*HEADER    LIGASE                                  05-MAR-16   5IM8              
*TITLE     SOLUTION STRUCTURE OF THE MICROTUBULE-TARGETING COS DOMAIN OF MID1    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: E3 UBIQUITIN-PROTEIN LIGASE MIDLINE-1;                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: COS DOMAIN (UNP RESIDUES 320-379);                         
*COMPND   5 SYNONYM: MIDIN,PUTATIVE TRANSCRIPTION FACTOR XPRF,RING FINGER PROTEIN
*COMPND   6 59,RING FINGER PROTEIN MIDLINE-1,TRIPARTITE MOTIF-CONTAINING PROTEIN 
*COMPND   7 18;                                                                  
*COMPND   8 EC: 6.3.2.-;                                                         
*COMPND   9 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: MID1, FXY, RNF59, TRIM18, XPRF;                                
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI 'BL21-GOLD(DE3)PLYSS AG';        
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 866768                                      
*KEYWDS    HELIX-LOOP-HELIX, MICROTUBULES, SPECTRIN, LIGASE                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    K.M.WRIGHT,H.DU,M.DAGNACHEW,M.A.MASSIAH                               
*REVDAT   1   13-JUL-16 5IM8    0                                                
# Restraints file 1: COS_helix_1.upl
#ASP5
5 ASP  H        5 ASP  HA    5
5 ASP  H        5 ASP  HB2   4.3
5 ASP  H        5 ASP  HB3   4.3

5 ASP  HA       5 ASP  HB2   5
5 ASP  HA       5 ASP  HB3   5

#HIS6
6 HIS  H        6 HIS  HA    5
6 HIS  H        6 HIS  HB2   2.8
6 HIS  H        6 HIS  HB3   2.8

6 HIS  HA       6 HIS  HB2   5
6 HIS  HA       6 HIS  HB3   5

6 HIS  H        5 ASP  HA    4.3

#ALA7
7 ALA  H        7 ALA  HA    5
7 ALA  H        7 ALA  QB    4.3

7 ALA  HA       7 ALA  QB    4.3

7 ALA  H        6 HIS  HA    5.0
7 ALA  H        6 HIS  HB2   5
7 ALA  H        6 HIS  HB3   3.3

#ARG8
8 ARG  H        8 ARG  HA    5
8 ARG  H        8 ARG  QB    3.8
8 ARG  H        8 ARG  QG    5.5
8 ARG  H        8 ARG  QD    6

8 ARG  HA       8 ARG  QB    4.3
8 ARG  HA       8 ARG  QG    5.5
8 ARG  HA       8 ARG  QD    6

8 ARG  H        7 ALA  HA    5    #overlap with R8 and H6 ha
8 ARG  H        7 ALA  QB    4.3

#PHE9
9 PHE  H        9 PHE  HA    5
9 PHE  H        9 PHE  HB2   4.3
9 PHE  H        9 PHE  HB3   4.3
9 PHE  H        9 PHE  QD   6.3

9 PHE  HA       9 PHE  HB2   5
9 PHE  HA       9 PHE  HB3   5
9 PHE  HA       9 PHE  QD    6.3

9 PHE  H        8 ARG  HA    5
9 PHE  H        8 ARG  QB    4.3
9 PHE  H        8 ARG  QG    3.8
9 PHE  H        8 ARG  QD    6

#LEU10
10 LEU H        10 LEU  HA    5
10 LEU H        10 LEU  HB2   4.3    #changed 3.8
10 LEU H        10 LEU  HB3   4.3
10 LEU H        10 LEU  HG    5.0
10 LEU H        10 LEU  QD1   5.5
10 LEU H        10 LEU  QD2   5.5

10 LEU HA       10 LEU  HB2   4.3
10 LEU HA       10 LEU  HB3   4.3
10 LEU HA       10 LEU  HG    3.3 
10 LEU HA       10 LEU  QD1   4.3
10 LEU HA       10 LEU  QD2   4.3

10 LEU H        9 PHE  HA     5
10 LEU H        9 PHE  HB2    4.3
10 LEU H        9 PHE  HB3    3.3


#GLN11
11 GLN H        11 GLN  HA    5
11 GLN H        11 GLN  QB    4.3        #changed from 3.3
11 GLN H        11 GLN  QG    5.5

11 GLN HA       11 GLN  QB    4.3
11 GLN HA       11 GLN  QG    3.8

11 GLN H        10 LEU  HA    5
11 GLN H        10 LEU  HB2   3.3
11 GLN H        10 LEU  HB3   3.3
11 GLN H        10 LEU  HG    5.0
11 GLN H        10 LEU  QD1   6
11 GLN H        10 LEU  QD2   6

#THR12
12 THR H        12 THR  HA    5        #changed from 3.3
12 THR H        12 THR  HB    3.3
12 THR H        12 THR  QG2   5       #changed from 3.8 

12 THR HA       12 THR  HB    4.3
12 THR HA       12 THR  QG2   3.8 

12 THR H        11 GLN  HA    5      #overlap
12 THR H        11 GLN  QB    3.8      #m/s
12 THR H        11 GLN  QG    5

#ALA13
13 ALA H        13 ALA  HA    5        #changed from 3.3
13 ALA H        13 ALA  QB    3.8

13 ALA HA       13 ALA  QB    4.3

13 ALA H        12 THR  HA    4.3       #changed from 3.8
13 ALA H        12 THR  HB    3.3       #changed from 3.8
13 ALA H        12 THR  QG2   5         #overlap

#LYS14
14 LYS H        14 LYS  HA    5         #changed from 3.3
14 LYS H        14 LYS  QB    3.3
14 LYS H        14 LYS  QG    5.5
14 LYS H        14 LYS  QD    6

14 LYS HA       14 LYS  QB    3.3    #chagned from 3.3
14 LYS HA       14 LYS  QG    3.8    #changed from 5.5    
14 LYS HA       14 LYS  QD    5

14 LYS H        13 ALA  HA    4.3      #changed form 3.3
14 LYS H        13 ALA  QB    3.8      #overlap

#ASN15
15 ASN H        15 ASN  HA    5        #changed from 3.3
15 ASN H        15 ASN  HB2   3.3
15 ASN H        15 ASN  HB3   3.3    #3.8

15 ASN HA       15 ASN  HB2   4.3
15 ASN HA       15 ASN  HB3   4.3

15 ASN H        14 LYS  HA    4.3        #changed from 3.8 overlap plane of K14
15 ASN H        14 LYS  QB    3.3      #3.8
15 ASN H        14 LYS  QG    5         #changed from 3.8
15 ASN H        14 LYS  QD    6

#ILE16
16 ILE H        16 ILE  HA    5         #changed from 3.3
16 ILE H        16 ILE  HB    3.3
16 ILE H        16 ILE  QD1   6
16 ILE H        16 ILE  QG2   6
16 ILE H        16 ILE  HG12  5
16 ILE H        16 ILE  HG22  5

16 ILE HA       16 ILE  HB    4.3      #changed from 2.8
16 ILE HA       16 ILE  HG12  3.3
16 ILE HA       16 ILE  HG22  3.3
16 ILE HA       16 ILE  QD1   5.0   #changed from 4.3

16 ILE H        15 ASN  HA    4.3
16 ILE H        15 ASN  HB2	  4.3
16 ILE H        15 ASN  HB3	  4.3

#THR17
17 THR H        17 THR  HA    5        #changed from 3.3
17 THR H        17 THR  HB    3.3
17 THR H        17 THR  QG2	  5.5       #changed from 4.3

17 THR HA       17 THR  HB    5
17 THR HA       17 THR  QG2   3.8

17 THR H        16 ILE  HA    5
17 THR H        16 ILE  HB    3.3
17 THR H        16 ILE  QD1   6
17 THR H        16 ILE  HG12  5.5       #changed from 5
17 THR H        16 ILE  HG22  5.5       #changed from 5

#GLU18
18 GLU H        18 GLU  HA   5        #changed from 3.3
18 GLU H        18 GLU  QB   3.8
18 GLU H        18 GLU  QG   5.5

18 GLU HA       18 GLU  QB   4.3
18 GLU HA       18 GLU  QG   3.8

18 GLU H        17 THR  HA   5
18 GLU H        17 THR  HB   3.3
18 GLU H        17 THR  QG2  5.5

#ARG19
19 ARG H        19 ARG  HA   5          #changed from 4.3
19 ARG H        19 ARG  QB   3.8
19 ARG H        19 ARG  QG   4.3
19 ARG H        19 ARG  QD   6

19 ARG HA       19 ARG  QB   5       #overlap
19 ARG HA       19 ARG  QG   3.8		   #overlap
19 ARG HA       19 ARG  QD   6

19 ARG H        18 GLU  HA   5         #overlap
19 ARG H        18 GLU  QB   3.8
19 ARG H        18 GLU  QG   5.5

#VAL20
20 VAL H        20 VAL  HA   5           #changed from 3.3
20 VAL H        20 VAL  HB   3.3     #changed from 3.3
20 VAL H        20 VAL  QG1  5.5       #changed from 3.8, then 4.3
20 VAL H        20 VAL  QG2  5.5         #changed from 4.3

20 VAL HA       20 VAL  HB   4.3
20 VAL HA       20 VAL  QG1  4.3
20 VAL HA       20 VAL  QG2  3.8       #overlap together

20 VAL H        19 ARG  HA   5
20 VAL H        19 ARG  QB   3.8
20 VAL H        19 ARG  QD   6

#SER21
21 SER H        21 SER  HA   5         #changed from 3.3
21 SER H        21 SER  QB   3.3

21 SER HA       21 SER  QB   4.3

21 SER H        20 VAL  HA   4.3
21 SER H        20 VAL  HB   4.3
21 SER H        20 VAL  QG1  3.8
21 SER H        20 VAL  QG2  5

#MET22
22 MET H        22 MET  HA   5       #overlap 21ha and changed from 3.3
22 MET H        22 MET  QB   3.8      #changed from 3.3
22 MET H        22 MET  HG2  5.5
22 MET H        22 MET  HG3  5.5
22 MET H        22 MET  QE   6

22 MET HA       22 MET  QB   4.3
22 MET HA       22 MET  HG2  3.3
22 MET HA       22 MET  HG3  3.3
22 MET HA       22 MET  QE   6     #overlap

22 MET H        21 SER  HA   5      #overlap
22 MET H        21 SER  QB   3.8

#ALA23
23 ALA H        23 ALA  HA   5           #changed from 4.3
23 ALA H        23 ALA  QB   3.8    #changed from 3.3

23 ALA HA       23 ALA  QB   3.8

23 ALA H        22 MET  HA   5     #overlap
23 ALA H        22 MET  QB   3.8
23 ALA H        22 MET  HG2  5
23 ALA H        22 MET  HG3  5
23 ALA H        22 MET  QE   6     #overlap hb

#THR24
24 THR H        24 THR  HA   5
24 THR H        24 THR  HB   3.3     #changed from 3.3
24 THR H        24 THR  QG2  4.8

24 THR HA       24 THR  HB   5    #overlap
24 THR HA       24 THR  QG2  3.8   #s/m

24 THR H        23 ALA  HA   5    #overlap hb
24 THR H        23 ALA  QB   3.8

#ALA25
25 ALA H        25 ALA  HA   5    #overlap T24hb
25 ALA H        25 ALA  QB   3.8   #changed from 

25 ALA HA       25 ALA  QB   3.8   #overlap

25 ALA H        24 THR  HA   5
25 ALA H        24 THR  HB   3.3    #overlap ha
25 ALA H        24 THR  QG2  5.5

#SER26
26 SER H        26 SER  HA   5             #changed from 3.3
26 SER H        26 SER  QB   3.8     #changed from 3.8

26 SER HA       26 SER  QB   5.5

26 SER H        25 ALA  HA   5
26 SER H        25 ALA  QB   4.3

#SER27
27 SER H        27 SER  HA   5        #changed from 4.3
27 SER H        27 SER  QB   3.8

27 SER HA       27 SER  QB   5       #m/w

27 SER H        26 SER  HA   5
27 SER H        26 SER  QB   3.8   #overlap

#GLN28
28 GLN H        28 GLN  HA   5          #changed from 3.3
28 GLN H        28 GLN  HB2  4.3
28 GLN H        28 GLN  HB3  4.3
28 GLN H        28 GLN  QG   4.8

28 GLN HA       28 GLN  HB2  3.3   #relative to each other
28 GLN HA       28 GLN  HB3  3.3
28 GLN HA       28 GLN  QG   5

28 GLN H        27 SER  HA   5     #overlap
28 GLN H        27 SER  QB   3.8

#28 GLN QG       30 LEU  QB   5

#VAL29
29 VAL H        29 VAL  HA   5           #changed from 4.3
29 VAL H        29 VAL  HB   4.3  #changed from 3.3
29 VAL H        29 VAL  QG1  4.8     #hg overlap
29 VAL H        29 VAL  QG2  4.8

29 VAL HA       29 VAL  HB   5
29 VAL HA       29 VAL  QG1  4.8
29 VAL HA       29 VAL  QG2  4.8

29 VAL H        28 GLN  HA   3.8
29 VAL H        28 GLN  HB2  5    #overlap
29 VAL H        28 GLN  HB3  5    #changed from 4.3
29 VAL H        28 GLN  QG   5   #changed from 4.3

#LEU30
30 LEU H        30 LEU  HA   5     #changed from 3.8
30 LEU H        30 LEU  HB2  4.3
30 LEU H        30 LEU  HB3  4.3
30 LEU H        30 LEU  HG   5.0   #s/m  underneath hb3
30 LEU H        30 LEU  QD1  5     #changed from 4.3
30 LEU H        30 LEU  QD2  6

30 LEU HA       30 LEU  HB2  5
30 LEU HA       30 LEU  HB3  5
30 LEU HA       30 LEU  HG   5	   #overlap
30 LEU HA       30 LEU  QD1  6
30 LEU HA       30 LEU  QD2  6       #lost separation of peaks

30 LEU H        29 VAL  HA   3.8     #changed from 3.3
30 LEU H        29 VAL  HB   5.0    #changed from 5
30 LEU H        29 VAL  QG1  5.5
30 LEU H        29 VAL  QG2  5.5    #overlap hd changed from 5

#ILE31
31 ILE H        31 ILE  HA   5     #s/m and changed from 4.3
31 ILE H        31 ILE  HB   4.3    #changed from 3.3
31 ILE H        31 ILE  QG1  4.8
31 ILE H        31 ILE  QG2  5.0       #changed from 4.3
31 ILE H        31 ILE  QD1  6    #overlap

31 ILE HA       31 ILE  HB   5
31 ILE HA       31 ILE  QG1  3.8
31 ILE HA       31 ILE  QG2  3.8
31 ILE HA       31 ILE  QD1  6   #overlap

31 ILE H        30 LEU  HA   3.8      #changed from 2.8
31 ILE H        30 LEU  HB2  5.0        #changed from 3.3
31 ILE H        30 LEU  HB3  5.0
31 ILE H        30 LEU  HG   5
31 ILE H        30 LEU  QD1  6        #changed from 5
#31 ILE H        30 LEU  QD2  5.5    #overlap changed from 5

#PRO32
32 PRO  HA         32  PRO  QB   4.3
32 PRO  HA         32  PRO  HG2  5
32 PRO  HA         32  PRO  HG3  5     #large signal but overlap e/o
32 PRO  HA         32  PRO  HD2  5
32 PRO  HA         32  PRO  HD3  5

32 PRO  HA         31  ILE  H   5
32 PRO  HA         31  ILE  HB   5

32 PRO   HD2        31 ILE  HA   3.3
32 PRO   HD3        31 ILE  HA   3.3     #overlap with hg P32
32 PRO   HD2        31 ILE  QG2  4.8
32 PRO   HD3        31 ILE  QG2  6.0


#GLU33
33 GLU H        33 GLU  HA   5
33 GLU H        33 GLU  HB2  5     #overlap hb2/hb3
33 GLU H        33 GLU  HB3  5
33 GLU H        33 GLU  HG2  4.3
33 GLU H        33 GLU  HG3  5

33 GLU HA       33 GLU  HB2  5    #overlap e/o
33 GLU HA       33 GLU  HB3  5
33 GLU HA       33 GLU  HG2  5	#overlap e/o
33 GLU HA       33 GLU  HG3  5

33 GLU H        32 PRO  HA   3.3   #changed from 3.3
#33 GLU H        32 PRO  QB   5.0   #overlap with #33 hb
#33 GLU H        32 PRO  QG   5.0   #overlap
#33 GLU H        32 PRO  HD3  5.0

33  GLU  HB2     31  ILE  QD1  4.3

#ILE34
34 ILE H        34 ILE  HA   5     #overlap with another ha
34 ILE H        34 ILE  HB   3.8   #changed from 4.3   
34 ILE H        34 ILE  HG12 5
34 ILE H        34 ILE  HG13 5
34 ILE H        34 ILE  QG2  5.5     #overlap hd1
34 ILE H        34 ILE  QD1  6

34 ILE HA       34 ILE  HB   4.3     #s/m
34 ILE HA       34 ILE  HG12 5
34 ILE HA       34 ILE  HG13 5
34 ILE HA       34 ILE  QG2  5.5     #overlap s
34 ILE HA       34 ILE  QD1  6

34 ILE H        33 GLU  HA   4.3      #s/overlap of ha for 34
34 ILE H        33 GLU  HB2  5      #m/w
34 ILE H        33 GLU  HB3  5      #m/w
34 ILE H        33 GLU  HG2  5
34 ILE H        33 GLU  HG3  5

#ASN35
35 ASN H        35 ASN  HA   5
35 ASN H        35 ASN  HB2  4.3   #changed from 3.3
35 ASN H        35 ASN  HB3  4.3   #changed from 3.3

35 ASN HA       35 ASN  HB2  5
35 ASN HA       35 ASN  HB3  4.3

35 ASN H        34 ILE  HA   4.3    
35 ASN H        34 ILE  HB   4.3
35 ASN H        34 ILE  HG12 5      #changed from 4.3
35 ASN H        34 ILE  HG13 5
35 ASN H        34 ILE  QG2  5   #overlap
35 ASN H        34 ILE  QD1  6.5


#LEU36
36 LEU H        36 LEU  HA   5
36 LEU H        36 LEU  QB   4.3    #s
36 LEU H        36 LEU  HG   5    #s/m  changed from 3.3
36 LEU H        36 LEU  QD1  6
36 LEU H        36 LEU  QD2  5   #changed from 5

36 LEU HA       36 LEU  QB   5
36 LEU HA       36 LEU  HG   4.3
36 LEU HA       36 LEU  QD1  6    #overlap hd2
36 LEU HA       36 LEU  QD2  6

36 LEU H        35 ASN  HA   3.8
36 LEU H        35 ASN  HB2  5
36 LEU H        35 ASN  HB3  5

#ASN37
37 ASN H        37 ASN  HA   5
37 ASN H        37 ASN  QB   3.3

37 ASN HA       37 ASN  QB   4.3

37 ASN H        36 LEU  HA   4.3
37 ASN H        36 LEU  QB   4.3
37 ASN H        36 LEU  HG   4.8      
37 ASN H        36 LEU  QD1  6
37 ASN H        36 LEU  QD2  5    #s than hd1 but still w

#ASP38
38 ASP H        38 ASP  HA  5
38 ASP H        38 ASP  QB  3.3     #hb2/hb3 overlap

38 ASP HA       38 ASP  QB  5

38 ASP H        37 ASN  HA  5     #overlap
38 ASP H        37 ASN  QB  3.8

#THR39
39 THR H        39 THR  HA  5
39 THR H        39 THR  HB  3.3   #changed from 3.3
39 THR H        39 THR  QG2 5     #changed from 4.3

39 THR HA       39 THR  HB  5     #overlap
39 THR HA       39 THR  QG2 3.8    #s/m

39 THR H        38 ASP  HA  5   #changed from 3.8   overlapped with others
39 THR H        38 ASP  QB  3.8    #changed form 3.3

#PHE40
40 PHE H        40 PHE  HA  5
40 PHE H        40 PHE  HB2 3.3
40 PHE H        40 PHE  HB3 3.3    #changed from 3.3
40 PHE H        40 PHE  QD  5.3

40 PHE HA       40 PHE  HB2 4.3
40 PHE HA       40 PHE  HB3 4.3
40 PHE HA       40 PHE  QD  6.3

40 PHE H        39 THR  HA  5
40 PHE H        39 THR  HB  3.3
40 PHE H        39 THR  QG2 5    #m/w

#ASP41
41 ASP H        41 ASP  HA  5   #overlap ha 40
41 ASP H        41 ASP  HB2 3.8
41 ASP H        41 ASP  HB3 3.8

41 ASP HA       41 ASP  HB2 5    #overlap e/o
41 ASP HA       41 ASP  HB3 5

41 ASP H        40 PHE  HA  5    #overlap ha
41 ASP H        40 PHE  HB2 3.8
41 ASP H        40 PHE  HB3 4.3

#THR42
42 THR H         42 THR HA  5     #overlap 
42 THR H         42 THR HB  3.3     #overlap
42 THR H         42 THR QG2 3.8 

42 THR HA        42 THR HB  5    #overlap     
42 THR HA        42 THR QG2 3.8

42 THR H         41 ASP HA  3.8
42 THR H         41 ASP HB2	3.3
42 THR H         41 ASP HB3 4.3

#PHE43
43 PHE H         43 PHE HA  5
43 PHE H         43 PHE HB2 3.8      #s/m overlap
43 PHE H         43 PHE HB3 3.8
43 PHE H         43 PHE QD  7.3

43 PHE HA        43 PHE HB2 5
43 PHE HA        43 PHE HB3 5      #overlap
43 PHE HA        43 PHE QD  4.3

43 PHE H         42 THR HA  5			
43 PHE H         42 THR HB  4.3    #changed from 3.3
43 PHE H         42 THR QG2 4.3

#ALA44
44 ALA H         44 ALA HA  5
44 ALA H         44 ALA QB  3.3

44 ALA HA        44 ALA QB  3.8 

44 ALA H         43 PHE HA  4.3   #changed from 3.3
44 ALA H         43 PHE HB2 4.3
44 ALA H         43 PHE HB3 4.3

#LEU45
45 LEU H         45 LEU HA  5
45 LEU H         45 LEU QB  3.8
45 LEU H         45 LEU HG  5    #changed from 4.3
45 LEU H         45 LEU QD1 6         #overlap
45 LEU H         45 LEU QD2 6

45 LEU HA        45 LEU QB  5
45 LEU HA        45 LEU HG  3.8
45 LEU HA        45 LEU QD1 3.8
45 LEU HA        45 LEU QD2 5

45 LEU H         44 ALA HA  5
45 LEU H         44 ALA QB  3.3

#45 LEU QB        43 PHE QD  6.5

#ASP46
46 ASP H         46 ASP HA  5
46 ASP H         46 ASP HB2 3.8         #slight overlap hb3
46 ASP H         46 ASP HB3 3.8         #m/s

#46 ASP HA       46 ASP HB2	5		#no ha in cnoesy
#46 ASP HA       46 ASP HB3 5

46 ASP H         45 LEU HA  4.3   #changed from 3.3
46 ASP H         45 LEU QB 3.8
46 ASP H         45 LEU HG 4.3   #changed from 3.8
46 ASP H         45 LEU QD1 4.3
46 ASP H         45 LEU QD2 6

#PHE47
47 PHE H         47 PHE HA  5
47 PHE H         47 PHE HB2 3.3         #m/s overlap
47 PHE H         47 PHE HB3 3.3
47 PHE H         47 PHE QD  6.3

47 PHE HA        47 PHE HB2 4.3
47 PHE HA        47 PHE HB3 4.3
47 PHE HA        47 PHE QD  5.3

47 PHE H         46 ASP HA  4.3    #changed from 3.3
47 PHE H         46 ASP HB2 3.3
47 PHE H         46 ASP HB3 3.8 

#SER48
48 SER H         48 SER HA  5
48 SER H         48 SER HB2 3.3
48 SER H         48 SER HB3 3.3          #overlap e/o

48 SER HA        48 SER HB2 5
48 SER HA        48 SER HB3 5         #overlap e/o

48 SER H         47 PHE HA  5           #overlap ha
48 SER H         47 PHE HB2 4.3       #changed from 4.3
48 SER H         47 PHE HB3 3.3

48 SER HA        51 LYS QD  4.8

#ARG49
49 ARG H         49 ARG HA  5           #overlap ha 48
49 ARG H         49 ARG QB  3.8
49 ARG H         49 ARG QG  4.3
49 ARG H         49 ARG QD  5.5

49 ARG HA        49 ARG QB  4.3   #changed from 3.8
49 ARG HA        49 ARG QG  3.8        #m/s
49 ARG HA        49 ARG QD  5.5

49 ARG H         48 SER HA  5          #overlap
49 ARG H         48 SER HB2 4.3
49 ARG H         48 SER HB3 3.3

#GLU50
50 GLU H         50 GLU HA  5
50 GLU H         50 GLU HB2 3.3
50 GLU H         50 GLU HB3 3.3
50 GLU H         50 GLU QG  5.5

50 GLU HA        50 GLU HB2 5    #overlap with m22
50 GLU HA        50 GLU HB3 5    
50 GLU HA        50 GLU QG  3.8    #not there

50 GLU H         49 ARG HA  5
50 GLU H         49 ARG QB  3.8
50 GLU H         49 ARG QG  5
50 GLU H         49 ARG QD  5

#LYS51 
51 LYS H        51 LYS  HA  5.0
51 LYS H        51 LYS  QB  3.8
51 LYS H        51 LYS  QG  4.3
51 LYS H        51 LYS  QD  6
51 LYS H        51 LYS  QE  6

51 LYS HA        51 LYS QB  4.3
51 LYS HA        51 LYS QG  3.8
51 LYS HA        51 LYS QD  5.0
51 LYS HA        51 LYS QD  5

51 LYS HE3        52 LYS HA  5.0
51 LYS HE3        52 LYS HB2  4.3
51 LYS HE3        52 LYS HG3  4.8
51 LYS HE3        52 LYS HD3  3.3

#LYS52
52 LYS H        52 LYS  HA  5.0
52 LYS H        52 LYS  QB  3.8
52 LYS H        52 LYS  QG  4.3
52 LYS H        52 LYS  QD  6

52 LYS HA        52 LYS QB  4.3
52 LYS HA        52 LYS QG  4.8
52 LYS HA        52 LYS QD  5.0

52 LYS H        51 LYS  HA  5.0
52 LYS H        51 LYS  QB  3.8
52 LYS H        51 LYS  QG  4.3
52 LYS H        51 LYS  QD  6
52 LYS H        51 LYS  QE  6

#LEU53
53 LEU H         53 LEU HA  5.0
53 LEU H         53 LEU HB2 3.3
53 LEU H         53 LEU HB3 3.3
53 LEU H         53 LEU HG  5.0
53 LEU H         53 LEU QD2 6.0

53 LEU HA        53 LEU HB2 5.0
53 LEU HA        53 LEU HB3 5.0
53 LEU HA        53 LEU HG  3.8
53 LEU HA        53 LEU QD2 5.0

53 LEU H         52 LYS HA  5.0
53 LEU H         52 LYS QB  3.8
53 LEU H         52 LYS QG  4.3
53 LEU H         52 LYS QD  5.0
53 LEU H         52 LYS QE 6.0

#LEU54
54 LEU H         54 LEU HA  5.0
54 LEU H         54 LEU HB2 3.3
54 LEU H         54 LEU HB3 3.3
54 LEU H         54 LEU HG  5.0
54 LEU H         54 LEU QD2 6.0

54 LEU HA        54 LEU HB2 5.0
54 LEU HA        54 LEU HB3 5.0
54 LEU HA        54 LEU HG  3.8
54 LEU HA        54 LEU QD2 5.0

#GLU55
55 GLU H         55 GLU HA  5.0
55 GLU H         55 GLU HB2 3.3
55 GLU H         55 GLU HB3 3.3
55 GLU H         55 GLU QG  5.0

55 GLU HA        55 GLU HB2 5.0
55 GLU HA        55 GLU HB3 5.0   #overlap e/o
55 GLU HA        55 GLU QG  3.8

#.................helix 1...............
#NH-NHi+1
05  ASP  H        06  HIS  H    4.3
06  HIS  H        07  ALA  H    2.8
07  ALA  H        08  ARG  H    2.8
08  ARG  H        09  PHE  H    2.8
09  PHE  H        10  LEU  H    2.8    #overlap but know is strong
10  LEU  H        11  GLN  H    2.8    #overlap
11  GLN  H        12  THR  H    2.8
12  THR  H        13  ALA  H    2.8
13  ALA  H        14  LYS  H    2.8
14  LYS  H        15  ASN  H    2.8
15  ASN  H        16  ILE  H    2.8
16  ILE  H        17  THR  H    2.8
17  THR  H        18  GLU  H    2.8
18  GLU  H        19  ARG  H    2.8
19  ARG  H        20  VAL  H    2.8
21  SER  H        22  MET  H    2.8
22  MET  H        23  ALA  H    2.8      #overlap
23  ALA  H        24  THR  H    2.8      #overlap M22
24  THR  H        25  ALA  H    2.8
25  ALA  H        26  SER  H    2.8
26  SER  H        27  SER  H    2.8      #overlap
27  SER  H        28  GLN  H    2.8
28  GLN  H        29  VAL  H    2.8
29  VAL  H        30  LEU  H    2.8
30  LEU  H        31  ILE  H    3.8

#NH-NHi+2
05  ASP  H        07  ALA  H    5
06  HIS  H        08  ARG  H    5    #overlap eachother, arg to the right
07  ALA  H        09  PHE  H    5
08  ARG  H        10  LEU  H    5    #same plane different H
09  PHE  H        11  GLN  H    5    #overlap e/o
10  LEU  H        12  THR  H    5
11  GLN  H        13  ALA  H    5
12  THR  H        14  LYS  H    5
13  ALA  H        15  ASN  H    5
14  LYS  H        16  ILE  H    5
15  ASN  H        17  THR  H    5
16  ILE  H        18  GLU  H    5
17  THR  H        19  ARG  H    5
18  GLU  H        20  VAL  H    5        #overlap 16
19  ARG  H        21  SER  H    5
20  VAL  H        22  MET  H    5
21  SER  H        23  ALA  H    5
22  MET  H        24  THR  H    5
23  ALA  H        25  ALA  H    5
24  THR  H        26  SER  H    5
25  ALA  H        27  SER  H    5
26  SER  H        28  GLN  H    5       #overlap w/ S27 +1
27  SER  H        29  VAL  H    5        #overlap
28  GLN  H        30  LEU  H    5       #overlap
29  VAL  H        31  ILE  H    5

#NH-NHi+3
05  ASP  H        08  ARG  H    5    #very very weak
06  HIS  H        09  PHE  H    5     #overlap R8
07  ALA  H        10  LEU  H    5       #overlap right underneath it
08  ARG  H        11  GLN  H    5
09  PHE  H        12  THR  H    5
10  LEU  H        13  ALA  H    5
11  GLN  H        14  LYS  H    5
12  THR  H        15  ASN  H    5
13  ALA  H        16  ILE  H    5
14  LYS  H        17  THR  H    5
15  ASN  H        18  GLU  H    5
16  ILE  H        19  ARG  H    5
17  THR  H        20  VAL  H    5       #overlap 16
18  GLU  H        21  SER  H    5
19  ARG  H        22  MET  H    5       #overlap
20  VAL  H        23  ALA  H    5       #overlap
21  SER  H        24  THR  H    5
22  MET  H        25  ALA  H    5
23  ALA  H        26  SER  H    5
24  THR  H        27  SER  H    5        #overlap S26
25  ALA  H        28  GLN  H    5
#26  SER  H        29  VAL  H    5
#27  SER  H        30  LEU  H    5
#28  GLN  H        31  ILE  H    5

#aNHi+1
07  ALA  HA       08  ARG  H    5     #overlap with its own ha
08  ARG  HA       09  PHE  H    5    #weak
09  PHE  HA       10  LEU  H    5
10  LEU  HA       11  GLN  H    5     #overlap A13
11  GLN  HA       12  THR  H    5
12  THR  HA       13  ALA  H    5
13  ALA  HA       14  LYS  H    5
14  LYS  HA       15  ASN  H    5
15  ASN  HA       16  ILE  H    5
16  ILE  HA       17  THR  H    5
17  THR  HA       18  GLU  H    5
18  GLU  HA       19  ARG  H    5
19  ARG  HA       20  VAL  H    5
20  VAL  HA       21  SER  H    5
21  SER  HA       22  MET  H    5
22  MET  HA       23  ALA  H    5        #overlap
23  ALA  HA       24  THR  H    5
24  THR  HA       25  ALA  H    5
25  ALA  HA       26  SER  H    5
26  SER  HA       27  SER  H    5
27  SER  HA       28  GLN  H    5
#28  GLN  HA       29  VAL  H    5
#29  VAL  HA       30  LEU  H    5
#30  LEU  HA       31  ILE  H    5

#aNHi+2 
06  HIS  HA       08  ARG  H    5   #overlap/slightly to right
07  ALA  HA       09  PHE  H    5
08  ARG  HA       10  LEU  H    5     #very weak
09  PHE  HA       11  GLN  H    5 
10  LEU  HA       12  THR  H    5   
11  GLN  HA       13  ALA  H    5    #overlap with T12 ha
12  THR  HA       14  LYS  H    5     #overlap e/o
13  ALA  HA       15  ASN  H    5
14  LYS  HA       16  ILE  H    5
15  ASN  HA       17  THR  H    5
16  ILE  HA       18  GLU  H    5
17  THR  HA       19  ARG  H    5
18  GLU  HA       20  VAL  H    5
19  ARG  HA       21  SER  H    5
20  VAL  HA       22  MET  H    5
21  SER  HA       23  ALA  H    5
22  MET  HA       24  THR  H    5
23  ALA  HA       25  ALA  H    5   #direct overlap
24  THR  HA       26  SER  H    5
25  ALA  HA       27  SER  H    5
26  SER  HA       28  GLN  H    5
#27  SER  HA       29  VAL  H    5
#28  GLN  HA       30  LEU  H    5
#29  VAL  HA       31  ILE  H    5

#aNHi+3
05  ASP  HA       08  ARG  H    5     
06  HIS  HA       09  PHE  H    5    #overlap with R8 HA
07  ALA  HA       10  LEU  H    5    #very weak
08  ARG  HA       11  GLN  H    5
09  PHE  HA       12  THR  H    5     #maybe 4.3
10  LEU  HA       13  ALA  H    5
11  GLN  HA       14  LYS  H    5       #overlap with itself ha
12  THR  HA       15  ASN  H    5    #overlap K14 ha
13  ALA  HA       16  ILE  H    5
14  LYS  HA       17  THR  H    5
15  ASN  HA       18  GLU  H    5
16  ILE  HA       19  ARG  H    5
17  THR  HA       20  VAL  H    5       #overlap 16
18  GLU  HA       21  SER  H    5       #overlap
19  ARG  HA       22  MET  H    5
20  VAL  HA       23  ALA  H    5
21  SER  HA       24  THR  H    5
22  MET  HA       25  ALA  H    5     #overlap
23  ALA  HA       26  SER  H    5
24  THR  HA       27  SER  H    5
25  ALA  HA       28  GLN  H    5
#27  SER  HA       30  LEU  H    5       #??????
#28  GLN  HA       31  ILE  H    5       #??????

#aNHi+4
06  HIS  HA       10  LEU  H    5     #overlap R8
08  ARG  HA       12  THR  H    5
09  PHE  HA       13  ALA  H    5
10  LEU  HA       14  LYS  H    5
11  GLN  HA       15  ASN  H    5    #overlap K14 ha
12  THR  HA       16  ILE  H    5    #overlap K14
13  ALA  HA       17  THR  H    5
14  LYS  HA       18  GLU  H    5
15  ASN  HA       19  ARG  H    5
16  ILE  HA       20  VAL  H    5   #overlap with its own ha
17  THR  HA       21  SER  H    5
18  GLU  HA       22  MET  H    5    #overlap
19  ARG  HA       23  ALA  H    5
20  VAL  HA       24  THR  H    5
21  SER  HA       25  ALA  H    5    #overlap with its own ha
22  MET  HA       26  SER  H    5    #overlaps with 25 ha
23  ALA  HA       27  SER  H    5    #overlap with 25
24  THR  HA       28  GLN  H    5   #overlap with hb S27

#aHbi+3
06  HIS  HA       09  PHE  HB2  3.8   #overlap
06  HIS  HA       09  PHE  HB3  3.8
07  ALA  HA       10  LEU  HB2  3.8
07  ALA  HA       10  LEU  HB3  3.8
08  ARG  HA       11  GLN  QB   4.3
09  PHE  HA       12  THR  HB   3.8    #overlap with ha
10  LEU  HA       13  ALA  QB   3.8
11  GLN  HA       14  LYS  QB   3.8    #changed from 3.3
12  THR  HA       15  ASN  QB   3.8
13  ALA  HA       16  ILE  HB   3.8
14  LYS  HA       17  THR  HB   3.8
15  ASN  HA       18  GLU  QB   3.8       #changed from 4.3
16  ILE  HA       19  ARG  QB   3.8
17  THR  HA       20  VAL  HB   3.8   #changed from 3.8
18  GLU  HA       21  SER  QB   3.8       #changed from 4.3
19  ARG  HA       22  MET  QB   3.8       #changed from 4.3
20  VAL  HA       23  ALA  QB   4.3
21  SER  HA       24  THR  HB   3.8
22  MET  HA       25  ALA  QB   4.3
23  ALA  HA       26  SER  QB   3.8
24  THR  HA       27  SER  QB   3.8

#H-bond
5 ASP  O   9 PHE H 2.5  
5 ASP  O   9 PHE N 3.5 
6 HIS  O   10 LEU H 2.5
6 HIS  O   10 LEU N 3.5
7 ALA  O   11 GLN H 2.5
7 ALA  O   11 GLN N 3.5
8 ARG  O   12 THR H 2.5
8 ARG  O   12 THR N 3.5
9 PHE  O   13 ALA H 2.5
9 PHE  O   13 ALA N 3.3
10 LEU  O   14 LYS H 2.5
10 LEU  O   14 LYS N 3.5
11 GLN  O   15 ASN H 2.5
11 GLN  O   15 ASN N 3.5
12 THR  O   16 ILE H 2.5
12 THR  O   16 ILE N 3.5
13 ALA  O   17 THR H 2.5
13 ALA  O   17 THR N 3.5
14 LYS  O   18 GLU H 2.5  
14 LYS  O   18 GLU N 3.5 
15 ASN  O   19 ARG H 2.5
15 ASN  O   19 ARG N 3.5
16 ILE  O   20 VAL H 2.5
16 ILE  O   20 VAL N 3.5
17 THR  O   21 SER H 2.5
17 THR  O   21 SER N 3.5
18 GLU  O   22 MET H 2.5
18 GLU  O   22 MET N 3.3
19 ARG  O   23 ALA H 2.5
20 VAL  O   24 THR H 2.5
20 VAL  O   24 THR N 3.5
21 SER  O   25 ALA H 2.5
21 SER  O   25 ALA N 3.5
22 MET  O   26 SER H 2.5
22 MET  O   26 SER N 3.5
23 ALA  O   27 SER H 2.5
23 ALA  O   27 SER N 3.5
24 THR  O   28 GLN H 2.5
24 THR  O   28 GLN N 3.5

#.................helix 2...............
#NH-NHi+1
33  GLU  H        34  ILE  H    2.8
34  ILE  H        35  ASN  H    2.8
35  ASN  H        36  LEU  H    2.8      #overlap
36  LEU  H        37  ASN  H    2.8
37  ASN  H        38  ASP  H    2.8
38  ASP  H        39  THR  H    2.8
39  THR  H        40  PHE  H    2.8
40  PHE  H        41  ASP  H    2.8
41  ASP  H        42  THR  H    3.3
42  THR  H        43  PHE  H    3.3
43  PHE  H        44  ALA  H    3.3
44  ALA  H        45  LEU  H    3.3     #overlap F43
45  LEU  H        46  ASP  H    3.3
46  ASP  H        47  PHE  H    3.3
47  PHE  H        48  SER  H    3.3
48  SER  H        49  ARG  H    2.8
49  ARG  H        50  GLU  H    2.8     #overlap?
50  GLU  H        51  LYS  H    2.8    #weak spin system but could be strong
51  LYS  H        52  LYS  H    2.8    #weak spin system
52  LYS  H        53  LEU  H    2.8    #overlap with other spin system
53  LEU  H        54  LEU  H    2.8    #weak spin system
54  LEU  H        55  GLU  H    2.8    #weak spin system, E55 overlap with E33 and L10


#NH-NHi+2
36  LEU  H        38  ASP  H    5
37  ASN  H        39  THR  H    5
38  ASP  H        40  PHE  H    5       #overlap N37
39  THR  H        41  ASP  H    5
40  PHE  H        42  THR  H    5
41  ASP  H        43  PHE  H    5
42  THR  H        44  ALA  H    5
43  PHE  H        45  LEU  H    5        #overlap
44  ALA  H        46  ASP  H    5
45  LEU  H        47  PHE  H    5
46  ASP  H        48  SER  H    5
47  PHE  H        49  ARG  H    5        #overlap e/o
48  SER  H        50  GLU  H    5
50  GLU  H        52  LYS  H    5     #overlap spin systems      
51  LYS  H        53  LEU  H    5
52  LYS  H        54  LEU  H    5
53  LEU  H        55  GLU  H    5

#NH-NHi+3
36  LEU  H        39  THR  H    5
37  ASN  H        40  PHE  H    5        #overlap
38  ASP  H        41  ASP  H    5        #overlap e/o
39  THR  H        42  THR  H    5        #overlap e/o
40  PHE  H        43  PHE  H    5
41  ASP  H        44  ALA  H    5
42  THR  H        45  LEU  H    5        #overlap with F43
43  PHE  H        46  ASP  H    5        #overlap  with L45
44  ALA  H        47  PHE  H    5      # barely there
46  ASP  H        49  ARG  H    5        #overlap
47  PHE  H        50  GLU  H    5
50  GLU  H        53  LEU  H    5     #weak
51  LYS  H        54  LEU  H    5
52  LYS  H        55  GLU  H    5

#NH-NHi+4
37  ASN  H        41  ASP  H    6    #overlap with F40
38  ASP  H        42  THR  H    6    #overlap with D41
#39  THR  H        43  PHE  H    5      #overlap with T42
#40  PHE  H        44  ALA  H    5     #very very weak  ????
#41  ASP  H        45  LEU  H    5    #?????
#42  THR  H        46  ASP  H    5    #?????
#43  PHE  H        47  PHE  H    5      #overlap with L45 ???
#44  ALA  H        48  SER  H    5    #??
#45  LEU  H        49  ARG  H    5    #overlap with F47

#aNHi+1
33  GLU  H        34  ILE  H    5
34  ILE  H        35  ASN  H    5
35  ASN  H        36  LEU  H    5
36  LEU  HA       37  ASN  H    5
37  ASN  HA       38  ASP  H    5
38  ASP  HA       39  THR  H    5
39  THR  HA       40  PHE  H    5
40  PHE  HA       41  ASP  H    5      #overlap e/o
41  ASP  HA       42  THR  H    5
42  THR  HA       43  PHE  H    5
43  PHE  HA       44  ALA  H    5
44  ALA  HA       45  LEU  H    5
45  LEU  HA       46  ASP  H    5
46  ASP  HA       47  PHE  H    5
47  PHE  HA       48  SER  H    5       #overlap
48  SER  HA       49  ARG  H    5       #overlap e/o
49  ARG  HA       50  GLU  H    5
50  GLU  HA       51  LYS  H    5
51  LYS  HA       52  LYS  H    5
52  LYS  HA       53  LEU  H    5
53  LEU  HA       54  LEU  H    5
54  LEU  HA       55  GLU  H    5

#aNHi+2
36  LEU  HA       38  ASP  H    5
37  ASN  HA       39  THR  H    5
38  ASP  HA       40  PHE  H    5
39  THR  HA       41  ASP  H    5         
40  PHE  HA       42  THR  H    5     #overlap with D41 ha
41  ASP  HA       43  PHE  H    5         #overlap e/o and F40
42  THR  HA       44  ALA  H    5         #overlap  e/o
43  PHE  HA       45  LEU  H    5         #overlap D41 
44  ALA  HA       46  ASP  H    5       #overlap with T42 ha
45  LEU  HA       47  PHE  H    5
46  ASP  HA       48  SER  H    5
47  PHE  HA       49  ARG  H    5      #overlap with S48 and e/o
48  SER  HA       50  GLU  H    5
49  ARG  HA       51  LYS  H    5
50  GLU  HA       52  LYS  H    5
51  LYS  HA       53  LEU  H    5
52  LYS  HA       54  LEU  H    5
53  LEU  HA       55  GLU  H    5


#aNHi+3
36  LEU  HA       39  THR  H    5
37  ASN  HA       40  PHE  H    5        #overlap  D41
38  ASP  HA       41  ASP  H    5        #close to e/o slight overlap
39  THR  HA       42  THR  H    5      #overlap with T42 hb
40  PHE  HA       43  PHE  H    5        #overlap e/o and with D41 and F40
41  ASP  HA       44  ALA  H    5       #overlap with F40 and F43
42  THR  HA       45  LEU  H    5        #overlap A44 ha
43  PHE  HA       46  ASP  H    5
44  ALA  HA       47  PHE  H    5     
46  ASP  HA       49  ARG  H    5
49  ARG  HA       52  LYS  H    5
50  GLU  HA       53  LEU  H    5
51  LYS  HA       54  LEU  H    5
52  LYS  HA       55  GLU  H    5

#aNHi+4
35  ASN  HA       39  THR  H    5
36  LEU  HA       40  PHE  H    5
37  ASN  HA       41  ASP  H    5     #slight overlap with D38, F40 and D41 ha
38  ASP  HA       42  THR  H    5     #slight overlap with D41 and D40
39  THR  HA       43  PHE  H    5      #overlap with T42 hb
40  PHE  HA       44  ALA  H    5      #overlap with F40 and D41
41  ASP  HA       45  LEU  H    5      #overlap with F43 ha
42  THR  HA       46  ASP  H    5     #overlap with A44 ha
43  PHE  HA       47  PHE  H    5  #?
44  ALA  HA       48  SER  H    5  #?
45  LEU  HA       49  ARG  H    5  #?
46  ASP  HA       50  GLU  H    5    #overlap F47
47  PHE  HA       51  LYS  H    5    #overlap e/o


#aHbi+3
36  LEU  HA       39  THR  HB   3.8
37  ASN  HA       40  PHE  HB3  3.8      #overlap spin systems???
38  ASP  HA       41  ASP  HB2  3.8        #over e/o spin systems
38  ASP  HA       41  ASP  HB3  3.8
39  THR  HA       42  THR  HB   3.8        #over e/o
40  PHE  HA       43  PHE  QB   3.8      #over e/o
41  ASP  HA       44  ALA  QB   4.3
42  THR  HA       45  LEU  QB   3.8
43  PHE  HA       46  ASP  QB   3.8     
44  ALA  HA       47  PHE  HB3  3.8
44  ALA  HA       47  PHE  HB3  3.8
45  LEU  HA       48  SER  HB2  3.8
45  LEU  HA       48  SER  HB3  3.8
48  SER  HA       51  LYS  HB2  3.3
48  SER  HA       51  LYS  HB3  3.3
51  LYS  HA       54  LEU  HB2  3.8   #overlap e.o
51  LYS  HA       54  LEU  HB3  3.8   #overlap eo
52  LYS  HA       55  GLU  HB2  3.8
52  LYS  HA       55  GLU  HB3  3.8    #overlap eo

#Hbond
36 LEU  O   40 PHE H 2.5  
36 LEU  O   40 PHE N 3.5 
37 ASN  O   41 ASP H 2.5
37 ASN  O   41 ASP N 3.5
38 ASP  O   42 THR H 2.5
38 ASP  O   42 THR N 3.5
39 THR  O   43 PHE H 2.5
39 THR  O   43 PHE N 3.5
40 PHE  O   44 ALA H 2.5
40 PHE  O   44 ALA N 3.3
41 ASP  O   45 LEU H 2.5
41 ASP  O   45 LEU N 3.5
42 THR  O   46 ASP H 2.5
42 THR  O   46 ASP N 3.5
43 PHE  O   47 PHE H 2.5
43 PHE  O   47 PHE N 3.5
44 ALA  O   48 SER H 2.5
44 ALA  O   48 SER N 3.5
45 LEU  O   49 ARG H 2.5  
45 LEU  O   49 ARG N 3.5 
46 ASP  O   50 GLU H 2.5
46 ASP  O   50 GLU N 3.5
47 PHE  O   51 LYS H 2.5
47 PHE  O   51 LYS N 3.5
48 SER  O   52 LYS H 2.5
48 SER  O   52 LYS N 3.5
49 ARG  O   53 LEU H 2.5
49 ARG  O   53 LEU N 3.3
50 GLU  O   54 LEU H 2.5
50 GLU  O   54 LEU N 3.5
51 LYS  O   55 GLU H 2.5
51 LYS  O   55 GLU N 3.5
52 LYS  O   56 CYS H 2.5
52 LYS  O   56 CYS N 3.5


#short range
12  THR  QG2      09  PHE  QD1  7.5

13  ALA  QB       09  PHE  QD1  7.5

16  ILE  QD1      12  THR  QG2  5.5   #new

44  ALA  QB       40  PHE  QD1  6.5

39  THR  QB       43  PHE  QD   6.5

#long distance
30  LEU  QD1      40  PHE  QD   6.5
30  LEU  QD2      40  PHE  QD   6.5
36  LEU  QD2      40  PHE  QD   6.5

30  LEU  QD1      25  ALA  QB   4.3

40  PHE  QD       24  THR  QG2  4.8
40  PHE  QE       24  THR  QG2  5.5

24  THR  QG2      43  PHE  QB   5.5   #new 6-8

43  PHE  QB       24  THR  QG2  5.5     #m/s
43  PHE  QD       24  THR  QG2  5.5
43  PHE  QE       24  THR  QG2  5.5

47  PHE  QB       16  ILE  QG2  6.0
47  PHE  QB       16  ILE  HG22 5.0

47  PHE  HB2      17  THR  QG2  5.0
47  PHE  HB3      17  THR  QG2  4.3

47  PHE  HD1       16  ILE  QG2  3.8
47  PHE  HD1       16  ILE  HG22 3.8

17  THR  QG2      47  PHE  QD2   6.5

44  ALA  QB       20  VAL  QG2  5.5

17  THR  QG2      44  ALA  QB   4.8   #overlap eachother

40  PHE  HD1       43  PHE  HD1   4.3
40  PHE  HE1       43  PHE  HE1   4.3
43  PHE  HD2       47  PHE  HD2   4.3
43  PHE  HE2       47  PHE  HE2   4.3

