN       ALA  14   5.812 -13.193  -3.733
  102    HA   ALA  14           HA       ALA  14   3.172 -12.210  -4.668
  103   1HB   ALA  14           HMBB     ALA  14   3.983 -14.880  -4.227
  104   2HB   ALA  14           HMBA     ALA  14   2.961 -14.434  -2.837
  105   3HB   ALA  14           HMBC     ALA  14   2.329 -14.276  -4.497
  106    H    GLU  15           HN       GLU  15   5.574 -12.019  -2.370
  107    HA   GLU  15           HA       GLU  15   3.777 -11.687  -0.066
  108   1HB   GLU  15           HBR      GLU  15   6.756 -11.384  -0.037
  109   2HB   GLU  15           HBS      GLU  15   5.701 -11.852   1.180
  110   1HG   GLU  15           HGS      GLU  15   5.113 -13.944   0.029
  111   2HG   GLU  15           HGR      GLU  15   6.357 -13.633  -1.211
  112    H    LEU  16           HN       LEU  16   2.887  -9.776   0.216
  113    HA   LEU  16           HA       LEU  16   4.722  -7.433   0.350
  114   1HB   LEU  16           HBR      LEU  16   1.816  -7.301  -0.467
  115   2HB   LEU  16           HBS      LEU  16   3.084  -6.050  -0.615
  116    HG   LEU  16           HG       LEU  16   2.904  -8.613  -2.222
  117   1HD1  LEU  16           HMDR     LEU  16   1.262  -6.614  -2.618
  118   2HD1  LEU  16           HMDR     LEU  16   2.700  -5.815  -3.305
  119   3HD1  LEU  16           HMDR     LEU  16   2.115  -7.349  -3.999
  120   1HD2  LEU  16           HMDS     LEU  16   5.166  -7.400  -1.545
  121   2HD2  LEU  16           HMDS     LEU  16   4.902  -8.038  -3.188
  122   3HD2  LEU  16           HMDS     LEU  16   4.689  -6.299  -2.863
  123    H    ILE  17           HN       ILE  17   3.778  -5.683   1.735
  124    HA   ILE  17           HA       ILE  17   2.303  -6.672   4.084
  125    HB   ILE  17           HB       ILE  17   4.375  -5.999   5.510
  126   1HG1  ILE  17           HG1R     ILE  17   5.741  -6.539   2.843
  127   2HG1  ILE  17           HG1S     ILE  17   5.624  -4.962   3.674
  128   1HG2  ILE  17           HMG2     ILE  17   3.427  -8.377   4.922
  129   2HG2  ILE  17           HMG2     ILE  17   4.957  -8.522   4.017
  130   3HG2  ILE  17           HMG2     ILE  17   4.985  -8.187   5.768
  131   1HD1  ILE  17           HMD1     ILE  17   6.890  -6.021   5.595
  132   2HD1  ILE  17           HMD1     ILE  17   7.193  -7.409   4.515
  133   3HD1  ILE  17           HMD1     ILE  17   7.808  -5.790   4.082
  134    H    TYR  18           HN       TYR  18   1.702  -5.060   5.512
  135    HA   TYR  18           HA       TYR  18   1.676  -2.392   4.223
  136   1HB   TYR  18           HBR      TYR  18  -0.486  -3.484   4.437
  137   2HB   TYR  18           HBS      TYR  18  -0.235  -3.706   6.192
  138    HD1  TYR  18           HD2      TYR  18   0.497  -0.673   4.160
  139    HD2  TYR  18           HD1      TYR  18  -1.999  -2.412   7.132
  140    HE1  TYR  18           HE2      TYR  18  -0.579   1.503   4.519
  141    HE2  TYR  18           HE1      TYR  18  -3.064  -0.232   7.523
  142    HH   TYR  18           HH       TYR  18  -2.886   1.973   7.178
  143    H    ASP  19           HN       ASP  19   2.611  -0.725   5.119
  144    HA   ASP  19           HA       ASP  19   3.852  -1.135   7.771
  145   1HB   ASP  19           HBS      ASP  19   5.063  -0.545   5.432
  146   2HB   ASP  19           HBR      ASP  19   4.795   1.094   6.095
  147    HA   PRO  20           HA       PRO  20   0.664   1.616   9.088
  148   1HB   PRO  20           HBR      PRO  20   1.281   1.126  11.705
  149   2HB   PRO  20           HBS      PRO  20   0.006   0.520  10.868
  150   1HG   PRO  20           HGS      PRO  20   2.357  -0.767  11.588
  151   2HG   PRO  20           HGR      PRO  20   0.923  -1.446  11.068
  152   1HD   PRO  20           HDS      PRO  20   3.144  -1.317   9.601
  153   2HD   PRO  20           HDR      PRO  20   1.627  -1.546   8.984
  154    H    GLU  21           HN       GLU  21   3.940   1.815   9.438
  155    HA   GLU  21           HA       GLU  21   3.940   4.163  11.149
  156   1HB   GLU  21           HBR      GLU  21   6.009   2.555   9.652
  157   2HB   GLU  21           HBS      GLU  21   6.386   4.011  10.397
  158   1HG   GLU  21           HGS      GLU  21   4.891   2.294  12.203
  159   2HG   GLU  21           HGR      GLU  21   6.457   1.566  11.753
  160    H    ARG  22           HN       ARG  22   4.356   3.435   7.706
  161    HA   ARG  22           HA       ARG  22   4.415   6.353   7.141
  162   1HB   ARG  22           HBR      ARG  22   4.978   4.020   5.283
  163   2HB   ARG  22           HBS      ARG  22   5.158   5.760   4.916
  164   1HG   ARG  22           HGS      ARG  22   6.728   5.394   7.181
  165   2HG   ARG  22           HGR      ARG  22   7.004   3.909   6.226
  166   1HD   ARG  22           HDS      ARG  22   8.010   5.009   4.543
  167   2HD   ARG  22           HDR      ARG  22   7.008   6.473   4.750
  168    HE   ARG  22           HE       ARG  22   9.575   5.915   5.983
  169   1HH1  ARG  22           HH1Z     ARG  22   6.670   7.913   5.994
  170   2HH1  ARG  22           HH1E     ARG  22   7.346   9.083   7.076
  171   1HH2  ARG  22           HH2Z     ARG  22  10.379   7.398   7.498
  172   2HH2  ARG  22           HH2E     ARG  22   9.445   8.793   7.927
  173    H    GLY  23           HN       GLY  23   2.434   3.551   7.084
  174   1HA   GLY  23           HAR      GLY  23   0.254   3.196   6.341
  175   2HA   GLY  23           HAS      GLY  23   0.195   4.876   5.744
  176    H    GLU  24           HN       GLU  24   2.381   2.105   5.103
  177    HA   GLU  24           HA       GLU  24   1.910   2.479   2.175
  178   1HB   GLU  24           HBS      GLU  24   3.747   3.734   2.862
  179   2HB   GLU  24           HBR      GLU  24   4.390   2.557   3.871
  180   1HG   GLU  24           HGS      GLU  24   4.725   1.127   1.749
  181   2HG   GLU  24           HGR      GLU  24   4.306   2.572   0.787
  182    H    ILE  25           HN       ILE  25   1.512   0.665   1.157
  183    HA   ILE  25           HA       ILE  25   2.242  -1.946   2.341
  184    HB   ILE  25           HB       ILE  25   0.770  -1.433  -0.282
  185   1HG1  ILE  25           HG1R     ILE  25  -1.281  -2.015   1.330
  186   2HG1  ILE  25           HG1S     ILE  25  -0.209  -1.267   2.548
  187   1HG2  ILE  25           HMG2     ILE  25   1.709  -3.779   0.895
  188   2HG2  ILE  25           HMG2     ILE  25  -0.044  -3.764   1.226
  189   3HG2  ILE  25           HMG2     ILE  25   0.547  -3.626  -0.450
  190   1HD1  ILE  25           HMD1     ILE  25  -0.642   0.196  -0.019
  191   2HD1  ILE  25           HMD1     ILE  25  -1.981   0.145   1.158
  192   3HD1  ILE  25           HMD1     ILE  25  -0.399   0.816   1.636
  193    H    VAL  26           HN       VAL  26   3.999  -2.974   1.795
  194    HA   VAL  26           HA       VAL  26   5.516  -2.043  -0.589
  195    HB   VAL  26           HB       VAL  26   6.736  -2.847   2.046
  196   1HG1  VAL  26           HMGR     VAL  26   7.757  -1.908  -0.518
  197   2HG1  VAL  26           HMGR     VAL  26   8.346  -0.943   0.856
  198   3HG1  VAL  26           HMGR     VAL  26   8.593  -2.706   0.836
  199   1HG2  VAL  26           HMGS     VAL  26   5.082  -0.874   2.206
  200   2HG2  VAL  26           HMGS     VAL  26   6.718  -0.683   2.881
  201   3HG2  VAL  26           HMGS     VAL  26   6.316   0.035   1.303
  202    H    CYS  27           HN       CYS  27   7.352  -3.557  -1.119
  203    HA   CYS  27           HA       CYS  27   6.516  -6.356  -0.973
  204   1HB   CYS  27           HBS      CYS  27   7.422  -5.255  -3.035
  205   2HB   CYS  27           HBR      CYS  27   9.011  -5.188  -2.225
  206    H    ALA  28           HN       ALA  28   7.011  -7.626   0.615
  207    HA   ALA  28           HA       ALA  28   9.075  -7.084   2.519
  208   1HB   ALA  28           HMBA     ALA  28   6.864  -8.433   2.712
  209   2HB   ALA  28           HMBC     ALA  28   7.853  -9.798   2.130
  210   3HB   ALA  28           HMBB     ALA  28   8.306  -8.943   3.628
  211    H    LYS  29           HN       LYS  29   9.399  -8.081  -0.612
  212    HA   LYS  29           HA       LYS  29  11.832  -9.653  -0.027
  213   1HB   LYS  29           HBS      LYS  29   9.949 -10.343  -1.667
  214   2HB   LYS  29           HBR      LYS  29  10.675  -9.138  -2.766
  215   1HG   LYS  29           HGR      LYS  29  11.541 -11.355  -3.275
  216   2HG   LYS  29           HGS      LYS  29  12.846 -10.336  -2.604
  217   1HD   LYS  29           HDS      LYS  29  11.338 -11.951  -0.646
  218   2HD   LYS  29           HDR      LYS  29  12.248 -12.859  -1.821
  219   1HE   LYS  29           HES      LYS  29  13.309 -10.807   0.108
  220   2HE   LYS  29           HER      LYS  29  13.645 -12.560   0.043
  221   1HZ   LYS  29           HZC      LYS  29  14.524 -12.005  -2.261
  222   2HZ   LYS  29           HZA      LYS  29  14.586 -10.456  -1.747
  223   3HZ   LYS  29           HZB      LYS  29  15.446 -11.608  -0.974
  224    H    CYS  30           HN       CYS  30  10.986  -7.365  -2.642
  225    HA   CYS  30           HA       CYS  30  13.752  -6.599  -2.702
  226   1HB   CYS  30           HBS      CYS  30  13.260  -5.493  -4.774
  227   2HB   CYS  30           HBR      CYS  30  12.545  -7.126  -4.725
  228    H    GLY  31           HN       GLY  31  11.236  -5.359  -0.945
  229   1HA   GLY  31           HAR      GLY  31  11.244  -3.484   0.389
  230   2HA   GLY  31           HAS      GLY  31  12.576  -2.817  -0.595
  231    H    TYR  32           HN       TYR  32  10.225  -3.715  -2.743
  232    HA   TYR  32           HA       TYR  32   9.976  -0.871  -3.461
  233   1HB   TYR  32           HBS      TYR  32  10.462  -2.444  -5.245
  234   2HB   TYR  32           HBR      TYR  32   9.010  -3.404  -4.847
  235    HD1  TYR  32           HD2      TYR  32  10.082  -0.019  -5.991
  236    HD2  TYR  32           HD1      TYR  32   6.996  -2.945  -5.976
  237    HE1  TYR  32           HE2      TYR  32   8.852   1.282  -7.669
  238    HE2  TYR  32           HE1      TYR  32   5.742  -1.641  -7.639
  239    HH   TYR  32           HH       TYR  32   5.565   0.314  -8.670
  240    H    VAL  33           HN       VAL  33   8.298   0.351  -3.046
  241    HA   VAL  33           HA       VAL  33   6.134  -0.545  -1.372
  242    HB   VAL  33           HB       VAL  33   6.437   2.004  -2.978
  243   1HG1  VAL  33           HMGR     VAL  33   4.497   1.246  -0.789
  244   2HG1  VAL  33           HMGR     VAL  33   4.823   2.926  -1.281
  245   3HG1  VAL  33           HMGR     VAL  33   4.137   1.772  -2.451
  246   1HG2  VAL  33           HMGS     VAL  33   7.155   1.371  -0.109
  247   2HG2  VAL  33           HMGS     VAL  33   8.259   1.813  -1.433
  248   3HG2  VAL  33           HMGS     VAL  33   7.098   3.007  -0.805
  249    H    ILE  34           HN       ILE  34   3.856  -0.286  -1.974
  250    HA   ILE  34           HA       ILE  34   3.332  -1.102  -4.789
  251    HB   ILE  34           HB       ILE  34   2.130  -1.946  -2.117
  252   1HG1  ILE  34           HG1R     ILE  34   4.244  -2.983  -2.920
  253   2HG1  ILE  34           HG1S     ILE  34   2.904  -4.139  -2.666
  254   1HG2  ILE  34           HMG2     ILE  34   0.951  -2.292  -4.859
  255   2HG2  ILE  34           HMG2     ILE  34   0.681  -3.507  -3.583
  256   3HG2  ILE  34           HMG2     ILE  34   0.171  -1.818  -3.326
  257   1HD1  ILE  34           HMD1     ILE  34   3.028  -3.160  -5.414
  258   2HD1  ILE  34           HMD1     ILE  34   4.539  -3.957  -4.899
  259   3HD1  ILE  34           HMD1     ILE  34   2.988  -4.830  -4.789
  260    H    GLU  35           HN       GLU  35   1.323  -0.040  -2.047
  261    HA   GLU  35           HA       GLU  35   0.827   2.535  -3.411
  262   1HB   GLU  35           HBS      GLU  35  -0.979   1.209  -4.051
  263   2HB   GLU  35           HBR      GLU  35  -1.216   0.507  -2.544
  264   1HG   GLU  35           HGS      GLU  35  -2.966   2.134  -2.951
  265   2HG   GLU  35           HGR      GLU  35  -1.954   2.849  -1.667
  266    H    GLU  36           HN       GLU  36   0.234   4.189  -1.952
  267    HA   GLU  36           HA       GLU  36   1.119   3.631   0.849
  268   1HB   GLU  36           HBR      GLU  36   2.562   4.702  -1.215
  269   2HB   GLU  36           HBS      GLU  36   1.813   6.080  -0.621
  270   1HG   GLU  36           HGS      GLU  36   2.581   5.207   1.746
  271   2HG   GLU  36           HGR      GLU  36   3.895   4.445   0.809
  272    H    ASN  37           HN       ASN  37   0.929   5.823   2.109
  273    HA   ASN  37           HA       ASN  37  -0.197   7.628   2.864
  274   1HB   ASN  37           HBS      ASN  37  -0.015   8.117   0.276
  275   2HB   ASN  37           HBR      ASN  37  -1.794   7.977   0.385
  276   1HD2  ASN  37           HD2Z     ASN  37   0.129  11.311   1.632
  277   2HD2  ASN  37           HD2E     ASN  37   0.903  10.012   0.787
  278    H    ILE  38           HN       ILE  38  -1.173   6.364   4.404
  279    HA   ILE  38           HA       ILE  38  -4.053   6.758   4.252
  280    HB   ILE  38           HB       ILE  38  -2.900   3.990   4.851
  281   1HG1  ILE  38           HG1R     ILE  38  -4.658   5.079   2.629
  282   2HG1  ILE  38           HG1S     ILE  38  -3.025   4.368   2.498
  283   1HG2  ILE  38           HMG2     ILE  38  -4.767   4.699   6.386
  284   2HG2  ILE  38           HMG2     ILE  38  -5.817   4.763   4.946
  285   3HG2  ILE  38           HMG2     ILE  38  -5.060   3.222   5.431
  286   1HD1  ILE  38           HMD1     ILE  38  -4.262   2.255   3.531
  287   2HD1  ILE  38           HMD1     ILE  38  -5.683   3.039   2.789
  288   3HD1  ILE  38           HMD1     ILE  38  -4.279   2.601   1.781
  289    H    ILE  39           HN       ILE  39  -4.900   7.317   6.172
  290    HA   ILE  39           HA       ILE  39  -3.654   6.494   8.653
  291    HB   ILE  39           HB       ILE  39  -3.380   8.756   9.605
  292   1HG1  ILE  39           HG1R     ILE  39  -3.239  10.469   7.377
  293   2HG1  ILE  39           HG1S     ILE  39  -4.729   9.514   7.137
  294   1HG2  ILE  39           HMG2     ILE  39  -1.466   7.579   8.465
  295   2HG2  ILE  39           HMG2     ILE  39  -1.760   8.636   7.059
  296   3HG2  ILE  39           HMG2     ILE  39  -1.307   9.347   8.630
  297   1HD1  ILE  39           HMD1     ILE  39  -4.732  10.288   9.846
  298   2HD1  ILE  39           HMD1     ILE  39  -4.231  11.727   8.918
  299   3HD1  ILE  39           HMD1     ILE  39  -5.764  10.903   8.527
  300    H    ASP  40           HN       ASP  40  -6.149   6.240   7.084
  301    HA   ASP  40           HA       ASP  40  -8.393   6.237   7.352
  302   1HB   ASP  40           HBR      ASP  40  -7.882   6.902  10.245
  303   2HB   ASP  40           HBS      ASP  40  -9.282   6.058   9.522
  304    H    MET  41           HN       MET  41  -9.980   7.804   9.182
  305    HA   MET  41           HA       MET  41  -9.962  10.234   7.496
  306   1HB   MET  41           HBS      MET  41 -11.894   8.376   7.789
  307   2HB   MET  41           HBR      MET  41 -12.373   9.524   9.072
  308   1HG   MET  41           HGS      MET  41 -12.500  11.348   7.484
  309   2HG   MET  41           HGR      MET  41 -11.751  10.351   6.213
  310   1HE   MET  41           HMEA     MET  41 -14.561  11.149   8.449
  311   2HE   MET  41           HMEB     MET  41 -16.023  10.390   7.770
  312   3HE   MET  41           HMEC     MET  41 -14.948   9.454   8.840
  313    H    GLY  42           HN       GLY  42 -10.468  12.259   8.333
  314   1HA   GLY  42           HAS      GLY  42 -10.725  12.583  11.265
  315   2HA   GLY  42           HAR      GLY  42  -9.385  13.435  10.448
  316    HA   PRO  43           HA       PRO  43 -12.040  16.777   9.684
  317   1HB   PRO  43           HBS      PRO  43 -10.815  17.733   7.486
  318   2HB   PRO  43           HBR      PRO  43 -10.461  18.167   9.030
  319   1HG   PRO  43           HGS      PRO  43  -9.029  16.508   7.297
  320   2HG   PRO  43           HGR      PRO  43  -8.480  17.294   8.663
  321   1HD   PRO  43           HDS      PRO  43  -8.983  14.667   8.499
  322   2HD   PRO  43           HDR      PRO  43  -8.810  15.515   9.908
  323    H    GLU  44           HN       GLU  44 -14.027  16.150   9.307
  324    HA   GLU  44           HA       GLU  44 -14.998  16.444   6.697
  325   1HB   GLU  44           HBR      GLU  44 -13.764  14.083   6.812
  326   2HB   GLU  44           HBS      GLU  44 -15.175  13.621   7.596
  327   1HG   GLU  44           HGS      GLU  44 -15.031  13.282   5.030
  328   2HG   GLU  44           HGR      GLU  44 -16.593  13.773   5.741
  329    H    TRP  45           HN       TRP  45 -15.500  17.279   9.368
  330    HA   TRP  45           HA       TRP  45 -17.219  17.712  10.795
  331   1HB   TRP  45           HBR      TRP  45 -18.816  16.489   8.554
  332   2HB   TRP  45           HBS      TRP  45 -19.557  16.973  10.107
  333    HD1  TRP  45           HD1      TRP  45 -19.922  19.576  10.504
  334    HE1  TRP  45           HE1      TRP  45 -19.737  21.649   8.998
  335    HE3  TRP  45           HE3      TRP  45 -17.437  17.448   6.608
  336    HZ2  TRP  45           HZ2      TRP  45 -18.623  22.281   6.503
  337    HZ3  TRP  45           HZ3      TRP  45 -16.835  18.852   4.691
  338    HH2  TRP  45           HH2      TRP  45 -17.410  21.222   4.630
  339    H    ARG  46           HN       ARG  46 -16.667  16.626  12.536
  340    HA   ARG  46           HA       ARG  46 -16.183  13.862  12.575
  341   1HB   ARG  46           HBR      ARG  46 -16.074  14.127  15.063
  342   2HB   ARG  46           HBS      ARG  46 -15.039  15.244  14.125
  343   1HG   ARG  46           HGS      ARG  46 -17.054  16.894  14.402
  344   2HG   ARG  46           HGR      ARG  46 -17.501  15.819  15.756
  345   1HD   ARG  46           HDS      ARG  46 -14.727  16.302  15.946
  346   2HD   ARG  46           HDR      ARG  46 -15.521  17.873  15.639
  347    HE   ARG  46           HE       ARG  46 -17.072  16.790  17.596
  348   1HH1  ARG  46           HH1Z     ARG  46 -13.651  17.579  17.274
  349   2HH1  ARG  46           HH1E     ARG  46 -13.392  17.639  18.985
  350   1HH2  ARG  46           HH2Z     ARG  46 -16.665  16.750  19.826
  351   2HH2  ARG  46           HH2E     ARG  46 -15.097  17.171  20.431
  352    H    ALA  47           HN       ALA  47 -18.822  15.686  14.178
  353    HA   ALA  47           HA       ALA  47 -20.185  13.088  14.658
  354   1HB   ALA  47           HMBC     ALA  47 -20.322  15.730  16.137
  355   2HB   ALA  47           HMBB     ALA  47 -21.230  14.254  16.551
  356   3HB   ALA  47           HMBA     ALA  47 -19.452  14.262  16.650
  357    H    PHE  48           HN       PHE  48 -22.252  12.766  14.109
  358    HA   PHE  48           HA       PHE  48 -23.702  14.956  12.715
  359   1HB   PHE  48           HBR      PHE  48 -24.236  11.955  12.734
  360   2HB   PHE  48           HBS      PHE  48 -25.346  13.179  12.050
  361    HD1  PHE  48           HD1      PHE  48 -22.003  11.705  11.843
  362    HD2  PHE  48           HD2      PHE  48 -24.870  14.133   9.832
  363    HE1  PHE  48           HE1      PHE  48 -20.688  11.511   9.780
  364    HE2  PHE  48           HE2      PHE  48 -23.561  13.955   7.740
  365    HZ   PHE  48           HZ       PHE  48 -21.496  12.585   7.711
  366    H    ASP  49           HN       ASP  49 -24.263  12.281  15.037
  367    HA   ASP  49           HA       ASP  49 -25.372  12.215  17.015
  368   1HB   ASP  49           HBR      ASP  49 -24.184  14.376  17.474
  369   2HB   ASP  49           HBS      ASP  49 -25.674  15.210  16.946
  370    H    ALA  50           HN       ALA  50 -27.057  15.043  15.677
  371    HA   ALA  50           HA       ALA  50 -29.384  13.535  14.798
  372   1HB   ALA  50           HMBA     ALA  50 -29.425  13.322  17.297
  373   2HB   ALA  50           HMBC     ALA  50 -29.589  15.094  17.383
  374   3HB   ALA  50           HMBB     ALA  50 -30.847  14.121  16.579
   
  No H/Q in entry =         374
  Start of MODEL   19
    1   1H    MET   1           HNB      MET   1  -9.507  -1.527 -12.409
    2   2H    MET   1           HN       MET   1  -9.841  -0.837 -13.850
    3   3H    MET   1           HNC      MET   1  -8.324  -1.342 -13.520
    4    HA   MET   1           HA       MET   1  -8.153   0.889 -13.274
    5   1HB   MET   1           HBR      MET   1  -9.843   2.182 -11.972
    6   2HB   MET   1           HBS      MET   1 -10.480   1.434 -13.464
    7   1HG   MET   1           HGS      MET   1 -11.292  -0.500 -12.005
    8   2HG   MET   1           HGR      MET   1 -10.864   0.503 -10.598
    9   1HE   MET   1           HMEB     MET   1 -13.689  -0.288 -10.570
   10   2HE   MET   1           HMEA     MET   1 -14.900   0.575 -11.550
   11   3HE   MET   1           HMEC     MET   1 -13.807  -0.602 -12.320
   12    H    VAL   2           HN       VAL   2  -6.526  -0.582 -12.200
   13    HA   VAL   2           HA       VAL   2  -5.161  -1.047 -10.444
   14    HB   VAL   2           HB       VAL   2  -5.331   1.477 -10.674
   15   1HG1  VAL   2           HMGR     VAL   2  -7.033   1.128  -8.209
   16   2HG1  VAL   2           HMGR     VAL   2  -6.072   2.599  -8.489
   17   3HG1  VAL   2           HMGR     VAL   2  -7.327   2.123  -9.656
   18   1HG2  VAL   2           HMGS     VAL   2  -3.792  -0.137  -9.100
   19   2HG2  VAL   2           HMGS     VAL   2  -3.531   1.603  -9.372
   20   3HG2  VAL   2           HMGS     VAL   2  -4.403   1.048  -7.922
   21    H    ASN   3           HN       ASN   3  -5.020  -1.150  -7.938
   22    HA   ASN   3           HA       ASN   3  -5.648  -2.288  -6.079
   23   1HB   ASN   3           HBR      ASN   3  -8.447  -1.926  -7.131
   24   2HB   ASN   3           HBS      ASN   3  -8.049  -2.851  -5.654
   25   1HD2  ASN   3           HD2Z     ASN   3  -6.700   0.189  -4.026
   26   2HD2  ASN   3           HD2E     ASN   3  -6.022  -1.316  -4.556
   27    H    LYS   4           HN       LYS   4  -7.799  -3.512  -8.668
   28    HA   LYS   4           HA       LYS   4  -7.021  -6.269  -8.363
   29   1HB   LYS   4           HBR      LYS   4  -8.098  -4.850 -10.820
   30   2HB   LYS   4           HBS      LYS   4  -8.046  -6.611 -10.524
   31   1HG   LYS   4           HGR      LYS   4  -9.624  -6.349  -8.654
   32   2HG   LYS   4           HGS      LYS   4  -9.668  -4.584  -8.932
   33   1HD   LYS   4           HDS      LYS   4 -11.424  -4.950 -10.206
   34   2HD   LYS   4           HDR      LYS   4 -10.271  -5.493 -11.394
   35   1HE   LYS   4           HES      LYS   4 -11.841  -7.221  -9.489
   36   2HE   LYS   4           HER      LYS   4 -11.998  -7.103 -11.265
   37   1HZ   LYS   4           HZC      LYS   4  -9.430  -7.730 -10.935
   38   2HZ   LYS   4           HZA      LYS   4 -10.107  -8.563  -9.703
   39   3HZ   LYS   4           HZB      LYS   4 -10.614  -8.814 -11.234
   40    H    GLN   5           HN       GLN   5  -4.764  -6.216  -8.208
   41    HA   GLN   5           HA       GLN   5  -3.448  -6.643 -10.643
   42   1HB   GLN   5           HBR      GLN   5  -1.608  -4.809 -10.145
   43   2HB   GLN   5           HBS      GLN   5  -3.000  -4.513 -11.224
   44   1HG   GLN   5           HGS      GLN   5  -4.048  -3.121  -9.722
   45   2HG   GLN   5           HGR      GLN   5  -3.231  -3.850  -8.310
   46   1HE2  GLN   5           HE2Z     GLN   5  -1.279  -1.036 -10.623
   47   2HE2  GLN   5           HE2E     GLN   5  -2.536  -2.019 -11.297
   48    H    LYS   6           HN       LYS   6  -2.718  -5.387  -7.371
   49    HA   LYS   6           HA       LYS   6  -1.767  -6.399  -5.554
   50   1HB   LYS   6           HBS      LYS   6  -3.499  -8.180  -6.687
   51   2HB   LYS   6           HBR      LYS   6  -1.984  -9.128  -6.666
   52   1HG   LYS   6           HGR      LYS   6  -1.867  -9.142  -4.346
   53   2HG   LYS   6           HGS      LYS   6  -2.860  -7.667  -4.181
   54   1HD   LYS   6           HDS      LYS   6  -4.036  -9.650  -3.401
   55   2HD   LYS   6           HDR      LYS   6  -4.843  -8.811  -4.697
   56   1HE   LYS   6           HES      LYS   6  -4.928 -11.265  -4.929
   57   2HE   LYS   6           HER      LYS   6  -4.173 -10.422  -6.311
   58   1HZ   LYS   6           HZC      LYS   6  -2.436 -11.341  -4.190
   59   2HZ   LYS   6           HZA      LYS   6  -3.071 -12.479  -5.174
   60   3HZ   LYS   6           HZB      LYS   6  -2.171 -11.269  -5.799
   61    H    VAL   7           HN       VAL   7  -0.282  -8.595  -5.108
   62    HA   VAL   7           HA       VAL   7   1.848  -9.396  -5.157
   63    HB   VAL   7           HB       VAL   7   2.453 -10.407  -7.202
   64   1HG1  VAL   7           HMGR     VAL   7   0.114 -10.904  -5.977
   65   2HG1  VAL   7           HMGR     VAL   7  -0.480 -10.543  -7.617
   66   3HG1  VAL   7           HMGR     VAL   7   0.718 -11.836  -7.369
   67   1HG2  VAL   7           HMGS     VAL   7   1.949  -8.218  -8.549
   68   2HG2  VAL   7           HMGS     VAL   7   1.868  -9.812  -9.336
   69   3HG2  VAL   7           HMGS     VAL   7   0.372  -8.995  -8.825
   70    H    CYS   8           HN       CYS   8   4.026  -9.207  -6.640
   71    HA   CYS   8           HA       CYS   8   4.667  -6.310  -6.777
   72   1HB   CYS   8           HBS      CYS   8   5.924  -7.898  -5.230
   73   2HB   CYS   8           HBR      CYS   8   6.595  -8.634  -6.712
   74    HA   PRO   9           HA       PRO   9   5.001  -6.726 -11.167
   75   1HB   PRO   9           HBR      PRO   9   5.080  -3.935 -11.154
   76   2HB   PRO   9           HBS      PRO   9   3.991  -4.917 -11.892
   77   1HG   PRO   9           HGS      PRO   9   3.476  -3.423  -9.769
   78   2HG   PRO   9           HGR      PRO   9   2.542  -4.713 -10.267
   79   1HD   PRO   9           HDS      PRO   9   4.315  -4.576  -8.089
   80   2HD   PRO   9           HDR      PRO   9   3.090  -5.657  -8.352
   81    H    ALA  10           HN       ALA  10   7.053  -5.870  -8.814
   82    HA   ALA  10           HA       ALA  10   9.203  -4.915 -10.607
   83   1HB   ALA  10           HMBC     ALA  10   8.603  -4.270  -8.043
   84   2HB   ALA  10           HMBB     ALA  10   9.814  -5.551  -7.788
   85   3HB   ALA  10           HMBA     ALA  10  10.220  -4.124  -8.776
   86    H    CYS  11           HN       CYS  11   9.154  -7.344  -7.974
   87    HA   CYS  11           HA       CYS  11  11.246  -8.714  -9.442
   88   1HB   CYS  11           HBS      CYS  11  11.712  -9.887  -7.397