12  THR  QG2      54  LEU  QD1  3.8   #changed from 4.3
12  THR  QG2      54  LEU  QD2  4.8

12  THR  QG2      16  ILE  QD1  3.3  #new 6-8

54  LEU  QD1      9  PHE  QD1   5.5
54  LEU  QD2      9  PHE  QE1   5.5

13  ALA  QB       54 LEU  QD1  5.0    #m/w

19  ARG  QD       47  PHE  QD1  7.5

13  ALA  QB       51  LYS  QB   4.3
13  ALA  QB       51  LYS  QG   5.5

13  ALA  QB       55  GLU  QB   3.8

51  LYS  QB       16  ILE  QD1  3.8
51  LYS  QB       16  ILE  QG2  4.3

36  LEU  HG       40  PHE  QD   7.5

25  ALA  QB       30  LEU  QD2  4.8

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    LEU   1           H        LEU   1   1.807   0.000   0.855
    2    HA   LEU   1           HA       LEU   1   2.375  -1.020  -1.457
    3    HB2  LEU   1          2HB       LEU   1   0.521   1.226  -1.977
    4    HB3  LEU   1          3HB       LEU   1   1.891   1.059  -3.074
    5    HG   LEU   1           HG       LEU   1   0.005  -1.215  -2.512
    6   HD11  LEU   1          1HD1      LEU   1  -1.579   0.050  -3.478
    7   HD12  LEU   1          2HD1      LEU   1  -0.719  -0.338  -4.968
    8   HD13  LEU   1          3HD1      LEU   1  -0.411   1.191  -4.145
    9   HD21  LEU   1          1HD2      LEU   1   2.220  -0.648  -4.410
   10   HD22  LEU   1          2HD2      LEU   1   0.865  -1.624  -4.979
   11   HD23  LEU   1          3HD2      LEU   1   1.797  -2.143  -3.574
   12    H    LYS   2           H        LYS   2   4.294  -0.668  -0.183
   13    HA   LYS   2           HA       LYS   2   5.450   2.002  -0.225
   14    HB2  LYS   2          2HB       LYS   2   5.784  -0.379   1.364
   15    HB3  LYS   2          3HB       LYS   2   7.341   0.155   0.746
   16    HG2  LYS   2          2HG       LYS   2   6.162   2.489   1.627
   17    HG3  LYS   2          3HG       LYS   2   5.679   1.290   2.831
   18    HD2  LYS   2          2HD       LYS   2   7.800   0.991   3.576
   19    HD3  LYS   2          3HD       LYS   2   8.509   1.228   1.977
   20    HE2  LYS   2          2HE       LYS   2   9.187   3.054   3.361
   21    HE3  LYS   2          3HE       LYS   2   8.008   3.663   2.200
   22    HZ1  LYS   2          1HZ       LYS   2   7.484   4.556   4.323
   23    HZ2  LYS   2          2HZ       LYS   2   7.544   3.035   5.062
   24    HZ3  LYS   2          3HZ       LYS   2   6.304   3.396   3.970
   25    H    GLU   3           H        GLU   3   6.221   2.567  -2.175
   26    HA   GLU   3           HA       GLU   3   8.028   0.671  -3.525
   27    HB2  GLU   3          2HB       GLU   3   5.703   1.710  -4.552
   28    HB3  GLU   3          3HB       GLU   3   6.913   2.818  -5.184
   29    HG2  GLU   3          2HG       GLU   3   7.874   1.243  -6.507
   30    HG3  GLU   3          3HG       GLU   3   7.458  -0.083  -5.423
   31    H    ASN   4           H        ASN   4   9.258   2.229  -5.321
   32    HA   ASN   4           HA       ASN   4  10.828   4.018  -3.624
   33    HB2  ASN   4          2HB       ASN   4  11.744   2.112  -5.201
   34    HB3  ASN   4          3HB       ASN   4  11.596   3.357  -6.439
   35   HD21  ASN   4          1HD2      ASN   4  13.464   2.126  -3.910
   36   HD22  ASN   4          2HD2      ASN   4  14.655   3.376  -3.854
   37    H    ASP   5           H        ASP   5   8.185   4.743  -4.731
   38    HA   ASP   5           HA       ASP   5   9.003   7.267  -5.954
   39    HB2  ASP   5          2HB       ASP   5   8.465   6.061  -7.917
   40    HB3  ASP   5          3HB       ASP   5   7.063   5.305  -7.165
   41    H    HIS   6           H        HIS   6   5.998   5.499  -5.186
   42    HA   HIS   6           HA       HIS   6   4.563   7.769  -4.370
   43    HB2  HIS   6          2HB       HIS   6   3.689   5.424  -4.975
   44    HB3  HIS   6          3HB       HIS   6   4.040   5.003  -3.301
   45    HD1  HIS   6           HD1      HIS   6   2.060   7.673  -5.161
   46    HD2  HIS   6           HD2      HIS   6   1.949   5.451  -1.652
   47    HE1  HIS   6           HE1      HIS   6  -0.103   8.295  -4.040
   48    H    ALA   7           H        ALA   7   6.486   5.435  -2.538
   49    HA   ALA   7           HA       ALA   7   5.864   6.245   0.044
   50    HB1  ALA   7          1HB       ALA   7   7.789   5.106   0.753
   51    HB2  ALA   7          2HB       ALA   7   7.279   4.265  -0.711
   52    HB3  ALA   7          3HB       ALA   7   8.629   5.399  -0.770
   53    H    ARG   8           H        ARG   8   8.501   7.405  -2.054
   54    HA   ARG   8           HA       ARG   8   9.562   9.288  -0.286
   55    HB2  ARG   8          2HB       ARG   8  10.806   8.667  -2.236
   56    HB3  ARG   8          3HB       ARG   8   9.515   9.205  -3.302
   57    HG2  ARG   8          2HG       ARG   8  10.333  11.263  -3.366
   58    HG3  ARG   8          3HG       ARG   8  10.395  11.356  -1.605
   59    HD2  ARG   8          2HD       ARG   8  12.467   9.964  -3.292
   60    HD3  ARG   8          3HD       ARG   8  12.602  11.638  -2.754
   61    HE   ARG   8           HE       ARG   8  12.129   9.886  -0.567
   62   HH11  ARG   8          1HH1      ARG   8  15.901  10.655  -1.665
   63   HH12  ARG   8          2HH1      ARG   8  14.600  10.976  -2.764
   64   HH21  ARG   8          1HH2      ARG   8  15.463   9.791   0.411
   65   HH22  ARG   8          2HH2      ARG   8  13.833   9.459   0.888
   66    H    PHE   9           H        PHE   9   7.036   9.631  -2.751
   67    HA   PHE   9           HA       PHE   9   6.629  12.385  -2.511
   68    HB2  PHE   9          2HB       PHE   9   5.237  10.124  -3.703
   69    HB3  PHE   9          3HB       PHE   9   4.118  11.329  -3.073
   70    HD1  PHE   9           HD1      PHE   9   3.315  12.652  -4.760
   71    HD2  PHE   9           HD2      PHE   9   7.422  11.535  -4.797
   72    HE1  PHE   9           HE1      PHE   9   3.669  14.030  -6.768
   73    HE2  PHE   9           HE2      PHE   9   7.783  12.911  -6.804
   74    HZ   PHE   9           HZ       PHE   9   5.905  14.162  -7.792
   75    H    LEU  10           H        LEU  10   5.282   9.686  -0.684
   76    HA   LEU  10           HA       LEU  10   3.409  11.211   0.797
   77    HB2  LEU  10          2HB       LEU  10   4.111   8.516   0.548
   78    HB3  LEU  10          3HB       LEU  10   4.389   8.917   2.242
   79    HG   LEU  10           HG       LEU  10   1.802   9.809   1.161
   80   HD11  LEU  10          1HD1      LEU  10   1.432   7.863   0.082
   81   HD12  LEU  10          2HD1      LEU  10   1.099   7.278   1.711
   82   HD13  LEU  10          3HD1      LEU  10   2.679   6.999   0.981
   83   HD21  LEU  10          1HD2      LEU  10   2.618   9.913   3.556
   84   HD22  LEU  10          2HD2      LEU  10   2.424   8.161   3.599
   85   HD23  LEU  10          3HD2      LEU  10   1.026   9.196   3.303
   86    H    GLN  11           H        GLN  11   6.690  10.064   1.534
   87    HA   GLN  11           HA       GLN  11   6.909  10.988   4.134
   88    HB2  GLN  11          2HB       GLN  11   8.894  10.553   1.935
   89    HB3  GLN  11          3HB       GLN  11   9.418  11.292   3.442
   90    HG2  GLN  11          2HG       GLN  11   7.837   8.932   3.936
   91    HG3  GLN  11          3HG       GLN  11   9.205   8.581   2.881
   92   HE21  GLN  11          1HE2      GLN  11   8.390  10.250   5.894
   93   HE22  GLN  11          2HE2      GLN  11   9.861   9.860   6.713
   94    H    THR  12           H        THR  12   6.951  12.755   1.149
   95    HA   THR  12           HA       THR  12   8.111  15.146   2.222
   96    HB   THR  12           HB       THR  12   6.571  14.646  -0.329
   97    HG1  THR  12           HG1      THR  12   9.322  15.274  -0.038
   98   HG21  THR  12          1HG2      THR  12   7.666  17.148   0.860
   99   HG22  THR  12          2HG2      THR  12   6.226  16.904  -0.129
  100   HG23  THR  12          3HG2      THR  12   7.821  16.912  -0.880
  101    H    ALA  13           H        ALA  13   4.811  14.367   1.101
  102    HA   ALA  13           HA       ALA  13   3.534  16.673   1.898
  103    HB1  ALA  13          1HB       ALA  13   2.675  13.871   1.468
  104    HB2  ALA  13          2HB       ALA  13   1.559  14.938   2.322
  105    HB3  ALA  13          3HB       ALA  13   2.118  15.361   0.703
  106    H    LYS  14           H        LYS  14   4.432  13.878   3.836
  107    HA   LYS  14           HA       LYS  14   3.023  14.742   6.176
  108    HB2  LYS  14          2HB       LYS  14   3.747  12.348   5.541
  109    HB3  LYS  14          3HB       LYS  14   5.325  12.805   6.167
  110    HG2  LYS  14          2HG       LYS  14   3.057  13.384   7.943
  111    HG3  LYS  14          3HG       LYS  14   3.373  11.674   7.642
  112    HD2  LYS  14          2HD       LYS  14   5.670  13.449   8.304
  113    HD3  LYS  14          3HD       LYS  14   4.573  12.972   9.603
  114    HE2  LYS  14          2HE       LYS  14   5.714  10.928   7.734
  115    HE3  LYS  14          3HE       LYS  14   6.656  11.515   9.104
  116    HZ1  LYS  14          1HZ       LYS  14   3.912  10.458   9.431
  117    HZ2  LYS  14          2HZ       LYS  14   5.100  10.677  10.615
  118    HZ3  LYS  14          3HZ       LYS  14   5.269   9.447   9.467
  119    H    ASN  15           H        ASN  15   6.424  14.767   5.150
  120    HA   ASN  15           HA       ASN  15   7.516  15.883   7.464
  121    HB2  ASN  15          2HB       ASN  15   8.888  14.901   5.685
  122    HB3  ASN  15          3HB       ASN  15   8.434  16.210   4.598
  123   HD21  ASN  15          1HD2      ASN  15   9.508  18.099   4.684
  124   HD22  ASN  15          2HD2      ASN  15  10.809  18.432   5.771
  125    H    ILE  16           H        ILE  16   5.597  17.301   4.987
  126    HA   ILE  16           HA       ILE  16   6.423  20.010   5.407
  127    HB   ILE  16           HB       ILE  16   3.951  18.890   4.084
  128   HG12  ILE  16          2HG1      ILE  16   6.173  20.255   2.630
  129   HG13  ILE  16          3HG1      ILE  16   6.425  18.599   3.171
  130   HG21  ILE  16          1HG2      ILE  16   3.784  21.182   3.079
  131   HG22  ILE  16          2HG2      ILE  16   3.422  21.095   4.802
  132   HG23  ILE  16          3HG2      ILE  16   4.983  21.712   4.259
  133   HD11  ILE  16          1HD1      ILE  16   5.268  17.822   1.458
  134   HD12  ILE  16          2HD1      ILE  16   3.880  18.823   1.883
  135   HD13  ILE  16          3HD1      ILE  16   5.148  19.470   0.843
  136    H    THR  17           H        THR  17   3.453  18.220   6.243
  137    HA   THR  17           HA       THR  17   2.493  20.326   7.936
  138    HB   THR  17           HB       THR  17   1.377  17.596   8.250
  139    HG1  THR  17           HG1      THR  17   1.142  19.093   5.832
  140   HG21  THR  17          1HG2      THR  17   0.253  19.416   9.326
  141   HG22  THR  17          2HG2      THR  17  -0.746  18.903   7.966
  142   HG23  THR  17          3HG2      THR  17   0.240  20.359   7.837
  143    H    GLU  18           H        GLU  18   4.694  17.776   8.331
  144    HA   GLU  18           HA       GLU  18   4.249  17.433  11.171
  145    HB2  GLU  18          2HB       GLU  18   5.002  15.558   9.721
  146    HB3  GLU  18          3HB       GLU  18   6.514  16.412   9.450
  147    HG2  GLU  18          2HG       GLU  18   6.464  16.384  12.140
  148    HG3  GLU  18          3HG       GLU  18   5.589  14.894  11.791
  149    H    ARG  19           H        ARG  19   6.514  19.086   9.046
  150    HA   ARG  19           HA       ARG  19   8.321  19.870  11.103
  151    HB2  ARG  19          2HB       ARG  19   9.147  19.806   8.865
  152    HB3  ARG  19          3HB       ARG  19   7.863  20.862   8.292
  153    HG2  ARG  19          2HG       ARG  19   8.807  22.745   9.385
  154    HG3  ARG  19          3HG       ARG  19   9.955  21.734  10.266
  155    HD2  ARG  19          2HD       ARG  19  10.182  21.307   7.425
  156    HD3  ARG  19          3HD       ARG  19  10.350  23.019   7.813
  157    HE   ARG  19           HE       ARG  19  11.921  21.416   9.552
  158   HH11  ARG  19          1HH1      ARG  19  13.530  22.709   6.122
  159   HH12  ARG  19          2HH1      ARG  19  11.809  22.704   6.320
  160   HH21  ARG  19          1HH2      ARG  19  14.883  21.976   7.819
  161   HH22  ARG  19          2HH2      ARG  19  14.189  21.417   9.303
  162    H    VAL  20           H        VAL  20   5.447  21.283   9.673
  163    HA   VAL  20           HA       VAL  20   5.752  23.869  10.818
  164    HB   VAL  20           HB       VAL  20   4.312  23.555   8.892
  165   HG11  VAL  20          1HG1      VAL  20   3.574  21.246   9.570
  166   HG12  VAL  20          2HG1      VAL  20   2.419  22.019  10.657
  167   HG13  VAL  20          3HG1      VAL  20   2.308  22.285   8.917
  168   HG21  VAL  20          1HG2      VAL  20   2.828  24.405  11.375
  169   HG22  VAL  20          2HG2      VAL  20   3.781  25.429  10.300
  170   HG23  VAL  20          3HG2      VAL  20   2.275  24.712   9.728
  171    H    SER  21           H        SER  21   3.942  20.973  11.774
  172    HA   SER  21           HA       SER  21   2.618  22.030  13.988
  173    HB2  SER  21          2HB       SER  21   2.522  19.652  12.807
  174    HB3  SER  21          3HB       SER  21   3.623  19.221  14.115
  175    HG   SER  21           HG       SER  21   1.026  20.338  14.364
  176    H    MET  22           H        MET  22   5.766  20.380  13.823
  177    HA   MET  22           HA       MET  22   6.391  20.480  16.538
  178    HB2  MET  22          2HB       MET  22   8.011  20.305  14.031
  179    HB3  MET  22          3HB       MET  22   8.835  20.565  15.562
  180    HG2  MET  22          2HG       MET  22   7.547  18.529  16.400
  181    HG3  MET  22          3HG       MET  22   7.180  18.221  14.704
  182    HE1  MET  22          1HE       MET  22  10.509  18.745  13.227
  183    HE2  MET  22          2HE       MET  22  10.012  17.067  13.010
  184    HE3  MET  22          3HE       MET  22   8.809  18.357  12.959
  185    H    ALA  23           H        ALA  23   6.978  22.843  13.970
  186    HA   ALA  23           HA       ALA  23   8.482  24.657  15.523
  187    HB1  ALA  23          1HB       ALA  23   8.575  25.897  13.651
  188    HB2  ALA  23          2HB       ALA  23   7.864  24.473  12.892
  189    HB3  ALA  23          3HB       ALA  23   6.833  25.816  13.386
  190    H    THR  24           H        THR  24   5.072  24.866  14.483
  191    HA   THR  24           HA       THR  24   4.358  27.093  15.968
  192    HB   THR  24           HB       THR  24   2.359  24.894  15.698
  193    HG1  THR  24           HG1      THR  24   3.069  24.636  13.695
  194   HG21  THR  24          1HG2      THR  24   1.356  27.173  14.556
  195   HG22  THR  24          2HG2      THR  24   2.425  27.820  15.801
  196   HG23  THR  24          3HG2      THR  24   1.136  26.700  16.240
  197    H    ALA  25           H        ALA  25   4.403  23.690  16.924
  198    HA   ALA  25           HA       ALA  25   3.108  23.840  19.363
  199    HB1  ALA  25          1HB       ALA  25   4.805  21.948  19.984
  200    HB2  ALA  25          2HB       ALA  25   3.589  21.684  18.733
  201    HB3  ALA  25          3HB       ALA  25   5.249  22.070  18.281
  202    H    SER  26           H        SER  26   6.559  24.351  18.675
  203    HA   SER  26           HA       SER  26   7.333  24.865  21.334
  204    HB2  SER  26          2HB       SER  26   9.108  24.373  19.890
  205    HB3  SER  26          3HB       SER  26   8.539  25.494  18.653
  206    HG   SER  26           HG       SER  26  10.258  25.934  20.668
  207    H    SER  27           H        SER  27   6.366  27.030  18.699
  208    HA   SER  27           HA       SER  27   6.804  29.452  20.050
  209    HB2  SER  27          2HB       SER  27   6.439  29.277  17.605
  210    HB3  SER  27          3HB       SER  27   4.749  28.870  17.903
  211    HG   SER  27           HG       SER  27   5.357  31.174  17.457
  212    H    GLN  28           H        GLN  28   4.456  27.045  20.523
  213    HA   GLN  28           HA       GLN  28   2.721  26.858  21.985
  214    HB2  GLN  28          2HB       GLN  28   3.370  29.616  23.005
  215    HB3  GLN  28          3HB       GLN  28   2.602  28.289  23.867
  216    HG2  GLN  28          2HG       GLN  28   4.885  27.086  23.405
  217    HG3  GLN  28          3HG       GLN  28   5.474  28.740  23.246
  218   HE21  GLN  28          1HE2      GLN  28   6.116  26.746  25.255
  219   HE22  GLN  28          2HE2      GLN  28   5.690  27.437  26.780
  220    H    VAL  29           H        VAL  29   2.044  27.566  19.480
  221    HA   VAL  29           HA       VAL  29  -0.214  29.395  19.925
  222    HB   VAL  29           HB       VAL  29   1.269  29.341  17.308
  223   HG11  VAL  29          1HG1      VAL  29   0.038  31.270  16.779
  224   HG12  VAL  29          2HG1      VAL  29  -1.126  30.186  17.543
  225   HG13  VAL  29          3HG1      VAL  29  -0.439  31.529  18.456
  226   HG21  VAL  29          1HG2      VAL  29   2.310  31.489  18.030
  227   HG22  VAL  29          2HG2      VAL  29   1.732  31.165  19.664
  228   HG23  VAL  29          3HG2      VAL  29   2.896  30.077  18.908
  229    H    LEU  30           H        LEU  30  -0.538  26.729  20.181
  230    HA   LEU  30           HA       LEU  30  -2.027  26.031  17.744
  231    HB2  LEU  30          2HB       LEU  30  -1.367  23.748  17.894
  232    HB3  LEU  30          3HB       LEU  30   0.090  24.741  17.905
  233    HG   LEU  30           HG       LEU  30  -1.122  23.666  20.437
  234   HD11  LEU  30          1HD1      LEU  30  -0.020  21.677  20.262
  235   HD12  LEU  30          2HD1      LEU  30   1.191  22.315  19.150
  236   HD13  LEU  30          3HD1      LEU  30  -0.431  21.941  18.567
  237   HD21  LEU  30          1HD2      LEU  30   1.245  25.204  19.683
  238   HD22  LEU  30          2HD2      LEU  30   1.594  23.818  20.717
  239   HD23  LEU  30          3HD2      LEU  30   0.443  25.046  21.246
  240    H    ILE  31           H        ILE  31  -2.651  27.164  20.493
  241    HA   ILE  31           HA       ILE  31  -4.791  25.248  21.128
  242    HB   ILE  31           HB       ILE  31  -4.590  25.915  23.522
  243   HG12  ILE  31          2HG1      ILE  31  -1.863  26.698  23.561
  244   HG13  ILE  31          3HG1      ILE  31  -2.688  27.749  22.415
  245   HG21  ILE  31          1HG2      ILE  31  -3.668  23.805  22.688
  246   HG22  ILE  31          2HG2      ILE  31  -2.139  24.613  22.342
  247   HG23  ILE  31          3HG2      ILE  31  -2.699  24.460  24.008
  248   HD11  ILE  31          1HD1      ILE  31  -3.965  28.724  24.021
  249   HD12  ILE  31          2HD1      ILE  31  -3.958  27.295  25.055
  250   HD13  ILE  31          3HD1      ILE  31  -2.535  28.332  24.974
  251    HA   PRO  32           HA       PRO  32  -7.564  28.639  20.826
  252    HB2  PRO  32          2HB       PRO  32  -9.471  27.906  22.614
  253    HB3  PRO  32          3HB       PRO  32  -9.264  27.110  21.049
  254    HG2  PRO  32          2HG       PRO  32  -8.311  26.250  23.754
  255    HG3  PRO  32          3HG       PRO  32  -9.051  25.279  22.468
  256    HD2  PRO  32          2HD       PRO  32  -6.380  25.316  22.911
  257    HD3  PRO  32          3HD       PRO  32  -7.076  25.102  21.292
  258    H    GLU  33           H        GLU  33  -8.608  30.377  22.069
  259    HA   GLU  33           HA       GLU  33  -8.164  30.860  24.784
  260    HB2  GLU  33          2HB       GLU  33  -5.864  31.343  23.121
  261    HB3  GLU  33          3HB       GLU  33  -6.425  32.855  23.819
  262    HG2  GLU  33          2HG       GLU  33  -6.220  30.545  25.647
  263    HG3  GLU  33          3HG       GLU  33  -4.709  31.226  25.046
  264    H    ILE  34           H        ILE  34  -7.647  33.008  21.991
  265    HA   ILE  34           HA       ILE  34 -10.278  34.199  22.421
  266    HB   ILE  34           HB       ILE  34  -7.733  35.825  22.428
  267   HG12  ILE  34          2HG1      ILE  34  -8.932  36.533  24.693
  268   HG13  ILE  34          3HG1      ILE  34  -9.631  34.924  24.548
  269   HG21  ILE  34          1HG2      ILE  34  -9.344  37.075  21.241
  270   HG22  ILE  34          2HG2      ILE  34 -10.631  36.619  22.356
  271   HG23  ILE  34          3HG2      ILE  34  -9.355  37.717  22.884
  272   HD11  ILE  34          1HD1      ILE  34  -7.767  33.984  25.279
  273   HD12  ILE  34          2HD1      ILE  34  -6.791  34.853  24.094
  274   HD13  ILE  34          3HD1      ILE  34  -7.171  35.603  25.644
  275    H    ASN  35           H        ASN  35  -7.273  34.327  20.526
  276    HA   ASN  35           HA       ASN  35  -8.815  34.200  18.074
  277    HB2  ASN  35          2HB       ASN  35  -8.519  36.667  18.765
  278    HB3  ASN  35          3HB       ASN  35  -6.824  36.442  18.344
  279   HD21  ASN  35          1HD2      ASN  35  -7.136  38.051  16.732
  280   HD22  ASN  35          2HD2      ASN  35  -7.872  37.646  15.222
  281    H    LEU  36           H        LEU  36  -6.832  32.578  19.553
  282    HA   LEU  36           HA       LEU  36  -4.478  32.651  17.844
  283    HB2  LEU  36          2HB       LEU  36  -4.363  32.277  20.324
  284    HB3  LEU  36          3HB       LEU  36  -5.122  30.709  20.054
  285    HG   LEU  36           HG       LEU  36  -2.547  31.431  18.695
  286   HD11  LEU  36          1HD1      LEU  36  -2.693  31.577  21.373
  287   HD12  LEU  36          2HD1      LEU  36  -1.270  31.006  20.503
  288   HD13  LEU  36          3HD1      LEU  36  -2.415  29.846  21.177
  289   HD21  LEU  36          1HD2      LEU  36  -4.261  29.101  18.942
  290   HD22  LEU  36          2HD2      LEU  36  -2.591  28.757  19.391
  291   HD23  LEU  36          3HD2      LEU  36  -2.957  29.430  17.802
  292    H    ASN  37           H        ASN  37  -7.269  30.601  18.496
  293    HA   ASN  37           HA       ASN  37  -6.570  28.337  17.058
  294    HB2  ASN  37          2HB       ASN  37  -8.551  28.319  18.410
  295    HB3  ASN  37          3HB       ASN  37  -9.269  29.629  17.477
  296   HD21  ASN  37          1HD2      ASN  37 -10.257  29.192  15.551
  297   HD22  ASN  37          2HD2      ASN  37 -10.557  27.589  14.983
  298    H    ASP  38           H        ASP  38  -8.236  31.259  15.904
  299    HA   ASP  38           HA       ASP  38  -8.583  30.463  13.248
  300    HB2  ASP  38          2HB       ASP  38  -8.977  32.823  14.776
  301    HB3  ASP  38          3HB       ASP  38  -8.064  33.276  13.340
  302    H    THR  39           H        THR  39  -5.789  31.695  14.923
  303    HA   THR  39           HA       THR  39  -4.290  32.330  12.564
  304    HB   THR  39           HB       THR  39  -2.615  31.774  14.853
  305    HG1  THR  39           HG1      THR  39  -4.543  33.776  15.369
  306   HG21  THR  39          1HG2      THR  39  -2.534  34.440  14.563
  307   HG22  THR  39          2HG2      THR  39  -3.231  34.002  13.003
  308   HG23  THR  39          3HG2      THR  39  -1.675  33.333  13.493
  309    H    PHE  40           H        PHE  40  -4.098  29.702  14.966
  310    HA   PHE  40           HA       PHE  40  -2.071  28.243  13.712
  311    HB2  PHE  40          2HB       PHE  40  -2.935  27.893  16.048
  312    HB3  PHE  40          3HB       PHE  40  -4.332  27.083  15.347
  313    HD1  PHE  40           HD1      PHE  40  -0.704  26.907  14.521
  314    HD2  PHE  40           HD2      PHE  40  -4.179  24.844  15.854
  315    HE1  PHE  40           HE1      PHE  40   0.547  24.788  14.490
  316    HE2  PHE  40           HE2      PHE  40  -2.935  22.722  15.826
  317    HZ   PHE  40           HZ       PHE  40  -0.568  22.692  15.144
  318    H    ASP  41           H        ASP  41  -5.591  28.049  13.373
  319    HA   ASP  41           HA       ASP  41  -5.717  25.828  11.687
  320    HB2  ASP  41          2HB       ASP  41  -7.508  27.884  12.601
  321    HB3  ASP  41          3HB       ASP  41  -7.760  27.602  10.881
  322    H    THR  42           H        THR  42  -5.945  29.253  10.707
  323    HA   THR  42           HA       THR  42  -5.771  28.851   7.968
  324    HB   THR  42           HB       THR  42  -6.135  31.043   9.448
  325    HG1  THR  42           HG1      THR  42  -5.147  30.849   6.788
  326   HG21  THR  42          1HG2      THR  42  -3.382  31.549   8.358
  327   HG22  THR  42          2HG2      THR  42  -3.623  30.967  10.005
  328   HG23  THR  42          3HG2      THR  42  -4.312  32.511   9.505
  329    H    PHE  43           H        PHE  43  -3.295  28.726  10.382
  330    HA   PHE  43           HA       PHE  43  -1.068  29.124   8.652
  331    HB2  PHE  43          2HB       PHE  43  -1.017  29.408  11.143
  332    HB3  PHE  43          3HB       PHE  43  -1.114  27.657  11.294
  333    HD1  PHE  43           HD1      PHE  43   0.938  27.147  12.288
  334    HD2  PHE  43           HD2      PHE  43   0.829  29.589   8.803
  335    HE1  PHE  43           HE1      PHE  43   3.388  26.997  12.110
  336    HE2  PHE  43           HE2      PHE  43   3.278  29.442   8.619
  337    HZ   PHE  43           HZ       PHE  43   4.561  28.144  10.273
  338    H    ALA  44           H        ALA  44  -2.188  26.160  10.296
  339    HA   ALA  44           HA       ALA  44  -0.601  24.375   8.862
  340    HB1  ALA  44          1HB       ALA  44  -1.629  23.627  10.862
  341    HB2  ALA  44          2HB       ALA  44  -3.243  23.989  10.249
  342    HB3  ALA  44          3HB       ALA  44  -2.313  22.662   9.553
  343    H    LEU  45           H        LEU  45  -3.946  25.411   8.250
  344    HA   LEU  45           HA       LEU  45  -4.637  23.830   6.138
  345    HB2  LEU  45          2HB       LEU  45  -5.823  25.872   7.310
  346    HB3  LEU  45          3HB       LEU  45  -5.204  26.745   5.910
  347    HG   LEU  45           HG       LEU  45  -7.426  26.152   5.390
  348   HD11  LEU  45          1HD1      LEU  45  -7.188  24.721   3.468
  349   HD12  LEU  45          2HD1      LEU  45  -5.678  24.063   4.098
  350   HD13  LEU  45          3HD1      LEU  45  -5.764  25.754   3.604
  351   HD21  LEU  45          1HD2      LEU  45  -8.323  24.537   6.649
  352   HD22  LEU  45          2HD2      LEU  45  -6.773  23.729   6.885
  353   HD23  LEU  45          3HD2      LEU  45  -7.710  23.430   5.421
  354    H    ASP  46           H        ASP  46  -3.119  27.039   5.758
  355    HA   ASP  46           HA       ASP  46  -2.671  27.017   3.060
  356    HB2  ASP  46          2HB       ASP  46  -1.919  28.643   5.145
  357    HB3  ASP  46          3HB       ASP  46  -0.369  28.048   4.557
  358    H    PHE  47           H        PHE  47  -0.573  25.633   5.568
  359    HA   PHE  47           HA       PHE  47   1.518  24.790   3.939
  360    HB2  PHE  47          2HB       PHE  47   0.581  24.248   6.637
  361    HB3  PHE  47          3HB       PHE  47   1.300  22.821   5.898
  362    HD1  PHE  47           HD1      PHE  47   3.555  23.450   4.524
  363    HD2  PHE  47           HD2      PHE  47   1.992  25.535   7.889
  364    HE1  PHE  47           HE1      PHE  47   5.801  24.323   5.022
  365    HE2  PHE  47           HE2      PHE  47   4.235  26.412   8.392
  366    HZ   PHE  47           HZ       PHE  47   6.143  25.807   6.957
  367    H    SER  48           H        SER  48  -1.368  22.975   4.963
  368    HA   SER  48           HA       SER  48  -0.860  20.578   3.691
  369    HB2  SER  48          2HB       SER  48  -2.766  21.012   5.240
  370    HB3  SER  48          3HB       SER  48  -3.574  21.896   3.946
  371    HG   SER  48           HG       SER  48  -4.342  19.831   3.866
  372    H    ARG  49           H        ARG  49  -2.420  23.479   2.373
  373    HA   ARG  49           HA       ARG  49  -3.214  22.574  -0.092
  374    HB2  ARG  49          2HB       ARG  49  -3.225  24.980   1.065
  375    HB3  ARG  49          3HB       ARG  49  -1.856  25.220  -0.013
  376    HG2  ARG  49          2HG       ARG  49  -4.201  24.025  -1.294
  377    HG3  ARG  49          3HG       ARG  49  -4.455  25.656  -0.668
  378    HD2  ARG  49          2HD       ARG  49  -2.217  24.817  -2.509
  379    HD3  ARG  49          3HD       ARG  49  -3.688  25.652  -3.008
  380    HE   ARG  49           HE       ARG  49  -2.656  27.276  -1.100
  381   HH11  ARG  49          1HH1      ARG  49  -0.260  27.144  -4.304
  382   HH12  ARG  49          2HH1      ARG  49  -1.366  25.846  -4.000
  383   HH21  ARG  49          1HH2      ARG  49  -0.168  28.932  -2.875
  384   HH22  ARG  49          2HH2      ARG  49  -1.204  28.991  -1.490
  385    H    GLU  50           H        GLU  50   0.023  23.629   0.883
  386    HA   GLU  50           HA       GLU  50   1.184  23.358  -1.696
  387    HB2  GLU  50          2HB       GLU  50   2.009  24.249   0.861
  388    HB3  GLU  50          3HB       GLU  50   3.127  22.981   0.380
  389    HG2  GLU  50          2HG       GLU  50   2.481  25.030  -1.648
  390    HG3  GLU  50          3HG       GLU  50   3.461  25.539  -0.273
  391    H    LYS  51           H        LYS  51   0.737  21.190   1.023
  392    HA   LYS  51           HA       LYS  51   2.493  19.146   0.241
  393    HB2  LYS  51          2HB       LYS  51   1.771  18.780   2.376
  394    HB3  LYS  51          3HB       LYS  51   0.148  19.369   2.043
  395    HG2  LYS  51          2HG       LYS  51   0.830  16.867   0.683
  396    HG3  LYS  51          3HG       LYS  51   0.808  16.769   2.445
  397    HD2  LYS  51          2HD       LYS  51  -1.435  17.207   2.577
  398    HD3  LYS  51          3HD       LYS  51  -1.447  18.156   1.089
  399    HE2  LYS  51          2HE       LYS  51  -2.635  15.961   0.938
  400    HE3  LYS  51          3HE       LYS  51  -1.357  16.189  -0.254
  401    HZ1  LYS  51          1HZ       LYS  51  -1.622  14.034   1.352
  402    HZ2  LYS  51          2HZ       LYS  51  -0.461  14.943   2.180
  403    HZ3  LYS  51          3HZ       LYS  51  -0.192  14.492   0.572
  404    H    LYS  52           H        LYS  52  -0.975  19.582  -0.414
  405    HA   LYS  52           HA       LYS  52  -1.380  17.248  -1.889
  406    HB2  LYS  52          2HB       LYS  52  -3.253  18.560  -1.128
  407    HB3  LYS  52          3HB       LYS  52  -2.730  19.945  -2.078
  408    HG2  LYS  52          2HG       LYS  52  -4.554  18.944  -3.216
  409    HG3  LYS  52          3HG       LYS  52  -3.092  18.569  -4.133
  410    HD2  LYS  52          2HD       LYS  52  -4.103  16.509  -4.093
  411    HD3  LYS  52          3HD       LYS  52  -3.103  16.403  -2.642
  412    HE2  LYS  52          2HE       LYS  52  -4.898  16.576  -1.229
  413    HE3  LYS  52          3HE       LYS  52  -5.856  17.501  -2.384
  414    HZ1  LYS  52          1HZ       LYS  52  -5.753  15.244  -3.691
  415    HZ2  LYS  52          2HZ       LYS  52  -6.913  15.507  -2.489
  416    HZ3  LYS  52          3HZ       LYS  52  -5.526  14.604  -2.142
  417    H    LEU  53           H        LEU  53  -0.641  20.530  -3.069
  418    HA   LEU  53           HA       LEU  53  -0.540  20.011  -5.775
  419    HB2  LEU  53          2HB       LEU  53  -0.362  22.242  -4.722
  420    HB3  LEU  53          3HB       LEU  53   1.290  21.855  -4.245
  421    HG   LEU  53           HG       LEU  53   0.629  21.685  -7.134
  422   HD11  LEU  53          1HD1      LEU  53  -0.470  23.730  -6.688
  423   HD12  LEU  53          2HD1      LEU  53   1.123  24.152  -7.316
  424   HD13  LEU  53          3HD1      LEU  53   0.801  24.258  -5.586
  425   HD21  LEU  53          1HD2      LEU  53   2.990  23.137  -6.208
  426   HD22  LEU  53          2HD2      LEU  53   2.851  21.814  -7.367
  427   HD23  LEU  53          3HD2      LEU  53   2.908  21.470  -5.637
  428    H    LEU  54           H        LEU  54   1.749  19.169  -3.297
  429    HA   LEU  54           HA       LEU  54   3.839  18.483  -5.177
  430    HB2  LEU  54          2HB       LEU  54   4.452  19.367  -3.010
  431    HB3  LEU  54          3HB       LEU  54   3.590  18.058  -2.203
  432    HG   LEU  54           HG       LEU  54   6.176  17.982  -2.373
  433   HD11  LEU  54          1HD1      LEU  54   6.113  15.677  -2.123
  434   HD12  LEU  54          2HD1      LEU  54   4.798  15.485  -3.282
  435   HD13  LEU  54          3HD1      LEU  54   4.475  16.167  -1.688
  436   HD21  LEU  54          1HD2      LEU  54   5.839  18.315  -4.976
  437   HD22  LEU  54          2HD2      LEU  54   5.709  16.557  -4.938
  438   HD23  LEU  54          3HD2      LEU  54   7.163  17.347  -4.328
  439    H    GLU  55           H        GLU  55   1.807  16.698  -2.854
  440    HA   GLU  55           HA       GLU  55   2.634  14.131  -3.607
  441    HB2  GLU  55          2HB       GLU  55   1.375  14.647  -1.538
  442    HB3  GLU  55          3HB       GLU  55  -0.057  14.959  -2.508
  443    HG2  GLU  55          2HG       GLU  55  -0.591  12.821  -2.418
  444    HG3  GLU  55          3HG       GLU  55   0.921  12.402  -3.221
  445    H    CYS  56           H        CYS  56  -0.571  15.511  -4.326
  446    HA   CYS  56           HA       CYS  56  -0.560  13.987  -6.841
  447    HB2  CYS  56          2HB       CYS  56  -2.762  14.870  -5.000
  448    HB3  CYS  56          3HB       CYS  56  -3.108  14.496  -6.683
  449    HG   CYS  56           HG       CYS  56  -1.696  12.304  -4.465
  450    H    LEU  57           H        LEU  57  -2.312  15.136  -8.402
  451    HA   LEU  57           HA       LEU  57  -1.161  17.772  -8.919
  452    HB2  LEU  57          2HB       LEU  57  -2.000  17.547 -11.149
  453    HB3  LEU  57          3HB       LEU  57  -1.159  16.064 -10.702
  454    HG   LEU  57           HG       LEU  57  -3.662  15.340 -10.084
  455   HD11  LEU  57          1HD1      LEU  57  -3.893  17.524 -12.117
  456   HD12  LEU  57          2HD1      LEU  57  -4.884  17.215 -10.692
  457   HD13  LEU  57          3HD1      LEU  57  -5.028  16.174 -12.108
  458   HD21  LEU  57          1HD2      LEU  57  -2.185  15.227 -12.692
  459   HD22  LEU  57          2HD2      LEU  57  -3.750  14.440 -12.485
  460   HD23  LEU  57          3HD2      LEU  57  -2.384  13.967 -11.474
  461    H    ASP  58           H        ASP  58  -2.643  19.462  -9.800
  462    HA   ASP  58           HA       ASP  58  -5.388  19.309  -8.827
  463    HB2  ASP  58          2HB       ASP  58  -3.265  20.878  -7.563
  464    HB3  ASP  58          3HB       ASP  58  -4.671  21.843  -8.006
  465    H    TYR  59           H        TYR  59  -6.411  21.646  -9.297
  466    HA   TYR  59           HA       TYR  59  -5.851  22.125 -12.134
  467    HB2  TYR  59          2HB       TYR  59  -8.260  22.868 -10.462
  468    HB3  TYR  59          3HB       TYR  59  -8.089  23.171 -12.187
  469    HD1  TYR  59           HD1      TYR  59  -9.533  21.046  -9.870
  470    HD2  TYR  59           HD2      TYR  59  -7.391  20.933 -13.545
  471    HE1  TYR  59           HE1      TYR  59 -10.480  18.826 -10.347
  472    HE2  TYR  59           HE2      TYR  59  -8.333  18.714 -14.032
  473    HH   TYR  59           HH       TYR  59 -10.787  17.493 -13.017
  474    H    LEU  60           H        LEU  60  -6.943  24.107  -9.373
  475    HA   LEU  60           HA       LEU  60  -5.771  26.473 -10.537
  476    HB2  LEU  60          2HB       LEU  60  -7.614  25.838  -8.365
  477    HB3  LEU  60          3HB       LEU  60  -6.497  27.144  -7.974
  478    HG   LEU  60           HG       LEU  60  -7.700  27.508 -10.586
  479   HD11  LEU  60          1HD1      LEU  60  -9.548  27.335  -8.211
  480   HD12  LEU  60          2HD1      LEU  60  -9.570  26.290  -9.631
  481   HD13  LEU  60          3HD1      LEU  60  -9.964  28.002  -9.790
  482   HD21  LEU  60          1HD2      LEU  60  -8.452  29.632  -9.185
  483   HD22  LEU  60          2HD2      LEU  60  -6.797  29.428  -9.761
  484   HD23  LEU  60          3HD2      LEU  60  -7.205  29.035  -8.090
  Start of MODEL    2
    1    H    LEU   1           H        LEU   1   3.907  -0.803   2.441
    2    HA   LEU   1           HA       LEU   1   3.375   0.983   0.704
    3    HB2  LEU   1          2HB       LEU   1   2.936   2.601   2.578
    4    HB3  LEU   1          3HB       LEU   1   4.681   2.691   2.811
    5    HG   LEU   1           HG       LEU   1   4.940   3.625   0.570
    6   HD11  LEU   1          1HD1      LEU   1   2.677   4.429  -0.461
    7   HD12  LEU   1          2HD1      LEU   1   2.017   3.058   0.430
    8   HD13  LEU   1          3HD1      LEU   1   3.275   2.800  -0.778
    9   HD21  LEU   1          1HD2      LEU   1   3.523   4.871   2.755
   10   HD22  LEU   1          2HD2      LEU   1   3.079   5.594   1.208
   11   HD23  LEU   1          3HD2      LEU   1   4.773   5.532   1.700
   12    H    LYS   2           H        LYS   2   4.842  -0.417  -0.311
   13    HA   LYS   2           HA       LYS   2   7.677   0.291   0.074
   14    HB2  LYS   2          2HB       LYS   2   6.401  -2.352  -0.602
   15    HB3  LYS   2          3HB       LYS   2   8.101  -2.033  -0.923
   16    HG2  LYS   2          2HG       LYS   2   8.647  -2.431   1.187
   17    HG3  LYS   2          3HG       LYS   2   7.419  -1.311   1.780
   18    HD2  LYS   2          2HD       LYS   2   5.870  -2.958   2.086
   19    HD3  LYS   2          3HD       LYS   2   6.498  -3.944   0.763
   20    HE2  LYS   2          2HE       LYS   2   8.489  -4.441   2.198
   21    HE3  LYS   2          3HE       LYS   2   7.666  -3.619   3.523
   22    HZ1  LYS   2          1HZ       LYS   2   7.040  -5.763   3.901
   23    HZ2  LYS   2          2HZ       LYS   2   7.053  -6.193   2.265
   24    HZ3  LYS   2          3HZ       LYS   2   5.770  -5.285   2.890
   25    H    GLU   3           H        GLU   3   8.015   1.766  -1.502
   26    HA   GLU   3           HA       GLU   3   8.028   0.844  -4.224
   27    HB2  GLU   3          2HB       GLU   3   5.679   1.998  -3.443
   28    HB3  GLU   3          3HB       GLU   3   6.565   3.391  -4.048
   29    HG2  GLU   3          2HG       GLU   3   5.584   2.748  -5.977
   30    HG3  GLU   3          3HG       GLU   3   7.028   1.741  -6.070
   31    H    ASN   4           H        ASN   4   8.573   2.929  -5.675
   32    HA   ASN   4           HA       ASN   4  10.560   4.531  -4.211
   33    HB2  ASN   4          2HB       ASN   4  10.919   2.967  -6.757
   34    HB3  ASN   4          3HB       ASN   4  11.941   4.353  -6.387
   35   HD21  ASN   4          1HD2      ASN   4  13.802   3.798  -5.546
   36   HD22  ASN   4          2HD2      ASN   4  14.091   2.463  -4.488
   37    H    ASP   5           H        ASP   5   7.942   5.338  -4.866
   38    HA   ASP   5           HA       ASP   5   8.550   7.696  -6.422
   39    HB2  ASP   5          2HB       ASP   5   7.064   5.461  -7.561
   40    HB3  ASP   5          3HB       ASP   5   6.140   6.960  -7.587
   41    H    HIS   6           H        HIS   6   5.507   6.046  -5.593
   42    HA   HIS   6           HA       HIS   6   4.262   8.377  -4.626
   43    HB2  HIS   6          2HB       HIS   6   3.199   6.156  -5.401
   44    HB3  HIS   6          3HB       HIS   6   3.488   5.602  -3.754
   45    HD1  HIS   6           HD1      HIS   6   1.505   5.871  -2.322
   46    HD2  HIS   6           HD2      HIS   6   1.694   8.818  -5.245
   47    HE1  HIS   6           HE1      HIS   6  -0.542   7.291  -1.979
   48    H    ALA   7           H        ALA   7   6.355   6.058  -3.122
   49    HA   ALA   7           HA       ALA   7   5.680   6.569  -0.422
   50    HB1  ALA   7          1HB       ALA   7   8.388   5.694  -1.393
   51    HB2  ALA   7          2HB       ALA   7   7.612   5.343   0.153
   52    HB3  ALA   7          3HB       ALA   7   7.000   4.607  -1.329
   53    H    ARG   8           H        ARG   8   8.423   7.733  -2.388
   54    HA   ARG   8           HA       ARG   8   9.479   9.486  -0.491
   55    HB2  ARG   8          2HB       ARG   8  10.779   8.899  -2.416
   56    HB3  ARG   8          3HB       ARG   8   9.563   9.549  -3.507
   57    HG2  ARG   8          2HG       ARG   8  10.485  11.561  -3.439
   58    HG3  ARG   8          3HG       ARG   8  10.453  11.576  -1.674
   59    HD2  ARG   8          2HD       ARG   8  12.515   9.894  -2.975
   60    HD3  ARG   8          3HD       ARG   8  12.720  11.642  -3.086
   61    HE   ARG   8           HE       ARG   8  13.055  10.011  -0.757
   62   HH11  ARG   8          1HH1      ARG   8  12.718  13.986  -0.428
   63   HH12  ARG   8          2HH1      ARG   8  12.236  13.198  -1.893
   64   HH21  ARG   8          1HH2      ARG   8  13.547  12.756   1.318
   65   HH22  ARG   8          2HH2      ARG   8  13.693  11.037   1.178
   66    H    PHE   9           H        PHE   9   7.063  10.043  -3.023
   67    HA   PHE   9           HA       PHE   9   6.768  12.800  -2.698
   68    HB2  PHE   9          2HB       PHE   9   5.234  10.623  -3.932
   69    HB3  PHE   9          3HB       PHE   9   4.242  11.972  -3.387
   70    HD1  PHE   9           HD1      PHE   9   5.633  14.335  -3.935
   71    HD2  PHE   9           HD2      PHE   9   5.657  10.716  -6.175
   72    HE1  PHE   9           HE1      PHE   9   6.234  15.597  -5.960
   73    HE2  PHE   9           HE2      PHE   9   6.260  11.972  -8.204
   74    HZ   PHE   9           HZ       PHE   9   6.550  14.415  -8.098
   75    H    LEU  10           H        LEU  10   4.942  10.143  -1.193
   76    HA   LEU  10           HA       LEU  10   3.214  11.701   0.346
   77    HB2  LEU  10          2HB       LEU  10   3.648   9.019  -0.034
   78    HB3  LEU  10          3HB       LEU  10   4.107   9.245   1.652
   79    HG   LEU  10           HG       LEU  10   1.676  10.563   1.432
   80   HD11  LEU  10          1HD1      LEU  10   0.313   8.522   0.546
   81   HD12  LEU  10          2HD1      LEU  10   1.783   8.190  -0.371
   82   HD13  LEU  10          3HD1      LEU  10   0.943   9.727  -0.579
   83   HD21  LEU  10          1HD2      LEU  10   2.140   9.379   3.377
   84   HD22  LEU  10          2HD2      LEU  10   2.549   7.904   2.501
   85   HD23  LEU  10          3HD2      LEU  10   0.866   8.421   2.621
   86    H    GLN  11           H        GLN  11   6.405  10.372   1.156
   87    HA   GLN  11           HA       GLN  11   6.562  11.169   3.804
   88    HB2  GLN  11          2HB       GLN  11   8.567  10.655   1.660
   89    HB3  GLN  11          3HB       GLN  11   9.121  11.436   3.135
   90    HG2  GLN  11          2HG       GLN  11   7.890   9.481   4.319
   91    HG3  GLN  11          3HG       GLN  11   8.017   8.693   2.747
   92   HE21  GLN  11          1HE2      GLN  11   9.682   7.389   2.621
   93   HE22  GLN  11          2HE2      GLN  11  11.221   7.614   3.372
   94    H    THR  12           H        THR  12   6.865  13.054   0.893
   95    HA   THR  12           HA       THR  12   8.042  15.345   2.149
   96    HB   THR  12           HB       THR  12   6.658  15.047  -0.522
   97    HG1  THR  12           HG1      THR  12   8.829  14.030   0.038
   98   HG21  THR  12          1HG2      THR  12   8.154  17.232  -0.848
   99   HG22  THR  12          2HG2      THR  12   7.803  17.403   0.872
  100   HG23  THR  12          3HG2      THR  12   6.482  17.308  -0.292
  101    H    ALA  13           H        ALA  13   4.805  14.756   0.763
  102    HA   ALA  13           HA       ALA  13   3.574  17.088   1.572
  103    HB1  ALA  13          1HB       ALA  13   1.540  15.294   1.803
  104    HB2  ALA  13          2HB       ALA  13   2.100  15.995   0.284
  105    HB3  ALA  13          3HB       ALA  13   2.682  14.409   0.791
  106    H    LYS  14           H        LYS  14   4.202  14.165   3.422
  107    HA   LYS  14           HA       LYS  14   2.651  14.987   5.692
  108    HB2  LYS  14          2HB       LYS  14   3.043  12.612   5.191
  109    HB3  LYS  14          3HB       LYS  14   4.769  12.842   5.444
  110    HG2  LYS  14          2HG       LYS  14   4.277  12.065   7.496
  111    HG3  LYS  14          3HG       LYS  14   3.850  13.752   7.793
  112    HD2  LYS  14          2HD       LYS  14   1.745  13.171   8.211
  113    HD3  LYS  14          3HD       LYS  14   1.613  12.418   6.620
  114    HE2  LYS  14          2HE       LYS  14   2.672  10.377   7.572
  115    HE3  LYS  14          3HE       LYS  14   2.616  11.139   9.161
  116    HZ1  LYS  14          1HZ       LYS  14   0.118  11.025   7.661
  117    HZ2  LYS  14          2HZ       LYS  14   0.393  10.853   9.321
  118    HZ3  LYS  14          3HZ       LYS  14   0.703   9.561   8.275
  119    H    ASN  15           H        ASN  15   6.117  14.860   4.926
  120    HA   ASN  15           HA       ASN  15   7.099  15.778   7.367
  121    HB2  ASN  15          2HB       ASN  15   8.560  14.848   5.652
  122    HB3  ASN  15          3HB       ASN  15   8.211  16.205   4.586
  123   HD21  ASN  15          1HD2      ASN  15  10.158  17.128   4.410
  124   HD22  ASN  15          2HD2      ASN  15  11.081  17.743   5.735
  125    H    ILE  16           H        ILE  16   5.444  17.457   4.855
  126    HA   ILE  16           HA       ILE  16   6.357  20.084   5.554
  127    HB   ILE  16           HB       ILE  16   3.960  19.227   3.929
  128   HG12  ILE  16          2HG1      ILE  16   6.377  20.477   2.726
  129   HG13  ILE  16          3HG1      ILE  16   6.514  18.802   3.251
  130   HG21  ILE  16          1HG2      ILE  16   3.482  21.407   4.633
  131   HG22  ILE  16          2HG2      ILE  16   5.162  21.919   4.480
  132   HG23  ILE  16          3HG2      ILE  16   4.201  21.609   3.035
  133   HD11  ILE  16          1HD1      ILE  16   5.332  19.860   0.883
  134   HD12  ILE  16          2HD1      ILE  16   5.595  18.178   1.344
  135   HD13  ILE  16          3HD1      ILE  16   4.107  18.999   1.815
  136    H    THR  17           H        THR  17   3.214  18.434   5.915
  137    HA   THR  17           HA       THR  17   2.145  20.441   7.629
  138    HB   THR  17           HB       THR  17   0.961  17.744   7.808
  139    HG1  THR  17           HG1      THR  17   0.758  19.140   5.345
  140   HG21  THR  17          1HG2      THR  17  -1.009  19.285   6.951
  141   HG22  THR  17          2HG2      THR  17   0.078  20.570   7.478
  142   HG23  THR  17          3HG2      THR  17  -0.463  19.345   8.626
  143    H    GLU  18           H        GLU  18   4.248  17.808   8.137
  144    HA   GLU  18           HA       GLU  18   3.557  17.409  10.915
  145    HB2  GLU  18          2HB       GLU  18   4.403  15.559   9.486
  146    HB3  GLU  18          3HB       GLU  18   5.947  16.392   9.369
  147    HG2  GLU  18          2HG       GLU  18   6.012  16.282  11.911
  148    HG3  GLU  18          3HG       GLU  18   4.690  15.125  11.776
  149    H    ARG  19           H        ARG  19   6.003  19.103   9.048
  150    HA   ARG  19           HA       ARG  19   7.623  19.796  11.300
  151    HB2  ARG  19          2HB       ARG  19   8.275  19.692   8.793
  152    HB3  ARG  19          3HB       ARG  19   7.596  21.312   8.707
  153    HG2  ARG  19          2HG       ARG  19   9.290  21.355  10.919
  154    HG3  ARG  19          3HG       ARG  19  10.160  20.445   9.682
  155    HD2  ARG  19          2HD       ARG  19   9.783  22.271   8.089
  156    HD3  ARG  19          3HD       ARG  19   8.930  23.178   9.338
  157    HE   ARG  19           HE       ARG  19  11.603  22.416  10.075
  158   HH11  ARG  19          1HH1      ARG  19  10.794  26.080   8.679
  159   HH12  ARG  19          2HH1      ARG  19   9.641  24.803   8.472
  160   HH21  ARG  19          1HH2      ARG  19  12.778  25.672   9.749
  161   HH22  ARG  19          2HH2      ARG  19  13.129  24.088  10.354
  162    H    VAL  20           H        VAL  20   4.944  21.280   9.596
  163    HA   VAL  20           HA       VAL  20   5.193  23.846  10.822
  164    HB   VAL  20           HB       VAL  20   4.013  23.572   8.696
  165   HG11  VAL  20          1HG1      VAL  20   1.909  22.112  10.291
  166   HG12  VAL  20          2HG1      VAL  20   1.836  22.513   8.574
  167   HG13  VAL  20          3HG1      VAL  20   3.035  21.360   9.161
  168   HG21  VAL  20          1HG2      VAL  20   2.389  24.609  11.008
  169   HG22  VAL  20          2HG2      VAL  20   3.428  25.520   9.913
  170   HG23  VAL  20          3HG2      VAL  20   1.915  24.832   9.325
  171    H    SER  21           H        SER  21   3.429  20.896  11.564
  172    HA   SER  21           HA       SER  21   1.761  21.967  13.577
  173    HB2  SER  21          2HB       SER  21   1.055  19.886  12.801
  174    HB3  SER  21          3HB       SER  21   2.679  19.201  12.859
  175    HG   SER  21           HG       SER  21   1.154  19.929  15.140
  176    H    MET  22           H        MET  22   4.795  20.109  13.826
  177    HA   MET  22           HA       MET  22   5.069  20.263  16.599
  178    HB2  MET  22          2HB       MET  22   6.447  19.019  14.654
  179    HB3  MET  22          3HB       MET  22   7.547  20.353  14.973
  180    HG2  MET  22          2HG       MET  22   8.181  19.530  16.957
  181    HG3  MET  22          3HG       MET  22   6.556  18.984  17.365
  182    HE1  MET  22          1HE       MET  22   9.044  17.032  14.203
  183    HE2  MET  22          2HE       MET  22   9.258  18.641  14.893
  184    HE3  MET  22          3HE       MET  22  10.089  17.258  15.607
  185    H    ALA  23           H        ALA  23   6.190  22.455  14.058
  186    HA   ALA  23           HA       ALA  23   7.743  24.173  15.599
  187    HB1  ALA  23          1HB       ALA  23   7.992  24.659  13.396
  188    HB2  ALA  23          2HB       ALA  23   6.286  24.398  13.029
  189    HB3  ALA  23          3HB       ALA  23   6.804  25.897  13.801
  190    H    THR  24           H        THR  24   4.274  24.391  14.830
  191    HA   THR  24           HA       THR  24   3.891  26.688  16.511
  192    HB   THR  24           HB       THR  24   1.524  25.081  15.759
  193    HG1  THR  24           HG1      THR  24   3.456  25.902  13.920
  194   HG21  THR  24          1HG2      THR  24   1.076  27.520  14.782
  195   HG22  THR  24          2HG2      THR  24   2.346  27.929  15.937
  196   HG23  THR  24          3HG2      THR  24   0.870  27.140  16.492
  197    H    ALA  25           H        ALA  25   4.004  23.319  17.009
  198    HA   ALA  25           HA       ALA  25   2.323  23.344  19.375
  199    HB1  ALA  25          1HB       ALA  25   2.358  21.396  17.856
  200    HB2  ALA  25          2HB       ALA  25   4.044  21.118  18.293
  201    HB3  ALA  25          3HB       ALA  25   2.781  20.981  19.517
  202    H    SER  26           H        SER  26   5.598  23.882  18.585
  203    HA   SER  26           HA       SER  26   6.409  23.482  21.387
  204    HB2  SER  26          2HB       SER  26   7.609  22.481  19.145
  205    HB3  SER  26          3HB       SER  26   8.530  23.962  19.400
  206    HG   SER  26           HG       SER  26   8.772  23.209  21.625
  207    H    SER  27           H        SER  27   5.474  25.831  19.267
  208    HA   SER  27           HA       SER  27   7.271  27.879  20.345
  209    HB2  SER  27          2HB       SER  27   6.867  27.756  17.872
  210    HB3  SER  27          3HB       SER  27   5.182  28.175  18.176
  211    HG   SER  27           HG       SER  27   6.326  30.022  19.414
  212    H    GLN  28           H        GLN  28   3.780  27.419  19.778
  213    HA   GLN  28           HA       GLN  28   3.248  29.306  21.966
  214    HB2  GLN  28          2HB       GLN  28   1.403  28.295  19.794
  215    HB3  GLN  28          3HB       GLN  28   0.973  29.465  21.034
  216    HG2  GLN  28          2HG       GLN  28   3.317  30.390  19.736
  217    HG3  GLN  28          3HG       GLN  28   2.153  29.917  18.500
  218   HE21  GLN  28          1HE2      GLN  28   0.922  31.515  17.854
  219   HE22  GLN  28          2HE2      GLN  28   0.371  32.839  18.817
  220    H    VAL  29           H        VAL  29   3.732  26.164  21.713
  221    HA   VAL  29           HA       VAL  29   3.184  24.352  22.979
  222    HB   VAL  29           HB       VAL  29   1.434  26.100  24.688
  223   HG11  VAL  29          1HG1      VAL  29   3.053  24.350  26.182
  224   HG12  VAL  29          2HG1      VAL  29   1.314  24.246  25.904
  225   HG13  VAL  29          3HG1      VAL  29   2.433  23.420  24.818
  226   HG21  VAL  29          1HG2      VAL  29   3.783  26.223  25.982
  227   HG22  VAL  29          2HG2      VAL  29   4.362  26.225  24.316
  228   HG23  VAL  29          3HG2      VAL  29   3.231  27.465  24.859
  229    H    LEU  30           H        LEU  30   1.308  25.645  20.866
  230    HA   LEU  30           HA       LEU  30  -0.716  25.225  19.908
  231    HB2  LEU  30          2HB       LEU  30   0.518  22.909  20.180
  232    HB3  LEU  30          3HB       LEU  30  -0.820  22.585  21.281
  233    HG   LEU  30           HG       LEU  30  -2.334  23.238  19.308
  234   HD11  LEU  30          1HD1      LEU  30  -0.567  22.286  17.308
  235   HD12  LEU  30          2HD1      LEU  30   0.215  23.640  18.125
  236   HD13  LEU  30          3HD1      LEU  30  -1.382  23.847  17.405
  237   HD21  LEU  30          1HD2      LEU  30  -2.540  21.032  19.787
  238   HD22  LEU  30          2HD2      LEU  30  -0.800  20.746  19.753
  239   HD23  LEU  30          3HD2      LEU  30  -1.703  20.873  18.242
  240    H    ILE  31           H        ILE  31  -1.243  26.833  21.856
  241    HA   ILE  31           HA       ILE  31  -3.669  25.739  23.085
  242    HB   ILE  31           HB       ILE  31  -3.174  27.042  25.169
  243   HG12  ILE  31          2HG1      ILE  31  -0.323  27.010  24.972
  244   HG13  ILE  31          3HG1      ILE  31  -0.963  27.916  23.605
  245   HG21  ILE  31          1HG2      ILE  31  -2.633  24.505  24.605
  246   HG22  ILE  31          2HG2      ILE  31  -0.987  25.056  24.916
  247   HG23  ILE  31          3HG2      ILE  31  -2.225  25.227  26.161
  248   HD11  ILE  31          1HD1      ILE  31  -1.296  29.666  24.907
  249   HD12  ILE  31          2HD1      ILE  31  -2.347  28.716  25.957
  250   HD13  ILE  31          3HD1      ILE  31  -0.611  28.772  26.264
  251    HA   PRO  32           HA       PRO  32  -5.572  29.461  21.740
  252    HB2  PRO  32          2HB       PRO  32  -7.482  29.785  23.642
  253    HB3  PRO  32          3HB       PRO  32  -7.569  28.533  22.397
  254    HG2  PRO  32          2HG       PRO  32  -6.679  28.312  25.247
  255    HG3  PRO  32          3HG       PRO  32  -7.708  27.215  24.308
  256    HD2  PRO  32          2HD       PRO  32  -5.082  26.725  24.753
  257    HD3  PRO  32          3HD       PRO  32  -5.910  26.217  23.267
  258    H    GLU  33           H        GLU  33  -6.012  31.695  22.320
  259    HA   GLU  33           HA       GLU  33  -4.986  32.708  24.822
  260    HB2  GLU  33          2HB       GLU  33  -2.888  32.575  23.726
  261    HB3  GLU  33          3HB       GLU  33  -3.553  33.178  22.215
  262    HG2  GLU  33          2HG       GLU  33  -3.892  35.370  23.235
  263    HG3  GLU  33          3HG       GLU  33  -3.226  34.766  24.751
  264    H    ILE  34           H        ILE  34  -6.127  33.429  21.554
  265    HA   ILE  34           HA       ILE  34  -8.165  35.163  22.520
  266    HB   ILE  34           HB       ILE  34  -6.369  36.761  22.758
  267   HG12  ILE  34          2HG1      ILE  34  -7.413  37.861  20.261
  268   HG13  ILE  34          3HG1      ILE  34  -8.671  37.156  21.271
  269   HG21  ILE  34          1HG2      ILE  34  -4.891  37.386  20.991
  270   HG22  ILE  34          2HG2      ILE  34  -4.839  35.630  21.138
  271   HG23  ILE  34          3HG2      ILE  34  -5.760  36.378  19.833
  272   HD11  ILE  34          1HD1      ILE  34  -8.242  38.635  23.026
  273   HD12  ILE  34          2HD1      ILE  34  -6.676  39.105  22.364
  274   HD13  ILE  34          3HD1      ILE  34  -8.162  39.626  21.570
  275    H    ASN  35           H        ASN  35  -6.184  34.139  19.786
  276    HA   ASN  35           HA       ASN  35  -8.562  33.581  18.246
  277    HB2  ASN  35          2HB       ASN  35  -6.669  35.795  17.513
  278    HB3  ASN  35          3HB       ASN  35  -7.525  34.905  16.258
  279   HD21  ASN  35          1HD2      ASN  35  -7.613  37.654  17.879
  280   HD22  ASN  35          2HD2      ASN  35  -9.316  37.937  17.962
  281    H    LEU  36           H        LEU  36  -6.084  32.293  19.394
  282    HA   LEU  36           HA       LEU  36  -4.281  31.525  17.434
  283    HB2  LEU  36          2HB       LEU  36  -3.860  30.979  19.709
  284    HB3  LEU  36          3HB       LEU  36  -5.347  30.041  19.824
  285    HG   LEU  36           HG       LEU  36  -3.761  28.868  17.792
  286   HD11  LEU  36          1HD1      LEU  36  -1.886  28.209  19.532
  287   HD12  LEU  36          2HD1      LEU  36  -2.225  29.827  20.145
  288   HD13  LEU  36          3HD1      LEU  36  -1.716  29.608  18.471
  289   HD21  LEU  36          1HD2      LEU  36  -5.212  27.486  18.947
  290   HD22  LEU  36          2HD2      LEU  36  -4.729  28.119  20.521
  291   HD23  LEU  36          3HD2      LEU  36  -3.649  27.043  19.633
  292    H    ASN  37           H        ASN  37  -7.490  30.267  18.152
  293    HA   ASN  37           HA       ASN  37  -7.493  27.941  16.665
  294    HB2  ASN  37          2HB       ASN  37  -9.356  29.113  18.125
  295    HB3  ASN  37          3HB       ASN  37  -9.898  29.715  16.561
  296   HD21  ASN  37          1HD2      ASN  37 -10.612  27.502  18.701
  297   HD22  ASN  37          2HD2      ASN  37 -11.112  26.191  17.693
  298    H    ASP  38           H        ASP  38  -8.235  31.237  15.560
  299    HA   ASP  38           HA       ASP  38  -8.647  30.456  12.845
  300    HB2  ASP  38          2HB       ASP  38  -9.207  32.708  14.322
  301    HB3  ASP  38          3HB       ASP  38  -7.885  33.253  13.293
  302    H    THR  39           H        THR  39  -5.898  31.455  14.737
  303    HA   THR  39           HA       THR  39  -4.178  32.106  12.573
  304    HB   THR  39           HB       THR  39  -2.972  31.052  15.071
  305    HG1  THR  39           HG1      THR  39  -3.572  33.307  15.924
  306   HG21  THR  39          1HG2      THR  39  -2.596  33.633  13.547
  307   HG22  THR  39          2HG2      THR  39  -1.660  32.160  13.290
  308   HG23  THR  39          3HG2      THR  39  -1.561  33.010  14.832
  309    H    PHE  40           H        PHE  40  -4.146  29.266  14.740
  310    HA   PHE  40           HA       PHE  40  -2.291  27.752  13.370
  311    HB2  PHE  40          2HB       PHE  40  -3.454  27.292  15.627
  312    HB3  PHE  40          3HB       PHE  40  -4.697  26.494  14.669
  313    HD1  PHE  40           HD1      PHE  40  -0.995  26.531  14.289
  314    HD2  PHE  40           HD2      PHE  40  -4.490  24.232  15.073
  315    HE1  PHE  40           HE1      PHE  40   0.356  24.474  14.260
  316    HE2  PHE  40           HE2      PHE  40  -3.145  22.172  15.047
  317    HZ   PHE  40           HZ       PHE  40  -0.719  22.291  14.640
  318    H    ASP  41           H        ASP  41  -5.784  27.959  12.850
  319    HA   ASP  41           HA       ASP  41  -6.050  25.942  10.942
  320    HB2  ASP  41          2HB       ASP  41  -7.812  27.525  12.144
  321    HB3  ASP  41          3HB       ASP  41  -7.663  28.433  10.643
  322    H    THR  42           H        THR  42  -5.851  29.445  10.289
  323    HA   THR  42           HA       THR  42  -5.502  29.229   7.529
  324    HB   THR  42           HB       THR  42  -5.860  31.327   9.156
  325    HG1  THR  42           HG1      THR  42  -6.135  32.136   7.229
  326   HG21  THR  42          1HG2      THR  42  -3.019  31.746   8.276
  327   HG22  THR  42          2HG2      THR  42  -3.397  31.061   9.857
  328   HG23  THR  42          3HG2      THR  42  -3.968  32.675   9.435
  329    H    PHE  43           H        PHE  43  -3.271  28.736  10.117
  330    HA   PHE  43           HA       PHE  43  -0.885  29.111   8.581
  331    HB2  PHE  43          2HB       PHE  43  -1.087  29.273  11.112
  332    HB3  PHE  43          3HB       PHE  43  -1.141  27.514  11.129
  333    HD1  PHE  43           HD1      PHE  43   0.847  26.928  12.185
  334    HD2  PHE  43           HD2      PHE  43   0.918  29.731   8.982
  335    HE1  PHE  43           HE1      PHE  43   3.306  26.853  12.179
  336    HE2  PHE  43           HE2      PHE  43   3.377  29.660   8.970
  337    HZ   PHE  43           HZ       PHE  43   4.575  28.219  10.569
  338    H    ALA  44           H        ALA  44  -2.525  26.219   9.868
  339    HA   ALA  44           HA       ALA  44  -0.856  24.381   8.492
  340    HB1  ALA  44          1HB       ALA  44  -2.688  22.738   9.074
  341    HB2  ALA  44          2HB       ALA  44  -1.950  23.591  10.430
  342    HB3  ALA  44          3HB       ALA  44  -3.532  24.089   9.832
  343    H    LEU  45           H        LEU  45  -4.137  25.595   7.856
  344    HA   LEU  45           HA       LEU  45  -4.831  24.124   5.659
  345    HB2  LEU  45          2HB       LEU  45  -6.505  25.533   6.284
  346    HB3  LEU  45          3HB       LEU  45  -5.410  26.886   6.562
  347    HG   LEU  45           HG       LEU  45  -5.299  27.320   4.177
  348   HD11  LEU  45          1HD1      LEU  45  -5.511  25.438   2.943
  349   HD12  LEU  45          2HD1      LEU  45  -7.198  25.950   2.886
  350   HD13  LEU  45          3HD1      LEU  45  -6.690  24.717   4.039
  351   HD21  LEU  45          1HD2      LEU  45  -7.649  27.980   3.809
  352   HD22  LEU  45          2HD2      LEU  45  -7.059  28.419   5.413
  353   HD23  LEU  45          3HD2      LEU  45  -8.115  27.020   5.214
  354    H    ASP  46           H        ASP  46  -3.178  27.285   5.509
  355    HA   ASP  46           HA       ASP  46  -2.693  27.399   2.809
  356    HB2  ASP  46          2HB       ASP  46  -1.979  28.924   4.961
  357    HB3  ASP  46          3HB       ASP  46  -0.417  28.289   4.450
  358    H    PHE  47           H        PHE  47  -0.618  25.910   5.284
  359    HA   PHE  47           HA       PHE  47   1.441  25.065   3.615
  360    HB2  PHE  47          2HB       PHE  47   0.526  24.485   6.317
  361    HB3  PHE  47          3HB       PHE  47   1.240  23.073   5.544
  362    HD1  PHE  47           HD1      PHE  47   3.487  23.706   4.179
  363    HD2  PHE  47           HD2      PHE  47   1.941  25.773   7.564
  364    HE1  PHE  47           HE1      PHE  47   5.736  24.572   4.674
  365    HE2  PHE  47           HE2      PHE  47   4.187  26.642   8.063
  366    HZ   PHE  47           HZ       PHE  47   6.089  26.043   6.617
  367    H    SER  48           H        SER  48  -1.433  23.250   4.676
  368    HA   SER  48           HA       SER  48  -0.972  20.878   3.343
  369    HB2  SER  48          2HB       SER  48  -2.916  21.613   4.942
  370    HB3  SER  48          3HB       SER  48  -3.751  22.003   3.438
  371    HG   SER  48           HG       SER  48  -4.022  19.798   4.319
  372    H    ARG  49           H        ARG  49  -2.576  23.800   2.125
  373    HA   ARG  49           HA       ARG  49  -3.450  22.969  -0.325
  374    HB2  ARG  49          2HB       ARG  49  -2.951  25.447   0.922
  375    HB3  ARG  49          3HB       ARG  49  -2.148  25.517  -0.641
  376    HG2  ARG  49          2HG       ARG  49  -4.782  24.387  -0.903
  377    HG3  ARG  49          3HG       ARG  49  -4.843  25.959  -0.102
  378    HD2  ARG  49          2HD       ARG  49  -3.146  26.571  -2.060
  379    HD3  ARG  49          3HD       ARG  49  -4.005  25.254  -2.858
  380    HE   ARG  49           HE       ARG  49  -4.998  27.877  -2.329
  381   HH11  ARG  49          1HH1      ARG  49  -7.548  24.902  -3.149
  382   HH12  ARG  49          2HH1      ARG  49  -5.923  24.538  -2.671
  383   HH21  ARG  49          1HH2      ARG  49  -8.236  27.082  -3.313
  384   HH22  ARG  49          2HH2      ARG  49  -7.134  28.369  -2.958
  385    H    GLU  50           H        GLU  50  -0.151  23.899   0.558
  386    HA   GLU  50           HA       GLU  50   0.858  23.487  -2.105
  387    HB2  GLU  50          2HB       GLU  50   1.744  24.978  -0.059
  388    HB3  GLU  50          3HB       GLU  50   2.714  23.537   0.212
  389    HG2  GLU  50          2HG       GLU  50   3.229  23.784  -2.346
  390    HG3  GLU  50          3HG       GLU  50   2.766  25.460  -2.055
  391    H    LYS  51           H        LYS  51   0.576  21.626   0.832
  392    HA   LYS  51           HA       LYS  51   2.431  19.599   0.285
  393    HB2  LYS  51          2HB       LYS  51   1.602  18.574   2.137
  394    HB3  LYS  51          3HB       LYS  51   0.851  20.145   2.381
  395    HG2  LYS  51          2HG       LYS  51  -0.970  18.831   2.675
  396    HG3  LYS  51          3HG       LYS  51  -1.066  19.037   0.924
  397    HD2  LYS  51          2HD       LYS  51   0.387  16.904   0.823
  398    HD3  LYS  51          3HD       LYS  51  -0.115  16.668   2.498
  399    HE2  LYS  51          2HE       LYS  51  -2.480  16.832   1.746
  400    HE3  LYS  51          3HE       LYS  51  -1.904  16.903   0.082
  401    HZ1  LYS  51          1HZ       LYS  51  -1.386  14.720   0.070
  402    HZ2  LYS  51          2HZ       LYS  51  -2.580  14.644   1.266
  403    HZ3  LYS  51          3HZ       LYS  51  -0.946  14.681   1.703
  404    H    LYS  52           H        LYS  52  -0.779  20.181  -0.928
  405    HA   LYS  52           HA       LYS  52  -1.077  17.539  -2.054
  406    HB2  LYS  52          2HB       LYS  52  -3.073  18.688  -1.344
  407    HB3  LYS  52          3HB       LYS  52  -2.691  20.075  -2.355
  408    HG2  LYS  52          2HG       LYS  52  -4.407  18.841  -3.436
  409    HG3  LYS  52          3HG       LYS  52  -2.916  18.588  -4.347
  410    HD2  LYS  52          2HD       LYS  52  -3.689  16.434  -4.221
  411    HD3  LYS  52          3HD       LYS  52  -2.696  16.496  -2.762
  412    HE2  LYS  52          2HE       LYS  52  -4.519  16.565  -1.364
  413    HE3  LYS  52          3HE       LYS  52  -5.566  17.281  -2.588
  414    HZ1  LYS  52          1HZ       LYS  52  -4.725  14.727  -3.435
  415    HZ2  LYS  52          2HZ       LYS  52  -6.295  15.276  -3.128
  416    HZ3  LYS  52          3HZ       LYS  52  -5.375  14.605  -1.878
  417    H    LEU  53           H        LEU  53  -0.701  20.824  -3.390
  418    HA   LEU  53           HA       LEU  53  -0.528  20.183  -6.068
  419    HB2  LEU  53          2HB       LEU  53  -0.494  22.471  -4.842
  420    HB3  LEU  53          3HB       LEU  53   1.257  22.272  -4.885
  421    HG   LEU  53           HG       LEU  53   0.239  21.826  -7.507
  422   HD11  LEU  53          1HD1      LEU  53  -1.626  23.294  -6.369
  423   HD12  LEU  53          2HD1      LEU  53  -1.070  23.629  -8.009
  424   HD13  LEU  53          3HD1      LEU  53  -0.463  24.589  -6.659
  425   HD21  LEU  53          1HD2      LEU  53   2.498  22.591  -6.869
  426   HD22  LEU  53          2HD2      LEU  53   1.811  24.138  -6.374
  427   HD23  LEU  53          3HD2      LEU  53   1.735  23.639  -8.064
  428    H    LEU  54           H        LEU  54   1.826  19.735  -3.551
  429    HA   LEU  54           HA       LEU  54   4.071  19.344  -5.277
  430    HB2  LEU  54          2HB       LEU  54   4.391  20.027  -2.981
  431    HB3  LEU  54          3HB       LEU  54   3.596  18.563  -2.405
  432    HG   LEU  54           HG       LEU  54   6.179  18.740  -2.311
  433   HD11  LEU  54          1HD1      LEU  54   5.154  16.249  -3.614
  434   HD12  LEU  54          2HD1      LEU  54   4.618  16.712  -1.999
  435   HD13  LEU  54          3HD1      LEU  54   6.330  16.426  -2.312
  436   HD21  LEU  54          1HD2      LEU  54   6.306  19.443  -4.732
  437   HD22  LEU  54          2HD2      LEU  54   5.889  17.780  -5.149
  438   HD23  LEU  54          3HD2      LEU  54   7.374  18.121  -4.258
  439    H    GLU  55           H        GLU  55   2.215  17.059  -3.254
  440    HA   GLU  55           HA       GLU  55   3.343  14.743  -4.390
  441    HB2  GLU  55          2HB       GLU  55   1.880  15.138  -2.213
  442    HB3  GLU  55          3HB       GLU  55   0.571  14.675  -3.291
  443    HG2  GLU  55          2HG       GLU  55   2.427  12.737  -3.786
  444    HG3  GLU  55          3HG       GLU  55   2.663  13.051  -2.068
  445    H    CYS  56           H        CYS  56   0.027  15.993  -4.817
  446    HA   CYS  56           HA       CYS  56  -0.283  14.427  -7.233
  447    HB2  CYS  56          2HB       CYS  56  -2.035  15.296  -5.290
  448    HB3  CYS  56          3HB       CYS  56  -2.385  16.376  -6.633
  449    HG   CYS  56           HG       CYS  56  -2.219  13.068  -7.316
  450    H    LEU  57           H        LEU  57  -1.798  15.940  -8.874
  451    HA   LEU  57           HA       LEU  57  -0.105  18.255  -9.541
  452    HB2  LEU  57          2HB       LEU  57  -0.259  15.891 -10.972
  453    HB3  LEU  57          3HB       LEU  57  -1.339  16.979 -11.840
  454    HG   LEU  57           HG       LEU  57   0.829  17.063 -12.856
  455   HD11  LEU  57          1HD1      LEU  57   0.463  19.543 -11.185
  456   HD12  LEU  57          2HD1      LEU  57  -0.453  19.170 -12.644
  457   HD13  LEU  57          3HD1      LEU  57   1.290  19.418 -12.737
  458   HD21  LEU  57          1HD2      LEU  57   1.997  17.975 -10.240
  459   HD22  LEU  57          2HD2      LEU  57   2.843  17.517 -11.718
  460   HD23  LEU  57          3HD2      LEU  57   2.020  16.289 -10.756
  461    H    ASP  58           H        ASP  58  -3.171  16.722 -10.538
  462    HA   ASP  58           HA       ASP  58  -4.357  19.348 -10.937
  463    HB2  ASP  58          2HB       ASP  58  -5.718  16.678 -11.289
  464    HB3  ASP  58          3HB       ASP  58  -6.157  18.223 -12.013
  465    H    TYR  59           H        TYR  59  -6.294  20.025  -9.917
  466    HA   TYR  59           HA       TYR  59  -7.512  18.575  -7.803
  467    HB2  TYR  59          2HB       TYR  59  -6.776  19.891  -5.906
  468    HB3  TYR  59          3HB       TYR  59  -5.373  19.179  -6.695
  469    HD1  TYR  59           HD1      TYR  59  -6.792  22.163  -5.429
  470    HD2  TYR  59           HD2      TYR  59  -4.145  20.699  -8.421
  471    HE1  TYR  59           HE1      TYR  59  -5.773  24.394  -5.610
  472    HE2  TYR  59           HE2      TYR  59  -3.118  22.926  -8.610
  473    HH   TYR  59           HH       TYR  59  -4.401  25.624  -7.711
  474    H    LEU  60           H        LEU  60  -8.186  20.151 -10.166
  475    HA   LEU  60           HA       LEU  60  -9.908  22.171  -8.888
  476    HB2  LEU  60          2HB       LEU  60  -7.961  22.810 -10.582
  477    HB3  LEU  60          3HB       LEU  60  -9.210  22.419 -11.762
  478    HG   LEU  60           HG       LEU  60  -9.897  24.315  -9.576
  479   HD11  LEU  60          1HD1      LEU  60  -7.748  25.160 -10.240
  480   HD12  LEU  60          2HD1      LEU  60  -9.004  26.185 -10.933
  481   HD13  LEU  60          3HD1      LEU  60  -8.169  25.008 -11.946
  482   HD21  LEU  60          1HD2      LEU  60 -11.699  24.499 -10.854
  483   HD22  LEU  60          2HD2      LEU  60 -10.989  23.423 -12.058
  484   HD23  LEU  60          3HD2      LEU  60 -10.697  25.160 -12.145
  Start of MODEL    3
    1    H    LEU   1           H        LEU   1   7.310   1.770   4.912
    2    HA   LEU   1           HA       LEU   1  10.104   1.291   4.646
    3    HB2  LEU   1          2HB       LEU   1   8.458  -1.171   5.143
    4    HB3  LEU   1          3HB       LEU   1  10.210  -1.037   5.007
    5    HG   LEU   1           HG       LEU   1   8.611   0.125   7.283
    6   HD11  LEU   1          1HD1      LEU   1   8.402  -1.929   8.090
    7   HD12  LEU   1          2HD1      LEU   1  10.160  -2.028   8.175
    8   HD13  LEU   1          3HD1      LEU   1   9.314  -2.605   6.740
    9   HD21  LEU   1          1HD2      LEU   1  11.049  -0.191   8.265
   10   HD22  LEU   1          2HD2      LEU   1  10.585   1.260   7.376
   11   HD23  LEU   1          3HD2      LEU   1  11.489  -0.021   6.565
   12    H    LYS   2           H        LYS   2   8.928   2.466   2.775
   13    HA   LYS   2           HA       LYS   2   8.834   0.637   0.580
   14    HB2  LYS   2          2HB       LYS   2   6.523   0.440   1.522
   15    HB3  LYS   2          3HB       LYS   2   6.294   2.154   1.199
   16    HG2  LYS   2          2HG       LYS   2   7.201   1.017  -1.203
   17    HG3  LYS   2          3HG       LYS   2   5.976  -0.079  -0.558
   18    HD2  LYS   2          2HD       LYS   2   4.376   1.713  -0.414
   19    HD3  LYS   2          3HD       LYS   2   5.602   2.898  -0.873
   20    HE2  LYS   2          2HE       LYS   2   5.552   2.300  -3.073
   21    HE3  LYS   2          3HE       LYS   2   5.125   0.626  -2.721
   22    HZ1  LYS   2          1HZ       LYS   2   3.401   2.947  -3.083
   23    HZ2  LYS   2          2HZ       LYS   2   2.922   1.827  -1.909
   24    HZ3  LYS   2          3HZ       LYS   2   3.144   1.331  -3.511
   25    H    GLU   3           H        GLU   3   9.590   1.631  -1.183
   26    HA   GLU   3           HA       GLU   3   9.156   4.490  -1.549
   27    HB2  GLU   3          2HB       GLU   3  11.680   3.319  -0.710
   28    HB3  GLU   3          3HB       GLU   3  11.839   4.189  -2.229
   29    HG2  GLU   3          2HG       GLU   3  10.381   5.941  -0.743
   30    HG3  GLU   3          3HG       GLU   3  11.405   5.192   0.481
   31    H    ASN   4           H        ASN   4   8.571   4.840  -3.580
   32    HA   ASN   4           HA       ASN   4   9.890   3.555  -5.787
   33    HB2  ASN   4          2HB       ASN   4   7.822   2.113  -4.772
   34    HB3  ASN   4          3HB       ASN   4   6.974   3.114  -5.946
   35   HD21  ASN   4          1HD2      ASN   4   6.943   0.488  -6.354
   36   HD22  ASN   4          2HD2      ASN   4   7.978   0.044  -7.665
   37    H    ASP   5           H        ASP   5   6.932   5.311  -4.867
   38    HA   ASP   5           HA       ASP   5   7.655   7.595  -6.408
   39    HB2  ASP   5          2HB       ASP   5   5.883   5.556  -7.611
   40    HB3  ASP   5          3HB       ASP   5   5.324   7.221  -7.736
   41    H    HIS   6           H        HIS   6   4.531   6.064  -5.632
   42    HA   HIS   6           HA       HIS   6   3.351   8.422  -4.661
   43    HB2  HIS   6          2HB       HIS   6   2.232   6.221  -5.409
   44    HB3  HIS   6          3HB       HIS   6   2.526   5.670  -3.763
   45    HD1  HIS   6           HD1      HIS   6   1.143   8.948  -5.134
   46    HD2  HIS   6           HD2      HIS   6   0.204   5.944  -2.422
   47    HE1  HIS   6           HE1      HIS   6  -1.017   9.661  -4.062
   48    H    ALA   7           H        ALA   7   5.414   6.079  -3.159
   49    HA   ALA   7           HA       ALA   7   4.771   6.618  -0.456
   50    HB1  ALA   7          1HB       ALA   7   6.106   4.872  -0.176
   51    HB2  ALA   7          2HB       ALA   7   6.592   4.959  -1.870
   52    HB3  ALA   7          3HB       ALA   7   7.493   5.855  -0.646
   53    H    ARG   8           H        ARG   8   7.589   7.666  -2.384
   54    HA   ARG   8           HA       ARG   8   8.623   9.452  -0.510
   55    HB2  ARG   8          2HB       ARG   8   9.810  10.485  -2.423
   56    HB3  ARG   8          3HB       ARG   8   9.932   8.731  -2.412
   57    HG2  ARG   8          2HG       ARG   8   8.410   8.512  -4.197
   58    HG3  ARG   8          3HG       ARG   8   7.890  10.192  -4.057
   59    HD2  ARG   8          2HD       ARG   8  10.729  10.073  -4.454
   60    HD3  ARG   8          3HD       ARG   8   9.909   9.139  -5.705
   61    HE   ARG   8           HE       ARG   8   8.510  11.454  -5.642
   62   HH11  ARG   8          1HH1      ARG   8  12.258  12.109  -6.889
   63   HH12  ARG   8          2HH1      ARG   8  11.898  10.708  -5.935
   64   HH21  ARG   8          1HH2      ARG   8  10.592  13.584  -7.436
   65   HH22  ARG   8          2HH2      ARG   8   8.971  13.302  -6.898
   66    H    PHE   9           H        PHE   9   5.993   9.793  -2.756
   67    HA   PHE   9           HA       PHE   9   5.851  12.649  -2.629
   68    HB2  PHE   9          2HB       PHE   9   4.163  10.469  -3.765
   69    HB3  PHE   9          3HB       PHE   9   3.411  12.038  -3.493
   70    HD1  PHE   9           HD1      PHE   9   5.242  14.012  -4.244
   71    HD2  PHE   9           HD2      PHE   9   4.727  10.149  -5.956
   72    HE1  PHE   9           HE1      PHE   9   6.181  14.831  -6.366
   73    HE2  PHE   9           HE2      PHE   9   5.667  10.961  -8.079
   74    HZ   PHE   9           HZ       PHE   9   6.396  13.304  -8.286
   75    H    LEU  10           H        LEU  10   3.733  10.086  -1.334
   76    HA   LEU  10           HA       LEU  10   2.090  11.707   0.207
   77    HB2  LEU  10          2HB       LEU  10   2.353   9.004  -0.254
   78    HB3  LEU  10          3HB       LEU  10   2.693   9.151   1.469
   79    HG   LEU  10           HG       LEU  10   0.338  10.652   0.828
   80   HD11  LEU  10          1HD1      LEU  10  -0.428   9.406  -0.886
   81   HD12  LEU  10          2HD1      LEU  10  -0.886   8.294   0.404
   82   HD13  LEU  10          3HD1      LEU  10   0.608   8.034  -0.496
   83   HD21  LEU  10          1HD2      LEU  10   1.257   9.422   2.971
   84   HD22  LEU  10          2HD2      LEU  10   0.290   8.090   2.339
   85   HD23  LEU  10          3HD2      LEU  10  -0.473   9.637   2.708
   86    H    GLN  11           H        GLN  11   5.153  10.150   1.074
   87    HA   GLN  11           HA       GLN  11   5.229  10.797   3.773
   88    HB2  GLN  11          2HB       GLN  11   6.837   9.328   2.454
   89    HB3  GLN  11          3HB       GLN  11   7.651  10.812   1.977
   90    HG2  GLN  11          2HG       GLN  11   7.994  11.327   4.381
   91    HG3  GLN  11          3HG       GLN  11   7.315   9.748   4.770
   92   HE21  GLN  11          1HE2      GLN  11   9.444   9.518   5.814
   93   HE22  GLN  11          2HE2      GLN  11  10.761   8.935   4.861
   94    H    THR  12           H        THR  12   6.444  12.665   1.004
   95    HA   THR  12           HA       THR  12   7.484  14.827   2.434
   96    HB   THR  12           HB       THR  12   6.308  14.739  -0.348
   97    HG1  THR  12           HG1      THR  12   8.159  13.567  -0.334
   98   HG21  THR  12          1HG2      THR  12   7.314  16.987   1.251
   99   HG22  THR  12          2HG2      THR  12   6.302  16.986  -0.194
  100   HG23  THR  12          3HG2      THR  12   8.052  16.834  -0.343
  101    H    ALA  13           H        ALA  13   4.272  14.466   0.934
  102    HA   ALA  13           HA       ALA  13   3.175  16.903   1.603
  103    HB1  ALA  13          1HB       ALA  13   2.118  14.233   0.984
  104    HB2  ALA  13          2HB       ALA  13   1.022  15.283   1.883
  105    HB3  ALA  13          3HB       ALA  13   1.676  15.812   0.333
  106    H    LYS  14           H        LYS  14   3.290  13.952   3.572
  107    HA   LYS  14           HA       LYS  14   1.886  15.073   5.779
  108    HB2  LYS  14          2HB       LYS  14   3.557  12.612   5.380
  109    HB3  LYS  14          3HB       LYS  14   3.018  13.068   6.990
  110    HG2  LYS  14          2HG       LYS  14   0.768  13.205   5.292
  111    HG3  LYS  14          3HG       LYS  14   1.597  11.685   4.948
  112    HD2  LYS  14          2HD       LYS  14   0.157  11.118   6.683
  113    HD3  LYS  14          3HD       LYS  14   1.684  11.417   7.516
  114    HE2  LYS  14          2HE       LYS  14   0.887  13.231   8.586
  115    HE3  LYS  14          3HE       LYS  14  -0.032  13.779   7.184
  116    HZ1  LYS  14          1HZ       LYS  14  -1.870  12.918   8.036
  117    HZ2  LYS  14          2HZ       LYS  14  -1.023  12.568   9.457
  118    HZ3  LYS  14          3HZ       LYS  14  -1.151  11.400   8.239
  119    H    ASN  15           H        ASN  15   5.328  14.522   5.101
  120    HA   ASN  15           HA       ASN  15   6.385  15.391   7.517
  121    HB2  ASN  15          2HB       ASN  15   7.386  14.670   4.984
  122    HB3  ASN  15          3HB       ASN  15   8.053  16.262   5.334
  123   HD21  ASN  15          1HD2      ASN  15   9.372  13.667   5.184
  124   HD22  ASN  15          2HD2      ASN  15  10.140  13.433   6.714
  125    H    ILE  16           H        ILE  16   4.966  17.201   4.936
  126    HA   ILE  16           HA       ILE  16   6.112  19.730   5.613
  127    HB   ILE  16           HB       ILE  16   3.652  19.061   3.996
  128   HG12  ILE  16          2HG1      ILE  16   6.134  20.166   2.792
  129   HG13  ILE  16          3HG1      ILE  16   6.190  18.493   3.335
  130   HG21  ILE  16          1HG2      ILE  16   3.895  21.390   3.132
  131   HG22  ILE  16          2HG2      ILE  16   3.403  21.289   4.821
  132   HG23  ILE  16          3HG2      ILE  16   5.072  21.684   4.411
  133   HD11  ILE  16          1HD1      ILE  16   5.053  19.584   0.958
  134   HD12  ILE  16          2HD1      ILE  16   5.249  17.896   1.430
  135   HD13  ILE  16          3HD1      ILE  16   3.797  18.779   1.898
  136    H    THR  17           H        THR  17   2.863  18.339   6.082
  137    HA   THR  17           HA       THR  17   1.973  20.491   7.729
  138    HB   THR  17           HB       THR  17   0.579  17.919   8.049
  139    HG1  THR  17           HG1      THR  17   1.063  19.062   5.503
  140   HG21  THR  17          1HG2      THR  17  -0.468  19.944   8.789
  141   HG22  THR  17          2HG2      THR  17  -1.351  19.369   7.375
  142   HG23  THR  17          3HG2      THR  17  -0.216  20.709   7.221
  143    H    GLU  18           H        GLU  18   3.709  17.561   8.302
  144    HA   GLU  18           HA       GLU  18   3.099  17.395  11.105
  145    HB2  GLU  18          2HB       GLU  18   5.005  15.985   9.268
  146    HB3  GLU  18          3HB       GLU  18   5.161  15.803  11.010
  147    HG2  GLU  18          2HG       GLU  18   2.787  15.053  11.072
  148    HG3  GLU  18          3HG       GLU  18   2.790  15.076   9.310
  149    H    ARG  19           H        ARG  19   5.697  18.711   9.131
  150    HA   ARG  19           HA       ARG  19   7.425  19.321  11.316
  151    HB2  ARG  19          2HB       ARG  19   8.088  19.047   8.875
  152    HB3  ARG  19          3HB       ARG  19   7.430  20.656   8.612
  153    HG2  ARG  19          2HG       ARG  19   9.112  20.988  10.777
  154    HG3  ARG  19          3HG       ARG  19   9.973  19.850   9.739
  155    HD2  ARG  19          2HD       ARG  19   9.620  21.403   7.835
  156    HD3  ARG  19          3HD       ARG  19   8.895  22.555   8.957
  157    HE   ARG  19           HE       ARG  19  11.415  21.866   9.938
  158   HH11  ARG  19          1HH1      ARG  19  11.366  24.571   6.987
  159   HH12  ARG  19          2HH1      ARG  19  10.008  23.520   7.216
  160   HH21  ARG  19          1HH2      ARG  19  13.186  24.413   8.369
  161   HH22  ARG  19          2HH2      ARG  19  13.209  23.244   9.646
  162    H    VAL  20           H        VAL  20   5.142  21.226   9.376
  163    HA   VAL  20           HA       VAL  20   5.602  23.721  10.524
  164    HB   VAL  20           HB       VAL  20   4.239  23.466   8.525
  165   HG11  VAL  20          1HG1      VAL  20   3.133  21.355   9.212
  166   HG12  VAL  20          2HG1      VAL  20   2.114  22.287  10.310
  167   HG13  VAL  20          3HG1      VAL  20   2.013  22.556   8.570
  168   HG21  VAL  20          1HG2      VAL  20   2.310  24.928   9.206
  169   HG22  VAL  20          2HG2      VAL  20   2.838  24.725  10.876
  170   HG23  VAL  20          3HG2      VAL  20   3.901  25.504   9.704
  171    H    SER  21           H        SER  21   3.524  21.073  11.580
  172    HA   SER  21           HA       SER  21   2.227  22.483  13.663
  173    HB2  SER  21          2HB       SER  21   1.058  20.568  13.209
  174    HB3  SER  21          3HB       SER  21   2.514  19.636  12.859
  175    HG   SER  21           HG       SER  21   1.882  18.844  14.768
  176    H    MET  22           H        MET  22   4.971  20.212  13.705
  177    HA   MET  22           HA       MET  22   5.507  20.311  16.434
  178    HB2  MET  22          2HB       MET  22   6.524  18.826  14.558
  179    HB3  MET  22          3HB       MET  22   7.714  20.112  14.409
  180    HG2  MET  22          2HG       MET  22   8.643  19.682  16.455
  181    HG3  MET  22          3HG       MET  22   7.163  18.977  17.101
  182    HE1  MET  22          1HE       MET  22  10.251  17.244  14.338
  183    HE2  MET  22          2HE       MET  22   8.693  17.220  13.511
  184    HE3  MET  22          3HE       MET  22   9.338  18.739  14.134
  185    H    ALA  23           H        ALA  23   6.073  22.656  13.972
  186    HA   ALA  23           HA       ALA  23   8.046  24.131  15.494
  187    HB1  ALA  23          1HB       ALA  23   7.171  24.072  12.785
  188    HB2  ALA  23          2HB       ALA  23   7.010  25.719  13.396
  189    HB3  ALA  23          3HB       ALA  23   8.567  24.896  13.479
  190    H    THR  24           H        THR  24   4.604  24.201  14.918
  191    HA   THR  24           HA       THR  24   4.206  26.823  16.019
  192    HB   THR  24           HB       THR  24   1.775  25.406  16.159
  193    HG1  THR  24           HG1      THR  24   3.009  24.928  13.648
  194   HG21  THR  24          1HG2      THR  24   1.385  27.469  15.356
  195   HG22  THR  24          2HG2      THR  24   1.686  26.749  13.775
  196   HG23  THR  24          3HG2      THR  24   2.984  27.587  14.624
  197    H    ALA  25           H        ALA  25   3.504  23.516  17.144
  198    HA   ALA  25           HA       ALA  25   2.555  24.257  19.688
  199    HB1  ALA  25          1HB       ALA  25   3.152  21.848  20.274
  200    HB2  ALA  25          2HB       ALA  25   2.000  22.098  18.962
  201    HB3  ALA  25          3HB       ALA  25   3.678  21.695  18.597
  202    H    SER  26           H        SER  26   5.740  22.951  18.744
  203    HA   SER  26           HA       SER  26   6.969  23.138  21.227
  204    HB2  SER  26          2HB       SER  26   7.873  22.008  19.147
  205    HB3  SER  26          3HB       SER  26   8.375  23.604  18.592
  206    HG   SER  26           HG       SER  26   9.917  23.650  20.063
  207    H    SER  27           H        SER  27   6.421  25.591  18.789
  208    HA   SER  27           HA       SER  27   8.183  27.556  19.742
  209    HB2  SER  27          2HB       SER  27   7.343  28.047  17.635
  210    HB3  SER  27          3HB       SER  27   5.695  27.598  18.074
  211    HG   SER  27           HG       SER  27   7.105  29.967  18.658
  212    H    GLN  28           H        GLN  28   4.696  27.146  20.357
  213    HA   GLN  28           HA       GLN  28   5.043  28.747  22.806
  214    HB2  GLN  28          2HB       GLN  28   2.810  28.652  20.810
  215    HB3  GLN  28          3HB       GLN  28   2.478  29.107  22.476
  216    HG2  GLN  28          2HG       GLN  28   4.708  30.612  21.689
  217    HG3  GLN  28          3HG       GLN  28   3.567  30.676  20.346
  218   HE21  GLN  28          1HE2      GLN  28   2.829  32.709  20.554
  219   HE22  GLN  28          2HE2      GLN  28   1.995  33.311  21.943
  220    H    VAL  29           H        VAL  29   2.422  26.668  21.608
  221    HA   VAL  29           HA       VAL  29   2.894  24.469  23.266
  222    HB   VAL  29           HB       VAL  29   2.501  25.892  25.162
  223   HG11  VAL  29          1HG1      VAL  29  -0.033  26.690  23.739
  224   HG12  VAL  29          2HG1      VAL  29   0.303  27.054  25.433
  225   HG13  VAL  29          3HG1      VAL  29   1.332  27.722  24.166
  226   HG21  VAL  29          1HG2      VAL  29   0.733  24.707  26.243
  227   HG22  VAL  29          2HG2      VAL  29  -0.025  24.314  24.700
  228   HG23  VAL  29          3HG2      VAL  29   1.522  23.587  25.132
  229    H    LEU  30           H        LEU  30   0.619  26.506  21.578
  230    HA   LEU  30           HA       LEU  30  -1.039  25.994  20.098
  231    HB2  LEU  30          2HB       LEU  30   0.625  23.960  19.753
  232    HB3  LEU  30          3HB       LEU  30  -0.707  23.066  20.483
  233    HG   LEU  30           HG       LEU  30  -1.962  24.527  18.522
  234   HD11  LEU  30          1HD1      LEU  30   0.717  24.706  17.876
  235   HD12  LEU  30          2HD1      LEU  30  -0.643  24.951  16.781
  236   HD13  LEU  30          3HD1      LEU  30   0.133  23.371  16.884
  237   HD21  LEU  30          1HD2      LEU  30  -2.022  22.036  19.246
  238   HD22  LEU  30          2HD2      LEU  30  -0.847  21.811  17.950
  239   HD23  LEU  30          3HD2      LEU  30  -2.444  22.466  17.589
  240    H    ILE  31           H        ILE  31  -2.580  26.787  21.561
  241    HA   ILE  31           HA       ILE  31  -4.429  24.767  22.510
  242    HB   ILE  31           HB       ILE  31  -4.615  25.919  24.763
  243   HG12  ILE  31          2HG1      ILE  31  -1.824  26.695  24.812
  244   HG13  ILE  31          3HG1      ILE  31  -2.717  27.629  23.616
  245   HG21  ILE  31          1HG2      ILE  31  -2.018  24.481  24.250
  246   HG22  ILE  31          2HG2      ILE  31  -2.926  24.542  25.760
  247   HG23  ILE  31          3HG2      ILE  31  -3.589  23.687  24.368
  248   HD11  ILE  31          1HD1      ILE  31  -3.795  27.313  26.380
  249   HD12  ILE  31          2HD1      ILE  31  -2.535  28.499  26.038
  250   HD13  ILE  31          3HD1      ILE  31  -4.085  28.592  25.202
  251    HA   PRO  32           HA       PRO  32  -7.432  27.752  21.351
  252    HB2  PRO  32          2HB       PRO  32  -9.464  27.148  23.047
  253    HB3  PRO  32          3HB       PRO  32  -9.013  26.118  21.683
  254    HG2  PRO  32          2HG       PRO  32  -8.309  25.843  24.580
  255    HG3  PRO  32          3HG       PRO  32  -8.813  24.593  23.427
  256    HD2  PRO  32          2HD       PRO  32  -6.223  24.979  24.117
  257    HD3  PRO  32          3HD       PRO  32  -6.708  24.417  22.504
  258    H    GLU  33           H        GLU  33  -6.122  29.561  22.142
  259    HA   GLU  33           HA       GLU  33  -6.735  30.557  24.804
  260    HB2  GLU  33          2HB       GLU  33  -4.640  30.969  22.846
  261    HB3  GLU  33          3HB       GLU  33  -5.269  32.502  23.431
  262    HG2  GLU  33          2HG       GLU  33  -4.965  30.962  25.718
  263    HG3  GLU  33          3HG       GLU  33  -3.546  30.594  24.739
  264    H    ILE  34           H        ILE  34  -6.571  32.304  21.713
  265    HA   ILE  34           HA       ILE  34  -9.312  33.222  22.025
  266    HB   ILE  34           HB       ILE  34  -7.008  35.174  21.950
  267   HG12  ILE  34          2HG1      ILE  34  -9.045  34.585  24.109
  268   HG13  ILE  34          3HG1      ILE  34  -7.332  34.183  24.167
  269   HG21  ILE  34          1HG2      ILE  34  -8.430  36.674  21.147
  270   HG22  ILE  34          2HG2      ILE  34  -9.676  35.432  21.043
  271   HG23  ILE  34          3HG2      ILE  34  -9.513  36.396  22.510
  272   HD11  ILE  34          1HD1      ILE  34  -7.200  36.839  23.725
  273   HD12  ILE  34          2HD1      ILE  34  -8.695  36.732  24.655
  274   HD13  ILE  34          3HD1      ILE  34  -7.193  36.094  25.324
  275    H    ASN  35           H        ASN  35  -6.498  34.450  20.223
  276    HA   ASN  35           HA       ASN  35  -7.997  33.971  17.738
  277    HB2  ASN  35          2HB       ASN  35  -6.418  36.200  18.702
  278    HB3  ASN  35          3HB       ASN  35  -5.810  35.621  17.154
  279   HD21  ASN  35          1HD2      ASN  35  -7.566  37.947  18.291
  280   HD22  ASN  35          2HD2      ASN  35  -8.809  38.083  17.099
  281    H    LEU  36           H        LEU  36  -5.509  32.740  19.558
  282    HA   LEU  36           HA       LEU  36  -3.454  32.163  17.812
  283    HB2  LEU  36          2HB       LEU  36  -3.263  31.625  20.129
  284    HB3  LEU  36          3HB       LEU  36  -4.628  30.514  20.039
  285    HG   LEU  36           HG       LEU  36  -2.287  29.889  18.336
  286   HD11  LEU  36          1HD1      LEU  36  -1.476  28.648  20.550
  287   HD12  LEU  36          2HD1      LEU  36  -2.169  30.093  21.285
  288   HD13  LEU  36          3HD1      LEU  36  -0.889  30.244  20.082
  289   HD21  LEU  36          1HD2      LEU  36  -3.552  28.067  18.164
  290   HD22  LEU  36          2HD2      LEU  36  -4.586  28.575  19.500
  291   HD23  LEU  36          3HD2      LEU  36  -3.095  27.689  19.825
  292    H    ASN  37           H        ASN  37  -6.518  30.446  18.249
  293    HA   ASN  37           HA       ASN  37  -6.022  28.262  16.590
  294    HB2  ASN  37          2HB       ASN  37  -8.356  29.535  17.791
  295    HB3  ASN  37          3HB       ASN  37  -8.718  28.810  16.227
  296   HD21  ASN  37          1HD2      ASN  37  -7.880  26.553  15.944
  297   HD22  ASN  37          2HD2      ASN  37  -8.026  25.489  17.297
  298    H    ASP  38           H        ASP  38  -7.467  31.412  15.797
  299    HA   ASP  38           HA       ASP  38  -7.961  30.939  13.093
  300    HB2  ASP  38          2HB       ASP  38  -7.392  33.455  14.645
  301    HB3  ASP  38          3HB       ASP  38  -7.690  33.494  12.909
  302    H    THR  39           H        THR  39  -5.116  32.444  14.616
  303    HA   THR  39           HA       THR  39  -3.637  32.901  12.301
  304    HB   THR  39           HB       THR  39  -1.828  32.149  14.375
  305    HG1  THR  39           HG1      THR  39  -2.825  33.784  15.915
  306   HG21  THR  39          1HG2      THR  39  -1.676  33.988  12.636
  307   HG22  THR  39          2HG2      THR  39  -1.168  34.425  14.267
  308   HG23  THR  39          3HG2      THR  39  -2.749  34.929  13.671
  309    H    PHE  40           H        PHE  40  -3.457  30.111  14.515
  310    HA   PHE  40           HA       PHE  40  -1.573  28.648  13.060
  311    HB2  PHE  40          2HB       PHE  40  -2.286  28.165  15.404
  312    HB3  PHE  40          3HB       PHE  40  -3.798  27.522  14.770
  313    HD1  PHE  40           HD1      PHE  40  -0.366  27.097  13.425
  314    HD2  PHE  40           HD2      PHE  40  -3.704  25.266  15.328
  315    HE1  PHE  40           HE1      PHE  40   0.692  24.893  13.152
  316    HE2  PHE  40           HE2      PHE  40  -2.651  23.059  15.059
  317    HZ   PHE  40           HZ       PHE  40  -0.450  22.870  13.971
  318    H    ASP  41           H        ASP  41  -5.103  28.691  12.873
  319    HA   ASP  41           HA       ASP  41  -5.463  26.571  11.097
  320    HB2  ASP  41          2HB       ASP  41  -7.035  28.878  12.007
  321    HB3  ASP  41          3HB       ASP  41  -7.452  28.325  10.388
  322    H    THR  42           H        THR  42  -5.475  30.042  10.265
  323    HA   THR  42           HA       THR  42  -5.423  29.752   7.510
  324    HB   THR  42           HB       THR  42  -5.548  31.897   9.104
  325    HG1  THR  42           HG1      THR  42  -5.905  32.822   7.227
  326   HG21  THR  42          1HG2      THR  42  -3.607  33.238   9.066
  327   HG22  THR  42          2HG2      THR  42  -2.803  32.182   7.904
  328   HG23  THR  42          3HG2      THR  42  -3.054  31.639   9.563
  329    H    PHE  43           H        PHE  43  -2.859  29.393   9.822
  330    HA   PHE  43           HA       PHE  43  -0.702  29.634   7.965
  331    HB2  PHE  43          2HB       PHE  43  -0.474  29.977  10.430
  332    HB3  PHE  43          3HB       PHE  43  -0.711  28.247  10.652
  333    HD1  PHE  43           HD1      PHE  43   1.353  27.639  11.583
  334    HD2  PHE  43           HD2      PHE  43   1.238  29.875   7.963
  335    HE1  PHE  43           HE1      PHE  43   3.767  27.271  11.283
  336    HE2  PHE  43           HE2      PHE  43   3.651  29.509   7.657
  337    HZ   PHE  43           HZ       PHE  43   4.919  28.205   9.317
  338    H    ALA  44           H        ALA  44  -1.988  26.798   9.710
  339    HA   ALA  44           HA       ALA  44  -0.580  24.858   8.297
  340    HB1  ALA  44          1HB       ALA  44  -2.942  24.901  10.046
  341    HB2  ALA  44          2HB       ALA  44  -2.840  23.523   8.949
  342    HB3  ALA  44          3HB       ALA  44  -1.523  23.853  10.074
  343    H    LEU  45           H        LEU  45  -3.826  26.170   7.686
  344    HA   LEU  45           HA       LEU  45  -4.674  24.610   5.617
  345    HB2  LEU  45          2HB       LEU  45  -5.662  26.776   6.750
  346    HB3  LEU  45          3HB       LEU  45  -4.981  27.558   5.324
  347    HG   LEU  45           HG       LEU  45  -7.252  27.154   4.835
  348   HD11  LEU  45          1HD1      LEU  45  -7.147  25.801   2.906
  349   HD12  LEU  45          2HD1      LEU  45  -5.840  24.821   3.570
  350   HD13  LEU  45          3HD1      LEU  45  -5.537  26.494   3.100
  351   HD21  LEU  45          1HD2      LEU  45  -7.348  24.268   5.111
  352   HD22  LEU  45          2HD2      LEU  45  -8.468  25.498   5.697
  353   HD23  LEU  45          3HD2      LEU  45  -7.044  25.076   6.649
  354    H    ASP  46           H        ASP  46  -2.883  27.663   5.150
  355    HA   ASP  46           HA       ASP  46  -2.461  27.534   2.450
  356    HB2  ASP  46          2HB       ASP  46  -1.557  29.143   4.489
  357    HB3  ASP  46          3HB       ASP  46  -0.068  28.407   3.902
  358    H    PHE  47           H        PHE  47  -0.464  26.049   4.982
  359    HA   PHE  47           HA       PHE  47   1.541  24.994   3.377
  360    HB2  PHE  47          2HB       PHE  47   0.557  24.584   6.080
  361    HB3  PHE  47          3HB       PHE  47   1.146  23.084   5.369
  362    HD1  PHE  47           HD1      PHE  47   3.438  23.562   3.933
  363    HD2  PHE  47           HD2      PHE  47   2.088  25.681   7.369
  364    HE1  PHE  47           HE1      PHE  47   5.753  24.239   4.420
  365    HE2  PHE  47           HE2      PHE  47   4.400  26.362   7.861
  366    HZ   PHE  47           HZ       PHE  47   6.236  25.642   6.386
  367    H    SER  48           H        SER  48  -1.498  23.458   4.411
  368    HA   SER  48           HA       SER  48  -1.197  21.001   3.191
  369    HB2  SER  48          2HB       SER  48  -3.095  21.823   4.709
  370    HB3  SER  48          3HB       SER  48  -3.838  22.456   3.240
  371    HG   SER  48           HG       SER  48  -3.800  20.329   2.401
  372    H    ARG  49           H        ARG  49  -2.513  23.990   1.801
  373    HA   ARG  49           HA       ARG  49  -3.361  23.125  -0.649
  374    HB2  ARG  49          2HB       ARG  49  -3.034  25.561   0.484
  375    HB3  ARG  49          3HB       ARG  49  -1.751  25.603  -0.718
  376    HG2  ARG  49          2HG       ARG  49  -4.553  24.836  -1.450
  377    HG3  ARG  49          3HG       ARG  49  -4.042  26.523  -1.370
  378    HD2  ARG  49          2HD       ARG  49  -2.041  25.466  -2.846
  379    HD3  ARG  49          3HD       ARG  49  -3.381  24.428  -3.331
  380    HE   ARG  49           HE       ARG  49  -4.371  26.968  -3.516
  381   HH11  ARG  49          1HH1      ARG  49  -1.615  26.210  -6.318
  382   HH12  ARG  49          2HH1      ARG  49  -1.642  25.275  -4.860
  383   HH21  ARG  49          1HH2      ARG  49  -3.153  27.877  -6.642
  384   HH22  ARG  49          2HH2      ARG  49  -4.346  28.205  -5.432
  385    H    GLU  50           H        GLU  50  -0.036  23.842   0.329
  386    HA   GLU  50           HA       GLU  50   1.033  23.246  -2.276
  387    HB2  GLU  50          2HB       GLU  50   1.953  24.763  -0.265
  388    HB3  GLU  50          3HB       GLU  50   2.803  23.270   0.109
  389    HG2  GLU  50          2HG       GLU  50   4.202  23.482  -1.621
  390    HG3  GLU  50          3HG       GLU  50   2.937  24.056  -2.705
  391    H    LYS  51           H        LYS  51   0.498  21.539   0.716
  392    HA   LYS  51           HA       LYS  51   2.225  19.365   0.338
  393    HB2  LYS  51          2HB       LYS  51   1.242  18.481   2.187
  394    HB3  LYS  51          3HB       LYS  51   0.599  20.111   2.335
  395    HG2  LYS  51          2HG       LYS  51  -1.326  18.946   2.592
  396    HG3  LYS  51          3HG       LYS  51  -1.328  19.080   0.832
  397    HD2  LYS  51          2HD       LYS  51  -0.042  16.847   0.880
  398    HD3  LYS  51          3HD       LYS  51  -0.613  16.723   2.546
  399    HE2  LYS  51          2HE       LYS  51  -2.935  17.017   1.705
  400    HE3  LYS  51          3HE       LYS  51  -2.303  16.976   0.060
  401    HZ1  LYS  51          1HZ       LYS  51  -2.961  14.819   1.732
  402    HZ2  LYS  51          2HZ       LYS  51  -1.302  14.751   1.409
  403    HZ3  LYS  51          3HZ       LYS  51  -2.411  14.781   0.132
  404    H    LYS  52           H        LYS  52  -0.877  20.119  -1.048
  405    HA   LYS  52           HA       LYS  52  -1.305  17.457  -2.087
  406    HB2  LYS  52          2HB       LYS  52  -3.250  18.756  -1.498
  407    HB3  LYS  52          3HB       LYS  52  -2.742  20.076  -2.544
  408    HG2  LYS  52          2HG       LYS  52  -4.487  18.914  -3.653
  409    HG3  LYS  52          3HG       LYS  52  -2.981  18.521  -4.486
  410    HD2  LYS  52          2HD       LYS  52  -2.879  16.376  -3.451
  411    HD3  LYS  52          3HD       LYS  52  -4.199  16.779  -2.350
  412    HE2  LYS  52          2HE       LYS  52  -5.543  17.138  -4.561
  413    HE3  LYS  52          3HE       LYS  52  -4.284  16.124  -5.264
  414    HZ1  LYS  52          1HZ       LYS  52  -4.967  14.307  -4.104
  415    HZ2  LYS  52          2HZ       LYS  52  -6.456  15.095  -4.254
  416    HZ3  LYS  52          3HZ       LYS  52  -5.584  15.203  -2.809
  417    H    LEU  53           H        LEU  53  -0.678  20.660  -3.524
  418    HA   LEU  53           HA       LEU  53  -0.435  19.902  -6.167
  419    HB2  LEU  53          2HB       LEU  53  -0.070  22.215  -4.735
  420    HB3  LEU  53          3HB       LEU  53   1.549  21.884  -5.350
  421    HG   LEU  53           HG       LEU  53   0.039  21.573  -7.598
  422   HD11  LEU  53          1HD1      LEU  53  -1.251  23.906  -7.385
  423   HD12  LEU  53          2HD1      LEU  53  -1.419  23.334  -5.725
  424   HD13  LEU  53          3HD1      LEU  53  -2.016  22.350  -7.062
  425   HD21  LEU  53          1HD2      LEU  53   0.711  24.252  -7.620
  426   HD22  LEU  53          2HD2      LEU  53   1.746  22.910  -8.110
  427   HD23  LEU  53          3HD2      LEU  53   1.844  23.546  -6.468
  428    H    LEU  54           H        LEU  54   1.777  19.415  -3.535
  429    HA   LEU  54           HA       LEU  54   4.066  18.834  -5.150
  430    HB2  LEU  54          2HB       LEU  54   4.320  19.603  -2.867
  431    HB3  LEU  54          3HB       LEU  54   3.445  18.194  -2.270
  432    HG   LEU  54           HG       LEU  54   6.026  18.269  -2.080
  433   HD11  LEU  54          1HD1      LEU  54   4.371  16.314  -1.774
  434   HD12  LEU  54          2HD1      LEU  54   6.081  15.953  -2.001
  435   HD13  LEU  54          3HD1      LEU  54   4.957  15.778  -3.348
  436   HD21  LEU  54          1HD2      LEU  54   6.107  18.829  -4.624
  437   HD22  LEU  54          2HD2      LEU  54   5.941  17.084  -4.821
  438   HD23  LEU  54          3HD2      LEU  54   7.308  17.745  -3.922
  439    H    GLU  55           H        GLU  55   1.986  16.755  -3.124
  440    HA   GLU  55           HA       GLU  55   3.016  14.312  -3.965
  441    HB2  GLU  55          2HB       GLU  55   1.405  14.777  -2.044
  442    HB3  GLU  55          3HB       GLU  55   0.122  14.754  -3.246
  443    HG2  GLU  55          2HG       GLU  55   1.326  12.431  -3.830
  444    HG3  GLU  55          3HG       GLU  55   1.700  12.540  -2.111
  445    H    CYS  56           H        CYS  56   0.014  15.875  -5.100
  446    HA   CYS  56           HA       CYS  56   0.524  14.886  -7.787
  447    HB2  CYS  56          2HB       CYS  56  -1.632  13.876  -6.010
  448    HB3  CYS  56          3HB       CYS  56  -2.070  14.199  -7.683
  449    HG   CYS  56           HG       CYS  56  -0.116  11.772  -6.410
  450    H    LEU  57           H        LEU  57   0.316  16.625  -9.019
  451    HA   LEU  57           HA       LEU  57  -0.946  19.003  -8.267
  452    HB2  LEU  57          2HB       LEU  57   0.162  17.888 -10.776
  453    HB3  LEU  57          3HB       LEU  57  -0.937  19.257 -10.929
  454    HG   LEU  57           HG       LEU  57   0.809  20.112  -8.992
  455   HD11  LEU  57          1HD1      LEU  57   2.921  19.384  -9.324
  456   HD12  LEU  57          2HD1      LEU  57   2.673  19.102 -11.047
  457   HD13  LEU  57          3HD1      LEU  57   2.089  17.928  -9.868
  458   HD21  LEU  57          1HD2      LEU  57   1.897  21.257 -11.099
  459   HD22  LEU  57          2HD2      LEU  57   0.259  21.661 -10.583
  460   HD23  LEU  57          3HD2      LEU  57   0.511  20.540 -11.922
  461    H    ASP  58           H        ASP  58  -3.008  19.585  -8.202
  462    HA   ASP  58           HA       ASP  58  -4.930  18.969 -10.150
  463    HB2  ASP  58          2HB       ASP  58  -4.513  16.844  -8.358
  464    HB3  ASP  58          3HB       ASP  58  -6.016  17.607  -7.848
  465    H    TYR  59           H        TYR  59  -6.394  20.540 -10.049
  466    HA   TYR  59           HA       TYR  59  -7.641  22.285  -9.296
  467    HB2  TYR  59          2HB       TYR  59  -7.508  20.974  -6.579
  468    HB3  TYR  59          3HB       TYR  59  -8.750  22.064  -7.185
  469    HD1  TYR  59           HD1      TYR  59  -8.375  18.866  -6.253
  470    HD2  TYR  59           HD2      TYR  59  -9.544  21.044  -9.716
  471    HE1  TYR  59           HE1      TYR  59  -9.688  16.932  -7.019
  472    HE2  TYR  59           HE2      TYR  59 -10.860  19.117 -10.491
  473    HH   TYR  59           HH       TYR  59 -10.539  16.040  -9.219
  474    H    LEU  60           H        LEU  60  -5.709  23.590  -9.671
  475    HA   LEU  60           HA       LEU  60  -4.192  24.363  -7.309
  476    HB2  LEU  60          2HB       LEU  60  -2.702  25.438  -8.750
  477    HB3  LEU  60          3HB       LEU  60  -3.182  23.975  -9.607
  478    HG   LEU  60           HG       LEU  60  -4.968  25.812 -10.568
  479   HD11  LEU  60          1HD1      LEU  60  -3.277  27.434  -9.268
  480   HD12  LEU  60          2HD1      LEU  60  -4.107  27.890 -10.756
  481   HD13  LEU  60          3HD1      LEU  60  -2.440  27.316 -10.816
  482   HD21  LEU  60          1HD2      LEU  60  -2.478  24.539 -11.497
  483   HD22  LEU  60          2HD2      LEU  60  -3.018  25.939 -12.425
  484   HD23  LEU  60          3HD2      LEU  60  -4.088  24.551 -12.217
  Start of MODEL    4
    1    H    LEU   1           H        LEU   1   5.037   4.431   3.471