   89   2HB   CYS  11           HBR      CYS  11  11.572  -8.130  -7.127
   90    H    GLU  12           HN       GLU  12   7.957  -9.078  -9.414
   91    HA   GLU  12           HA       GLU  12   6.424 -10.758  -9.649
   92   1HB   GLU  12           HBS      GLU  12   8.777 -11.497 -11.069
   93   2HB   GLU  12           HBR      GLU  12   8.153 -12.915 -10.425
   94   1HG   GLU  12           HGS      GLU  12   6.968 -10.940 -12.367
   95   2HG   GLU  12           HGR      GLU  12   7.083 -12.703 -12.620
   96    H    SER  13           HN       SER  13   7.095 -10.302  -7.165
   97    HA   SER  13           HA       SER  13   6.910 -13.059  -6.056
   98   1HB   SER  13           HBS      SER  13   7.734 -10.495  -4.684
   99   2HB   SER  13           HBR      SER  13   7.197 -11.949  -3.798
  100    HG   SER  13           HG       SER  13   8.784 -13.154  -5.147
  101    H    ALA  14           HN       ALA  14   5.447 -12.760  -3.911
  102    HA   ALA  14           HA       ALA  14   3.087 -11.094  -4.592
  103   1HB   ALA  14           HMBC     ALA  14   3.221 -13.798  -4.968
  104   2HB   ALA  14           HMBB     ALA  14   2.590 -13.705  -3.303
  105   3HB   ALA  14           HMBA     ALA  14   1.720 -12.898  -4.632
  106    H    GLU  15           HN       GLU  15   5.396 -11.896  -2.333
  107    HA   GLU  15           HA       GLU  15   3.711 -11.684   0.096
  108   1HB   GLU  15           HBR      GLU  15   6.709 -11.612  -0.073
  109   2HB   GLU  15           HBS      GLU  15   5.719 -11.958   1.237
  110   1HG   GLU  15           HGS      GLU  15   5.432 -13.752  -1.105
  111   2HG   GLU  15           HGR      GLU  15   6.871 -14.007  -0.081
  112    H    LEU  16           HN       LEU  16   3.054  -9.767   0.697
  113    HA   LEU  16           HA       LEU  16   4.971  -7.498   0.578
  114   1HB   LEU  16           HBR      LEU  16   2.017  -7.159   0.094
  115   2HB   LEU  16           HBS      LEU  16   3.371  -6.057  -0.293
  116    HG   LEU  16           HG       LEU  16   2.660  -8.633  -1.721
  117   1HD1  LEU  16           HMDR     LEU  16   1.609  -6.052  -1.973
  118   2HD1  LEU  16           HMDR     LEU  16   2.812  -6.185  -3.281
  119   3HD1  LEU  16           HMDR     LEU  16   1.495  -7.380  -3.157
  120   1HD2  LEU  16           HMDS     LEU  16   5.147  -7.436  -1.384
  121   2HD2  LEU  16           HMDS     LEU  16   4.685  -8.576  -2.672
  122   3HD2  LEU  16           HMDS     LEU  16   4.585  -6.819  -2.958
  123    H    ILE  17           HN       ILE  17   4.272  -5.710   2.043
  124    HA   ILE  17           HA       ILE  17   3.007  -6.671   4.534
  125    HB   ILE  17           HB       ILE  17   5.133  -6.062   5.794
  126   1HG1  ILE  17           HG1R     ILE  17   6.253  -6.069   2.972
  127   2HG1  ILE  17           HG1S     ILE  17   6.267  -4.738   4.164
  128   1HG2  ILE  17           HMG2     ILE  17   4.352  -8.459   4.810
  129   2HG2  ILE  17           HMG2     ILE  17   5.994  -8.335   4.125
  130   3HG2  ILE  17           HMG2     ILE  17   5.751  -8.214   5.888
  131   1HD1  ILE  17           HMD1     ILE  17   7.665  -7.309   4.820
  132   2HD1  ILE  17           HMD1     ILE  17   8.429  -6.152   3.700
  133   3HD1  ILE  17           HMD1     ILE  17   8.013  -5.644   5.359
  134    H    TYR  18           HN       TYR  18   2.311  -5.079   5.850
  135    HA   TYR  18           HA       TYR  18   2.170  -2.447   4.517
  136   1HB   TYR  18           HBS      TYR  18   0.112  -3.845   5.058
  137   2HB   TYR  18           HBR      TYR  18   0.430  -3.482   6.778
  138    HD1  TYR  18           HD1      TYR  18   0.769  -0.845   7.249
  139    HD2  TYR  18           HD2      TYR  18  -1.441  -2.508   4.019
  140    HE1  TYR  18           HE1      TYR  18  -0.546   1.225   7.091
  141    HE2  TYR  18           HE2      TYR  18  -2.745  -0.437   3.834
  142    HH   TYR  18           HH       TYR  18  -3.316   1.440   6.081
  143    H    ASP  19           HN       ASP  19   2.287  -0.507   5.678
  144    HA   ASP  19           HA       ASP  19   4.038  -0.677   8.064
  145   1HB   ASP  19           HBS      ASP  19   5.203  -0.402   5.775
  146   2HB   ASP  19           HBR      ASP  19   4.596   1.276   5.865
  147    HA   PRO  20           HA       PRO  20   0.609   1.846   9.194
  148   1HB   PRO  20           HBR      PRO  20   1.499   1.602  11.842
  149   2HB   PRO  20           HBS      PRO  20   0.073   1.104  11.198
  150   1HG   PRO  20           HGS      PRO  20   2.036  -0.508  11.934
  151   2HG   PRO  20           HGR      PRO  20   0.794  -0.940  10.907
  152   1HD   PRO  20           HDS      PRO  20   3.477  -0.431  10.277
  153   2HD   PRO  20           HDR      PRO  20   2.335  -1.201   9.361
  154    H    GLU  21           HN       GLU  21   3.823   2.528   9.464
  155    HA   GLU  21           HA       GLU  21   3.649   4.990  11.021
  156   1HB   GLU  21           HBR      GLU  21   5.761   3.877   9.162
  157   2HB   GLU  21           HBS      GLU  21   5.904   5.268  10.088
  158   1HG   GLU  21           HGS      GLU  21   5.625   4.112  12.190
  159   2HG   GLU  21           HGR      GLU  21   5.476   2.533  11.373
  160    H    ARG  22           HN       ARG  22   3.902   4.055   7.580
  161    HA   ARG  22           HA       ARG  22   3.230   6.836   6.821
  162   1HB   ARG  22           HBR      ARG  22   4.286   4.494   5.202
  163   2HB   ARG  22           HBS      ARG  22   3.890   6.109   4.545
  164   1HG   ARG  22           HGS      ARG  22   5.784   6.031   6.839
  165   2HG   ARG  22           HGR      ARG  22   6.374   5.367   5.289
  166   1HD   ARG  22           HDS      ARG  22   5.020   7.748   4.673
  167   2HD   ARG  22           HDR      ARG  22   6.025   8.093   6.109
  168    HE   ARG  22           HE       ARG  22   7.349   6.689   3.897
  169   1HH1  ARG  22           HH1Z     ARG  22   6.524   9.840   5.246
  170   2HH1  ARG  22           HH1E     ARG  22   7.952  10.600   4.626
  171   1HH2  ARG  22           HH2Z     ARG  22   9.266   7.687   3.213
  172   2HH2  ARG  22           HH2E     ARG  22   9.503   9.383   3.475
  173    H    GLY  23           HN       GLY  23   1.912   3.654   7.019
  174   1HA   GLY  23           HAR      GLY  23  -0.268   2.914   6.532
  175   2HA   GLY  23           HAS      GLY  23  -0.589   4.446   5.677
  176    H    GLU  24           HN       GLU  24   2.347   2.605   5.120
  177    HA   GLU  24           HA       GLU  24   1.625   2.457   2.288
  178   1HB   GLU  24           HBR      GLU  24   3.762   3.338   3.426
  179   2HB   GLU  24           HBS      GLU  24   4.117   1.733   3.767
  180   1HG   GLU  24           HGS      GLU  24   5.104   1.400   1.852
  181   2HG   GLU  24           HGR      GLU  24   3.581   1.681   0.966
  182    H    ILE  25           HN       ILE  25   2.173   0.562   1.004
  183    HA   ILE  25           HA       ILE  25   2.481  -1.966   2.531
  184    HB   ILE  25           HB       ILE  25   0.957  -1.809  -0.108
  185   1HG1  ILE  25           HG1R     ILE  25  -1.034  -2.329   1.616
  186   2HG1  ILE  25           HG1S     ILE  25   0.010  -1.360   2.694
  187   1HG2  ILE  25           HMG2     ILE  25   1.945  -3.982   0.460
  188   2HG2  ILE  25           HMG2     ILE  25   1.042  -3.979   1.998
  189   3HG2  ILE  25           HMG2     ILE  25   0.162  -4.025   0.448
  190   1HD1  ILE  25           HMD1     ILE  25  -0.141   0.028   0.229
  191   2HD1  ILE  25           HMD1     ILE  25  -1.799  -0.484   0.646
  192   3HD1  ILE  25           HMD1     ILE  25  -0.846   0.484   1.804
  193    H    VAL  26           HN       VAL  26   4.147  -3.161   1.929
  194    HA   VAL  26           HA       VAL  26   5.708  -2.257  -0.436
  195    HB   VAL  26           HB       VAL  26   6.878  -3.056   2.225
  196   1HG1  VAL  26           HMGR     VAL  26   7.967  -1.505  -0.133
  197   2HG1  VAL  26           HMGR     VAL  26   8.789  -1.658   1.438
  198   3HG1  VAL  26           HMGR     VAL  26   8.477  -3.107   0.452
  199   1HG2  VAL  26           HMGS     VAL  26   5.616  -0.481   1.465
  200   2HG2  VAL  26           HMGS     VAL  26   5.811  -1.251   3.058
  201   3HG2  VAL  26           HMGS     VAL  26   7.180  -0.396   2.310
  202    H    CYS  27           HN       CYS  27   7.541  -3.791  -0.925
  203    HA   CYS  27           HA       CYS  27   6.611  -6.558  -0.810
  204   1HB   CYS  27           HBS      CYS  27   7.393  -5.405  -2.894
  205   2HB   CYS  27           HBR      CYS  27   9.040  -5.412  -2.206
  206    H    ALA  28           HN       ALA  28   7.376  -8.109   0.411
  207    HA   ALA  28           HA       ALA  28   9.690  -7.622   2.126
  208   1HB   ALA  28           HMBB     ALA  28   7.294  -9.055   2.313
  209   2HB   ALA  28           HMBA     ALA  28   8.579 -10.289   2.263
  210   3HB   ALA  28           HMBC     ALA  28   8.628  -9.001   3.494
  211    H    LYS  29           HN       LYS  29  10.104  -7.878  -0.771
  212    HA   LYS  29           HA       LYS  29  11.823 -10.307  -0.865
  213   1HB   LYS  29           HBR      LYS  29   9.270 -10.058  -2.058
  214   2HB   LYS  29           HBS      LYS  29  10.467  -9.874  -3.372
  215   1HG   LYS  29           HGR      LYS  29  10.759 -12.129  -1.396
  216   2HG   LYS  29           HGS      LYS  29   9.558 -12.255  -2.714
  217   1HD   LYS  29           HDS      LYS  29  11.122 -12.325  -4.361
  218   2HD   LYS  29           HDR      LYS  29  12.282 -11.393  -3.457
  219   1HE   LYS  29           HES      LYS  29  11.567 -14.200  -2.657
  220   2HE   LYS  29           HER      LYS  29  12.831 -13.819  -3.862
  221   1HZ   LYS  29           HZA      LYS  29  12.826 -12.622  -1.190
  222   2HZ   LYS  29           HZB      LYS  29  13.545 -14.059  -1.486
  223   3HZ   LYS  29           HZC      LYS  29  14.059 -12.714  -2.256
  224    H    CYS  30           HN       CYS  30  10.873  -7.180  -2.252
  225    HA   CYS  30           HA       CYS  30  13.730  -6.874  -2.990
  226   1HB   CYS  30           HBS      CYS  30  13.175  -5.469  -4.874
  227   2HB   CYS  30           HBR      CYS  30  12.544  -7.127  -5.057
  228    H    GLY  31           HN       GLY  31  11.244  -5.906  -1.037
  229   1HA   GLY  31           HAR      GLY  31  11.181  -4.209   0.507
  230   2HA   GLY  31           HAS      GLY  31  12.584  -3.466  -0.309
  231    H    TYR  32           HN       TYR  32  10.334  -3.980  -2.677
  232    HA   TYR  32           HA       TYR  32  10.149  -1.080  -3.063
  233   1HB   TYR  32           HBS      TYR  32  10.506  -2.492  -5.013
  234   2HB   TYR  32           HBR      TYR  32   9.025  -3.423  -4.650
  235    HD1  TYR  32           HD1      TYR  32   9.885   0.236  -5.015
  236    HD2  TYR  32           HD2      TYR  32   7.323  -2.973  -6.121
  237    HE1  TYR  32           HE1      TYR  32   8.650   1.745  -6.509
  238    HE2  TYR  32           HE2      TYR  32   6.097  -1.482  -7.636
  239    HH   TYR  32           HH       TYR  32   6.624   0.401  -8.989
  240    H    VAL  33           HN       VAL  33   8.469   0.170  -2.644
  241    HA   VAL  33           HA       VAL  33   6.196  -0.676  -1.142
  242    HB   VAL  33           HB       VAL  33   6.599   1.793  -2.847
  243   1HG1  VAL  33           HMGR     VAL  33   4.510   1.219  -0.732
  244   2HG1  VAL  33           HMGR     VAL  33   4.817   2.806  -1.476
  245   3HG1  VAL  33           HMGR     VAL  33   4.237   1.452  -2.475
  246   1HG2  VAL  33           HMGS     VAL  33   8.170   1.278  -0.843
  247   2HG2  VAL  33           HMGS     VAL  33   7.449   2.897  -1.010
  248   3HG2  VAL  33           HMGS     VAL  33   6.761   1.733   0.148
  249    H    ILE  34           HN       ILE  34   3.973  -0.597  -1.838
  250    HA   ILE  34           HA       ILE  34   3.579  -1.360  -4.688
  251    HB   ILE  34           HB       ILE  34   2.159  -2.150  -2.107
  252   1HG1  ILE  34           HG1R     ILE  34   4.315  -3.239  -2.715
  253   2HG1  ILE  34           HG1S     ILE  34   2.934  -4.363  -2.556
  254   1HG2  ILE  34           HMG2     ILE  34   1.083  -2.145  -4.829
  255   2HG2  ILE  34           HMG2     ILE  34   1.010  -3.736  -4.027
  256   3HG2  ILE  34           HMG2     ILE  34   0.263  -2.314  -3.254
  257   1HD1  ILE  34           HMD1     ILE  34   2.808  -3.961  -5.190
  258   2HD1  ILE  34           HMD1     ILE  34   4.541  -3.609  -4.954
  259   3HD1  ILE  34           HMD1     ILE  34   3.876  -5.190  -4.463
  260    H    GLU  35           HN       GLU  35   1.401  -0.254  -2.099
  261    HA   GLU  35           HA       GLU  35   0.808   2.201  -3.703
  262   1HB   GLU  35           HBS      GLU  35  -0.887   0.621  -3.908
  263   2HB   GLU  35           HBR      GLU  35  -0.914   0.187  -2.288
  264   1HG   GLU  35           HGS      GLU  35  -2.691   1.609  -2.139
  265   2HG   GLU  35           HGR      GLU  35  -1.525   2.959  -2.187
  266    H    GLU  36           HN       GLU  36   0.418   4.073  -2.581
  267    HA   GLU  36           HA       GLU  36   1.942   4.363  -0.101
  268   1HB   GLU  36           HBR      GLU  36   1.270   6.701  -0.371
  269   2HB   GLU  36           HBS      GLU  36   2.106   6.022  -1.659
  270   1HG   GLU  36           HGS      GLU  36   0.267   5.806  -3.085
  271   2HG   GLU  36           HGR      GLU  36  -0.928   6.174  -1.813
  272    H    ASN  37           HN       ASN  37   0.521   6.173   1.312
  273    HA   ASN  37           HA       ASN  37  -1.220   4.697   2.816
  274   1HB   ASN  37           HBR      ASN  37  -1.829   6.689   3.982
  275   2HB   ASN  37           HBS      ASN  37  -0.087   6.709   3.581
  276   1HD2  ASN  37           HD2Z     ASN  37  -0.919  10.107   2.834
  277   2HD2  ASN  37           HD2E     ASN  37  -0.342   9.044   4.075
  278    H    ILE  38           HN       ILE  38  -3.371   4.439   3.088
  279    HA   ILE  38           HA       ILE  38  -4.835   4.735   0.530
  280    HB   ILE  38           HB       ILE  38  -5.145   2.726   2.816
  281   1HG1  ILE  38           HG1R     ILE  38  -4.106   2.120   0.041
  282   2HG1  ILE  38           HG1S     ILE  38  -3.026   2.762   1.311
  283   1HG2  ILE  38           HMG2     ILE  38  -6.504   2.829   0.115
  284   2HG2  ILE  38           HMG2     ILE  38  -6.545   1.439   1.232
  285   3HG2  ILE  38           HMG2     ILE  38  -7.266   2.995   1.719
  286   1HD1  ILE  38           HMD1     ILE  38  -4.656   0.466   2.166
  287   2HD1  ILE  38           HMD1     ILE  38  -3.518   0.111   0.839
  288   3HD1  ILE  38           HMD1     ILE  38  -2.914   0.790   2.374
  289    H    ILE  39           HN       ILE  39  -6.446   6.083   0.402
  290    HA   ILE  39           HA       ILE  39  -8.323   7.292   0.889
  291    HB   ILE  39           HB       ILE  39  -8.715   5.203   3.084
  292   1HG1  ILE  39           HG1R     ILE  39  -9.619   4.897   0.208
  293   2HG1  ILE  39           HG1S     ILE  39  -8.008   4.354   0.756
  294   1HG2  ILE  39           HMG2     ILE  39 -10.648   6.889   1.490
  295   2HG2  ILE  39           HMG2     ILE  39 -11.134   5.464   2.446
  296   3HG2  ILE  39           HMG2     ILE  39 -10.389   6.869   3.255
  297   1HD1  ILE  39           HMD1     ILE  39  -9.749   3.252   2.619
  298   2HD1  ILE  39           HMD1     ILE  39 -10.619   3.097   1.069
  299   3HD1  ILE  39           HMD1     ILE  39  -8.982   2.410   1.247
  300    H    ASP  40           HN       ASP  40  -7.053   9.090   1.552
  301    HA   ASP  40           HA       ASP  40  -7.633   9.821   4.348
  302   1HB   ASP  40           HBS      ASP  40  -5.446   8.844   4.456
  303   2HB   ASP  40           HBR      ASP  40  -4.869   9.903   3.136
  304    H    MET  41           HN       MET  41  -5.378  11.568   2.346
  305    HA   MET  41           HA       MET  41  -5.419  13.704   1.538
  306   1HB   MET  41           HBS      MET  41  -8.396  13.180   1.331
  307   2HB   MET  41           HBR      MET  41  -7.606  14.697   0.815
  308   1HG   MET  41           HGS      MET  41  -6.269  13.515  -0.829
  309   2HG   MET  41           HGR      MET  41  -6.808  11.941  -0.193
  310   1HE   MET  41           HMEB     MET  41  -7.266  14.852  -2.305
  311   2HE   MET  41           HMEC     MET  41  -8.841  14.714  -3.126
  312   3HE   MET  41           HMEA     MET  41  -8.744  15.438  -1.501
  313    H    GLY  42           HN       GLY  42  -8.560  13.883   3.177
  314   1HA   GLY  42           HAR      GLY  42  -8.291  14.188   5.746
  315   2HA   GLY  42           HAS      GLY  42  -7.380  15.646   5.266
  316    HA   PRO  43           HA       PRO  43 -12.178  16.052   5.205
  317   1HB   PRO  43           HBS      PRO  43 -12.170  16.833   7.900
  318   2HB   PRO  43           HBR      PRO  43 -13.177  15.770   7.158
  319   1HG   PRO  43           HGS      PRO  43 -11.256  15.116   8.859
  320   2HG   PRO  43           HGR      PRO  43 -11.958  14.048   7.787
  321   1HD   PRO  43           HDS      PRO  43  -9.402  15.187   7.684
  322   2HD   PRO  43           HDR      PRO  43  -9.979  13.883   6.847
  323    H    GLU  44           HN       GLU  44  -9.774  17.919   6.811
  324    HA   GLU  44           HA       GLU  44  -9.063  20.072   6.472
  325   1HB   GLU  44           HBR      GLU  44 -10.818  19.933   4.010
  326   2HB   GLU  44           HBS      GLU  44  -9.723  21.144   4.399
  327   1HG   GLU  44           HGS      GLU  44  -8.113  18.940   4.651
  328   2HG   GLU  44           HGR      GLU  44  -9.071  18.520   3.204
  329    H    TRP  45           HN       TRP  45 -12.310  20.327   4.998
  330    HA   TRP  45           HA       TRP  45 -14.039  21.756   5.404
  331   1HB   TRP  45           HBS      TRP  45 -12.962  21.386   8.128
  332   2HB   TRP  45           HBR      TRP  45 -13.883  22.891   7.845
  333    HD1  TRP  45           HD1      TRP  45 -14.364  19.049   7.757
  334    HE1  TRP  45           HE1      TRP  45 -16.852  18.542   8.151
  335    HE3  TRP  45           HE3      TRP  45 -16.121  23.822   7.665
  336    HZ2  TRP  45           HZ2      TRP  45 -19.226  20.008   8.434
  337    HZ3  TRP  45           HZ3      TRP  45 -18.522  24.195   7.990
  338    HH2  TRP  45           HH2      TRP  45 -20.049  22.336   8.387
  339    H    ARG  46           HN       ARG  46 -11.973  23.508   7.635
  340    HA   ARG  46           HA       ARG  46 -10.739  25.422   7.470
  341   1HB   ARG  46           HBR      ARG  46 -10.192  23.899   5.065
  342   2HB   ARG  46           HBS      ARG  46 -10.112  25.655   4.742
  343   1HG   ARG  46           HGS      ARG  46  -8.614  24.247   6.976
  344   2HG   ARG  46           HGR      ARG  46  -7.925  24.622   5.370
  345   1HD   ARG  46           HDS      ARG  46  -7.237  26.469   6.441
  346   2HD   ARG  46           HDR      ARG  46  -8.875  27.033   6.009
  347    HE   ARG  46           HE       ARG  46  -9.558  26.706   8.262
  348   1HH1  ARG  46           HH1Z     ARG  46  -6.224  25.654   7.805
  349   2HH1  ARG  46           HH1E     ARG  46  -5.820  25.844   9.478
  350   1HH2  ARG  46           HH2Z     ARG  46  -8.956  27.068  10.418
  351   2HH2  ARG  46           HH2E     ARG  46  -7.365  26.643  10.958
  352    H    ALA  47           HN       ALA  47 -11.986  25.522   4.144
  353    HA   ALA  47           HA       ALA  47 -14.315  27.000   4.741
  354   1HB   ALA  47           HMBC     ALA  47 -12.321  28.696   5.083
  355   2HB   ALA  47           HMBA     ALA  47 -12.404  28.794   3.305
  356   3HB   ALA  47           HMBB     ALA  47 -13.839  29.185   4.287
  357    H    PHE  48           HN       PHE  48 -14.601  28.454   2.386
  358    HA   PHE  48           HA       PHE  48 -14.544  26.363   0.300
  359   1HB   PHE  48           HBS      PHE  48 -15.754  29.162   0.275
  360   2HB   PHE  48           HBR      PHE  48 -15.736  28.040  -1.116
  361    HD1  PHE  48           HD2      PHE  48 -16.377  25.436   0.309
  362    HD2  PHE  48           HD1      PHE  48 -17.915  29.377   0.825
  363    HE1  PHE  48           HE2      PHE  48 -18.517  24.490   1.114
  364    HE2  PHE  48           HE1      PHE  48 -20.047  28.464   1.623
  365    HZ   PHE  48           HZ       PHE  48 -20.373  26.021   1.713
  366    H    ASP  49           HN       ASP  49 -12.721  26.133  -0.735
  367    HA   ASP  49           HA       ASP  49 -11.324  28.590  -1.637
  368   1HB   ASP  49           HBR      ASP  49 -10.101  26.873  -0.088
  369   2HB   ASP  49           HBS      ASP  49  -9.891  25.977  -1.621
  370    H    ALA  50           HN       ALA  50 -11.307  25.185  -2.704
  371    HA   ALA  50           HA       ALA  50 -12.042  26.169  -5.423
  372   1HB   ALA  50           HMBC     ALA  50  -9.665  25.342  -5.172
  373   2HB   ALA  50           HMBB     ALA  50 -10.352  23.731  -4.845
  374   3HB   ALA  50           HMBA     ALA  50 -10.658  24.530  -6.408
   
  No H/Q in entry =         374
  Start of MODEL   20
    1   1H    MET   1           HNB      MET   1  -7.964  -0.576  -9.880
    2   2H    MET   1           HN       MET   1  -9.190   0.481 -10.099
    3   3H    MET   1           HNC      MET   1  -9.304  -0.676  -8.951
    4    HA   MET   1           HA       MET   1  -9.798  -2.314 -10.330
    5   1HB   MET   1           HBR      MET   1 -11.517  -0.539 -10.515
    6   2HB   MET   1           HBS      MET   1 -10.665   0.104 -11.949
    7   1HG   MET   1           HGS      MET   1 -10.941  -2.177 -13.025
    8   2HG   MET   1           HGR      MET   1 -11.962  -2.629 -11.637
    9   1HE   MET   1           HMEB     MET   1 -11.911  -1.687 -14.974
   10   2HE   MET   1           HMEA     MET   1 -13.398  -2.610 -14.640
   11   3HE   MET   1           HMEC     MET   1 -13.503  -0.974 -15.338
   12    H    VAL   2           HN       VAL   2  -8.416   0.308 -12.341
   13    HA   VAL   2           HA       VAL   2  -7.775  -1.293 -14.513
   14    HB   VAL   2           HB       VAL   2  -6.190   0.528 -15.138
   15   1HG1  VAL   2           HMGS     VAL   2  -8.951   0.502 -15.072
   16   2HG1  VAL   2           HMGS     VAL   2  -8.534   2.101 -14.410
   17   3HG1  VAL   2           HMGS     VAL   2  -7.922   1.612 -16.009
   18   1HG2  VAL   2           HMGR     VAL   2  -6.246   1.133 -12.370
   19   2HG2  VAL   2           HMGR     VAL   2  -5.361   1.963 -13.671
   20   3HG2  VAL   2           HMGR     VAL   2  -6.999   2.499 -13.226
   21    H    ASN   3           HN       ASN   3  -5.979  -2.324 -15.265
   22    HA   ASN   3           HA       ASN   3  -4.178  -3.699 -15.130
   23   1HB   ASN   3           HBS      ASN   3  -3.303  -2.499 -12.524
   24   2HB   ASN   3           HBR      ASN   3  -2.341  -3.294 -13.805
   25   1HD2  ASN   3           HD2Z     ASN   3  -3.032  -0.254 -15.966
   26   2HD2  ASN   3           HD2E     ASN   3  -3.639  -1.877 -16.001
   27    H    LYS   4           HN       LYS   4  -5.289  -3.148 -11.770
   28    HA   LYS   4           HA       LYS   4  -6.330  -4.546 -10.269
   29   1HB   LYS   4           HBR      LYS   4  -7.750  -5.162 -12.356
   30   2HB   LYS   4           HBS      LYS   4  -6.735  -6.631 -12.408
   31   1HG   LYS   4           HGR      LYS   4  -7.745  -6.146  -9.719
   32   2HG   LYS   4           HGS      LYS   4  -9.078  -6.230 -10.907
   33   1HD   LYS   4           HDS      LYS   4  -6.907  -8.310 -10.644
   34   2HD   LYS   4           HDR      LYS   4  -8.431  -8.374  -9.802
   35   1HE   LYS   4           HES      LYS   4  -9.625  -8.933 -11.628
   36   2HE   LYS   4           HER      LYS   4  -8.601  -7.950 -12.714
   37   1HZ   LYS   4           HZC      LYS   4  -6.885  -9.681 -12.370
   38   2HZ   LYS   4           HZA      LYS   4  -8.002 -10.607 -11.621
   39   3HZ   LYS   4           HZB      LYS   4  -8.203 -10.194 -13.188
   40    H    GLN   5           HN       GLN   5  -4.602  -5.014  -9.047
   41    HA   GLN   5           HA       GLN   5  -3.110  -7.497  -9.611
   42   1HB   GLN   5           HBS      GLN   5  -0.995  -6.122  -8.968
   43   2HB   GLN   5           HBR      GLN   5  -1.587  -6.170 -10.652
   44   1HG   GLN   5           HGS      GLN   5  -0.898  -3.913  -9.965
   45   2HG   GLN   5           HGR      GLN   5  -2.633  -4.000 -10.383
   46   1HE2  GLN   5           HE2Z     GLN   5  -3.503  -2.381  -7.483
   47   2HE2  GLN   5           HE2E     GLN   5  -3.605  -2.527  -9.206
   48    H    LYS   6           HN       LYS   6  -1.945  -8.308  -7.830
   49    HA   LYS   6           HA       LYS   6  -2.214  -6.955  -5.280
   50   1HB   LYS   6           HBR      LYS   6  -4.314  -8.409  -5.518
   51   2HB   LYS   6           HBS      LYS   6  -3.214  -9.812  -5.403
   52   1HG   LYS   6           HGR      LYS   6  -2.438  -9.004  -3.196
   53   2HG   LYS   6           HGS      LYS   6  -3.577  -7.631  -3.310
   54   1HD   LYS   6           HDS      LYS   6  -5.391  -9.427  -3.621
   55   2HD   LYS   6           HDR      LYS   6  -4.190 -10.555  -3.052
   56   1HE   LYS   6           HES      LYS   6  -4.696 -10.071  -0.967
   57   2HE   LYS   6           HER      LYS   6  -4.140  -8.397  -1.251
   58   1HZ   LYS   6           HZC      LYS   6  -6.571  -8.423  -2.350
   59   2HZ   LYS   6           HZA      LYS   6  -6.796  -9.419  -1.075
   60   3HZ   LYS   6           HZB      LYS   6  -6.242  -7.901  -0.838
   61    H    VAL   7           HN       VAL   7  -0.055  -7.318  -6.866
   62    HA   VAL   7           HA       VAL   7   1.569  -9.273  -5.349
   63    HB   VAL   7           HB       VAL   7   2.472 -10.239  -7.356
   64   1HG1  VAL   7           HMGR     VAL   7   0.235 -11.040  -6.291
   65   2HG1  VAL   7           HMGR     VAL   7  -0.488 -10.455  -7.808
   66   3HG1  VAL   7           HMGR     VAL   7   0.768 -11.716  -7.849
   67   1HG2  VAL   7           HMGS     VAL   7   1.725  -8.000  -8.679
   68   2HG2  VAL   7           HMGS     VAL   7   2.179  -9.531  -9.464
   69   3HG2  VAL   7           HMGS     VAL   7   0.462  -9.135  -9.215
   70    H    CYS   8           HN       CYS   8   3.912  -9.102  -6.582
   71    HA   CYS   8           HA       CYS   8   4.590  -6.223  -6.768
   72   1HB   CYS   8           HBS      CYS   8   5.876  -7.810  -5.252
   73   2HB   CYS   8           HBR      CYS   8   6.480  -8.579  -6.747
   74    HA   PRO   9           HA       PRO   9   4.790  -6.638 -11.164
   75   1HB   PRO   9           HBR      PRO   9   4.956  -3.847 -11.145
   76   2HB   PRO   9           HBS      PRO   9   3.821  -4.794 -11.864
   77   1HG   PRO   9           HGS      PRO   9   3.392  -3.300  -9.726
   78   2HG   PRO   9           HGR      PRO   9   2.420  -4.572 -10.198
   79   1HD   PRO   9           HDS      PRO   9   4.258  -4.469  -8.071
   80   2HD   PRO   9           HDR      PRO   9   3.002  -5.523  -8.296
   81    H    ALA  10           HN       ALA  10   6.951  -5.857  -8.888
   82    HA   ALA  10           HA       ALA  10   9.075  -4.967 -10.755
   83   1HB   ALA  10           HMBA     ALA  10   8.625  -4.207  -8.232
   84   2HB   ALA  10           HMBB     ALA  10   9.655  -5.625  -7.912
   85   3HB   ALA  10           HMBC     ALA  10  10.255  -4.303  -8.945
   86    H    CYS  11           HN       CYS  11   9.052  -7.355  -8.092
   87    HA   CYS  11           HA       CYS  11  11.045  -8.800  -9.626
   88   1HB   CYS  11           HBS      CYS  11  11.563  -9.970  -7.598
   89   2HB   CYS  11           HBR      CYS  11  11.477  -8.209  -7.330
   90    H    GLU  12           HN       GLU  12   7.752  -9.066  -9.479
   91    HA   GLU  12           HA       GLU  12   6.162 -10.700  -9.655
   92   1HB   GLU  12           HBR      GLU  12   8.574 -12.072 -10.838
   93   2HB   GLU  12           HBS      GLU  12   7.149 -12.911 -10.553
   94   1HG   GLU  12           HGS      GLU  12   6.312 -10.541 -11.814
   95   2HG   GLU  12           HGR      GLU  12   7.648 -11.170 -12.817
   96    H    SER  13           HN       SER  13   6.942 -10.258  -7.195
   97    HA   SER  13           HA       SER  13   6.647 -13.001  -6.089
   98   1HB   SER  13           HBS      SER  13   7.747 -10.549  -4.694
   99   2HB   SER  13           HBR      SER  13   7.238 -12.042  -3.857
  100    HG   SER  13           HG       SER  13   8.668 -13.253  -5.237
  101    H    ALA  14           HN       ALA  14   5.377 -12.582  -3.830
  102    HA   ALA  14           HA       ALA  14   2.880 -11.209  -4.666
  103   1HB   ALA  14           HMBB     ALA  14   3.489 -14.029  -4.407
  104   2HB   ALA  14           HMBC     ALA  14   2.203 -13.556  -3.267
  105   3HB   ALA  14           HMBA     ALA  14   2.007 -13.244  -5.010
  106    H    GLU  15           HN       GLU  15   5.182 -11.587  -2.293
  107    HA   GLU  15           HA       GLU  15   3.296 -11.408   0.010
  108   1HB   GLU  15           HBR      GLU  15   6.303 -11.664   0.016
  109   2HB   GLU  15           HBS      GLU  15   5.244 -11.776   1.313
  110   1HG   GLU  15           HGS      GLU  15   4.310 -13.657  -0.585
  111   2HG   GLU  15           HGR      GLU  15   6.050 -13.984  -0.356
  112    H    LEU  16           HN       LEU  16   2.828  -9.492   0.770
  113    HA   LEU  16           HA       LEU  16   4.886  -7.339   0.667
  114   1HB   LEU  16           HBR      LEU  16   1.906  -6.994   0.280
  115   2HB   LEU  16           HBS      LEU  16   3.212  -5.811  -0.013
  116    HG   LEU  16           HG       LEU  16   2.606  -8.293  -1.639
  117   1HD1  LEU  16           HMDR     LEU  16   1.595  -5.631  -1.717
  118   2HD1  LEU  16           HMDR     LEU  16   2.689  -5.836  -3.108
  119   3HD1  LEU  16           HMDR     LEU  16   1.323  -6.955  -2.876
  120   1HD2  LEU  16           HMDS     LEU  16   4.994  -6.665  -1.289
  121   2HD2  LEU  16           HMDS     LEU  16   4.773  -8.193  -2.180
  122   3HD2  LEU  16           HMDS     LEU  16   4.416  -6.639  -2.975
  123    H    ILE  17           HN       ILE  17   4.709  -5.717   2.271
  124    HA   ILE  17           HA       ILE  17   3.350  -6.601   4.762
  125    HB   ILE  17           HB       ILE  17   5.621  -5.980   5.896
  126   1HG1  ILE  17           HG1R     ILE  17   6.494  -6.433   3.022
  127   2HG1  ILE  17           HG1S     ILE  17   6.739  -4.981   4.034
  128   1HG2  ILE  17           HMG2     ILE  17   4.531  -8.398   5.089
  129   2HG2  ILE  17           HMG2     ILE  17   6.229  -8.484   4.550
  130   3HG2  ILE  17           HMG2     ILE  17   5.852  -8.156   6.262
  131   1HD1  ILE  17           HMD1     ILE  17   8.016  -7.695   4.494
  132   2HD1  ILE  17           HMD1     ILE  17   8.808  -6.273   3.764
  133   3HD1  ILE  17           HMD1     ILE  17   8.280  -6.223   5.467
  134    H    TYR  18           HN       TYR  18   2.464  -5.021   5.868
  135    HA   TYR  18           HA       TYR  18   2.444  -2.422   4.572
  136   1HB   TYR  18           HBR      TYR  18   0.429  -3.806   5.428
  137   2HB   TYR  18           HBS      TYR  18   0.858  -3.162   7.037
  138    HD1  TYR  18           HD1      TYR  18   1.188  -0.488   7.053
  139    HD2  TYR  18           HD2      TYR  18  -1.119  -2.626   4.192
  140    HE1  TYR  18           HE1      TYR  18   0.087   1.606   6.386
  141    HE2  TYR  18           HE2      TYR  18  -2.239  -0.545   3.528
  142    HH   TYR  18           HH       TYR  18  -1.426   1.810   3.369
  143    H    ASP  19           HN       ASP  19   3.110  -0.515   5.338
  144    HA   ASP  19           HA       ASP  19   4.367  -0.465   8.027
  145   1HB   ASP  19           HBS      ASP  19   5.339   0.501   5.520
  146   2HB   ASP  19           HBR      ASP  19   5.059   1.879   6.620
  147    HA   PRO  20           HA       PRO  20   0.331   1.282   8.459
  148   1HB   PRO  20           HBR      PRO  20   0.315   1.042  11.163
  149   2HB   PRO  20           HBS      PRO  20  -0.370  -0.002  10.097
  150   1HG   PRO  20           HGS      PRO  20   1.990  -0.311  11.543
  151   2HG   PRO  20           HGR      PRO  20   1.065  -1.486  10.801
  152   1HD   PRO  20           HDS      PRO  20   3.411  -0.620   9.883
  153   2HD   PRO  20           HDR      PRO  20   2.283  -1.414   8.970
  154    H    GLU  21           HN       GLU  21   3.191   2.508   9.549
  155    HA   GLU  21           HA       GLU  21   2.069   4.768  11.056
  156   1HB   GLU  21           HBR      GLU  21   4.770   3.723  10.279
  157   2HB   GLU  21           HBS      GLU  21   4.606   5.355  10.631
  158   1HG   GLU  21           HGS      GLU  21   3.365   4.676  12.782
  159   2HG   GLU  21           HGR      GLU  21   4.160   3.089  12.595
  160    H    ARG  22           HN       ARG  22   3.918   4.246   8.024
  161    HA   ARG  22           HA       ARG  22   3.381   6.887   7.018
  162   1HB   ARG  22           HBR      ARG  22   4.386   4.346   5.709
  163   2HB   ARG  22           HBS      ARG  22   4.153   5.885   4.832
  164   1HG   ARG  22           HGS      ARG  22   5.829   6.976   6.152
  165   2HG   ARG  22           HGR      ARG  22   5.945   5.580   7.261
  166   1HD   ARG  22           HDS      ARG  22   6.603   4.231   5.205
  167   2HD   ARG  22           HDR      ARG  22   6.834   5.808   4.398
  168    HE   ARG  22           HE       ARG  22   8.339   6.181   6.559
  169   1HH1  ARG  22           HH1Z     ARG  22   7.981   3.147   4.801
  170   2HH1  ARG  22           HH1E     ARG  22   9.641   2.703   5.013
  171   1HH2  ARG  22           HH2Z     ARG  22  10.534   5.630   6.699
  172   2HH2  ARG  22           HH2E     ARG  22  11.086   4.107   6.088
  173    H    GLY  23           HN       GLY  23   1.779   3.769   6.845
  174   1HA   GLY  23           HAR      GLY  23  -0.410   3.306   6.066
  175   2HA   GLY  23           HAS      GLY  23  -0.457   4.904   5.276
  176    H    GLU  24           HN       GLU  24   2.263   2.661   5.052
  177    HA   GLU  24           HA       GLU  24   1.813   2.558   2.113
  178   1HB   GLU  24           HBS      GLU  24   3.664   3.769   2.905
  179   2HB   GLU  24           HBR      GLU  24   4.201   2.569   3.948
  180   1HG   GLU  24           HGS      GLU  24   5.282   1.424   2.257
  181   2HG   GLU  24           HGR      GLU  24   4.014   1.744   1.044
  182    H    ILE  25           HN       ILE  25   2.575   0.664   0.978
  183    HA   ILE  25           HA       ILE  25   2.926  -1.769   2.628
  184    HB   ILE  25           HB       ILE  25   1.344  -1.799   0.018
  185   1HG1  ILE  25           HG1R     ILE  25  -0.560  -2.308   1.887
  186   2HG1  ILE  25           HG1S     ILE  25   0.466  -1.156   2.788
  187   1HG2  ILE  25           HMG2     ILE  25   1.692  -3.846   2.218
  188   2HG2  ILE  25           HMG2     ILE  25   0.567  -4.000   0.842
  189   3HG2  ILE  25           HMG2     ILE  25   2.325  -3.923   0.552
  190   1HD1  ILE  25           HMD1     ILE  25  -0.119  -0.299   0.045
  191   2HD1  ILE  25           HMD1     ILE  25  -1.574  -0.497   1.058
  192   3HD1  ILE  25           HMD1     ILE  25  -0.259   0.587   1.587
  193    H    VAL  26           HN       VAL  26   4.555  -3.033   1.998
  194    HA   VAL  26           HA       VAL  26   6.047  -2.215  -0.442
  195    HB   VAL  26           HB       VAL  26   7.295  -3.013   2.184
  196   1HG1  VAL  26           HMGR     VAL  26   8.343  -1.537  -0.241
  197   2HG1  VAL  26           HMGR     VAL  26   9.220  -1.692   1.300
  198   3HG1  VAL  26           HMGR     VAL  26   8.822  -3.146   0.353
  199   1HG2  VAL  26           HMGS     VAL  26   6.321  -0.297   1.332
  200   2HG2  VAL  26           HMGS     VAL  26   6.090  -1.148   2.878
  201   3HG2  VAL  26           HMGS     VAL  26   7.688  -0.488   2.455
  202    H    CYS  27           HN       CYS  27   7.812  -3.815  -0.978
  203    HA   CYS  27           HA       CYS  27   6.738  -6.520  -0.873
  204   1HB   CYS  27           HBS      CYS  27   7.524  -5.378  -2.950
  205   2HB   CYS  27           HBR      CYS  27   9.188  -5.476  -2.315
  206    H    ALA  28           HN       ALA  28   7.272  -7.956   0.558
  207    HA   ALA  28           HA       ALA  28   9.553  -7.696   2.292
  208   1HB   ALA  28           HMBC     ALA  28   7.315  -8.764   2.799
  209   2HB   ALA  28           HMBA     ALA  28   7.882 -10.174   1.868
  210   3HB   ALA  28           HMBB     ALA  28   8.770  -9.650   3.322
  211    H    LYS  29           HN       LYS  29   9.445  -8.538  -0.897
  212    HA   LYS  29           HA       LYS  29  11.731 -10.413  -0.681
  213   1HB   LYS  29           HBR      LYS  29   9.577 -10.131  -2.523
  214   2HB   LYS  29           HBS      LYS  29  11.089  -9.727  -3.386
  215   1HG   LYS  29           HGR      LYS  29  10.964 -12.014  -3.729
  216   2HG   LYS  29           HGS      LYS  29  11.974 -11.937  -2.257
  217   1HD   LYS  29           HDS      LYS  29   9.685 -12.109  -1.018
  218   2HD   LYS  29           HDR      LYS  29   9.102 -12.708  -2.547
  219   1HE   LYS  29           HES      LYS  29   9.677 -14.696  -1.679
  220   2HE   LYS  29           HER      LYS  29  11.271 -14.239  -2.344
  221   1HZ   LYS  29           HZB      LYS  29  10.570 -13.439   0.363
  222   2HZ   LYS  29           HZC      LYS  29  11.046 -14.978   0.092
  223   3HZ   LYS  29           HZA      LYS  29  12.040 -13.737  -0.282
  224    H    CYS  30           HN       CYS  30  10.973  -7.800  -2.997
  225    HA   CYS  30           HA       CYS  30  13.806  -7.338  -3.174
  226   1HB   CYS  30           HBR      CYS  30  13.323  -6.002  -5.116
  227   2HB   CYS  30           HBS      CYS  30  12.463  -7.563  -5.161
  228    H    GLY  31           HN       GLY  31  11.535  -5.998  -1.175
  229   1HA   GLY  31           HAR      GLY  31  11.840  -4.263   0.308
  230   2HA   GLY  31           HAS      GLY  31  13.162  -3.644  -0.720
  231    H    TYR  32           HN       TYR  32  10.588  -4.120  -2.743
  232    HA   TYR  32           HA       TYR  32  10.567  -1.198  -3.181
  233   1HB   TYR  32           HBS      TYR  32  10.860  -2.602  -5.146
  234   2HB   TYR  32           HBR      TYR  32   9.358  -3.495  -4.774
  235    HD1  TYR  32           HD1      TYR  32  10.372   0.116  -5.195
  236    HD2  TYR  32           HD2      TYR  32   7.631  -2.981  -6.184
  237    HE1  TYR  32           HE1      TYR  32   9.187   1.655  -6.701
  238    HE2  TYR  32           HE2      TYR  32   6.444  -1.458  -7.701
  239    HH   TYR  32           HH       TYR  32   7.684   0.879  -9.123
  240    H    VAL  33           HN       VAL  33   8.903   0.090  -2.775
  241    HA   VAL  33           HA       VAL  33   6.678  -0.699  -1.177
  242    HB   VAL  33           HB       VAL  33   7.010   1.736  -2.944
  243   1HG1  VAL  33           HMGR     VAL  33   5.056   1.173  -0.704
  244   2HG1  VAL  33           HMGR     VAL  33   5.352   2.780  -1.409
  245   3HG1  VAL  33           HMGR     VAL  33   4.688   1.474  -2.420
  246   1HG2  VAL  33           HMGS     VAL  33   8.803   1.572  -1.311
  247   2HG2  VAL  33           HMGS     VAL  33   7.691   2.900  -0.902
  248   3HG2  VAL  33           HMGS     VAL  33   7.615   1.368  -0.001
  249    H    ILE  34           HN       ILE  34   4.423  -0.564  -1.799
  250    HA   ILE  34           HA       ILE  34   3.912  -1.328  -4.631
  251    HB   ILE  34           HB       ILE  34   2.545  -2.087  -2.010
  252   1HG1  ILE  34           HG1R     ILE  34   4.688  -3.206  -2.765
  253   2HG1  ILE  34           HG1S     ILE  34   3.310  -4.281  -2.398
  254   1HG2  ILE  34           HMG2     ILE  34   1.410  -2.052  -4.709
  255   2HG2  ILE  34           HMG2     ILE  34   1.313  -3.642  -3.908
  256   3HG2  ILE  34           HMG2     ILE  34   0.620  -2.202  -3.117
  257   1HD1  ILE  34           HMD1     ILE  34   2.896  -4.113  -4.994
  258   2HD1  ILE  34           HMD1     ILE  34   4.621  -3.660  -5.021
  259   3HD1  ILE  34           HMD1     ILE  34   4.122  -5.228  -4.331
  260    H    GLU  35           HN       GLU  35   1.847  -0.192  -1.966
  261    HA   GLU  35           HA       GLU  35   1.375   2.423  -3.270
  262   1HB   GLU  35           HBS      GLU  35   0.017   0.940  -4.445
  263   2HB   GLU  35           HBR      GLU  35  -0.505   0.084  -3.100
  264   1HG   GLU  35           HGS      GLU  35  -2.334   1.460  -3.779
  265   2HG   GLU  35           HGR      GLU  35  -1.709   2.319  -2.345
  266    H    GLU  36           HN       GLU  36  -0.344   3.616  -1.985
  267    HA   GLU  36           HA       GLU  36   0.103   3.144   0.931
  268   1HB   GLU  36           HBR      GLU  36   1.815   4.572  -0.106
  269   2HB   GLU  36           HBS      GLU  36   0.617   5.500  -0.827
  270   1HG   GLU  36           HGS      GLU  36   0.089   6.738   0.944
  271   2HG   GLU  36           HGR      GLU  36   0.322   5.432   2.137
  272    H    ASN  37           HN       ASN  37  -2.027   2.621   1.301
  273    HA   ASN  37           HA       ASN  37  -3.953   4.704   1.562
  274   1HB   ASN  37           HBS      ASN  37  -3.827   4.409  -0.948
  275   2HB   ASN  37           HBR      ASN  37  -4.610   2.823  -0.689
  276   1HD2  ASN  37           HD2Z     ASN  37  -6.701   6.334  -0.051
  277   2HD2  ASN  37           HD2E     ASN  37  -4.969   6.323  -0.005
  278    H    ILE  38           HN       ILE  38  -4.565   4.072   3.471
  279    HA   ILE  38           HA       ILE  38  -6.053   1.502   3.541
  280    HB   ILE  38           HB       ILE  38  -5.707   1.695   6.128
  281   1HG1  ILE  38           HG1R     ILE  38  -3.029   2.730   5.922
  282   2HG1  ILE  38           HG1S     ILE  38  -4.167   3.918   5.225
  283   1HG2  ILE  38           HMG2     ILE  38  -3.726   0.667   4.138
  284   2HG2  ILE  38           HMG2     ILE  38  -3.343   0.595   5.879
  285   3HG2  ILE  38           HMG2     ILE  38  -4.803  -0.216   5.251
  286   1HD1  ILE  38           HMD1     ILE  38  -5.198   2.871   7.714
  287   2HD1  ILE  38           HMD1     ILE  38  -3.548   3.511   7.936
  288   3HD1  ILE  38           HMD1     ILE  38  -4.824   4.553   7.251
  289    H    ILE  39           HN       ILE  39  -7.785   1.667   5.319
  290    HA   ILE  39           HA       ILE  39  -9.316   4.052   4.456
  291    HB   ILE  39           HB       ILE  39 -11.269   2.478   5.383
  292   1HG1  ILE  39           HG1R     ILE  39  -9.600   0.234   4.343
  293   2HG1  ILE  39           HG1S     ILE  39  -9.221   0.816   5.988
  294   1HG2  ILE  39           HMG2     ILE  39 -11.000   3.298   3.076
  295   2HG2  ILE  39           HMG2     ILE  39  -9.945   1.903   2.726
  296   3HG2  ILE  39           HMG2     ILE  39 -11.653   1.641   3.170
  297   1HD1  ILE  39           HMD1     ILE  39 -12.084   0.299   5.345
  298   2HD1  ILE  39           HMD1     ILE  39 -11.003  -1.111   5.513
  299   3HD1  ILE  39           HMD1     ILE  39 -11.178   0.047   6.860
  300    H    ASP  40           HN       ASP  40  -9.753   1.927   7.298
  301    HA   ASP  40           HA       ASP  40 -10.953   4.103   8.679
  302   1HB   ASP  40           HBS      ASP  40 -11.350   2.596  10.475
  303   2HB   ASP  40           HBR      ASP  40 -11.679   1.784   8.917
  304    H    MET  41           HN       MET  41  -9.247   5.645   8.510
  305    HA   MET  41           HA       MET  41  -7.997   5.787  11.118
  306   1HB   MET  41           HBS      MET  41  -6.350   4.835   9.126
  307   2HB   MET  41           HBR      MET  41  -6.011   6.589   9.119
  308   1HG   MET  41           HGS      MET  41  -5.632   6.495  11.586
  309   2HG   MET  41           HGR      MET  41  -5.920   4.739  11.535
  310   1HE   MET  41           HMEA     MET  41  -3.647   5.698  12.780
  311   2HE   MET  41           HMEB     MET  41  -2.991   4.116  12.289
  312   3HE   MET  41           HMEC     MET  41  -2.054   5.601  11.988
  313    H    GLY  42           HN       GLY  42  -6.495   8.029  10.820
  314   1HA   GLY  42           HAR      GLY  42  -7.334  10.255   9.516
  315   2HA   GLY  42           HAS      GLY  42  -8.656  10.004  10.690
  316    HA   PRO  43           HA       PRO  43  -6.500  11.795  13.970
  317   1HB   PRO  43           HBS      PRO  43  -6.621   9.932  15.912
  318   2HB   PRO  43           HBR      PRO  43  -7.754  11.091  15.641
  319   1HG   PRO  43           HGS      PRO  43  -7.860   8.360  15.064
  320   2HG   PRO  43           HGR      PRO  43  -9.128   9.437  15.198
  321   1HD   PRO  43           HDS      PRO  43  -8.191   8.451  12.890
  322   2HD   PRO  43           HDR      PRO  43  -9.165   9.780  13.029
  323    H    GLU  44           HN       GLU  44  -4.510  12.372  13.845
  324    HA   GLU  44           HA       GLU  44  -2.469  10.189  13.967
  325   1HB   GLU  44           HBR      GLU  44  -3.341  11.706  11.800
  326   2HB   GLU  44           HBS      GLU  44  -2.021  12.576  12.361
  327   1HG   GLU  44           HGS      GLU  44  -0.794  10.249  12.452
  328   2HG   GLU  44           HGR      GLU  44  -1.934   9.821  11.148
  329    H    TRP  45           HN       TRP  45  -0.318  11.989  13.518
  330    HA   TRP  45           HA       TRP  45   0.100  12.592  16.301
  331   1HB   TRP  45           HBS      TRP  45   1.692  11.947  14.061
  332   2HB   TRP  45           HBR      TRP  45   2.252  13.532  14.669
  333    HD1  TRP  45           HD1      TRP  45   1.327  10.143  16.403
  334    HE1  TRP  45           HE1      TRP  45   3.104   9.658  18.193
  335    HE3  TRP  45           HE3      TRP  45   4.219  14.273  15.722
  336    HZ2  TRP  45           HZ2      TRP  45   5.403  10.912  19.197
  337    HZ3  TRP  45           HZ3      TRP  45   6.198  14.566  17.136
  338    HH2  TRP  45           HH2      TRP  45   6.786  12.927  18.844
  339    H    ARG  46           HN       ARG  46  -0.558  14.443  13.404
  340    HA   ARG  46           HA       ARG  46   0.540  16.901  14.154
  341   1HB   ARG  46           HBR      ARG  46  -0.884  17.917  12.491
  342   2HB   ARG  46           HBS      ARG  46  -0.227  16.371  11.882
  343   1HG   ARG  46           HGS      ARG  46  -2.368  16.107  11.181
  344   2HG   ARG  46           HGR      ARG  46  -2.572  15.483  12.841
  345   1HD   ARG  46           HDS      ARG  46  -4.321  17.074  12.182
  346   2HD   ARG  46           HDR      ARG  46  -3.370  17.615  13.594
  347    HE   ARG  46           HE       ARG  46  -2.441  18.636  11.023
  348   1HH1  ARG  46           HH1Z     ARG  46  -4.250  19.225  13.991
  349   2HH1  ARG  46           HH1E     ARG  46  -4.421  20.919  13.680
  350   1HH2  ARG  46           HH2Z     ARG  46  -2.797  20.832  10.587
  351   2HH2  ARG  46           HH2E     ARG  46  -3.597  21.830  11.755
  352    H    ALA  47           HN       ALA  47  -2.229  15.275  15.368
  353    HA   ALA  47           HA       ALA  47  -2.896  17.674  17.007
  354   1HB   ALA  47           HMBB     ALA  47  -4.554  16.097  15.143
  355   2HB   ALA  47           HMBC     ALA  47  -5.280  16.402  16.742
  356   3HB   ALA  47           HMBA     ALA  47  -4.738  17.768  15.734
  357    H    PHE  48           HN       PHE  48  -2.211  17.136  18.955
  358    HA   PHE  48           HA       PHE  48  -3.250  14.593  20.107
  359   1HB   PHE  48           HBR      PHE  48  -1.573  14.761  21.893
  360   2HB   PHE  48           HBS      PHE  48  -0.797  14.617  20.289
  361    HD1  PHE  48           HD1      PHE  48  -0.314  16.850  19.118
  362    HD2  PHE  48           HD2      PHE  48  -0.637  16.421  23.345
  363    HE1  PHE  48           HE1      PHE  48   0.956  18.929  19.405
  364    HE2  PHE  48           HE2      PHE  48   0.648  18.511  23.662
  365    HZ   PHE  48           HZ       PHE  48   1.389  19.794  21.674
  366    H    ASP  49           HN       ASP  49  -2.957  18.078  20.295
  367    HA   ASP  49           HA       ASP  49  -4.259  19.633  21.289
  368   1HB   ASP  49           HBS      ASP  49  -5.951  17.391  20.705
  369   2HB   ASP  49           HBR      ASP  49  -6.522  18.241  22.170
  370    H    ALA  50           HN       ALA  50  -6.076  19.439  23.443
  371    HA   ALA  50           HA       ALA  50  -6.034  19.817  25.700
  372   1HB   ALA  50           HMBC     ALA  50  -5.317  17.327  25.647
  373   2HB   ALA  50           HMBB     ALA  50  -3.688  17.959  25.997
  374   3HB   ALA  50           HMBA     ALA  50  -5.033  18.289  27.120
   
  No H/Q in entry =         374
  Start of MODEL   21
    1   1H    MET   1           HNB      MET   1  -7.964  -0.576  -9.880
    2   2H    MET   1           HN       MET   1  -9.190   0.481 -10.099
    3   3H    MET   1           HNC      MET   1  -9.304  -0.676  -8.951
    4    HA   MET   1           HA       MET   1  -9.798  -2.314 -10.330
    5   1HB   MET   1           HBR      MET   1 -11.517  -0.539 -10.515
    6   2HB   MET   1           HBS      MET   1 -10.665   0.104 -11.949
    7   1HG   MET   1           HGS      MET   1 -10.941  -2.177 -13.025
    8   2HG   MET   1           HGR      MET   1 -11.962  -2.629 -11.637
    9   1HE   MET   1           HMEB     MET   1 -11.911  -1.687 -14.974
   10   2HE   MET   1           HMEA     MET   1 -13.398  -2.610 -14.640
   11   3HE   MET   1           HMEC     MET   1 -13.503  -0.974 -15.338
   12    H    VAL   2           HN       VAL   2  -8.416   0.308 -12.341
   13    HA   VAL   2           HA       VAL   2  -7.775  -1.293 -14.513
   14    HB   VAL   2           HB       VAL   2  -6.190   0.528 -15.138
   15   1HG1  VAL   2           HMGS     VAL   2  -8.951   0.502 -15.072
   16   2HG1  VAL   2           HMGS     VAL   2  -8.534   2.101 -14.410
   17   3HG1  VAL   2           HMGS     VAL   2  -7.922   1.612 -16.009
   18   1HG2  VAL   2           HMGR     VAL   2  -6.246   1.133 -12.370
   19   2HG2  VAL   2           HMGR     VAL   2  -5.361   1.963 -13.671
   20   3HG2  VAL   2           HMGR     VAL   2  -6.999   2.499 -13.226
   21    H    ASN   3           HN       ASN   3  -5.979  -2.324 -15.265
   22    HA   ASN   3           HA       ASN   3  -4.178  -3.699 -15.130
   23   1HB   ASN   3           HBS      ASN   3  -3.303  -2.499 -12.524
   24   2HB   ASN   3           HBR      ASN   3  -2.341  -3.294 -13.805
   25   1HD2  ASN   3           HD2Z     ASN   3  -3.032  -0.254 -15.966
   26   2HD2  ASN   3           HD2E     ASN   3  -3.639  -1.877 -16.001
   27    H    LYS   4           HN       LYS   4  -5.289  -3.148 -11.770
   28    HA   LYS   4           HA       LYS   4  -6.330  -4.546 -10.269
   29   1HB   LYS   4           HBR      LYS   4  -7.750  -5.162 -12.356
   30   2HB   LYS   4           HBS      LYS   4  -6.735  -6.631 -12.408
   31   1HG   LYS   4           HGR      LYS   4  -7.745  -6.146  -9.719
   32   2HG   LYS   4           HGS      LYS   4  -9.078  -6.230 -10.907
   33   1HD   LYS   4           HDS      LYS   4  -6.907  -8.310 -10.644
   34   2HD   LYS   4           HDR      LYS   4  -8.431  -8.374  -9.802
   35   1HE   LYS   4           HES      LYS   4  -9.625  -8.933 -11.628
   36   2HE   LYS   4           HER      LYS   4  -8.601  -7.950 -12.714
   37   1HZ   LYS   4           HZC      LYS   4  -6.885  -9.681 -12.370
   38   2HZ   LYS   4           HZA      LYS   4  -8.002 -10.607 -11.621
   39   3HZ   LYS   4           HZB      LYS   4  -8.203 -10.194 -13.188
   40    H    GLN   5           HN       GLN   5  -4.602  -5.014  -9.047
   41    HA   GLN   5           HA       GLN   5  -3.110  -7.497  -9.611
   42   1HB   GLN   5           HBS      GLN   5  -0.995  -6.122  -8.968
   43   2HB   GLN   5           HBR      GLN   5  -1.587  -6.170 -10.652
   44   1HG   GLN   5           HGS      GLN   5  -0.898  -3.913  -9.965
   45   2HG   GLN   5           HGR      GLN   5  -2.633  -4.000 -10.383
   46   1HE2  GLN   5           HE2Z     GLN   5  -3.503  -2.381  -7.483
   47   2HE2  GLN   5           HE2E     GLN   5  -3.605  -2.527  -9.206
   48    H    LYS   6           HN       LYS   6  -1.945  -8.308  -7.830
   49    HA   LYS   6           HA       LYS   6  -2.214  -6.955  -5.280
   50   1HB   LYS   6           HBR      LYS   6  -4.314  -8.409  -5.518
   51   2HB   LYS   6           HBS      LYS   6  -3.214  -9.812  -5.403
   52   1HG   LYS   6           HGR      LYS   6  -2.438  -9.004  -3.196
   53   2HG   LYS   6           HGS      LYS   6  -3.577  -7.631  -3.310
   54   1HD   LYS   6           HDS      LYS   6  -5.391  -9.427  -3.621
   55   2HD   LYS   6           HDR      LYS   6  -4.190 -10.555  -3.052
   56   1HE   LYS   6           HES      LYS   6  -4.696 -10.071  -0.967
   57   2HE   LYS   6           HER      LYS   6  -4.140  -8.397  -1.251
   58   1HZ   LYS   6           HZC      LYS   6  -6.571  -8.423  -2.350
   59   2HZ   LYS   6           HZA      LYS   6  -6.796  -9.419  -1.075
   60   3HZ   LYS   6           HZB      LYS   6  -6.242  -7.901  -0.838
   61    H    VAL   7           HN       VAL   7  -0.055  -7.318  -6.866
   62    HA   VAL   7           HA       VAL   7   1.569  -9.273  -5.349
   63    HB   VAL   7           HB       VAL   7   2.472 -10.239  -7.356