    2    HA   LEU   1           HA       LEU   1   7.319   5.153   3.218
    3    HB2  LEU   1          2HB       LEU   1   6.743   2.913   5.061
    4    HB3  LEU   1          3HB       LEU   1   8.441   3.311   4.808
    5    HG   LEU   1           HG       LEU   1   7.313   5.765   5.324
    6   HD11  LEU   1          1HD1      LEU   1   5.893   3.649   6.913
    7   HD12  LEU   1          2HD1      LEU   1   5.200   4.985   5.996
    8   HD13  LEU   1          3HD1      LEU   1   6.078   5.305   7.492
    9   HD21  LEU   1          1HD2      LEU   1   8.583   3.813   7.242
   10   HD22  LEU   1          2HD2      LEU   1   8.415   5.548   7.511
   11   HD23  LEU   1          3HD2      LEU   1   9.427   4.953   6.193
   12    H    LYS   2           H        LYS   2   6.943   1.660   2.681
   13    HA   LYS   2           HA       LYS   2   9.471   1.605   1.217
   14    HB2  LYS   2          2HB       LYS   2   8.864  -0.155   2.931
   15    HB3  LYS   2          3HB       LYS   2   7.630  -0.713   1.809
   16    HG2  LYS   2          2HG       LYS   2  10.149  -0.497   0.459
   17    HG3  LYS   2          3HG       LYS   2  10.322  -1.472   1.919
   18    HD2  LYS   2          2HD       LYS   2   8.154  -1.908  -0.128
   19    HD3  LYS   2          3HD       LYS   2   9.705  -2.750  -0.156
   20    HE2  LYS   2          2HE       LYS   2   9.106  -4.135   1.498
   21    HE3  LYS   2          3HE       LYS   2   8.385  -2.834   2.445
   22    HZ1  LYS   2          1HZ       LYS   2   7.030  -4.807   1.153
   23    HZ2  LYS   2          2HZ       LYS   2   6.855  -3.485   0.113
   24    HZ3  LYS   2          3HZ       LYS   2   6.361  -3.362   1.726
   25    H    GLU   3           H        GLU   3   8.941   2.685  -0.682
   26    HA   GLU   3           HA       GLU   3   7.877   1.115  -2.761
   27    HB2  GLU   3          2HB       GLU   3   5.915   2.497  -1.257
   28    HB3  GLU   3          3HB       GLU   3   6.065   3.336  -2.795
   29    HG2  GLU   3          2HG       GLU   3   5.882   0.984  -3.837
   30    HG3  GLU   3          3HG       GLU   3   5.248   0.511  -2.261
   31    H    ASN   4           H        ASN   4   7.233   2.811  -4.686
   32    HA   ASN   4           HA       ASN   4   9.366   4.842  -4.715
   33    HB2  ASN   4          2HB       ASN   4   9.418   2.540  -6.198
   34    HB3  ASN   4          3HB       ASN   4   8.670   3.671  -7.322
   35   HD21  ASN   4          1HD2      ASN   4  11.416   2.336  -6.963
   36   HD22  ASN   4          2HD2      ASN   4  12.522   3.640  -7.217
   37    H    ASP   5           H        ASP   5   8.956   6.737  -5.869
   38    HA   ASP   5           HA       ASP   5   7.732   8.401  -6.841
   39    HB2  ASP   5          2HB       ASP   5   5.496   6.478  -7.414
   40    HB3  ASP   5          3HB       ASP   5   5.999   7.895  -8.332
   41    H    HIS   6           H        HIS   6   5.204   6.263  -5.520
   42    HA   HIS   6           HA       HIS   6   3.729   8.362  -4.360
   43    HB2  HIS   6          2HB       HIS   6   2.889   6.042  -4.934
   44    HB3  HIS   6          3HB       HIS   6   3.682   5.478  -3.465
   45    HD1  HIS   6           HD1      HIS   6   1.264   4.792  -2.637
   46    HD2  HIS   6           HD2      HIS   6   1.897   8.872  -3.105
   47    HE1  HIS   6           HE1      HIS   6  -0.622   5.911  -1.406
   48    H    ALA   7           H        ALA   7   6.458   6.545  -3.253
   49    HA   ALA   7           HA       ALA   7   6.173   6.989  -0.472
   50    HB1  ALA   7          1HB       ALA   7   7.670   5.309  -0.921
   51    HB2  ALA   7          2HB       ALA   7   8.419   6.183  -2.258
   52    HB3  ALA   7          3HB       ALA   7   8.767   6.651  -0.593
   53    H    ARG   8           H        ARG   8   7.930   8.744  -3.010
   54    HA   ARG   8           HA       ARG   8   8.930  10.734  -1.213
   55    HB2  ARG   8          2HB       ARG   8   9.735  11.861  -3.210
   56    HB3  ARG   8          3HB       ARG   8  10.092  10.142  -3.306
   57    HG2  ARG   8          2HG       ARG   8   8.486   9.771  -4.945
   58    HG3  ARG   8          3HG       ARG   8   7.633  11.273  -4.580
   59    HD2  ARG   8          2HD       ARG   8   9.514  12.558  -5.464
   60    HD3  ARG   8          3HD       ARG   8  10.377  11.061  -5.814
   61    HE   ARG   8           HE       ARG   8   7.806  11.185  -7.067
   62   HH11  ARG   8          1HH1      ARG   8  11.097  12.287  -9.061
   63   HH12  ARG   8          2HH1      ARG   8  11.140  12.149  -7.335
   64   HH21  ARG   8          1HH2      ARG   8   9.161  11.840 -10.201
   65   HH22  ARG   8          2HH2      ARG   8   7.737  11.363  -9.340
   66    H    PHE   9           H        PHE   9   6.014  10.278  -2.991
   67    HA   PHE   9           HA       PHE   9   5.236  13.052  -2.976
   68    HB2  PHE   9          2HB       PHE   9   3.909  10.483  -3.779
   69    HB3  PHE   9          3HB       PHE   9   2.953  11.951  -3.601
   70    HD1  PHE   9           HD1      PHE   9   4.495  14.053  -4.695
   71    HD2  PHE   9           HD2      PHE   9   4.251  10.006  -5.991
   72    HE1  PHE   9           HE1      PHE   9   5.135  14.745  -6.968
   73    HE2  PHE   9           HE2      PHE   9   4.891  10.691  -8.265
   74    HZ   PHE   9           HZ       PHE   9   5.335  13.064  -8.756
   75    H    LEU  10           H        LEU  10   4.276  10.122  -1.213
   76    HA   LEU  10           HA       LEU  10   2.408  11.465   0.464
   77    HB2  LEU  10          2HB       LEU  10   2.958   8.858  -0.119
   78    HB3  LEU  10          3HB       LEU  10   3.613   9.006   1.510
   79    HG   LEU  10           HG       LEU  10   0.828   9.936   0.959
   80   HD11  LEU  10          1HD1      LEU  10   1.048   7.176   1.892
   81   HD12  LEU  10          2HD1      LEU  10   1.557   7.412   0.221
   82   HD13  LEU  10          3HD1      LEU  10  -0.061   7.898   0.726
   83   HD21  LEU  10          1HD2      LEU  10   2.104  10.270   3.139
   84   HD22  LEU  10          2HD2      LEU  10   1.943   8.528   3.367
   85   HD23  LEU  10          3HD2      LEU  10   0.503   9.540   3.249
   86    H    GLN  11           H        GLN  11   5.744  10.341   0.927
   87    HA   GLN  11           HA       GLN  11   6.057  11.036   3.599
   88    HB2  GLN  11          2HB       GLN  11   7.696   9.717   2.324
   89    HB3  GLN  11          3HB       GLN  11   8.132  11.150   1.402
   90    HG2  GLN  11          2HG       GLN  11   9.768  10.695   3.130
   91    HG3  GLN  11          3HG       GLN  11   8.942  12.223   3.432
   92   HE21  GLN  11          1HE2      GLN  11   8.691  12.504   5.522
   93   HE22  GLN  11          2HE2      GLN  11   8.210  11.300   6.664
   94    H    THR  12           H        THR  12   6.700  12.991   0.700
   95    HA   THR  12           HA       THR  12   7.635  15.286   1.979
   96    HB   THR  12           HB       THR  12   6.116  15.025  -0.621
   97    HG1  THR  12           HG1      THR  12   8.406  15.473  -1.338
   98   HG21  THR  12          1HG2      THR  12   5.886  17.261  -0.447
   99   HG22  THR  12          2HG2      THR  12   7.600  17.292  -0.860
  100   HG23  THR  12          3HG2      THR  12   7.098  17.386   0.828
  101    H    ALA  13           H        ALA  13   4.322  14.502   0.930
  102    HA   ALA  13           HA       ALA  13   3.032  16.804   1.733
  103    HB1  ALA  13          1HB       ALA  13   2.226  13.998   1.312
  104    HB2  ALA  13          2HB       ALA  13   1.128  14.987   2.276
  105    HB3  ALA  13          3HB       ALA  13   1.560  15.487   0.640
  106    H    LYS  14           H        LYS  14   3.772  13.923   3.669
  107    HA   LYS  14           HA       LYS  14   2.540  14.895   6.042
  108    HB2  LYS  14          2HB       LYS  14   4.291  12.607   5.314
  109    HB3  LYS  14          3HB       LYS  14   4.251  13.074   7.009
  110    HG2  LYS  14          2HG       LYS  14   1.581  12.968   6.003
  111    HG3  LYS  14          3HG       LYS  14   2.421  11.467   5.605
  112    HD2  LYS  14          2HD       LYS  14   3.215  11.648   8.113
  113    HD3  LYS  14          3HD       LYS  14   1.759  12.634   8.266
  114    HE2  LYS  14          2HE       LYS  14   1.392  10.120   6.797
  115    HE3  LYS  14          3HE       LYS  14   1.840   9.921   8.490
  116    HZ1  LYS  14          1HZ       LYS  14  -0.042  11.118   9.186
  117    HZ2  LYS  14          2HZ       LYS  14  -0.608  10.055   7.998
  118    HZ3  LYS  14          3HZ       LYS  14  -0.373  11.689   7.628
  119    H    ASN  15           H        ASN  15   5.906  14.774   4.917
  120    HA   ASN  15           HA       ASN  15   7.136  15.828   7.178
  121    HB2  ASN  15          2HB       ASN  15   8.456  14.873   5.399
  122    HB3  ASN  15          3HB       ASN  15   7.884  16.089   4.260
  123   HD21  ASN  15          1HD2      ASN  15   9.232  16.159   7.545
  124   HD22  ASN  15          2HD2      ASN  15  10.458  17.325   7.198
  125    H    ILE  16           H        ILE  16   5.175  17.365   4.793
  126    HA   ILE  16           HA       ILE  16   6.088  20.036   5.252
  127    HB   ILE  16           HB       ILE  16   3.550  18.997   3.991
  128   HG12  ILE  16          2HG1      ILE  16   5.666  20.438   2.477
  129   HG13  ILE  16          3HG1      ILE  16   6.031  18.797   2.998
  130   HG21  ILE  16          1HG2      ILE  16   3.040  21.165   4.811
  131   HG22  ILE  16          2HG2      ILE  16   4.588  21.807   4.264
  132   HG23  ILE  16          3HG2      ILE  16   3.363  21.336   3.086
  133   HD11  ILE  16          1HD1      ILE  16   4.481  19.672   0.782
  134   HD12  ILE  16          2HD1      ILE  16   4.928  18.030   1.247
  135   HD13  ILE  16          3HD1      ILE  16   3.447  18.753   1.875
  136    H    THR  17           H        THR  17   3.130  18.284   6.200
  137    HA   THR  17           HA       THR  17   2.259  20.381   7.945
  138    HB   THR  17           HB       THR  17   1.163  17.664   8.357
  139    HG1  THR  17           HG1      THR  17   1.346  17.468   6.175
  140   HG21  THR  17          1HG2      THR  17  -0.972  19.021   7.999
  141   HG22  THR  17          2HG2      THR  17   0.073  20.442   7.972
  142   HG23  THR  17          3HG2      THR  17   0.005  19.424   9.410
  143    H    GLU  18           H        GLU  18   4.437  17.772   8.237
  144    HA   GLU  18           HA       GLU  18   4.161  17.474  11.098
  145    HB2  GLU  18          2HB       GLU  18   6.044  16.327   9.049
  146    HB3  GLU  18          3HB       GLU  18   6.300  16.084  10.772
  147    HG2  GLU  18          2HG       GLU  18   3.607  15.454   9.746
  148    HG3  GLU  18          3HG       GLU  18   4.918  14.394   9.230
  149    H    ARG  19           H        ARG  19   6.135  19.270   8.861
  150    HA   ARG  19           HA       ARG  19   8.110  20.011  10.822
  151    HB2  ARG  19          2HB       ARG  19   8.865  19.895   8.567
  152    HB3  ARG  19          3HB       ARG  19   7.552  20.920   8.003
  153    HG2  ARG  19          2HG       ARG  19   8.511  22.833   9.123
  154    HG3  ARG  19          3HG       ARG  19   9.784  21.822   9.811
  155    HD2  ARG  19          2HD       ARG  19   9.681  21.477   6.964
  156    HD3  ARG  19          3HD       ARG  19   9.805  23.191   7.358
  157    HE   ARG  19           HE       ARG  19  11.669  21.800   8.908
  158   HH11  ARG  19          1HH1      ARG  19  12.735  22.555   5.124
  159   HH12  ARG  19          2HH1      ARG  19  11.061  22.581   5.570
  160   HH21  ARG  19          1HH2      ARG  19  14.335  22.088   6.696
  161   HH22  ARG  19          2HH2      ARG  19  13.876  21.762   8.333
  162    H    VAL  20           H        VAL  20   5.179  21.385   9.477
  163    HA   VAL  20           HA       VAL  20   5.530  24.002  10.537
  164    HB   VAL  20           HB       VAL  20   4.011  23.608   8.674
  165   HG11  VAL  20          1HG1      VAL  20   2.264  22.126  10.635
  166   HG12  VAL  20          2HG1      VAL  20   1.921  22.430   8.931
  167   HG13  VAL  20          3HG1      VAL  20   3.250  21.364   9.388
  168   HG21  VAL  20          1HG2      VAL  20   1.987  24.788   9.611
  169   HG22  VAL  20          2HG2      VAL  20   2.743  24.648  11.198
  170   HG23  VAL  20          3HG2      VAL  20   3.538  25.568   9.921
  171    H    SER  21           H        SER  21   3.956  21.069  11.700
  172    HA   SER  21           HA       SER  21   2.750  22.280  13.977
  173    HB2  SER  21          2HB       SER  21   3.277  19.444  13.135
  174    HB3  SER  21          3HB       SER  21   2.675  19.797  14.754
  175    HG   SER  21           HG       SER  21   0.786  19.949  13.873
  176    H    MET  22           H        MET  22   5.801  20.617  13.393
  177    HA   MET  22           HA       MET  22   6.659  20.298  16.025
  178    HB2  MET  22          2HB       MET  22   7.704  19.673  13.619
  179    HB3  MET  22          3HB       MET  22   8.711  21.056  14.028
  180    HG2  MET  22          2HG       MET  22   9.613  20.009  15.892
  181    HG3  MET  22          3HG       MET  22   8.307  18.830  15.980
  182    HE1  MET  22          1HE       MET  22  11.791  18.769  12.968
  183    HE2  MET  22          2HE       MET  22  10.730  20.154  13.227
  184    HE3  MET  22          3HE       MET  22  11.841  19.645  14.499
  185    H    ALA  23           H        ALA  23   6.982  23.066  13.843
  186    HA   ALA  23           HA       ALA  23   8.580  24.646  15.555
  187    HB1  ALA  23          1HB       ALA  23   7.279  26.495  14.067
  188    HB2  ALA  23          2HB       ALA  23   8.684  25.583  13.513
  189    HB3  ALA  23          3HB       ALA  23   7.060  25.054  13.073
  190    H    THR  24           H        THR  24   5.076  24.755  14.895
  191    HA   THR  24           HA       THR  24   4.388  26.764  16.672
  192    HB   THR  24           HB       THR  24   2.294  24.862  16.775
  193    HG1  THR  24           HG1      THR  24   3.154  25.147  14.097
  194   HG21  THR  24          1HG2      THR  24   1.646  26.583  14.737
  195   HG22  THR  24          2HG2      THR  24   2.851  27.500  15.642
  196   HG23  THR  24          3HG2      THR  24   1.406  26.899  16.455
  197    H    ALA  25           H        ALA  25   4.757  23.294  17.261
  198    HA   ALA  25           HA       ALA  25   3.845  23.311  19.934
  199    HB1  ALA  25          1HB       ALA  25   5.898  21.321  19.246
  200    HB2  ALA  25          2HB       ALA  25   4.275  21.103  19.904
  201    HB3  ALA  25          3HB       ALA  25   4.498  21.364  18.174
  202    H    SER  26           H        SER  26   7.068  23.654  18.508
  203    HA   SER  26           HA       SER  26   8.515  23.662  20.924
  204    HB2  SER  26          2HB       SER  26   9.142  24.875  18.225
  205    HB3  SER  26          3HB       SER  26  10.291  24.819  19.562
  206    HG   SER  26           HG       SER  26  10.643  23.030  18.289
  207    H    SER  27           H        SER  27   6.422  25.964  19.559
  208    HA   SER  27           HA       SER  27   7.598  28.171  21.085
  209    HB2  SER  27          2HB       SER  27   7.024  28.661  18.759
  210    HB3  SER  27          3HB       SER  27   5.357  28.162  19.048
  211    HG   SER  27           HG       SER  27   6.537  30.542  19.532
  212    H    GLN  28           H        GLN  28   5.142  25.840  21.274
  213    HA   GLN  28           HA       GLN  28   3.510  25.424  22.802
  214    HB2  GLN  28          2HB       GLN  28   5.443  26.310  24.313
  215    HB3  GLN  28          3HB       GLN  28   4.438  27.746  24.457
  216    HG2  GLN  28          2HG       GLN  28   2.863  25.392  24.909
  217    HG3  GLN  28          3HG       GLN  28   4.285  25.388  25.951
  218   HE21  GLN  28          1HE2      GLN  28   1.166  26.240  25.848
  219   HE22  GLN  28          2HE2      GLN  28   1.163  27.558  26.965
  220    H    VAL  29           H        VAL  29   2.482  26.618  20.756
  221    HA   VAL  29           HA       VAL  29   0.729  28.711  21.864
  222    HB   VAL  29           HB       VAL  29   2.417  29.550  20.155
  223   HG11  VAL  29          1HG1      VAL  29   0.710  28.624  17.956
  224   HG12  VAL  29          2HG1      VAL  29   2.465  28.786  18.043
  225   HG13  VAL  29          3HG1      VAL  29   1.675  27.362  18.722
  226   HG21  VAL  29          1HG2      VAL  29   0.925  31.132  19.332
  227   HG22  VAL  29          2HG2      VAL  29  -0.397  29.970  19.215
  228   HG23  VAL  29          3HG2      VAL  29   0.126  30.554  20.795
  229    H    LEU  30           H        LEU  30   0.517  25.719  21.500
  230    HA   LEU  30           HA       LEU  30  -1.712  25.557  19.610
  231    HB2  LEU  30          2HB       LEU  30  -0.091  23.475  21.051
  232    HB3  LEU  30          3HB       LEU  30  -1.553  23.085  20.147
  233    HG   LEU  30           HG       LEU  30  -0.350  24.201  18.154
  234   HD11  LEU  30          1HD1      LEU  30   1.524  25.231  18.980
  235   HD12  LEU  30          2HD1      LEU  30   2.199  23.684  18.467
  236   HD13  LEU  30          3HD1      LEU  30   1.832  23.965  20.169
  237   HD21  LEU  30          1HD2      LEU  30  -0.690  21.957  17.869
  238   HD22  LEU  30          2HD2      LEU  30   0.143  21.526  19.363
  239   HD23  LEU  30          3HD2      LEU  30   1.072  21.995  17.938
  240    H    ILE  31           H        ILE  31  -2.425  27.072  21.701
  241    HA   ILE  31           HA       ILE  31  -4.380  25.375  23.057
  242    HB   ILE  31           HB       ILE  31  -3.997  26.591  25.204
  243   HG12  ILE  31          2HG1      ILE  31  -1.266  27.288  24.847
  244   HG13  ILE  31          3HG1      ILE  31  -2.177  28.064  23.556
  245   HG21  ILE  31          1HG2      ILE  31  -3.141  24.312  24.770
  246   HG22  ILE  31          2HG2      ILE  31  -1.616  25.017  24.235
  247   HG23  ILE  31          3HG2      ILE  31  -2.143  25.218  25.906
  248   HD11  ILE  31          1HD1      ILE  31  -3.354  29.389  25.000
  249   HD12  ILE  31          2HD1      ILE  31  -3.178  28.265  26.349
  250   HD13  ILE  31          3HD1      ILE  31  -1.811  29.259  25.845
  251    HA   PRO  32           HA       PRO  32  -7.171  28.649  22.180
  252    HB2  PRO  32          2HB       PRO  32  -8.923  28.404  24.239
  253    HB3  PRO  32          3HB       PRO  32  -8.846  27.251  22.901
  254    HG2  PRO  32          2HG       PRO  32  -7.672  27.047  25.648
  255    HG3  PRO  32          3HG       PRO  32  -8.516  25.811  24.697
  256    HD2  PRO  32          2HD       PRO  32  -5.817  25.901  24.902
  257    HD3  PRO  32          3HD       PRO  32  -6.645  25.318  23.444
  258    H    GLU  33           H        GLU  33  -8.100  30.659  23.038
  259    HA   GLU  33           HA       GLU  33  -7.446  31.772  25.515
  260    HB2  GLU  33          2HB       GLU  33  -5.273  31.778  23.626
  261    HB3  GLU  33          3HB       GLU  33  -5.771  33.429  23.968
  262    HG2  GLU  33          2HG       GLU  33  -5.418  31.603  26.272
  263    HG3  GLU  33          3HG       GLU  33  -3.970  32.152  25.430
  264    H    ILE  34           H        ILE  34  -7.156  33.133  22.234
  265    HA   ILE  34           HA       ILE  34  -9.739  34.443  22.527
  266    HB   ILE  34           HB       ILE  34  -7.209  36.022  22.047
  267   HG12  ILE  34          2HG1      ILE  34  -9.160  36.059  24.360
  268   HG13  ILE  34          3HG1      ILE  34  -7.526  35.406  24.404
  269   HG21  ILE  34          1HG2      ILE  34  -9.475  37.661  22.530
  270   HG22  ILE  34          2HG2      ILE  34  -8.474  37.566  21.082
  271   HG23  ILE  34          3HG2      ILE  34  -9.885  36.520  21.249
  272   HD11  ILE  34          1HD1      ILE  34  -8.406  38.067  24.872
  273   HD12  ILE  34          2HD1      ILE  34  -6.782  37.392  25.012
  274   HD13  ILE  34          3HD1      ILE  34  -7.331  38.058  23.474
  275    H    ASN  35           H        ASN  35  -6.913  34.978  20.427
  276    HA   ASN  35           HA       ASN  35  -8.556  34.100  18.144
  277    HB2  ASN  35          2HB       ASN  35  -6.456  36.261  17.981
  278    HB3  ASN  35          3HB       ASN  35  -7.681  35.846  16.786
  279   HD21  ASN  35          1HD2      ASN  35  -6.913  38.254  18.600
  280   HD22  ASN  35          2HD2      ASN  35  -8.452  38.805  19.161
  281    H    LEU  36           H        LEU  36  -6.703  32.534  19.719
  282    HA   LEU  36           HA       LEU  36  -4.313  32.251  18.110
  283    HB2  LEU  36          2HB       LEU  36  -4.286  31.966  20.567
  284    HB3  LEU  36          3HB       LEU  36  -5.318  30.549  20.386
  285    HG   LEU  36           HG       LEU  36  -2.677  30.628  18.992
  286   HD11  LEU  36          1HD1      LEU  36  -3.140  30.418  21.919
  287   HD12  LEU  36          2HD1      LEU  36  -1.781  31.109  21.033
  288   HD13  LEU  36          3HD1      LEU  36  -1.938  29.358  21.182
  289   HD21  LEU  36          1HD2      LEU  36  -4.772  28.752  19.400
  290   HD22  LEU  36          2HD2      LEU  36  -3.327  28.154  20.216
  291   HD23  LEU  36          3HD2      LEU  36  -3.270  28.550  18.497
  292    H    ASN  37           H        ASN  37  -7.249  30.385  18.791
  293    HA   ASN  37           HA       ASN  37  -6.644  28.112  17.293
  294    HB2  ASN  37          2HB       ASN  37  -8.598  28.463  18.887
  295    HB3  ASN  37          3HB       ASN  37  -9.413  29.284  17.559
  296   HD21  ASN  37          1HD2      ASN  37  -7.876  26.244  18.470
  297   HD22  ASN  37          2HD2      ASN  37  -8.851  25.240  17.456
  298    H    ASP  38           H        ASP  38  -7.418  31.292  16.277
  299    HA   ASP  38           HA       ASP  38  -8.324  30.536  13.641
  300    HB2  ASP  38          2HB       ASP  38  -9.287  32.537  14.432
  301    HB3  ASP  38          3HB       ASP  38  -7.736  33.166  14.981
  302    H    THR  39           H        THR  39  -5.467  32.214  14.952
  303    HA   THR  39           HA       THR  39  -4.045  32.452  12.571
  304    HB   THR  39           HB       THR  39  -2.368  31.879  14.916
  305    HG1  THR  39           HG1      THR  39  -3.373  33.131  16.292
  306   HG21  THR  39          1HG2      THR  39  -1.790  34.381  14.278
  307   HG22  THR  39          2HG2      THR  39  -2.635  33.949  12.792
  308   HG23  THR  39          3HG2      THR  39  -1.219  33.030  13.301
  309    H    PHE  40           H        PHE  40  -3.944  29.850  14.994
  310    HA   PHE  40           HA       PHE  40  -1.989  28.282  13.748
  311    HB2  PHE  40          2HB       PHE  40  -2.924  28.023  16.098
  312    HB3  PHE  40          3HB       PHE  40  -4.293  27.193  15.365
  313    HD1  PHE  40           HD1      PHE  40  -0.673  27.005  14.539
  314    HD2  PHE  40           HD2      PHE  40  -4.108  24.987  16.036
  315    HE1  PHE  40           HE1      PHE  40   0.591  24.894  14.583
  316    HE2  PHE  40           HE2      PHE  40  -2.850  22.873  16.084
  317    HZ   PHE  40           HZ       PHE  40  -0.497  22.825  15.358
  318    H    ASP  41           H        ASP  41  -5.516  28.264  13.428
  319    HA   ASP  41           HA       ASP  41  -5.767  26.041  11.762
  320    HB2  ASP  41          2HB       ASP  41  -7.438  28.226  12.638
  321    HB3  ASP  41          3HB       ASP  41  -7.724  27.883  10.934
  322    H    THR  42           H        THR  42  -5.780  29.468  10.763
  323    HA   THR  42           HA       THR  42  -5.636  29.017   8.019
  324    HB   THR  42           HB       THR  42  -5.939  31.241   9.446
  325    HG1  THR  42           HG1      THR  42  -6.355  31.747   7.439
  326   HG21  THR  42          1HG2      THR  42  -3.408  31.028  10.030
  327   HG22  THR  42          2HG2      THR  42  -4.076  32.608   9.623
  328   HG23  THR  42          3HG2      THR  42  -3.166  31.698   8.418
  329    H    PHE  43           H        PHE  43  -3.203  28.743  10.441
  330    HA   PHE  43           HA       PHE  43  -0.949  29.041   8.701
  331    HB2  PHE  43          2HB       PHE  43  -0.922  29.396  11.202
  332    HB3  PHE  43          3HB       PHE  43  -1.014  27.647  11.380
  333    HD1  PHE  43           HD1      PHE  43   1.044  27.166  12.379
  334    HD2  PHE  43           HD2      PHE  43   0.914  29.537   8.847
  335    HE1  PHE  43           HE1      PHE  43   3.493  27.019  12.195
  336    HE2  PHE  43           HE2      PHE  43   3.363  29.393   8.656
  337    HZ   PHE  43           HZ       PHE  43   4.656  28.132  10.331
  338    H    ALA  44           H        ALA  44  -2.407  26.221  10.325
  339    HA   ALA  44           HA       ALA  44  -0.829  24.320   8.927
  340    HB1  ALA  44          1HB       ALA  44  -2.985  22.885   9.738
  341    HB2  ALA  44          2HB       ALA  44  -1.597  23.270  10.757
  342    HB3  ALA  44          3HB       ALA  44  -3.053  24.261  10.840
  343    H    LEU  45           H        LEU  45  -4.182  25.431   8.522
  344    HA   LEU  45           HA       LEU  45  -5.041  23.794   6.506
  345    HB2  LEU  45          2HB       LEU  45  -6.138  25.852   7.728
  346    HB3  LEU  45          3HB       LEU  45  -5.619  26.707   6.277
  347    HG   LEU  45           HG       LEU  45  -7.871  26.115   5.918
  348   HD11  LEU  45          1HD1      LEU  45  -6.209  25.609   4.077
  349   HD12  LEU  45          2HD1      LEU  45  -7.772  24.801   3.966
  350   HD13  LEU  45          3HD1      LEU  45  -6.360  23.913   4.539
  351   HD21  LEU  45          1HD2      LEU  45  -8.194  23.412   6.012
  352   HD22  LEU  45          2HD2      LEU  45  -8.665  24.532   7.291
  353   HD23  LEU  45          3HD2      LEU  45  -7.116  23.692   7.380
  354    H    ASP  46           H        ASP  46  -3.535  26.986   5.967
  355    HA   ASP  46           HA       ASP  46  -3.297  26.922   3.241
  356    HB2  ASP  46          2HB       ASP  46  -2.409  28.595   5.213
  357    HB3  ASP  46          3HB       ASP  46  -0.893  27.958   4.583
  358    H    PHE  47           H        PHE  47  -0.977  25.613   5.595
  359    HA   PHE  47           HA       PHE  47   0.945  24.708   3.798
  360    HB2  PHE  47          2HB       PHE  47   0.289  24.278   6.598
  361    HB3  PHE  47          3HB       PHE  47   0.938  22.823   5.849
  362    HD1  PHE  47           HD1      PHE  47   2.990  23.546   4.124
  363    HD2  PHE  47           HD2      PHE  47   1.861  25.468   7.750
  364    HE1  PHE  47           HE1      PHE  47   5.270  24.443   4.355
  365    HE2  PHE  47           HE2      PHE  47   4.138  26.368   7.986
  366    HZ   PHE  47           HZ       PHE  47   5.846  25.857   6.287
  367    H    SER  48           H        SER  48  -1.775  22.899   5.219
  368    HA   SER  48           HA       SER  48  -1.384  20.471   3.963
  369    HB2  SER  48          2HB       SER  48  -3.077  20.869   5.722
  370    HB3  SER  48          3HB       SER  48  -4.049  21.779   4.565
  371    HG   SER  48           HG       SER  48  -4.816  19.689   4.613
  372    H    ARG  49           H        ARG  49  -3.170  23.297   2.773
  373    HA   ARG  49           HA       ARG  49  -4.266  22.326   0.466
  374    HB2  ARG  49          2HB       ARG  49  -4.297  24.718   1.452
  375    HB3  ARG  49          3HB       ARG  49  -2.859  24.982   0.473
  376    HG2  ARG  49          2HG       ARG  49  -5.047  23.778  -1.022
  377    HG3  ARG  49          3HG       ARG  49  -5.451  25.353  -0.336
  378    HD2  ARG  49          2HD       ARG  49  -3.273  26.188  -1.318
  379    HD3  ARG  49          3HD       ARG  49  -3.190  24.662  -2.197
  380    HE   ARG  49           HE       ARG  49  -5.681  26.013  -2.579
  381   HH11  ARG  49          1HH1      ARG  49  -2.681  26.542  -5.178
  382   HH12  ARG  49          2HH1      ARG  49  -2.359  25.873  -3.612
  383   HH21  ARG  49          1HH2      ARG  49  -4.820  27.123  -5.759
  384   HH22  ARG  49          2HH2      ARG  49  -6.118  26.894  -4.637
  385    H    GLU  50           H        GLU  50  -0.917  23.359   0.966
  386    HA   GLU  50           HA       GLU  50  -0.170  22.833  -1.762
  387    HB2  GLU  50          2HB       GLU  50   0.887  24.413   0.161
  388    HB3  GLU  50          3HB       GLU  50   1.936  23.011   0.309
  389    HG2  GLU  50          2HG       GLU  50   1.756  23.503  -2.429
  390    HG3  GLU  50          3HG       GLU  50   1.921  25.088  -1.677
  391    H    LYS  51           H        LYS  51  -0.141  21.107   1.265
  392    HA   LYS  51           HA       LYS  51   1.707  19.093   0.650
  393    HB2  LYS  51          2HB       LYS  51   1.063  18.141   2.610
  394    HB3  LYS  51          3HB       LYS  51   0.291  19.703   2.846
  395    HG2  LYS  51          2HG       LYS  51  -1.463  18.362   3.348
  396    HG3  LYS  51          3HG       LYS  51  -1.707  18.481   1.604
  397    HD2  LYS  51          2HD       LYS  51  -0.204  16.381   1.485
  398    HD3  LYS  51          3HD       LYS  51  -0.569  16.214   3.204
  399    HE2  LYS  51          2HE       LYS  51  -2.985  16.272   2.641
  400    HE3  LYS  51          3HE       LYS  51  -2.552  16.302   0.932
  401    HZ1  LYS  51          1HZ       LYS  51  -3.105  14.065   1.780
  402    HZ2  LYS  51          2HZ       LYS  51  -1.768  14.143   2.812
  403    HZ3  LYS  51          3HZ       LYS  51  -1.544  14.160   1.136
  404    H    LYS  52           H        LYS  52  -1.603  19.560  -0.316
  405    HA   LYS  52           HA       LYS  52  -1.919  16.863  -1.307
  406    HB2  LYS  52          2HB       LYS  52  -3.880  17.972  -0.450
  407    HB3  LYS  52          3HB       LYS  52  -3.643  19.333  -1.539
  408    HG2  LYS  52          2HG       LYS  52  -5.406  18.009  -2.414
  409    HG3  LYS  52          3HG       LYS  52  -3.998  17.763  -3.449
  410    HD2  LYS  52          2HD       LYS  52  -3.552  15.637  -2.473
  411    HD3  LYS  52          3HD       LYS  52  -4.734  15.910  -1.190
  412    HE2  LYS  52          2HE       LYS  52  -6.406  16.143  -3.184
  413    HE3  LYS  52          3HE       LYS  52  -5.171  15.251  -4.071
  414    HZ1  LYS  52          1HZ       LYS  52  -5.311  13.479  -2.464
  415    HZ2  LYS  52          2HZ       LYS  52  -6.851  13.793  -3.089
  416    HZ3  LYS  52          3HZ       LYS  52  -6.438  14.342  -1.543
  417    H    LEU  53           H        LEU  53  -1.800  20.106  -2.785
  418    HA   LEU  53           HA       LEU  53  -1.842  19.360  -5.444
  419    HB2  LEU  53          2HB       LEU  53  -1.958  21.680  -4.569
  420    HB3  LEU  53          3HB       LEU  53  -0.224  21.612  -4.262
  421    HG   LEU  53           HG       LEU  53   0.183  21.369  -6.671
  422   HD11  LEU  53          1HD1      LEU  53  -2.779  21.238  -6.721
  423   HD12  LEU  53          2HD1      LEU  53  -1.588  20.390  -7.706
  424   HD13  LEU  53          3HD1      LEU  53  -1.972  22.077  -8.046
  425   HD21  LEU  53          1HD2      LEU  53  -1.609  23.740  -6.254
  426   HD22  LEU  53          2HD2      LEU  53  -0.136  23.622  -7.217
  427   HD23  LEU  53          3HD2      LEU  53  -0.042  23.608  -5.455
  428    H    LEU  54           H        LEU  54   0.740  19.113  -3.135
  429    HA   LEU  54           HA       LEU  54   2.837  18.753  -5.048
  430    HB2  LEU  54          2HB       LEU  54   3.313  19.565  -2.813
  431    HB3  LEU  54          3HB       LEU  54   2.683  18.074  -2.115
  432    HG   LEU  54           HG       LEU  54   5.244  18.428  -2.281
  433   HD11  LEU  54          1HD1      LEU  54   4.279  15.826  -3.399
  434   HD12  LEU  54          2HD1      LEU  54   3.867  16.312  -1.755
  435   HD13  LEU  54          3HD1      LEU  54   5.557  16.131  -2.223
  436   HD21  LEU  54          1HD2      LEU  54   4.800  17.300  -5.028
  437   HD22  LEU  54          2HD2      LEU  54   6.299  17.880  -4.303
  438   HD23  LEU  54          3HD2      LEU  54   5.034  19.025  -4.750
  439    H    GLU  55           H        GLU  55   1.268  16.495  -2.770
  440    HA   GLU  55           HA       GLU  55   2.416  14.158  -3.738
  441    HB2  GLU  55          2HB       GLU  55   1.026  14.468  -1.633
  442    HB3  GLU  55          3HB       GLU  55  -0.394  14.339  -2.660
  443    HG2  GLU  55          2HG       GLU  55   0.794  12.121  -3.439
  444    HG3  GLU  55          3HG       GLU  55   1.567  12.260  -1.861
  445    H    CYS  56           H        CYS  56  -0.625  15.722  -4.691
  446    HA   CYS  56           HA       CYS  56  -0.563  14.126  -7.164
  447    HB2  CYS  56          2HB       CYS  56  -2.434  13.750  -5.240
  448    HB3  CYS  56          3HB       CYS  56  -3.215  15.004  -6.194
  449    HG   CYS  56           HG       CYS  56  -3.557  13.593  -8.438
  450    H    LEU  57           H        LEU  57  -0.086  15.479  -8.761
  451    HA   LEU  57           HA       LEU  57  -0.354  18.260  -8.692
  452    HB2  LEU  57          2HB       LEU  57  -0.030  18.133 -11.161
  453    HB3  LEU  57          3HB       LEU  57   1.184  17.280 -10.210
  454    HG   LEU  57           HG       LEU  57  -1.060  15.615 -11.123
  455   HD11  LEU  57          1HD1      LEU  57  -0.534  15.550 -13.397
  456   HD12  LEU  57          2HD1      LEU  57   0.962  16.455 -13.173
  457   HD13  LEU  57          3HD1      LEU  57  -0.593  17.272 -13.017
  458   HD21  LEU  57          1HD2      LEU  57   1.202  14.405 -11.924
  459   HD22  LEU  57          2HD2      LEU  57   0.561  14.284 -10.285
  460   HD23  LEU  57          3HD2      LEU  57   1.847  15.437 -10.647
  461    H    ASP  58           H        ASP  58  -1.799  19.679  -9.713
  462    HA   ASP  58           HA       ASP  58  -4.232  18.633 -10.889
  463    HB2  ASP  58          2HB       ASP  58  -4.164  19.230  -8.132
  464    HB3  ASP  58          3HB       ASP  58  -5.036  20.554  -8.901
  465    H    TYR  59           H        TYR  59  -4.948  19.948 -12.447
  466    HA   TYR  59           HA       TYR  59  -3.516  22.342 -13.051
  467    HB2  TYR  59          2HB       TYR  59  -5.776  20.836 -14.299
  468    HB3  TYR  59          3HB       TYR  59  -5.488  22.497 -14.804
  469    HD1  TYR  59           HD1      TYR  59  -4.267  22.698 -16.741
  470    HD2  TYR  59           HD2      TYR  59  -3.391  19.472 -14.109
  471    HE1  TYR  59           HE1      TYR  59  -2.509  21.928 -18.279
  472    HE2  TYR  59           HE2      TYR  59  -1.630  18.694 -15.639
  473    HH   TYR  59           HH       TYR  59  -0.165  19.693 -17.420
  474    H    LEU  60           H        LEU  60  -3.950  24.372 -12.488
  475    HA   LEU  60           HA       LEU  60  -6.071  24.967 -10.685
  476    HB2  LEU  60          2HB       LEU  60  -5.263  27.296 -10.878
  477    HB3  LEU  60          3HB       LEU  60  -3.996  26.137 -10.479
  478    HG   LEU  60           HG       LEU  60  -3.707  26.237 -13.154
  479   HD11  LEU  60          1HD1      LEU  60  -5.530  28.248 -12.749
  480   HD12  LEU  60          2HD1      LEU  60  -4.460  28.090 -14.142
  481   HD13  LEU  60          3HD1      LEU  60  -3.993  29.111 -12.782
  482   HD21  LEU  60          1HD2      LEU  60  -2.512  28.211 -11.211
  483   HD22  LEU  60          2HD2      LEU  60  -1.824  27.707 -12.756
  484   HD23  LEU  60          3HD2      LEU  60  -1.971  26.547 -11.434
  Start of MODEL    5
    1    H    LEU   1           H        LEU   1   3.391  -4.897  -4.733
    2    HA   LEU   1           HA       LEU   1   3.852  -2.571  -5.218
    3    HB2  LEU   1          2HB       LEU   1   1.743  -3.001  -4.055
    4    HB3  LEU   1          3HB       LEU   1   2.569  -2.862  -2.505
    5    HG   LEU   1           HG       LEU   1   3.129  -0.458  -3.736
    6   HD11  LEU   1          1HD1      LEU   1   1.252  -1.345  -5.366
    7   HD12  LEU   1          2HD1      LEU   1   1.327   0.347  -4.877
    8   HD13  LEU   1          3HD1      LEU   1   0.193  -0.749  -4.087
    9   HD21  LEU   1          1HD2      LEU   1   0.724  -0.803  -1.991
   10   HD22  LEU   1          2HD2      LEU   1   1.944   0.471  -1.978
   11   HD23  LEU   1          3HD2      LEU   1   2.338  -1.135  -1.362
   12    H    LYS   2           H        LYS   2   6.093  -2.208  -5.162
   13    HA   LYS   2           HA       LYS   2   7.413  -1.715  -2.639
   14    HB2  LYS   2          2HB       LYS   2   9.388  -1.241  -4.005
   15    HB3  LYS   2          3HB       LYS   2   8.641  -2.760  -4.482
   16    HG2  LYS   2          2HG       LYS   2   8.403  -2.055  -6.566
   17    HG3  LYS   2          3HG       LYS   2   7.558  -0.600  -6.030
   18    HD2  LYS   2          2HD       LYS   2   9.391   0.683  -6.241
   19    HD3  LYS   2          3HD       LYS   2  10.451  -0.555  -5.561
   20    HE2  LYS   2          2HE       LYS   2   9.821  -1.680  -7.940
   21    HE3  LYS   2          3HE       LYS   2   9.765   0.030  -8.365
   22    HZ1  LYS   2          1HZ       LYS   2  11.959  -0.537  -8.731
   23    HZ2  LYS   2          2HZ       LYS   2  12.047  -1.555  -7.384
   24    HZ3  LYS   2          3HZ       LYS   2  12.024   0.123  -7.175
   25    H    GLU   3           H        GLU   3   8.648   0.332  -2.312
   26    HA   GLU   3           HA       GLU   3   6.871   2.584  -2.746
   27    HB2  GLU   3          2HB       GLU   3   9.447   2.369  -1.178
   28    HB3  GLU   3          3HB       GLU   3   8.400   3.781  -1.213
   29    HG2  GLU   3          2HG       GLU   3   7.589   1.059  -0.217
   30    HG3  GLU   3          3HG       GLU   3   8.104   2.402   0.802
   31    H    ASN   4           H        ASN   4   7.220   4.261  -4.084
   32    HA   ASN   4           HA       ASN   4   9.854   4.670  -5.260
   33    HB2  ASN   4          2HB       ASN   4   8.533   3.061  -6.725
   34    HB3  ASN   4          3HB       ASN   4   7.436   4.401  -7.047
   35   HD21  ASN   4          1HD2      ASN   4   8.836   3.110  -9.048
   36   HD22  ASN   4          2HD2      ASN   4   9.993   4.202  -9.722
   37    H    ASP   5           H        ASP   5   6.467   5.723  -5.665
   38    HA   ASP   5           HA       ASP   5   7.404   8.500  -5.354
   39    HB2  ASP   5          2HB       ASP   5   5.477   9.146  -6.819
   40    HB3  ASP   5          3HB       ASP   5   6.715   8.197  -7.637
   41    H    HIS   6           H        HIS   6   5.623   6.065  -3.986
   42    HA   HIS   6           HA       HIS   6   3.490   7.693  -2.907
   43    HB2  HIS   6          2HB       HIS   6   3.421   5.157  -3.464
   44    HB3  HIS   6          3HB       HIS   6   4.216   4.954  -1.906
   45    HD1  HIS   6           HD1      HIS   6   1.179   6.923  -3.114
   46    HD2  HIS   6           HD2      HIS   6   2.379   4.438  -0.009
   47    HE1  HIS   6           HE1      HIS   6  -0.824   6.713  -1.610
   48    H    ALA   7           H        ALA   7   6.640   6.563  -1.940
   49    HA   ALA   7           HA       ALA   7   6.334   7.139   0.845
   50    HB1  ALA   7          1HB       ALA   7   9.057   7.195   0.276
   51    HB2  ALA   7          2HB       ALA   7   8.119   5.814   0.848
   52    HB3  ALA   7          3HB       ALA   7   8.377   6.050  -0.880
   53    H    ARG   8           H        ARG   8   7.462   8.909  -1.967
   54    HA   ARG   8           HA       ARG   8   8.468  11.119  -0.403
   55    HB2  ARG   8          2HB       ARG   8   8.773  12.200  -2.639
   56    HB3  ARG   8          3HB       ARG   8   9.593  10.654  -2.468
   57    HG2  ARG   8          2HG       ARG   8   8.391   9.696  -4.092
   58    HG3  ARG   8          3HG       ARG   8   6.889  10.461  -3.568
   59    HD2  ARG   8          2HD       ARG   8   7.138  12.209  -4.972
   60    HD3  ARG   8          3HD       ARG   8   8.885  12.275  -4.743
   61    HE   ARG   8           HE       ARG   8   7.491  10.972  -6.852
   62   HH11  ARG   8          1HH1      ARG   8  11.242   9.862  -6.001
   63   HH12  ARG   8          2HH1      ARG   8  10.322  10.757  -4.838
   64   HH21  ARG   8          1HH2      ARG   8  10.314   9.315  -8.023
   65   HH22  ARG   8          2HH2      ARG   8   8.692   9.793  -8.392
   66    H    PHE   9           H        PHE   9   5.505  10.215  -1.959
   67    HA   PHE   9           HA       PHE   9   4.386  12.855  -2.032
   68    HB2  PHE   9          2HB       PHE   9   3.507  10.125  -2.718
   69    HB3  PHE   9          3HB       PHE   9   2.225  11.203  -2.174
   70    HD1  PHE   9           HD1      PHE   9   5.231  12.253  -4.034
   71    HD2  PHE   9           HD2      PHE   9   1.059  11.429  -4.216
   72    HE1  PHE   9           HE1      PHE   9   5.133  13.260  -6.277
   73    HE2  PHE   9           HE2      PHE   9   0.955  12.434  -6.459
   74    HZ   PHE   9           HZ       PHE   9   2.993  13.351  -7.493
   75    H    LEU  10           H        LEU  10   4.222  10.093   0.151
   76    HA   LEU  10           HA       LEU  10   2.276  11.340   1.872
   77    HB2  LEU  10          2HB       LEU  10   3.046   8.763   1.432
   78    HB3  LEU  10          3HB       LEU  10   3.858   9.120   2.955
   79    HG   LEU  10           HG       LEU  10   1.137   9.989   3.114
   80   HD11  LEU  10          1HD1      LEU  10  -0.107   8.085   2.656
   81   HD12  LEU  10          2HD1      LEU  10   1.316   7.047   2.593
   82   HD13  LEU  10          3HD1      LEU  10   0.994   8.181   1.282
   83   HD21  LEU  10          1HD2      LEU  10   1.113   8.536   5.041
   84   HD22  LEU  10          2HD2      LEU  10   2.646   9.407   4.981
   85   HD23  LEU  10          3HD2      LEU  10   2.571   7.716   4.482
   86    H    GLN  11           H        GLN  11   5.742  10.579   2.071
   87    HA   GLN  11           HA       GLN  11   6.208  11.610   4.623
   88    HB2  GLN  11          2HB       GLN  11   7.801  10.219   3.289
   89    HB3  GLN  11          3HB       GLN  11   8.140  11.633   2.300
   90    HG2  GLN  11          2HG       GLN  11   9.111  12.787   4.132
   91    HG3  GLN  11          3HG       GLN  11   8.553  11.566   5.275
   92   HE21  GLN  11          1HE2      GLN  11  10.251  10.531   6.033
   93   HE22  GLN  11          2HE2      GLN  11  11.574   9.926   5.101
   94    H    THR  12           H        THR  12   6.534  13.193   1.454
   95    HA   THR  12           HA       THR  12   7.373  15.693   2.388
   96    HB   THR  12           HB       THR  12   5.854  14.935  -0.108
   97    HG1  THR  12           HG1      THR  12   8.242  14.430   0.448
   98   HG21  THR  12          1HG2      THR  12   7.000  17.314  -0.712
   99   HG22  THR  12          2HG2      THR  12   6.550  17.588   0.971
  100   HG23  THR  12          3HG2      THR  12   5.321  17.129  -0.207
  101    H    ALA  13           H        ALA  13   4.091  14.659   1.443
  102    HA   ALA  13           HA       ALA  13   2.730  16.977   2.106
  103    HB1  ALA  13          1HB       ALA  13   1.994  14.131   1.807
  104    HB2  ALA  13          2HB       ALA  13   0.852  15.156   2.677
  105    HB3  ALA  13          3HB       ALA  13   1.327  15.566   1.029
  106    H    LYS  14           H        LYS  14   3.294  14.123   4.164
  107    HA   LYS  14           HA       LYS  14   2.046  15.133   6.465
  108    HB2  LYS  14          2HB       LYS  14   4.070  12.995   5.940
  109    HB3  LYS  14          3HB       LYS  14   3.746  13.472   7.601
  110    HG2  LYS  14          2HG       LYS  14   1.504  12.742   5.760
  111    HG3  LYS  14          3HG       LYS  14   2.442  11.497   6.589
  112    HD2  LYS  14          2HD       LYS  14   1.596  13.660   8.353
  113    HD3  LYS  14          3HD       LYS  14   0.244  12.807   7.604
  114    HE2  LYS  14          2HE       LYS  14   2.458  11.188   8.748
  115    HE3  LYS  14          3HE       LYS  14   1.352  11.981   9.868
  116    HZ1  LYS  14          1HZ       LYS  14  -0.461  10.804   9.015
  117    HZ2  LYS  14          2HZ       LYS  14   0.766   9.646   9.137
  118    HZ3  LYS  14          3HZ       LYS  14   0.377  10.310   7.630
  119    H    ASN  15           H        ASN  15   5.441  15.233   5.433
  120    HA   ASN  15           HA       ASN  15   6.508  16.461   7.699
  121    HB2  ASN  15          2HB       ASN  15   7.850  15.465   5.860
  122    HB3  ASN  15          3HB       ASN  15   7.411  16.828   4.834
  123   HD21  ASN  15          1HD2      ASN  15   8.577  18.639   4.940
  124   HD22  ASN  15          2HD2      ASN  15   9.849  18.933   6.072
  125    H    ILE  16           H        ILE  16   4.836  17.816   4.928
  126    HA   ILE  16           HA       ILE  16   5.463  20.520   5.313
  127    HB   ILE  16           HB       ILE  16   3.012  19.234   4.115
  128   HG12  ILE  16          2HG1      ILE  16   5.051  20.768   2.570
  129   HG13  ILE  16          3HG1      ILE  16   5.481  19.156   3.131
  130   HG21  ILE  16          1HG2      ILE  16   2.106  21.276   4.526
  131   HG22  ILE  16          2HG2      ILE  16   3.673  22.080   4.596
  132   HG23  ILE  16          3HG2      ILE  16   2.964  21.667   3.035
  133   HD11  ILE  16          1HD1      ILE  16   4.359  18.241   1.465
  134   HD12  ILE  16          2HD1      ILE  16   2.888  19.094   1.933
  135   HD13  ILE  16          3HD1      ILE  16   4.039  19.858   0.837
  136    H    THR  17           H        THR  17   2.697  18.621   6.495
  137    HA   THR  17           HA       THR  17   1.708  20.828   8.069
  138    HB   THR  17           HB       THR  17   0.692  18.096   8.602
  139    HG1  THR  17           HG1      THR  17  -0.105  17.780   6.621
  140   HG21  THR  17          1HG2      THR  17  -0.669  19.640   9.593
  141   HG22  THR  17          2HG2      THR  17  -1.456  19.554   8.017
  142   HG23  THR  17          3HG2      THR  17  -0.341  20.872   8.375
  143    H    GLU  18           H        GLU  18   3.921  18.253   8.503
  144    HA   GLU  18           HA       GLU  18   3.655  18.078  11.363
  145    HB2  GLU  18          2HB       GLU  18   4.440  16.191   9.906
  146    HB3  GLU  18          3HB       GLU  18   5.925  17.090   9.632
  147    HG2  GLU  18          2HG       GLU  18   6.262  17.084  12.122
  148    HG3  GLU  18          3HG       GLU  18   4.916  15.950  12.221
  149    H    ARG  19           H        ARG  19   5.778  19.708   9.075
  150    HA   ARG  19           HA       ARG  19   7.630  20.657  11.013
  151    HB2  ARG  19          2HB       ARG  19   7.790  20.477   8.384
  152    HB3  ARG  19          3HB       ARG  19   7.160  22.118   8.450
  153    HG2  ARG  19          2HG       ARG  19   9.243  22.021  10.321
  154    HG3  ARG  19          3HG       ARG  19   9.829  21.176   8.886
  155    HD2  ARG  19          2HD       ARG  19   9.440  23.057   7.506
  156    HD3  ARG  19          3HD       ARG  19   8.488  23.864   8.751
  157    HE   ARG  19           HE       ARG  19  10.429  24.683   9.622
  158   HH11  ARG  19          1HH1      ARG  19  12.895  22.116   7.790
  159   HH12  ARG  19          2HH1      ARG  19  11.180  21.922   7.640
  160   HH21  ARG  19          1HH2      ARG  19  13.750  23.838   9.036
  161   HH22  ARG  19          2HH2      ARG  19  12.685  24.950   9.828
  162    H    VAL  20           H        VAL  20   4.830  22.121   9.394
  163    HA   VAL  20           HA       VAL  20   5.009  24.683  10.460
  164    HB   VAL  20           HB       VAL  20   3.439  24.212   8.696
  165   HG11  VAL  20          1HG1      VAL  20   1.536  22.809   8.916
  166   HG12  VAL  20          2HG1      VAL  20   2.918  21.886   9.510
  167   HG13  VAL  20          3HG1      VAL  20   1.791  22.622  10.651
  168   HG21  VAL  20          1HG2      VAL  20   1.417  25.293   9.598
  169   HG22  VAL  20          2HG2      VAL  20   2.025  25.031  11.233
  170   HG23  VAL  20          3HG2      VAL  20   2.897  26.092  10.127
  171    H    SER  21           H        SER  21   3.382  21.812  11.767
  172    HA   SER  21           HA       SER  21   2.219  23.004  14.007
  173    HB2  SER  21          2HB       SER  21   2.106  20.535  12.990
  174    HB3  SER  21          3HB       SER  21   3.273  20.231  14.276
  175    HG   SER  21           HG       SER  21   0.652  20.418  14.488
  176    H    MET  22           H        MET  22   5.283  21.182  13.838
  177    HA   MET  22           HA       MET  22   6.108  21.677  16.458
  178    HB2  MET  22          2HB       MET  22   7.092  20.025  14.800
  179    HB3  MET  22          3HB       MET  22   7.968  21.380  14.100
  180    HG2  MET  22          2HG       MET  22   9.095  21.770  16.214
  181    HG3  MET  22          3HG       MET  22   8.186  20.454  16.955
  182    HE1  MET  22          1HE       MET  22  11.326  20.161  13.678
  183    HE2  MET  22          2HE       MET  22  10.385  21.563  14.188
  184    HE3  MET  22          3HE       MET  22  11.779  21.044  15.136
  185    H    ALA  23           H        ALA  23   6.415  23.611  13.550
  186    HA   ALA  23           HA       ALA  23   8.281  25.485  14.581
  187    HB1  ALA  23          1HB       ALA  23   8.018  25.275  12.209
  188    HB2  ALA  23          2HB       ALA  23   6.308  25.692  12.313
  189    HB3  ALA  23          3HB       ALA  23   7.535  26.905  12.678
  190    H    THR  24           H        THR  24   4.782  25.840  13.965
  191    HA   THR  24           HA       THR  24   4.432  28.292  15.207
  192    HB   THR  24           HB       THR  24   2.292  26.206  15.426
  193    HG1  THR  24           HG1      THR  24   1.854  26.915  13.129
  194   HG21  THR  24          1HG2      THR  24   0.954  28.214  14.577
  195   HG22  THR  24          2HG2      THR  24   2.408  29.163  14.886
  196   HG23  THR  24          3HG2      THR  24   1.609  28.317  16.211
  197    H    ALA  25           H        ALA  25   4.246  25.039  16.605
  198    HA   ALA  25           HA       ALA  25   3.463  25.851  19.195
  199    HB1  ALA  25          1HB       ALA  25   3.878  23.635  19.874
  200    HB2  ALA  25          2HB       ALA  25   3.339  23.522  18.198
  201    HB3  ALA  25          3HB       ALA  25   5.053  23.375  18.584
  202    H    SER  26           H        SER  26   6.660  24.779  18.017
  203    HA   SER  26           HA       SER  26   8.096  25.356  20.327
  204    HB2  SER  26          2HB       SER  26   9.108  24.037  18.589
  205    HB3  SER  26          3HB       SER  26   8.972  25.361  17.432
  206    HG   SER  26           HG       SER  26  10.805  24.963  19.479
  207    H    SER  27           H        SER  27   6.962  27.458  17.796
  208    HA   SER  27           HA       SER  27   8.639  29.664  18.225
  209    HB2  SER  27          2HB       SER  27   6.082  29.155  16.868
  210    HB3  SER  27          3HB       SER  27   6.268  30.808  17.454
  211    HG   SER  27           HG       SER  27   7.348  29.707  15.300
  212    H    GLN  28           H        GLN  28   5.491  28.840  19.644
  213    HA   GLN  28           HA       GLN  28   6.044  30.796  21.775
  214    HB2  GLN  28          2HB       GLN  28   3.538  30.280  20.231
  215    HB3  GLN  28          3HB       GLN  28   3.410  30.784  21.911
  216    HG2  GLN  28          2HG       GLN  28   5.213  32.374  20.203
  217    HG3  GLN  28          3HG       GLN  28   3.489  32.491  19.854
  218   HE21  GLN  28          1HE2      GLN  28   6.017  33.539  21.816
  219   HE22  GLN  28          2HE2      GLN  28   5.086  34.409  22.982
  220    H    VAL  29           H        VAL  29   3.513  28.345  21.324
  221    HA   VAL  29           HA       VAL  29   4.562  26.401  23.039
  222    HB   VAL  29           HB       VAL  29   4.359  27.990  24.836
  223   HG11  VAL  29          1HG1      VAL  29   2.786  29.556  24.902
  224   HG12  VAL  29          2HG1      VAL  29   2.113  28.895  23.410
  225   HG13  VAL  29          3HG1      VAL  29   1.518  28.333  24.973
  226   HG21  VAL  29          1HG2      VAL  29   2.103  25.990  24.950
  227   HG22  VAL  29          2HG2      VAL  29   3.792  25.664  25.337
  228   HG23  VAL  29          3HG2      VAL  29   2.859  26.778  26.335
  229    H    LEU  30           H        LEU  30   1.747  28.003  21.719
  230    HA   LEU  30           HA       LEU  30  -0.126  27.189  20.713
  231    HB2  LEU  30          2HB       LEU  30   1.696  25.442  19.969
  232    HB3  LEU  30          3HB       LEU  30   0.790  24.373  21.038
  233    HG   LEU  30           HG       LEU  30  -1.162  25.513  19.439
  234   HD11  LEU  30          1HD1      LEU  30  -0.406  25.947  17.391
  235   HD12  LEU  30          2HD1      LEU  30   0.607  24.504  17.370
  236   HD13  LEU  30          3HD1      LEU  30   1.206  25.990  18.107
  237   HD21  LEU  30          1HD2      LEU  30  -0.637  23.096  20.269
  238   HD22  LEU  30          2HD2      LEU  30   0.138  22.930  18.693
  239   HD23  LEU  30          3HD2      LEU  30  -1.575  23.341  18.795
  240    H    ILE  31           H        ILE  31  -1.343  27.823  22.545
  241    HA   ILE  31           HA       ILE  31  -2.495  25.550  23.978
  242    HB   ILE  31           HB       ILE  31  -2.496  26.824  26.109
  243   HG12  ILE  31          2HG1      ILE  31  -0.315  28.556  25.733
  244   HG13  ILE  31          3HG1      ILE  31  -1.402  28.868  24.383
  245   HG21  ILE  31          1HG2      ILE  31   0.006  26.544  26.526
  246   HG22  ILE  31          2HG2      ILE  31  -0.887  25.127  25.977
  247   HG23  ILE  31          3HG2      ILE  31   0.107  26.037  24.840
  248   HD11  ILE  31          1HD1      ILE  31  -1.843  29.254  27.301