   64   1HG1  VAL   7           HMGR     VAL   7   0.235 -11.040  -6.291
   65   2HG1  VAL   7           HMGR     VAL   7  -0.488 -10.455  -7.808
   66   3HG1  VAL   7           HMGR     VAL   7   0.768 -11.716  -7.849
   67   1HG2  VAL   7           HMGS     VAL   7   1.725  -8.000  -8.679
   68   2HG2  VAL   7           HMGS     VAL   7   2.179  -9.531  -9.464
   69   3HG2  VAL   7           HMGS     VAL   7   0.462  -9.135  -9.215
   70    H    CYS   8           HN       CYS   8   3.912  -9.102  -6.582
   71    HA   CYS   8           HA       CYS   8   4.590  -6.223  -6.768
   72   1HB   CYS   8           HBS      CYS   8   5.876  -7.810  -5.252
   73   2HB   CYS   8           HBR      CYS   8   6.480  -8.579  -6.747
   74    HA   PRO   9           HA       PRO   9   4.790  -6.638 -11.164
   75   1HB   PRO   9           HBR      PRO   9   4.956  -3.847 -11.145
   76   2HB   PRO   9           HBS      PRO   9   3.821  -4.794 -11.864
   77   1HG   PRO   9           HGS      PRO   9   3.392  -3.300  -9.726
   78   2HG   PRO   9           HGR      PRO   9   2.420  -4.572 -10.198
   79   1HD   PRO   9           HDS      PRO   9   4.258  -4.469  -8.071
   80   2HD   PRO   9           HDR      PRO   9   3.002  -5.523  -8.296
   81    H    ALA  10           HN       ALA  10   6.951  -5.857  -8.888
   82    HA   ALA  10           HA       ALA  10   9.075  -4.967 -10.755
   83   1HB   ALA  10           HMBA     ALA  10   8.625  -4.207  -8.232
   84   2HB   ALA  10           HMBB     ALA  10   9.655  -5.625  -7.912
   85   3HB   ALA  10           HMBC     ALA  10  10.255  -4.303  -8.945
   86    H    CYS  11           HN       CYS  11   9.052  -7.355  -8.092
   87    HA   CYS  11           HA       CYS  11  11.045  -8.800  -9.626
   88   1HB   CYS  11           HBS      CYS  11  11.563  -9.970  -7.598
   89   2HB   CYS  11           HBR      CYS  11  11.477  -8.209  -7.330
   90    H    GLU  12           HN       GLU  12   7.752  -9.066  -9.479
   91    HA   GLU  12           HA       GLU  12   6.162 -10.700  -9.655
   92   1HB   GLU  12           HBR      GLU  12   8.574 -12.072 -10.838
   93   2HB   GLU  12           HBS      GLU  12   7.149 -12.911 -10.553
   94   1HG   GLU  12           HGS      GLU  12   6.312 -10.541 -11.814
   95   2HG   GLU  12           HGR      GLU  12   7.648 -11.170 -12.817
   96    H    SER  13           HN       SER  13   6.942 -10.258  -7.195
   97    HA   SER  13           HA       SER  13   6.647 -13.001  -6.089
   98   1HB   SER  13           HBS      SER  13   7.747 -10.549  -4.694
   99   2HB   SER  13           HBR      SER  13   7.238 -12.042  -3.857
  100    HG   SER  13           HG       SER  13   8.668 -13.253  -5.237
  101    H    ALA  14           HN       ALA  14   5.377 -12.582  -3.830
  102    HA   ALA  14           HA       ALA  14   2.880 -11.209  -4.666
  103   1HB   ALA  14           HMBB     ALA  14   3.489 -14.029  -4.407
  104   2HB   ALA  14           HMBC     ALA  14   2.203 -13.556  -3.267
  105   3HB   ALA  14           HMBA     ALA  14   2.007 -13.244  -5.010
  106    H    GLU  15           HN       GLU  15   5.182 -11.587  -2.293
  107    HA   GLU  15           HA       GLU  15   3.296 -11.408   0.010
  108   1HB   GLU  15           HBR      GLU  15   6.303 -11.664   0.016
  109   2HB   GLU  15           HBS      GLU  15   5.244 -11.776   1.313
  110   1HG   GLU  15           HGS      GLU  15   4.310 -13.657  -0.585
  111   2HG   GLU  15           HGR      GLU  15   6.050 -13.984  -0.356
  112    H    LEU  16           HN       LEU  16   2.828  -9.492   0.770
  113    HA   LEU  16           HA       LEU  16   4.886  -7.339   0.667
  114   1HB   LEU  16           HBR      LEU  16   1.906  -6.994   0.280
  115   2HB   LEU  16           HBS      LEU  16   3.212  -5.811  -0.013
  116    HG   LEU  16           HG       LEU  16   2.606  -8.293  -1.639
  117   1HD1  LEU  16           HMDR     LEU  16   1.595  -5.631  -1.717
  118   2HD1  LEU  16           HMDR     LEU  16   2.689  -5.836  -3.108
  119   3HD1  LEU  16           HMDR     LEU  16   1.323  -6.955  -2.876
  120   1HD2  LEU  16           HMDS     LEU  16   4.994  -6.665  -1.289
  121   2HD2  LEU  16           HMDS     LEU  16   4.773  -8.193  -2.180
  122   3HD2  LEU  16           HMDS     LEU  16   4.416  -6.639  -2.975
  123    H    ILE  17           HN       ILE  17   4.709  -5.717   2.271
  124    HA   ILE  17           HA       ILE  17   3.350  -6.601   4.762
  125    HB   ILE  17           HB       ILE  17   5.621  -5.980   5.896
  126   1HG1  ILE  17           HG1R     ILE  17   6.494  -6.433   3.022
  127   2HG1  ILE  17           HG1S     ILE  17   6.739  -4.981   4.034
  128   1HG2  ILE  17           HMG2     ILE  17   4.531  -8.398   5.089
  129   2HG2  ILE  17           HMG2     ILE  17   6.229  -8.484   4.550
  130   3HG2  ILE  17           HMG2     ILE  17   5.852  -8.156   6.262
  131   1HD1  ILE  17           HMD1     ILE  17   8.016  -7.695   4.494
  132   2HD1  ILE  17           HMD1     ILE  17   8.808  -6.273   3.764
  133   3HD1  ILE  17           HMD1     ILE  17   8.280  -6.223   5.467
  134    H    TYR  18           HN       TYR  18   2.464  -5.021   5.868
  135    HA   TYR  18           HA       TYR  18   2.444  -2.422   4.572
  136   1HB   TYR  18           HBR      TYR  18   0.429  -3.806   5.428
  137   2HB   TYR  18           HBS      TYR  18   0.858  -3.162   7.037
  138    HD1  TYR  18           HD1      TYR  18   1.188  -0.488   7.053
  139    HD2  TYR  18           HD2      TYR  18  -1.119  -2.626   4.192
  140    HE1  TYR  18           HE1      TYR  18   0.087   1.606   6.386
  141    HE2  TYR  18           HE2      TYR  18  -2.239  -0.545   3.528
  142    HH   TYR  18           HH       TYR  18  -1.426   1.810   3.369
  143    H    ASP  19           HN       ASP  19   3.110  -0.515   5.338
  144    HA   ASP  19           HA       ASP  19   4.367  -0.465   8.027
  145   1HB   ASP  19           HBS      ASP  19   5.339   0.501   5.520
  146   2HB   ASP  19           HBR      ASP  19   5.059   1.879   6.620
  147    HA   PRO  20           HA       PRO  20   0.331   1.282   8.459
  148   1HB   PRO  20           HBR      PRO  20   0.315   1.042  11.163
  149   2HB   PRO  20           HBS      PRO  20  -0.370  -0.002  10.097
  150   1HG   PRO  20           HGS      PRO  20   1.990  -0.311  11.543
  151   2HG   PRO  20           HGR      PRO  20   1.065  -1.486  10.801
  152   1HD   PRO  20           HDS      PRO  20   3.411  -0.620   9.883
  153   2HD   PRO  20           HDR      PRO  20   2.283  -1.414   8.970
  154    H    GLU  21           HN       GLU  21   3.191   2.508   9.549
  155    HA   GLU  21           HA       GLU  21   2.069   4.768  11.056
  156   1HB   GLU  21           HBR      GLU  21   4.770   3.723  10.279
  157   2HB   GLU  21           HBS      GLU  21   4.606   5.355  10.631
  158   1HG   GLU  21           HGS      GLU  21   3.365   4.676  12.782
  159   2HG   GLU  21           HGR      GLU  21   4.160   3.089  12.595
  160    H    ARG  22           HN       ARG  22   3.918   4.246   8.024
  161    HA   ARG  22           HA       ARG  22   3.381   6.887   7.018
  162   1HB   ARG  22           HBR      ARG  22   4.386   4.346   5.709
  163   2HB   ARG  22           HBS      ARG  22   4.153   5.885   4.832
  164   1HG   ARG  22           HGS      ARG  22   5.829   6.976   6.152
  165   2HG   ARG  22           HGR      ARG  22   5.945   5.580   7.261
  166   1HD   ARG  22           HDS      ARG  22   6.603   4.231   5.205
  167   2HD   ARG  22           HDR      ARG  22   6.834   5.808   4.398
  168    HE   ARG  22           HE       ARG  22   8.339   6.181   6.559
  169   1HH1  ARG  22           HH1Z     ARG  22   7.981   3.147   4.801
  170   2HH1  ARG  22           HH1E     ARG  22   9.641   2.703   5.013
  171   1HH2  ARG  22           HH2Z     ARG  22  10.534   5.630   6.699
  172   2HH2  ARG  22           HH2E     ARG  22  11.086   4.107   6.088
  173    H    GLY  23           HN       GLY  23   1.779   3.769   6.845
  174   1HA   GLY  23           HAR      GLY  23  -0.410   3.306   6.066
  175   2HA   GLY  23           HAS      GLY  23  -0.457   4.904   5.276
  176    H    GLU  24           HN       GLU  24   2.263   2.661   5.052
  177    HA   GLU  24           HA       GLU  24   1.813   2.558   2.113
  178   1HB   GLU  24           HBS      GLU  24   3.664   3.769   2.905
  179   2HB   GLU  24           HBR      GLU  24   4.201   2.569   3.948
  180   1HG   GLU  24           HGS      GLU  24   5.282   1.424   2.257
  181   2HG   GLU  24           HGR      GLU  24   4.014   1.744   1.044
  182    H    ILE  25           HN       ILE  25   2.575   0.664   0.978
  183    HA   ILE  25           HA       ILE  25   2.926  -1.769   2.628
  184    HB   ILE  25           HB       ILE  25   1.344  -1.799   0.018
  185   1HG1  ILE  25           HG1R     ILE  25  -0.560  -2.308   1.887
  186   2HG1  ILE  25           HG1S     ILE  25   0.466  -1.156   2.788
  187   1HG2  ILE  25           HMG2     ILE  25   1.692  -3.846   2.218
  188   2HG2  ILE  25           HMG2     ILE  25   0.567  -4.000   0.842
  189   3HG2  ILE  25           HMG2     ILE  25   2.325  -3.923   0.552
  190   1HD1  ILE  25           HMD1     ILE  25  -0.119  -0.299   0.045
  191   2HD1  ILE  25           HMD1     ILE  25  -1.574  -0.497   1.058
  192   3HD1  ILE  25           HMD1     ILE  25  -0.259   0.587   1.587
  193    H    VAL  26           HN       VAL  26   4.555  -3.033   1.998
  194    HA   VAL  26           HA       VAL  26   6.047  -2.215  -0.442
  195    HB   VAL  26           HB       VAL  26   7.295  -3.013   2.184
  196   1HG1  VAL  26           HMGR     VAL  26   8.343  -1.537  -0.241
  197   2HG1  VAL  26           HMGR     VAL  26   9.220  -1.692   1.300
  198   3HG1  VAL  26           HMGR     VAL  26   8.822  -3.146   0.353
  199   1HG2  VAL  26           HMGS     VAL  26   6.321  -0.297   1.332
  200   2HG2  VAL  26           HMGS     VAL  26   6.090  -1.148   2.878
  201   3HG2  VAL  26           HMGS     VAL  26   7.688  -0.488   2.455
  202    H    CYS  27           HN       CYS  27   7.812  -3.815  -0.978
  203    HA   CYS  27           HA       CYS  27   6.738  -6.520  -0.873
  204   1HB   CYS  27           HBS      CYS  27   7.524  -5.378  -2.950
  205   2HB   CYS  27           HBR      CYS  27   9.188  -5.476  -2.315
  206    H    ALA  28           HN       ALA  28   7.272  -7.956   0.558
  207    HA   ALA  28           HA       ALA  28   9.553  -7.696   2.292
  208   1HB   ALA  28           HMBC     ALA  28   7.315  -8.764   2.799
  209   2HB   ALA  28           HMBA     ALA  28   7.882 -10.174   1.868
  210   3HB   ALA  28           HMBB     ALA  28   8.770  -9.650   3.322
  211    H    LYS  29           HN       LYS  29   9.445  -8.538  -0.897
  212    HA   LYS  29           HA       LYS  29  11.731 -10.413  -0.681
  213   1HB   LYS  29           HBR      LYS  29   9.577 -10.131  -2.523
  214   2HB   LYS  29           HBS      LYS  29  11.089  -9.727  -3.386
  215   1HG   LYS  29           HGR      LYS  29  10.964 -12.014  -3.729
  216   2HG   LYS  29           HGS      LYS  29  11.974 -11.937  -2.257
  217   1HD   LYS  29           HDS      LYS  29   9.685 -12.109  -1.018
  218   2HD   LYS  29           HDR      LYS  29   9.102 -12.708  -2.547
  219   1HE   LYS  29           HES      LYS  29   9.677 -14.696  -1.679
  220   2HE   LYS  29           HER      LYS  29  11.271 -14.239  -2.344
  221   1HZ   LYS  29           HZB      LYS  29  10.570 -13.439   0.363
  222   2HZ   LYS  29           HZC      LYS  29  11.046 -14.978   0.092
  223   3HZ   LYS  29           HZA      LYS  29  12.040 -13.737  -0.282
  224    H    CYS  30           HN       CYS  30  10.973  -7.800  -2.997
  225    HA   CYS  30           HA       CYS  30  13.806  -7.338  -3.174
  226   1HB   CYS  30           HBR      CYS  30  13.323  -6.002  -5.116
  227   2HB   CYS  30           HBS      CYS  30  12.463  -7.563  -5.161
  228    H    GLY  31           HN       GLY  31  11.535  -5.998  -1.175
  229   1HA   GLY  31           HAR      GLY  31  11.840  -4.263   0.308
  230   2HA   GLY  31           HAS      GLY  31  13.162  -3.644  -0.720
  231    H    TYR  32           HN       TYR  32  10.588  -4.120  -2.743
  232    HA   TYR  32           HA       TYR  32  10.567  -1.198  -3.181
  233   1HB   TYR  32           HBS      TYR  32  10.860  -2.602  -5.146
  234   2HB   TYR  32           HBR      TYR  32   9.358  -3.495  -4.774
  235    HD1  TYR  32           HD1      TYR  32  10.372   0.116  -5.195
  236    HD2  TYR  32           HD2      TYR  32   7.631  -2.981  -6.184
  237    HE1  TYR  32           HE1      TYR  32   9.187   1.655  -6.701
  238    HE2  TYR  32           HE2      TYR  32   6.444  -1.458  -7.701
  239    HH   TYR  32           HH       TYR  32   7.684   0.879  -9.123
  240    H    VAL  33           HN       VAL  33   8.903   0.090  -2.775
  241    HA   VAL  33           HA       VAL  33   6.678  -0.699  -1.177
  242    HB   VAL  33           HB       VAL  33   7.010   1.736  -2.944
  243   1HG1  VAL  33           HMGR     VAL  33   5.056   1.173  -0.704
  244   2HG1  VAL  33           HMGR     VAL  33   5.352   2.780  -1.409
  245   3HG1  VAL  33           HMGR     VAL  33   4.688   1.474  -2.420
  246   1HG2  VAL  33           HMGS     VAL  33   8.803   1.572  -1.311
  247   2HG2  VAL  33           HMGS     VAL  33   7.691   2.900  -0.902
  248   3HG2  VAL  33           HMGS     VAL  33   7.615   1.368  -0.001
  249    H    ILE  34           HN       ILE  34   4.423  -0.564  -1.799
  250    HA   ILE  34           HA       ILE  34   3.912  -1.328  -4.631
  251    HB   ILE  34           HB       ILE  34   2.545  -2.087  -2.010
  252   1HG1  ILE  34           HG1R     ILE  34   4.688  -3.206  -2.765
  253   2HG1  ILE  34           HG1S     ILE  34   3.310  -4.281  -2.398
  254   1HG2  ILE  34           HMG2     ILE  34   1.410  -2.052  -4.709
  255   2HG2  ILE  34           HMG2     ILE  34   1.313  -3.642  -3.908
  256   3HG2  ILE  34           HMG2     ILE  34   0.620  -2.202  -3.117
  257   1HD1  ILE  34           HMD1     ILE  34   2.896  -4.113  -4.994
  258   2HD1  ILE  34           HMD1     ILE  34   4.621  -3.660  -5.021
  259   3HD1  ILE  34           HMD1     ILE  34   4.122  -5.228  -4.331
  260    H    GLU  35           HN       GLU  35   1.847  -0.192  -1.966
  261    HA   GLU  35           HA       GLU  35   1.375   2.423  -3.270
  262   1HB   GLU  35           HBS      GLU  35   0.017   0.940  -4.445
  263   2HB   GLU  35           HBR      GLU  35  -0.505   0.084  -3.100
  264   1HG   GLU  35           HGS      GLU  35  -2.334   1.460  -3.779
  265   2HG   GLU  35           HGR      GLU  35  -1.709   2.319  -2.345
  266    H    GLU  36           HN       GLU  36  -0.344   3.616  -1.985
  267    HA   GLU  36           HA       GLU  36   0.103   3.144   0.931
  268   1HB   GLU  36           HBR      GLU  36   1.815   4.572  -0.106
  269   2HB   GLU  36           HBS      GLU  36   0.617   5.500  -0.827
  270   1HG   GLU  36           HGS      GLU  36   0.089   6.738   0.944
  271   2HG   GLU  36           HGR      GLU  36   0.322   5.432   2.137
  272    H    ASN  37           HN       ASN  37  -2.027   2.621   1.301
  273    HA   ASN  37           HA       ASN  37  -3.953   4.704   1.562
  274   1HB   ASN  37           HBS      ASN  37  -3.827   4.409  -0.948
  275   2HB   ASN  37           HBR      ASN  37  -4.610   2.823  -0.689
  276   1HD2  ASN  37           HD2Z     ASN  37  -6.701   6.334  -0.051
  277   2HD2  ASN  37           HD2E     ASN  37  -4.969   6.323  -0.005
  278    H    ILE  38           HN       ILE  38  -4.565   4.072   3.471
  279    HA   ILE  38           HA       ILE  38  -6.053   1.502   3.541
  280    HB   ILE  38           HB       ILE  38  -5.707   1.695   6.128
  281   1HG1  ILE  38           HG1R     ILE  38  -3.029   2.730   5.922
  282   2HG1  ILE  38           HG1S     ILE  38  -4.167   3.918   5.225
  283   1HG2  ILE  38           HMG2     ILE  38  -3.726   0.667   4.138
  284   2HG2  ILE  38           HMG2     ILE  38  -3.343   0.595   5.879
  285   3HG2  ILE  38           HMG2     ILE  38  -4.803  -0.216   5.251
  286   1HD1  ILE  38           HMD1     ILE  38  -5.198   2.871   7.714
  287   2HD1  ILE  38           HMD1     ILE  38  -3.548   3.511   7.936
  288   3HD1  ILE  38           HMD1     ILE  38  -4.824   4.553   7.251
  289    H    ILE  39           HN       ILE  39  -7.785   1.667   5.319
  290    HA   ILE  39           HA       ILE  39  -9.316   4.052   4.456
  291    HB   ILE  39           HB       ILE  39 -11.269   2.478   5.383
  292   1HG1  ILE  39           HG1R     ILE  39  -9.600   0.234   4.343
  293   2HG1  ILE  39           HG1S     ILE  39  -9.221   0.816   5.988
  294   1HG2  ILE  39           HMG2     ILE  39 -11.000   3.298   3.076
  295   2HG2  ILE  39           HMG2     ILE  39  -9.945   1.903   2.726
  296   3HG2  ILE  39           HMG2     ILE  39 -11.653   1.641   3.170
  297   1HD1  ILE  39           HMD1     ILE  39 -12.084   0.299   5.345
  298   2HD1  ILE  39           HMD1     ILE  39 -11.003  -1.111   5.513
  299   3HD1  ILE  39           HMD1     ILE  39 -11.178   0.047   6.860
  300    H    ASP  40           HN       ASP  40  -9.753   1.927   7.298
  301    HA   ASP  40           HA       ASP  40 -10.953   4.103   8.679
  302   1HB   ASP  40           HBS      ASP  40 -11.350   2.596  10.475
  303   2HB   ASP  40           HBR      ASP  40 -11.679   1.784   8.917
  304    H    MET  41           HN       MET  41  -9.247   5.645   8.510
  305    HA   MET  41           HA       MET  41  -7.997   5.787  11.118
  306   1HB   MET  41           HBS      MET  41  -6.350   4.835   9.126
  307   2HB   MET  41           HBR      MET  41  -6.011   6.589   9.119
  308   1HG   MET  41           HGS      MET  41  -5.632   6.495  11.586
  309   2HG   MET  41           HGR      MET  41  -5.920   4.739  11.535
  310   1HE   MET  41           HMEA     MET  41  -3.647   5.698  12.780
  311   2HE   MET  41           HMEB     MET  41  -2.991   4.116  12.289
  312   3HE   MET  41           HMEC     MET  41  -2.054   5.601  11.988
  313    H    GLY  42           HN       GLY  42  -6.495   8.029  10.820
  314   1HA   GLY  42           HAR      GLY  42  -7.334  10.255   9.516
  315   2HA   GLY  42           HAS      GLY  42  -8.656  10.004  10.690
  316    HA   PRO  43           HA       PRO  43  -6.500  11.795  13.970
  317   1HB   PRO  43           HBS      PRO  43  -6.621   9.932  15.912
  318   2HB   PRO  43           HBR      PRO  43  -7.754  11.091  15.641
  319   1HG   PRO  43           HGS      PRO  43  -7.860   8.360  15.064
  320   2HG   PRO  43           HGR      PRO  43  -9.128   9.437  15.198
  321   1HD   PRO  43           HDS      PRO  43  -8.191   8.451  12.890
  322   2HD   PRO  43           HDR      PRO  43  -9.165   9.780  13.029
  323    H    GLU  44           HN       GLU  44  -4.510  12.372  13.845
  324    HA   GLU  44           HA       GLU  44  -2.469  10.189  13.967
  325   1HB   GLU  44           HBR      GLU  44  -3.341  11.706  11.800
  326   2HB   GLU  44           HBS      GLU  44  -2.021  12.576  12.361
  327   1HG   GLU  44           HGS      GLU  44  -0.794  10.249  12.452
  328   2HG   GLU  44           HGR      GLU  44  -1.934   9.821  11.148
  329    H    TRP  45           HN       TRP  45  -0.318  11.989  13.518
  330    HA   TRP  45           HA       TRP  45   0.100  12.592  16.301
  331   1HB   TRP  45           HBS      TRP  45   1.692  11.947  14.061
  332   2HB   TRP  45           HBR      TRP  45   2.252  13.532  14.669
  333    HD1  TRP  45           HD1      TRP  45   1.327  10.143  16.403
  334    HE1  TRP  45           HE1      TRP  45   3.104   9.658  18.193
  335    HE3  TRP  45           HE3      TRP  45   4.219  14.273  15.722
  336    HZ2  TRP  45           HZ2      TRP  45   5.403  10.912  19.197
  337    HZ3  TRP  45           HZ3      TRP  45   6.198  14.566  17.136
  338    HH2  TRP  45           HH2      TRP  45   6.786  12.927  18.844
  339    H    ARG  46           HN       ARG  46  -0.558  14.443  13.404
  340    HA   ARG  46           HA       ARG  46   0.540  16.901  14.154
  341   1HB   ARG  46           HBR      ARG  46  -0.884  17.917  12.491
  342   2HB   ARG  46           HBS      ARG  46  -0.227  16.371  11.882
  343   1HG   ARG  46           HGS      ARG  46  -2.368  16.107  11.181
  344   2HG   ARG  46           HGR      ARG  46  -2.572  15.483  12.841
  345   1HD   ARG  46           HDS      ARG  46  -4.321  17.074  12.182
  346   2HD   ARG  46           HDR      ARG  46  -3.370  17.615  13.594
  347    HE   ARG  46           HE       ARG  46  -2.441  18.636  11.023
  348   1HH1  ARG  46           HH1Z     ARG  46  -4.250  19.225  13.991
  349   2HH1  ARG  46           HH1E     ARG  46  -4.421  20.919  13.680
  350   1HH2  ARG  46           HH2Z     ARG  46  -2.797  20.832  10.587
  351   2HH2  ARG  46           HH2E     ARG  46  -3.597  21.830  11.755
  352    H    ALA  47           HN       ALA  47  -2.229  15.275  15.368
  353    HA   ALA  47           HA       ALA  47  -2.896  17.674  17.007
  354   1HB   ALA  47           HMBB     ALA  47  -4.554  16.097  15.143
  355   2HB   ALA  47           HMBC     ALA  47  -5.280  16.402  16.742
  356   3HB   ALA  47           HMBA     ALA  47  -4.738  17.768  15.734
  357    H    PHE  48           HN       PHE  48  -2.211  17.136  18.955
  358    HA   PHE  48           HA       PHE  48  -3.250  14.593  20.107
  359   1HB   PHE  48           HBR      PHE  48  -1.573  14.761  21.893
  360   2HB   PHE  48           HBS      PHE  48  -0.797  14.617  20.289
  361    HD1  PHE  48           HD1      PHE  48  -0.314  16.850  19.118
  362    HD2  PHE  48           HD2      PHE  48  -0.637  16.421  23.345
  363    HE1  PHE  48           HE1      PHE  48   0.956  18.929  19.405
  364    HE2  PHE  48           HE2      PHE  48   0.648  18.511  23.662
  365    HZ   PHE  48           HZ       PHE  48   1.389  19.794  21.674
  366    H    ASP  49           HN       ASP  49  -2.957  18.078  20.295
  367    HA   ASP  49           HA       ASP  49  -4.259  19.633  21.289
  368   1HB   ASP  49           HBS      ASP  49  -5.951  17.391  20.705
  369   2HB   ASP  49           HBR      ASP  49  -6.522  18.241  22.170
  370    H    ALA  50           HN       ALA  50  -6.076  19.439  23.443
  371    HA   ALA  50           HA       ALA  50  -6.034  19.817  25.700
  372   1HB   ALA  50           HMBC     ALA  50  -5.317  17.327  25.647
  373   2HB   ALA  50           HMBB     ALA  50  -3.688  17.959  25.997
  374   3HB   ALA  50           HMBA     ALA  50  -5.033  18.289  27.120
   
  No H/Q in entry =         374
  Start of MODEL   22
    1   1H    MET   1           HNB      MET   1 -14.372   0.138  -5.164
    2   2H    MET   1           HNC      MET   1 -13.848   0.909  -6.506
    3   3H    MET   1           HN       MET   1 -15.406   0.431  -6.393
    4    HA   MET   1           HA       MET   1 -14.925  -1.795  -6.553
    5   1HB   MET   1           HBR      MET   1 -14.206   0.071  -8.561
    6   2HB   MET   1           HBS      MET   1 -12.964  -1.213  -8.573
    7   1HG   MET   1           HGS      MET   1 -14.633  -2.928  -8.884
    8   2HG   MET   1           HGR      MET   1 -15.950  -1.774  -8.559
    9   1HE   MET   1           HMEA     MET   1 -16.857  -2.820 -10.455
   10   2HE   MET   1           HMEB     MET   1 -17.048  -1.721 -11.846
   11   3HE   MET   1           HMEC     MET   1 -16.006  -3.159 -11.984
   12    H    VAL   2           HN       VAL   2 -12.365   0.226  -5.490
   13    HA   VAL   2           HA       VAL   2 -10.546  -0.219  -4.190
   14    HB   VAL   2           HB       VAL   2 -11.389  -3.122  -4.221
   15   1HG1  VAL   2           HMGS     VAL   2  -9.584  -1.489  -2.442
   16   2HG1  VAL   2           HMGS     VAL   2 -10.279  -3.045  -1.931
   17   3HG1  VAL   2           HMGS     VAL   2  -9.215  -2.972  -3.356
   18   1HG2  VAL   2           HMGR     VAL   2 -12.298  -0.927  -2.342
   19   2HG2  VAL   2           HMGR     VAL   2 -13.303  -1.845  -3.489
   20   3HG2  VAL   2           HMGR     VAL   2 -12.564  -2.670  -2.095
   21    H    ASN   3           HN       ASN   3 -10.565  -3.375  -5.802
   22    HA   ASN   3           HA       ASN   3  -9.001  -4.417  -7.055
   23   1HB   ASN   3           HBR      ASN   3  -9.694  -2.533  -8.639
   24   2HB   ASN   3           HBS      ASN   3  -8.119  -1.797  -8.219
   25   1HD2  ASN   3           HD2Z     ASN   3  -8.186  -5.413 -10.247
   26   2HD2  ASN   3           HD2E     ASN   3  -9.431  -5.035  -9.104
   27    H    LYS   4           HN       LYS   4  -7.694  -5.253  -5.611
   28    HA   LYS   4           HA       LYS   4  -5.235  -3.805  -4.836
   29   1HB   LYS   4           HBS      LYS   4  -7.514  -4.523  -3.005
   30   2HB   LYS   4           HBR      LYS   4  -5.829  -4.566  -2.414
   31   1HG   LYS   4           HGR      LYS   4  -5.885  -2.114  -3.608
   32   2HG   LYS   4           HGS      LYS   4  -7.580  -2.256  -3.058
   33   1HD   LYS   4           HDS      LYS   4  -5.323  -2.865  -1.182
   34   2HD   LYS   4           HDR      LYS   4  -5.735  -1.211  -1.544
   35   1HE   LYS   4           HES      LYS   4  -8.159  -2.605  -0.989
   36   2HE   LYS   4           HER      LYS   4  -6.965  -2.951   0.294
   37   1HZ   LYS   4           HZA      LYS   4  -6.942  -0.232  -0.405
   38   2HZ   LYS   4           HZB      LYS   4  -8.456  -0.685   0.007
   39   3HZ   LYS   4           HZC      LYS   4  -7.221  -0.919   1.050
   40    H    GLN   5           HN       GLN   5  -5.979  -6.210  -6.415
   41    HA   GLN   5           HA       GLN   5  -4.702  -8.321  -4.820
   42   1HB   GLN   5           HBR      GLN   5  -5.075  -9.768  -6.741
   43   2HB   GLN   5           HBS      GLN   5  -6.579  -8.986  -6.175
   44   1HG   GLN   5           HGS      GLN   5  -6.703  -7.591  -8.039
   45   2HG   GLN   5           HGR      GLN   5  -4.980  -7.826  -8.447
   46   1HE2  GLN   5           HE2Z     GLN   5  -5.408 -10.824 -10.217
   47   2HE2  GLN   5           HE2E     GLN   5  -4.308  -9.905  -9.244
   48    H    LYS   6           HN       LYS   6  -3.231  -5.907  -5.439
   49    HA   LYS   6           HA       LYS   6  -1.533  -6.428  -7.684
   50   1HB   LYS   6           HBS      LYS   6  -1.924  -4.297  -5.710