  249   HD12  ILE  31          2HD1      ILE  31  -2.169  30.347  25.955
  250   HD13  ILE  31          3HD1      ILE  31  -3.222  28.962  26.241
  251    HA   PRO  32           HA       PRO  32  -6.321  27.557  23.195
  252    HB2  PRO  32          2HB       PRO  32  -7.791  26.712  25.315
  253    HB3  PRO  32          3HB       PRO  32  -7.339  25.651  23.975
  254    HG2  PRO  32          2HG       PRO  32  -6.083  25.929  26.678
  255    HG3  PRO  32          3HG       PRO  32  -6.444  24.457  25.758
  256    HD2  PRO  32          2HD       PRO  32  -3.962  25.535  25.867
  257    HD3  PRO  32          3HD       PRO  32  -4.565  24.670  24.439
  258    H    GLU  33           H        GLU  33  -6.075  29.748  23.381
  259    HA   GLU  33           HA       GLU  33  -6.222  30.904  26.083
  260    HB2  GLU  33          2HB       GLU  33  -4.733  31.612  23.675
  261    HB3  GLU  33          3HB       GLU  33  -5.610  32.977  24.352
  262    HG2  GLU  33          2HG       GLU  33  -4.203  31.432  26.371
  263    HG3  GLU  33          3HG       GLU  33  -3.132  32.088  25.134
  264    H    ILE  34           H        ILE  34  -7.072  32.175  22.874
  265    HA   ILE  34           HA       ILE  34  -9.856  32.124  23.207
  266    HB   ILE  34           HB       ILE  34  -9.537  33.711  25.004
  267   HG12  ILE  34          2HG1      ILE  34 -10.556  35.071  22.500
  268   HG13  ILE  34          3HG1      ILE  34 -11.493  34.015  23.551
  269   HG21  ILE  34          1HG2      ILE  34  -8.430  35.823  24.731
  270   HG22  ILE  34          2HG2      ILE  34  -7.327  34.542  24.231
  271   HG23  ILE  34          3HG2      ILE  34  -8.162  35.510  23.016
  272   HD11  ILE  34          1HD1      ILE  34 -10.554  36.802  24.018
  273   HD12  ILE  34          2HD1      ILE  34 -12.154  36.097  24.249
  274   HD13  ILE  34          3HD1      ILE  34 -10.859  35.737  25.390
  275    H    ASN  35           H        ASN  35  -7.093  33.866  21.876
  276    HA   ASN  35           HA       ASN  35  -8.519  34.003  19.304
  277    HB2  ASN  35          2HB       ASN  35  -7.850  36.205  20.791
  278    HB3  ASN  35          3HB       ASN  35  -6.456  36.055  19.725
  279   HD21  ASN  35          1HD2      ASN  35  -8.425  38.139  19.761
  280   HD22  ASN  35          2HD2      ASN  35  -9.186  38.140  18.210
  281    H    LEU  36           H        LEU  36  -6.818  31.904  20.172
  282    HA   LEU  36           HA       LEU  36  -4.484  32.298  18.416
  283    HB2  LEU  36          2HB       LEU  36  -3.612  31.935  20.548
  284    HB3  LEU  36          3HB       LEU  36  -4.834  30.729  20.943
  285    HG   LEU  36           HG       LEU  36  -2.924  30.086  18.761
  286   HD11  LEU  36          1HD1      LEU  36  -1.962  29.388  21.441
  287   HD12  LEU  36          2HD1      LEU  36  -1.857  31.102  21.042
  288   HD13  LEU  36          3HD1      LEU  36  -1.072  29.908  20.010
  289   HD21  LEU  36          1HD2      LEU  36  -4.599  28.689  20.765
  290   HD22  LEU  36          2HD2      LEU  36  -3.089  27.909  20.294
  291   HD23  LEU  36          3HD2      LEU  36  -4.297  28.306  19.070
  292    H    ASN  37           H        ASN  37  -7.368  30.575  18.933
  293    HA   ASN  37           HA       ASN  37  -6.672  28.171  17.555
  294    HB2  ASN  37          2HB       ASN  37  -9.096  29.347  18.744
  295    HB3  ASN  37          3HB       ASN  37  -9.393  28.312  17.350
  296   HD21  ASN  37          1HD2      ASN  37  -7.942  28.455  20.540
  297   HD22  ASN  37          2HD2      ASN  37  -8.012  26.758  20.853
  298    H    ASP  38           H        ASP  38  -8.494  31.088  16.652
  299    HA   ASP  38           HA       ASP  38  -9.116  30.363  14.034
  300    HB2  ASP  38          2HB       ASP  38  -9.216  32.748  15.640
  301    HB3  ASP  38          3HB       ASP  38  -8.633  33.144  14.025
  302    H    THR  39           H        THR  39  -6.339  32.248  15.224
  303    HA   THR  39           HA       THR  39  -5.078  32.659  12.776
  304    HB   THR  39           HB       THR  39  -3.161  32.189  14.913
  305    HG1  THR  39           HG1      THR  39  -4.186  33.099  16.518
  306   HG21  THR  39          1HG2      THR  39  -2.906  34.736  14.508
  307   HG22  THR  39          2HG2      THR  39  -4.020  34.470  13.167
  308   HG23  THR  39          3HG2      THR  39  -2.474  33.622  13.212
  309    H    PHE  40           H        PHE  40  -4.529  30.058  15.149
  310    HA   PHE  40           HA       PHE  40  -2.579  28.676  13.696
  311    HB2  PHE  40          2HB       PHE  40  -3.294  28.339  16.131
  312    HB3  PHE  40          3HB       PHE  40  -4.594  27.337  15.494
  313    HD1  PHE  40           HD1      PHE  40  -1.037  27.631  14.443
  314    HD2  PHE  40           HD2      PHE  40  -4.090  25.164  16.088
  315    HE1  PHE  40           HE1      PHE  40   0.489  25.702  14.375
  316    HE2  PHE  40           HE2      PHE  40  -2.569  23.231  16.023
  317    HZ   PHE  40           HZ       PHE  40  -0.275  23.499  15.167
  318    H    ASP  41           H        ASP  41  -6.104  28.352  13.712
  319    HA   ASP  41           HA       ASP  41  -6.324  26.112  12.064
  320    HB2  ASP  41          2HB       ASP  41  -8.119  27.564  13.382
  321    HB3  ASP  41          3HB       ASP  41  -8.333  28.300  11.796
  322    H    THR  42           H        THR  42  -6.758  29.514  11.075
  323    HA   THR  42           HA       THR  42  -6.827  29.079   8.335
  324    HB   THR  42           HB       THR  42  -7.130  31.278   9.818
  325    HG1  THR  42           HG1      THR  42  -6.301  31.213   7.089
  326   HG21  THR  42          1HG2      THR  42  -4.503  31.850   8.475
  327   HG22  THR  42          2HG2      THR  42  -4.584  31.306  10.151
  328   HG23  THR  42          3HG2      THR  42  -5.363  32.814   9.674
  329    H    PHE  43           H        PHE  43  -4.130  29.094  10.508
  330    HA   PHE  43           HA       PHE  43  -2.103  29.513   8.543
  331    HB2  PHE  43          2HB       PHE  43  -1.866  29.894  11.038
  332    HB3  PHE  43          3HB       PHE  43  -1.765  28.145  11.213
  333    HD1  PHE  43           HD1      PHE  43   0.419  27.829  11.959
  334    HD2  PHE  43           HD2      PHE  43  -0.304  30.255   8.537
  335    HE1  PHE  43           HE1      PHE  43   2.839  27.926  11.520
  336    HE2  PHE  43           HE2      PHE  43   2.114  30.354   8.092
  337    HZ   PHE  43           HZ       PHE  43   3.688  29.188   9.584
  338    H    ALA  44           H        ALA  44  -2.996  26.599  10.401
  339    HA   ALA  44           HA       ALA  44  -1.452  24.785   8.965
  340    HB1  ALA  44          1HB       ALA  44  -2.206  23.664  10.747
  341    HB2  ALA  44          2HB       ALA  44  -3.672  24.640  10.858
  342    HB3  ALA  44          3HB       ALA  44  -3.600  23.279   9.738
  343    H    LEU  45           H        LEU  45  -4.841  25.734   8.465
  344    HA   LEU  45           HA       LEU  45  -5.597  24.046   6.462
  345    HB2  LEU  45          2HB       LEU  45  -7.284  25.450   7.080
  346    HB3  LEU  45          3HB       LEU  45  -6.236  26.867   7.119
  347    HG   LEU  45           HG       LEU  45  -6.331  27.043   4.705
  348   HD11  LEU  45          1HD1      LEU  45  -8.253  25.430   3.741
  349   HD12  LEU  45          2HD1      LEU  45  -7.534  24.364   4.947
  350   HD13  LEU  45          3HD1      LEU  45  -6.532  25.052   3.670
  351   HD21  LEU  45          1HD2      LEU  45  -8.973  26.788   6.116
  352   HD22  LEU  45          2HD2      LEU  45  -8.830  27.394   4.466
  353   HD23  LEU  45          3HD2      LEU  45  -8.041  28.249   5.792
  354    H    ASP  46           H        ASP  46  -4.137  27.252   5.882
  355    HA   ASP  46           HA       ASP  46  -3.818  27.104   3.161
  356    HB2  ASP  46          2HB       ASP  46  -3.027  28.858   5.127
  357    HB3  ASP  46          3HB       ASP  46  -1.488  28.277   4.499
  358    H    PHE  47           H        PHE  47  -1.571  25.926   5.646
  359    HA   PHE  47           HA       PHE  47   0.457  25.038   3.950
  360    HB2  PHE  47          2HB       PHE  47  -0.314  24.637   6.738
  361    HB3  PHE  47          3HB       PHE  47   0.477  23.226   6.043
  362    HD1  PHE  47           HD1      PHE  47   2.643  23.831   4.608
  363    HD2  PHE  47           HD2      PHE  47   1.016  26.203   7.746
  364    HE1  PHE  47           HE1      PHE  47   4.836  24.897   4.935
  365    HE2  PHE  47           HE2      PHE  47   3.206  27.273   8.077
  366    HZ   PHE  47           HZ       PHE  47   5.120  26.622   6.670
  367    H    SER  48           H        SER  48  -2.278  23.208   5.310
  368    HA   SER  48           HA       SER  48  -1.764  20.745   4.174
  369    HB2  SER  48          2HB       SER  48  -3.683  21.584   5.786
  370    HB3  SER  48          3HB       SER  48  -4.595  21.708   4.281
  371    HG   SER  48           HG       SER  48  -4.917  19.663   5.042
  372    H    ARG  49           H        ARG  49  -3.558  23.473   2.786
  373    HA   ARG  49           HA       ARG  49  -4.486  22.360   0.458
  374    HB2  ARG  49          2HB       ARG  49  -5.078  24.608   0.995
  375    HB3  ARG  49          3HB       ARG  49  -3.397  25.123   0.978
  376    HG2  ARG  49          2HG       ARG  49  -4.509  25.910  -1.003
  377    HG3  ARG  49          3HG       ARG  49  -3.313  24.689  -1.443
  378    HD2  ARG  49          2HD       ARG  49  -4.870  23.350  -2.312
  379    HD3  ARG  49          3HD       ARG  49  -5.906  23.519  -0.895
  380    HE   ARG  49           HE       ARG  49  -6.116  25.874  -2.353
  381   HH11  ARG  49          1HH1      ARG  49  -8.175  22.773  -3.828
  382   HH12  ARG  49          2HH1      ARG  49  -6.844  22.493  -2.756
  383   HH21  ARG  49          1HH2      ARG  49  -8.756  24.914  -4.402
  384   HH22  ARG  49          2HH2      ARG  49  -7.867  26.256  -3.764
  385    H    GLU  50           H        GLU  50  -1.242  23.624   1.103
  386    HA   GLU  50           HA       GLU  50  -0.261  23.228  -1.531
  387    HB2  GLU  50          2HB       GLU  50   0.743  24.755   0.196
  388    HB3  GLU  50          3HB       GLU  50   1.351  23.327   1.021
  389    HG2  GLU  50          2HG       GLU  50   2.652  22.737  -0.963
  390    HG3  GLU  50          3HG       GLU  50   2.052  24.180  -1.779
  391    H    LYS  51           H        LYS  51  -0.399  21.225   1.344
  392    HA   LYS  51           HA       LYS  51   1.379  19.206   0.543
  393    HB2  LYS  51          2HB       LYS  51   0.857  18.959   2.754
  394    HB3  LYS  51          3HB       LYS  51  -0.815  19.453   2.526
  395    HG2  LYS  51          2HG       LYS  51  -0.129  16.897   1.274
  396    HG3  LYS  51          3HG       LYS  51   0.006  16.917   3.033
  397    HD2  LYS  51          2HD       LYS  51  -2.235  17.260   3.338
  398    HD3  LYS  51          3HD       LYS  51  -2.423  18.112   1.803
  399    HE2  LYS  51          2HE       LYS  51  -3.505  15.851   1.907
  400    HE3  LYS  51          3HE       LYS  51  -2.373  16.078   0.574
  401    HZ1  LYS  51          1HZ       LYS  51  -2.334  13.986   2.237
  402    HZ2  LYS  51          2HZ       LYS  51  -1.215  15.000   2.998
  403    HZ3  LYS  51          3HZ       LYS  51  -0.980  14.540   1.387
  404    H    LYS  52           H        LYS  52  -2.148  19.463   0.168
  405    HA   LYS  52           HA       LYS  52  -2.585  17.023  -1.105
  406    HB2  LYS  52          2HB       LYS  52  -4.442  18.320  -0.297
  407    HB3  LYS  52          3HB       LYS  52  -4.036  19.660  -1.362
  408    HG2  LYS  52          2HG       LYS  52  -5.913  18.524  -2.284
  409    HG3  LYS  52          3HG       LYS  52  -4.514  18.175  -3.303
  410    HD2  LYS  52          2HD       LYS  52  -5.480  16.086  -3.077
  411    HD3  LYS  52          3HD       LYS  52  -4.273  16.071  -1.789
  412    HE2  LYS  52          2HE       LYS  52  -5.843  16.214  -0.131
  413    HE3  LYS  52          3HE       LYS  52  -6.997  17.075  -1.148
  414    HZ1  LYS  52          1HZ       LYS  52  -7.918  14.975  -0.892
  415    HZ2  LYS  52          2HZ       LYS  52  -6.435  14.179  -1.051
  416    HZ3  LYS  52          3HZ       LYS  52  -7.169  14.877  -2.406
  417    H    LEU  53           H        LEU  53  -1.961  20.220  -2.542
  418    HA   LEU  53           HA       LEU  53  -2.092  19.525  -5.216
  419    HB2  LEU  53          2HB       LEU  53  -1.803  21.822  -4.187
  420    HB3  LEU  53          3HB       LEU  53  -0.082  21.455  -4.084
  421    HG   LEU  53           HG       LEU  53  -0.356  21.014  -6.665
  422   HD11  LEU  53          1HD1      LEU  53  -1.981  22.926  -7.431
  423   HD12  LEU  53          2HD1      LEU  53  -2.790  22.555  -5.909
  424   HD13  LEU  53          3HD1      LEU  53  -2.581  21.296  -7.127
  425   HD21  LEU  53          1HD2      LEU  53  -0.114  23.651  -6.869
  426   HD22  LEU  53          2HD2      LEU  53   1.164  22.639  -6.194
  427   HD23  LEU  53          3HD2      LEU  53   0.068  23.511  -5.121
  428    H    LEU  54           H        LEU  54   0.395  18.866  -2.879
  429    HA   LEU  54           HA       LEU  54   2.332  18.067  -4.881
  430    HB2  LEU  54          2HB       LEU  54   3.062  19.148  -2.812
  431    HB3  LEU  54          3HB       LEU  54   2.384  17.817  -1.876
  432    HG   LEU  54           HG       LEU  54   4.927  17.889  -2.273
  433   HD11  LEU  54          1HD1      LEU  54   4.876  15.762  -1.621
  434   HD12  LEU  54          2HD1      LEU  54   4.125  15.235  -3.126
  435   HD13  LEU  54          3HD1      LEU  54   3.125  15.849  -1.810
  436   HD21  LEU  54          1HD2      LEU  54   4.400  16.403  -4.780
  437   HD22  LEU  54          2HD2      LEU  54   5.798  17.367  -4.303
  438   HD23  LEU  54          3HD2      LEU  54   4.323  18.163  -4.854
  439    H    GLU  55           H        GLU  55  -0.164  16.631  -2.992
  440    HA   GLU  55           HA       GLU  55   0.793  13.941  -3.713
  441    HB2  GLU  55          2HB       GLU  55   0.346  14.590  -1.254
  442    HB3  GLU  55          3HB       GLU  55  -1.356  14.506  -1.687
  443    HG2  GLU  55          2HG       GLU  55  -0.138  12.148  -2.643
  444    HG3  GLU  55          3HG       GLU  55   0.423  12.399  -0.991
  445    H    CYS  56           H        CYS  56  -0.762  15.951  -5.337
  446    HA   CYS  56           HA       CYS  56  -2.754  14.070  -6.300
  447    HB2  CYS  56          2HB       CYS  56  -3.662  15.898  -4.549
  448    HB3  CYS  56          3HB       CYS  56  -3.763  16.848  -6.027
  449    HG   CYS  56           HG       CYS  56  -6.104  15.965  -6.572
  450    H    LEU  57           H        LEU  57  -2.968  14.131  -8.469
  451    HA   LEU  57           HA       LEU  57  -2.483  14.630 -10.635
  452    HB2  LEU  57          2HB       LEU  57  -2.480  17.515  -9.802
  453    HB3  LEU  57          3HB       LEU  57  -2.928  16.827 -11.361
  454    HG   LEU  57           HG       LEU  57  -4.504  16.543  -8.803
  455   HD11  LEU  57          1HD1      LEU  57  -4.442  18.586 -10.873
  456   HD12  LEU  57          2HD1      LEU  57  -5.195  18.608  -9.279
  457   HD13  LEU  57          3HD1      LEU  57  -6.043  17.882 -10.645
  458   HD21  LEU  57          1HD2      LEU  57  -6.239  15.841 -10.649
  459   HD22  LEU  57          2HD2      LEU  57  -5.111  14.668  -9.968
  460   HD23  LEU  57          3HD2      LEU  57  -4.781  15.401 -11.539
  461    H    ASP  58           H        ASP  58  -0.994  16.437 -11.944
  462    HA   ASP  58           HA       ASP  58   1.577  16.726 -10.617
  463    HB2  ASP  58          2HB       ASP  58   2.707  15.625 -12.632
  464    HB3  ASP  58          3HB       ASP  58   1.934  14.554 -11.467
  465    H    TYR  59           H        TYR  59   3.144  17.931 -11.986
  466    HA   TYR  59           HA       TYR  59   3.698  19.763 -13.212
  467    HB2  TYR  59          2HB       TYR  59   1.690  18.364 -14.874
  468    HB3  TYR  59          3HB       TYR  59   1.981  20.050 -15.285
  469    HD1  TYR  59           HD1      TYR  59   3.794  16.853 -14.652
  470    HD2  TYR  59           HD2      TYR  59   3.769  20.603 -16.663
  471    HE1  TYR  59           HE1      TYR  59   5.814  16.195 -15.891
  472    HE2  TYR  59           HE2      TYR  59   5.788  19.954 -17.910
  473    HH   TYR  59           HH       TYR  59   7.034  16.724 -17.837
  474    H    LEU  60           H        LEU  60   3.093  21.121 -11.445
  475    HA   LEU  60           HA       LEU  60   0.474  22.414 -11.643
  476    HB2  LEU  60          2HB       LEU  60   0.806  23.205  -9.453
  477    HB3  LEU  60          3HB       LEU  60   1.364  21.533  -9.457
  478    HG   LEU  60           HG       LEU  60   3.616  23.148  -9.996
  479   HD11  LEU  60          1HD1      LEU  60   3.701  24.652  -8.136
  480   HD12  LEU  60          2HD1      LEU  60   2.124  24.110  -7.562
  481   HD13  LEU  60          3HD1      LEU  60   2.250  25.011  -9.073
  482   HD21  LEU  60          1HD2      LEU  60   2.837  21.805  -7.413
  483   HD22  LEU  60          2HD2      LEU  60   4.466  22.158  -7.991
  484   HD23  LEU  60          3HD2      LEU  60   3.477  20.953  -8.819
  Start of MODEL    6
    1    H    LEU   1           H        LEU   1   9.196  -0.545   1.745
    2    HA   LEU   1           HA       LEU   1   7.496   1.582   0.778
    3    HB2  LEU   1          2HB       LEU   1   9.509   2.268   2.898
    4    HB3  LEU   1          3HB       LEU   1   8.257   3.297   2.205
    5    HG   LEU   1           HG       LEU   1   7.644   0.894   3.914
    6   HD11  LEU   1          1HD1      LEU   1   7.313   2.462   5.762
    7   HD12  LEU   1          2HD1      LEU   1   7.931   3.774   4.759
    8   HD13  LEU   1          3HD1      LEU   1   8.992   2.443   5.219
    9   HD21  LEU   1          1HD2      LEU   1   5.861   3.242   3.703
   10   HD22  LEU   1          2HD2      LEU   1   5.473   1.524   3.800
   11   HD23  LEU   1          3HD2      LEU   1   6.001   2.224   2.269
   12    H    LYS   2           H        LYS   2   8.955   0.202  -0.862
   13    HA   LYS   2           HA       LYS   2  11.218   1.962  -1.494
   14    HB2  LYS   2          2HB       LYS   2  11.238  -1.023  -1.253
   15    HB3  LYS   2          3HB       LYS   2  12.295  -0.244  -2.423
   16    HG2  LYS   2          2HG       LYS   2  13.430   0.961  -0.713
   17    HG3  LYS   2          3HG       LYS   2  12.250   0.462   0.501
   18    HD2  LYS   2          2HD       LYS   2  13.316  -1.465   0.868
   19    HD3  LYS   2          3HD       LYS   2  13.438  -1.809  -0.859
   20    HE2  LYS   2          2HE       LYS   2  15.645  -1.548  -0.504
   21    HE3  LYS   2          3HE       LYS   2  15.264   0.170  -0.613
   22    HZ1  LYS   2          1HZ       LYS   2  14.794  -0.647   2.014
   23    HZ2  LYS   2          2HZ       LYS   2  15.986   0.411   1.450
   24    HZ3  LYS   2          3HZ       LYS   2  16.313  -1.244   1.569
   25    H    GLU   3           H        GLU   3  11.370   2.535  -3.597
   26    HA   GLU   3           HA       GLU   3  10.715   2.872  -5.752
   27    HB2  GLU   3          2HB       GLU   3  10.214  -0.109  -5.685
   28    HB3  GLU   3          3HB       GLU   3  10.417   0.874  -7.128
   29    HG2  GLU   3          2HG       GLU   3  12.657   0.956  -6.928
   30    HG3  GLU   3          3HG       GLU   3  12.608   1.006  -5.167
   31    H    ASN   4           H        ASN   4   8.878   4.104  -5.046
   32    HA   ASN   4           HA       ASN   4   6.398   3.005  -6.040
   33    HB2  ASN   4          2HB       ASN   4   6.828   3.624  -3.135
   34    HB3  ASN   4          3HB       ASN   4   5.237   3.850  -3.856
   35   HD21  ASN   4          1HD2      ASN   4   7.209   1.717  -2.291
   36   HD22  ASN   4          2HD2      ASN   4   6.408   0.242  -2.699
   37    H    ASP   5           H        ASP   5   4.674   4.664  -6.132
   38    HA   ASP   5           HA       ASP   5   5.857   7.334  -6.495
   39    HB2  ASP   5          2HB       ASP   5   3.450   6.065  -7.816
   40    HB3  ASP   5          3HB       ASP   5   3.955   7.735  -8.060
   41    H    HIS   6           H        HIS   6   2.696   5.871  -5.713
   42    HA   HIS   6           HA       HIS   6   1.537   8.136  -4.587
   43    HB2  HIS   6          2HB       HIS   6   0.367   5.990  -5.193
   44    HB3  HIS   6          3HB       HIS   6   1.013   5.291  -3.711
   45    HD1  HIS   6           HD1      HIS   6  -0.613   5.340  -1.864
   46    HD2  HIS   6           HD2      HIS   6  -1.146   8.541  -4.459
   47    HE1  HIS   6           HE1      HIS   6  -2.577   6.623  -0.956
   48    H    ALA   7           H        ALA   7   3.843   5.898  -3.269
   49    HA   ALA   7           HA       ALA   7   3.466   6.488  -0.526
   50    HB1  ALA   7          1HB       ALA   7   5.386   5.236  -0.124
   51    HB2  ALA   7          2HB       ALA   7   4.742   4.533  -1.609
   52    HB3  ALA   7          3HB       ALA   7   6.102   5.654  -1.681
   53    H    ARG   8           H        ARG   8   6.025   7.570  -2.771
   54    HA   ARG   8           HA       ARG   8   7.222   9.415  -1.068
   55    HB2  ARG   8          2HB       ARG   8   8.322   8.738  -3.098
   56    HB3  ARG   8          3HB       ARG   8   7.015   9.387  -4.080
   57    HG2  ARG   8          2HG       ARG   8   7.943  11.400  -4.123
   58    HG3  ARG   8          3HG       ARG   8   8.138  11.419  -2.369
   59    HD2  ARG   8          2HD       ARG   8  10.204  10.179  -2.547
   60    HD3  ARG   8          3HD       ARG   8   9.988  10.011  -4.289
   61    HE   ARG   8           HE       ARG   8  10.015  12.744  -3.501
   62   HH11  ARG   8          1HH1      ARG   8  13.457  10.957  -4.497
   63   HH12  ARG   8          2HH1      ARG   8  12.072   9.998  -4.092
   64   HH21  ARG   8          1HH2      ARG   8  13.319  13.244  -4.462
   65   HH22  ARG   8          2HH2      ARG   8  11.831  14.018  -4.032
   66    H    PHE   9           H        PHE   9   4.608   9.884  -3.422
   67    HA   PHE   9           HA       PHE   9   4.310  12.639  -3.174
   68    HB2  PHE   9          2HB       PHE   9   2.661  10.402  -4.135
   69    HB3  PHE   9          3HB       PHE   9   1.738  11.795  -3.583
   70    HD1  PHE   9           HD1      PHE   9   3.024  14.109  -4.411
   71    HD2  PHE   9           HD2      PHE   9   2.941  10.347  -6.400
   72    HE1  PHE   9           HE1      PHE   9   3.443  15.238  -6.557
   73    HE2  PHE   9           HE2      PHE   9   3.361  11.469  -8.548
   74    HZ   PHE   9           HZ       PHE   9   3.614  13.918  -8.629
   75    H    LEU  10           H        LEU  10   2.993  10.023  -1.209
   76    HA   LEU  10           HA       LEU  10   1.322  11.684   0.388
   77    HB2  LEU  10          2HB       LEU  10   1.623   8.987   0.032
   78    HB3  LEU  10          3HB       LEU  10   2.308   9.228   1.638
   79    HG   LEU  10           HG       LEU  10  -0.100  10.622   1.690
   80   HD11  LEU  10          1HD1      LEU  10  -1.176   9.744  -0.113
   81   HD12  LEU  10          2HD1      LEU  10  -1.566   8.507   1.081
   82   HD13  LEU  10          3HD1      LEU  10  -0.259   8.238  -0.071
   83   HD21  LEU  10          1HD2      LEU  10   0.803   9.404   3.549
   84   HD22  LEU  10          2HD2      LEU  10   0.644   7.875   2.684
   85   HD23  LEU  10          3HD2      LEU  10  -0.798   8.761   3.182
   86    H    GLN  11           H        GLN  11   4.538  10.259   0.893
   87    HA   GLN  11           HA       GLN  11   5.016  11.133   3.473
   88    HB2  GLN  11          2HB       GLN  11   6.668  10.319   1.179
   89    HB3  GLN  11          3HB       GLN  11   7.489  11.357   2.337
   90    HG2  GLN  11          2HG       GLN  11   6.424   9.646   4.056
   91    HG3  GLN  11          3HG       GLN  11   6.479   8.591   2.645
   92   HE21  GLN  11          1HE2      GLN  11   7.977   8.542   5.189
   93   HE22  GLN  11          2HE2      GLN  11   9.644   8.535   4.740
   94    H    THR  12           H        THR  12   5.021  12.926   0.496
   95    HA   THR  12           HA       THR  12   6.420  15.207   1.522
   96    HB   THR  12           HB       THR  12   4.698  14.884  -0.942
   97    HG1  THR  12           HG1      THR  12   6.616  14.584  -1.974
   98   HG21  THR  12          1HG2      THR  12   4.614  17.156  -0.753
   99   HG22  THR  12          2HG2      THR  12   6.194  17.012  -1.523
  100   HG23  THR  12          3HG2      THR  12   6.081  17.239   0.221
  101    H    ALA  13           H        ALA  13   3.015  14.699   0.574
  102    HA   ALA  13           HA       ALA  13   1.986  17.099   1.486
  103    HB1  ALA  13          1HB       ALA  13  -0.078  15.387   1.964
  104    HB2  ALA  13          2HB       ALA  13   0.325  16.069   0.388
  105    HB3  ALA  13          3HB       ALA  13   0.901  14.461   0.826
  106    H    LYS  14           H        LYS  14   2.683  14.149   3.273
  107    HA   LYS  14           HA       LYS  14   1.457  15.072   5.703
  108    HB2  LYS  14          2HB       LYS  14   2.166  12.612   4.762
  109    HB3  LYS  14          3HB       LYS  14   3.476  12.934   5.890
  110    HG2  LYS  14          2HG       LYS  14   1.446  13.603   7.462
  111    HG3  LYS  14          3HG       LYS  14   0.595  12.477   6.401
  112    HD2  LYS  14          2HD       LYS  14   2.723  10.980   6.881
  113    HD3  LYS  14          3HD       LYS  14   2.801  11.977   8.336
  114    HE2  LYS  14          2HE       LYS  14   0.497  11.360   8.879
  115    HE3  LYS  14          3HE       LYS  14   0.415  10.371   7.422
  116    HZ1  LYS  14          1HZ       LYS  14   1.624   8.738   8.356
  117    HZ2  LYS  14          2HZ       LYS  14   1.073   9.410   9.807
  118    HZ3  LYS  14          3HZ       LYS  14   2.615   9.795   9.229
  119    H    ASN  15           H        ASN  15   4.682  15.049   4.324
  120    HA   ASN  15           HA       ASN  15   6.049  15.797   6.704
  121    HB2  ASN  15          2HB       ASN  15   7.286  14.750   4.920
  122    HB3  ASN  15          3HB       ASN  15   6.822  16.017   3.789
  123   HD21  ASN  15          1HD2      ASN  15   7.890  17.950   3.805
  124   HD22  ASN  15          2HD2      ASN  15   9.319  18.234   4.733
  125    H    ILE  16           H        ILE  16   4.118  17.506   4.462
  126    HA   ILE  16           HA       ILE  16   5.296  20.094   4.940
  127    HB   ILE  16           HB       ILE  16   2.679  19.359   3.623
  128   HG12  ILE  16          2HG1      ILE  16   4.999  20.420   2.100
  129   HG13  ILE  16          3HG1      ILE  16   5.117  18.760   2.673
  130   HG21  ILE  16          1HG2      ILE  16   2.755  21.649   2.709
  131   HG22  ILE  16          2HG2      ILE  16   2.599  21.622   4.465
  132   HG23  ILE  16          3HG2      ILE  16   4.158  21.984   3.724
  133   HD11  ILE  16          1HD1      ILE  16   3.752  19.766   0.404
  134   HD12  ILE  16          2HD1      ILE  16   3.907  18.096   0.952
  135   HD13  ILE  16          3HD1      ILE  16   2.560  19.087   1.513
  136    H    THR  17           H        THR  17   2.269  18.464   5.854
  137    HA   THR  17           HA       THR  17   1.442  20.614   7.566
  138    HB   THR  17           HB       THR  17   0.222  17.954   7.976
  139    HG1  THR  17           HG1      THR  17  -0.196  17.594   5.940
  140   HG21  THR  17          1HG2      THR  17  -1.280  19.376   8.824
  141   HG22  THR  17          2HG2      THR  17  -1.682  19.808   7.162
  142   HG23  THR  17          3HG2      THR  17  -0.500  20.761   8.060
  143    H    GLU  18           H        GLU  18   3.474  17.882   7.896
  144    HA   GLU  18           HA       GLU  18   3.154  17.622  10.754
  145    HB2  GLU  18          2HB       GLU  18   3.708  15.661   9.397
  146    HB3  GLU  18          3HB       GLU  18   5.202  16.428   8.878
  147    HG2  GLU  18          2HG       GLU  18   6.283  15.808  10.717
  148    HG3  GLU  18          3HG       GLU  18   4.960  16.312  11.767
  149    H    ARG  19           H        ARG  19   5.333  19.208   8.520
  150    HA   ARG  19           HA       ARG  19   7.298  19.875  10.496
  151    HB2  ARG  19          2HB       ARG  19   7.536  19.702   7.900
  152    HB3  ARG  19          3HB       ARG  19   6.975  21.369   7.918
  153    HG2  ARG  19          2HG       ARG  19   8.986  21.263   9.843
  154    HG3  ARG  19          3HG       ARG  19   9.586  20.306   8.488
  155    HD2  ARG  19          2HD       ARG  19   9.134  22.163   6.969
  156    HD3  ARG  19          3HD       ARG  19   8.507  23.117   8.313
  157    HE   ARG  19           HE       ARG  19  11.028  22.447   9.092
  158   HH11  ARG  19          1HH1      ARG  19  11.067  24.985   5.997
  159   HH12  ARG  19          2HH1      ARG  19   9.668  24.006   6.292
  160   HH21  ARG  19          1HH2      ARG  19  12.891  24.827   7.374
  161   HH22  ARG  19          2HH2      ARG  19  12.875  23.731   8.714
  162    H    VAL  20           H        VAL  20   4.458  21.422   9.141
  163    HA   VAL  20           HA       VAL  20   4.957  24.006  10.233
  164    HB   VAL  20           HB       VAL  20   3.454  23.729   8.335
  165   HG11  VAL  20          1HG1      VAL  20   1.270  22.701   8.563
  166   HG12  VAL  20          2HG1      VAL  20   2.532  21.537   8.972
  167   HG13  VAL  20          3HG1      VAL  20   1.601  22.317  10.252
  168   HG21  VAL  20          1HG2      VAL  20   3.090  25.697   9.618
  169   HG22  VAL  20          2HG2      VAL  20   1.500  25.038   9.233
  170   HG23  VAL  20          3HG2      VAL  20   2.183  24.810  10.843
  171    H    SER  21           H        SER  21   3.220  21.150  11.339
  172    HA   SER  21           HA       SER  21   1.950  22.351  13.560
  173    HB2  SER  21          2HB       SER  21   2.701  19.480  12.986
  174    HB3  SER  21          3HB       SER  21   1.760  19.973  14.393
  175    HG   SER  21           HG       SER  21   0.125  19.802  13.088
  176    H    MET  22           H        MET  22   4.834  20.253  13.430
  177    HA   MET  22           HA       MET  22   5.561  20.526  16.110
  178    HB2  MET  22          2HB       MET  22   6.528  19.131  13.958
  179    HB3  MET  22          3HB       MET  22   7.814  20.296  14.241
  180    HG2  MET  22          2HG       MET  22   8.548  19.169  15.996
  181    HG3  MET  22          3HG       MET  22   6.942  19.130  16.718
  182    HE1  MET  22          1HE       MET  22   5.300  16.027  15.492
  183    HE2  MET  22          2HE       MET  22   5.106  17.773  15.654
  184    HE3  MET  22          3HE       MET  22   5.469  17.068  14.078
  185    H    ALA  23           H        ALA  23   6.061  22.633  13.385
  186    HA   ALA  23           HA       ALA  23   8.121  24.227  14.519
  187    HB1  ALA  23          1HB       ALA  23   7.073  25.924  12.773
  188    HB2  ALA  23          2HB       ALA  23   8.051  24.546  12.265
  189    HB3  ALA  23          3HB       ALA  23   6.292  24.453  12.193
  190    H    THR  24           H        THR  24   4.677  25.010  13.983
  191    HA   THR  24           HA       THR  24   4.595  27.348  15.462
  192    HB   THR  24           HB       THR  24   2.212  25.564  15.585
  193    HG1  THR  24           HG1      THR  24   2.476  25.120  13.522
  194   HG21  THR  24          1HG2      THR  24   2.819  28.460  15.259
  195   HG22  THR  24          2HG2      THR  24   1.629  27.665  16.289
  196   HG23  THR  24          3HG2      THR  24   1.323  27.841  14.561
  197    H    ALA  25           H        ALA  25   4.161  24.009  16.542
  198    HA   ALA  25           HA       ALA  25   3.332  24.511  19.160
  199    HB1  ALA  25          1HB       ALA  25   3.116  22.304  18.478
  200    HB2  ALA  25          2HB       ALA  25   4.770  22.225  17.868
  201    HB3  ALA  25          3HB       ALA  25   4.470  22.236  19.606
  202    H    SER  26           H        SER  26   6.543  24.477  17.733
  203    HA   SER  26           HA       SER  26   7.744  25.010  20.353
  204    HB2  SER  26          2HB       SER  26   8.612  23.597  18.019
  205    HB3  SER  26          3HB       SER  26   9.729  24.927  18.323
  206    HG   SER  26           HG       SER  26   9.513  24.037  20.634
  207    H    SER  27           H        SER  27   6.292  26.785  18.121
  208    HA   SER  27           HA       SER  27   8.293  28.924  18.015
  209    HB2  SER  27          2HB       SER  27   6.335  27.996  16.187
  210    HB3  SER  27          3HB       SER  27   5.852  29.620  16.676
  211    HG   SER  27           HG       SER  27   7.596  30.436  15.759
  212    H    GLN  28           H        GLN  28   5.094  28.171  19.251
  213    HA   GLN  28           HA       GLN  28   5.214  30.627  20.863
  214    HB2  GLN  28          2HB       GLN  28   3.041  29.671  19.081
  215    HB3  GLN  28          3HB       GLN  28   2.555  30.353  20.627
  216    HG2  GLN  28          2HG       GLN  28   3.637  32.427  20.123
  217    HG3  GLN  28          3HG       GLN  28   4.342  31.753  18.655
  218   HE21  GLN  28          1HE2      GLN  28   2.818  31.047  16.983
  219   HE22  GLN  28          2HE2      GLN  28   1.352  31.937  16.774
  220    H    VAL  29           H        VAL  29   2.758  28.084  20.706
  221    HA   VAL  29           HA       VAL  29   3.672  26.656  22.982
  222    HB   VAL  29           HB       VAL  29   1.385  27.407  24.214
  223   HG11  VAL  29          1HG1      VAL  29   2.757  28.133  25.869
  224   HG12  VAL  29          2HG1      VAL  29   3.981  27.383  24.842
  225   HG13  VAL  29          3HG1      VAL  29   3.726  29.127  24.782
  226   HG21  VAL  29          1HG2      VAL  29   2.487  30.003  23.175
  227   HG22  VAL  29          2HG2      VAL  29   1.122  29.187  22.413
  228   HG23  VAL  29          3HG2      VAL  29   1.003  29.727  24.088
  229    H    LEU  30           H        LEU  30   0.944  27.593  20.956
  230    HA   LEU  30           HA       LEU  30  -0.683  26.377  19.935
  231    HB2  LEU  30          2HB       LEU  30   1.449  24.879  19.610
  232    HB3  LEU  30          3HB       LEU  30   0.616  23.817  20.742
  233    HG   LEU  30           HG       LEU  30  -1.276  24.461  18.777
  234   HD11  LEU  30          1HD1      LEU  30   0.243  23.359  16.864
  235   HD12  LEU  30          2HD1      LEU  30   1.467  24.318  17.697
  236   HD13  LEU  30          3HD1      LEU  30   0.027  25.100  17.047
  237   HD21  LEU  30          1HD2      LEU  30   0.375  22.034  19.412
  238   HD22  LEU  30          2HD2      LEU  30  -0.851  22.025  18.144
  239   HD23  LEU  30          3HD2      LEU  30  -1.312  22.359  19.814
  240    H    ILE  31           H        ILE  31  -1.943  27.167  21.817
  241    HA   ILE  31           HA       ILE  31  -3.276  24.930  23.084
  242    HB   ILE  31           HB       ILE  31  -3.180  26.114  25.343
  243   HG12  ILE  31          2HG1      ILE  31  -0.520  27.172  24.773
  244   HG13  ILE  31          3HG1      ILE  31  -1.784  28.017  23.887
  245   HG21  ILE  31          1HG2      ILE  31  -1.429  24.773  26.028
  246   HG22  ILE  31          2HG2      ILE  31  -1.900  24.013  24.509
  247   HG23  ILE  31          3HG2      ILE  31  -0.490  25.071  24.565
  248   HD11  ILE  31          1HD1      ILE  31  -1.638  27.632  26.866
  249   HD12  ILE  31          2HD1      ILE  31  -1.351  29.128  25.976
  250   HD13  ILE  31          3HD1      ILE  31  -2.964  28.415  26.005
  251    HA   PRO  32           HA       PRO  32  -6.826  27.462  22.578
  252    HB2  PRO  32          2HB       PRO  32  -8.380  26.628  24.642
  253    HB3  PRO  32          3HB       PRO  32  -8.074  25.639  23.209
  254    HG2  PRO  32          2HG       PRO  32  -6.777  25.519  25.904
  255    HG3  PRO  32          3HG       PRO  32  -7.327  24.190  24.867
  256    HD2  PRO  32          2HD       PRO  32  -4.728  24.933  25.027
  257    HD3  PRO  32          3HD       PRO  32  -5.445  24.278  23.540
  258    H    GLU  33           H        GLU  33  -5.558  29.417  23.139
  259    HA   GLU  33           HA       GLU  33  -5.844  30.385  25.867
  260    HB2  GLU  33          2HB       GLU  33  -4.132  30.981  23.603
  261    HB3  GLU  33          3HB       GLU  33  -4.808  32.448  24.297
  262    HG2  GLU  33          2HG       GLU  33  -3.645  30.438  26.143
  263    HG3  GLU  33          3HG       GLU  33  -2.547  31.406  25.162
  264    H    ILE  34           H        ILE  34  -6.336  32.086  22.785
  265    HA   ILE  34           HA       ILE  34  -9.089  32.533  23.073
  266    HB   ILE  34           HB       ILE  34  -8.532  33.860  25.018
  267   HG12  ILE  34          2HG1      ILE  34  -9.211  35.608  22.642
  268   HG13  ILE  34          3HG1      ILE  34 -10.356  34.655  23.580
  269   HG21  ILE  34          1HG2      ILE  34  -7.050  35.752  24.949
  270   HG22  ILE  34          2HG2      ILE  34  -6.187  34.331  24.362
  271   HG23  ILE  34          3HG2      ILE  34  -6.787  35.534  23.219
  272   HD11  ILE  34          1HD1      ILE  34  -9.846  36.011  25.553
  273   HD12  ILE  34          2HD1      ILE  34  -8.735  36.981  24.585
  274   HD13  ILE  34          3HD1      ILE  34 -10.459  36.982  24.215
  275    H    ASN  35           H        ASN  35  -6.008  33.823  21.947
  276    HA   ASN  35           HA       ASN  35  -7.308  34.484  19.389
  277    HB2  ASN  35          2HB       ASN  35  -6.555  36.469  20.859
  278    HB3  ASN  35          3HB       ASN  35  -4.917  35.988  20.428
  279   HD21  ASN  35          1HD2      ASN  35  -8.054  36.733  18.967
  280   HD22  ASN  35          2HD2      ASN  35  -7.410  37.513  17.566
  281    H    LEU  36           H        LEU  36  -6.050  32.014  20.126
  282    HA   LEU  36           HA       LEU  36  -3.684  32.069  18.370
  283    HB2  LEU  36          2HB       LEU  36  -2.898  31.412  20.465
  284    HB3  LEU  36          3HB       LEU  36  -4.326  30.434  20.796
  285    HG   LEU  36           HG       LEU  36  -2.569  29.587  18.556
  286   HD11  LEU  36          1HD1      LEU  36  -1.048  28.437  20.054
  287   HD12  LEU  36          2HD1      LEU  36  -1.856  29.146  21.452
  288   HD13  LEU  36          3HD1      LEU  36  -0.976  30.178  20.325
  289   HD21  LEU  36          1HD2      LEU  36  -4.064  27.940  18.717
  290   HD22  LEU  36          2HD2      LEU  36  -4.618  28.485  20.300
  291   HD23  LEU  36          3HD2      LEU  36  -3.199  27.445  20.173
  292    H    ASN  37           H        ASN  37  -6.843  30.895  18.813
  293    HA   ASN  37           HA       ASN  37  -6.633  28.486  17.303
  294    HB2  ASN  37          2HB       ASN  37  -8.874  30.166  18.344
  295    HB3  ASN  37          3HB       ASN  37  -9.227  28.979  17.092
  296   HD21  ASN  37          1HD2      ASN  37 -10.568  28.335  19.082
  297   HD22  ASN  37          2HD2      ASN  37  -9.849  27.142  20.105
  298    H    ASP  38           H        ASP  38  -8.237  31.572  16.495
  299    HA   ASP  38           HA       ASP  38  -8.672  31.071  13.810
  300    HB2  ASP  38          2HB       ASP  38  -8.905  33.287  15.554
  301    HB3  ASP  38          3HB       ASP  38  -7.997  33.841  14.149
  302    H    THR  39           H        THR  39  -5.745  32.017  15.440
  303    HA   THR  39           HA       THR  39  -4.329  32.791  13.072
  304    HB   THR  39           HB       THR  39  -2.460  32.049  15.054
  305    HG1  THR  39           HG1      THR  39  -3.506  33.520  16.740
  306   HG21  THR  39          1HG2      THR  39  -3.631  34.739  14.332
  307   HG22  THR  39          2HG2      THR  39  -2.244  33.961  13.569
  308   HG23  THR  39          3HG2      THR  39  -2.146  34.490  15.248
  309    H    PHE  40           H        PHE  40  -4.042  29.989  15.264
  310    HA   PHE  40           HA       PHE  40  -2.203  28.557  13.724
  311    HB2  PHE  40          2HB       PHE  40  -2.864  28.081  16.109
  312    HB3  PHE  40          3HB       PHE  40  -4.337  27.344  15.486
  313    HD1  PHE  40           HD1      PHE  40  -0.844  27.147  14.225
  314    HD2  PHE  40           HD2      PHE  40  -4.151  25.085  15.937
  315    HE1  PHE  40           HE1      PHE  40   0.347  25.012  13.947
  316    HE2  PHE  40           HE2      PHE  40  -2.965  22.947  15.662
  317    HZ   PHE  40           HZ       PHE  40  -0.712  22.909  14.666
  318    H    ASP  41           H        ASP  41  -5.735  28.569  13.670
  319    HA   ASP  41           HA       ASP  41  -6.147  26.441  11.915
  320    HB2  ASP  41          2HB       ASP  41  -7.701  28.677  12.947
  321    HB3  ASP  41          3HB       ASP  41  -8.145  28.269  11.291
  322    H    THR  42           H        THR  42  -6.179  29.912  11.085
  323    HA   THR  42           HA       THR  42  -6.239  29.619   8.327
  324    HB   THR  42           HB       THR  42  -6.306  31.765   9.924
  325    HG1  THR  42           HG1      THR  42  -5.489  31.720   7.192
  326   HG21  THR  42          1HG2      THR  42  -3.773  31.481  10.250
  327   HG22  THR  42          2HG2      THR  42  -4.374  33.092   9.855
  328   HG23  THR  42          3HG2      THR  42  -3.628  32.098   8.604
  329    H    PHE  43           H        PHE  43  -3.611  29.196  10.537
  330    HA   PHE  43           HA       PHE  43  -1.499  29.490   8.643
  331    HB2  PHE  43          2HB       PHE  43  -1.311  29.658  11.178
  332    HB3  PHE  43          3HB       PHE  43  -1.376  27.899  11.203
  333    HD1  PHE  43           HD1      PHE  43   0.748  27.303  11.945
  334    HD2  PHE  43           HD2      PHE  43   0.343  30.094   8.757
  335    HE1  PHE  43           HE1      PHE  43   3.176  27.208  11.557
  336    HE2  PHE  43           HE2      PHE  43   2.770  30.002   8.364
  337    HZ   PHE  43           HZ       PHE  43   4.190  28.558   9.764
  338    H    ALA  44           H        ALA  44  -2.709  26.575  10.309
  339    HA   ALA  44           HA       ALA  44  -1.380  24.719   8.706
  340    HB1  ALA  44          1HB       ALA  44  -2.732  24.455  10.939
  341    HB2  ALA  44          2HB       ALA  44  -4.049  24.039   9.842
  342    HB3  ALA  44          3HB       ALA  44  -2.557  23.099   9.824
  343    H    LEU  45           H        LEU  45  -4.682  26.005   8.418
  344    HA   LEU  45           HA       LEU  45  -5.671  24.535   6.347
  345    HB2  LEU  45          2HB       LEU  45  -6.589  26.633   7.659
  346    HB3  LEU  45          3HB       LEU  45  -6.038  27.487   6.219
  347    HG   LEU  45           HG       LEU  45  -8.336  27.068   5.900
  348   HD11  LEU  45          1HD1      LEU  45  -8.369  25.841   3.901
  349   HD12  LEU  45          2HD1      LEU  45  -7.043  24.800   4.419
  350   HD13  LEU  45          3HD1      LEU  45  -6.732  26.488   4.015
  351   HD21  LEU  45          1HD2      LEU  45  -8.677  24.295   5.942
  352   HD22  LEU  45          2HD2      LEU  45  -9.326  25.471   7.084
  353   HD23  LEU  45          3HD2      LEU  45  -7.782  24.683   7.411
  354    H    ASP  46           H        ASP  46  -3.978  27.644   5.882
  355    HA   ASP  46           HA       ASP  46  -3.764  27.636   3.154
  356    HB2  ASP  46          2HB       ASP  46  -2.763  29.202   5.164
  357    HB3  ASP  46          3HB       ASP  46  -1.293  28.502   4.493
  358    H    PHE  47           H        PHE  47  -1.498  26.143   5.451
  359    HA   PHE  47           HA       PHE  47   0.351  25.175   3.609
  360    HB2  PHE  47          2HB       PHE  47  -0.327  24.668   6.407
  361    HB3  PHE  47          3HB       PHE  47   0.322  23.250   5.592
  362    HD1  PHE  47           HD1      PHE  47   2.456  23.807   4.074
  363    HD2  PHE  47           HD2      PHE  47   1.167  26.045   7.458
  364    HE1  PHE  47           HE1      PHE  47   4.737  24.688   4.357
  365    HE2  PHE  47           HE2      PHE  47   3.445  26.929   7.746
  366    HZ   PHE  47           HZ       PHE  47   5.233  26.251   6.194
  367    H    SER  48           H        SER  48  -2.436  23.475   5.039
  368    HA   SER  48           HA       SER  48  -2.195  21.064   3.716
  369    HB2  SER  48          2HB       SER  48  -3.833  21.532   5.524
  370    HB3  SER  48          3HB       SER  48  -4.790  22.476   4.382
  371    HG   SER  48           HG       SER  48  -5.693  20.528   4.228
  372    H    ARG  49           H        ARG  49  -3.855  24.007   2.633
  373    HA   ARG  49           HA       ARG  49  -5.052  23.161   0.331
  374    HB2  ARG  49          2HB       ARG  49  -5.004  25.507   1.319
  375    HB3  ARG  49          3HB       ARG  49  -3.482  25.732   0.467
  376    HG2  ARG  49          2HG       ARG  49  -5.257  24.743  -1.447
  377    HG3  ARG  49          3HG       ARG  49  -6.175  25.927  -0.513
  378    HD2  ARG  49          2HD       ARG  49  -3.442  26.471  -1.651
  379    HD3  ARG  49          3HD       ARG  49  -4.938  26.834  -2.511
  380    HE   ARG  49           HE       ARG  49  -5.112  28.016   0.001
  381   HH11  ARG  49          1HH1      ARG  49  -2.851  29.973  -2.661
  382   HH12  ARG  49          2HH1      ARG  49  -3.181  28.287  -2.884
  383   HH21  ARG  49          1HH2      ARG  49  -3.705  31.080  -0.846
  384   HH22  ARG  49          2HH2      ARG  49  -4.684  30.235   0.305
  385    H    GLU  50           H        GLU  50  -1.635  23.973   0.774
  386    HA   GLU  50           HA       GLU  50  -0.988  23.452  -1.983
  387    HB2  GLU  50          2HB       GLU  50   0.287  24.690   0.244
  388    HB3  GLU  50          3HB       GLU  50   1.341  23.410  -0.340
  389    HG2  GLU  50          2HG       GLU  50   0.152  25.507  -2.132
  390    HG3  GLU  50          3HG       GLU  50   1.717  25.680  -1.339
  391    H    LYS  51           H        LYS  51  -0.941  21.698   1.034
  392    HA   LYS  51           HA       LYS  51   0.762  19.589   0.322
  393    HB2  LYS  51          2HB       LYS  51   0.151  18.648   2.301
  394    HB3  LYS  51          3HB       LYS  51  -0.496  20.258   2.589
  395    HG2  LYS  51          2HG       LYS  51  -2.313  19.040   3.170
  396    HG3  LYS  51          3HG       LYS  51  -2.636  19.192   1.441
  397    HD2  LYS  51          2HD       LYS  51  -1.310  16.994   1.222
  398    HD3  LYS  51          3HD       LYS  51  -1.561  16.838   2.962
  399    HE2  LYS  51          2HE       LYS  51  -4.008  17.089   2.558
  400    HE3  LYS  51          3HE       LYS  51  -3.679  17.056   0.827
  401    HZ1  LYS  51          1HZ       LYS  51  -2.432  14.852   1.547
  402    HZ2  LYS  51          2HZ       LYS  51  -4.076  14.868   1.153
  403    HZ3  LYS  51          3HZ       LYS  51  -3.595  14.888   2.775
  404    H    LYS  52           H        LYS  52  -2.561  20.246  -0.477
  405    HA   LYS  52           HA       LYS  52  -3.087  17.581  -1.456
  406    HB2  LYS  52          2HB       LYS  52  -4.933  18.820  -0.524
  407    HB3  LYS  52          3HB       LYS  52  -4.653  20.159  -1.630
  408    HG2  LYS  52          2HG       LYS  52  -6.534  18.949  -2.424
  409    HG3  LYS  52          3HG       LYS  52  -5.189  18.611  -3.515
  410    HD2  LYS  52          2HD       LYS  52  -6.000  16.491  -3.200
  411    HD3  LYS  52          3HD       LYS  52  -4.822  16.571  -1.888
  412    HE2  LYS  52          2HE       LYS  52  -6.443  16.760  -0.267
  413    HE3  LYS  52          3HE       LYS  52  -7.621  17.459  -1.376
  414    HZ1  LYS  52          1HZ       LYS  52  -8.412  15.458  -1.887
  415    HZ2  LYS  52          2HZ       LYS  52  -7.565  14.875  -0.544
  416    HZ3  LYS  52          3HZ       LYS  52  -6.872  14.784  -2.084
  417    H    LEU  53           H        LEU  53  -2.799  20.808  -2.946
  418    HA   LEU  53           HA       LEU  53  -3.011  20.083  -5.598
  419    HB2  LEU  53          2HB       LEU  53  -2.261  22.370  -4.150
  420    HB3  LEU  53          3HB       LEU  53  -0.961  22.073  -5.303
  421    HG   LEU  53           HG       LEU  53  -2.606  23.647  -6.184
  422   HD11  LEU  53          1HD1      LEU  53  -2.733  22.745  -8.317
  423   HD12  LEU  53          2HD1      LEU  53  -2.975  21.104  -7.719
  424   HD13  LEU  53          3HD1      LEU  53  -1.388  21.863  -7.594
  425   HD21  LEU  53          1HD2      LEU  53  -4.867  23.152  -6.492
  426   HD22  LEU  53          2HD2      LEU  53  -4.514  22.547  -4.873
  427   HD23  LEU  53          3HD2      LEU  53  -4.621  21.425  -6.230
  428    H    LEU  54           H        LEU  54  -0.351  19.622  -3.410
  429    HA   LEU  54           HA       LEU  54   1.619  19.091  -5.413
  430    HB2  LEU  54          2HB       LEU  54   2.254  19.844  -3.194
  431    HB3  LEU  54          3HB       LEU  54   1.536  18.402  -2.479
  432    HG   LEU  54           HG       LEU  54   4.103  18.541  -2.743
  433   HD11  LEU  54          1HD1      LEU  54   2.580  16.530  -2.211
  434   HD12  LEU  54          2HD1      LEU  54   4.231  16.224  -2.750
  435   HD13  LEU  54          3HD1      LEU  54   2.888  16.052  -3.881
  436   HD21  LEU  54          1HD2      LEU  54   3.510  17.478  -5.483
  437   HD22  LEU  54          2HD2      LEU  54   5.048  18.016  -4.806
  438   HD23  LEU  54          3HD2      LEU  54   3.801  19.196  -5.213
  439    H    GLU  55           H        GLU  55  -0.027  16.955  -3.072
  440    HA   GLU  55           HA       GLU  55   0.873  14.534  -4.059
  441    HB2  GLU  55          2HB       GLU  55  -0.425  14.891  -1.944
  442    HB3  GLU  55          3HB       GLU  55  -1.880  15.035  -2.921
  443    HG2  GLU  55          2HG       GLU  55  -0.752  12.664  -3.773
  444    HG3  GLU  55          3HG       GLU  55  -0.463  12.671  -2.035
  445    H    CYS  56           H        CYS  56  -2.406  15.796  -4.673
  446    HA   CYS  56           HA       CYS  56  -3.044  14.068  -6.743
  447    HB2  CYS  56          2HB       CYS  56  -4.851  15.543  -7.266
  448    HB3  CYS  56          3HB       CYS  56  -4.615  15.616  -5.524
  449    HG   CYS  56           HG       CYS  56  -2.838  17.954  -7.049
  450    H    LEU  57           H        LEU  57  -3.194  14.410  -9.036
  451    HA   LEU  57           HA       LEU  57  -2.291  14.871 -11.071
  452    HB2  LEU  57          2HB       LEU  57  -2.852  17.302  -9.858
  453    HB3  LEU  57          3HB       LEU  57  -1.205  17.489 -10.456
  454    HG   LEU  57           HG       LEU  57  -2.305  16.529 -12.675
  455   HD11  LEU  57          1HD1      LEU  57  -4.535  16.868 -12.955
  456   HD12  LEU  57          2HD1      LEU  57  -4.602  18.173 -11.772
  457   HD13  LEU  57          3HD1      LEU  57  -4.528  16.496 -11.231
  458   HD21  LEU  57          1HD2      LEU  57  -2.143  18.653 -13.513
  459   HD22  LEU  57          2HD2      LEU  57  -1.223  18.835 -12.020
  460   HD23  LEU  57          3HD2      LEU  57  -2.896  19.389 -12.099
  461    H    ASP  58           H        ASP  58  -0.142  16.032 -12.062
  462    HA   ASP  58           HA       ASP  58   2.005  14.421 -11.105
  463    HB2  ASP  58          2HB       ASP  58   1.937  16.626 -13.173
  464    HB3  ASP  58          3HB       ASP  58   3.334  15.599 -12.864
  465    H    TYR  59           H        TYR  59   1.610  17.960 -11.326
  466    HA   TYR  59           HA       TYR  59   2.990  18.297  -8.804
  467    HB2  TYR  59          2HB       TYR  59   4.422  18.504 -11.257
  468    HB3  TYR  59          3HB       TYR  59   4.267  20.123 -10.585
  469    HD1  TYR  59           HD1      TYR  59   5.530  20.788  -8.692
  470    HD2  TYR  59           HD2      TYR  59   5.497  16.705  -9.887
  471    HE1  TYR  59           HE1      TYR  59   7.377  20.324  -7.136
  472    HE2  TYR  59           HE2      TYR  59   7.343  16.229  -8.333
  473    HH   TYR  59           HH       TYR  59   8.398  17.105  -6.403
  474    H    LEU  60           H        LEU  60   2.200  20.262 -11.678
  475    HA   LEU  60           HA       LEU  60   0.142  21.679 -10.241
  476    HB2  LEU  60          2HB       LEU  60   2.490  22.690  -9.707
  477    HB3  LEU  60          3HB       LEU  60   2.340  23.390 -11.317
  478    HG   LEU  60           HG       LEU  60   0.092  23.807  -9.421
  479   HD11  LEU  60          1HD1      LEU  60   1.174  25.629  -8.307
  480   HD12  LEU  60          2HD1      LEU  60   2.644  25.401  -9.254
  481   HD13  LEU  60          3HD1      LEU  60   2.154  24.180  -8.080
  482   HD21  LEU  60          1HD2      LEU  60  -0.481  25.149 -11.092
  483   HD22  LEU  60          2HD2      LEU  60   1.058  24.868 -11.906
  484   HD23  LEU  60          3HD2      LEU  60   0.914  26.158 -10.712
  Start of MODEL    7
    1    H    LEU   1           H        LEU   1   6.185   0.793  -9.591
    2    HA   LEU   1           HA       LEU   1   7.625   1.402  -7.391
    3    HB2  LEU   1          2HB       LEU   1   7.116   3.724  -7.748
    4    HB3  LEU   1          3HB       LEU   1   7.270   2.907  -9.302
    5    HG   LEU   1           HG       LEU   1   4.544   3.239  -8.156
    6   HD11  LEU   1          1HD1      LEU   1   6.215   5.456  -9.308
    7   HD12  LEU   1          2HD1      LEU   1   5.322   5.435  -7.788
    8   HD13  LEU   1          3HD1      LEU   1   4.452   5.481  -9.321
    9   HD21  LEU   1          1HD2      LEU   1   4.409   2.137 -10.153
   10   HD22  LEU   1          2HD2      LEU   1   5.833   2.937 -10.819
   11   HD23  LEU   1          3HD2      LEU   1   4.299   3.803 -10.723
   12    H    LYS   2           H        LYS   2   5.460  -0.249  -6.517
   13    HA   LYS   2           HA       LYS   2   3.448   1.045  -5.113
   14    HB2  LYS   2          2HB       LYS   2   3.643  -1.420  -5.451
   15    HB3  LYS   2          3HB       LYS   2   4.911  -1.449  -4.232
   16    HG2  LYS   2          2HG       LYS   2   2.876  -0.158  -2.932
   17    HG3  LYS   2          3HG       LYS   2   2.015  -1.337  -3.925
   18    HD2  LYS   2          2HD       LYS   2   3.943  -2.924  -2.987
   19    HD3  LYS   2          3HD       LYS   2   3.894  -1.754  -1.666
   20    HE2  LYS   2          2HE       LYS   2   1.830  -2.405  -0.990
   21    HE3  LYS   2          3HE       LYS   2   1.288  -2.762  -2.629
   22    HZ1  LYS   2          1HZ       LYS   2   3.351  -4.521  -1.631
   23    HZ2  LYS   2          2HZ       LYS   2   1.923  -4.888  -2.458
   24    HZ3  LYS   2          3HZ       LYS   2   1.887  -4.618  -0.789
   25    H    GLU   3           H        GLU   3   6.806   0.481  -4.226
   26    HA   GLU   3           HA       GLU   3   6.378   2.139  -1.827
   27    HB2  GLU   3          2HB       GLU   3   8.339   0.937  -0.843
   28    HB3  GLU   3          3HB       GLU   3   6.927  -0.077  -1.103
   29    HG2  GLU   3          2HG       GLU   3   8.655  -0.115  -3.406
   30    HG3  GLU   3          3HG       GLU   3   9.535  -0.559  -1.945
   31    H    ASN   4           H        ASN   4   8.716   2.943  -1.072
   32    HA   ASN   4           HA       ASN   4  10.499   4.305  -1.468
   33    HB2  ASN   4          2HB       ASN   4  10.519   2.469  -3.673
   34    HB3  ASN   4          3HB       ASN   4  10.976   4.069  -4.250
   35   HD21  ASN   4          1HD2      ASN   4  11.599   1.962  -1.461
   36   HD22  ASN   4          2HD2      ASN   4  13.301   2.256  -1.406
   37    H    ASP   5           H        ASP   5   8.980   4.448  -4.676
   38    HA   ASP   5           HA       ASP   5   9.126   7.193  -4.982
   39    HB2  ASP   5          2HB       ASP   5   7.512   5.028  -6.213
   40    HB3  ASP   5          3HB       ASP   5   6.933   6.675  -6.451
   41    H    HIS   6           H        HIS   6   6.478   5.257  -3.633
   42    HA   HIS   6           HA       HIS   6   4.865   7.578  -3.078
   43    HB2  HIS   6          2HB       HIS   6   4.081   5.148  -3.575
   44    HB3  HIS   6          3HB       HIS   6   4.399   4.870  -1.865
   45    HD1  HIS   6           HD1      HIS   6   2.922   8.080  -3.156
   46    HD2  HIS   6           HD2      HIS   6   1.740   4.649  -1.133
   47    HE1  HIS   6           HE1      HIS   6   0.586   8.546  -2.349
   48    H    ALA   7           H        ALA   7   7.215   5.653  -1.397
   49    HA   ALA   7           HA       ALA   7   6.537   6.398   1.250
   50    HB1  ALA   7          1HB       ALA   7   7.904   4.473   0.912
   51    HB2  ALA   7          2HB       ALA   7   9.121   5.418   0.053
   52    HB3  ALA   7          3HB       ALA   7   8.869   5.667   1.781
   53    H    ARG   8           H        ARG   8   8.524   7.871  -1.237
   54    HA   ARG   8           HA       ARG   8   9.626   9.855   0.542
   55    HB2  ARG   8          2HB       ARG   8  10.619  10.808  -1.499
   56    HB3  ARG   8          3HB       ARG   8  10.944   9.086  -1.354
   57    HG2  ARG   8          2HG       ARG   8   9.276   8.573  -2.999
   58    HG3  ARG   8          3HG       ARG   8   8.758  10.259  -3.057
   59    HD2  ARG   8          2HD       ARG   8  11.618   9.842  -3.552
   60    HD3  ARG   8          3HD       ARG   8  10.555   9.112  -4.755
   61    HE   ARG   8           HE       ARG   8   9.677  11.720  -4.317
   62   HH11  ARG   8          1HH1      ARG   8  12.876  11.346  -6.695
   63   HH12  ARG   8          2HH1      ARG   8  12.462  10.070  -5.598
   64   HH21  ARG   8          1HH2      ARG   8  11.596  13.244  -6.783
   65   HH22  ARG   8          2HH2      ARG   8  10.212  13.407  -5.756
   66    H    PHE   9           H        PHE   9   6.978   9.611  -1.734
   67    HA   PHE   9           HA       PHE   9   6.405  12.400  -1.847
   68    HB2  PHE   9          2HB       PHE   9   5.142   9.903  -2.799
   69    HB3  PHE   9          3HB       PHE   9   4.041  11.245  -2.507
   70    HD1  PHE   9           HD1      PHE   9   5.281  13.588  -3.386
   71    HD2  PHE   9           HD2      PHE   9   5.666   9.673  -5.010
   72    HE1  PHE   9           HE1      PHE   9   5.883  14.555  -5.567
   73    HE2  PHE   9           HE2      PHE   9   6.269  10.634  -7.193
   74    HZ   PHE   9           HZ       PHE   9   6.379  13.078  -7.474
   75    H    LEU  10           H        LEU  10   5.213   9.709   0.103
   76    HA   LEU  10           HA       LEU  10   3.214  11.259   1.439
   77    HB2  LEU  10          2HB       LEU  10   3.772   8.576   1.176
   78    HB3  LEU  10          3HB       LEU  10   4.174   8.903   2.860
   79    HG   LEU  10           HG       LEU  10   1.710  10.098   2.567
   80   HD11  LEU  10          1HD1      LEU  10   0.294   8.354   1.552
   81   HD12  LEU  10          2HD1      LEU  10   1.748   7.523   1.002
   82   HD13  LEU  10          3HD1      LEU  10   1.364   9.129   0.384
   83   HD21  LEU  10          1HD2      LEU  10   2.541   7.395   3.592
   84   HD22  LEU  10          2HD2      LEU  10   0.909   8.035   3.793
   85   HD23  LEU  10          3HD2      LEU  10   2.283   8.880   4.508
   86    H    GLN  11           H        GLN  11   6.473  10.137   2.264
   87    HA   GLN  11           HA       GLN  11   6.569  11.051   4.895
   88    HB2  GLN  11          2HB       GLN  11   8.266   9.575   3.907
   89    HB3  GLN  11          3HB       GLN  11   8.824  10.895   2.888
   90    HG2  GLN  11          2HG       GLN  11  10.151  11.653   4.485
   91    HG3  GLN  11          3HG       GLN  11   8.821  11.703   5.640
   92   HE21  GLN  11          1HE2      GLN  11   8.589  10.083   7.113
   93   HE22  GLN  11          2HE2      GLN  11   9.740   8.812   7.325
   94    H    THR  12           H        THR  12   6.861  12.768   1.882
   95    HA   THR  12           HA       THR  12   7.989  15.150   3.007
   96    HB   THR  12           HB       THR  12   6.630  14.661   0.352
   97    HG1  THR  12           HG1      THR  12   9.343  14.821   1.192
   98   HG21  THR  12          1HG2      THR  12   7.679  17.131   1.613
   99   HG22  THR  12          2HG2      THR  12   6.387  16.924   0.431
  100   HG23  THR  12          3HG2      THR  12   8.072  16.868  -0.085
  101    H    ALA  13           H        ALA  13   4.759  14.367   1.708
  102    HA   ALA  13           HA       ALA  13   3.460  16.720   2.306
  103    HB1  ALA  13          1HB       ALA  13   1.498  14.891   2.774
  104    HB2  ALA  13          2HB       ALA  13   2.000  15.447   1.177
  105    HB3  ALA  13          3HB       ALA  13   2.651  13.945   1.832
  106    H    LYS  14           H        LYS  14   3.942  13.904   4.411
  107    HA   LYS  14           HA       LYS  14   2.521  15.001   6.619
  108    HB2  LYS  14          2HB       LYS  14   3.610  12.524   5.970
  109    HB3  LYS  14          3HB       LYS  14   4.566  13.063   7.345
  110    HG2  LYS  14          2HG       LYS  14   2.764  13.055   8.776
  111    HG3  LYS  14          3HG       LYS  14   1.590  13.229   7.468
  112    HD2  LYS  14          2HD       LYS  14   1.451  11.010   7.142
  113    HD3  LYS  14          3HD       LYS  14   3.191  10.778   7.327
  114    HE2  LYS  14          2HE       LYS  14   1.654  11.467   9.764
  115    HE3  LYS  14          3HE       LYS  14   1.404   9.857   9.089
  116    HZ1  LYS  14          1HZ       LYS  14   4.123  10.904   9.565
  117    HZ2  LYS  14          2HZ       LYS  14   3.621   9.297   9.406
  118    HZ3  LYS  14          3HZ       LYS  14   3.245  10.165  10.808
  119    H    ASN  15           H        ASN  15   5.972  14.740   5.823
  120    HA   ASN  15           HA       ASN  15   7.024  15.844   8.147
  121    HB2  ASN  15          2HB       ASN  15   8.580  14.873   6.681
  122    HB3  ASN  15          3HB       ASN  15   7.987  15.789   5.299
  123   HD21  ASN  15          1HD2      ASN  15  10.137  15.717   7.954
  124   HD22  ASN  15          2HD2      ASN  15  10.898  17.242   7.671
  125    H    ILE  16           H        ILE  16   5.354  17.354   5.524
  126    HA   ILE  16           HA       ILE  16   6.287  20.013   5.997
  127    HB   ILE  16           HB       ILE  16   3.844  19.015   4.530
  128   HG12  ILE  16          2HG1      ILE  16   6.155  20.293   3.166
  129   HG13  ILE  16          3HG1      ILE  16   6.400  18.667   3.793
  130   HG21  ILE  16          1HG2      ILE  16   3.170  21.151   4.881
  131   HG22  ILE  16          2HG2      ILE  16   4.811  21.743   5.138
  132   HG23  ILE  16          3HG2      ILE  16   4.227  21.446   3.500
  133   HD11  ILE  16          1HD1      ILE  16   5.091  19.497   1.406
  134   HD12  ILE  16          2HD1      ILE  16   5.442  17.864   1.974
  135   HD13  ILE  16          3HD1      ILE  16   3.935  18.654   2.437
  136    H    THR  17           H        THR  17   3.199  18.371   6.694
  137    HA   THR  17           HA       THR  17   2.191  20.537   8.256
  138    HB   THR  17           HB       THR  17   1.031  17.877   8.758
  139    HG1  THR  17           HG1      THR  17   0.432  17.470   6.707
  140   HG21  THR  17          1HG2      THR  17   0.042  20.605   7.972
  141   HG22  THR  17          2HG2      THR  17  -0.239  19.720   9.471
  142   HG23  THR  17          3HG2      THR  17  -1.023  19.200   7.980
  143    H    GLU  18           H        GLU  18   4.207  17.817   8.904
  144    HA   GLU  18           HA       GLU  18   3.705  17.711  11.727
  145    HB2  GLU  18          2HB       GLU  18   5.750  16.468   9.910
  146    HB3  GLU  18          3HB       GLU  18   5.897  16.338  11.657
  147    HG2  GLU  18          2HG       GLU  18   3.330  15.575  10.356
  148    HG3  GLU  18          3HG       GLU  18   4.705  14.475  10.271
  149    H    ARG  19           H        ARG  19   6.093  19.219   9.626
  150    HA   ARG  19           HA       ARG  19   7.795  20.111  11.730
  151    HB2  ARG  19          2HB       ARG  19   8.332  19.824   9.217
  152    HB3  ARG  19          3HB       ARG  19   7.613  21.417   9.029
  153    HG2  ARG  19          2HG       ARG  19   9.411  21.673  11.145
  154    HG3  ARG  19          3HG       ARG  19  10.240  20.687   9.939
  155    HD2  ARG  19          2HD       ARG  19   9.744  22.372   8.231
  156    HD3  ARG  19          3HD       ARG  19   8.924  23.356   9.443
  157    HE   ARG  19           HE       ARG  19  11.741  23.159   9.009
  158   HH11  ARG  19          1HH1      ARG  19  10.335  24.657  12.445
  159   HH12  ARG  19          2HH1      ARG  19   9.294  23.728  11.418
  160   HH21  ARG  19          1HH2      ARG  19  12.513  25.028  11.837
  161   HH22  ARG  19          2HH2      ARG  19  13.122  24.380  10.352
  162    H    VAL  20           H        VAL  20   5.262  21.670   9.791
  163    HA   VAL  20           HA       VAL  20   5.471  24.243  10.851
  164    HB   VAL  20           HB       VAL  20   4.120  23.750   8.875
  165   HG11  VAL  20          1HG1      VAL  20   3.208  21.596   9.630
  166   HG12  VAL  20          2HG1      VAL  20   2.180  22.448  10.783
  167   HG13  VAL  20          3HG1      VAL  20   1.947  22.683   9.050
  168   HG21  VAL  20          1HG2      VAL  20   2.683  25.016  11.195
  169   HG22  VAL  20          2HG2      VAL  20   3.612  25.812   9.925
  170   HG23  VAL  20          3HG2      VAL  20   2.063  25.058   9.545
  171    H    SER  21           H        SER  21   3.798  21.394  12.054
  172    HA   SER  21           HA       SER  21   2.301  22.684  14.074
  173    HB2  SER  21          2HB       SER  21   2.859  19.954  13.245
  174    HB3  SER  21          3HB       SER  21   2.800  20.101  15.001
  175    HG   SER  21           HG       SER  21   0.763  19.904  13.428
  176    H    MET  22           H        MET  22   5.262  20.709  14.361
  177    HA   MET  22           HA       MET  22   5.770  21.279  17.044
  178    HB2  MET  22          2HB       MET  22   6.876  19.585  15.345
  179    HB3  MET  22          3HB       MET  22   8.050  20.881  15.155
  180    HG2  MET  22          2HG       MET  22   8.788  20.713  17.336
  181    HG3  MET  22          3HG       MET  22   7.311  19.922  17.882
  182    HE1  MET  22          1HE       MET  22   9.590  18.677  14.647
  183    HE2  MET  22          2HE       MET  22  10.412  19.759  15.772
  184    HE3  MET  22          3HE       MET  22  10.862  18.055  15.699
  185    H    ALA  23           H        ALA  23   6.381  23.136  14.171
  186    HA   ALA  23           HA       ALA  23   8.317  24.904  15.265
  187    HB1  ALA  23          1HB       ALA  23   7.094  26.343  13.280
  188    HB2  ALA  23          2HB       ALA  23   8.441  25.226  13.056
  189    HB3  ALA  23          3HB       ALA  23   6.786  24.677  12.790
  190    H    THR  24           H        THR  24   4.878  25.473  14.488
  191    HA   THR  24           HA       THR  24   4.623  27.945  15.708
  192    HB   THR  24           HB       THR  24   2.331  26.036  15.882
  193    HG1  THR  24           HG1      THR  24   2.026  26.489  13.564
  194   HG21  THR  24          1HG2      THR  24   1.480  28.273  14.594
  195   HG22  THR  24          2HG2      THR  24   2.786  28.927  15.583
  196   HG23  THR  24          3HG2      THR  24   1.451  28.061  16.344
  197    H    ALA  25           H        ALA  25   4.770  24.787  17.136
  198    HA   ALA  25           HA       ALA  25   3.747  25.651  19.700
  199    HB1  ALA  25          1HB       ALA  25   3.803  23.239  18.488
  200    HB2  ALA  25          2HB       ALA  25   5.208  23.101  19.546
  201    HB3  ALA  25          3HB       ALA  25   3.623  23.466  20.228
  202    H    SER  26           H        SER  26   6.884  24.448  18.497
  203    HA   SER  26           HA       SER  26   8.304  24.993  20.872
  204    HB2  SER  26          2HB       SER  26   9.219  23.433  19.282
  205    HB3  SER  26          3HB       SER  26   9.248  24.661  18.016
  206    HG   SER  26           HG       SER  26  11.028  24.188  20.050
  207    H    SER  27           H        SER  27   7.074  27.057  18.496
  208    HA   SER  27           HA       SER  27   9.028  29.165  19.056
  209    HB2  SER  27          2HB       SER  27   8.267  28.618  16.684
  210    HB3  SER  27          3HB       SER  27   6.712  29.323  17.124
  211    HG   SER  27           HG       SER  27   7.970  30.920  16.205
  212    H    GLN  28           H        GLN  28   5.641  28.347  19.472
  213    HA   GLN  28           HA       GLN  28   5.342  30.728  21.182
  214    HB2  GLN  28          2HB       GLN  28   3.676  29.745  18.984
  215    HB3  GLN  28          3HB       GLN  28   2.771  30.060  20.459
  216    HG2  GLN  28          2HG       GLN  28   3.130  32.300  20.373
  217    HG3  GLN  28          3HG       GLN  28   4.685  32.133  19.560
  218   HE21  GLN  28          1HE2      GLN  28   4.768  32.491  17.448
  219   HE22  GLN  28          2HE2      GLN  28   3.403  32.648  16.401
  220    H    VAL  29           H        VAL  29   3.226  27.940  20.616
  221    HA   VAL  29           HA       VAL  29   3.862  26.481  22.911
  222    HB   VAL  29           HB       VAL  29   3.094  28.357  24.217
  223   HG11  VAL  29          1HG1      VAL  29   1.717  29.471  22.567
  224   HG12  VAL  29          2HG1      VAL  29   0.538  28.159  22.627
  225   HG13  VAL  29          3HG1      VAL  29   0.783  29.192  24.036
  226   HG21  VAL  29          1HG2      VAL  29   0.696  26.725  24.568
  227   HG22  VAL  29          2HG2      VAL  29   2.187  25.788  24.488
  228   HG23  VAL  29          3HG2      VAL  29   2.011  27.064  25.692
  229    H    LEU  30           H        LEU  30   1.398  27.514  20.642
  230    HA   LEU  30           HA       LEU  30  -0.122  26.352  19.412
  231    HB2  LEU  30          2HB       LEU  30   1.954  24.766  19.354
  232    HB3  LEU  30          3HB       LEU  30   0.970  23.759  20.414
  233    HG   LEU  30           HG       LEU  30  -0.709  24.363  18.283
  234   HD11  LEU  30          1HD1      LEU  30   2.121  24.225  17.418
  235   HD12  LEU  30          2HD1      LEU  30   0.755  25.080  16.703
  236   HD13  LEU  30          3HD1      LEU  30   0.931  23.342  16.462
  237   HD21  LEU  30          1HD2      LEU  30  -0.549  22.015  17.801
  238   HD22  LEU  30          2HD2      LEU  30  -0.479  22.240  19.549
  239   HD23  LEU  30          3HD2      LEU  30   0.997  21.903  18.643
  240    H    ILE  31           H        ILE  31  -1.515  27.249  21.197
  241    HA   ILE  31           HA       ILE  31  -3.136  25.085  22.257
  242    HB   ILE  31           HB       ILE  31  -3.239  26.051  24.521
  243   HG12  ILE  31          2HG1      ILE  31  -1.075  27.547  24.974
  244   HG13  ILE  31          3HG1      ILE  31  -1.342  27.991  23.292
  245   HG21  ILE  31          1HG2      ILE  31  -0.434  25.324  23.688
  246   HG22  ILE  31          2HG2      ILE  31  -1.116  25.192  25.308
  247   HG23  ILE  31          3HG2      ILE  31  -1.732  24.174  24.008
  248   HD11  ILE  31          1HD1      ILE  31  -3.728  28.076  24.996
  249   HD12  ILE  31          2HD1      ILE  31  -2.466  29.243  25.393
  250   HD13  ILE  31          3HD1      ILE  31  -3.158  29.210  23.772
  251    HA   PRO  32           HA       PRO  32  -6.437  27.804  21.259
  252    HB2  PRO  32          2HB       PRO  32  -8.325  26.990  23.032
  253    HB3  PRO  32          3HB       PRO  32  -7.846  26.027  21.629
  254    HG2  PRO  32          2HG       PRO  32  -6.985  25.771  24.485
  255    HG3  PRO  32          3HG       PRO  32  -7.428  24.499  23.331
  256    HD2  PRO  32          2HD       PRO  32  -4.854  25.109  23.911
  257    HD3  PRO  32          3HD       PRO  32  -5.361  24.531  22.311
  258    H    GLU  33           H        GLU  33  -6.986  29.845  21.750
  259    HA   GLU  33           HA       GLU  33  -7.024  30.700  24.546
  260    HB2  GLU  33          2HB       GLU  33  -5.099  31.572  22.487
  261    HB3  GLU  33          3HB       GLU  33  -5.848  32.869  23.408
  262    HG2  GLU  33          2HG       GLU  33  -4.861  30.626  25.018
  263    HG3  GLU  33          3HG       GLU  33  -3.619  31.532  24.156
  264    H    ILE  34           H        ILE  34  -7.087  32.461  21.460
  265    HA   ILE  34           HA       ILE  34  -9.868  32.766  21.287
  266    HB   ILE  34           HB       ILE  34  -9.730  34.053  23.327
  267   HG12  ILE  34          2HG1      ILE  34  -9.999  36.375  21.604
  268   HG13  ILE  34          3HG1      ILE  34 -10.803  34.967  20.918
  269   HG21  ILE  34          1HG2      ILE  34  -8.348  35.997  23.584
  270   HG22  ILE  34          2HG2      ILE  34  -7.328  34.643  23.101
  271   HG23  ILE  34          3HG2      ILE  34  -7.783  35.870  21.919
  272   HD11  ILE  34          1HD1      ILE  34 -11.422  35.151  23.698
  273   HD12  ILE  34          2HD1      ILE  34 -11.745  36.696  22.911
  274   HD13  ILE  34          3HD1      ILE  34 -12.500  35.222  22.305
  275    H    ASN  35           H        ASN  35  -6.721  34.269  20.748
  276    HA   ASN  35           HA       ASN  35  -7.633  35.043  18.054
  277    HB2  ASN  35          2HB       ASN  35  -7.036  36.923  19.684
  278    HB3  ASN  35          3HB       ASN  35  -5.369  36.373  19.537
  279   HD21  ASN  35          1HD2      ASN  35  -8.135  37.539  17.697
  280   HD22  ASN  35          2HD2      ASN  35  -7.215  38.259  16.424
  281    H    LEU  36           H        LEU  36  -6.425  32.511  19.022
  282    HA   LEU  36           HA       LEU  36  -3.967  32.543  17.397
  283    HB2  LEU  36          2HB       LEU  36  -3.294  31.969  19.555
  284    HB3  LEU  36          3HB       LEU  36  -4.726  30.982  19.838
  285    HG   LEU  36           HG       LEU  36  -2.832  30.085  17.733
  286   HD11  LEU  36          1HD1      LEU  36  -1.516  28.898  19.517
  287   HD12  LEU  36          2HD1      LEU  36  -2.260  29.989  20.685
  288   HD13  LEU  36          3HD1      LEU  36  -1.240  30.636  19.401
  289   HD21  LEU  36          1HD2      LEU  36  -4.454  28.525  17.883
  290   HD22  LEU  36          2HD2      LEU  36  -4.875  28.962  19.539
  291   HD23  LEU  36          3HD2      LEU  36  -3.472  27.939  19.226
  292    H    ASN  37           H        ASN  37  -7.130  31.340  17.694
  293    HA   ASN  37           HA       ASN  37  -6.826  28.873  16.319
  294    HB2  ASN  37          2HB       ASN  37  -9.084  30.587  17.186
  295    HB3  ASN  37          3HB       ASN  37  -9.406  29.501  15.837
  296   HD21  ASN  37          1HD2      ASN  37  -8.599  27.213  16.213
  297   HD22  ASN  37          2HD2      ASN  37  -8.920  26.540  17.772
  298    H    ASP  38           H        ASP  38  -8.309  31.924  15.207
  299    HA   ASP  38           HA       ASP  38  -8.505  31.264  12.521
  300    HB2  ASP  38          2HB       ASP  38  -7.994  34.010  13.687
  301    HB3  ASP  38          3HB       ASP  38  -8.656  33.670  12.090
  302    H    THR  39           H        THR  39  -5.742  32.274  14.369
  303    HA   THR  39           HA       THR  39  -4.119  32.916  12.079
  304    HB   THR  39           HB       THR  39  -2.449  32.398  14.301
  305    HG1  THR  39           HG1      THR  39  -3.678  34.020  15.710
  306   HG21  THR  39          1HG2      THR  39  -2.542  34.256  12.450
  307   HG22  THR  39          2HG2      THR  39  -1.817  34.598  14.021
  308   HG23  THR  39          3HG2      THR  39  -3.459  35.136  13.671
  309    H    PHE  40           H        PHE  40  -4.034  30.325  14.531
  310    HA   PHE  40           HA       PHE  40  -2.022  28.802  13.334
  311    HB2  PHE  40          2HB       PHE  40  -2.925  28.516  15.664
  312    HB3  PHE  40          3HB       PHE  40  -4.326  27.715  14.960
  313    HD1  PHE  40           HD1      PHE  40  -0.722  27.441  14.081
  314    HD2  PHE  40           HD2      PHE  40  -4.184  25.506  15.625
  315    HE1  PHE  40           HE1      PHE  40   0.492  25.302  14.111
  316    HE2  PHE  40           HE2      PHE  40  -2.975  23.363  15.660
  317    HZ   PHE  40           HZ       PHE  40  -0.634  23.259  14.903
  318    H    ASP  41           H        ASP  41  -5.526  28.739  12.895
  319    HA   ASP  41           HA       ASP  41  -5.724  26.458  11.303
  320    HB2  ASP  41          2HB       ASP  41  -7.535  28.141  12.307
  321    HB3  ASP  41          3HB       ASP  41  -7.474  28.784  10.669
  322    H    THR  42           H        THR  42  -5.642  29.846  10.182
  323    HA   THR  42           HA       THR  42  -5.397  29.295   7.464
  324    HB   THR  42           HB       THR  42  -5.695  31.576   8.825
  325    HG1  THR  42           HG1      THR  42  -5.815  32.393   6.850
  326   HG21  THR  42          1HG2      THR  42  -2.896  31.914   7.805
  327   HG22  THR  42          2HG2      THR  42  -3.189  31.359   9.454
  328   HG23  THR  42          3HG2      THR  42  -3.803  32.927   8.928
  329    H    PHE  43           H        PHE  43  -3.065  29.081   9.992
  330    HA   PHE  43           HA       PHE  43  -0.743  29.265   8.325
  331    HB2  PHE  43          2HB       PHE  43  -0.836  29.729  10.824
  332    HB3  PHE  43          3HB       PHE  43  -0.896  27.984  11.053
  333    HD1  PHE  43           HD1      PHE  43   1.133  27.520  12.095
  334    HD2  PHE  43           HD2      PHE  43   1.079  29.900   8.566
  335    HE1  PHE  43           HE1      PHE  43   3.590  27.422  11.995
  336    HE2  PHE  43           HE2      PHE  43   3.535  29.806   8.461
  337    HZ   PHE  43           HZ       PHE  43   4.794  28.565  10.176
  338    H    ALA  44           H        ALA  44  -2.326  26.555  10.017
  339    HA   ALA  44           HA       ALA  44  -0.722  24.559   8.796
  340    HB1  ALA  44          1HB       ALA  44  -3.068  23.304   9.568
  341    HB2  ALA  44          2HB       ALA  44  -1.606  23.492  10.538
  342    HB3  ALA  44          3HB       ALA  44  -2.917  24.663  10.682
  343    H    LEU  45           H        LEU  45  -4.027  25.708   8.166
  344    HA   LEU  45           HA       LEU  45  -4.810  23.988   6.186
  345    HB2  LEU  45          2HB       LEU  45  -5.934  26.116   7.257
  346    HB3  LEU  45          3HB       LEU  45  -5.334  26.893   5.794
  347    HG   LEU  45           HG       LEU  45  -7.576  26.312   5.358
  348   HD11  LEU  45          1HD1      LEU  45  -6.026  24.037   4.152
  349   HD12  LEU  45          2HD1      LEU  45  -5.839  25.707   3.621
  350   HD13  LEU  45          3HD1      LEU  45  -7.403  24.906   3.474
  351   HD21  LEU  45          1HD2      LEU  45  -6.941  23.992   7.003
  352   HD22  LEU  45          2HD2      LEU  45  -7.882  23.588   5.567
  353   HD23  LEU  45          3HD2      LEU  45  -8.489  24.787   6.710
  354    H    ASP  46           H        ASP  46  -3.241  27.136   5.576
  355    HA   ASP  46           HA       ASP  46  -2.864  26.935   2.871
  356    HB2  ASP  46          2HB       ASP  46  -2.054  28.691   4.818
  357    HB3  ASP  46          3HB       ASP  46  -0.520  28.030   4.260
  358    H    PHE  47           H        PHE  47  -0.707  25.709   5.414
  359    HA   PHE  47           HA       PHE  47   1.312  24.715   3.768
  360    HB2  PHE  47          2HB       PHE  47   0.489  24.407   6.547
  361    HB3  PHE  47          3HB       PHE  47   1.203  22.935   5.896
  362    HD1  PHE  47           HD1      PHE  47   3.371  23.540   4.335
  363    HD2  PHE  47           HD2      PHE  47   1.943  25.754   7.678
  364    HE1  PHE  47           HE1      PHE  47   5.620  24.484   4.666
  365    HE2  PHE  47           HE2      PHE  47   4.189  26.702   8.014
  366    HZ   PHE  47           HZ       PHE  47   6.030  26.068   6.507
  367    H    SER  48           H        SER  48  -1.519  23.018   5.103
  368    HA   SER  48           HA       SER  48  -1.083  20.518   4.013
  369    HB2  SER  48          2HB       SER  48  -3.188  21.811   5.357
  370    HB3  SER  48          3HB       SER  48  -3.894  21.169   3.874
  371    HG   SER  48           HG       SER  48  -3.360  19.147   4.476
  372    H    ARG  49           H        ARG  49  -2.776  23.279   2.559
  373    HA   ARG  49           HA       ARG  49  -3.706  22.182   0.235
  374    HB2  ARG  49          2HB       ARG  49  -4.187  24.467   0.726
  375    HB3  ARG  49          3HB       ARG  49  -2.481  24.895   0.719
  376    HG2  ARG  49          2HG       ARG  49  -3.530  25.700  -1.290
  377    HG3  ARG  49          3HG       ARG  49  -2.395  24.410  -1.693
  378    HD2  ARG  49          2HD       ARG  49  -4.011  23.122  -2.537
  379    HD3  ARG  49          3HD       ARG  49  -5.064  23.404  -1.151
  380    HE   ARG  49           HE       ARG  49  -5.135  24.755  -3.685
  381   HH11  ARG  49          1HH1      ARG  49  -7.176  26.152  -0.537
  382   HH12  ARG  49          2HH1      ARG  49  -5.921  24.981  -0.301
  383   HH21  ARG  49          1HH2      ARG  49  -7.667  26.898  -2.647
  384   HH22  ARG  49          2HH2      ARG  49  -6.785  26.296  -4.009
  385    H    GLU  50           H        GLU  50  -0.407  23.266   0.917
  386    HA   GLU  50           HA       GLU  50   0.534  22.628  -1.725
  387    HB2  GLU  50          2HB       GLU  50   1.486  24.129   0.455
  388    HB3  GLU  50          3HB       GLU  50   2.643  22.824   0.233
  389    HG2  GLU  50          2HG       GLU  50   1.820  24.929  -1.739
  390    HG3  GLU  50          3HG       GLU  50   3.419  24.629  -1.062
  391    H    LYS  51           H        LYS  51   0.352  21.029   1.366
  392    HA   LYS  51           HA       LYS  51   2.242  19.001   0.968
  393    HB2  LYS  51          2HB       LYS  51   1.460  18.124   2.914
  394    HB3  LYS  51          3HB       LYS  51   0.678  19.694   3.033
  395    HG2  LYS  51          2HG       LYS  51  -1.113  18.379   3.461
  396    HG3  LYS  51          3HG       LYS  51  -1.229  18.418   1.700
  397    HD2  LYS  51          2HD       LYS  51   0.215  16.312   1.732
  398    HD3  LYS  51          3HD       LYS  51  -0.140  16.236   3.459
  399    HE2  LYS  51          2HE       LYS  51  -2.562  16.267   2.899
  400    HE3  LYS  51          3HE       LYS  51  -2.128  16.184   1.192
  401    HZ1  LYS  51          1HZ       LYS  51  -2.621  14.043   2.675
  402    HZ2  LYS  51          2HZ       LYS  51  -0.951  14.159   2.913
  403    HZ3  LYS  51          3HZ       LYS  51  -1.574  14.021   1.346
  404    H    LYS  52           H        LYS  52  -0.996  19.407  -0.241
  405    HA   LYS  52           HA       LYS  52  -1.238  16.671  -1.138
  406    HB2  LYS  52          2HB       LYS  52  -3.002  18.858  -2.153
  407    HB3  LYS  52          3HB       LYS  52  -3.405  17.194  -1.747
  408    HG2  LYS  52          2HG       LYS  52  -2.862  17.942   0.685
  409    HG3  LYS  52          3HG       LYS  52  -3.123  19.564   0.041
  410    HD2  LYS  52          2HD       LYS  52  -5.338  18.795  -0.807
  411    HD3  LYS  52          3HD       LYS  52  -5.072  17.262   0.025
  412    HE2  LYS  52          2HE       LYS  52  -4.677  18.760   2.109
  413    HE3  LYS  52          3HE       LYS  52  -5.527  19.989   1.172
  414    HZ1  LYS  52          1HZ       LYS  52  -6.543  17.549   2.388
  415    HZ2  LYS  52          2HZ       LYS  52  -7.183  17.946   0.874
  416    HZ3  LYS  52          3HZ       LYS  52  -7.304  19.043   2.156
  417    H    LEU  53           H        LEU  53  -1.033  19.843  -2.758
  418    HA   LEU  53           HA       LEU  53  -0.872  18.981  -5.371
  419    HB2  LEU  53          2HB       LEU  53  -0.586  21.389  -4.030
  420    HB3  LEU  53          3HB       LEU  53   0.958  21.172  -4.852
  421    HG   LEU  53           HG       LEU  53  -0.477  20.763  -6.960
  422   HD11  LEU  53          1HD1      LEU  53  -2.593  20.641  -5.549
  423   HD12  LEU  53          2HD1      LEU  53  -2.655  21.630  -7.007
  424   HD13  LEU  53          3HD1      LEU  53  -2.478  22.396  -5.429
  425   HD21  LEU  53          1HD2      LEU  53   0.670  22.678  -7.229
  426   HD22  LEU  53          2HD2      LEU  53   0.295  23.255  -5.605
  427   HD23  LEU  53          3HD2      LEU  53  -0.887  23.439  -6.901
  428    H    LEU  54           H        LEU  54   1.539  18.848  -2.875
  429    HA   LEU  54           HA       LEU  54   3.773  18.417  -4.604
  430    HB2  LEU  54          2HB       LEU  54   4.090  19.297  -2.374
  431    HB3  LEU  54          3HB       LEU  54   3.379  17.846  -1.671
  432    HG   LEU  54           HG       LEU  54   5.950  18.155  -1.639
  433   HD11  LEU  54          1HD1      LEU  54   4.499  16.082  -1.147
  434   HD12  LEU  54          2HD1      LEU  54   6.218  15.857  -1.469
  435   HD13  LEU  54          3HD1      LEU  54   5.034  15.524  -2.733
  436   HD21  LEU  54          1HD2      LEU  54   5.707  16.929  -4.371
  437   HD22  LEU  54          2HD2      LEU  54   7.157  17.503  -3.547
  438   HD23  LEU  54          3HD2      LEU  54   5.960  18.659  -4.135
  439    H    GLU  55           H        GLU  55   2.041  16.227  -2.378
  440    HA   GLU  55           HA       GLU  55   3.260  13.871  -3.283
  441    HB2  GLU  55          2HB       GLU  55   1.774  14.337  -1.185
  442    HB3  GLU  55          3HB       GLU  55   0.447  13.885  -2.246
  443    HG2  GLU  55          2HG       GLU  55   2.056  11.816  -2.707
  444    HG3  GLU  55          3HG       GLU  55   2.599  12.227  -1.082
  445    H    CYS  56           H        CYS  56  -0.053  15.009  -3.975
  446    HA   CYS  56           HA       CYS  56   0.183  13.843  -6.656
  447    HB2  CYS  56          2HB       CYS  56  -1.706  13.071  -4.524
  448    HB3  CYS  56          3HB       CYS  56  -2.434  13.341  -6.103
  449    HG   CYS  56           HG       CYS  56  -0.347  11.555  -7.242
  450    H    LEU  57           H        LEU  57   0.186  15.704  -7.796
  451    HA   LEU  57           HA       LEU  57  -1.090  18.080  -7.205
  452    HB2  LEU  57          2HB       LEU  57  -0.636  18.758  -9.390
  453    HB3  LEU  57          3HB       LEU  57   0.619  17.577  -9.022
  454    HG   LEU  57           HG       LEU  57  -1.481  16.150 -10.238
  455   HD11  LEU  57          1HD1      LEU  57  -2.377  18.252 -11.066
  456   HD12  LEU  57          2HD1      LEU  57  -1.697  17.303 -12.387
  457   HD13  LEU  57          3HD1      LEU  57  -0.802  18.677 -11.738
  458   HD21  LEU  57          1HD2      LEU  57   0.351  16.264 -12.162
  459   HD22  LEU  57          2HD2      LEU  57   0.582  15.314 -10.693
  460   HD23  LEU  57          3HD2      LEU  57   1.321  16.910 -10.837
  461    H    ASP  58           H        ASP  58  -3.011  19.065  -7.955
  462    HA   ASP  58           HA       ASP  58  -4.990  17.724  -9.455
  463    HB2  ASP  58          2HB       ASP  58  -5.263  16.296  -7.534
  464    HB3  ASP  58          3HB       ASP  58  -5.332  17.684  -6.452
  465    H    TYR  59           H        TYR  59  -4.636  19.918 -10.305
  466    HA   TYR  59           HA       TYR  59  -6.079  21.980  -8.782
  467    HB2  TYR  59          2HB       TYR  59  -4.916  23.623 -10.160
  468    HB3  TYR  59          3HB       TYR  59  -3.757  22.546  -9.389
  469    HD1  TYR  59           HD1      TYR  59  -2.457  20.969 -10.701
  470    HD2  TYR  59           HD2      TYR  59  -5.272  23.559 -12.565
  471    HE1  TYR  59           HE1      TYR  59  -1.467  20.458 -12.893
  472    HE2  TYR  59           HE2      TYR  59  -4.290  23.054 -14.763
  473    HH   TYR  59           HH       TYR  59  -1.603  20.755 -15.090
  474    H    LEU  60           H        LEU  60  -6.809  23.729 -10.679
  475    HA   LEU  60           HA       LEU  60  -9.143  22.602 -11.761
  476    HB2  LEU  60          2HB       LEU  60  -8.060  25.160 -11.443
  477    HB3  LEU  60          3HB       LEU  60  -8.323  24.976 -13.176
  478    HG   LEU  60           HG       LEU  60 -10.694  24.412 -12.707
  479   HD11  LEU  60          1HD1      LEU  60 -10.775  23.578 -10.549
  480   HD12  LEU  60          2HD1      LEU  60 -11.451  25.196 -10.363
  481   HD13  LEU  60          3HD1      LEU  60  -9.779  24.880  -9.897
  482   HD21  LEU  60          1HD2      LEU  60 -11.146  26.569 -13.000
  483   HD22  LEU  60          2HD2      LEU  60  -9.437  26.897 -12.709
  484   HD23  LEU  60          3HD2      LEU  60 -10.590  26.971 -11.376
  Start of MODEL    8
    1    H    LEU   1           H        LEU   1   6.500   0.959   5.664
    2    HA   LEU   1           HA       LEU   1   8.172   3.153   5.617
    3    HB2  LEU   1          2HB       LEU   1   9.654   0.581   6.135
    4    HB3  LEU   1          3HB       LEU   1  10.411   2.067   5.566
    5    HG   LEU   1           HG       LEU   1   8.967   1.799   8.200
    6   HD11  LEU   1          1HD1      LEU   1  11.941   1.901   7.775
    7   HD12  LEU   1          2HD1      LEU   1  11.050   0.389   7.953
    8   HD13  LEU   1          3HD1      LEU   1  11.059   1.566   9.266
    9   HD21  LEU   1          1HD2      LEU   1  10.036   4.025   6.693
   10   HD22  LEU   1          2HD2      LEU   1  10.799   3.884   8.278
   11   HD23  LEU   1          3HD2      LEU   1   9.044   4.022   8.152
   12    H    LYS   2           H        LYS   2   8.855   3.592   3.561
   13    HA   LYS   2           HA       LYS   2   9.051   1.501   1.576
   14    HB2  LYS   2          2HB       LYS   2   6.647   3.141   1.858
   15    HB3  LYS   2          3HB       LYS   2   7.352   3.231   0.250
   16    HG2  LYS   2          2HG       LYS   2   7.416   0.549   0.738
   17    HG3  LYS   2          3HG       LYS   2   5.934   1.041   1.562
   18    HD2  LYS   2          2HD       LYS   2   6.562   1.872  -1.260
   19    HD3  LYS   2          3HD       LYS   2   5.722   0.366  -0.883
   20    HE2  LYS   2          2HE       LYS   2   4.371   2.255   0.611
   21    HE3  LYS   2          3HE       LYS   2   4.740   3.105  -0.889
   22    HZ1  LYS   2          1HZ       LYS   2   3.442   0.439  -0.769
   23    HZ2  LYS   2          2HZ       LYS   2   3.657   1.405  -2.140
   24    HZ3  LYS   2          3HZ       LYS   2   2.597   1.897  -0.917
   25    H    GLU   3           H        GLU   3   9.752   2.351  -0.539
   26    HA   GLU   3           HA       GLU   3  10.903   5.042  -0.433
   27    HB2  GLU   3          2HB       GLU   3  12.472   2.901   0.125
   28    HB3  GLU   3          3HB       GLU   3  12.654   2.982  -1.621
   29    HG2  GLU   3          2HG       GLU   3  13.869   4.867  -1.543
   30    HG3  GLU   3          3HG       GLU   3  12.928   5.546  -0.217
   31    H    ASN   4           H        ASN   4   8.655   3.800  -1.867
   32    HA   ASN   4           HA       ASN   4   9.557   3.671  -4.628
   33    HB2  ASN   4          2HB       ASN   4   7.345   2.632  -3.165
   34    HB3  ASN   4          3HB       ASN   4   6.709   3.670  -4.437
   35   HD21  ASN   4          1HD2      ASN   4   8.980   1.027  -3.855
   36   HD22  ASN   4          2HD2      ASN   4   8.763   0.269  -5.392
   37    H    ASP   5           H        ASP   5   8.039   4.864  -6.239
   38    HA   ASP   5           HA       ASP   5   8.512   7.585  -6.067
   39    HB2  ASP   5          2HB       ASP   5   6.710   5.889  -7.734
   40    HB3  ASP   5          3HB       ASP   5   6.483   7.635  -7.779
   41    H    HIS   6           H        HIS   6   5.334   6.002  -5.699
   42    HA   HIS   6           HA       HIS   6   3.952   8.260  -4.819
   43    HB2  HIS   6          2HB       HIS   6   3.036   5.967  -5.552
   44    HB3  HIS   6          3HB       HIS   6   3.295   5.475  -3.881
   45    HD1  HIS   6           HD1      HIS   6   0.629   5.153  -3.906
   46    HD2  HIS   6           HD2      HIS   6   2.007   9.066  -4.142
   47    HE1  HIS   6           HE1      HIS   6  -1.346   6.597  -3.326
   48    H    ALA   7           H        ALA   7   6.153   6.187  -3.156
   49    HA   ALA   7           HA       ALA   7   5.309   6.756  -0.500
   50    HB1  ALA   7          1HB       ALA   7   8.143   6.064  -1.075
   51    HB2  ALA   7          2HB       ALA   7   7.064   5.465   0.186
   52    HB3  ALA   7          3HB       ALA   7   6.893   4.883  -1.470
   53    H    ARG   8           H        ARG   8   8.222   7.849  -2.257
   54    HA   ARG   8           HA       ARG   8   9.043   9.769  -0.441
   55    HB2  ARG   8          2HB       ARG   8  10.185  10.848  -2.401
   56    HB3  ARG   8          3HB       ARG   8  10.507   9.129  -2.217
   57    HG2  ARG   8          2HG       ARG   8   8.907   8.621  -3.973
   58    HG3  ARG   8          3HG       ARG   8   8.526  10.337  -4.137
   59    HD2  ARG   8          2HD       ARG   8  11.358   9.435  -4.401
   60    HD3  ARG   8          3HD       ARG   8  10.246   9.184  -5.746
   61    HE   ARG   8           HE       ARG   8  10.131  11.859  -4.793
   62   HH11  ARG   8          1HH1      ARG   8  12.733  10.930  -7.690
   63   HH12  ARG   8          2HH1      ARG   8  12.045   9.675  -6.713
   64   HH21  ARG   8          1HH2      ARG   8  12.155  13.116  -7.325
   65   HH22  ARG   8          2HH2      ARG   8  11.029  13.520  -6.073
   66    H    PHE   9           H        PHE   9   6.535   9.924  -2.864
   67    HA   PHE   9           HA       PHE   9   6.214  12.756  -2.814
   68    HB2  PHE   9          2HB       PHE   9   4.811  10.451  -4.012
   69    HB3  PHE   9          3HB       PHE   9   3.799  11.851  -3.671
   70    HD1  PHE   9           HD1      PHE   9   3.832  13.728  -5.066
   71    HD2  PHE   9           HD2      PHE   9   6.861  10.763  -5.444
   72    HE1  PHE   9           HE1      PHE   9   4.621  14.803  -7.135
   73    HE2  PHE   9           HE2      PHE   9   7.656  11.833  -7.512
   74    HZ   PHE   9           HZ       PHE   9   6.536  13.856  -8.360
   75    H    LEU  10           H        LEU  10   4.173  10.136  -1.509
   76    HA   LEU  10           HA       LEU  10   2.433  11.763  -0.059
   77    HB2  LEU  10          2HB       LEU  10   2.728   9.060  -0.505
   78    HB3  LEU  10          3HB       LEU  10   2.998   9.212   1.230
   79    HG   LEU  10           HG       LEU  10   0.662  10.699   0.488
   80   HD11  LEU  10          1HD1      LEU  10   0.243   9.361  -1.366
   81   HD12  LEU  10          2HD1      LEU  10  -0.676   8.580  -0.080
   82   HD13  LEU  10          3HD1      LEU  10   0.875   7.911  -0.586
   83   HD21  LEU  10          1HD2      LEU  10  -0.125   9.801   2.398
   84   HD22  LEU  10          2HD2      LEU  10   1.561   9.343   2.640
   85   HD23  LEU  10          3HD2      LEU  10   0.415   8.174   1.983
   86    H    GLN  11           H        GLN  11   5.469  10.222   0.926
   87    HA   GLN  11           HA       GLN  11   5.435  10.878   3.626
   88    HB2  GLN  11          2HB       GLN  11   7.084   9.376   2.497
   89    HB3  GLN  11          3HB       GLN  11   7.877  10.804   1.847
   90    HG2  GLN  11          2HG       GLN  11   7.611  11.166   4.641
   91    HG3  GLN  11          3HG       GLN  11   8.251   9.548   4.362
   92   HE21  GLN  11          1HE2      GLN  11  10.058   9.471   2.720
   93   HE22  GLN  11          2HE2      GLN  11  11.252  10.715   2.826
   94    H    THR  12           H        THR  12   6.772  12.729   0.900
   95    HA   THR  12           HA       THR  12   7.742  14.900   2.369
   96    HB   THR  12           HB       THR  12   6.793  14.675  -0.481
   97    HG1  THR  12           HG1      THR  12   9.010  14.759  -0.880
   98   HG21  THR  12          1HG2      THR  12   7.923  17.097   0.922
   99   HG22  THR  12          2HG2      THR  12   6.363  16.961   0.112
  100   HG23  THR  12          3HG2      THR  12   7.852  16.913  -0.830
  101    H    ALA  13           H        ALA  13   4.630  14.569   0.660
  102    HA   ALA  13           HA       ALA  13   3.509  17.005   1.288
  103    HB1  ALA  13          1HB       ALA  13   1.896  16.091   0.071
  104    HB2  ALA  13          2HB       ALA  13   2.581  14.483   0.310
  105    HB3  ALA  13          3HB       ALA  13   1.420  15.129   1.470
  106    H    LYS  14           H        LYS  14   3.150  13.980   3.145
  107    HA   LYS  14           HA       LYS  14   1.712  15.109   5.278
  108    HB2  LYS  14          2HB       LYS  14   3.005  12.568   4.677
  109    HB3  LYS  14          3HB       LYS  14   3.129  12.989   6.380
  110    HG2  LYS  14          2HG       LYS  14   0.489  13.534   5.732
  111    HG3  LYS  14          3HG       LYS  14   0.857  12.039   4.869
  112    HD2  LYS  14          2HD       LYS  14   1.675  11.044   6.955
  113    HD3  LYS  14          3HD       LYS  14   1.295  12.538   7.814
  114    HE2  LYS  14          2HE       LYS  14  -1.083  12.244   7.097
  115    HE3  LYS  14          3HE       LYS  14  -0.637  10.663   6.458
  116    HZ1  LYS  14          1HZ       LYS  14   0.070  11.245   9.232
  117    HZ2  LYS  14          2HZ       LYS  14  -0.412   9.787   8.523
  118    HZ3  LYS  14          3HZ       LYS  14  -1.564  10.971   8.891
  119    H    ASN  15           H        ASN  15   5.187  14.503   4.872
  120    HA   ASN  15           HA       ASN  15   6.079  15.273   7.376
  121    HB2  ASN  15          2HB       ASN  15   7.545  14.261   5.699
  122    HB3  ASN  15          3HB       ASN  15   7.431  15.709   4.703
  123   HD21  ASN  15          1HD2      ASN  15   9.460  16.441   4.726
  124   HD22  ASN  15          2HD2      ASN  15  10.346  16.857   6.150
  125    H    ILE  16           H        ILE  16   5.006  17.234   4.697
  126    HA   ILE  16           HA       ILE  16   6.059  19.708   5.582
  127    HB   ILE  16           HB       ILE  16   3.682  19.124   3.814
  128   HG12  ILE  16          2HG1      ILE  16   6.228  20.279   2.801
  129   HG13  ILE  16          3HG1      ILE  16   6.248  18.580   3.259
  130   HG21  ILE  16          1HG2      ILE  16   3.192  21.275   4.356
  131   HG22  ILE  16          2HG2      ILE  16   4.859  21.666   4.778
  132   HG23  ILE  16          3HG2      ILE  16   4.373  21.588   3.085
  133   HD11  ILE  16          1HD1      ILE  16   3.941  19.170   1.650
  134   HD12  ILE  16          2HD1      ILE  16   5.425  19.669   0.838
  135   HD13  ILE  16          3HD1      ILE  16   5.234  18.002   1.382
  136    H    THR  17           H        THR  17   2.843  18.230   5.940
  137    HA   THR  17           HA       THR  17   1.869  20.361   7.597
  138    HB   THR  17           HB       THR  17   0.439  17.796   7.749
  139    HG1  THR  17           HG1      THR  17  -0.192  17.844   5.568
  140   HG21  THR  17          1HG2      THR  17  -1.453  19.139   7.528
  141   HG22  THR  17          2HG2      THR  17  -0.583  20.387   6.636
  142   HG23  THR  17          3HG2      THR  17  -0.317  20.193   8.368
  143    H    GLU  18           H        GLU  18   3.540  17.378   8.112
  144    HA   GLU  18           HA       GLU  18   2.821  17.134  10.889
  145    HB2  GLU  18          2HB       GLU  18   4.685  15.695   9.041
  146    HB3  GLU  18          3HB       GLU  18   4.853  15.477  10.777
  147    HG2  GLU  18          2HG       GLU  18   2.336  14.939  10.733
  148    HG3  GLU  18          3HG       GLU  18   2.572  14.724   8.999
  149    H    ARG  19           H        ARG  19   5.573  18.341   9.043
  150    HA   ARG  19           HA       ARG  19   7.249  18.820  11.286
  151    HB2  ARG  19          2HB       ARG  19   7.972  18.618   8.863
  152    HB3  ARG  19          3HB       ARG  19   7.365  20.252   8.633
  153    HG2  ARG  19          2HG       ARG  19   8.992  20.492  10.840
  154    HG3  ARG  19          3HG       ARG  19   9.849  19.335   9.819
  155    HD2  ARG  19          2HD       ARG  19   9.576  20.933   7.918
  156    HD3  ARG  19          3HD       ARG  19   8.914  22.099   9.063
  157    HE   ARG  19           HE       ARG  19  11.661  21.466   8.665
  158   HH11  ARG  19          1HH1      ARG  19  10.512  23.204  12.084
  159   HH12  ARG  19          2HH1      ARG  19   9.338  22.426  11.074
  160   HH21  ARG  19          1HH2      ARG  19  12.717  23.239  11.464
  161   HH22  ARG  19          2HH2      ARG  19  13.216  22.487   9.986
  162    H    VAL  20           H        VAL  20   5.091  20.898   9.380
  163    HA   VAL  20           HA       VAL  20   5.621  23.327  10.620
  164    HB   VAL  20           HB       VAL  20   4.268  23.248   8.628
  165   HG11  VAL  20          1HG1      VAL  20   2.114  22.269   8.493
  166   HG12  VAL  20          2HG1      VAL  20   3.165  21.062   9.236
  167   HG13  VAL  20          3HG1      VAL  20   2.052  21.997  10.235
  168   HG21  VAL  20          1HG2      VAL  20   2.691  24.274  10.986
  169   HG22  VAL  20          2HG2      VAL  20   3.921  25.158  10.084
  170   HG23  VAL  20          3HG2      VAL  20   2.405  24.712   9.301
  171    H    SER  21           H        SER  21   3.259  20.829  11.503
  172    HA   SER  21           HA       SER  21   2.041  22.161  13.627
  173    HB2  SER  21          2HB       SER  21   1.809  19.662  12.464
  174    HB3  SER  21          3HB       SER  21   2.365  19.293  14.097
  175    HG   SER  21           HG       SER  21   0.179  19.423  14.232
  176    H    MET  22           H        MET  22   4.830  19.954  13.655
  177    HA   MET  22           HA       MET  22   5.318  19.959  16.393
  178    HB2  MET  22          2HB       MET  22   6.814  19.282  13.968
  179    HB3  MET  22          3HB       MET  22   7.838  19.806  15.298
  180    HG2  MET  22          2HG       MET  22   6.662  18.119  16.734
  181    HG3  MET  22          3HG       MET  22   5.899  17.513  15.266
  182    HE1  MET  22          1HE       MET  22   7.236  17.318  13.195
  183    HE2  MET  22          2HE       MET  22   8.970  17.022  13.079
  184    HE3  MET  22          3HE       MET  22   7.864  15.680  13.379
  185    H    ALA  23           H        ALA  23   6.411  22.205  13.890
  186    HA   ALA  23           HA       ALA  23   8.147  23.728  15.493
  187    HB1  ALA  23          1HB       ALA  23   7.950  25.444  13.765
  188    HB2  ALA  23          2HB       ALA  23   8.165  23.843  13.057
  189    HB3  ALA  23          3HB       ALA  23   6.569  24.593  13.072
  190    H    THR  24           H        THR  24   4.833  24.539  14.437
  191    HA   THR  24           HA       THR  24   4.488  26.800  16.000
  192    HB   THR  24           HB       THR  24   2.027  25.267  15.838
  193    HG1  THR  24           HG1      THR  24   3.287  25.760  13.344
  194   HG21  THR  24          1HG2      THR  24   3.099  27.905  15.041
  195   HG22  THR  24          2HG2      THR  24   1.584  27.491  15.845
  196   HG23  THR  24          3HG2      THR  24   1.737  27.300  14.099
  197    H    ALA  25           H        ALA  25   4.362  23.444  16.897
  198    HA   ALA  25           HA       ALA  25   3.039  23.893  19.414
  199    HB1  ALA  25          1HB       ALA  25   4.135  21.569  17.958
  200    HB2  ALA  25          2HB       ALA  25   4.100  21.450  19.718
  201    HB3  ALA  25          3HB       ALA  25   2.610  21.753  18.824
  202    H    SER  26           H        SER  26   6.316  23.799  18.247
  203    HA   SER  26           HA       SER  26   7.353  23.882  20.990
  204    HB2  SER  26          2HB       SER  26   8.320  22.759  18.525
  205    HB3  SER  26          3HB       SER  26   9.491  23.926  19.140
  206    HG   SER  26           HG       SER  26   9.716  22.759  20.967
  207    H    SER  27           H        SER  27   6.161  26.030  18.954
  208    HA   SER  27           HA       SER  27   8.278  28.033  19.327
  209    HB2  SER  27          2HB       SER  27   7.490  27.757  17.019
  210    HB3  SER  27          3HB       SER  27   5.838  28.098  17.533
  211    HG   SER  27           HG       SER  27   8.015  29.825  17.251
  212    H    GLN  28           H        GLN  28   4.910  27.322  20.015
  213    HA   GLN  28           HA       GLN  28   4.894  29.568  21.915
  214    HB2  GLN  28          2HB       GLN  28   2.979  28.946  19.746
  215    HB3  GLN  28          3HB       GLN  28   2.273  29.406  21.289
  216    HG2  GLN  28          2HG       GLN  28   2.485  31.488  20.517
  217    HG3  GLN  28          3HG       GLN  28   4.172  31.316  20.997
  218   HE21  GLN  28          1HE2      GLN  28   2.973  32.948  18.894
  219   HE22  GLN  28          2HE2      GLN  28   3.746  32.473  17.424
  220    H    VAL  29           H        VAL  29   2.509  27.067  21.095
  221    HA   VAL  29           HA       VAL  29   3.026  25.348  23.245
  222    HB   VAL  29           HB       VAL  29   2.366  27.172  24.696
  223   HG11  VAL  29          1HG1      VAL  29   1.037  28.464  23.127
  224   HG12  VAL  29          2HG1      VAL  29  -0.208  27.213  23.123
  225   HG13  VAL  29          3HG1      VAL  29   0.110  28.138  24.591
  226   HG21  VAL  29          1HG2      VAL  29   1.714  24.875  25.304
  227   HG22  VAL  29          2HG2      VAL  29   0.594  26.080  25.939
  228   HG23  VAL  29          3HG2      VAL  29   0.154  25.127  24.521
  229    H    LEU  30           H        LEU  30   0.674  26.753  21.059
  230    HA   LEU  30           HA       LEU  30  -0.894  25.812  19.706
  231    HB2  LEU  30          2HB       LEU  30   1.058  24.076  19.561
  232    HB3  LEU  30          3HB       LEU  30  -0.035  23.068  20.506
  233    HG   LEU  30           HG       LEU  30  -1.599  23.978  18.400
  234   HD11  LEU  30          1HD1      LEU  30   1.232  23.778  17.601
  235   HD12  LEU  30          2HD1      LEU  30  -0.095  24.685  16.876
  236   HD13  LEU  30          3HD1      LEU  30   0.069  22.957  16.561
  237   HD21  LEU  30          1HD2      LEU  30  -0.800  21.494  17.614
  238   HD22  LEU  30          2HD2      LEU  30  -2.049  21.823  18.816
  239   HD23  LEU  30          3HD2      LEU  30  -0.397  21.476  19.331
  240    H    ILE  31           H        ILE  31  -2.207  26.674  21.600
  241    HA   ILE  31           HA       ILE  31  -4.056  24.584  22.402
  242    HB   ILE  31           HB       ILE  31  -4.094  25.343  24.768
  243   HG12  ILE  31          2HG1      ILE  31  -1.502  26.399  25.052
  244   HG13  ILE  31          3HG1      ILE  31  -2.235  27.288  23.721
  245   HG21  ILE  31          1HG2      ILE  31  -1.471  24.227  23.786
  246   HG22  ILE  31          2HG2      ILE  31  -2.054  24.147  25.447
  247   HG23  ILE  31          3HG2      ILE  31  -2.926  23.307  24.165
  248   HD11  ILE  31          1HD1      ILE  31  -4.177  27.759  25.201
  249   HD12  ILE  31          2HD1      ILE  31  -3.276  27.022  26.526
  250   HD13  ILE  31          3HD1      ILE  31  -2.657  28.473  25.739
  251    HA   PRO  32           HA       PRO  32  -7.045  27.729  21.727
  252    HB2  PRO  32          2HB       PRO  32  -9.024  26.928  23.405
  253    HB3  PRO  32          3HB       PRO  32  -8.637  26.081  21.902
  254    HG2  PRO  32          2HG       PRO  32  -7.834  25.422  24.710
  255    HG3  PRO  32          3HG       PRO  32  -8.397  24.339  23.423
  256    HD2  PRO  32          2HD       PRO  32  -5.779  24.606  24.060
  257    HD3  PRO  32          3HD       PRO  32  -6.330  24.266  22.407