   51   2HB   LYS   6           HBR      LYS   6  -0.210  -4.539  -6.152
   52   1HG   LYS   6           HGR      LYS   6  -2.536  -3.885  -7.995
   53   2HG   LYS   6           HGS      LYS   6  -1.112  -2.872  -7.621
   54   1HD   LYS   6           HDS      LYS   6   0.315  -4.667  -8.644
   55   2HD   LYS   6           HDR      LYS   6  -1.151  -5.460  -9.151
   56   1HE   LYS   6           HES      LYS   6  -1.796  -3.597 -10.528
   57   2HE   LYS   6           HER      LYS   6  -0.406  -2.652  -9.925
   58   1HZ   LYS   6           HZA      LYS   6   0.984  -4.469 -10.863
   59   2HZ   LYS   6           HZB      LYS   6  -0.345  -5.048 -11.615
   60   3HZ   LYS   6           HZC      LYS   6   0.210  -3.552 -11.971
   61    H    VAL   7           HN       VAL   7  -0.261  -8.165  -7.599
   62    HA   VAL   7           HA       VAL   7   1.453  -8.956  -5.459
   63    HB   VAL   7           HB       VAL   7   2.761 -10.060  -7.200
   64   1HG1  VAL   7           HMGR     VAL   7   0.565 -10.994  -6.280
   65   2HG1  VAL   7           HMGR     VAL   7  -0.146 -10.540  -7.848
   66   3HG1  VAL   7           HMGR     VAL   7   1.198 -11.706  -7.784
   67   1HG2  VAL   7           HMGS     VAL   7   0.937  -8.611  -9.127
   68   2HG2  VAL   7           HMGS     VAL   7   2.707  -8.486  -8.990
   69   3HG2  VAL   7           HMGS     VAL   7   1.965  -9.996  -9.566
   70    H    CYS   8           HN       CYS   8   3.986  -8.918  -6.401
   71    HA   CYS   8           HA       CYS   8   4.741  -6.076  -6.776
   72   1HB   CYS   8           HBS      CYS   8   5.980  -7.608  -5.158
   73   2HB   CYS   8           HBR      CYS   8   6.577  -8.469  -6.604
   74    HA   PRO   9           HA       PRO   9   4.972  -6.784 -11.127
   75   1HB   PRO   9           HBR      PRO   9   5.070  -4.112 -11.575
   76   2HB   PRO   9           HBS      PRO   9   3.761  -5.082 -11.778
   77   1HG   PRO   9           HGS      PRO   9   4.233  -3.242  -9.760
   78   2HG   PRO   9           HGR      PRO   9   2.795  -3.985 -10.163
   79   1HD   PRO   9           HDS      PRO   9   4.305  -4.565  -8.005
   80   2HD   PRO   9           HDR      PRO   9   3.051  -5.482  -8.576
   81    H    ALA  10           HN       ALA  10   7.095  -5.864  -8.891
   82    HA   ALA  10           HA       ALA  10   9.237  -5.106 -10.791
   83   1HB   ALA  10           HMBB     ALA  10   8.753  -4.307  -8.236
   84   2HB   ALA  10           HMBA     ALA  10   9.920  -5.627  -7.970
   85   3HB   ALA  10           HMBC     ALA  10  10.343  -4.266  -9.040
   86    H    CYS  11           HN       CYS  11   9.158  -7.372  -8.020
   87    HA   CYS  11           HA       CYS  11  11.109  -8.939  -9.489
   88   1HB   CYS  11           HBS      CYS  11  11.601 -10.028  -7.405
   89   2HB   CYS  11           HBR      CYS  11  11.571  -8.254  -7.225
   90    H    GLU  12           HN       GLU  12   7.811  -9.109  -9.302
   91    HA   GLU  12           HA       GLU  12   6.177 -10.707  -9.399
   92   1HB   GLU  12           HBR      GLU  12   8.548 -12.156 -10.563
   93   2HB   GLU  12           HBS      GLU  12   7.138 -12.988 -10.197
   94   1HG   GLU  12           HGS      GLU  12   7.340 -12.142 -12.584
   95   2HG   GLU  12           HGR      GLU  12   5.756 -11.912 -11.792
   96    H    SER  13           HN       SER  13   6.981 -10.183  -6.967
   97    HA   SER  13           HA       SER  13   6.651 -12.872  -5.740
   98   1HB   SER  13           HBS      SER  13   7.796 -10.375  -4.469
   99   2HB   SER  13           HBR      SER  13   7.267 -11.815  -3.557
  100    HG   SER  13           HG       SER  13   8.752 -13.104  -4.471
  101    H    ALA  14           HN       ALA  14   5.271 -12.633  -3.684
  102    HA   ALA  14           HA       ALA  14   2.939 -10.915  -4.344
  103   1HB   ALA  14           HMBB     ALA  14   3.117 -13.628  -4.739
  104   2HB   ALA  14           HMBC     ALA  14   2.393 -13.533  -3.113
  105   3HB   ALA  14           HMBA     ALA  14   1.600 -12.727  -4.490
  106    H    GLU  15           HN       GLU  15   5.197 -11.748  -2.045
  107    HA   GLU  15           HA       GLU  15   3.353 -11.868   0.221
  108   1HB   GLU  15           HBR      GLU  15   6.363 -12.128   0.034
  109   2HB   GLU  15           HBS      GLU  15   5.421 -12.418   1.392
  110   1HG   GLU  15           HGS      GLU  15   5.211 -13.981  -1.166
  111   2HG   GLU  15           HGR      GLU  15   5.933 -14.612   0.339
  112    H    LEU  16           HN       LEU  16   3.210  -9.370  -0.795
  113    HA   LEU  16           HA       LEU  16   5.022  -7.509   0.304
  114   1HB   LEU  16           HBR      LEU  16   2.103  -7.040  -0.344
  115   2HB   LEU  16           HBS      LEU  16   3.459  -5.877  -0.414
  116    HG   LEU  16           HG       LEU  16   3.209  -8.284  -2.231
  117   1HD1  LEU  16           HMDR     LEU  16   2.056  -5.530  -2.389
  118   2HD1  LEU  16           HMDR     LEU  16   2.732  -6.247  -3.873
  119   3HD1  LEU  16           HMDR     LEU  16   1.420  -7.077  -3.000
  120   1HD2  LEU  16           HMDS     LEU  16   5.060  -5.971  -1.858
  121   2HD2  LEU  16           HMDS     LEU  16   5.403  -7.653  -2.338
  122   3HD2  LEU  16           HMDS     LEU  16   4.725  -6.507  -3.524
  123    H    ILE  17           HN       ILE  17   4.082  -5.668   1.770
  124    HA   ILE  17           HA       ILE  17   2.795  -6.723   4.194
  125    HB   ILE  17           HB       ILE  17   4.964  -6.082   5.487
  126   1HG1  ILE  17           HG1R     ILE  17   6.130  -6.556   2.717
  127   2HG1  ILE  17           HG1S     ILE  17   6.096  -5.008   3.606
  128   1HG2  ILE  17           HMG2     ILE  17   4.058  -8.386   5.255
  129   2HG2  ILE  17           HMG2     ILE  17   5.092  -8.599   3.817
  130   3HG2  ILE  17           HMG2     ILE  17   5.833  -8.311   5.413
  131   1HD1  ILE  17           HMD1     ILE  17   7.521  -7.480   4.618
  132   2HD1  ILE  17           HMD1     ILE  17   8.301  -6.226   3.617
  133   3HD1  ILE  17           HMD1     ILE  17   7.650  -5.807   5.224
  134    H    TYR  18           HN       TYR  18   2.402  -5.133   5.760
  135    HA   TYR  18           HA       TYR  18   2.162  -2.471   4.503
  136   1HB   TYR  18           HBS      TYR  18   0.228  -4.056   5.434
  137   2HB   TYR  18           HBR      TYR  18   0.640  -3.234   6.966
  138    HD1  TYR  18           HD2      TYR  18   0.601  -0.676   6.967
  139    HD2  TYR  18           HD1      TYR  18  -1.192  -2.976   3.872
  140    HE1  TYR  18           HE2      TYR  18  -0.853   1.222   6.411
  141    HE2  TYR  18           HE1      TYR  18  -2.617  -1.066   3.271
  142    HH   TYR  18           HH       TYR  18  -2.935   1.608   5.563
  143    H    ASP  19           HN       ASP  19   2.933  -0.663   5.359
  144    HA   ASP  19           HA       ASP  19   4.339  -0.862   7.966
  145   1HB   ASP  19           HBS      ASP  19   5.560  -0.236   5.639
  146   2HB   ASP  19           HBR      ASP  19   5.060   1.384   6.204
  147    HA   PRO  20           HA       PRO  20   0.575   1.271   8.740
  148   1HB   PRO  20           HBR      PRO  20   1.099   0.961  11.478
  149   2HB   PRO  20           HBS      PRO  20  -0.155   0.357  10.607
  150   1HG   PRO  20           HGS      PRO  20   1.845  -1.087  11.552
  151   2HG   PRO  20           HGR      PRO  20   0.828  -1.578  10.324
  152   1HD   PRO  20           HDS      PRO  20   3.499  -0.739  10.146
  153   2HD   PRO  20           HDR      PRO  20   2.610  -1.580   9.034
  154    H    GLU  21           HN       GLU  21   3.621   2.257   9.539
  155    HA   GLU  21           HA       GLU  21   2.894   4.581  11.067
  156   1HB   GLU  21           HBR      GLU  21   5.336   3.361   9.860
  157   2HB   GLU  21           HBS      GLU  21   5.377   5.008  10.176
  158   1HG   GLU  21           HGS      GLU  21   6.195   3.391  12.026
  159   2HG   GLU  21           HGR      GLU  21   5.297   4.854  12.510
  160    H    ARG  22           HN       ARG  22   4.117   4.083   7.736
  161    HA   ARG  22           HA       ARG  22   3.284   6.819   6.981
  162   1HB   ARG  22           HBR      ARG  22   4.810   4.617   5.594
  163   2HB   ARG  22           HBS      ARG  22   4.071   5.960   4.675
  164   1HG   ARG  22           HGS      ARG  22   6.297   6.621   5.009
  165   2HG   ARG  22           HGR      ARG  22   5.370   7.519   6.244
  166   1HD   ARG  22           HDS      ARG  22   7.032   6.752   7.554
  167   2HD   ARG  22           HDR      ARG  22   5.930   5.351   7.666
  168    HE   ARG  22           HE       ARG  22   7.363   4.134   6.217
  169   1HH1  ARG  22           HH1Z     ARG  22   8.512   7.445   6.601
  170   2HH1  ARG  22           HH1E     ARG  22  10.143   7.044   6.180
  171   1HH2  ARG  22           HH2Z     ARG  22   9.532   3.624   5.797
  172   2HH2  ARG  22           HH2E     ARG  22  10.721   4.882   5.723
  173    H    GLY  23           HN       GLY  23   2.157   3.575   7.062
  174   1HA   GLY  23           HAR      GLY  23   0.028   2.788   6.517
  175   2HA   GLY  23           HAS      GLY  23  -0.278   4.288   5.602
  176    H    GLU  24           HN       GLU  24   2.708   2.613   5.029
  177    HA   GLU  24           HA       GLU  24   2.008   2.466   2.187
  178   1HB   GLU  24           HBR      GLU  24   4.216   3.135   3.537
  179   2HB   GLU  24           HBS      GLU  24   4.477   1.478   3.499
  180   1HG   GLU  24           HGS      GLU  24   5.446   1.620   1.545
  181   2HG   GLU  24           HGR      GLU  24   3.858   1.949   0.802
  182    H    ILE  25           HN       ILE  25   2.477   0.539   0.930
  183    HA   ILE  25           HA       ILE  25   2.633  -1.993   2.462
  184    HB   ILE  25           HB       ILE  25   1.009  -1.783  -0.109
  185   1HG1  ILE  25           HG1R     ILE  25  -0.945  -2.078   1.727
  186   2HG1  ILE  25           HG1S     ILE  25   0.208  -1.110   2.689
  187   1HG2  ILE  25           HMG2     ILE  25   1.630  -3.917   1.839
  188   2HG2  ILE  25           HMG2     ILE  25  -0.049  -3.855   1.244
  189   3HG2  ILE  25           HMG2     ILE  25   1.302  -3.999   0.089
  190   1HD1  ILE  25           HMD1     ILE  25  -0.356  -0.152  -0.067
  191   2HD1  ILE  25           HMD1     ILE  25  -1.686  -0.030   1.117
  192   3HD1  ILE  25           HMD1     ILE  25  -0.121   0.759   1.449
  193    H    VAL  26           HN       VAL  26   4.486  -2.886   2.018
  194    HA   VAL  26           HA       VAL  26   5.824  -2.141  -0.534
  195    HB   VAL  26           HB       VAL  26   7.246  -2.760   2.050
  196   1HG1  VAL  26           HMGR     VAL  26   8.083  -1.350  -0.492
  197   2HG1  VAL  26           HMGR     VAL  26   9.053  -1.391   1.000
  198   3HG1  VAL  26           HMGR     VAL  26   8.675  -2.904   0.143
  199   1HG2  VAL  26           HMGS     VAL  26   5.865  -0.260   1.264
  200   2HG2  VAL  26           HMGS     VAL  26   6.247  -0.915   2.873
  201   3HG2  VAL  26           HMGS     VAL  26   7.508  -0.090   1.925
  202    H    CYS  27           HN       CYS  27   7.625  -3.672  -1.102
  203    HA   CYS  27           HA       CYS  27   6.674  -6.384  -1.010
  204   1HB   CYS  27           HBS      CYS  27   7.720  -5.200  -2.974
  205   2HB   CYS  27           HBR      CYS  27   9.291  -5.378  -2.143
  206    H    ALA  28           HN       ALA  28   7.066  -7.835   0.452
  207    HA   ALA  28           HA       ALA  28   9.128  -7.616   2.411
  208   1HB   ALA  28           HMBC     ALA  28   6.988  -8.749   2.773
  209   2HB   ALA  28           HMBB     ALA  28   7.460 -10.016   1.610
  210   3HB   ALA  28           HMBA     ALA  28   8.380  -9.808   3.122
  211    H    LYS  29           HN       LYS  29   9.455  -8.326  -0.798
  212    HA   LYS  29           HA       LYS  29  11.825 -10.036  -0.315
  213   1HB   LYS  29           HBR      LYS  29   9.777 -10.167  -2.186
  214   2HB   LYS  29           HBS      LYS  29  11.135  -9.441  -3.094
  215   1HG   LYS  29           HGR      LYS  29  11.758 -11.824  -1.403
  216   2HG   LYS  29           HGS      LYS  29  10.767 -12.101  -2.865
  217   1HD   LYS  29           HDS      LYS  29  12.486 -11.887  -4.221
  218   2HD   LYS  29           HDR      LYS  29  12.957 -10.377  -3.491
  219   1HE   LYS  29           HES      LYS  29  14.244 -11.472  -1.795
  220   2HE   LYS  29           HER      LYS  29  13.639 -13.065  -2.331
  221   1HZ   LYS  29           HZA      LYS  29  15.140 -11.286  -4.111
  222   2HZ   LYS  29           HZB      LYS  29  15.884 -12.374  -3.144
  223   3HZ   LYS  29           HZC      LYS  29  14.840 -12.881  -4.293
  224    H    CYS  30           HN       CYS  30  11.006  -7.513  -2.724
  225    HA   CYS  30           HA       CYS  30  13.825  -6.891  -2.808
  226   1HB   CYS  30           HBS      CYS  30  13.370  -5.699  -4.834
  227   2HB   CYS  30           HBR      CYS  30  12.575  -7.295  -4.841
  228    H    GLY  31           HN       GLY  31  11.357  -5.636  -0.993
  229   1HA   GLY  31           HAR      GLY  31  11.389  -3.813   0.398
  230   2HA   GLY  31           HAS      GLY  31  12.785  -3.177  -0.514
  231    H    TYR  32           HN       TYR  32  10.468  -3.855  -2.773
  232    HA   TYR  32           HA       TYR  32  10.291  -0.966  -3.329
  233   1HB   TYR  32           HBS      TYR  32  10.794  -2.481  -5.185
  234   2HB   TYR  32           HBR      TYR  32   9.270  -3.368  -4.898
  235    HD1  TYR  32           HD1      TYR  32  10.318   0.223  -5.415
  236    HD2  TYR  32           HD2      TYR  32   7.544  -2.870  -6.325
  237    HE1  TYR  32           HE1      TYR  32   9.067   1.775  -6.851
  238    HE2  TYR  32           HE2      TYR  32   6.292  -1.333  -7.772
  239    HH   TYR  32           HH       TYR  32   6.927   0.540  -9.222
  240    H    VAL  33           HN       VAL  33   8.544   0.248  -3.077
  241    HA   VAL  33           HA       VAL  33   6.380  -0.659  -1.391
  242    HB   VAL  33           HB       VAL  33   6.640   1.872  -3.030
  243   1HG1  VAL  33           HMGR     VAL  33   4.738   1.113  -0.807
  244   2HG1  VAL  33           HMGR     VAL  33   5.016   2.787  -1.347
  245   3HG1  VAL  33           HMGR     VAL  33   4.348   1.586  -2.479
  246   1HG2  VAL  33           HMGS     VAL  33   7.814   1.041  -0.458
  247   2HG2  VAL  33           HMGS     VAL  33   8.328   2.290  -1.618
  248   3HG2  VAL  33           HMGS     VAL  33   7.025   2.636  -0.455
  249    H    ILE  34           HN       ILE  34   4.105  -0.433  -2.049
  250    HA   ILE  34           HA       ILE  34   3.658  -1.317  -4.855
  251    HB   ILE  34           HB       ILE  34   2.486  -2.163  -2.173
  252   1HG1  ILE  34           HG1R     ILE  34   4.639  -3.120  -3.029
  253   2HG1  ILE  34           HG1S     ILE  34   3.359  -4.313  -2.662
  254   1HG2  ILE  34           HMG2     ILE  34   1.169  -2.293  -4.801
  255   2HG2  ILE  34           HMG2     ILE  34   1.222  -3.834  -3.904
  256   3HG2  ILE  34           HMG2     ILE  34   0.498  -2.388  -3.152
  257   1HD1  ILE  34           HMD1     ILE  34   2.835  -4.239  -5.176
  258   2HD1  ILE  34           HMD1     ILE  34   4.409  -3.419  -5.346
  259   3HD1  ILE  34           HMD1     ILE  34   4.329  -5.064  -4.662
  260    H    GLU  35           HN       GLU  35   1.594  -0.261  -2.148
  261    HA   GLU  35           HA       GLU  35   0.851   2.158  -3.706
  262   1HB   GLU  35           HBR      GLU  35  -0.917   0.086  -2.453
  263   2HB   GLU  35           HBS      GLU  35  -1.349   1.701  -2.318
  264   1HG   GLU  35           HGS      GLU  35  -2.246   1.787  -4.303
  265   2HG   GLU  35           HGR      GLU  35  -0.688   1.416  -5.089
  266    H    GLU  36           HN       GLU  36  -0.319   3.700  -2.131
  267    HA   GLU  36           HA       GLU  36   1.317   3.779   0.369
  268   1HB   GLU  36           HBS      GLU  36   1.420   6.179  -0.171
  269   2HB   GLU  36           HBR      GLU  36   2.383   5.174  -1.109
  270   1HG   GLU  36           HGS      GLU  36  -0.359   5.708  -2.139
  271   2HG   GLU  36           HGR      GLU  36   0.674   7.162  -2.103
  272    H    ASN  37           HN       ASN  37   0.010   3.696   2.047
  273    HA   ASN  37           HA       ASN  37  -1.709   4.090   3.477
  274   1HB   ASN  37           HBR      ASN  37  -2.154   6.332   3.879
  275   2HB   ASN  37           HBS      ASN  37  -0.493   6.262   3.225
  276   1HD2  ASN  37           HD2Z     ASN  37  -1.149   8.675   0.832
  277   2HD2  ASN  37           HD2E     ASN  37  -0.034   7.874   1.889
  278    H    ILE  38           HN       ILE  38  -4.018   5.222   3.620
  279    HA   ILE  38           HA       ILE  38  -5.657   4.275   1.354
  280    HB   ILE  38           HB       ILE  38  -5.703   3.037   4.149
  281   1HG1  ILE  38           HG1R     ILE  38  -5.110   1.828   1.419
  282   2HG1  ILE  38           HG1S     ILE  38  -3.904   2.247   2.668
  283   1HG2  ILE  38           HMG2     ILE  38  -7.696   2.949   1.925
  284   2HG2  ILE  38           HMG2     ILE  38  -7.436   1.492   2.921
  285   3HG2  ILE  38           HMG2     ILE  38  -7.942   3.021   3.689
  286   1HD1  ILE  38           HMD1     ILE  38  -5.188   0.618   4.185
  287   2HD1  ILE  38           HMD1     ILE  38  -5.961   0.041   2.686
  288   3HD1  ILE  38           HMD1     ILE  38  -4.191  -0.068   2.874
  289    H    ILE  39           HN       ILE  39  -6.459   6.305   1.089
  290    HA   ILE  39           HA       ILE  39  -7.742   8.168   1.454
  291    HB   ILE  39           HB       ILE  39  -8.689   6.870   4.051
  292   1HG1  ILE  39           HG1R     ILE  39  -9.032   5.222   2.377
  293   2HG1  ILE  39           HG1S     ILE  39 -10.613   5.998   2.674
  294   1HG2  ILE  39           HMG2     ILE  39  -9.178   9.383   3.142
  295   2HG2  ILE  39           HMG2     ILE  39 -10.551   8.486   2.443
  296   3HG2  ILE  39           HMG2     ILE  39 -10.266   8.450   4.203
  297   1HD1  ILE  39           HMD1     ILE  39  -9.767   7.503   0.613
  298   2HD1  ILE  39           HMD1     ILE  39  -8.906   5.986   0.242
  299   3HD1  ILE  39           HMD1     ILE  39 -10.682   5.985   0.409
  300    H    ASP  40           HN       ASP  40  -7.365  10.126   2.363
  301    HA   ASP  40           HA       ASP  40  -5.208  10.174   4.399
  302   1HB   ASP  40           HBR      ASP  40  -5.233  11.894   1.928
  303   2HB   ASP  40           HBS      ASP  40  -3.922  11.653   3.119
  304    H    MET  41           HN       MET  41  -8.192  11.399   3.331
  305    HA   MET  41           HA       MET  41  -7.821  14.015   4.573
  306   1HB   MET  41           HBR      MET  41  -9.280  13.014   2.388
  307   2HB   MET  41           HBS      MET  41 -10.495  13.530   3.591
  308   1HG   MET  41           HGS      MET  41  -9.283  15.731   3.779
  309   2HG   MET  41           HGR      MET  41  -8.210  15.192   2.465
  310   1HE   MET  41           HMEC     MET  41  -8.431  15.828   0.488
  311   2HE   MET  41           HMEB     MET  41  -9.551  14.722  -0.346
  312   3HE   MET  41           HMEA     MET  41  -9.817  16.482  -0.421
  313    H    GLY  42           HN       GLY  42  -7.769  11.814   6.369
  314   1HA   GLY  42           HAR      GLY  42  -8.394  11.557   8.578
  315   2HA   GLY  42           HAS      GLY  42  -9.297  13.089   8.406
  316    HA   PRO  43           HA       PRO  43 -12.133   9.170   7.767
  317   1HB   PRO  43           HBR      PRO  43 -11.275   7.417   9.691
  318   2HB   PRO  43           HBS      PRO  43 -11.358   7.142   8.075
  319   1HG   PRO  43           HGS      PRO  43  -9.111   7.376   9.532
  320   2HG   PRO  43           HGR      PRO  43  -9.199   7.286   7.869
  321   1HD   PRO  43           HDS      PRO  43  -8.733   9.541   9.469
  322   2HD   PRO  43           HDR      PRO  43  -8.449   9.353   7.850
  323    H    GLU  44           HN       GLU  44 -13.931   8.544   9.066
  324    HA   GLU  44           HA       GLU  44 -13.854   9.232  11.865
  325   1HB   GLU  44           HBS      GLU  44 -14.731  11.117   9.949
  326   2HB   GLU  44           HBR      GLU  44 -16.121  10.634  10.757
  327   1HG   GLU  44           HGS      GLU  44 -14.546  11.029  12.906
  328   2HG   GLU  44           HGR      GLU  44 -13.660  12.110  11.797
  329    H    TRP  45           HN       TRP  45 -14.617   7.340  12.498
  330    HA   TRP  45           HA       TRP  45 -16.628   5.983  10.827
  331   1HB   TRP  45           HBS      TRP  45 -14.376   5.147  12.538
  332   2HB   TRP  45           HBR      TRP  45 -15.826   4.105  12.596
  333    HD1  TRP  45           HD1      TRP  45 -16.695   3.998   9.612
  334    HE1  TRP  45           HE1      TRP  45 -15.221   2.942   7.794
  335    HE3  TRP  45           HE3      TRP  45 -12.218   4.311  12.007
  336    HZ2  TRP  45           HZ2      TRP  45 -12.500   2.366   7.433
  337    HZ3  TRP  45           HZ3      TRP  45 -10.214   3.484  10.862
  338    HH2  TRP  45           HH2      TRP  45 -10.339   2.537   8.619
  339    H    ARG  46           HN       ARG  46 -18.570   6.725  11.406
  340    HA   ARG  46           HA       ARG  46 -20.565   6.576  12.508
  341   1HB   ARG  46           HBR      ARG  46 -19.153   4.240  13.112
  342   2HB   ARG  46           HBS      ARG  46 -19.749   4.832  14.690
  343   1HG   ARG  46           HGS      ARG  46 -21.831   4.168  14.246
  344   2HG   ARG  46           HGR      ARG  46 -21.818   4.965  12.646
  345   1HD   ARG  46           HDS      ARG  46 -20.827   3.090  11.619
  346   2HD   ARG  46           HDR      ARG  46 -20.463   2.332  13.195
  347    HE   ARG  46           HE       ARG  46 -23.241   2.676  13.076
  348   1HH1  ARG  46           HH1Z     ARG  46 -20.853   1.058  11.048
  349   2HH1  ARG  46           HH1E     ARG  46 -21.894  -0.284  10.705
  350   1HH2  ARG  46           HH2Z     ARG  46 -24.525   0.844  12.708
  351   2HH2  ARG  46           HH2E     ARG  46 -23.973  -0.404  11.642
  352    H    ALA  47           HN       ALA  47 -18.495   5.950  15.335
  353    HA   ALA  47           HA       ALA  47 -19.006   8.517  16.610
  354   1HB   ALA  47           HMBB     ALA  47 -21.242   7.278  16.486
  355   2HB   ALA  47           HMBA     ALA  47 -20.536   6.142  17.664
  356   3HB   ALA  47           HMBC     ALA  47 -20.703   7.866  18.079
  357    H    PHE  48           HN       PHE  48 -19.091   7.566  19.237
  358    HA   PHE  48           HA       PHE  48 -17.903   6.636  20.942
  359   1HB   PHE  48           HBS      PHE  48 -17.446   4.714  18.752
  360   2HB   PHE  48           HBR      PHE  48 -16.113   4.775  19.942
  361    HD1  PHE  48           HD2      PHE  48 -19.805   4.143  19.607
  362    HD2  PHE  48           HD1      PHE  48 -16.343   4.017  22.090
  363    HE1  PHE  48           HE2      PHE  48 -21.020   2.714  21.220
  364    HE2  PHE  48           HE1      PHE  48 -17.526   2.598  23.704
  365    HZ   PHE  48           HZ       PHE  48 -19.845   1.895  23.243
  366    H    ASP  49           HN       ASP  49 -15.695   6.655  18.113
  367    HA   ASP  49           HA       ASP  49 -13.641   7.574  17.804
  368   1HB   ASP  49           HBS      ASP  49 -14.769   9.583  19.066
  369   2HB   ASP  49           HBR      ASP  49 -13.637   9.096  20.360
  370    H    ALA  50           HN       ALA  50 -13.099   5.374  18.060
  371    HA   ALA  50           HA       ALA  50 -11.203   5.097  20.326
  372   1HB   ALA  50           HMBB     ALA  50 -13.374   3.565  20.327
  373   2HB   ALA  50           HMBC     ALA  50 -12.398   2.620  19.175
  374   3HB   ALA  50           HMBA     ALA  50 -11.772   2.952  20.809
   
  No H/Q in entry =         374
  Start of MODEL   23
    1   1H    MET   1           HNB      MET   1  -9.965  -2.286  -9.630
    2   2H    MET   1           HN       MET   1 -11.558  -2.405  -9.965
    3   3H    MET   1           HNC      MET   1 -10.526  -1.840 -11.097
    4    HA   MET   1           HA       MET   1 -10.339   0.178 -10.247
    5   1HB   MET   1           HBS      MET   1 -12.877  -0.793 -10.475
    6   2HB   MET   1           HBR      MET   1 -12.895  -0.179  -8.802
    7   1HG   MET   1           HGS      MET   1 -11.796   1.496 -11.100
    8   2HG   MET   1           HGR      MET   1 -13.538   1.440 -10.743
    9   1HE   MET   1           HMEC     MET   1 -14.631   2.569  -9.339
   10   2HE   MET   1           HMEA     MET   1 -14.252   2.199  -7.637
   11   3HE   MET   1           HMEB     MET   1 -14.094   3.867  -8.243
   12    H    VAL   2           HN       VAL   2 -11.239  -2.197  -7.775
   13    HA   VAL   2           HA       VAL   2 -10.045  -0.417  -5.717
   14    HB   VAL   2           HB       VAL   2 -12.405  -0.563  -5.480
   15   1HG1  VAL   2           HMGR     VAL   2 -12.227  -3.135  -6.515
   16   2HG1  VAL   2           HMGR     VAL   2 -12.740  -3.378  -4.827
   17   3HG1  VAL   2           HMGR     VAL   2 -13.690  -2.327  -5.904
   18   1HG2  VAL   2           HMGS     VAL   2 -10.771  -0.853  -3.463
   19   2HG2  VAL   2           HMGS     VAL   2 -12.528  -1.016  -3.234
   20   3HG2  VAL   2           HMGS     VAL   2 -11.507  -2.469  -3.353
   21    H    ASN   3           HN       ASN   3  -7.975  -1.306  -6.143
   22    HA   ASN   3           HA       ASN   3  -6.207  -2.532  -5.453
   23   1HB   ASN   3           HBR      ASN   3  -8.180  -3.333  -3.317
   24   2HB   ASN   3           HBS      ASN   3  -6.426  -3.679  -3.278
   25   1HD2  ASN   3           HD2Z     ASN   3  -5.428  -0.364  -2.536
   26   2HD2  ASN   3           HD2E     ASN   3  -4.938  -1.845  -3.291
   27    H    LYS   4           HN       LYS   4  -8.696  -4.915  -4.560
   28    HA   LYS   4           HA       LYS   4  -8.925  -7.131  -5.093
   29   1HB   LYS   4           HBR      LYS   4  -9.143  -5.866  -7.386
   30   2HB   LYS   4           HBS      LYS   4  -7.574  -6.647  -7.730
   31   1HG   LYS   4           HGR      LYS   4  -9.218  -8.683  -6.677
   32   2HG   LYS   4           HGS      LYS   4 -10.256  -7.763  -7.804
   33   1HD   LYS   4           HDS      LYS   4  -7.802  -8.067  -9.120
   34   2HD   LYS   4           HDR      LYS   4  -8.089  -9.597  -8.335
   35   1HE   LYS   4           HES      LYS   4 -10.341  -8.354  -9.840
   36   2HE   LYS   4           HER      LYS   4  -8.999  -9.126 -10.731
   37   1HZ   LYS   4           HZB      LYS   4  -9.399 -11.105  -9.406
   38   2HZ   LYS   4           HZC      LYS   4 -10.679 -10.396  -8.681
   39   3HZ   LYS   4           HZA      LYS   4 -10.713 -10.698 -10.286
   40    H    GLN   5           HN       GLN   5  -6.218  -5.940  -4.155
   41    HA   GLN   5           HA       GLN   5  -4.246  -6.818  -3.431
   42   1HB   GLN   5           HBR      GLN   5  -6.282  -8.618  -2.967
   43   2HB   GLN   5           HBS      GLN   5  -5.013  -9.619  -3.728
   44   1HG   GLN   5           HGS      GLN   5  -3.488  -9.214  -2.029
   45   2HG   GLN   5           HGR      GLN   5  -4.324  -7.728  -1.496
   46   1HE2  GLN   5           HE2Z     GLN   5  -5.577 -11.457  -0.269
   47   2HE2  GLN   5           HE2E     GLN   5  -4.698 -11.261  -1.748
   48    H    LYS   6           HN       LYS   6  -2.645  -6.426  -4.784
   49    HA   LYS   6           HA       LYS   6  -2.333  -8.192  -7.150
   50   1HB   LYS   6           HBR      LYS   6  -1.569  -5.339  -6.539
   51   2HB   LYS   6           HBS      LYS   6  -0.756  -6.257  -7.837
   52   1HG   LYS   6           HGR      LYS   6  -3.772  -5.990  -7.701
   53   2HG   LYS   6           HGS      LYS   6  -2.744  -4.766  -8.500
   54   1HD   LYS   6           HDS      LYS   6  -2.508  -7.665  -9.226
   55   2HD   LYS   6           HDR      LYS   6  -3.824  -6.707  -9.845
   56   1HE   LYS   6           HES      LYS   6  -1.227  -5.388 -10.118
   57   2HE   LYS   6           HER      LYS   6  -1.374  -6.939 -10.993
   58   1HZ   LYS   6           HZC      LYS   6  -3.565  -5.953 -11.774
   59   2HZ   LYS   6           HZA      LYS   6  -2.955  -4.508 -11.316
   60   3HZ   LYS   6           HZB      LYS   6  -2.188  -5.394 -12.453
   61    H    VAL   7           HN       VAL   7   0.129  -7.953  -7.918
   62    HA   VAL   7           HA       VAL   7   1.610  -9.337  -5.749
   63    HB   VAL   7           HB       VAL   7   2.894 -10.388  -7.490
   64   1HG1  VAL   7           HMGR     VAL   7   0.222 -10.922  -6.954
   65   2HG1  VAL   7           HMGR     VAL   7   0.327 -10.983  -8.729
   66   3HG1  VAL   7           HMGR     VAL   7   1.391 -12.010  -7.739
   67   1HG2  VAL   7           HMGS     VAL   7   1.721  -8.324  -9.181
   68   2HG2  VAL   7           HMGS     VAL   7   3.197  -9.295  -9.400
   69   3HG2  VAL   7           HMGS     VAL   7   1.619  -9.950  -9.900
   70    H    CYS   8           HN       CYS   8   4.143  -9.186  -6.676
   71    HA   CYS   8           HA       CYS   8   4.793  -6.306  -6.951
   72   1HB   CYS   8           HBS      CYS   8   5.978  -7.792  -5.268
   73   2HB   CYS   8           HBR      CYS   8   6.715  -8.618  -6.671
   74    HA   PRO   9           HA       PRO   9   5.330  -6.950 -11.298
   75   1HB   PRO   9           HBR      PRO   9   5.390  -4.165 -11.449
   76   2HB   PRO   9           HBS      PRO   9   4.328  -5.198 -12.158
   77   1HG   PRO   9           HGS      PRO   9   3.737  -3.576 -10.155
   78   2HG   PRO   9           HGR      PRO   9   2.830  -4.907 -10.590
   79   1HD   PRO   9           HDS      PRO   9   4.566  -4.606  -8.391
   80   2HD   PRO   9           HDR      PRO   9   3.329  -5.687  -8.584
   81    H    ALA  10           HN       ALA  10   7.270  -5.956  -8.909
   82    HA   ALA  10           HA       ALA  10   9.506  -5.096 -10.648
   83   1HB   ALA  10           HMBC     ALA  10   8.781  -4.413  -8.079
   84   2HB   ALA  10           HMBA     ALA  10  10.088  -5.597  -7.825
   85   3HB   ALA  10           HMBB     ALA  10  10.375  -4.156  -8.832
   86    H    CYS  11           HN       CYS  11   9.330  -7.382  -7.901
   87    HA   CYS  11           HA       CYS  11  11.497  -8.801  -9.198
   88   1HB   CYS  11           HBS      CYS  11  11.920  -9.816  -7.069
   89   2HB   CYS  11           HBR      CYS  11  11.710  -8.053  -6.910
   90    H    GLU  12           HN       GLU  12   8.214  -9.226  -9.249
   91    HA   GLU  12           HA       GLU  12   6.723 -10.947  -9.444
   92   1HB   GLU  12           HBS      GLU  12   9.147 -11.752 -10.711
   93   2HB   GLU  12           HBR      GLU  12   8.492 -13.128 -10.009
   94   1HG   GLU  12           HGS      GLU  12   6.478 -11.484 -11.376
   95   2HG   GLU  12           HGR      GLU  12   7.776 -11.937 -12.514
   96    H    SER  13           HN       SER  13   7.227 -10.321  -6.984
   97    HA   SER  13           HA       SER  13   6.939 -13.005  -5.761
   98   1HB   SER  13           HBS      SER  13   8.044 -10.565  -4.345
   99   2HB   SER  13           HBR      SER  13   7.604 -12.110  -3.570
  100    HG   SER  13           HG       SER  13   9.328 -13.037  -4.155
  101    H    ALA  14           HN       ALA  14   5.283 -13.151  -4.197
  102    HA   ALA  14           HA       ALA  14   3.055 -11.311  -4.847
  103   1HB   ALA  14           HMBA     ALA  14   2.886 -13.862  -5.126
  104   2HB   ALA  14           HMBB     ALA  14   2.884 -13.929  -3.345
  105   3HB   ALA  14           HMBC     ALA  14   1.592 -13.054  -4.207
  106    H    GLU  15           HN       GLU  15   5.387 -11.830  -2.529
  107    HA   GLU  15           HA       GLU  15   3.713 -11.593  -0.118
  108   1HB   GLU  15           HBR      GLU  15   6.690 -11.312  -0.220
  109   2HB   GLU  15           HBS      GLU  15   5.689 -11.833   1.021
  110   1HG   GLU  15           HGS      GLU  15   6.180 -13.403  -1.493
  111   2HG   GLU  15           HGR      GLU  15   6.883 -13.819   0.093
  112    H    LEU  16           HN       LEU  16   2.865  -9.693   0.309
  113    HA   LEU  16           HA       LEU  16   4.694  -7.347   0.423
  114   1HB   LEU  16           HBR      LEU  16   1.818  -7.265  -0.506
  115   2HB   LEU  16           HBS      LEU  16   3.069  -5.994  -0.623
  116    HG   LEU  16           HG       LEU  16   3.168  -8.608  -2.145
  117   1HD1  LEU  16           HMDR     LEU  16   2.078  -5.887  -2.913
  118   2HD1  LEU  16           HMDR     LEU  16   2.553  -7.127  -4.101
  119   3HD1  LEU  16           HMDR     LEU  16   1.237  -7.457  -2.946
  120   1HD2  LEU  16           HMDS     LEU  16   4.889  -6.260  -1.757
  121   2HD2  LEU  16           HMDS     LEU  16   5.280  -7.882  -2.384
  122   3HD2  LEU  16           HMDS     LEU  16   4.589  -6.650  -3.469
  123    H    ILE  17           HN       ILE  17   3.942  -5.646   1.839
  124    HA   ILE  17           HA       ILE  17   2.290  -6.548   4.116
  125    HB   ILE  17           HB       ILE  17   4.350  -6.019   5.614
  126   1HG1  ILE  17           HG1R     ILE  17   5.841  -6.699   3.050
  127   2HG1  ILE  17           HG1S     ILE  17   5.655  -5.048   3.707
  128   1HG2  ILE  17           HMG2     ILE  17   3.412  -8.418   4.491
  129   2HG2  ILE  17           HMG2     ILE  17   5.192  -8.502   4.429
  130   3HG2  ILE  17           HMG2     ILE  17   4.367  -8.199   5.981
  131   1HD1  ILE  17           HMD1     ILE  17   6.685  -6.852   5.726
  132   2HD1  ILE  17           HMD1     ILE  17   7.698  -6.884   4.258
  133   3HD1  ILE  17           HMD1     ILE  17   7.376  -5.337   5.086
  134    H    TYR  18           HN       TYR  18   2.037  -4.899   5.740
  135    HA   TYR  18           HA       TYR  18   1.912  -2.259   4.395
  136   1HB   TYR  18           HBS      TYR  18  -0.210  -3.457   4.984
  137   2HB   TYR  18           HBR      TYR  18   0.239  -3.307   6.707
  138    HD1  TYR  18           HD1      TYR  18   0.950  -0.716   7.307
  139    HD2  TYR  18           HD2      TYR  18  -1.826  -1.959   4.334
  140    HE1  TYR  18           HE1      TYR  18  -0.149   1.479   7.423
  141    HE2  TYR  18           HE2      TYR  18  -2.996   0.190   4.517
  142    HH   TYR  18           HH       TYR  18  -2.798   2.095   7.063
  143    H    ASP  19           HN       ASP  19   2.995  -0.605   5.131
  144    HA   ASP  19           HA       ASP  19   4.372  -0.860   7.744
  145   1HB   ASP  19           HBS      ASP  19   5.568  -0.315   5.447
  146   2HB   ASP  19           HBR      ASP  19   5.046   1.342   5.866
  147    HA   PRO  20           HA       PRO  20   1.028   1.688   9.088
  148   1HB   PRO  20           HBR      PRO  20   1.780   1.322  11.691
  149   2HB   PRO  20           HBS      PRO  20   0.517   0.605  10.925
  150   1HG   PRO  20           HGS      PRO  20   2.980  -0.497  11.579
  151   2HG   PRO  20           HGR      PRO  20   1.575  -1.286  11.143
  152   1HD   PRO  20           HDS      PRO  20   3.717  -1.060   9.576
  153   2HD   PRO  20           HDR      PRO  20   2.192  -1.400   9.031
  154    H    GLU  21           HN       GLU  21   4.291   2.125   9.283
  155    HA   GLU  21           HA       GLU  21   4.285   4.419  11.040
  156   1HB   GLU  21           HBR      GLU  21   6.336   3.266   9.137
  157   2HB   GLU  21           HBS      GLU  21   6.604   4.570  10.160
  158   1HG   GLU  21           HGS      GLU  21   6.370   3.396  12.161
  159   2HG   GLU  21           HGR      GLU  21   5.694   1.939  11.384
  160    H    ARG  22           HN       ARG  22   4.294   3.872   7.541
  161    HA   ARG  22           HA       ARG  22   3.924   6.800   7.141
  162   1HB   ARG  22           HBR      ARG  22   4.842   4.585   5.295
  163   2HB   ARG  22           HBS      ARG  22   4.280   6.173   4.697
  164   1HG   ARG  22           HGS      ARG  22   6.624   6.340   4.763
  165   2HG   ARG  22           HGR      ARG  22   6.061   7.194   6.228
  166   1HD   ARG  22           HDS      ARG  22   6.621   5.369   7.613
  167   2HD   ARG  22           HDR      ARG  22   6.896   4.299   6.209
  168    HE   ARG  22           HE       ARG  22   8.715   6.355   7.253
  169   1HH1  ARG  22           HH1Z     ARG  22   8.042   3.836   4.880
  170   2HH1  ARG  22           HH1E     ARG  22   9.631   3.904   4.196
  171   1HH2  ARG  22           HH2Z     ARG  22  10.741   6.505   6.248
  172   2HH2  ARG  22           HH2E     ARG  22  11.159   5.413   4.970
  173    H    GLY  23           HN       GLY  23   2.376   3.734   7.130
  174   1HA   GLY  23           HAR      GLY  23   0.127   3.188   6.714
  175   2HA   GLY  23           HAS      GLY  23  -0.137   4.818   6.040
  176    H    GLU  24           HN       GLU  24   2.372   2.397   5.263
  177    HA   GLU  24           HA       GLU  24   1.616   2.687   2.400
  178   1HB   GLU  24           HBR      GLU  24   3.887   3.277   3.695
  179   2HB   GLU  24           HBS      GLU  24   4.149   1.629   3.517
  180   1HG   GLU  24           HGR      GLU  24   5.139   2.112   1.499
  181   2HG   GLU  24           HGS      GLU  24   3.430   2.100   0.986
  182    H    ILE  25           HN       ILE  25   2.179   0.807   1.020
  183    HA   ILE  25           HA       ILE  25   2.352  -1.777   2.452
  184    HB   ILE  25           HB       ILE  25   0.813  -1.532  -0.167
  185   1HG1  ILE  25           HG1R     ILE  25  -1.212  -1.937   1.536
  186   2HG1  ILE  25           HG1S     ILE  25  -0.132  -1.028   2.631
  187   1HG2  ILE  25           HMG2     ILE  25   1.659  -3.744   0.367
  188   2HG2  ILE  25           HMG2     ILE  25   0.850  -3.687   1.955
  189   3HG2  ILE  25           HMG2     ILE  25  -0.122  -3.696   0.459
  190   1HD1  ILE  25           HMD1     ILE  25  -0.260   0.300   0.084
  191   2HD1  ILE  25           HMD1     ILE  25  -1.911  -0.009   0.685
  192   3HD1  ILE  25           HMD1     ILE  25  -0.746   0.890   1.695
  193    H    VAL  26           HN       VAL  26   4.086  -2.847   1.905
  194    HA   VAL  26           HA       VAL  26   5.525  -2.045  -0.571
  195    HB   VAL  26           HB       VAL  26   6.866  -2.667   2.052
  196   1HG1  VAL  26           HMGR     VAL  26   7.752  -1.142  -0.407
  197   2HG1  VAL  26           HMGR     VAL  26   8.679  -1.266   1.107
  198   3HG1  VAL  26           HMGR     VAL  26   8.333  -2.729   0.155
  199   1HG2  VAL  26           HMGS     VAL  26   5.675  -0.046   1.176
  200   2HG2  VAL  26           HMGS     VAL  26   5.554  -0.878   2.745
  201   3HG2  VAL  26           HMGS     VAL  26   7.087  -0.114   2.259
  202    H    CYS  27           HN       CYS  27   7.339  -3.564  -1.091
  203    HA   CYS  27           HA       CYS  27   6.458  -6.315  -0.876
  204   1HB   CYS  27           HBS      CYS  27   7.361  -5.203  -2.942
  205   2HB   CYS  27           HBR      CYS  27   8.972  -5.245  -2.174
  206    H    ALA  28           HN       ALA  28   7.154  -7.856   0.392
  207    HA   ALA  28           HA       ALA  28   9.318  -7.328   2.273
  208   1HB   ALA  28           HMBA     ALA  28   6.939  -8.666   2.403
  209   2HB   ALA  28           HMBC     ALA  28   8.101 -10.005   2.219
  210   3HB   ALA  28           HMBB     ALA  28   8.287  -8.842   3.557
  211    H    LYS  29           HN       LYS  29   9.767  -7.803  -0.702
  212    HA   LYS  29           HA       LYS  29  11.470 -10.246  -0.584
  213   1HB   LYS  29           HBS      LYS  29   8.914  -9.870  -1.811
  214   2HB   LYS  29           HBR      LYS  29  10.136 -10.041  -3.101
  215   1HG   LYS  29           HGR      LYS  29   9.708 -11.979  -0.794
  216   2HG   LYS  29           HGS      LYS  29   9.132 -12.207  -2.470
  217   1HD   LYS  29           HDS      LYS  29  11.017 -13.423  -2.599
  218   2HD   LYS  29           HDR      LYS  29  11.618 -11.864  -3.093
  219   1HE   LYS  29           HES      LYS  29  12.972 -13.228  -1.380
  220   2HE   LYS  29           HER      LYS  29  12.744 -11.473  -1.141
  221   1HZ   LYS  29           HZA      LYS  29  10.994 -13.477   0.092
  222   2HZ   LYS  29           HZB      LYS  29  12.340 -12.917   0.827
  223   3HZ   LYS  29           HZC      LYS  29  11.122 -11.891   0.461
  224    H    CYS  30           HN       CYS  30  10.740  -7.132  -2.070
  225    HA   CYS  30           HA       CYS  30  13.659  -7.029  -2.621
  226   1HB   CYS  30           HBR      CYS  30  13.350  -5.709  -4.602
  227   2HB   CYS  30           HBS      CYS  30  12.586  -7.313  -4.756
  228    H    GLY  31           HN       GLY  31  11.107  -5.814  -0.901
  229   1HA   GLY  31           HAR      GLY  31  11.131  -4.055   0.583
  230   2HA   GLY  31           HAS      GLY  31  12.532  -3.370  -0.286
  231    H    TYR  32           HN       TYR  32  10.248  -3.993  -2.598
  232    HA   TYR  32           HA       TYR  32  10.169  -1.095  -3.111
  233   1HB   TYR  32           HBS      TYR  32  10.658  -2.548  -4.990
  234   2HB   TYR  32           HBR      TYR  32   9.166  -3.486  -4.707
  235    HD1  TYR  32           HD1      TYR  32   9.709   0.235  -4.817
  236    HD2  TYR  32           HD2      TYR  32   7.866  -3.155  -6.604
  237    HE1  TYR  32           HE1      TYR  32   8.436   1.719  -6.306
  238    HE2  TYR  32           HE2      TYR  32   6.567  -1.684  -8.078
  239    HH   TYR  32           HH       TYR  32   7.272   1.138  -8.905
  240    H    VAL  33           HN       VAL  33   8.521   0.181  -2.718
  241    HA   VAL  33           HA       VAL  33   6.233  -0.569  -1.317
  242    HB   VAL  33           HB       VAL  33   6.579   1.816  -3.151
  243   1HG1  VAL  33           HMGR     VAL  33   4.532   1.210  -1.019
  244   2HG1  VAL  33           HMGR     VAL  33   4.902   2.866  -1.556
  245   3HG1  VAL  33           HMGR     VAL  33   4.274   1.674  -2.719
  246   1HG2  VAL  33           HMGS     VAL  33   8.314   1.562  -1.369
  247   2HG2  VAL  33           HMGS     VAL  33   7.337   3.046  -1.256
  248   3HG2  VAL  33           HMGS     VAL  33   7.012   1.679  -0.162
  249    H    ILE  34           HN       ILE  34   3.997  -0.521  -1.937
  250    HA   ILE  34           HA       ILE  34   3.490  -1.288  -4.769
  251    HB   ILE  34           HB       ILE  34   2.282  -2.189  -2.122
  252   1HG1  ILE  34           HG1R     ILE  34   4.380  -3.216  -2.969
  253   2HG1  ILE  34           HG1S     ILE  34   3.034  -4.371  -2.746
  254   1HG2  ILE  34           HMG2     ILE  34   1.003  -2.235  -4.798
  255   2HG2  ILE  34           HMG2     ILE  34   0.907  -3.729  -3.828
  256   3HG2  ILE  34           HMG2     ILE  34   0.289  -2.194  -3.164
  257   1HD1  ILE  34           HMD1     ILE  34   2.615  -4.166  -5.238
  258   2HD1  ILE  34           HMD1     ILE  34   4.162  -3.281  -5.335
  259   3HD1  ILE  34           HMD1     ILE  34   4.135  -4.970  -4.764
  260    H    GLU  35           HN       GLU  35   1.464  -0.243  -2.027
  261    HA   GLU  35           HA       GLU  35   0.632   2.132  -3.604
  262   1HB   GLU  35           HBR      GLU  35  -0.960  -0.116  -3.184
  263   2HB   GLU  35           HBS      GLU  35  -1.357   0.875  -1.889
  264   1HG   GLU  35           HGS      GLU  35  -2.715   2.122  -3.052
  265   2HG   GLU  35           HGR      GLU  35  -1.401   2.649  -4.139
  266    H    GLU  36           HN       GLU  36  -1.021   3.276  -1.801
  267    HA   GLU  36           HA       GLU  36  -0.215   2.902   0.973
  268   1HB   GLU  36           HBR      GLU  36   0.648   5.186   1.201
  269   2HB   GLU  36           HBS      GLU  36   1.610   4.113   0.341
  270   1HG   GLU  36           HGS      GLU  36   0.541   4.996  -1.818
  271   2HG   GLU  36           HGR      GLU  36   0.071   6.432  -0.868
  272    H    ASN  37           HN       ASN  37  -1.104   5.118   2.123
  273    HA   ASN  37           HA       ASN  37  -2.805   6.520   2.607
  274   1HB   ASN  37           HBS      ASN  37  -2.881   6.421  -0.345
  275   2HB   ASN  37           HBR      ASN  37  -4.328   7.062   0.485
  276   1HD2  ASN  37           HD2Z     ASN  37  -2.916  10.140   1.273
  277   2HD2  ASN  37           HD2E     ASN  37  -4.310   9.112   1.224
  278    H    ILE  38           HN       ILE  38  -4.119   5.678   3.994
  279    HA   ILE  38           HA       ILE  38  -6.356   4.028   2.983
  280    HB   ILE  38           HB       ILE  38  -4.652   3.358   5.431
  281   1HG1  ILE  38           HG1R     ILE  38  -4.519   1.112   4.137
  282   2HG1  ILE  38           HG1S     ILE  38  -5.085   2.061   2.732
  283   1HG2  ILE  38           HMG2     ILE  38  -7.270   2.150   4.519
  284   2HG2  ILE  38           HMG2     ILE  38  -6.175   1.407   5.715
  285   3HG2  ILE  38           HMG2     ILE  38  -6.928   2.987   6.056
  286   1HD1  ILE  38           HMD1     ILE  38  -2.827   3.287   4.156
  287   2HD1  ILE  38           HMD1     ILE  38  -2.463   1.685   3.462
  288   3HD1  ILE  38           HMD1     ILE  38  -3.073   2.994   2.414
  289    H    ILE  39           HN       ILE  39  -8.147   3.966   4.581
  290    HA   ILE  39           HA       ILE  39  -8.914   6.648   4.938
  291    HB   ILE  39           HB       ILE  39 -10.974   5.656   6.012
  292   1HG1  ILE  39           HG1R     ILE  39 -10.329   2.874   5.389
  293   2HG1  ILE  39           HG1S     ILE  39  -9.223   3.555   6.614
  294   1HG2  ILE  39           HMG2     ILE  39  -9.988   4.601   3.374
  295   2HG2  ILE  39           HMG2     ILE  39 -11.607   4.191   4.000
  296   3HG2  ILE  39           HMG2     ILE  39 -11.169   5.895   3.708
  297   1HD1  ILE  39           HMD1     ILE  39 -12.191   3.923   6.906
  298   2HD1  ILE  39           HMD1     ILE  39 -11.428   2.373   7.354
  299   3HD1  ILE  39           HMD1     ILE  39 -10.917   3.884   8.154
  300    H    ASP  40           HN       ASP  40  -8.270   8.014   6.409
  301    HA   ASP  40           HA       ASP  40  -9.074   7.711   9.037
  302   1HB   ASP  40           HBS      ASP  40  -6.717   7.891  10.123
  303   2HB   ASP  40           HBR      ASP  40  -7.461   6.309   9.752
  304    H    MET  41           HN       MET  41  -5.978   9.252   8.610
  305    HA   MET  41           HA       MET  41  -5.338  11.436   8.490
  306   1HB   MET  41           HBR      MET  41  -7.096  10.900   6.365
  307   2HB   MET  41           HBS      MET  41  -7.578  12.497   7.003
  308   1HG   MET  41           HGS      MET  41  -5.153  13.194   6.896
  309   2HG   MET  41           HGR      MET  41  -4.801  11.637   6.107
  310   1HE   MET  41           HMEB     MET  41  -6.786  10.795   4.596
  311   2HE   MET  41           HMEA     MET  41  -7.573  11.761   3.321
  312   3HE   MET  41           HMEC     MET  41  -5.864  11.283   3.151
  313    H    GLY  42           HN       GLY  42  -7.406  10.502  10.552
  314   1HA   GLY  42           HAS      GLY  42  -8.324  11.452  12.448
  315   2HA   GLY  42           HAR      GLY  42  -7.271  12.846  12.079
  316    HA   PRO  43           HA       PRO  43 -11.450  14.644  11.733
  317   1HB   PRO  43           HBR      PRO  43 -10.557  16.960  12.756
  318   2HB   PRO  43           HBS      PRO  43 -11.425  15.838  13.582
  319   1HG   PRO  43           HGS      PRO  43  -8.702  16.411  13.778
  320   2HG   PRO  43           HGR      PRO  43  -9.682  15.635  14.883
  321   1HD   PRO  43           HDS      PRO  43  -7.885  14.427  13.296
  322   2HD   PRO  43           HDR      PRO  43  -9.092  13.661  14.127
  323    H    GLU  44           HN       GLU  44 -12.083  16.733  10.694
  324    HA   GLU  44           HA       GLU  44 -10.140  18.195   9.274
  325   1HB   GLU  44           HBS      GLU  44 -10.776  17.597   7.026
  326   2HB   GLU  44           HBR      GLU  44  -9.854  16.421   7.789
  327   1HG   GLU  44           HGS      GLU  44 -11.439  14.899   7.224
  328   2HG   GLU  44           HGR      GLU  44 -12.626  15.712   8.280
  329    H    TRP  45           HN       TRP  45 -11.294  19.851  10.204
  330    HA   TRP  45           HA       TRP  45 -13.578  20.655   8.542
  331   1HB   TRP  45           HBS      TRP  45 -13.649  21.128  11.521
  332   2HB   TRP  45           HBR      TRP  45 -14.907  21.484  10.302
  333    HD1  TRP  45           HD1      TRP  45 -15.388  18.808   8.892
  334    HE1  TRP  45           HE1      TRP  45 -16.278  16.737  10.122
  335    HE3  TRP  45           HE3      TRP  45 -14.084  20.134  13.628
  336    HZ2  TRP  45           HZ2      TRP  45 -16.400  15.812  12.767
  337    HZ3  TRP  45           HZ3      TRP  45 -14.638  18.613  15.467
  338    HH2  TRP  45           HH2      TRP  45 -15.764  16.488  15.056
  339    H    ARG  46           HN       ARG  46 -12.982  22.394   7.544
  340    HA   ARG  46           HA       ARG  46 -12.354  24.763   8.938
  341   1HB   ARG  46           HBR      ARG  46 -10.073  23.399   8.842
  342   2HB   ARG  46           HBS      ARG  46 -10.019  24.093   7.196
  343   1HG   ARG  46           HGS      ARG  46  -8.826  25.632   8.476
  344   2HG   ARG  46           HGR      ARG  46 -10.455  26.357   8.370
  345   1HD   ARG  46           HDS      ARG  46  -9.887  26.591  10.597
  346   2HD   ARG  46           HDR      ARG  46 -10.920  25.135  10.569
  347    HE   ARG  46           HE       ARG  46  -8.536  23.983  10.404
  348   1HH1  ARG  46           HH1Z     ARG  46  -9.732  26.504  12.558
  349   2HH1  ARG  46           HH1E     ARG  46  -8.516  26.210  13.756
  350   1HH2  ARG  46           HH2Z     ARG  46  -6.884  23.714  11.933
  351   2HH2  ARG  46           HH2E     ARG  46  -6.904  24.631  13.403
  352    H    ALA  47           HN       ALA  47 -11.067  23.589   5.819
  353    HA   ALA  47           HA       ALA  47 -12.248  25.927   4.528
  354   1HB   ALA  47           HMBC     ALA  47 -10.024  24.088   4.080
  355   2HB   ALA  47           HMBB     ALA  47 -10.932  24.459   2.593
  356   3HB   ALA  47           HMBA     ALA  47 -10.247  25.781   3.571
  357    H    PHE  48           HN       PHE  48 -14.330  25.750   4.059
  358    HA   PHE  48           HA       PHE  48 -15.069  23.558   2.195
  359   1HB   PHE  48           HBS      PHE  48 -16.306  23.694   4.608
  360   2HB   PHE  48           HBR      PHE  48 -17.314  24.843   3.681
  361    HD1  PHE  48           HD1      PHE  48 -15.573  21.673   2.917
  362    HD2  PHE  48           HD2      PHE  48 -19.310  23.719   2.967
  363    HE1  PHE  48           HE1      PHE  48 -16.625  19.733   1.845
  364    HE2  PHE  48           HE2      PHE  48 -20.397  21.774   1.891
  365    HZ   PHE  48           HZ       PHE  48 -19.025  19.803   1.278
  366    H    ASP  49           HN       ASP  49 -14.942  24.520   0.303
  367    HA   ASP  49           HA       ASP  49 -16.793  26.747  -0.209
  368   1HB   ASP  49           HBS      ASP  49 -15.212  28.161  -1.213
  369   2HB   ASP  49           HBR      ASP  49 -14.606  27.729   0.412
  370    H    ALA  50           HN       ALA  50 -14.560  24.305  -1.465
  371    HA   ALA  50           HA       ALA  50 -16.594  23.236  -3.118
  372   1HB   ALA  50           HMBC     ALA  50 -15.771  25.335  -4.422
  373   2HB   ALA  50           HMBB     ALA  50 -14.360  24.318  -4.807
  374   3HB   ALA  50           HMBA     ALA  50 -15.995  23.786  -5.273
   
  No H/Q in entry =         374
  Start of MODEL   24
    1   1H    MET   1           HNC      MET   1  -1.355 -11.711 -18.528
    2   2H    MET   1           HNB      MET   1  -0.058 -11.743 -19.519
    3   3H    MET   1           HN       MET   1  -1.544 -12.077 -20.109
    4    HA   MET   1           HA       MET   1  -1.650 -14.128 -19.310
    5   1HB   MET   1           HBR      MET   1   0.527 -13.575 -20.738
    6   2HB   MET   1           HBS      MET   1   1.337 -14.073 -19.225
    7   1HG   MET   1           HGS      MET   1   0.192 -16.230 -19.271
    8   2HG   MET   1           HGR      MET   1  -0.779 -15.714 -20.673
    9   1HE   MET   1           HMEB     MET   1   0.129 -14.806 -22.679
   10   2HE   MET   1           HMEA     MET   1   1.807 -14.204 -22.671
   11   3HE   MET   1           HMEC     MET   1   1.385 -15.657 -23.612
   12    H    VAL   2           HN       VAL   2   0.215 -11.911 -17.378
   13    HA   VAL   2           HA       VAL   2  -0.704 -13.305 -15.003
   14    HB   VAL   2           HB       VAL   2   1.566 -13.146 -13.911
   15   1HG1  VAL   2           HMGS     VAL   2   0.505 -15.265 -14.484
   16   2HG1  VAL   2           HMGS     VAL   2   1.215 -15.191 -16.115
   17   3HG1  VAL   2           HMGS     VAL   2   2.271 -15.348 -14.691
   18   1HG2  VAL   2           HMGR     VAL   2   2.340 -12.119 -16.445
   19   2HG2  VAL   2           HMGR     VAL   2   3.342 -12.400 -15.000
   20   3HG2  VAL   2           HMGR     VAL   2   3.156 -13.684 -16.219
   21    H    ASN   3           HN       ASN   3  -1.916 -11.696 -14.329
   22    HA   ASN   3           HA       ASN   3  -0.537  -9.340 -13.270
   23   1HB   ASN   3           HBS      ASN   3  -1.783  -7.714 -14.391
   24   2HB   ASN   3           HBR      ASN   3  -1.122  -8.816 -15.632
   25   1HD2  ASN   3           HD2Z     ASN   3  -5.131  -8.224 -15.217