  258    H    GLU  33           H        GLU  33  -6.400  29.699  22.446
  259    HA   GLU  33           HA       GLU  33  -6.751  30.272  25.316
  260    HB2  GLU  33          2HB       GLU  33  -4.579  30.878  23.466
  261    HB3  GLU  33          3HB       GLU  33  -5.168  32.308  24.302
  262    HG2  GLU  33          2HG       GLU  33  -4.879  30.155  26.164
  263    HG3  GLU  33          3HG       GLU  33  -3.386  30.365  25.251
  264    H    ILE  34           H        ILE  34  -6.380  32.350  22.458
  265    HA   ILE  34           HA       ILE  34  -9.100  33.348  22.803
  266    HB   ILE  34           HB       ILE  34  -6.681  35.154  22.892
  267   HG12  ILE  34          2HG1      ILE  34  -7.237  33.997  25.024
  268   HG13  ILE  34          3HG1      ILE  34  -7.432  35.743  25.119
  269   HG21  ILE  34          1HG2      ILE  34  -8.801  36.751  23.420
  270   HG22  ILE  34          2HG2      ILE  34  -8.064  36.572  21.829
  271   HG23  ILE  34          3HG2      ILE  34  -9.504  35.643  22.243
  272   HD11  ILE  34          1HD1      ILE  34  -9.538  35.511  25.742
  273   HD12  ILE  34          2HD1      ILE  34  -9.898  34.533  24.319
  274   HD13  ILE  34          3HD1      ILE  34  -9.292  33.766  25.787
  275    H    ASN  35           H        ASN  35  -6.112  34.228  21.054
  276    HA   ASN  35           HA       ASN  35  -7.613  33.936  18.538
  277    HB2  ASN  35          2HB       ASN  35  -7.126  36.352  19.332
  278    HB3  ASN  35          3HB       ASN  35  -5.458  36.006  18.884
  279   HD21  ASN  35          1HD2      ASN  35  -4.958  36.733  16.961
  280   HD22  ASN  35          2HD2      ASN  35  -6.007  36.815  15.590
  281    H    LEU  36           H        LEU  36  -6.171  31.850  19.530
  282    HA   LEU  36           HA       LEU  36  -3.677  31.877  17.966
  283    HB2  LEU  36          2HB       LEU  36  -3.177  31.431  20.232
  284    HB3  LEU  36          3HB       LEU  36  -4.515  30.293  20.378
  285    HG   LEU  36           HG       LEU  36  -2.332  29.642  18.466
  286   HD11  LEU  36          1HD1      LEU  36  -1.428  30.475  20.782
  287   HD12  LEU  36          2HD1      LEU  36  -0.780  29.018  20.030
  288   HD13  LEU  36          3HD1      LEU  36  -1.971  28.887  21.324
  289   HD21  LEU  36          1HD2      LEU  36  -2.952  27.430  19.949
  290   HD22  LEU  36          2HD2      LEU  36  -3.689  27.864  18.406
  291   HD23  LEU  36          3HD2      LEU  36  -4.484  28.302  19.919
  292    H    ASN  37           H        ASN  37  -6.813  30.575  18.170
  293    HA   ASN  37           HA       ASN  37  -6.257  28.135  16.744
  294    HB2  ASN  37          2HB       ASN  37  -8.885  29.504  17.361
  295    HB3  ASN  37          3HB       ASN  37  -8.717  27.887  16.684
  296   HD21  ASN  37          1HD2      ASN  37 -10.012  28.643  19.127
  297   HD22  ASN  37          2HD2      ASN  37  -9.189  27.826  20.408
  298    H    ASP  38           H        ASP  38  -6.882  31.405  15.935
  299    HA   ASP  38           HA       ASP  38  -7.860  30.852  13.272
  300    HB2  ASP  38          2HB       ASP  38  -8.724  32.839  14.209
  301    HB3  ASP  38          3HB       ASP  38  -7.135  33.371  14.754
  302    H    THR  39           H        THR  39  -4.907  32.277  14.660
  303    HA   THR  39           HA       THR  39  -3.502  32.631  12.281
  304    HB   THR  39           HB       THR  39  -1.880  31.791  14.603
  305    HG1  THR  39           HG1      THR  39  -3.276  34.245  14.792
  306   HG21  THR  39          1HG2      THR  39  -1.857  34.454  13.224
  307   HG22  THR  39          2HG2      THR  39  -1.181  33.027  12.437
  308   HG23  THR  39          3HG2      THR  39  -0.525  33.579  13.978
  309    H    PHE  40           H        PHE  40  -3.461  29.860  14.516
  310    HA   PHE  40           HA       PHE  40  -1.624  28.295  13.102
  311    HB2  PHE  40          2HB       PHE  40  -2.467  27.895  15.448
  312    HB3  PHE  40          3HB       PHE  40  -3.935  27.236  14.733
  313    HD1  PHE  40           HD1      PHE  40  -0.390  26.825  13.691
  314    HD2  PHE  40           HD2      PHE  40  -3.900  24.977  15.233
  315    HE1  PHE  40           HE1      PHE  40   0.693  24.623  13.509
  316    HE2  PHE  40           HE2      PHE  40  -2.822  22.773  15.055
  317    HZ   PHE  40           HZ       PHE  40  -0.522  22.594  14.193
  318    H    ASP  41           H        ASP  41  -5.151  28.484  12.875
  319    HA   ASP  41           HA       ASP  41  -5.571  26.390  11.083
  320    HB2  ASP  41          2HB       ASP  41  -7.081  28.639  12.104
  321    HB3  ASP  41          3HB       ASP  41  -7.433  28.370  10.400
  322    H    THR  42           H        THR  42  -5.392  29.865  10.287
  323    HA   THR  42           HA       THR  42  -5.315  29.557   7.516
  324    HB   THR  42           HB       THR  42  -5.480  31.712   9.085
  325    HG1  THR  42           HG1      THR  42  -5.317  32.884   7.177
  326   HG21  THR  42          1HG2      THR  42  -2.996  31.422   9.633
  327   HG22  THR  42          2HG2      THR  42  -3.532  33.029   9.144
  328   HG23  THR  42          3HG2      THR  42  -2.692  31.991   7.993
  329    H    PHE  43           H        PHE  43  -2.830  29.162   9.900
  330    HA   PHE  43           HA       PHE  43  -0.611  29.397   8.117
  331    HB2  PHE  43          2HB       PHE  43  -0.474  29.708  10.599
  332    HB3  PHE  43          3HB       PHE  43  -0.712  27.973  10.783
  333    HD1  PHE  43           HD1      PHE  43   1.306  27.277  11.717
  334    HD2  PHE  43           HD2      PHE  43   1.333  29.731   8.240
  335    HE1  PHE  43           HE1      PHE  43   3.730  26.920  11.488
  336    HE2  PHE  43           HE2      PHE  43   3.757  29.377   8.005
  337    HZ   PHE  43           HZ       PHE  43   4.958  27.970   9.630
  338    H    ALA  44           H        ALA  44  -1.973  26.557   9.797
  339    HA   ALA  44           HA       ALA  44  -0.542  24.620   8.400
  340    HB1  ALA  44          1HB       ALA  44  -3.222  23.744   9.102
  341    HB2  ALA  44          2HB       ALA  44  -1.657  23.198   9.707
  342    HB3  ALA  44          3HB       ALA  44  -2.428  24.619  10.412
  343    H    LEU  45           H        LEU  45  -3.768  25.954   7.728
  344    HA   LEU  45           HA       LEU  45  -4.572  24.421   5.621
  345    HB2  LEU  45          2HB       LEU  45  -6.134  25.983   6.184
  346    HB3  LEU  45          3HB       LEU  45  -4.944  27.273   6.344
  347    HG   LEU  45           HG       LEU  45  -4.856  27.534   3.936
  348   HD11  LEU  45          1HD1      LEU  45  -5.348  25.823   2.616
  349   HD12  LEU  45          2HD1      LEU  45  -7.049  26.041   3.027
  350   HD13  LEU  45          3HD1      LEU  45  -6.052  24.929   3.964
  351   HD21  LEU  45          1HD2      LEU  45  -6.470  28.934   4.834
  352   HD22  LEU  45          2HD2      LEU  45  -7.533  27.596   5.273
  353   HD23  LEU  45          3HD2      LEU  45  -7.362  28.070   3.582
  354    H    ASP  46           H        ASP  46  -2.734  27.459   5.252
  355    HA   ASP  46           HA       ASP  46  -2.259  27.360   2.552
  356    HB2  ASP  46          2HB       ASP  46  -1.435  28.978   4.597
  357    HB3  ASP  46          3HB       ASP  46   0.081  28.220   4.116
  358    H    PHE  47           H        PHE  47  -0.249  25.928   5.114
  359    HA   PHE  47           HA       PHE  47   1.731  24.841   3.483
  360    HB2  PHE  47          2HB       PHE  47   0.833  24.518   6.238
  361    HB3  PHE  47          3HB       PHE  47   1.474  23.024   5.564
  362    HD1  PHE  47           HD1      PHE  47   3.673  23.684   3.963
  363    HD2  PHE  47           HD2      PHE  47   2.371  25.607   7.530
  364    HE1  PHE  47           HE1      PHE  47   5.964  24.487   4.362
  365    HE2  PHE  47           HE2      PHE  47   4.660  26.413   7.935
  366    HZ   PHE  47           HZ       PHE  47   6.460  25.855   6.349
  367    H    SER  48           H        SER  48  -1.121  23.181   4.838
  368    HA   SER  48           HA       SER  48  -0.816  20.740   3.591
  369    HB2  SER  48          2HB       SER  48  -2.693  21.806   5.236
  370    HB3  SER  48          3HB       SER  48  -3.600  21.731   3.725
  371    HG   SER  48           HG       SER  48  -3.770  19.668   4.019
  372    H    ARG  49           H        ARG  49  -2.423  23.648   2.356
  373    HA   ARG  49           HA       ARG  49  -3.543  22.731   0.040
  374    HB2  ARG  49          2HB       ARG  49  -3.334  25.151   1.050
  375    HB3  ARG  49          3HB       ARG  49  -1.978  25.279  -0.063
  376    HG2  ARG  49          2HG       ARG  49  -4.012  24.228  -1.614
  377    HG3  ARG  49          3HG       ARG  49  -4.821  25.407  -0.580
  378    HD2  ARG  49          2HD       ARG  49  -2.713  26.872  -1.269
  379    HD3  ARG  49          3HD       ARG  49  -2.753  25.805  -2.672
  380    HE   ARG  49           HE       ARG  49  -5.309  26.635  -2.490
  381   HH11  ARG  49          1HH1      ARG  49  -2.918  29.757  -3.242
  382   HH12  ARG  49          2HH1      ARG  49  -2.269  28.331  -2.502
  383   HH21  ARG  49          1HH2      ARG  49  -5.141  29.855  -3.788
  384   HH22  ARG  49          2HH2      ARG  49  -6.176  28.506  -3.465
  385    H    GLU  50           H        GLU  50  -0.151  23.661   0.523
  386    HA   GLU  50           HA       GLU  50   0.628  23.099  -2.158
  387    HB2  GLU  50          2HB       GLU  50   1.841  24.171   0.195
  388    HB3  GLU  50          3HB       GLU  50   2.866  22.881  -0.418
  389    HG2  GLU  50          2HG       GLU  50   2.094  24.402  -2.648
  390    HG3  GLU  50          3HG       GLU  50   2.539  25.549  -1.386
  391    H    LYS  51           H        LYS  51   0.541  21.256   0.824
  392    HA   LYS  51           HA       LYS  51   2.121  19.076   0.013
  393    HB2  LYS  51          2HB       LYS  51   1.773  18.884   2.242
  394    HB3  LYS  51          3HB       LYS  51   0.188  19.640   2.163
  395    HG2  LYS  51          2HG       LYS  51   0.303  16.980   0.953
  396    HG3  LYS  51          3HG       LYS  51   0.650  17.011   2.683
  397    HD2  LYS  51          2HD       LYS  51  -1.448  17.798   3.225
  398    HD3  LYS  51          3HD       LYS  51  -1.699  18.529   1.638
  399    HE2  LYS  51          2HE       LYS  51  -3.091  16.503   2.073
  400    HE3  LYS  51          3HE       LYS  51  -2.075  16.393   0.637
  401    HZ1  LYS  51          1HZ       LYS  51  -0.554  15.000   1.774
  402    HZ2  LYS  51          2HZ       LYS  51  -2.096  14.372   2.072
  403    HZ3  LYS  51          3HZ       LYS  51  -1.302  15.265   3.269
  404    H    LYS  52           H        LYS  52  -1.398  19.567  -0.116
  405    HA   LYS  52           HA       LYS  52  -2.099  17.104  -1.212
  406    HB2  LYS  52          2HB       LYS  52  -3.789  18.586  -0.345
  407    HB3  LYS  52          3HB       LYS  52  -3.382  19.821  -1.529
  408    HG2  LYS  52          2HG       LYS  52  -5.395  18.777  -2.233
  409    HG3  LYS  52          3HG       LYS  52  -4.110  18.239  -3.317
  410    HD2  LYS  52          2HD       LYS  52  -3.990  16.117  -2.268
  411    HD3  LYS  52          3HD       LYS  52  -4.982  16.655  -0.910
  412    HE2  LYS  52          2HE       LYS  52  -6.806  17.061  -2.676
  413    HE3  LYS  52          3HE       LYS  52  -5.812  16.059  -3.732
  414    HZ1  LYS  52          1HZ       LYS  52  -7.684  15.070  -2.150
  415    HZ2  LYS  52          2HZ       LYS  52  -6.374  14.992  -1.083
  416    HZ3  LYS  52          3HZ       LYS  52  -6.297  14.200  -2.576
  417    H    LEU  53           H        LEU  53  -1.530  20.184  -2.918
  418    HA   LEU  53           HA       LEU  53  -1.838  19.286  -5.513
  419    HB2  LEU  53          2HB       LEU  53  -1.236  21.650  -4.419
  420    HB3  LEU  53          3HB       LEU  53   0.364  21.201  -5.006
  421    HG   LEU  53           HG       LEU  53  -1.362  20.757  -7.160
  422   HD11  LEU  53          1HD1      LEU  53  -3.121  22.023  -6.164
  423   HD12  LEU  53          2HD1      LEU  53  -2.381  23.022  -7.413
  424   HD13  LEU  53          3HD1      LEU  53  -2.012  23.318  -5.715
  425   HD21  LEU  53          1HD2      LEU  53   0.434  23.116  -6.602
  426   HD22  LEU  53          2HD2      LEU  53  -0.115  22.567  -8.186
  427   HD23  LEU  53          3HD2      LEU  53   0.964  21.553  -7.226
  428    H    LEU  54           H        LEU  54   0.788  18.763  -3.306
  429    HA   LEU  54           HA       LEU  54   2.735  17.997  -5.237
  430    HB2  LEU  54          2HB       LEU  54   3.021  18.699  -2.757
  431    HB3  LEU  54          3HB       LEU  54   2.714  16.997  -2.417
  432    HG   LEU  54           HG       LEU  54   4.940  17.978  -4.198
  433   HD11  LEU  54          1HD1      LEU  54   4.942  17.296  -1.266
  434   HD12  LEU  54          2HD1      LEU  54   5.398  18.824  -2.019
  435   HD13  LEU  54          3HD1      LEU  54   6.399  17.392  -2.255
  436   HD21  LEU  54          1HD2      LEU  54   5.780  15.623  -3.499
  437   HD22  LEU  54          2HD2      LEU  54   4.569  15.770  -4.774
  438   HD23  LEU  54          3HD2      LEU  54   4.080  15.317  -3.140
  439    H    GLU  55           H        GLU  55   0.874  16.039  -2.902
  440    HA   GLU  55           HA       GLU  55   1.580  13.559  -4.033
  441    HB2  GLU  55          2HB       GLU  55   0.387  14.265  -1.739
  442    HB3  GLU  55          3HB       GLU  55  -1.041  13.809  -2.657
  443    HG2  GLU  55          2HG       GLU  55   1.143  11.878  -2.831
  444    HG3  GLU  55          3HG       GLU  55   0.513  12.111  -1.201
  445    H    CYS  56           H        CYS  56  -1.451  15.418  -4.298
  446    HA   CYS  56           HA       CYS  56  -1.911  14.115  -6.895
  447    HB2  CYS  56          2HB       CYS  56  -3.496  13.845  -4.544
  448    HB3  CYS  56          3HB       CYS  56  -4.421  14.783  -5.710
  449    HG   CYS  56           HG       CYS  56  -4.303  11.629  -5.539
  450    H    LEU  57           H        LEU  57  -1.639  15.687  -8.343
  451    HA   LEU  57           HA       LEU  57  -1.908  18.431  -7.864
  452    HB2  LEU  57          2HB       LEU  57  -2.192  17.044 -10.523
  453    HB3  LEU  57          3HB       LEU  57  -1.727  18.721 -10.244
  454    HG   LEU  57           HG       LEU  57   0.054  16.790  -8.962
  455   HD11  LEU  57          1HD1      LEU  57  -0.633  16.512 -11.818
  456   HD12  LEU  57          2HD1      LEU  57   0.027  15.333 -10.685
  457   HD13  LEU  57          3HD1      LEU  57   1.086  16.535 -11.424
  458   HD21  LEU  57          1HD2      LEU  57   1.114  18.607 -10.978
  459   HD22  LEU  57          2HD2      LEU  57   1.517  18.449  -9.268
  460   HD23  LEU  57          3HD2      LEU  57   0.127  19.418  -9.760
  461    H    ASP  58           H        ASP  58  -3.430  19.837  -9.249
  462    HA   ASP  58           HA       ASP  58  -6.112  18.716  -9.490
  463    HB2  ASP  58          2HB       ASP  58  -5.421  20.027  -7.173
  464    HB3  ASP  58          3HB       ASP  58  -6.129  21.319  -8.138
  465    H    TYR  59           H        TYR  59  -7.606  20.809 -10.084
  466    HA   TYR  59           HA       TYR  59  -6.653  21.605 -12.649
  467    HB2  TYR  59          2HB       TYR  59  -9.148  21.529 -11.297
  468    HB3  TYR  59          3HB       TYR  59  -8.899  23.185 -11.840
  469    HD1  TYR  59           HD1      TYR  59  -7.521  22.886 -14.371
  470    HD2  TYR  59           HD2      TYR  59 -10.675  20.547 -12.733
  471    HE1  TYR  59           HE1      TYR  59  -8.220  22.250 -16.641
  472    HE2  TYR  59           HE2      TYR  59 -11.382  19.903 -14.999
  473    HH   TYR  59           HH       TYR  59  -9.550  20.151 -17.637
  474    H    LEU  60           H        LEU  60  -5.863  23.530 -13.347
  475    HA   LEU  60           HA       LEU  60  -5.121  25.461 -11.267
  476    HB2  LEU  60          2HB       LEU  60  -3.674  24.290 -13.328
  477    HB3  LEU  60          3HB       LEU  60  -3.980  25.933 -13.887
  478    HG   LEU  60           HG       LEU  60  -2.787  25.370 -11.187
  479   HD11  LEU  60          1HD1      LEU  60  -1.552  25.134 -13.836
  480   HD12  LEU  60          2HD1      LEU  60  -1.034  24.494 -12.277
  481   HD13  LEU  60          3HD1      LEU  60  -0.684  26.169 -12.703
  482   HD21  LEU  60          1HD2      LEU  60  -1.781  27.697 -11.869
  483   HD22  LEU  60          2HD2      LEU  60  -3.408  27.577 -11.199
  484   HD23  LEU  60          3HD2      LEU  60  -3.182  27.746 -12.940
  Start of MODEL    9
    1    H    LEU   1           H        LEU   1   9.946   5.270  -0.100
    2    HA   LEU   1           HA       LEU   1  11.009   4.543   2.462
    3    HB2  LEU   1          2HB       LEU   1   8.224   4.760   2.251
    4    HB3  LEU   1          3HB       LEU   1   8.574   3.034   2.180
    5    HG   LEU   1           HG       LEU   1  10.071   3.735   4.312
    6   HD11  LEU   1          1HD1      LEU   1   8.154   5.894   3.897
    7   HD12  LEU   1          2HD1      LEU   1   9.588   5.828   4.922
    8   HD13  LEU   1          3HD1      LEU   1   8.060   5.163   5.499
    9   HD21  LEU   1          1HD2      LEU   1   8.364   1.932   4.102
   10   HD22  LEU   1          2HD2      LEU   1   7.122   3.131   4.461
   11   HD23  LEU   1          3HD2      LEU   1   8.357   2.753   5.663
   12    H    LYS   2           H        LYS   2  12.543   3.252   1.647
   13    HA   LYS   2           HA       LYS   2  13.534   1.452   0.671
   14    HB2  LYS   2          2HB       LYS   2  10.767   0.287   0.369
   15    HB3  LYS   2          3HB       LYS   2  12.293  -0.582   0.458
   16    HG2  LYS   2          2HG       LYS   2  12.548   0.277   2.793
   17    HG3  LYS   2          3HG       LYS   2  10.905   0.909   2.671
   18    HD2  LYS   2          2HD       LYS   2   9.957  -1.195   2.630
   19    HD3  LYS   2          3HD       LYS   2  11.428  -1.959   2.022
   20    HE2  LYS   2          2HE       LYS   2  11.867  -0.740   4.604
   21    HE3  LYS   2          3HE       LYS   2  10.528  -1.886   4.662
   22    HZ1  LYS   2          1HZ       LYS   2  13.172  -2.512   4.802
   23    HZ2  LYS   2          2HZ       LYS   2  12.777  -2.890   3.202
   24    HZ3  LYS   2          3HZ       LYS   2  11.916  -3.597   4.475
   25    H    GLU   3           H        GLU   3  12.843   3.664  -0.954
   26    HA   GLU   3           HA       GLU   3  12.835   4.281  -3.144
   27    HB2  GLU   3          2HB       GLU   3  13.207   1.364  -3.817
   28    HB3  GLU   3          3HB       GLU   3  13.673   2.758  -4.781
   29    HG2  GLU   3          2HG       GLU   3  15.699   2.519  -3.917
   30    HG3  GLU   3          3HG       GLU   3  15.025   3.140  -2.411
   31    H    ASN   4           H        ASN   4  10.841   4.983  -3.624
   32    HA   ASN   4           HA       ASN   4   9.083   3.280  -5.111
   33    HB2  ASN   4          2HB       ASN   4   8.599   3.719  -2.263
   34    HB3  ASN   4          3HB       ASN   4   7.237   4.204  -3.268
   35   HD21  ASN   4          1HD2      ASN   4   7.052   2.469  -5.206
   36   HD22  ASN   4          2HD2      ASN   4   6.877   0.850  -4.626
   37    H    ASP   5           H        ASP   5   6.985   4.530  -5.635
   38    HA   ASP   5           HA       ASP   5   7.765   7.295  -6.236
   39    HB2  ASP   5          2HB       ASP   5   6.004   5.292  -7.581
   40    HB3  ASP   5          3HB       ASP   5   5.651   7.004  -7.803
   41    H    HIS   6           H        HIS   6   4.682   5.596  -5.652
   42    HA   HIS   6           HA       HIS   6   3.302   7.873  -4.768
   43    HB2  HIS   6          2HB       HIS   6   2.283   5.701  -5.550
   44    HB3  HIS   6          3HB       HIS   6   2.690   5.022  -3.977
   45    HD1  HIS   6           HD1      HIS   6   0.383   4.725  -3.033
   46    HD2  HIS   6           HD2      HIS   6   1.038   8.565  -4.477
   47    HE1  HIS   6           HE1      HIS   6  -1.618   6.065  -2.311
   48    H    ALA   7           H        ALA   7   5.472   5.727  -3.142
   49    HA   ALA   7           HA       ALA   7   4.662   6.230  -0.477
   50    HB1  ALA   7          1HB       ALA   7   7.481   5.572  -1.259
   51    HB2  ALA   7          2HB       ALA   7   6.589   5.095   0.187
   52    HB3  ALA   7          3HB       ALA   7   6.191   4.374  -1.372
   53    H    ARG   8           H        ARG   8   7.460   7.508  -2.293
   54    HA   ARG   8           HA       ARG   8   8.242   9.394  -0.392
   55    HB2  ARG   8          2HB       ARG   8   9.419  10.513  -2.275
   56    HB3  ARG   8          3HB       ARG   8   9.718   8.782  -2.196
   57    HG2  ARG   8          2HG       ARG   8   8.194   8.382  -4.011
   58    HG3  ARG   8          3HG       ARG   8   7.719  10.081  -4.033
   59    HD2  ARG   8          2HD       ARG   8  10.497   9.044  -4.582
   60    HD3  ARG   8          3HD       ARG   8   9.328   9.513  -5.816
   61    HE   ARG   8           HE       ARG   8   9.613  11.682  -4.116
   62   HH11  ARG   8          1HH1      ARG   8  12.652  11.150  -6.667
   63   HH12  ARG   8          2HH1      ARG   8  11.606   9.824  -6.282
   64   HH21  ARG   8          1HH2      ARG   8  12.297  13.204  -5.716
   65   HH22  ARG   8          2HH2      ARG   8  10.983  13.436  -4.614
   66    H    PHE   9           H        PHE   9   5.749   9.502  -2.827
   67    HA   PHE   9           HA       PHE   9   5.347  12.321  -2.774
   68    HB2  PHE   9          2HB       PHE   9   3.852   9.972  -3.852
   69    HB3  PHE   9          3HB       PHE   9   2.998  11.502  -3.688
   70    HD1  PHE   9           HD1      PHE   9   4.669  13.556  -4.510
   71    HD2  PHE   9           HD2      PHE   9   4.570   9.563  -5.981
   72    HE1  PHE   9           HE1      PHE   9   5.629  14.322  -6.642
   73    HE2  PHE   9           HE2      PHE   9   5.530  10.322  -8.115
   74    HZ   PHE   9           HZ       PHE   9   6.062  12.704  -8.448
   75    H    LEU  10           H        LEU  10   3.614   9.599  -1.273
   76    HA   LEU  10           HA       LEU  10   1.771  11.213   0.145
   77    HB2  LEU  10          2HB       LEU  10   2.091   8.522  -0.334
   78    HB3  LEU  10          3HB       LEU  10   2.408   8.657   1.395
   79    HG   LEU  10           HG       LEU  10  -0.034   9.990   0.379
   80   HD11  LEU  10          1HD1      LEU  10   0.501   7.120   0.049
   81   HD12  LEU  10          2HD1      LEU  10  -0.677   8.159  -0.752
   82   HD13  LEU  10          3HD1      LEU  10  -1.016   7.518   0.855
   83   HD21  LEU  10          1HD2      LEU  10   0.465   8.226   2.772
   84   HD22  LEU  10          2HD2      LEU  10  -0.917   9.287   2.494
   85   HD23  LEU  10          3HD2      LEU  10   0.685   9.976   2.762
   86    H    GLN  11           H        GLN  11   4.848   9.708   1.057
   87    HA   GLN  11           HA       GLN  11   4.848  10.368   3.764
   88    HB2  GLN  11          2HB       GLN  11   6.975   9.797   1.750
   89    HB3  GLN  11          3HB       GLN  11   7.454  10.445   3.312
   90    HG2  GLN  11          2HG       GLN  11   5.591   8.293   3.666
   91    HG3  GLN  11          3HG       GLN  11   6.936   7.781   2.648
   92   HE21  GLN  11          1HE2      GLN  11   5.891   7.938   5.732
   93   HE22  GLN  11          2HE2      GLN  11   7.405   7.940   6.564
   94    H    THR  12           H        THR  12   5.497  12.317   0.954
   95    HA   THR  12           HA       THR  12   6.752  14.469   2.368
   96    HB   THR  12           HB       THR  12   5.511  14.395  -0.389
   97    HG1  THR  12           HG1      THR  12   7.533  13.943  -1.075
   98   HG21  THR  12          1HG2      THR  12   5.576  16.647  -0.129
   99   HG22  THR  12          2HG2      THR  12   7.288  16.417  -0.488
  100   HG23  THR  12          3HG2      THR  12   6.750  16.568   1.184
  101    H    ALA  13           H        ALA  13   3.555  14.109   0.823
  102    HA   ALA  13           HA       ALA  13   2.427  16.509   1.555
  103    HB1  ALA  13          1HB       ALA  13   0.530  15.651   0.729
  104    HB2  ALA  13          2HB       ALA  13   1.527  14.257   0.311
  105    HB3  ALA  13          3HB       ALA  13   0.582  14.250   1.800
  106    H    LYS  14           H        LYS  14   2.539  13.504   3.441
  107    HA   LYS  14           HA       LYS  14   1.101  14.562   5.661
  108    HB2  LYS  14          2HB       LYS  14   1.121  12.186   5.337
  109    HB3  LYS  14          3HB       LYS  14   2.879  12.141   5.356
  110    HG2  LYS  14          2HG       LYS  14   2.970  12.544   7.670
  111    HG3  LYS  14          3HG       LYS  14   1.276  13.037   7.730
  112    HD2  LYS  14          2HD       LYS  14   0.534  10.804   7.345
  113    HD3  LYS  14          3HD       LYS  14   2.171  10.261   6.969
  114    HE2  LYS  14          2HE       LYS  14   1.365  11.375   9.649
  115    HE3  LYS  14          3HE       LYS  14   1.318   9.655   9.261
  116    HZ1  LYS  14          1HZ       LYS  14   3.458   9.536   9.750
  117    HZ2  LYS  14          2HZ       LYS  14   3.511  11.192  10.089
  118    HZ3  LYS  14          3HZ       LYS  14   3.825  10.639   8.521
  119    H    ASN  15           H        ASN  15   4.551  14.017   5.013
  120    HA   ASN  15           HA       ASN  15   5.584  14.806   7.463
  121    HB2  ASN  15          2HB       ASN  15   7.105  13.833   5.954
  122    HB3  ASN  15          3HB       ASN  15   6.677  14.953   4.663
  123   HD21  ASN  15          1HD2      ASN  15   8.169  16.396   4.253
  124   HD22  ASN  15          2HD2      ASN  15   9.282  17.071   5.390
  125    H    ILE  16           H        ILE  16   4.360  16.733   4.820
  126    HA   ILE  16           HA       ILE  16   5.444  19.221   5.634
  127    HB   ILE  16           HB       ILE  16   2.978  18.639   3.989
  128   HG12  ILE  16          2HG1      ILE  16   5.481  19.697   2.796
  129   HG13  ILE  16          3HG1      ILE  16   5.513  18.020   3.327
  130   HG21  ILE  16          1HG2      ILE  16   2.528  20.808   4.219
  131   HG22  ILE  16          2HG2      ILE  16   4.069  21.118   5.017
  132   HG23  ILE  16          3HG2      ILE  16   3.974  21.116   3.256
  133   HD11  ILE  16          1HD1      ILE  16   4.565  17.455   1.415
  134   HD12  ILE  16          2HD1      ILE  16   3.122  18.346   1.901
  135   HD13  ILE  16          3HD1      ILE  16   4.380  19.150   0.963
  136    H    THR  17           H        THR  17   2.203  17.803   6.067
  137    HA   THR  17           HA       THR  17   1.277  19.920   7.735
  138    HB   THR  17           HB       THR  17  -0.085  17.347   8.078
  139    HG1  THR  17           HG1      THR  17   0.144  18.492   5.475
  140   HG21  THR  17          1HG2      THR  17  -1.013  19.577   8.665
  141   HG22  THR  17          2HG2      THR  17  -2.036  18.668   7.552
  142   HG23  THR  17          3HG2      THR  17  -1.028  19.983   6.949
  143    H    GLU  18           H        GLU  18   3.038  16.990   8.288
  144    HA   GLU  18           HA       GLU  18   2.456  16.834  11.099
  145    HB2  GLU  18          2HB       GLU  18   3.000  14.807   9.883
  146    HB3  GLU  18          3HB       GLU  18   4.557  15.471   9.409
  147    HG2  GLU  18          2HG       GLU  18   5.239  15.513  11.767
  148    HG3  GLU  18          3HG       GLU  18   3.693  14.794  12.211
  149    H    ARG  19           H        ARG  19   5.070  18.089   9.095
  150    HA   ARG  19           HA       ARG  19   6.821  18.703  11.250
  151    HB2  ARG  19          2HB       ARG  19   7.406  18.443   8.770
  152    HB3  ARG  19          3HB       ARG  19   6.805  20.084   8.574
  153    HG2  ARG  19          2HG       ARG  19   8.574  20.192  10.734
  154    HG3  ARG  19          3HG       ARG  19   9.356  19.175   9.521
  155    HD2  ARG  19          2HD       ARG  19   8.955  20.931   7.836
  156    HD3  ARG  19          3HD       ARG  19   8.251  21.948   9.092
  157    HE   ARG  19           HE       ARG  19  10.809  21.184   9.917
  158   HH11  ARG  19          1HH1      ARG  19  10.630  24.215   7.308
  159   HH12  ARG  19          2HH1      ARG  19   9.293  23.123   7.455
  160   HH21  ARG  19          1HH2      ARG  19  12.497  23.925   8.603
  161   HH22  ARG  19          2HH2      ARG  19  12.576  22.615   9.733
  162    H    VAL  20           H        VAL  20   4.565  20.661   9.323
  163    HA   VAL  20           HA       VAL  20   5.036  23.143  10.444
  164    HB   VAL  20           HB       VAL  20   3.584  22.938   8.539
  165   HG11  VAL  20          1HG1      VAL  20   1.471  21.859   8.550
  166   HG12  VAL  20          2HG1      VAL  20   2.620  20.726   9.266
  167   HG13  VAL  20          3HG1      VAL  20   1.518  21.637  10.299
  168   HG21  VAL  20          1HG2      VAL  20   1.691  24.336   9.253
  169   HG22  VAL  20          2HG2      VAL  20   2.071  23.971  10.936
  170   HG23  VAL  20          3HG2      VAL  20   3.217  24.879   9.951
  171    H    SER  21           H        SER  21   2.818  20.607  11.565
  172    HA   SER  21           HA       SER  21   1.679  22.001  13.699
  173    HB2  SER  21          2HB       SER  21   1.447  19.450  12.647
  174    HB3  SER  21          3HB       SER  21   2.092  19.163  14.263
  175    HG   SER  21           HG       SER  21   0.087  19.410  14.846
  176    H    MET  22           H        MET  22   4.357  19.644  13.814
  177    HA   MET  22           HA       MET  22   5.010  20.024  16.501
  178    HB2  MET  22          2HB       MET  22   6.527  19.014  14.122
  179    HB3  MET  22          3HB       MET  22   7.358  19.243  15.655
  180    HG2  MET  22          2HG       MET  22   5.346  17.834  16.583
  181    HG3  MET  22          3HG       MET  22   5.249  17.288  14.911
  182    HE1  MET  22          1HE       MET  22   7.560  17.015  13.662
  183    HE2  MET  22          2HE       MET  22   8.952  17.501  14.629
  184    HE3  MET  22          3HE       MET  22   8.700  15.799  14.239
  185    H    ALA  23           H        ALA  23   5.907  21.831  13.643
  186    HA   ALA  23           HA       ALA  23   8.016  23.325  14.819
  187    HB1  ALA  23          1HB       ALA  23   7.302  24.941  12.848
  188    HB2  ALA  23          2HB       ALA  23   8.161  23.430  12.548
  189    HB3  ALA  23          3HB       ALA  23   6.413  23.510  12.327
  190    H    THR  24           H        THR  24   4.595  24.087  14.198
  191    HA   THR  24           HA       THR  24   4.546  26.669  15.206
  192    HB   THR  24           HB       THR  24   2.252  24.774  15.647
  193    HG1  THR  24           HG1      THR  24   1.805  25.652  13.335
  194   HG21  THR  24          1HG2      THR  24   2.069  27.116  16.432
  195   HG22  THR  24          2HG2      THR  24   0.906  26.731  15.163
  196   HG23  THR  24          3HG2      THR  24   2.352  27.666  14.781
  197    H    ALA  25           H        ALA  25   4.057  23.602  16.925
  198    HA   ALA  25           HA       ALA  25   3.530  24.752  19.452
  199    HB1  ALA  25          1HB       ALA  25   2.846  22.591  19.463
  200    HB2  ALA  25          2HB       ALA  25   4.174  22.048  18.437
  201    HB3  ALA  25          3HB       ALA  25   4.451  22.349  20.153
  202    H    SER  26           H        SER  26   6.486  23.153  18.246
  203    HA   SER  26           HA       SER  26   8.115  23.735  20.422
  204    HB2  SER  26          2HB       SER  26   8.897  22.149  18.826
  205    HB3  SER  26          3HB       SER  26   8.769  23.309  17.504
  206    HG   SER  26           HG       SER  26  10.460  23.836  19.689
  207    H    SER  27           H        SER  27   7.119  25.738  17.758
  208    HA   SER  27           HA       SER  27   9.090  27.727  17.892
  209    HB2  SER  27          2HB       SER  27   7.850  28.111  16.028
  210    HB3  SER  27          3HB       SER  27   6.372  27.487  16.760
  211    HG   SER  27           HG       SER  27   6.350  29.779  16.337
  212    H    GLN  28           H        GLN  28   5.945  27.482  19.525
  213    HA   GLN  28           HA       GLN  28   6.923  29.421  21.507
  214    HB2  GLN  28          2HB       GLN  28   4.251  29.369  20.122
  215    HB3  GLN  28          3HB       GLN  28   4.474  30.171  21.671
  216    HG2  GLN  28          2HG       GLN  28   6.429  30.896  19.607
  217    HG3  GLN  28          3HG       GLN  28   4.764  31.363  19.263
  218   HE21  GLN  28          1HE2      GLN  28   7.560  32.382  20.605
  219   HE22  GLN  28          2HE2      GLN  28   6.950  33.570  21.702
  220    H    VAL  29           H        VAL  29   3.928  27.538  21.121
  221    HA   VAL  29           HA       VAL  29   4.526  25.540  22.988
  222    HB   VAL  29           HB       VAL  29   4.582  27.262  24.673
  223   HG11  VAL  29          1HG1      VAL  29   3.262  28.945  23.455
  224   HG12  VAL  29          2HG1      VAL  29   1.798  28.017  23.789
  225   HG13  VAL  29          3HG1      VAL  29   2.709  28.737  25.117
  226   HG21  VAL  29          1HG2      VAL  29   1.983  25.738  24.826
  227   HG22  VAL  29          2HG2      VAL  29   3.569  25.116  25.283
  228   HG23  VAL  29          3HG2      VAL  29   2.851  26.449  26.186
  229    H    LEU  30           H        LEU  30   2.146  27.547  21.410
  230    HA   LEU  30           HA       LEU  30   0.206  27.022  20.337
  231    HB2  LEU  30          2HB       LEU  30   1.675  24.729  20.153
  232    HB3  LEU  30          3HB       LEU  30   0.218  24.158  20.963
  233    HG   LEU  30           HG       LEU  30  -0.868  25.571  18.925
  234   HD11  LEU  30          1HD1      LEU  30   1.386  24.185  17.554
  235   HD12  LEU  30          2HD1      LEU  30   1.619  25.827  18.152
  236   HD13  LEU  30          3HD1      LEU  30   0.345  25.488  16.980
  237   HD21  LEU  30          1HD2      LEU  30  -1.424  23.484  17.975
  238   HD22  LEU  30          2HD2      LEU  30  -1.256  23.194  19.706
  239   HD23  LEU  30          3HD2      LEU  30   0.037  22.720  18.603
  240    H    ILE  31           H        ILE  31  -1.016  28.097  21.903
  241    HA   ILE  31           HA       ILE  31  -2.722  26.344  23.474
  242    HB   ILE  31           HB       ILE  31  -2.498  27.724  25.514
  243   HG12  ILE  31          2HG1      ILE  31   0.023  28.877  25.242
  244   HG13  ILE  31          3HG1      ILE  31  -0.799  29.284  23.740
  245   HG21  ILE  31          1HG2      ILE  31  -1.286  25.602  25.270
  246   HG22  ILE  31          2HG2      ILE  31   0.093  26.477  24.607
  247   HG23  ILE  31          3HG2      ILE  31  -0.407  26.754  26.275
  248   HD11  ILE  31          1HD1      ILE  31  -1.056  30.501  26.271
  249   HD12  ILE  31          2HD1      ILE  31  -1.895  30.897  24.771
  250   HD13  ILE  31          3HD1      ILE  31  -2.596  29.730  25.892
  251    HA   PRO  32           HA       PRO  32  -5.839  29.195  22.272
  252    HB2  PRO  32          2HB       PRO  32  -7.602  28.915  24.318
  253    HB3  PRO  32          3HB       PRO  32  -7.363  27.676  23.080
  254    HG2  PRO  32          2HG       PRO  32  -6.241  27.827  25.851
  255    HG3  PRO  32          3HG       PRO  32  -6.916  26.431  24.992
  256    HD2  PRO  32          2HD       PRO  32  -4.251  26.845  25.230
  257    HD3  PRO  32          3HD       PRO  32  -4.972  26.057  23.812
  258    H    GLU  33           H        GLU  33  -6.458  31.302  22.554
  259    HA   GLU  33           HA       GLU  33  -5.961  32.629  25.097
  260    HB2  GLU  33          2HB       GLU  33  -4.128  32.792  22.921
  261    HB3  GLU  33          3HB       GLU  33  -4.917  34.355  23.084
  262    HG2  GLU  33          2HG       GLU  33  -3.759  32.963  25.464
  263    HG3  GLU  33          3HG       GLU  33  -2.746  33.918  24.383
  264    H    ILE  34           H        ILE  34  -6.892  33.105  21.697
  265    HA   ILE  34           HA       ILE  34  -9.441  34.156  22.404
  266    HB   ILE  34           HB       ILE  34  -8.199  36.162  22.936
  267   HG12  ILE  34          2HG1      ILE  34  -9.209  37.045  20.324
  268   HG13  ILE  34          3HG1      ILE  34 -10.335  36.025  21.213
  269   HG21  ILE  34          1HG2      ILE  34  -6.226  35.596  21.511
  270   HG22  ILE  34          2HG2      ILE  34  -7.149  36.144  20.113
  271   HG23  ILE  34          3HG2      ILE  34  -6.746  37.277  21.403
  272   HD11  ILE  34          1HD1      ILE  34 -10.976  37.918  22.191
  273   HD12  ILE  34          2HD1      ILE  34  -9.491  37.775  23.133
  274   HD13  ILE  34          3HD1      ILE  34  -9.523  38.780  21.684
  275    H    ASN  35           H        ASN  35  -6.913  33.867  19.961
  276    HA   ASN  35           HA       ASN  35  -8.940  33.002  18.041
  277    HB2  ASN  35          2HB       ASN  35  -7.946  35.558  17.906
  278    HB3  ASN  35          3HB       ASN  35  -6.864  34.686  16.823
  279   HD21  ASN  35          1HD2      ASN  35 -10.327  34.423  17.550
  280   HD22  ASN  35          2HD2      ASN  35 -10.855  34.581  15.913
  281    H    LEU  36           H        LEU  36  -7.088  31.476  19.527
  282    HA   LEU  36           HA       LEU  36  -4.737  30.899  18.054
  283    HB2  LEU  36          2HB       LEU  36  -4.986  30.338  20.415
  284    HB3  LEU  36          3HB       LEU  36  -6.267  29.195  20.016
  285    HG   LEU  36           HG       LEU  36  -3.910  28.294  20.530
  286   HD11  LEU  36          1HD1      LEU  36  -4.486  26.393  19.451
  287   HD12  LEU  36          2HD1      LEU  36  -4.802  27.221  17.927
  288   HD13  LEU  36          3HD1      LEU  36  -6.002  27.264  19.218
  289   HD21  LEU  36          1HD2      LEU  36  -2.263  28.399  18.921
  290   HD22  LEU  36          2HD2      LEU  36  -2.957  30.018  18.825
  291   HD23  LEU  36          3HD2      LEU  36  -3.399  28.796  17.631
  292    H    ASN  37           H        ASN  37  -7.874  29.227  18.273
  293    HA   ASN  37           HA       ASN  37  -7.326  27.174  16.467
  294    HB2  ASN  37          2HB       ASN  37  -9.480  27.891  18.002
  295    HB3  ASN  37          3HB       ASN  37 -10.083  28.191  16.375
  296   HD21  ASN  37          1HD2      ASN  37  -9.659  25.910  18.752
  297   HD22  ASN  37          2HD2      ASN  37  -9.901  24.485  17.806
  298    H    ASP  38           H        ASP  38  -7.859  30.515  15.922
  299    HA   ASP  38           HA       ASP  38  -8.666  30.227  13.164
  300    HB2  ASP  38          2HB       ASP  38  -8.681  32.312  15.101
  301    HB3  ASP  38          3HB       ASP  38  -7.734  32.868  13.723
  302    H    THR  39           H        THR  39  -5.823  31.641  14.791
  303    HA   THR  39           HA       THR  39  -4.271  32.063  12.528
  304    HB   THR  39           HB       THR  39  -2.699  31.188  14.836
  305    HG1  THR  39           HG1      THR  39  -3.757  32.223  16.343
  306   HG21  THR  39          1HG2      THR  39  -1.641  32.541  13.214
  307   HG22  THR  39          2HG2      THR  39  -1.908  33.598  14.600
  308   HG23  THR  39          3HG2      THR  39  -2.971  33.698  13.197
  309    H    PHE  40           H        PHE  40  -4.271  29.240  14.701
  310    HA   PHE  40           HA       PHE  40  -2.349  27.748  13.319
  311    HB2  PHE  40          2HB       PHE  40  -3.394  27.336  15.645
  312    HB3  PHE  40          3HB       PHE  40  -4.660  26.481  14.770
  313    HD1  PHE  40           HD1      PHE  40  -0.958  26.605  14.346
  314    HD2  PHE  40           HD2      PHE  40  -4.403  24.224  15.101
  315    HE1  PHE  40           HE1      PHE  40   0.440  24.580  14.315
  316    HE2  PHE  40           HE2      PHE  40  -3.012  22.195  15.072
  317    HZ   PHE  40           HZ       PHE  40  -0.587  22.372  14.679
  318    H    ASP  41           H        ASP  41  -5.849  27.952  12.925
  319    HA   ASP  41           HA       ASP  41  -6.205  25.849  11.123
  320    HB2  ASP  41          2HB       ASP  41  -7.713  28.259  11.908
  321    HB3  ASP  41          3HB       ASP  41  -8.085  27.639  10.302
  322    H    THR  42           H        THR  42  -5.942  29.323  10.343
  323    HA   THR  42           HA       THR  42  -5.745  29.018   7.577
  324    HB   THR  42           HB       THR  42  -5.954  31.172   9.138
  325    HG1  THR  42           HG1      THR  42  -6.368  31.660   7.106
  326   HG21  THR  42          1HG2      THR  42  -3.486  30.823   9.786
  327   HG22  THR  42          2HG2      THR  42  -4.002  32.448   9.334
  328   HG23  THR  42          3HG2      THR  42  -3.122  31.449   8.178
  329    H    PHE  43           H        PHE  43  -3.392  28.536  10.065
  330    HA   PHE  43           HA       PHE  43  -1.090  28.744   8.371
  331    HB2  PHE  43          2HB       PHE  43  -1.121  29.066  10.891
  332    HB3  PHE  43          3HB       PHE  43  -1.251  27.315  11.025
  333    HD1  PHE  43           HD1      PHE  43   0.769  26.686  11.986
  334    HD2  PHE  43           HD2      PHE  43   0.769  29.309   8.633
  335    HE1  PHE  43           HE1      PHE  43   3.218  26.493  11.839
  336    HE2  PHE  43           HE2      PHE  43   3.217  29.119   8.481
  337    HZ   PHE  43           HZ       PHE  43   4.445  27.710  10.084
  338    H    ALA  44           H        ALA  44  -2.772  26.002   9.905
  339    HA   ALA  44           HA       ALA  44  -1.246  24.016   8.576
  340    HB1  ALA  44          1HB       ALA  44  -2.893  22.442   9.424
  341    HB2  ALA  44          2HB       ALA  44  -2.433  23.594  10.679
  342    HB3  ALA  44          3HB       ALA  44  -3.974  23.773   9.840
  343    H    LEU  45           H        LEU  45  -4.504  25.322   7.999
  344    HA   LEU  45           HA       LEU  45  -5.321  23.761   5.902
  345    HB2  LEU  45          2HB       LEU  45  -6.930  25.241   6.555
  346    HB3  LEU  45          3HB       LEU  45  -5.796  26.585   6.678
  347    HG   LEU  45           HG       LEU  45  -5.824  26.876   4.276
  348   HD11  LEU  45          1HD1      LEU  45  -7.800  25.426   3.184
  349   HD12  LEU  45          2HD1      LEU  45  -7.196  24.266   4.366
  350   HD13  LEU  45          3HD1      LEU  45  -6.105  24.939   3.154
  351   HD21  LEU  45          1HD2      LEU  45  -7.651  27.812   5.815
  352   HD22  LEU  45          2HD2      LEU  45  -8.696  26.586   5.095
  353   HD23  LEU  45          3HD2      LEU  45  -7.950  27.819   4.076
  354    H    ASP  46           H        ASP  46  -3.653  26.894   5.522
  355    HA   ASP  46           HA       ASP  46  -3.262  26.880   2.814
  356    HB2  ASP  46          2HB       ASP  46  -2.407  28.460   4.879
  357    HB3  ASP  46          3HB       ASP  46  -0.890  27.773   4.306
  358    H    PHE  47           H        PHE  47  -1.126  25.425   5.256
  359    HA   PHE  47           HA       PHE  47   0.838  24.463   3.532
  360    HB2  PHE  47          2HB       PHE  47   0.045  24.033   6.294
  361    HB3  PHE  47          3HB       PHE  47   0.655  22.556   5.557
  362    HD1  PHE  47           HD1      PHE  47   2.830  23.119   3.979
  363    HD2  PHE  47           HD2      PHE  47   1.601  25.214   7.475
  364    HE1  PHE  47           HE1      PHE  47   5.138  23.904   4.317
  365    HE2  PHE  47           HE2      PHE  47   3.906  26.003   7.817
  366    HZ   PHE  47           HZ       PHE  47   5.678  25.348   6.237
  367    H    SER  48           H        SER  48  -2.106  22.858   4.708
  368    HA   SER  48           HA       SER  48  -1.775  20.378   3.537
  369    HB2  SER  48          2HB       SER  48  -3.629  20.406   4.893
  370    HB3  SER  48          3HB       SER  48  -4.138  22.004   4.345
  371    HG   SER  48           HG       SER  48  -5.547  20.451   3.534
  372    H    ARG  49           H        ARG  49  -3.237  23.291   2.127
  373    HA   ARG  49           HA       ARG  49  -4.103  22.316  -0.286
  374    HB2  ARG  49          2HB       ARG  49  -4.158  24.726   0.704
  375    HB3  ARG  49          3HB       ARG  49  -2.650  24.937  -0.176
  376    HG2  ARG  49          2HG       ARG  49  -4.451  23.777  -1.987
  377    HG3  ARG  49          3HG       ARG  49  -5.341  25.043  -1.138
  378    HD2  ARG  49          2HD       ARG  49  -3.045  26.347  -1.614
  379    HD3  ARG  49          3HD       ARG  49  -3.044  25.242  -2.987
  380    HE   ARG  49           HE       ARG  49  -5.570  26.389  -2.858
  381   HH11  ARG  49          1HH1      ARG  49  -2.716  28.744  -4.386
  382   HH12  ARG  49          2HH1      ARG  49  -2.281  27.404  -3.379
  383   HH21  ARG  49          1HH2      ARG  49  -4.921  29.169  -4.842
  384   HH22  ARG  49          2HH2      ARG  49  -6.156  28.151  -4.183
  385    H    GLU  50           H        GLU  50  -0.819  23.338   0.572
  386    HA   GLU  50           HA       GLU  50   0.247  22.804  -2.030
  387    HB2  GLU  50          2HB       GLU  50   1.122  24.151   0.244
  388    HB3  GLU  50          3HB       GLU  50   2.207  22.774   0.115
  389    HG2  GLU  50          2HG       GLU  50   1.830  24.009  -2.454
  390    HG3  GLU  50          3HG       GLU  50   2.359  25.192  -1.260
  391    H    LYS  51           H        LYS  51  -0.205  20.981   0.898
  392    HA   LYS  51           HA       LYS  51   1.635  18.910   0.459
  393    HB2  LYS  51          2HB       LYS  51   0.791  18.096   2.370
  394    HB3  LYS  51          3HB       LYS  51  -0.227  19.530   2.402
  395    HG2  LYS  51          2HG       LYS  51  -1.903  18.189   1.048
  396    HG3  LYS  51          3HG       LYS  51  -0.925  16.774   1.443
  397    HD2  LYS  51          2HD       LYS  51  -1.715  16.688   3.536
  398    HD3  LYS  51          3HD       LYS  51  -1.521  18.427   3.768
  399    HE2  LYS  51          2HE       LYS  51  -3.764  18.459   3.793
  400    HE3  LYS  51          3HE       LYS  51  -3.622  18.339   2.040
  401    HZ1  LYS  51          1HZ       LYS  51  -3.670  15.891   3.673
  402    HZ2  LYS  51          2HZ       LYS  51  -4.139  16.112   2.063
  403    HZ3  LYS  51          3HZ       LYS  51  -5.120  16.686   3.316
  404    H    LYS  52           H        LYS  52  -1.571  19.490  -0.817
  405    HA   LYS  52           HA       LYS  52  -1.818  16.863  -1.977
  406    HB2  LYS  52          2HB       LYS  52  -3.443  19.388  -2.308
  407    HB3  LYS  52          3HB       LYS  52  -3.838  17.862  -3.088
  408    HG2  LYS  52          2HG       LYS  52  -4.542  16.891  -1.152
  409    HG3  LYS  52          3HG       LYS  52  -3.468  17.863  -0.143
  410    HD2  LYS  52          2HD       LYS  52  -5.726  18.559   0.266
  411    HD3  LYS  52          3HD       LYS  52  -4.905  19.838  -0.631
  412    HE2  LYS  52          2HE       LYS  52  -6.273  17.828  -2.284
  413    HE3  LYS  52          3HE       LYS  52  -7.333  18.815  -1.279
  414    HZ1  LYS  52          1HZ       LYS  52  -5.996  19.514  -3.670
  415    HZ2  LYS  52          2HZ       LYS  52  -5.506  20.547  -2.423
  416    HZ3  LYS  52          3HZ       LYS  52  -7.148  20.396  -2.799
  417    H    LEU  53           H        LEU  53  -1.454  20.157  -3.295
  418    HA   LEU  53           HA       LEU  53  -1.220  19.540  -5.968
  419    HB2  LEU  53          2HB       LEU  53  -0.747  21.782  -4.319
  420    HB3  LEU  53          3HB       LEU  53   0.680  21.579  -5.331
  421    HG   LEU  53           HG       LEU  53  -2.077  21.649  -6.517
  422   HD11  LEU  53          1HD1      LEU  53  -1.214  23.710  -5.016
  423   HD12  LEU  53          2HD1      LEU  53  -2.221  23.895  -6.452
  424   HD13  LEU  53          3HD1      LEU  53  -0.475  24.120  -6.564
  425   HD21  LEU  53          1HD2      LEU  53   0.253  22.776  -7.904
  426   HD22  LEU  53          2HD2      LEU  53  -1.028  21.722  -8.502
  427   HD23  LEU  53          3HD2      LEU  53   0.330  21.039  -7.606
  428    H    LEU  54           H        LEU  54   1.071  19.034  -3.414
  429    HA   LEU  54           HA       LEU  54   3.359  18.679  -5.092
  430    HB2  LEU  54          2HB       LEU  54   3.665  19.305  -2.795
  431    HB3  LEU  54          3HB       LEU  54   2.792  17.877  -2.244
  432    HG   LEU  54           HG       LEU  54   5.383  17.953  -2.088
  433   HD11  LEU  54          1HD1      LEU  54   3.735  15.998  -1.782
  434   HD12  LEU  54          2HD1      LEU  54   5.435  15.631  -2.069
  435   HD13  LEU  54          3HD1      LEU  54   4.270  15.494  -3.385
  436   HD21  LEU  54          1HD2      LEU  54   5.280  16.793  -4.830
  437   HD22  LEU  54          2HD2      LEU  54   6.634  17.512  -3.957
  438   HD23  LEU  54          3HD2      LEU  54   5.380  18.545  -4.647
  439    H    GLU  55           H        GLU  55   1.446  16.355  -3.170
  440    HA   GLU  55           HA       GLU  55   2.582  14.031  -4.166
  441    HB2  GLU  55          2HB       GLU  55   0.965  14.256  -2.231
  442    HB3  GLU  55          3HB       GLU  55  -0.328  14.318  -3.420
  443    HG2  GLU  55          2HG       GLU  55   0.934  12.081  -4.216
  444    HG3  GLU  55          3HG       GLU  55   1.287  12.042  -2.490
  445    H    CYS  56           H        CYS  56  -0.297  15.758  -5.341
  446    HA   CYS  56           HA       CYS  56   0.221  14.866  -8.033
  447    HB2  CYS  56          2HB       CYS  56  -1.532  13.346  -6.406
  448    HB3  CYS  56          3HB       CYS  56  -2.532  14.224  -7.557
  449    HG   CYS  56           HG       CYS  56   0.110  12.806  -9.002
  450    H    LEU  57           H        LEU  57   0.133  16.808  -8.971
  451    HA   LEU  57           HA       LEU  57  -1.270  19.037  -8.146
  452    HB2  LEU  57          2HB       LEU  57  -0.931  19.928 -10.372
  453    HB3  LEU  57          3HB       LEU  57   0.513  19.087  -9.812
  454    HG   LEU  57           HG       LEU  57  -1.339  17.485 -11.456
  455   HD11  LEU  57          1HD1      LEU  57   0.159  19.849 -12.561
  456   HD12  LEU  57          2HD1      LEU  57  -1.563  19.494 -12.699
  457   HD13  LEU  57          3HD1      LEU  57  -0.386  18.492 -13.547
  458   HD21  LEU  57          1HD2      LEU  57   1.448  17.703 -12.245
  459   HD22  LEU  57          2HD2      LEU  57   0.509  16.282 -11.785
  460   HD23  LEU  57          3HD2      LEU  57   1.258  17.286 -10.542
  461    H    ASP  58           H        ASP  58  -3.076  20.141  -9.315
  462    HA   ASP  58           HA       ASP  58  -5.037  18.358 -10.522
  463    HB2  ASP  58          2HB       ASP  58  -5.414  19.759  -7.889
  464    HB3  ASP  58          3HB       ASP  58  -6.794  19.399  -8.923
  465    H    TYR  59           H        TYR  59  -5.242  21.583  -9.035
  466    HA   TYR  59           HA       TYR  59  -5.422  22.815 -11.668
  467    HB2  TYR  59          2HB       TYR  59  -7.735  22.253 -11.225
  468    HB3  TYR  59          3HB       TYR  59  -7.640  22.965  -9.618
  469    HD1  TYR  59           HD1      TYR  59  -7.736  25.361  -9.310
  470    HD2  TYR  59           HD2      TYR  59  -7.847  23.669 -13.213
  471    HE1  TYR  59           HE1      TYR  59  -8.477  27.522 -10.219
  472    HE2  TYR  59           HE2      TYR  59  -8.587  25.827 -14.133
  473    HH   TYR  59           HH       TYR  59  -9.374  28.544 -12.041
  474    H    LEU  60           H        LEU  60  -4.965  25.022 -11.681
  475    HA   LEU  60           HA       LEU  60  -3.668  25.988  -9.241
  476    HB2  LEU  60          2HB       LEU  60  -3.139  26.205 -12.062
  477    HB3  LEU  60          3HB       LEU  60  -3.226  27.804 -11.327
  478    HG   LEU  60           HG       LEU  60  -1.468  25.625 -10.227
  479   HD11  LEU  60          1HD1      LEU  60  -1.112  27.274 -12.628
  480   HD12  LEU  60          2HD1      LEU  60  -0.332  25.765 -12.157
  481   HD13  LEU  60          3HD1      LEU  60   0.242  27.297 -11.498
  482   HD21  LEU  60          1HD2      LEU  60  -0.943  28.550 -10.041
  483   HD22  LEU  60          2HD2      LEU  60  -0.526  27.253  -8.920
  484   HD23  LEU  60          3HD2      LEU  60  -2.187  27.843  -9.009
  Start of MODEL   10
    1    H    LEU   1           H        LEU   1   8.534   3.680   6.052
    2    HA   LEU   1           HA       LEU   1  10.670   1.765   5.756
    3    HB2  LEU   1          2HB       LEU   1   9.264  -0.205   6.082
    4    HB3  LEU   1          3HB       LEU   1   9.424   0.741   7.561
    5    HG   LEU   1           HG       LEU   1   7.063   1.548   6.143
    6   HD11  LEU   1          1HD1      LEU   1   7.506  -0.971   5.431
    7   HD12  LEU   1          2HD1      LEU   1   5.889  -0.363   5.788
    8   HD13  LEU   1          3HD1      LEU   1   6.778  -1.272   7.010
    9   HD21  LEU   1          1HD2      LEU   1   7.900   1.426   8.701
   10   HD22  LEU   1          2HD2      LEU   1   6.865  -0.001   8.642
   11   HD23  LEU   1          3HD2      LEU   1   6.208   1.583   8.228
   12    H    LYS   2           H        LYS   2   9.821   3.656   3.987
   13    HA   LYS   2           HA       LYS   2   8.893   1.995   1.791
   14    HB2  LYS   2          2HB       LYS   2   7.505   4.597   2.456
   15    HB3  LYS   2          3HB       LYS   2   7.149   3.540   1.096
   16    HG2  LYS   2          2HG       LYS   2   6.432   1.790   2.645
   17    HG3  LYS   2          3HG       LYS   2   6.784   2.855   4.007
   18    HD2  LYS   2          2HD       LYS   2   4.811   3.867   3.802
   19    HD3  LYS   2          3HD       LYS   2   5.096   4.187   2.090
   20    HE2  LYS   2          2HE       LYS   2   4.532   1.579   1.945