   26   2HD2  ASN   3           HD2E     ASN   3  -3.965  -7.444 -14.200
   27    H    LYS   4           HN       LYS   4  -1.265 -11.107 -11.619
   28    HA   LYS   4           HA       LYS   4  -3.926 -10.931 -10.550
   29   1HB   LYS   4           HBR      LYS   4  -1.335 -11.991  -9.731
   30   2HB   LYS   4           HBS      LYS   4  -2.184 -11.174  -8.387
   31   1HG   LYS   4           HGR      LYS   4  -4.197 -12.683  -9.518
   32   2HG   LYS   4           HGS      LYS   4  -2.768 -13.735  -9.732
   33   1HD   LYS   4           HDS      LYS   4  -3.621 -12.502  -7.111
   34   2HD   LYS   4           HDR      LYS   4  -4.070 -14.096  -7.652
   35   1HE   LYS   4           HES      LYS   4  -1.331 -13.094  -6.943
   36   2HE   LYS   4           HER      LYS   4  -2.269 -14.439  -6.233
   37   1HZ   LYS   4           HZA      LYS   4  -2.098 -15.304  -8.658
   38   2HZ   LYS   4           HZB      LYS   4  -0.770 -14.356  -8.713
   39   3HZ   LYS   4           HZC      LYS   4  -0.878 -15.546  -7.600
   40    H    GLN   5           HN       GLN   5  -4.673  -9.672  -8.838
   41    HA   GLN   5           HA       GLN   5  -3.646  -6.933  -9.100
   42   1HB   GLN   5           HBR      GLN   5  -6.300  -8.159  -8.713
   43   2HB   GLN   5           HBS      GLN   5  -6.009  -6.655  -7.794
   44   1HG   GLN   5           HGS      GLN   5  -5.804  -7.060 -10.789
   45   2HG   GLN   5           HGR      GLN   5  -7.025  -6.106  -9.900
   46   1HE2  GLN   5           HE2Z     GLN   5  -4.438  -3.653  -8.901
   47   2HE2  GLN   5           HE2E     GLN   5  -5.566  -4.706  -8.114
   48    H    LYS   6           HN       LYS   6  -2.289  -8.773  -7.350
   49    HA   LYS   6           HA       LYS   6  -1.792  -6.827  -5.369
   50   1HB   LYS   6           HBS      LYS   6  -2.155  -8.354  -3.358
   51   2HB   LYS   6           HBR      LYS   6  -3.586  -7.538  -4.050
   52   1HG   LYS   6           HGR      LYS   6  -4.610  -9.492  -4.427
   53   2HG   LYS   6           HGS      LYS   6  -3.178 -10.147  -5.272
   54   1HD   LYS   6           HDS      LYS   6  -3.253 -11.622  -3.585
   55   2HD   LYS   6           HDR      LYS   6  -2.223 -10.407  -2.877
   56   1HE   LYS   6           HES      LYS   6  -4.235  -9.404  -1.776
   57   2HE   LYS   6           HER      LYS   6  -5.153 -10.820  -2.361
   58   1HZ   LYS   6           HZC      LYS   6  -3.069 -11.962  -1.199
   59   2HZ   LYS   6           HZA      LYS   6  -3.224 -10.643  -0.248
   60   3HZ   LYS   6           HZB      LYS   6  -4.482 -11.668  -0.434
   61    H    VAL   7           HN       VAL   7   0.200  -7.139  -6.420
   62    HA   VAL   7           HA       VAL   7   1.795  -9.347  -5.415
   63    HB   VAL   7           HB       VAL   7   2.574 -10.125  -7.576
   64   1HG1  VAL   7           HMGR     VAL   7   0.664 -11.254  -6.411
   65   2HG1  VAL   7           HMGR     VAL   7  -0.440 -10.381  -7.499
   66   3HG1  VAL   7           HMGR     VAL   7   0.743 -11.531  -8.167
   67   1HG2  VAL   7           HMGS     VAL   7   1.923  -7.946  -8.766
   68   2HG2  VAL   7           HMGS     VAL   7   1.753  -9.480  -9.654
   69   3HG2  VAL   7           HMGS     VAL   7   0.317  -8.691  -8.957
   70    H    CYS   8           HN       CYS   8   4.085  -9.122  -6.538
   71    HA   CYS   8           HA       CYS   8   4.788  -6.250  -6.730
   72   1HB   CYS   8           HBS      CYS   8   6.041  -7.833  -5.197
   73   2HB   CYS   8           HBR      CYS   8   6.659  -8.617  -6.679
   74    HA   PRO   9           HA       PRO   9   5.013  -6.727 -11.134
   75   1HB   PRO   9           HBR      PRO   9   5.187  -4.054 -11.464
   76   2HB   PRO   9           HBS      PRO   9   3.826  -4.955 -11.651
   77   1HG   PRO   9           HGS      PRO   9   4.485  -3.236  -9.566
   78   2HG   PRO   9           HGR      PRO   9   2.985  -3.847  -9.971
   79   1HD   PRO   9           HDS      PRO   9   4.484  -4.650  -7.885
   80   2HD   PRO   9           HDR      PRO   9   3.164  -5.448  -8.480
   81    H    ALA  10           HN       ALA  10   7.146  -5.891  -8.838
   82    HA   ALA  10           HA       ALA  10   9.274  -5.005 -10.689
   83   1HB   ALA  10           HMBA     ALA  10   8.741  -4.299  -8.135
   84   2HB   ALA  10           HMBB     ALA  10   9.913  -5.613  -7.865
   85   3HB   ALA  10           HMBC     ALA  10  10.353  -4.221  -8.888
   86    H    CYS  11           HN       CYS  11   9.205  -7.416  -8.036
   87    HA   CYS  11           HA       CYS  11  11.228  -8.854  -9.541
   88   1HB   CYS  11           HBS      CYS  11  11.750  -9.985  -7.492
   89   2HB   CYS  11           HBR      CYS  11  11.638  -8.222  -7.248
   90    H    GLU  12           HN       GLU  12   7.936  -9.140  -9.393
   91    HA   GLU  12           HA       GLU  12   6.358 -10.789  -9.554
   92   1HB   GLU  12           HBS      GLU  12   8.659 -11.620 -11.021
   93   2HB   GLU  12           HBR      GLU  12   7.994 -13.004 -10.346
   94   1HG   GLU  12           HGS      GLU  12   6.732 -12.969 -12.260
   95   2HG   GLU  12           HGR      GLU  12   5.689 -11.815 -11.386
   96    H    SER  13           HN       SER  13   7.113 -10.307  -7.100
   97    HA   SER  13           HA       SER  13   6.857 -13.041  -5.954
   98   1HB   SER  13           HBS      SER  13   7.890 -10.532  -4.617
   99   2HB   SER  13           HBR      SER  13   7.378 -11.993  -3.729
  100    HG   SER  13           HG       SER  13   9.275 -12.691  -3.950
  101    H    ALA  14           HN       ALA  14   5.443 -12.898  -3.901
  102    HA   ALA  14           HA       ALA  14   2.992 -11.427  -4.703
  103   1HB   ALA  14           HMBA     ALA  14   3.440 -14.103  -4.888
  104   2HB   ALA  14           HMBB     ALA  14   2.762 -13.995  -3.242
  105   3HB   ALA  14           HMBC     ALA  14   1.832 -13.379  -4.632
  106    H    GLU  15           HN       GLU  15   5.241 -11.779  -2.275
  107    HA   GLU  15           HA       GLU  15   3.307 -11.491  -0.019
  108   1HB   GLU  15           HBR      GLU  15   6.311 -11.742   0.079
  109   2HB   GLU  15           HBS      GLU  15   5.215 -11.795   1.349
  110   1HG   GLU  15           HGS      GLU  15   5.327 -13.861  -0.830
  111   2HG   GLU  15           HGR      GLU  15   5.944 -14.130   0.823
  112    H    LEU  16           HN       LEU  16   2.805  -9.516   0.547
  113    HA   LEU  16           HA       LEU  16   4.936  -7.434   0.528
  114   1HB   LEU  16           HBR      LEU  16   2.006  -6.975  -0.072
  115   2HB   LEU  16           HBS      LEU  16   3.374  -5.844  -0.273
  116    HG   LEU  16           HG       LEU  16   3.022  -8.377  -1.891
  117   1HD1  LEU  16           HMDR     LEU  16   1.792  -5.706  -2.132
  118   2HD1  LEU  16           HMDR     LEU  16   2.613  -6.284  -3.604
  119   3HD1  LEU  16           HMDR     LEU  16   1.321  -7.261  -2.861
  120   1HD2  LEU  16           HMDS     LEU  16   4.894  -6.025  -1.838
  121   2HD2  LEU  16           HMDS     LEU  16   5.252  -7.763  -2.002
  122   3HD2  LEU  16           HMDS     LEU  16   4.564  -6.860  -3.377
  123    H    ILE  17           HN       ILE  17   4.488  -5.650   2.022
  124    HA   ILE  17           HA       ILE  17   3.211  -6.647   4.519
  125    HB   ILE  17           HB       ILE  17   5.357  -5.717   5.652
  126   1HG1  ILE  17           HG1R     ILE  17   6.299  -5.970   2.777
  127   2HG1  ILE  17           HG1S     ILE  17   6.310  -4.519   3.818
  128   1HG2  ILE  17           HMG2     ILE  17   4.686  -8.163   5.347
  129   2HG2  ILE  17           HMG2     ILE  17   5.879  -8.195   4.021
  130   3HG2  ILE  17           HMG2     ILE  17   6.400  -7.807   5.683
  131   1HD1  ILE  17           HMD1     ILE  17   7.827  -6.550   5.124
  132   2HD1  ILE  17           HMD1     ILE  17   8.365  -6.458   3.425
  133   3HD1  ILE  17           HMD1     ILE  17   8.384  -4.996   4.448
  134    H    TYR  18           HN       TYR  18   2.387  -5.146   5.862
  135    HA   TYR  18           HA       TYR  18   2.004  -2.500   4.599
  136   1HB   TYR  18           HBR      TYR  18   0.063  -4.056   5.048
  137   2HB   TYR  18           HBS      TYR  18   0.353  -3.799   6.792
  138    HD1  TYR  18           HD2      TYR  18   0.575  -1.172   7.395
  139    HD2  TYR  18           HD1      TYR  18  -1.629  -2.746   4.116
  140    HE1  TYR  18           HE2      TYR  18  -0.868   0.813   7.422
  141    HE2  TYR  18           HE1      TYR  18  -3.091  -0.770   4.141
  142    HH   TYR  18           HH       TYR  18  -2.313   2.026   5.413
  143    H    ASP  19           HN       ASP  19   2.378  -0.620   5.596
  144    HA   ASP  19           HA       ASP  19   3.869  -0.791   8.158
  145   1HB   ASP  19           HBS      ASP  19   4.824  -0.078   5.562
  146   2HB   ASP  19           HBR      ASP  19   4.902   1.347   6.638
  147    HA   PRO  20           HA       PRO  20   0.410   1.829   8.994
  148   1HB   PRO  20           HBS      PRO  20   1.022   1.510  11.703
  149   2HB   PRO  20           HBR      PRO  20  -0.344   1.051  10.918
  150   1HG   PRO  20           HGS      PRO  20   1.521  -0.595  11.835
  151   2HG   PRO  20           HGR      PRO  20   0.385  -1.013  10.687
  152   1HD   PRO  20           HDS      PRO  20   3.122  -0.505  10.331
  153   2HD   PRO  20           HDR      PRO  20   2.081  -1.291   9.314
  154    H    GLU  21           HN       GLU  21   3.610   2.356   9.593
  155    HA   GLU  21           HA       GLU  21   3.342   4.899  11.037
  156   1HB   GLU  21           HBR      GLU  21   5.658   3.600   9.587
  157   2HB   GLU  21           HBS      GLU  21   5.720   5.019  10.481
  158   1HG   GLU  21           HGS      GLU  21   4.624   2.654  11.890
  159   2HG   GLU  21           HGR      GLU  21   6.397   2.710  11.691
  160    H    ARG  22           HN       ARG  22   3.943   3.698   7.737
  161    HA   ARG  22           HA       ARG  22   4.104   6.486   6.717
  162   1HB   ARG  22           HBR      ARG  22   5.139   3.867   5.802
  163   2HB   ARG  22           HBS      ARG  22   4.448   4.913   4.528
  164   1HG   ARG  22           HGS      ARG  22   6.569   5.696   4.438
  165   2HG   ARG  22           HGR      ARG  22   6.003   6.716   5.791
  166   1HD   ARG  22           HDS      ARG  22   6.753   4.620   7.206
  167   2HD   ARG  22           HDR      ARG  22   7.801   4.346   5.785
  168    HE   ARG  22           HE       ARG  22   8.059   7.047   6.548
  169   1HH1  ARG  22           HH1Z     ARG  22   9.006   3.804   7.555
  170   2HH1  ARG  22           HH1E     ARG  22  10.292   4.376   8.566
  171   1HH2  ARG  22           HH2Z     ARG  22   9.666   7.763   7.978
  172   2HH2  ARG  22           HH2E     ARG  22  10.667   6.615   8.803
  173    H    GLY  23           HN       GLY  23   2.071   3.714   7.009
  174   1HA   GLY  23           HAR      GLY  23  -0.078   3.255   6.249
  175   2HA   GLY  23           HAS      GLY  23  -0.140   4.868   5.490
  176    H    GLU  24           HN       GLU  24   2.313   2.311   5.108
  177    HA   GLU  24           HA       GLU  24   1.789   2.376   2.166
  178   1HB   GLU  24           HBS      GLU  24   3.580   3.720   2.795
  179   2HB   GLU  24           HBR      GLU  24   4.243   2.627   3.881
  180   1HG   GLU  24           HGS      GLU  24   5.047   1.209   2.099
  181   2HG   GLU  24           HGR      GLU  24   4.038   2.014   0.867
  182    H    ILE  25           HN       ILE  25   2.002   0.520   1.032
  183    HA   ILE  25           HA       ILE  25   2.644  -1.963   2.549
  184    HB   ILE  25           HB       ILE  25   1.062  -1.820  -0.055
  185   1HG1  ILE  25           HG1R     ILE  25  -0.872  -2.384   1.741
  186   2HG1  ILE  25           HG1S     ILE  25   0.176  -1.356   2.758
  187   1HG2  ILE  25           HMG2     ILE  25   1.586  -3.982   1.971
  188   2HG2  ILE  25           HMG2     ILE  25   0.189  -4.050   0.863
  189   3HG2  ILE  25           HMG2     ILE  25   1.847  -3.994   0.206
  190   1HD1  ILE  25           HMD1     ILE  25  -0.079  -0.023   0.284
  191   2HD1  ILE  25           HMD1     ILE  25  -1.711  -0.598   0.719
  192   3HD1  ILE  25           HMD1     ILE  25  -0.793   0.427   1.856
  193    H    VAL  26           HN       VAL  26   4.307  -3.141   1.901
  194    HA   VAL  26           HA       VAL  26   5.775  -2.254  -0.528
  195    HB   VAL  26           HB       VAL  26   7.058  -3.016   2.090
  196   1HG1  VAL  26           HMGR     VAL  26   8.034  -1.450  -0.308
  197   2HG1  VAL  26           HMGR     VAL  26   8.924  -1.617   1.224
  198   3HG1  VAL  26           HMGR     VAL  26   8.573  -3.057   0.239
  199   1HG2  VAL  26           HMGS     VAL  26   6.000  -0.316   1.267
  200   2HG2  VAL  26           HMGS     VAL  26   5.742  -1.210   2.784
  201   3HG2  VAL  26           HMGS     VAL  26   7.336  -0.502   2.429
  202    H    CYS  27           HN       CYS  27   7.586  -3.785  -1.078
  203    HA   CYS  27           HA       CYS  27   6.671  -6.542  -0.997
  204   1HB   CYS  27           HBS      CYS  27   7.657  -5.379  -3.001
  205   2HB   CYS  27           HBR      CYS  27   9.237  -5.453  -2.172
  206    H    ALA  28           HN       ALA  28   7.188  -8.007   0.413
  207    HA   ALA  28           HA       ALA  28   9.532  -7.731   2.136
  208   1HB   ALA  28           HMBA     ALA  28   7.033  -8.995   2.285
  209   2HB   ALA  28           HMBB     ALA  28   8.237 -10.309   2.244
  210   3HB   ALA  28           HMBC     ALA  28   8.354  -9.030   3.480
  211    H    LYS  29           HN       LYS  29  10.358  -7.736  -0.462
  212    HA   LYS  29           HA       LYS  29  11.936 -10.198  -0.601
  213   1HB   LYS  29           HBR      LYS  29   9.642 -10.264  -2.056
  214   2HB   LYS  29           HBS      LYS  29  10.748  -9.474  -3.216
  215   1HG   LYS  29           HGR      LYS  29  11.056 -12.195  -1.901
  216   2HG   LYS  29           HGS      LYS  29  10.825 -11.831  -3.635
  217   1HD   LYS  29           HDS      LYS  29  13.204 -10.685  -2.255
  218   2HD   LYS  29           HDR      LYS  29  13.179 -12.402  -2.558
  219   1HE   LYS  29           HES      LYS  29  12.394 -11.526  -4.983
  220   2HE   LYS  29           HER      LYS  29  13.414 -10.163  -4.442
  221   1HZ   LYS  29           HZC      LYS  29  14.941 -12.186  -3.801
  222   2HZ   LYS  29           HZA      LYS  29  14.158 -12.880  -5.055
  223   3HZ   LYS  29           HZB      LYS  29  14.989 -11.491  -5.279
  224    H    CYS  30           HN       CYS  30  10.978  -7.359  -2.583
  225    HA   CYS  30           HA       CYS  30  13.862  -6.793  -2.884
  226   1HB   CYS  30           HBS      CYS  30  13.312  -5.552  -4.862
  227   2HB   CYS  30           HBR      CYS  30  12.647  -7.204  -4.925
  228    H    GLY  31           HN       GLY  31  11.347  -5.749  -1.004
  229   1HA   GLY  31           HAR      GLY  31  11.247  -3.968   0.434
  230   2HA   GLY  31           HAS      GLY  31  12.648  -3.256  -0.411
  231    H    TYR  32           HN       TYR  32  10.422  -3.926  -2.763
  232    HA   TYR  32           HA       TYR  32  10.154  -1.058  -3.302
  233   1HB   TYR  32           HBS      TYR  32  10.523  -2.555  -5.178
  234   2HB   TYR  32           HBR      TYR  32   9.083  -3.518  -4.744
  235    HD1  TYR  32           HD1      TYR  32   9.918   0.087  -5.486
  236    HD2  TYR  32           HD2      TYR  32   7.252  -3.173  -6.078
  237    HE1  TYR  32           HE1      TYR  32   8.604   1.454  -7.050
  238    HE2  TYR  32           HE2      TYR  32   5.944  -1.826  -7.658
  239    HH   TYR  32           HH       TYR  32   5.458   0.518  -8.024
  240    H    VAL  33           HN       VAL  33   8.513   0.177  -2.784
  241    HA   VAL  33           HA       VAL  33   6.281  -0.676  -1.231
  242    HB   VAL  33           HB       VAL  33   6.645   1.811  -2.918
  243   1HG1  VAL  33           HMGR     VAL  33   4.598   1.156  -0.789
  244   2HG1  VAL  33           HMGR     VAL  33   4.939   2.803  -1.374
  245   3HG1  VAL  33           HMGR     VAL  33   4.312   1.571  -2.497
  246   1HG2  VAL  33           HMGS     VAL  33   7.261   1.232  -0.018
  247   2HG2  VAL  33           HMGS     VAL  33   8.378   1.751  -1.304
  248   3HG2  VAL  33           HMGS     VAL  33   7.139   2.874  -0.694
  249    H    ILE  34           HN       ILE  34   4.030  -0.541  -1.868
  250    HA   ILE  34           HA       ILE  34   3.556  -1.279  -4.713
  251    HB   ILE  34           HB       ILE  34   2.174  -2.074  -2.112
  252   1HG1  ILE  34           HG1R     ILE  34   4.301  -3.190  -2.770
  253   2HG1  ILE  34           HG1S     ILE  34   2.907  -4.296  -2.604
  254   1HG2  ILE  34           HMG2     ILE  34   1.181  -2.359  -4.929
  255   2HG2  ILE  34           HMG2     ILE  34   0.785  -3.587  -3.697
  256   3HG2  ILE  34           HMG2     ILE  34   0.309  -1.887  -3.447
  257   1HD1  ILE  34           HMD1     ILE  34   2.672  -4.151  -5.131
  258   2HD1  ILE  34           HMD1     ILE  34   4.262  -3.342  -5.134
  259   3HD1  ILE  34           HMD1     ILE  34   4.110  -5.008  -4.515
  260    H    GLU  35           HN       GLU  35   1.450  -0.171  -2.065
  261    HA   GLU  35           HA       GLU  35   0.953   2.360  -3.510
  262   1HB   GLU  35           HBS      GLU  35  -1.344   2.160  -3.351
  263   2HB   GLU  35           HBR      GLU  35  -0.789   0.857  -4.252
  264   1HG   GLU  35           HGS      GLU  35  -1.797  -0.601  -2.830
  265   2HG   GLU  35           HGR      GLU  35  -0.972   0.085  -1.404
  266    H    GLU  36           HN       GLU  36  -0.336   3.843  -2.066
  267    HA   GLU  36           HA       GLU  36   0.424   3.500   0.797
  268   1HB   GLU  36           HBR      GLU  36   1.695   5.475   0.717
  269   2HB   GLU  36           HBS      GLU  36   2.218   4.422  -0.481
  270   1HG   GLU  36           HGS      GLU  36   0.450   5.764  -1.982
  271   2HG   GLU  36           HGR      GLU  36   0.955   7.099  -0.908
  272    H    ASN  37           HN       ASN  37  -0.590   4.966   2.210
  273    HA   ASN  37           HA       ASN  37  -2.469   5.900   3.081
  274   1HB   ASN  37           HBR      ASN  37  -3.051   7.993   2.149
  275   2HB   ASN  37           HBS      ASN  37  -1.288   7.747   1.994
  276   1HD2  ASN  37           HD2Z     ASN  37  -3.668   8.315  -1.278
  277   2HD2  ASN  37           HD2E     ASN  37  -4.314   8.221   0.327
  278    H    ILE  38           HN       ILE  38  -3.950   4.363   3.251
  279    HA   ILE  38           HA       ILE  38  -5.903   4.014   1.046
  280    HB   ILE  38           HB       ILE  38  -5.639   2.579   3.735
  281   1HG1  ILE  38           HG1R     ILE  38  -5.221   0.779   1.604
  282   2HG1  ILE  38           HG1S     ILE  38  -4.310   2.254   1.170
  283   1HG2  ILE  38           HMG2     ILE  38  -7.526   2.126   1.420
  284   2HG2  ILE  38           HMG2     ILE  38  -7.210   0.917   2.690
  285   3HG2  ILE  38           HMG2     ILE  38  -7.926   2.492   3.119
  286   1HD1  ILE  38           HMD1     ILE  38  -4.051   0.726   3.778
  287   2HD1  ILE  38           HMD1     ILE  38  -2.931   0.625   2.394
  288   3HD1  ILE  38           HMD1     ILE  38  -3.108   2.158   3.288
  289    H    ILE  39           HN       ILE  39  -7.476   5.410   0.947
  290    HA   ILE  39           HA       ILE  39  -9.305   5.733   3.045
  291    HB   ILE  39           HB       ILE  39  -7.525   7.211   4.011
  292   1HG1  ILE  39           HG1R     ILE  39  -9.521   9.260   3.633
  293   2HG1  ILE  39           HG1S     ILE  39 -10.313   7.660   3.685
  294   1HG2  ILE  39           HMG2     ILE  39  -7.555   8.378   1.365
  295   2HG2  ILE  39           HMG2     ILE  39  -7.846   9.609   2.622
  296   3HG2  ILE  39           HMG2     ILE  39  -6.389   8.585   2.699
  297   1HD1  ILE  39           HMD1     ILE  39  -8.268   8.128   5.770
  298   2HD1  ILE  39           HMD1     ILE  39  -9.723   9.154   5.872
  299   3HD1  ILE  39           HMD1     ILE  39  -9.883   7.377   5.879
  300    H    ASP  40           HN       ASP  40  -7.895   6.914   0.051
  301    HA   ASP  40           HA       ASP  40  -8.803   7.628  -1.903
  302   1HB   ASP  40           HBR      ASP  40 -10.495   6.286  -2.756
  303   2HB   ASP  40           HBS      ASP  40  -9.586   5.272  -1.599
  304    H    MET  41           HN       MET  41 -11.059   8.369  -2.941
  305    HA   MET  41           HA       MET  41 -12.329  10.239  -3.218
  306   1HB   MET  41           HBS      MET  41 -12.993   9.331  -0.598
  307   2HB   MET  41           HBR      MET  41 -12.861  11.112  -0.557
  308   1HG   MET  41           HGS      MET  41 -14.422  11.299  -2.444
  309   2HG   MET  41           HGR      MET  41 -14.476   9.525  -2.591
  310   1HE   MET  41           HMEB     MET  41 -16.826  10.336  -2.662
  311   2HE   MET  41           HMEC     MET  41 -17.832   9.729  -1.323
  312   3HE   MET  41           HMEA     MET  41 -17.512  11.475  -1.477
  313    H    GLY  42           HN       GLY  42 -11.133  11.287  -0.066
  314   1HA   GLY  42           HAR      GLY  42  -8.904  12.802  -1.266
  315   2HA   GLY  42           HAS      GLY  42 -10.186  13.755  -0.468
  316    HA   PRO  43           HA       PRO  43  -6.937  11.893   2.508
  317   1HB   PRO  43           HBR      PRO  43  -5.520  14.151   2.848
  318   2HB   PRO  43           HBS      PRO  43  -5.014  12.837   2.003
  319   1HG   PRO  43           HGS      PRO  43  -5.898  15.293   1.020
  320   2HG   PRO  43           HGR      PRO  43  -4.969  14.139   0.249
  321   1HD   PRO  43           HDS      PRO  43  -7.568  14.598  -0.230
  322   2HD   PRO  43           HDR      PRO  43  -6.736  13.250  -0.703
  323    H    GLU  44           HN       GLU  44  -6.096  13.494   4.556
  324    HA   GLU  44           HA       GLU  44  -8.647  13.992   5.883
  325   1HB   GLU  44           HBR      GLU  44  -5.741  13.848   6.583
  326   2HB   GLU  44           HBS      GLU  44  -6.749  14.749   7.578
  327   1HG   GLU  44           HGS      GLU  44  -6.939  11.817   7.045
  328   2HG   GLU  44           HGR      GLU  44  -6.798  12.598   8.643
  329    H    TRP  45           HN       TRP  45  -9.527  15.886   6.388
  330    HA   TRP  45           HA       TRP  45  -8.616  18.392   5.344
  331   1HB   TRP  45           HBS      TRP  45 -10.966  17.510   6.305
  332   2HB   TRP  45           HBR      TRP  45 -10.360  18.400   7.732
  333    HD1  TRP  45           HD1      TRP  45 -10.931  20.915   7.740
  334    HE1  TRP  45           HE1      TRP  45 -11.768  22.631   6.022
  335    HE3  TRP  45           HE3      TRP  45 -10.646  18.002   3.579
  336    HZ2  TRP  45           HZ2      TRP  45 -12.248  22.706   3.261
  337    HZ3  TRP  45           HZ3      TRP  45 -11.298  18.970   1.424
  338    HH2  TRP  45           HH2      TRP  45 -12.093  21.268   1.256
  339    H    ARG  46           HN       ARG  46  -9.027  17.614   8.802
  340    HA   ARG  46           HA       ARG  46  -7.664  17.877  10.615
  341   1HB   ARG  46           HBR      ARG  46  -5.841  17.261   8.377
  342   2HB   ARG  46           HBS      ARG  46  -5.080  18.105   9.756
  343   1HG   ARG  46           HGS      ARG  46  -5.681  16.363  11.266
  344   2HG   ARG  46           HGR      ARG  46  -6.752  15.596  10.060
  345   1HD   ARG  46           HDS      ARG  46  -4.981  14.821   8.791
  346   2HD   ARG  46           HDR      ARG  46  -3.828  15.976   9.518
  347    HE   ARG  46           HE       ARG  46  -4.556  14.443  11.645
  348   1HH1  ARG  46           HH1Z     ARG  46  -3.135  13.802   8.483
  349   2HH1  ARG  46           HH1E     ARG  46  -2.474  12.277   8.969
  350   1HH2  ARG  46           HH2Z     ARG  46  -3.785  12.387  12.205
  351   2HH2  ARG  46           HH2E     ARG  46  -2.840  11.476  11.076
  352    H    ALA  47           HN       ALA  47  -5.571  19.643   8.353
  353    HA   ALA  47           HA       ALA  47  -6.723  22.165   8.647
  354   1HB   ALA  47           HMBC     ALA  47  -5.018  21.425  10.892
  355   2HB   ALA  47           HMBA     ALA  47  -4.453  22.895  10.059
  356   3HB   ALA  47           HMBB     ALA  47  -6.120  22.810  10.685
  357    H    PHE  48           HN       PHE  48  -6.122  23.118   6.866
  358    HA   PHE  48           HA       PHE  48  -3.624  24.086   6.396
  359   1HB   PHE  48           HBS      PHE  48  -3.616  21.329   5.540
  360   2HB   PHE  48           HBR      PHE  48  -3.491  22.391   4.108
  361    HD1  PHE  48           HD1      PHE  48  -1.979  24.518   4.630
  362    HD2  PHE  48           HD2      PHE  48  -1.506  20.709   6.481
  363    HE1  PHE  48           HE1      PHE  48   0.376  25.047   5.069
  364    HE2  PHE  48           HE2      PHE  48   0.869  21.222   6.941
  365    HZ   PHE  48           HZ       PHE  48   1.818  23.378   6.170
  366    H    ASP  49           HN       ASP  49  -4.457  25.872   5.613
  367    HA   ASP  49           HA       ASP  49  -5.298  25.757   2.851
  368   1HB   ASP  49           HBS      ASP  49  -7.157  26.979   4.888
  369   2HB   ASP  49           HBR      ASP  49  -7.233  27.269   3.126
  370    H    ALA  50           HN       ALA  50  -5.461  28.242   5.415
  371    HA   ALA  50           HA       ALA  50  -4.523  30.325   5.566
  372   1HB   ALA  50           HMBB     ALA  50  -2.405  28.994   3.868
  373   2HB   ALA  50           HMBC     ALA  50  -2.307  30.686   4.418
  374   3HB   ALA  50           HMBA     ALA  50  -2.362  29.364   5.611
   
  No H/Q in entry =         374
  Start of MODEL   25
    1   1H    MET   1           HNC      MET   1 -10.762 -19.618  -7.624
    2   2H    MET   1           HN       MET   1 -11.761 -18.366  -7.947
    3   3H    MET   1           HNB      MET   1 -11.372 -19.426  -9.128
    4    HA   MET   1           HA       MET   1 -10.101 -17.632  -9.635
    5   1HB   MET   1           HBR      MET   1  -9.579 -17.485  -6.652
    6   2HB   MET   1           HBS      MET   1  -8.727 -16.497  -7.871
    7   1HG   MET   1           HGS      MET   1 -10.989 -15.659  -8.649
    8   2HG   MET   1           HGR      MET   1 -11.707 -16.521  -7.267
    9   1HE   MET   1           HMEC     MET   1 -10.854 -13.568  -8.596
   10   2HE   MET   1           HMEA     MET   1 -11.864 -12.982  -7.250
   11   3HE   MET   1           HMEB     MET   1 -10.173 -12.438  -7.398
   12    H    VAL   2           HN       VAL   2  -8.020 -17.811 -10.372
   13    HA   VAL   2           HA       VAL   2  -6.795 -20.427  -9.774
   14    HB   VAL   2           HB       VAL   2  -5.663 -19.987 -12.011
   15   1HG1  VAL   2           HMGS     VAL   2  -8.566 -20.559 -11.583
   16   2HG1  VAL   2           HMGS     VAL   2  -7.931 -20.456 -13.242
   17   3HG1  VAL   2           HMGS     VAL   2  -7.246 -21.636 -12.098
   18   1HG2  VAL   2           HMGR     VAL   2  -6.813 -17.462 -11.776
   19   2HG2  VAL   2           HMGR     VAL   2  -6.043 -18.164 -13.219
   20   3HG2  VAL   2           HMGR     VAL   2  -7.805 -18.295 -12.998
   21    H    ASN   3           HN       ASN   3  -5.937 -17.004 -10.247
   22    HA   ASN   3           HA       ASN   3  -3.337 -17.481  -8.938
   23   1HB   ASN   3           HBS      ASN   3  -4.473 -14.906 -10.029
   24   2HB   ASN   3           HBR      ASN   3  -2.835 -15.167  -9.362
   25   1HD2  ASN   3           HD2Z     ASN   3  -2.753 -15.284 -13.112
   26   2HD2  ASN   3           HD2E     ASN   3  -3.261 -14.124 -11.929
   27    H    LYS   4           HN       LYS   4  -2.912 -15.467  -7.342
   28    HA   LYS   4           HA       LYS   4  -5.053 -15.330  -5.318
   29   1HB   LYS   4           HBS      LYS   4  -3.613 -16.465  -3.645
   30   2HB   LYS   4           HBR      LYS   4  -4.232 -17.547  -4.926
   31   1HG   LYS   4           HGR      LYS   4  -1.697 -16.557  -5.790
   32   2HG   LYS   4           HGS      LYS   4  -1.518 -17.091  -4.093
   33   1HD   LYS   4           HDS      LYS   4  -2.586 -19.246  -4.714
   34   2HD   LYS   4           HDR      LYS   4  -2.614 -18.718  -6.374
   35   1HE   LYS   4           HES      LYS   4   0.020 -18.310  -5.686
   36   2HE   LYS   4           HER      LYS   4  -0.427 -19.803  -4.812
   37   1HZ   LYS   4           HZB      LYS   4  -1.302 -20.612  -6.946
   38   2HZ   LYS   4           HZC      LYS   4  -0.677 -19.303  -7.695
   39   3HZ   LYS   4           HZA      LYS   4   0.313 -20.374  -6.961
   40    H    GLN   5           HN       GLN   5  -4.770 -13.699  -3.935
   41    HA   GLN   5           HA       GLN   5  -3.815 -12.089  -2.655
   42   1HB   GLN   5           HBR      GLN   5  -1.683 -14.061  -3.049
   43   2HB   GLN   5           HBS      GLN   5  -1.091 -12.414  -2.693
   44   1HG   GLN   5           HGS      GLN   5  -2.199 -12.338  -0.626
   45   2HG   GLN   5           HGR      GLN   5  -3.240 -13.730  -1.036
   46   1HE2  GLN   5           HE2Z     GLN   5  -1.114 -15.452   1.156
   47   2HE2  GLN   5           HE2E     GLN   5  -2.593 -14.558   1.031
   48    H    LYS   6           HN       LYS   6  -3.002 -10.052  -2.778
   49    HA   LYS   6           HA       LYS   6  -2.291  -8.859  -5.318
   50   1HB   LYS   6           HBR      LYS   6  -1.463  -6.984  -3.844
   51   2HB   LYS   6           HBS      LYS   6  -3.197  -7.392  -3.703
   52   1HG   LYS   6           HGR      LYS   6  -1.322  -8.717  -1.789
   53   2HG   LYS   6           HGS      LYS   6  -1.617  -6.968  -1.569
   54   1HD   LYS   6           HDS      LYS   6  -3.638  -7.277  -0.748
   55   2HD   LYS   6           HDR      LYS   6  -4.084  -8.344  -2.051
   56   1HE   LYS   6           HES      LYS   6  -2.332  -9.846  -0.457
   57   2HE   LYS   6           HER      LYS   6  -3.425  -8.977   0.657
   58   1HZ   LYS   6           HZB      LYS   6  -5.070  -9.861  -1.254
   59   2HZ   LYS   6           HZC      LYS   6  -4.002 -11.092  -1.164
   60   3HZ   LYS   6           HZA      LYS   6  -4.811 -10.614   0.172
   61    H    VAL   7           HN       VAL   7  -0.281  -8.257  -6.040
   62    HA   VAL   7           HA       VAL   7   1.889  -9.983  -4.964
   63    HB   VAL   7           HB       VAL   7   2.465 -10.517  -7.237
   64   1HG1  VAL   7           HMGR     VAL   7   0.349 -11.552  -5.918
   65   2HG1  VAL   7           HMGR     VAL   7  -0.443 -11.031  -7.424
   66   3HG1  VAL   7           HMGR     VAL   7   0.938 -12.152  -7.487
   67   1HG2  VAL   7           HMGS     VAL   7   1.131  -8.183  -7.939
   68   2HG2  VAL   7           HMGS     VAL   7   1.857  -9.379  -9.039
   69   3HG2  VAL   7           HMGS     VAL   7   0.130  -9.489  -8.620
   70    H    CYS   8           HN       CYS   8   4.022  -9.432  -6.208
   71    HA   CYS   8           HA       CYS   8   4.440  -6.502  -6.236
   72   1HB   CYS   8           HBS      CYS   8   5.957  -8.048  -4.930
   73   2HB   CYS   8           HBR      CYS   8   6.489  -8.706  -6.503
   74    HA   PRO   9           HA       PRO   9   4.283  -6.635 -10.662
   75   1HB   PRO   9           HBR      PRO   9   4.269  -3.848 -10.494
   76   2HB   PRO   9           HBS      PRO   9   3.128  -4.831 -11.146
   77   1HG   PRO   9           HGS      PRO   9   2.830  -3.477  -8.897
   78   2HG   PRO   9           HGR      PRO   9   1.898  -4.790  -9.336
   79   1HD   PRO   9           HDS      PRO   9   3.957  -4.661  -7.419
   80   2HD   PRO   9           HDR      PRO   9   2.733  -5.768  -7.543
   81    H    ALA  10           HN       ALA  10   6.576  -5.787  -8.526
   82    HA   ALA  10           HA       ALA  10   8.460  -4.801 -10.545
   83   1HB   ALA  10           HMBC     ALA  10   8.099  -4.257  -7.903
   84   2HB   ALA  10           HMBA     ALA  10   9.444  -5.424  -7.838
   85   3HB   ALA  10           HMBB     ALA  10   9.594  -3.945  -8.821
   86    H    CYS  11           HN       CYS  11   8.737  -7.322  -8.006
   87    HA   CYS  11           HA       CYS  11  10.814  -8.527  -9.668
   88   1HB   CYS  11           HBS      CYS  11  11.535  -9.683  -7.700
   89   2HB   CYS  11           HBR      CYS  11  11.300  -7.948  -7.370
   90    H    GLU  12           HN       GLU  12   7.559  -9.021  -9.360
   91    HA   GLU  12           HA       GLU  12   6.076 -10.756  -9.510
   92   1HB   GLU  12           HBR      GLU  12   8.496 -12.034 -10.799
   93   2HB   GLU  12           HBS      GLU  12   7.033 -12.828 -10.590
   94   1HG   GLU  12           HGS      GLU  12   5.764 -11.416 -11.947
   95   2HG   GLU  12           HGR      GLU  12   7.042 -10.176 -12.077
   96    H    SER  13           HN       SER  13   6.972 -10.341  -7.077
   97    HA   SER  13           HA       SER  13   7.153 -13.107  -5.991
   98   1HB   SER  13           HBS      SER  13   7.477 -12.129  -3.805
   99   2HB   SER  13           HBR      SER  13   8.728 -11.547  -4.941
  100    HG   SER  13           HG       SER  13   7.095 -10.204  -3.316
  101    H    ALA  14           HN       ALA  14   5.732 -12.896  -3.738
  102    HA   ALA  14           HA       ALA  14   3.105 -11.694  -4.422
  103   1HB   ALA  14           HMBA     ALA  14   3.706 -14.449  -3.300
  104   2HB   ALA  14           HMBC     ALA  14   2.078 -13.732  -3.415
  105   3HB   ALA  14           HMBB     ALA  14   3.006 -14.073  -4.896
  106    H    GLU  15           HN       GLU  15   5.618 -11.890  -2.250
  107    HA   GLU  15           HA       GLU  15   3.953 -11.748   0.217
  108   1HB   GLU  15           HBR      GLU  15   6.948 -11.641   0.061
  109   2HB   GLU  15           HBS      GLU  15   5.948 -12.008   1.358
  110   1HG   GLU  15           HGS      GLU  15   5.923 -13.785  -1.046
  111   2HG   GLU  15           HGR      GLU  15   7.115 -14.071   0.250
  112    H    LEU  16           HN       LEU  16   3.280  -9.828   0.779
  113    HA   LEU  16           HA       LEU  16   5.192  -7.550   0.648
  114   1HB   LEU  16           HBR      LEU  16   2.230  -7.292   0.137
  115   2HB   LEU  16           HBS      LEU  16   3.546  -6.139  -0.224
  116    HG   LEU  16           HG       LEU  16   2.951  -8.734  -1.668
  117   1HD1  LEU  16           HMDR     LEU  16   2.603  -5.805  -2.327
  118   2HD1  LEU  16           HMDR     LEU  16   2.702  -7.058  -3.589
  119   3HD1  LEU  16           HMDR     LEU  16   1.394  -7.111  -2.381
  120   1HD2  LEU  16           HMDS     LEU  16   5.400  -7.520  -1.263
  121   2HD2  LEU  16           HMDS     LEU  16   4.982  -8.605  -2.612
  122   3HD2  LEU  16           HMDS     LEU  16   4.868  -6.840  -2.822
  123    H    ILE  17           HN       ILE  17   3.884  -5.642   1.906
  124    HA   ILE  17           HA       ILE  17   2.870  -6.559   4.490
  125    HB   ILE  17           HB       ILE  17   4.946  -5.500   5.639
  126   1HG1  ILE  17           HG1R     ILE  17   6.034  -5.997   2.848
  127   2HG1  ILE  17           HG1S     ILE  17   5.982  -4.459   3.757
  128   1HG2  ILE  17           HMG2     ILE  17   4.341  -7.942   5.611
  129   2HG2  ILE  17           HMG2     ILE  17   5.482  -8.129   4.253
  130   3HG2  ILE  17           HMG2     ILE  17   6.070  -7.572   5.843
  131   1HD1  ILE  17           HMD1     ILE  17   7.506  -6.710   4.976
  132   2HD1  ILE  17           HMD1     ILE  17   8.199  -5.936   3.525
  133   3HD1  ILE  17           HMD1     ILE  17   7.838  -4.957   4.972
  134    H    TYR  18           HN       TYR  18   1.798  -5.001   5.494
  135    HA   TYR  18           HA       TYR  18   1.850  -2.311   4.280
  136   1HB   TYR  18           HBR      TYR  18  -0.288  -3.515   4.360
  137   2HB   TYR  18           HBS      TYR  18  -0.166  -3.631   6.139
  138    HD1  TYR  18           HD2      TYR  18   0.674  -0.676   4.049
  139    HD2  TYR  18           HD1      TYR  18  -2.138  -2.392   6.739
  140    HE1  TYR  18           HE2      TYR  18  -0.504   1.473   4.175
  141    HE2  TYR  18           HE1      TYR  18  -3.322  -0.243   6.882
  142    HH   TYR  18           HH       TYR  18  -2.157   2.464   6.359
  143    H    ASP  19           HN       ASP  19   2.698  -0.635   5.239
  144    HA   ASP  19           HA       ASP  19   3.619  -0.958   8.039
  145   1HB   ASP  19           HBS      ASP  19   5.028  -0.205   5.726
  146   2HB   ASP  19           HBR      ASP  19   4.854   1.265   6.727
  147    HA   PRO  20           HA       PRO  20   0.086   1.609   8.530
  148   1HB   PRO  20           HBS      PRO  20   0.152   1.361  11.251
  149   2HB   PRO  20           HBR      PRO  20  -0.854   0.567  10.225
  150   1HG   PRO  20           HGS      PRO  20   1.405  -0.384  11.542
  151   2HG   PRO  20           HGR      PRO  20   0.198  -1.266  10.801
  152   1HD   PRO  20           HDS      PRO  20   2.659  -0.984   9.826
  153   2HD   PRO  20           HDR      PRO  20   1.343  -1.422   8.924
  154    H    GLU  21           HN       GLU  21   3.162   2.197   9.573
  155    HA   GLU  21           HA       GLU  21   2.557   4.638  11.035
  156   1HB   GLU  21           HBR      GLU  21   5.062   3.208  10.144
  157   2HB   GLU  21           HBS      GLU  21   5.100   4.731  10.848
  158   1HG   GLU  21           HGS      GLU  21   3.422   3.006  12.437
  159   2HG   GLU  21           HGR      GLU  21   5.070   2.328  12.335
  160    H    ARG  22           HN       ARG  22   3.769   3.728   7.834
  161    HA   ARG  22           HA       ARG  22   3.717   6.579   7.009
  162   1HB   ARG  22           HBR      ARG  22   4.645   4.125   5.483
  163   2HB   ARG  22           HBS      ARG  22   4.749   5.825   4.941
  164   1HG   ARG  22           HGS      ARG  22   6.032   5.302   7.543
  165   2HG   ARG  22           HGR      ARG  22   6.759   4.415   6.173
  166   1HD   ARG  22           HDS      ARG  22   7.692   6.708   6.707
  167   2HD   ARG  22           HDR      ARG  22   7.241   6.376   5.011
  168    HE   ARG  22           HE       ARG  22   4.992   7.531   6.108
  169   1HH1  ARG  22           HH1Z     ARG  22   8.335   8.459   5.480
  170   2HH1  ARG  22           HH1E     ARG  22   7.989  10.156   5.539
  171   1HH2  ARG  22           HH2Z     ARG  22   4.604   9.756   6.305
  172   2HH2  ARG  22           HH2E     ARG  22   5.878  10.891   6.004
  173    H    GLY  23           HN       GLY  23   2.021   3.551   6.790
  174   1HA   GLY  23           HAR      GLY  23   0.065   2.923   5.686
  175   2HA   GLY  23           HAS      GLY  23  -0.111   4.587   5.066
  176    H    GLU  24           HN       GLU  24   2.277   1.914   4.849
  177    HA   GLU  24           HA       GLU  24   2.471   2.372   1.902
  178   1HB   GLU  24           HBS      GLU  24   4.070   3.635   3.018
  179   2HB   GLU  24           HBR      GLU  24   4.488   2.448   4.128
  180   1HG   GLU  24           HGS      GLU  24   5.128   1.138   1.841
  181   2HG   GLU  24           HGR      GLU  24   5.323   2.800   1.222
  182    H    ILE  25           HN       ILE  25   2.257   0.564   0.812
  183    HA   ILE  25           HA       ILE  25   2.503  -2.033   2.247
  184    HB   ILE  25           HB       ILE  25   1.161  -1.534  -0.449
  185   1HG1  ILE  25           HG1R     ILE  25  -0.961  -1.860   1.186
  186   2HG1  ILE  25           HG1S     ILE  25   0.163  -1.068   2.327
  187   1HG2  ILE  25           HMG2     ILE  25   1.851  -3.893   0.848
  188   2HG2  ILE  25           HMG2     ILE  25   0.108  -3.698   1.171
  189   3HG2  ILE  25           HMG2     ILE  25   0.707  -3.702  -0.508
  190   1HD1  ILE  25           HMD1     ILE  25   0.038   0.247  -0.292
  191   2HD1  ILE  25           HMD1     ILE  25  -1.523   0.215   0.572
  192   3HD1  ILE  25           HMD1     ILE  25  -0.086   0.930   1.351
  193    H    VAL  26           HN       VAL  26   4.323  -3.051   1.957
  194    HA   VAL  26           HA       VAL  26   5.980  -2.303  -0.396
  195    HB   VAL  26           HB       VAL  26   7.031  -3.022   2.337
  196   1HG1  VAL  26           HMGR     VAL  26   8.231  -1.568  -0.030
  197   2HG1  VAL  26           HMGR     VAL  26   8.985  -1.659   1.580
  198   3HG1  VAL  26           HMGR     VAL  26   8.706  -3.147   0.643
  199   1HG2  VAL  26           HMGS     VAL  26   5.930  -0.409   1.388
  200   2HG2  VAL  26           HMGS     VAL  26   5.838  -1.182   2.989
  201   3HG2  VAL  26           HMGS     VAL  26   7.354  -0.415   2.456
  202    H    CYS  27           HN       CYS  27   7.824  -3.846  -0.761
  203    HA   CYS  27           HA       CYS  27   6.818  -6.595  -0.654
  204   1HB   CYS  27           HBS      CYS  27   7.527  -5.474  -2.766
  205   2HB   CYS  27           HBR      CYS  27   9.197  -5.445  -2.142
  206    H    ALA  28           HN       ALA  28   7.483  -8.063   0.682
  207    HA   ALA  28           HA       ALA  28   9.957  -7.762   2.187
  208   1HB   ALA  28           HMBB     ALA  28   7.494  -9.013   2.561
  209   2HB   ALA  28           HMBC     ALA  28   8.659 -10.350   2.384
  210   3HB   ALA  28           HMBA     ALA  28   8.924  -9.097   3.623
  211    H    LYS  29           HN       LYS  29  10.524  -7.833  -0.520
  212    HA   LYS  29           HA       LYS  29  12.042 -10.340  -0.769
  213   1HB   LYS  29           HBR      LYS  29   9.610 -10.209  -2.055
  214   2HB   LYS  29           HBS      LYS  29  10.739  -9.600  -3.298
  215   1HG   LYS  29           HGR      LYS  29  11.322 -11.699  -3.777
  216   2HG   LYS  29           HGS      LYS  29  11.941 -11.897  -2.113
  217   1HD   LYS  29           HDS      LYS  29   9.211 -12.164  -1.812
  218   2HD   LYS  29           HDR      LYS  29   9.503 -12.904  -3.361
  219   1HE   LYS  29           HES      LYS  29  10.991 -13.622  -0.839
  220   2HE   LYS  29           HER      LYS  29   9.586 -14.499  -1.509
  221   1HZ   LYS  29           HZA      LYS  29  11.737 -14.054  -3.347
  222   2HZ   LYS  29           HZB      LYS  29  12.109 -15.045  -2.103
  223   3HZ   LYS  29           HZC      LYS  29  10.849 -15.399  -3.080
  224    H    CYS  30           HN       CYS  30  11.027  -7.426  -2.608
  225    HA   CYS  30           HA       CYS  30  13.895  -6.985  -3.172
  226   1HB   CYS  30           HBR      CYS  30  13.230  -5.752  -5.112
  227   2HB   CYS  30           HBS      CYS  30  12.464  -7.360  -5.085
  228    H    GLY  31           HN       GLY  31  11.603  -5.848  -1.074
  229   1HA   GLY  31           HAR      GLY  31  11.792  -4.096   0.406
  230   2HA   GLY  31           HAS      GLY  31  13.078  -3.403  -0.621
  231    H    TYR  32           HN       TYR  32  10.533  -4.009  -2.645
  232    HA   TYR  32           HA       TYR  32  10.392  -1.122  -3.149
  233   1HB   TYR  32           HBS      TYR  32  10.565  -2.604  -5.060
  234   2HB   TYR  32           HBR      TYR  32   9.118  -3.510  -4.539
  235    HD1  TYR  32           HD1      TYR  32  10.080   0.045  -5.358
  236    HD2  TYR  32           HD2      TYR  32   7.183  -3.052  -5.687
  237    HE1  TYR  32           HE1      TYR  32   8.712   1.486  -6.805
  238    HE2  TYR  32           HE2      TYR  32   5.827  -1.638  -7.164
  239    HH   TYR  32           HH       TYR  32   6.800   0.477  -8.938
  240    H    VAL  33           HN       VAL  33   8.785   0.190  -2.638
  241    HA   VAL  33           HA       VAL  33   6.338  -0.820  -1.348
  242    HB   VAL  33           HB       VAL  33   7.151   1.986  -2.142
  243   1HG1  VAL  33           HMGR     VAL  33   4.715   1.710  -2.124
  244   2HG1  VAL  33           HMGR     VAL  33   4.800   1.092  -0.456
  245   3HG1  VAL  33           HMGR     VAL  33   5.279   2.770  -0.810
  246   1HG2  VAL  33           HMGS     VAL  33   8.487   0.880  -0.306
  247   2HG2  VAL  33           HMGS     VAL  33   7.676   2.407   0.120
  248   3HG2  VAL  33           HMGS     VAL  33   6.987   0.853   0.651
  249    H    ILE  34           HN       ILE  34   4.294  -0.627  -2.240
  250    HA   ILE  34           HA       ILE  34   4.165   0.073  -5.128
  251    HB   ILE  34           HB       ILE  34   2.521  -1.752  -3.331
  252   1HG1  ILE  34           HG1R     ILE  34   3.409  -2.595  -6.031
  253   2HG1  ILE  34           HG1S     ILE  34   4.716  -2.178  -4.888
  254   1HG2  ILE  34           HMG2     ILE  34   1.527  -0.285  -5.659
  255   2HG2  ILE  34           HMG2     ILE  34   1.354  -2.055  -5.798
  256   3HG2  ILE  34           HMG2     ILE  34   0.654  -1.196  -4.400
  257   1HD1  ILE  34           HMD1     ILE  34   2.512  -4.203  -4.388
  258   2HD1  ILE  34           HMD1     ILE  34   4.193  -4.579  -4.849
  259   3HD1  ILE  34           HMD1     ILE  34   3.853  -3.800  -3.282
  260    H    GLU  35           HN       GLU  35   1.822   0.126  -2.430
  261    HA   GLU  35           HA       GLU  35   0.856   2.728  -3.529
  262   1HB   GLU  35           HBS      GLU  35  -0.399   0.750  -3.993
  263   2HB   GLU  35           HBR      GLU  35  -0.494   0.281  -2.384
  264   1HG   GLU  35           HGS      GLU  35  -2.162   1.836  -1.900
  265   2HG   GLU  35           HGR      GLU  35  -1.575   3.040  -3.081
  266    H    GLU  36           HN       GLU  36  -0.490   3.983  -1.998
  267    HA   GLU  36           HA       GLU  36   0.785   3.996   0.706
  268   1HB   GLU  36           HBR      GLU  36   0.177   6.207  -1.265
  269   2HB   GLU  36           HBS      GLU  36   0.518   6.470   0.357
  270   1HG   GLU  36           HGS      GLU  36   2.661   5.127   0.096
  271   2HG   GLU  36           HGR      GLU  36   2.488   5.345  -1.667
  272    H    ASN  37           HN       ASN  37  -0.453   4.551   2.415
  273    HA   ASN  37           HA       ASN  37  -2.333   4.418   3.676
  274   1HB   ASN  37           HBS      ASN  37  -3.830   6.167   3.426
  275   2HB   ASN  37           HBR      ASN  37  -2.267   6.763   2.797
  276   1HD2  ASN  37           HD2Z     ASN  37  -3.736   7.890  -0.130
  277   2HD2  ASN  37           HD2E     ASN  37  -2.593   8.109   1.155
  278    H    ILE  38           HN       ILE  38  -4.862   4.204   3.556
  279    HA   ILE  38           HA       ILE  38  -5.961   2.580   1.550
  280    HB   ILE  38           HB       ILE  38  -4.130   0.997   2.330
  281   1HG1  ILE  38           HG1R     ILE  38  -7.046   0.160   2.517
  282   2HG1  ILE  38           HG1S     ILE  38  -6.027   0.238   1.052
  283   1HG2  ILE  38           HMG2     ILE  38  -4.713   1.634   4.843
  284   2HG2  ILE  38           HMG2     ILE  38  -5.785   0.218   4.677
  285   3HG2  ILE  38           HMG2     ILE  38  -4.032   0.050   4.387
  286   1HD1  ILE  38           HMD1     ILE  38  -4.563  -1.481   2.512
  287   2HD1  ILE  38           HMD1     ILE  38  -6.181  -1.834   3.176
  288   3HD1  ILE  38           HMD1     ILE  38  -5.882  -1.992   1.425
  289    H    ILE  39           HN       ILE  39  -6.839   4.709   2.960
  290    HA   ILE  39           HA       ILE  39  -8.715   5.484   4.012
  291    HB   ILE  39           HB       ILE  39  -9.657   2.658   3.319
  292   1HG1  ILE  39           HG1R     ILE  39  -9.589   5.243   1.726
  293   2HG1  ILE  39           HG1S     ILE  39  -8.726   3.717   1.383
  294   1HG2  ILE  39           HMG2     ILE  39 -11.028   4.419   4.863
  295   2HG2  ILE  39           HMG2     ILE  39 -11.593   4.876   3.234
  296   3HG2  ILE  39           HMG2     ILE  39 -11.777   3.196   3.802
  297   1HD1  ILE  39           HMD1     ILE  39 -11.499   3.113   1.496
  298   2HD1  ILE  39           HMD1     ILE  39 -11.307   4.572   0.489
  299   3HD1  ILE  39           HMD1     ILE  39 -10.410   3.085   0.084
  300    H    ASP  40           HN       ASP  40  -9.381   2.188   5.047
  301    HA   ASP  40           HA       ASP  40  -8.216   2.693   7.674
  302   1HB   ASP  40           HBR      ASP  40 -10.147   2.065   8.950
  303   2HB   ASP  40           HBS      ASP  40 -10.475   3.521   7.966
  304    H    MET  41           HN       MET  41  -9.466   0.379   8.849
  305    HA   MET  41           HA       MET  41  -8.711  -1.806   7.003
  306   1HB   MET  41           HBR      MET  41  -6.891  -1.276   8.768
  307   2HB   MET  41           HBS      MET  41  -8.027  -2.024   9.928
  308   1HG   MET  41           HGS      MET  41  -8.001  -4.113   8.722
  309   2HG   MET  41           HGR      MET  41  -7.151  -3.367   7.347
  310   1HE   MET  41           HMEA     MET  41  -5.219  -3.780   6.914
  311   2HE   MET  41           HMEC     MET  41  -3.750  -3.448   7.867
  312   3HE   MET  41           HMEB     MET  41  -4.414  -5.101   7.798
  313    H    GLY  42           HN       GLY  42 -10.571  -2.716   6.591
  314   1HA   GLY  42           HAS      GLY  42 -11.976  -4.255   8.568
  315   2HA   GLY  42           HAR      GLY  42 -12.879  -2.768   8.169
  316    HA   PRO  43           HA       PRO  43 -12.303  -5.857   4.443
  317   1HB   PRO  43           HBR      PRO  43 -13.071  -8.291   5.559
  318   2HB   PRO  43           HBS      PRO  43 -11.700  -7.951   4.721
  319   1HG   PRO  43           HGS      PRO  43 -11.805  -8.445   7.324
  320   2HG   PRO  43           HGR      PRO  43 -10.516  -7.731   6.542
  321   1HD   PRO  43           HDS      PRO  43 -12.441  -6.529   8.199
  322   2HD   PRO  43           HDR      PRO  43 -10.952  -5.952   7.765
  323    H    GLU  44           HN       GLU  44 -14.079  -7.948   3.866
  324    HA   GLU  44           HA       GLU  44 -16.326  -6.146   3.326
  325   1HB   GLU  44           HBS      GLU  44 -15.279  -8.755   2.373
  326   2HB   GLU  44           HBR      GLU  44 -16.850  -8.357   1.938
  327   1HG   GLU  44           HGS      GLU  44 -15.350  -6.043   1.374
  328   2HG   GLU  44           HGR      GLU  44 -14.244  -7.356   0.885
  329    H    TRP  45           HN       TRP  45 -16.238  -6.964   6.003
  330    HA   TRP  45           HA       TRP  45 -18.973  -7.536   6.260
  331   1HB   TRP  45           HBR      TRP  45 -17.213  -9.896   6.427
  332   2HB   TRP  45           HBS      TRP  45 -18.370  -9.693   7.774
  333    HD1  TRP  45           HD1      TRP  45 -21.029  -9.026   6.586
  334    HE1  TRP  45           HE1      TRP  45 -22.239 -10.441   4.814
  335    HE3  TRP  45           HE3      TRP  45 -16.995 -11.515   4.736
  336    HZ2  TRP  45           HZ2      TRP  45 -21.534 -12.323   2.858
  337    HZ3  TRP  45           HZ3      TRP  45 -17.338 -13.109   2.907
  338    HH2  TRP  45           HH2      TRP  45 -19.556 -13.511   1.978
  339    H    ARG  46           HN       ARG  46 -19.052  -5.802   7.531
  340    HA   ARG  46           HA       ARG  46 -17.035  -5.283   9.525
  341   1HB   ARG  46           HBR      ARG  46 -19.657  -3.811   9.353
  342   2HB   ARG  46           HBS      ARG  46 -18.040  -3.216   9.828
  343   1HG   ARG  46           HGS      ARG  46 -17.407  -2.809   7.685
  344   2HG   ARG  46           HGR      ARG  46 -18.337  -4.187   7.030
  345   1HD   ARG  46           HDS      ARG  46 -19.858  -1.919   8.190
  346   2HD   ARG  46           HDR      ARG  46 -19.022  -1.649   6.635
  347    HE   ARG  46           HE       ARG  46 -21.269  -3.484   7.143
  348   1HH1  ARG  46           HH1Z     ARG  46 -18.687  -2.557   4.929
  349   2HH1  ARG  46           HH1E     ARG  46 -19.566  -3.055   3.522
  350   1HH2  ARG  46           HH2Z     ARG  46 -22.438  -4.005   5.273
  351   2HH2  ARG  46           HH2E     ARG  46 -21.689  -3.877   3.716
  352    H    ALA  47           HN       ALA  47 -17.198  -7.084  10.906
  353    HA   ALA  47           HA       ALA  47 -18.707  -6.689  13.202
  354   1HB   ALA  47           HMBA     ALA  47 -20.148  -8.202  11.157
  355   2HB   ALA  47           HMBB     ALA  47 -19.982  -9.082  12.697
  356   3HB   ALA  47           HMBC     ALA  47 -20.724  -7.463  12.672
  357    H    PHE  48           HN       PHE  48 -16.917  -7.170  14.299
  358    HA   PHE  48           HA       PHE  48 -16.144 -10.030  14.415
  359   1HB   PHE  48           HBR      PHE  48 -14.518  -7.947  13.230
  360   2HB   PHE  48           HBS      PHE  48 -13.746  -8.539  14.730
  361    HD1  PHE  48           HD2      PHE  48 -13.392 -11.134  14.920
  362    HD2  PHE  48           HD1      PHE  48 -14.404  -9.100  11.315
  363    HE1  PHE  48           HE2      PHE  48 -12.671 -13.105  13.611
  364    HE2  PHE  48           HE1      PHE  48 -13.699 -11.044   9.995
  365    HZ   PHE  48           HZ       PHE  48 -12.889 -13.071  11.143
  366    H    ASP  49           HN       ASP  49 -14.710  -7.050  15.743
  367    HA   ASP  49           HA       ASP  49 -14.802  -8.362  18.370
  368   1HB   ASP  49           HBR      ASP  49 -12.641  -7.699  17.352
  369   2HB   ASP  49           HBS      ASP  49 -13.130  -5.991  17.546
  370    H    ALA  50           HN       ALA  50 -15.430  -5.159  16.929
  371    HA   ALA  50           HA       ALA  50 -16.514  -4.002  19.355
  372   1HB   ALA  50           HMBC     ALA  50 -15.614  -2.952  17.062
  373   2HB   ALA  50           HMBB     ALA  50 -17.353  -3.018  16.679
  374   3HB   ALA  50           HMBA     ALA  50 -16.791  -2.130  18.118
   
  No H/Q in entry =         374