   21    HE3  LYS   2          3HE       LYS   2   3.617   1.977   3.399
   22    HZ1  LYS   2          1HZ       LYS   2   3.307   3.761   1.114
   23    HZ2  LYS   2          2HZ       LYS   2   2.162   3.245   2.248
   24    HZ3  LYS   2          3HZ       LYS   2   2.613   2.224   0.976
   25    H    GLU   3           H        GLU   3   9.653   2.645  -0.192
   26    HA   GLU   3           HA       GLU   3  10.825   5.249  -0.570
   27    HB2  GLU   3          2HB       GLU   3  12.483   2.880   0.033
   28    HB3  GLU   3          3HB       GLU   3  13.005   3.837  -1.346
   29    HG2  GLU   3          2HG       GLU   3  12.614   5.806   0.417
   30    HG3  GLU   3          3HG       GLU   3  13.001   4.495   1.530
   31    H    ASN   4           H        ASN   4   9.324   5.344  -2.269
   32    HA   ASN   4           HA       ASN   4  10.251   4.083  -4.714
   33    HB2  ASN   4          2HB       ASN   4   7.347   3.828  -3.920
   34    HB3  ASN   4          3HB       ASN   4   8.142   3.119  -5.323
   35   HD21  ASN   4          1HD2      ASN   4   9.467   1.325  -5.056
   36   HD22  ASN   4          2HD2      ASN   4   9.426   0.361  -3.622
   37    H    ASP   5           H        ASP   5   8.335   4.792  -6.461
   38    HA   ASP   5           HA       ASP   5   8.771   7.513  -6.885
   39    HB2  ASP   5          2HB       ASP   5   7.764   5.490  -8.388
   40    HB3  ASP   5          3HB       ASP   5   6.294   6.399  -8.049
   41    H    HIS   6           H        HIS   6   5.636   6.008  -6.077
   42    HA   HIS   6           HA       HIS   6   4.438   8.482  -5.362
   43    HB2  HIS   6          2HB       HIS   6   3.333   6.241  -6.104
   44    HB3  HIS   6          3HB       HIS   6   3.416   5.830  -4.394
   45    HD1  HIS   6           HD1      HIS   6   0.695   5.835  -4.884
   46    HD2  HIS   6           HD2      HIS   6   2.632   9.504  -4.667
   47    HE1  HIS   6           HE1      HIS   6  -1.116   7.528  -4.463
   48    H    ALA   7           H        ALA   7   5.815   5.811  -3.486
   49    HA   ALA   7           HA       ALA   7   5.139   6.610  -0.929
   50    HB1  ALA   7          1HB       ALA   7   7.356   5.019  -2.091
   51    HB2  ALA   7          2HB       ALA   7   7.521   5.553  -0.417
   52    HB3  ALA   7          3HB       ALA   7   6.139   4.568  -0.896
   53    H    ARG   8           H        ARG   8   7.601   7.877  -3.068
   54    HA   ARG   8           HA       ARG   8   8.937   9.419  -1.056
   55    HB2  ARG   8          2HB       ARG   8  10.179   8.741  -3.006
   56    HB3  ARG   8          3HB       ARG   8   9.019   9.519  -4.073
   57    HG2  ARG   8          2HG       ARG   8   9.953  11.540  -3.822
   58    HG3  ARG   8          3HG       ARG   8  10.246  11.303  -2.098
   59    HD2  ARG   8          2HD       ARG   8  11.871   9.685  -3.969
   60    HD3  ARG   8          3HD       ARG   8  12.208  11.415  -3.915
   61    HE   ARG   8           HE       ARG   8  12.103  10.489  -1.289
   62   HH11  ARG   8          1HH1      ARG   8  15.505   9.726  -3.258
   63   HH12  ARG   8          2HH1      ARG   8  14.054  10.068  -4.142
   64   HH21  ARG   8          1HH2      ARG   8  15.476   9.709  -0.967
   65   HH22  ARG   8          2HH2      ARG   8  14.006  10.040  -0.115
   66    H    PHE   9           H        PHE   9   6.716  10.216  -3.722
   67    HA   PHE   9           HA       PHE   9   6.531  12.957  -3.233
   68    HB2  PHE   9          2HB       PHE   9   5.254  11.049  -4.921
   69    HB3  PHE   9          3HB       PHE   9   4.001  12.018  -4.154
   70    HD1  PHE   9           HD1      PHE   9   3.276  13.768  -5.430
   71    HD2  PHE   9           HD2      PHE   9   7.380  12.658  -5.614
   72    HE1  PHE   9           HE1      PHE   9   3.690  15.580  -7.042
   73    HE2  PHE   9           HE2      PHE   9   7.801  14.468  -7.226
   74    HZ   PHE   9           HZ       PHE   9   5.955  15.932  -7.942
   75    H    LEU  10           H        LEU  10   4.780  10.247  -1.827
   76    HA   LEU  10           HA       LEU  10   2.854  11.794  -0.435
   77    HB2  LEU  10          2HB       LEU  10   3.366   9.087  -0.858
   78    HB3  LEU  10          3HB       LEU  10   3.513   9.308   0.884
   79    HG   LEU  10           HG       LEU  10   1.128  10.582  -0.155
   80   HD11  LEU  10          1HD1      LEU  10   0.163   8.072  -0.346
   81   HD12  LEU  10          2HD1      LEU  10   1.758   7.856  -1.066
   82   HD13  LEU  10          3HD1      LEU  10   0.645   9.051  -1.732
   83   HD21  LEU  10          1HD2      LEU  10   0.097   9.180   1.614
   84   HD22  LEU  10          2HD2      LEU  10   1.453  10.152   2.187
   85   HD23  LEU  10          3HD2      LEU  10   1.669   8.428   1.884
   86    H    GLN  11           H        GLN  11   5.914  10.295   0.583
   87    HA   GLN  11           HA       GLN  11   5.887  11.014   3.255
   88    HB2  GLN  11          2HB       GLN  11   7.563   9.528   2.142
   89    HB3  GLN  11          3HB       GLN  11   8.328  10.964   1.475
   90    HG2  GLN  11          2HG       GLN  11   8.594  11.761   3.863
   91    HG3  GLN  11          3HG       GLN  11   8.135  10.130   4.351
   92   HE21  GLN  11          1HE2      GLN  11  10.541  12.074   2.745
   93   HE22  GLN  11          2HE2      GLN  11  11.809  10.902   2.795
   94    H    THR  12           H        THR  12   6.479  12.967   0.444
   95    HA   THR  12           HA       THR  12   7.685  15.157   1.845
   96    HB   THR  12           HB       THR  12   6.529  14.895  -0.927
   97    HG1  THR  12           HG1      THR  12   8.673  14.006  -0.253
   98   HG21  THR  12          1HG2      THR  12   7.823  17.188  -1.150
   99   HG22  THR  12          2HG2      THR  12   7.405  17.325   0.558
  100   HG23  THR  12          3HG2      THR  12   6.134  17.138  -0.650
  101    H    ALA  13           H        ALA  13   4.521  14.801   0.227
  102    HA   ALA  13           HA       ALA  13   3.356  17.155   1.051
  103    HB1  ALA  13          1HB       ALA  13   1.282  15.298   1.131
  104    HB2  ALA  13          2HB       ALA  13   1.797  16.260  -0.255
  105    HB3  ALA  13          3HB       ALA  13   2.444  14.636  -0.019
  106    H    LYS  14           H        LYS  14   3.700  14.136   2.827
  107    HA   LYS  14           HA       LYS  14   2.054  14.954   5.023
  108    HB2  LYS  14          2HB       LYS  14   2.634  12.557   4.286
  109    HB3  LYS  14          3HB       LYS  14   4.156  12.801   5.133
  110    HG2  LYS  14          2HG       LYS  14   3.060  11.961   6.889
  111    HG3  LYS  14          3HG       LYS  14   2.372  13.581   7.024
  112    HD2  LYS  14          2HD       LYS  14   0.465  12.862   5.641
  113    HD3  LYS  14          3HD       LYS  14   1.148  11.236   5.568
  114    HE2  LYS  14          2HE       LYS  14   0.522  10.739   7.681
  115    HE3  LYS  14          3HE       LYS  14   0.830  12.372   8.269
  116    HZ1  LYS  14          1HZ       LYS  14  -1.242  13.054   7.109
  117    HZ2  LYS  14          2HZ       LYS  14  -1.495  11.972   8.384
  118    HZ3  LYS  14          3HZ       LYS  14  -1.557  11.423   6.785
  119    H    ASN  15           H        ASN  15   5.555  14.732   4.471
  120    HA   ASN  15           HA       ASN  15   6.398  15.544   7.006
  121    HB2  ASN  15          2HB       ASN  15   8.035  14.628   5.561
  122    HB3  ASN  15          3HB       ASN  15   7.664  15.779   4.281
  123   HD21  ASN  15          1HD2      ASN  15   9.041  15.457   7.499
  124   HD22  ASN  15          2HD2      ASN  15  10.083  16.831   7.390
  125    H    ILE  16           H        ILE  16   4.968  17.336   4.445
  126    HA   ILE  16           HA       ILE  16   5.958  19.910   5.206
  127    HB   ILE  16           HB       ILE  16   3.592  19.136   3.498
  128   HG12  ILE  16          2HG1      ILE  16   6.099  20.401   2.474
  129   HG13  ILE  16          3HG1      ILE  16   6.117  18.683   2.859
  130   HG21  ILE  16          1HG2      ILE  16   3.127  21.306   4.315
  131   HG22  ILE  16          2HG2      ILE  16   4.798  21.823   4.101
  132   HG23  ILE  16          3HG2      ILE  16   3.782  21.522   2.692
  133   HD11  ILE  16          1HD1      ILE  16   5.248  18.264   0.875
  134   HD12  ILE  16          2HD1      ILE  16   3.800  19.162   1.332
  135   HD13  ILE  16          3HD1      ILE  16   5.136  19.990   0.534
  136    H    THR  17           H        THR  17   2.757  18.364   5.509
  137    HA   THR  17           HA       THR  17   1.753  20.411   7.234
  138    HB   THR  17           HB       THR  17   0.457  17.732   7.193
  139    HG1  THR  17           HG1      THR  17   0.995  19.292   4.933
  140   HG21  THR  17          1HG2      THR  17  -0.524  19.703   8.345
  141   HG22  THR  17          2HG2      THR  17  -1.563  19.052   7.077
  142   HG23  THR  17          3HG2      THR  17  -0.630  20.519   6.786
  143    H    GLU  18           H        GLU  18   3.514  17.479   7.692
  144    HA   GLU  18           HA       GLU  18   2.782  17.126  10.452
  145    HB2  GLU  18          2HB       GLU  18   3.397  15.166   9.218
  146    HB3  GLU  18          3HB       GLU  18   4.925  15.884   8.729
  147    HG2  GLU  18          2HG       GLU  18   5.881  15.595  10.813
  148    HG3  GLU  18          3HG       GLU  18   4.321  15.467  11.623
  149    H    ARG  19           H        ARG  19   5.483  18.532   8.674
  150    HA   ARG  19           HA       ARG  19   7.110  19.020  10.955
  151    HB2  ARG  19          2HB       ARG  19   7.992  18.902   8.644
  152    HB3  ARG  19          3HB       ARG  19   7.147  20.396   8.263
  153    HG2  ARG  19          2HG       ARG  19   8.518  21.310  10.311
  154    HG3  ARG  19          3HG       ARG  19   9.579  19.957   9.913
  155    HD2  ARG  19          2HD       ARG  19   9.383  20.882   7.484
  156    HD3  ARG  19          3HD       ARG  19   8.888  22.370   8.290
  157    HE   ARG  19           HE       ARG  19  11.294  21.311   9.393
  158   HH11  ARG  19          1HH1      ARG  19  11.482  23.983   6.417
  159   HH12  ARG  19          2HH1      ARG  19  10.003  23.134   6.723
  160   HH21  ARG  19          1HH2      ARG  19  13.327  23.576   7.713
  161   HH22  ARG  19          2HH2      ARG  19  13.247  22.422   9.000
  162    H    VAL  20           H        VAL  20   4.904  21.058   9.059
  163    HA   VAL  20           HA       VAL  20   5.295  23.472  10.368
  164    HB   VAL  20           HB       VAL  20   3.967  23.379   8.360
  165   HG11  VAL  20          1HG1      VAL  20   1.860  22.304   8.180
  166   HG12  VAL  20          2HG1      VAL  20   2.966  21.129   8.893
  167   HG13  VAL  20          3HG1      VAL  20   1.802  21.978   9.912
  168   HG21  VAL  20          1HG2      VAL  20   2.033  24.735   9.044
  169   HG22  VAL  20          2HG2      VAL  20   2.310  24.266  10.721
  170   HG23  VAL  20          3HG2      VAL  20   3.513  25.230   9.865
  171    H    SER  21           H        SER  21   3.053  20.839  11.170
  172    HA   SER  21           HA       SER  21   1.760  22.072  13.317
  173    HB2  SER  21          2HB       SER  21   0.881  20.030  12.372
  174    HB3  SER  21          3HB       SER  21   2.343  19.145  12.811
  175    HG   SER  21           HG       SER  21   1.671  19.006  14.819
  176    H    MET  22           H        MET  22   4.449  19.727  13.444
  177    HA   MET  22           HA       MET  22   4.929  19.935  16.187
  178    HB2  MET  22          2HB       MET  22   5.844  18.222  14.517
  179    HB3  MET  22          3HB       MET  22   7.087  19.411  14.152
  180    HG2  MET  22          2HG       MET  22   7.843  19.377  16.446
  181    HG3  MET  22          3HG       MET  22   6.546  18.266  16.881
  182    HE1  MET  22          1HE       MET  22   8.750  17.646  13.392
  183    HE2  MET  22          2HE       MET  22   9.320  18.930  14.458
  184    HE3  MET  22          3HE       MET  22  10.227  17.422  14.329
  185    H    ALA  23           H        ALA  23   6.036  21.900  13.502
  186    HA   ALA  23           HA       ALA  23   8.034  23.331  14.918
  187    HB1  ALA  23          1HB       ALA  23   7.908  23.193  12.450
  188    HB2  ALA  23          2HB       ALA  23   6.483  24.232  12.495
  189    HB3  ALA  23          3HB       ALA  23   8.041  24.847  13.047
  190    H    THR  24           H        THR  24   4.801  24.402  13.844
  191    HA   THR  24           HA       THR  24   4.733  26.802  15.229
  192    HB   THR  24           HB       THR  24   2.238  25.162  14.925
  193    HG1  THR  24           HG1      THR  24   2.780  24.916  12.888
  194   HG21  THR  24          1HG2      THR  24   2.982  28.025  15.073
  195   HG22  THR  24          2HG2      THR  24   1.555  27.190  15.689
  196   HG23  THR  24          3HG2      THR  24   1.665  27.604  13.978
  197    H    ALA  25           H        ALA  25   3.768  23.571  16.305
  198    HA   ALA  25           HA       ALA  25   2.710  24.360  18.802
  199    HB1  ALA  25          1HB       ALA  25   2.683  22.058  19.365
  200    HB2  ALA  25          2HB       ALA  25   2.341  22.157  17.637
  201    HB3  ALA  25          3HB       ALA  25   3.947  21.686  18.192
  202    H    SER  26           H        SER  26   5.835  22.803  18.052
  203    HA   SER  26           HA       SER  26   6.935  23.028  20.604
  204    HB2  SER  26          2HB       SER  26   7.818  21.672  18.638
  205    HB3  SER  26          3HB       SER  26   8.541  23.168  18.050
  206    HG   SER  26           HG       SER  26   9.198  21.621  20.281
  207    H    SER  27           H        SER  27   6.607  25.372  18.063
  208    HA   SER  27           HA       SER  27   8.571  27.214  18.846
  209    HB2  SER  27          2HB       SER  27   6.091  27.319  17.209
  210    HB3  SER  27          3HB       SER  27   6.730  28.857  17.789
  211    HG   SER  27           HG       SER  27   7.842  28.586  15.974
  212    H    GLN  28           H        GLN  28   5.153  26.946  19.767
  213    HA   GLN  28           HA       GLN  28   5.726  28.718  22.050
  214    HB2  GLN  28          2HB       GLN  28   3.381  28.648  20.191
  215    HB3  GLN  28          3HB       GLN  28   3.152  29.177  21.852
  216    HG2  GLN  28          2HG       GLN  28   5.356  30.605  21.048
  217    HG3  GLN  28          3HG       GLN  28   4.354  30.560  19.598
  218   HE21  GLN  28          1HE2      GLN  28   1.928  30.926  20.175
  219   HE22  GLN  28          2HE2      GLN  28   1.627  32.300  21.179
  220    H    VAL  29           H        VAL  29   2.915  26.737  21.157
  221    HA   VAL  29           HA       VAL  29   3.385  24.604  22.900
  222    HB   VAL  29           HB       VAL  29   3.210  26.130  24.740
  223   HG11  VAL  29          1HG1      VAL  29   0.582  27.011  23.549
  224   HG12  VAL  29          2HG1      VAL  29   1.234  27.535  25.102
  225   HG13  VAL  29          3HG1      VAL  29   2.068  27.958  23.607
  226   HG21  VAL  29          1HG2      VAL  29   2.121  23.936  24.987
  227   HG22  VAL  29          2HG2      VAL  29   1.344  25.180  25.966
  228   HG23  VAL  29          3HG2      VAL  29   0.596  24.649  24.460
  229    H    LEU  30           H        LEU  30   1.059  26.704  21.335
  230    HA   LEU  30           HA       LEU  30  -0.786  26.258  20.079
  231    HB2  LEU  30          2HB       LEU  30   0.829  24.294  19.410
  232    HB3  LEU  30          3HB       LEU  30  -0.341  23.318  20.296
  233    HG   LEU  30           HG       LEU  30  -1.895  24.845  18.575
  234   HD11  LEU  30          1HD1      LEU  30   0.662  24.970  17.543
  235   HD12  LEU  30          2HD1      LEU  30  -0.838  25.240  16.657
  236   HD13  LEU  30          3HD1      LEU  30  -0.086  23.645  16.651
  237   HD21  LEU  30          1HD2      LEU  30  -2.406  22.755  17.549
  238   HD22  LEU  30          2HD2      LEU  30  -2.115  22.448  19.261
  239   HD23  LEU  30          3HD2      LEU  30  -0.873  22.056  18.071
  240    H    ILE  31           H        ILE  31  -2.028  26.980  21.902
  241    HA   ILE  31           HA       ILE  31  -3.871  24.944  22.821
  242    HB   ILE  31           HB       ILE  31  -3.679  25.808  25.215
  243   HG12  ILE  31          2HG1      ILE  31  -0.827  26.333  24.891
  244   HG13  ILE  31          3HG1      ILE  31  -1.827  27.525  24.068
  245   HG21  ILE  31          1HG2      ILE  31  -2.961  23.567  24.430
  246   HG22  ILE  31          2HG2      ILE  31  -1.348  24.221  24.153
  247   HG23  ILE  31          3HG2      ILE  31  -2.010  24.173  25.787
  248   HD11  ILE  31          1HD1      ILE  31  -2.932  27.085  26.638
  249   HD12  ILE  31          2HD1      ILE  31  -1.196  27.340  26.817
  250   HD13  ILE  31          3HD1      ILE  31  -2.184  28.545  25.991
  251    HA   PRO  32           HA       PRO  32  -6.783  28.214  22.507
  252    HB2  PRO  32          2HB       PRO  32  -8.605  27.492  24.386
  253    HB3  PRO  32          3HB       PRO  32  -8.418  26.636  22.851
  254    HG2  PRO  32          2HG       PRO  32  -7.350  25.928  25.556
  255    HG3  PRO  32          3HG       PRO  32  -8.094  24.877  24.337
  256    HD2  PRO  32          2HD       PRO  32  -5.414  25.027  24.691
  257    HD3  PRO  32          3HD       PRO  32  -6.152  24.719  23.106
  258    H    GLU  33           H        GLU  33  -6.143  30.190  23.146
  259    HA   GLU  33           HA       GLU  33  -6.208  30.780  26.030
  260    HB2  GLU  33          2HB       GLU  33  -3.895  30.767  25.435
  261    HB3  GLU  33          3HB       GLU  33  -4.200  31.702  23.978
  262    HG2  GLU  33          2HG       GLU  33  -4.736  33.651  25.282
  263    HG3  GLU  33          3HG       GLU  33  -4.597  32.729  26.778
  264    H    ILE  34           H        ILE  34  -5.705  32.775  23.133
  265    HA   ILE  34           HA       ILE  34  -8.190  34.216  23.782
  266    HB   ILE  34           HB       ILE  34  -7.108  36.321  23.091
  267   HG12  ILE  34          2HG1      ILE  34  -4.420  35.960  23.329
  268   HG13  ILE  34          3HG1      ILE  34  -4.884  34.463  22.527
  269   HG21  ILE  34          1HG2      ILE  34  -6.789  34.925  25.500
  270   HG22  ILE  34          2HG2      ILE  34  -5.231  35.681  25.166
  271   HG23  ILE  34          3HG2      ILE  34  -6.691  36.667  25.244
  272   HD11  ILE  34          1HD1      ILE  34  -4.479  35.780  20.720
  273   HD12  ILE  34          2HD1      ILE  34  -6.194  36.120  20.955
  274   HD13  ILE  34          3HD1      ILE  34  -4.981  37.257  21.542
  275    H    ASN  35           H        ASN  35  -5.850  33.274  21.325
  276    HA   ASN  35           HA       ASN  35  -7.821  32.862  19.355
  277    HB2  ASN  35          2HB       ASN  35  -7.759  35.390  19.420
  278    HB3  ASN  35          3HB       ASN  35  -6.105  35.291  18.823
  279   HD21  ASN  35          1HD2      ASN  35  -9.051  35.978  17.847
  280   HD22  ASN  35          2HD2      ASN  35  -9.017  35.387  16.224
  281    H    LEU  36           H        LEU  36  -6.303  30.981  19.780
  282    HA   LEU  36           HA       LEU  36  -3.864  31.189  18.151
  283    HB2  LEU  36          2HB       LEU  36  -3.455  30.449  20.408
  284    HB3  LEU  36          3HB       LEU  36  -4.679  29.190  20.254
  285    HG   LEU  36           HG       LEU  36  -2.594  28.935  18.250
  286   HD11  LEU  36          1HD1      LEU  36  -1.782  28.773  21.148
  287   HD12  LEU  36          2HD1      LEU  36  -1.202  29.953  19.973
  288   HD13  LEU  36          3HD1      LEU  36  -0.815  28.244  19.771
  289   HD21  LEU  36          1HD2      LEU  36  -3.689  27.153  20.421
  290   HD22  LEU  36          2HD2      LEU  36  -2.540  26.637  19.186
  291   HD23  LEU  36          3HD2      LEU  36  -4.156  27.169  18.720
  292    H    ASN  37           H        ASN  37  -6.815  29.325  18.626
  293    HA   ASN  37           HA       ASN  37  -6.376  27.267  16.810
  294    HB2  ASN  37          2HB       ASN  37  -8.793  28.595  17.937
  295    HB3  ASN  37          3HB       ASN  37  -9.017  27.555  16.534
  296   HD21  ASN  37          1HD2      ASN  37  -8.915  27.653  19.833
  297   HD22  ASN  37          2HD2      ASN  37  -8.662  25.974  20.155
  298    H    ASP  38           H        ASP  38  -7.851  30.454  16.254
  299    HA   ASP  38           HA       ASP  38  -8.405  30.133  13.533
  300    HB2  ASP  38          2HB       ASP  38  -9.025  32.046  15.227
  301    HB3  ASP  38          3HB       ASP  38  -7.558  32.797  14.605
  302    H    THR  39           H        THR  39  -5.570  31.629  15.087
  303    HA   THR  39           HA       THR  39  -4.150  32.244  12.772
  304    HB   THR  39           HB       THR  39  -2.286  31.441  14.781
  305    HG1  THR  39           HG1      THR  39  -3.168  32.728  16.515
  306   HG21  THR  39          1HG2      THR  39  -2.190  34.042  14.994
  307   HG22  THR  39          2HG2      THR  39  -3.282  34.008  13.610
  308   HG23  THR  39          3HG2      THR  39  -1.686  33.268  13.492
  309    H    PHE  40           H        PHE  40  -3.853  29.354  14.840
  310    HA   PHE  40           HA       PHE  40  -1.953  28.021  13.281
  311    HB2  PHE  40          2HB       PHE  40  -2.688  27.435  15.631
  312    HB3  PHE  40          3HB       PHE  40  -4.108  26.679  14.917
  313    HD1  PHE  40           HD1      PHE  40  -0.561  26.659  13.798
  314    HD2  PHE  40           HD2      PHE  40  -3.861  24.408  15.266
  315    HE1  PHE  40           HE1      PHE  40   0.716  24.581  13.473
  316    HE2  PHE  40           HE2      PHE  40  -2.589  22.327  14.945
  317    HZ   PHE  40           HZ       PHE  40  -0.297  22.411  14.047
  318    H    ASP  41           H        ASP  41  -5.483  27.994  13.145
  319    HA   ASP  41           HA       ASP  41  -5.826  25.945  11.283
  320    HB2  ASP  41          2HB       ASP  41  -7.431  28.192  12.297
  321    HB3  ASP  41          3HB       ASP  41  -7.868  27.662  10.675
  322    H    THR  42           H        THR  42  -5.916  29.449  10.608
  323    HA   THR  42           HA       THR  42  -5.902  29.284   7.842
  324    HB   THR  42           HB       THR  42  -6.045  31.353   9.531
  325    HG1  THR  42           HG1      THR  42  -4.984  31.927   6.991
  326   HG21  THR  42          1HG2      THR  42  -3.536  31.116   9.944
  327   HG22  THR  42          2HG2      THR  42  -4.130  32.727   9.539
  328   HG23  THR  42          3HG2      THR  42  -3.323  31.749   8.313
  329    H    PHE  43           H        PHE  43  -3.298  28.865  10.098
  330    HA   PHE  43           HA       PHE  43  -1.173  29.233   8.224
  331    HB2  PHE  43          2HB       PHE  43  -0.982  29.430  10.741
  332    HB3  PHE  43          3HB       PHE  43  -1.057  27.672  10.807
  333    HD1  PHE  43           HD1      PHE  43   1.063  27.115  11.607
  334    HD2  PHE  43           HD2      PHE  43   0.690  29.769   8.300
  335    HE1  PHE  43           HE1      PHE  43   3.494  26.999  11.244
  336    HE2  PHE  43           HE2      PHE  43   3.120  29.656   7.932
  337    HZ   PHE  43           HZ       PHE  43   4.525  28.270   9.404
  338    H    ALA  44           H        ALA  44  -2.385  26.297   9.853
  339    HA   ALA  44           HA       ALA  44  -0.962  24.451   8.332
  340    HB1  ALA  44          1HB       ALA  44  -1.899  23.534  10.221
  341    HB2  ALA  44          2HB       ALA  44  -3.463  24.304   9.951
  342    HB3  ALA  44          3HB       ALA  44  -2.980  22.921   8.969
  343    H    LEU  45           H        LEU  45  -4.240  25.728   7.829
  344    HA   LEU  45           HA       LEU  45  -5.091  24.249   5.702
  345    HB2  LEU  45          2HB       LEU  45  -6.662  25.756   6.381
  346    HB3  LEU  45          3HB       LEU  45  -5.495  27.068   6.534
  347    HG   LEU  45           HG       LEU  45  -5.512  27.407   4.135
  348   HD11  LEU  45          1HD1      LEU  45  -6.852  24.809   4.167
  349   HD12  LEU  45          2HD1      LEU  45  -5.902  25.584   2.900
  350   HD13  LEU  45          3HD1      LEU  45  -7.605  25.996   3.102
  351   HD21  LEU  45          1HD2      LEU  45  -8.394  27.312   4.448
  352   HD22  LEU  45          2HD2      LEU  45  -7.318  28.702   4.291
  353   HD23  LEU  45          3HD2      LEU  45  -7.590  27.969   5.873
  354    H    ASP  46           H        ASP  46  -3.341  27.343   5.367
  355    HA   ASP  46           HA       ASP  46  -2.965  27.342   2.649
  356    HB2  ASP  46          2HB       ASP  46  -2.106  28.915   4.714
  357    HB3  ASP  46          3HB       ASP  46  -0.591  28.213   4.152
  358    H    PHE  47           H        PHE  47  -0.824  25.884   5.088
  359    HA   PHE  47           HA       PHE  47   1.121  24.902   3.353
  360    HB2  PHE  47          2HB       PHE  47   0.324  24.456   6.125
  361    HB3  PHE  47          3HB       PHE  47   0.993  23.011   5.374
  362    HD1  PHE  47           HD1      PHE  47   3.157  23.651   3.827
  363    HD2  PHE  47           HD2      PHE  47   1.824  25.703   7.310
  364    HE1  PHE  47           HE1      PHE  47   5.432  24.519   4.184
  365    HE2  PHE  47           HE2      PHE  47   4.096  26.575   7.671
  366    HZ   PHE  47           HZ       PHE  47   5.904  25.983   6.106
  367    H    SER  48           H        SER  48  -1.603  23.089   4.778
  368    HA   SER  48           HA       SER  48  -1.280  20.722   3.398
  369    HB2  SER  48          2HB       SER  48  -3.024  21.501   5.245
  370    HB3  SER  48          3HB       SER  48  -4.064  21.708   3.835
  371    HG   SER  48           HG       SER  48  -4.392  19.642   4.247
  372    H    ARG  49           H        ARG  49  -3.090  23.608   2.413
  373    HA   ARG  49           HA       ARG  49  -4.334  22.784   0.142
  374    HB2  ARG  49          2HB       ARG  49  -4.185  25.140   1.182
  375    HB3  ARG  49          3HB       ARG  49  -2.776  25.356   0.152
  376    HG2  ARG  49          2HG       ARG  49  -4.764  24.352  -1.528
  377    HG3  ARG  49          3HG       ARG  49  -5.569  25.540  -0.500
  378    HD2  ARG  49          2HD       ARG  49  -3.661  27.109  -1.057
  379    HD3  ARG  49          3HD       ARG  49  -3.183  25.942  -2.289
  380    HE   ARG  49           HE       ARG  49  -5.797  26.403  -2.834
  381   HH11  ARG  49          1HH1      ARG  49  -3.610  29.697  -3.460
  382   HH12  ARG  49          2HH1      ARG  49  -3.030  28.466  -2.387
  383   HH21  ARG  49          1HH2      ARG  49  -5.626  29.439  -4.518
  384   HH22  ARG  49          2HH2      ARG  49  -6.572  28.015  -4.249
  385    H    GLU  50           H        GLU  50  -0.919  23.705   0.424
  386    HA   GLU  50           HA       GLU  50  -0.376  23.148  -2.344
  387    HB2  GLU  50          2HB       GLU  50   1.002  24.369  -0.129
  388    HB3  GLU  50          3HB       GLU  50   2.047  23.188  -0.907
  389    HG2  GLU  50          2HG       GLU  50   1.298  24.360  -3.100
  390    HG3  GLU  50          3HG       GLU  50   0.856  25.684  -2.023
  391    H    LYS  51           H        LYS  51  -0.056  21.461   0.711
  392    HA   LYS  51           HA       LYS  51   1.610  19.362  -0.145
  393    HB2  LYS  51          2HB       LYS  51   1.307  18.514   1.936
  394    HB3  LYS  51          3HB       LYS  51   0.606  20.097   2.245
  395    HG2  LYS  51          2HG       LYS  51  -1.036  18.782   3.098
  396    HG3  LYS  51          3HG       LYS  51  -1.596  18.893   1.427
  397    HD2  LYS  51          2HD       LYS  51  -0.043  16.760   1.161
  398    HD3  LYS  51          3HD       LYS  51  -0.387  16.601   2.885
  399    HE2  LYS  51          2HE       LYS  51  -2.779  16.646   2.420
  400    HE3  LYS  51          3HE       LYS  51  -2.454  16.853   0.700
  401    HZ1  LYS  51          1HZ       LYS  51  -2.325  14.464   2.331
  402    HZ2  LYS  51          2HZ       LYS  51  -1.047  14.647   1.238
  403    HZ3  LYS  51          3HZ       LYS  51  -2.643  14.632   0.677
  404    H    LYS  52           H        LYS  52  -1.793  19.954  -0.540
  405    HA   LYS  52           HA       LYS  52  -2.471  17.264  -1.270
  406    HB2  LYS  52          2HB       LYS  52  -4.207  18.633  -0.352
  407    HB3  LYS  52          3HB       LYS  52  -3.927  19.893  -1.546
  408    HG2  LYS  52          2HG       LYS  52  -5.925  18.708  -2.120
  409    HG3  LYS  52          3HG       LYS  52  -4.679  18.327  -3.310
  410    HD2  LYS  52          2HD       LYS  52  -5.718  16.273  -2.799
  411    HD3  LYS  52          3HD       LYS  52  -4.189  16.260  -1.918
  412    HE2  LYS  52          2HE       LYS  52  -5.231  16.105   0.045
  413    HE3  LYS  52          3HE       LYS  52  -6.308  17.444  -0.347
  414    HZ1  LYS  52          1HZ       LYS  52  -7.210  15.362  -1.872
  415    HZ2  LYS  52          2HZ       LYS  52  -7.912  15.931  -0.442
  416    HZ3  LYS  52          3HZ       LYS  52  -6.821  14.638  -0.393
  417    H    LEU  53           H        LEU  53  -2.147  20.308  -3.096
  418    HA   LEU  53           HA       LEU  53  -2.596  19.331  -5.640
  419    HB2  LEU  53          2HB       LEU  53  -1.556  21.703  -4.473
  420    HB3  LEU  53          3HB       LEU  53  -0.488  21.231  -5.793
  421    HG   LEU  53           HG       LEU  53  -2.481  21.183  -7.294
  422   HD11  LEU  53          1HD1      LEU  53  -4.381  22.693  -6.258
  423   HD12  LEU  53          2HD1      LEU  53  -3.802  21.978  -4.754
  424   HD13  LEU  53          3HD1      LEU  53  -4.381  20.941  -6.058
  425   HD21  LEU  53          1HD2      LEU  53  -2.533  23.921  -6.250
  426   HD22  LEU  53          2HD2      LEU  53  -2.095  23.322  -7.850
  427   HD23  LEU  53          3HD2      LEU  53  -0.917  23.277  -6.537
  428    H    LEU  54           H        LEU  54   0.168  18.916  -3.593
  429    HA   LEU  54           HA       LEU  54   1.998  18.146  -5.647
  430    HB2  LEU  54          2HB       LEU  54   2.991  18.928  -3.682
  431    HB3  LEU  54          3HB       LEU  54   1.969  17.920  -2.659
  432    HG   LEU  54           HG       LEU  54   3.874  16.554  -4.487
  433   HD11  LEU  54          1HD1      LEU  54   4.736  17.839  -1.901
  434   HD12  LEU  54          2HD1      LEU  54   5.186  18.401  -3.510
  435   HD13  LEU  54          3HD1      LEU  54   5.714  16.814  -2.951
  436   HD21  LEU  54          1HD2      LEU  54   3.926  15.561  -1.862
  437   HD22  LEU  54          2HD2      LEU  54   3.139  14.849  -3.272
  438   HD23  LEU  54          3HD2      LEU  54   2.239  15.938  -2.214
  439    H    GLU  55           H        GLU  55   0.200  16.304  -3.180
  440    HA   GLU  55           HA       GLU  55   0.973  13.761  -4.110
  441    HB2  GLU  55          2HB       GLU  55  -0.061  14.356  -1.859
  442    HB3  GLU  55          3HB       GLU  55  -1.612  14.373  -2.685
  443    HG2  GLU  55          2HG       GLU  55  -0.644  11.970  -3.467
  444    HG3  GLU  55          3HG       GLU  55   0.064  12.115  -1.859
  445    H    CYS  56           H        CYS  56  -2.227  15.313  -4.413
  446    HA   CYS  56           HA       CYS  56  -2.542  13.923  -6.992
  447    HB2  CYS  56          2HB       CYS  56  -4.126  13.674  -4.653
  448    HB3  CYS  56          3HB       CYS  56  -5.089  14.547  -5.838
  449    HG   CYS  56           HG       CYS  56  -3.699  11.447  -6.236
  450    H    LEU  57           H        LEU  57  -4.109  14.983  -8.467
  451    HA   LEU  57           HA       LEU  57  -4.716  16.778  -9.724
  452    HB2  LEU  57          2HB       LEU  57  -5.431  17.399  -6.987
  453    HB3  LEU  57          3HB       LEU  57  -5.095  18.856  -7.920
  454    HG   LEU  57           HG       LEU  57  -6.743  17.810  -9.644
  455   HD11  LEU  57          1HD1      LEU  57  -8.220  16.659  -7.408
  456   HD12  LEU  57          2HD1      LEU  57  -6.760  15.763  -7.825
  457   HD13  LEU  57          3HD1      LEU  57  -7.993  16.058  -9.050
  458   HD21  LEU  57          1HD2      LEU  57  -8.475  19.094  -8.739
  459   HD22  LEU  57          2HD2      LEU  57  -7.006  19.854  -8.127
  460   HD23  LEU  57          3HD2      LEU  57  -7.954  18.795  -7.081
  461    H    ASP  58           H        ASP  58  -2.746  17.104 -10.751
  462    HA   ASP  58           HA       ASP  58  -0.960  19.117  -9.568
  463    HB2  ASP  58          2HB       ASP  58   0.762  18.296 -11.056
  464    HB3  ASP  58          3HB       ASP  58   0.046  16.931 -10.203
  465    H    TYR  59           H        TYR  59  -0.038  20.740 -11.008
  466    HA   TYR  59           HA       TYR  59  -0.230  22.462 -12.480
  467    HB2  TYR  59          2HB       TYR  59  -0.045  20.579 -14.123
  468    HB3  TYR  59          3HB       TYR  59  -1.803  20.522 -14.184
  469    HD1  TYR  59           HD1      TYR  59  -2.835  21.649 -15.909
  470    HD2  TYR  59           HD2      TYR  59   0.947  23.034 -14.537
  471    HE1  TYR  59           HE1      TYR  59  -2.834  23.369 -17.666
  472    HE2  TYR  59           HE2      TYR  59   0.958  24.759 -16.290
  473    HH   TYR  59           HH       TYR  59  -1.838  25.331 -18.322
  474    H    LEU  60           H        LEU  60  -1.489  23.847 -11.294
  475    HA   LEU  60           HA       LEU  60  -3.303  25.080 -10.694
  476    HB2  LEU  60          2HB       LEU  60  -3.639  24.384 -13.484
  477    HB3  LEU  60          3HB       LEU  60  -5.190  24.620 -12.683
  478    HG   LEU  60           HG       LEU  60  -2.976  26.659 -12.600
  479   HD11  LEU  60          1HD1      LEU  60  -5.256  26.397 -14.551
  480   HD12  LEU  60          2HD1      LEU  60  -3.530  26.366 -14.913
  481   HD13  LEU  60          3HD1      LEU  60  -4.284  27.854 -14.340
  482   HD21  LEU  60          1HD2      LEU  60  -5.838  27.354 -12.367
  483   HD22  LEU  60          2HD2      LEU  60  -4.435  28.016 -11.528
  484   HD23  LEU  60          3HD2      LEU  60  -5.126  26.476 -11.013
  Start of MODEL   11
    1    H    LEU   1           H        LEU   1   7.472   0.934   5.868
    2    HA   LEU   1           HA       LEU   1   8.991   2.935   5.498
    3    HB2  LEU   1          2HB       LEU   1  10.903   0.776   6.346
    4    HB3  LEU   1          3HB       LEU   1  11.420   2.195   5.438
    5    HG   LEU   1           HG       LEU   1   9.936   3.057   7.719
    6   HD11  LEU   1          1HD1      LEU   1  12.041   0.980   8.245
    7   HD12  LEU   1          2HD1      LEU   1  10.398   1.066   8.880
    8   HD13  LEU   1          3HD1      LEU   1  11.615   2.218   9.427
    9   HD21  LEU   1          1HD2      LEU   1  11.604   4.368   6.520
   10   HD22  LEU   1          2HD2      LEU   1  12.865   3.239   7.015
   11   HD23  LEU   1          3HD2      LEU   1  12.030   4.216   8.224
   12    H    LYS   2           H        LYS   2   9.156   3.281   3.377
   13    HA   LYS   2           HA       LYS   2   9.964   1.139   1.584
   14    HB2  LYS   2          2HB       LYS   2   7.259   2.473   1.452
   15    HB3  LYS   2          3HB       LYS   2   7.969   1.608   0.095
   16    HG2  LYS   2          2HG       LYS   2   6.769  -0.095   0.951
   17    HG3  LYS   2          3HG       LYS   2   8.198  -0.283   1.970
   18    HD2  LYS   2          2HD       LYS   2   6.534  -0.298   3.554
   19    HD3  LYS   2          3HD       LYS   2   6.936   1.420   3.516
   20    HE2  LYS   2          2HE       LYS   2   4.836   1.896   2.978
   21    HE3  LYS   2          3HE       LYS   2   4.996   0.939   1.506
   22    HZ1  LYS   2          1HZ       LYS   2   3.151   0.245   2.994
   23    HZ2  LYS   2          2HZ       LYS   2   4.298  -0.214   4.149
   24    HZ3  LYS   2          3HZ       LYS   2   4.252  -0.993   2.648
   25    H    GLU   3           H        GLU   3   9.963   2.020  -0.760
   26    HA   GLU   3           HA       GLU   3  10.512   4.889  -0.858
   27    HB2  GLU   3          2HB       GLU   3  12.488   2.722  -1.556
   28    HB3  GLU   3          3HB       GLU   3  12.625   4.358  -2.185
   29    HG2  GLU   3          2HG       GLU   3  12.783   5.229   0.084
   30    HG3  GLU   3          3HG       GLU   3  12.622   3.596   0.727
   31    H    ASN   4           H        ASN   4   8.298   3.633  -1.890
   32    HA   ASN   4           HA       ASN   4   8.754   3.097  -4.704
   33    HB2  ASN   4          2HB       ASN   4   6.515   2.779  -2.802
   34    HB3  ASN   4          3HB       ASN   4   6.051   3.161  -4.458
   35   HD21  ASN   4          1HD2      ASN   4   6.200   0.692  -2.528
   36   HD22  ASN   4          2HD2      ASN   4   6.741  -0.561  -3.587
   37    H    ASP   5           H        ASP   5   7.175   4.184  -6.277
   38    HA   ASP   5           HA       ASP   5   7.776   6.899  -6.453
   39    HB2  ASP   5          2HB       ASP   5   5.630   5.244  -7.781
   40    HB3  ASP   5          3HB       ASP   5   5.904   6.938  -8.177
   41    H    HIS   6           H        HIS   6   4.725   5.345  -5.480
   42    HA   HIS   6           HA       HIS   6   3.452   7.819  -4.833
   43    HB2  HIS   6          2HB       HIS   6   2.295   5.651  -5.483
   44    HB3  HIS   6          3HB       HIS   6   2.641   5.081  -3.854
   45    HD1  HIS   6           HD1      HIS   6   0.316   5.036  -2.912
   46    HD2  HIS   6           HD2      HIS   6   1.254   8.678  -4.677
   47    HE1  HIS   6           HE1      HIS   6  -1.587   6.575  -2.331
   48    H    ALA   7           H        ALA   7   5.473   5.578  -3.130
   49    HA   ALA   7           HA       ALA   7   4.763   6.290  -0.485
   50    HB1  ALA   7          1HB       ALA   7   6.340   4.814   0.150
   51    HB2  ALA   7          2HB       ALA   7   6.312   4.357  -1.553
   52    HB3  ALA   7          3HB       ALA   7   7.548   5.464  -0.958
   53    H    ARG   8           H        ARG   8   7.626   7.219  -2.408
   54    HA   ARG   8           HA       ARG   8   8.657   9.096  -0.647
   55    HB2  ARG   8          2HB       ARG   8   9.968   8.353  -2.514
   56    HB3  ARG   8          3HB       ARG   8   8.785   8.970  -3.659
   57    HG2  ARG   8          2HG       ARG   8   9.779  10.947  -3.704
   58    HG3  ARG   8          3HG       ARG   8   9.687  11.086  -1.948
   59    HD2  ARG   8          2HD       ARG   8  11.820  10.422  -1.655
   60    HD3  ARG   8          3HD       ARG   8  11.733   9.230  -2.951
   61    HE   ARG   8           HE       ARG   8  12.700  11.916  -3.143
   62   HH11  ARG   8          1HH1      ARG   8  11.776   9.854  -6.447
   63   HH12  ARG   8          2HH1      ARG   8  11.196   9.318  -4.905
   64   HH21  ARG   8          1HH2      ARG   8  13.071  11.738  -6.595
   65   HH22  ARG   8          2HH2      ARG   8  13.471  12.631  -5.167
   66    H    PHE   9           H        PHE   9   6.289   9.531  -3.247
   67    HA   PHE   9           HA       PHE   9   6.045  12.309  -3.104
   68    HB2  PHE   9          2HB       PHE   9   4.489  10.087  -4.225
   69    HB3  PHE   9          3HB       PHE   9   3.516  11.486  -3.785
   70    HD1  PHE   9           HD1      PHE   9   4.975  13.781  -4.454
   71    HD2  PHE   9           HD2      PHE   9   4.939  10.030  -6.464
   72    HE1  PHE   9           HE1      PHE   9   5.637  14.899  -6.544
   73    HE2  PHE   9           HE2      PHE   9   5.602  11.141  -8.557
   74    HZ   PHE   9           HZ       PHE   9   5.952  13.578  -8.599
   75    H    LEU  10           H        LEU  10   4.223   9.773  -1.411
   76    HA   LEU  10           HA       LEU  10   2.544  11.551   0.018
   77    HB2  LEU  10          2HB       LEU  10   2.805   8.781  -0.293
   78    HB3  LEU  10          3HB       LEU  10   3.017   9.085   1.430
   79    HG   LEU  10           HG       LEU  10   0.753  10.561   0.583
   80   HD11  LEU  10          1HD1      LEU  10   0.792   8.961  -1.354
   81   HD12  LEU  10          2HD1      LEU  10  -0.677   8.934  -0.380
   82   HD13  LEU  10          3HD1      LEU  10   0.529   7.662  -0.190
   83   HD21  LEU  10          1HD2      LEU  10  -0.346   9.335   2.272
   84   HD22  LEU  10          2HD2      LEU  10   1.325   9.500   2.811
   85   HD23  LEU  10          3HD2      LEU  10   0.768   7.976   2.119
   86    H    GLN  11           H        GLN  11   5.676  10.104   0.702
   87    HA   GLN  11           HA       GLN  11   5.875  10.724   3.417
   88    HB2  GLN  11          2HB       GLN  11   7.802  10.164   1.228
   89    HB3  GLN  11          3HB       GLN  11   8.442  10.927   2.677
   90    HG2  GLN  11          2HG       GLN  11   6.926   8.918   3.724
   91    HG3  GLN  11          3HG       GLN  11   7.530   8.189   2.237
   92   HE21  GLN  11          1HE2      GLN  11  10.000   9.282   2.004
   93   HE22  GLN  11          2HE2      GLN  11  10.997   8.793   3.327
   94    H    THR  12           H        THR  12   6.164  12.729   0.600
   95    HA   THR  12           HA       THR  12   7.452  14.912   1.974
   96    HB   THR  12           HB       THR  12   6.152  14.782  -0.752
   97    HG1  THR  12           HG1      THR  12   8.000  13.672  -0.941
   98   HG21  THR  12          1HG2      THR  12   6.101  17.034  -0.494
   99   HG22  THR  12          2HG2      THR  12   7.813  16.895  -0.893
  100   HG23  THR  12          3HG2      THR  12   7.308  17.021   0.792
  101    H    ALA  13           H        ALA  13   4.227  14.420   0.531
  102    HA   ALA  13           HA       ALA  13   3.036  16.784   1.301
  103    HB1  ALA  13          1HB       ALA  13   2.069  14.081   0.629
  104    HB2  ALA  13          2HB       ALA  13   0.943  15.108   1.518
  105    HB3  ALA  13          3HB       ALA  13   1.604  15.651  -0.025
  106    H    LYS  14           H        LYS  14   3.303  13.767   3.151
  107    HA   LYS  14           HA       LYS  14   1.872  14.737   5.412
  108    HB2  LYS  14          2HB       LYS  14   2.870  12.274   4.569
  109    HB3  LYS  14          3HB       LYS  14   3.784  12.638   6.026
  110    HG2  LYS  14          2HG       LYS  14   2.059  12.129   7.319
  111    HG3  LYS  14          3HG       LYS  14   0.987  13.199   6.413
  112    HD2  LYS  14          2HD       LYS  14   0.540  11.472   4.800
  113    HD3  LYS  14          3HD       LYS  14   1.745  10.414   5.537
  114    HE2  LYS  14          2HE       LYS  14   0.366  10.521   7.649
  115    HE3  LYS  14          3HE       LYS  14  -0.886  11.312   6.693
  116    HZ1  LYS  14          1HZ       LYS  14  -0.889   8.740   7.019
  117    HZ2  LYS  14          2HZ       LYS  14   0.218   8.766   5.741
  118    HZ3  LYS  14          3HZ       LYS  14  -1.331   9.412   5.531
  119    H    ASN  15           H        ASN  15   5.328  14.370   4.685
  120    HA   ASN  15           HA       ASN  15   6.348  15.217   7.134
  121    HB2  ASN  15          2HB       ASN  15   7.804  14.208   5.505
  122    HB3  ASN  15          3HB       ASN  15   7.479  15.492   4.344
  123   HD21  ASN  15          1HD2      ASN  15   9.494  16.274   4.094
  124   HD22  ASN  15          2HD2      ASN  15  10.424  16.992   5.361
  125    H    ILE  16           H        ILE  16   4.827  17.007   4.616
  126    HA   ILE  16           HA       ILE  16   5.913  19.566   5.297
  127    HB   ILE  16           HB       ILE  16   3.481  18.800   3.683
  128   HG12  ILE  16          2HG1      ILE  16   5.878  20.126   2.524
  129   HG13  ILE  16          3HG1      ILE  16   6.045  18.440   2.998
  130   HG21  ILE  16          1HG2      ILE  16   2.881  20.923   4.288
  131   HG22  ILE  16          2HG2      ILE  16   4.549  21.455   4.494
  132   HG23  ILE  16          3HG2      ILE  16   3.875  21.274   2.874
  133   HD11  ILE  16          1HD1      ILE  16   5.116  17.838   1.090
  134   HD12  ILE  16          2HD1      ILE  16   3.632  18.669   1.556
  135   HD13  ILE  16          3HD1      ILE  16   4.878  19.529   0.652
  136    H    THR  17           H        THR  17   2.734  18.040   5.817
  137    HA   THR  17           HA       THR  17   1.822  20.153   7.524
  138    HB   THR  17           HB       THR  17   0.475  17.523   7.691
  139    HG1  THR  17           HG1      THR  17  -0.452  17.978   5.538
  140   HG21  THR  17          1HG2      THR  17  -0.227  20.406   7.564
  141   HG22  THR  17          2HG2      THR  17  -0.849  19.134   8.616
  142   HG23  THR  17          3HG2      THR  17  -1.411  19.253   6.949
  143    H    GLU  18           H        GLU  18   3.639  17.268   7.968
  144    HA   GLU  18           HA       GLU  18   3.021  16.933  10.756
  145    HB2  GLU  18          2HB       GLU  18   3.671  14.996   9.459
  146    HB3  GLU  18          3HB       GLU  18   5.195  15.755   9.020
  147    HG2  GLU  18          2HG       GLU  18   6.165  14.918  10.817
  148    HG3  GLU  18          3HG       GLU  18   4.985  15.711  11.858
  149    H    ARG  19           H        ARG  19   5.608  18.408   8.869
  150    HA   ARG  19           HA       ARG  19   7.306  18.974  11.074
  151    HB2  ARG  19          2HB       ARG  19   7.943  18.903   8.608
  152    HB3  ARG  19          3HB       ARG  19   7.223  20.502   8.477
  153    HG2  ARG  19          2HG       ARG  19   8.949  20.656  10.661
  154    HG3  ARG  19          3HG       ARG  19   9.822  19.735   9.435
  155    HD2  ARG  19          2HD       ARG  19   9.333  21.509   7.795
  156    HD3  ARG  19          3HD       ARG  19   8.532  22.436   9.064
  157    HE   ARG  19           HE       ARG  19  11.110  21.842   9.941
  158   HH11  ARG  19          1HH1      ARG  19  10.817  24.875   7.345
  159   HH12  ARG  19          2HH1      ARG  19   9.550  23.698   7.443
  160   HH21  ARG  19          1HH2      ARG  19  12.657  24.696   8.697
  161   HH22  ARG  19          2HH2      ARG  19  12.785  23.386   9.821
  162    H    VAL  20           H        VAL  20   4.960  20.938   9.265
  163    HA   VAL  20           HA       VAL  20   5.307  23.358  10.567
  164    HB   VAL  20           HB       VAL  20   3.905  23.239   8.621
  165   HG11  VAL  20          1HG1      VAL  20   3.041  20.934   9.137
  166   HG12  VAL  20          2HG1      VAL  20   1.877  21.695  10.223
  167   HG13  VAL  20          3HG1      VAL  20   1.846  22.062   8.498
  168   HG21  VAL  20          1HG2      VAL  20   3.214  24.588  10.968
  169   HG22  VAL  20          2HG2      VAL  20   2.715  24.983   9.323
  170   HG23  VAL  20          3HG2      VAL  20   1.698  23.952  10.330
  171    H    SER  21           H        SER  21   3.184  20.652  11.448
  172    HA   SER  21           HA       SER  21   1.935  21.828  13.647
  173    HB2  SER  21          2HB       SER  21   2.072  19.235  12.470
  174    HB3  SER  21          3HB       SER  21   2.342  19.058  14.203
  175    HG   SER  21           HG       SER  21   0.176  19.037  13.998
  176    H    MET  22           H        MET  22   4.878  19.834  13.527
  177    HA   MET  22           HA       MET  22   5.463  19.775  16.236
  178    HB2  MET  22          2HB       MET  22   6.949  19.383  13.739
  179    HB3  MET  22          3HB       MET  22   7.951  19.916  15.082
  180    HG2  MET  22          2HG       MET  22   6.481  17.966  16.262
  181    HG3  MET  22          3HG       MET  22   6.622  17.349  14.618
  182    HE1  MET  22          1HE       MET  22  10.112  18.190  17.501
  183    HE2  MET  22          2HE       MET  22   9.226  19.522  16.759
  184    HE3  MET  22          3HE       MET  22   8.399  18.414  17.856
  185    H    ALA  23           H        ALA  23   6.283  22.230  13.822
  186    HA   ALA  23           HA       ALA  23   7.874  23.837  15.514
  187    HB1  ALA  23          1HB       ALA  23   7.200  25.651  13.789
  188    HB2  ALA  23          2HB       ALA  23   8.176  24.279  13.263
  189    HB3  ALA  23          3HB       ALA  23   6.445  24.309  12.930
  190    H    THR  24           H        THR  24   4.420  23.682  14.918
  191    HA   THR  24           HA       THR  24   3.827  26.106  16.345
  192    HB   THR  24           HB       THR  24   1.480  24.602  16.263
  193    HG1  THR  24           HG1      THR  24   2.845  24.294  13.786
  194   HG21  THR  24          1HG2      THR  24   1.463  26.095  13.940
  195   HG22  THR  24          2HG2      THR  24   2.642  26.929  14.952
  196   HG23  THR  24          3HG2      THR  24   1.001  26.668  15.542
  197    H    ALA  25           H        ALA  25   3.998  22.692  17.095
  198    HA   ALA  25           HA       ALA  25   2.849  23.090  19.741
  199    HB1  ALA  25          1HB       ALA  25   2.624  20.818  19.883
  200    HB2  ALA  25          2HB       ALA  25   2.568  21.026  18.132
  201    HB3  ALA  25          3HB       ALA  25   4.061  20.502  18.910
  202    H    SER  26           H        SER  26   5.747  23.732  18.451
  203    HA   SER  26           HA       SER  26   7.229  22.907  20.861
  204    HB2  SER  26          2HB       SER  26   8.063  21.937  18.717
  205    HB3  SER  26          3HB       SER  26   8.377  23.574  18.140
  206    HG   SER  26           HG       SER  26  10.044  23.742  19.465
  207    H    SER  27           H        SER  27   6.205  25.541  18.883
  208    HA   SER  27           HA       SER  27   7.919  27.415  20.356
  209    HB2  SER  27          2HB       SER  27   7.323  27.287  17.670
  210    HB3  SER  27          3HB       SER  27   6.219  28.536  18.246
  211    HG   SER  27           HG       SER  27   9.032  28.482  18.300
  212    H    GLN  28           H        GLN  28   4.570  26.608  19.679
  213    HA   GLN  28           HA       GLN  28   3.743  28.580  21.706
  214    HB2  GLN  28          2HB       GLN  28   2.293  27.601  19.249
  215    HB3  GLN  28          3HB       GLN  28   1.493  28.486  20.541
  216    HG2  GLN  28          2HG       GLN  28   2.505  30.458  20.012
  217    HG3  GLN  28          3HG       GLN  28   3.930  29.673  19.333
  218   HE21  GLN  28          1HE2      GLN  28   1.251  31.412  18.596
  219   HE22  GLN  28          2HE2      GLN  28   1.068  30.978  16.934
  220    H    VAL  29           H        VAL  29   3.671  25.290  20.666
  221    HA   VAL  29           HA       VAL  29   3.008  23.375  21.707
  222    HB   VAL  29           HB       VAL  29   2.237  24.966  24.138
  223   HG11  VAL  29          1HG1      VAL  29   3.700  22.414  24.316
  224   HG12  VAL  29          2HG1      VAL  29   2.325  23.006  25.252
  225   HG13  VAL  29          3HG1      VAL  29   2.071  22.321  23.646
  226   HG21  VAL  29          1HG2      VAL  29   4.956  24.458  23.029
  227   HG22  VAL  29          2HG2      VAL  29   4.330  25.874  23.874
  228   HG23  VAL  29          3HG2      VAL  29   4.724  24.412  24.777
  229    H    LEU  30           H        LEU  30   1.149  25.065  20.204
  230    HA   LEU  30           HA       LEU  30  -1.069  25.258  19.719
  231    HB2  LEU  30          2HB       LEU  30  -0.770  22.562  20.941
  232    HB3  LEU  30          3HB       LEU  30  -2.398  23.158  20.621
  233    HG   LEU  30           HG       LEU  30  -1.936  23.312  18.265
  234   HD11  LEU  30          1HD1      LEU  30   0.241  22.549  17.358
  235   HD12  LEU  30          2HD1      LEU  30   0.872  22.506  19.004
  236   HD13  LEU  30          3HD1      LEU  30   0.354  24.037  18.299
  237   HD21  LEU  30          1HD2      LEU  30  -0.732  20.681  18.664
  238   HD22  LEU  30          2HD2      LEU  30  -2.265  21.127  17.916
  239   HD23  LEU  30          3HD2      LEU  30  -2.150  20.974  19.670
  240    H    ILE  31           H        ILE  31  -1.020  27.082  21.312
  241    HA   ILE  31           HA       ILE  31  -2.724  26.503  23.644
  242    HB   ILE  31           HB       ILE  31  -1.894  28.735  24.500
  243   HG12  ILE  31          2HG1      ILE  31   0.589  28.599  23.003
  244   HG13  ILE  31          3HG1      ILE  31  -0.784  28.893  21.941
  245   HG21  ILE  31          1HG2      ILE  31  -0.985  26.981  25.655
  246   HG22  ILE  31          2HG2      ILE  31  -0.249  26.273  24.218
  247   HG23  ILE  31          3HG2      ILE  31   0.475  27.694  24.970
  248   HD11  ILE  31          1HD1      ILE  31  -1.300  30.907  22.964
  249   HD12  ILE  31          2HD1      ILE  31  -0.395  30.508  24.426
  250   HD13  ILE  31          3HD1      ILE  31   0.464  30.900  22.936
  251    HA   PRO  32           HA       PRO  32  -5.357  28.909  20.690
  252    HB2  PRO  32          2HB       PRO  32  -7.600  27.451  21.155
  253    HB3  PRO  32          3HB       PRO  32  -6.383  26.987  19.960
  254    HG2  PRO  32          2HG       PRO  32  -6.777  25.980  22.752
  255    HG3  PRO  32          3HG       PRO  32  -6.412  25.069  21.275
  256    HD2  PRO  32          2HD       PRO  32  -4.516  25.702  23.101
  257    HD3  PRO  32          3HD       PRO  32  -4.166  25.577  21.365
  258    H    GLU  33           H        GLU  33  -5.206  30.691  22.139
  259    HA   GLU  33           HA       GLU  33  -6.816  30.690  24.547
  260    HB2  GLU  33          2HB       GLU  33  -4.524  31.924  24.024
  261    HB3  GLU  33          3HB       GLU  33  -5.607  33.187  23.454
  262    HG2  GLU  33          2HG       GLU  33  -6.164  32.024  26.118
  263    HG3  GLU  33          3HG       GLU  33  -4.744  33.056  25.960
  264    H    ILE  34           H        ILE  34  -6.663  32.972  21.810
  265    HA   ILE  34           HA       ILE  34  -9.531  32.846  21.458
  266    HB   ILE  34           HB       ILE  34  -9.674  35.404  21.653
  267   HG12  ILE  34          2HG1      ILE  34  -7.233  34.886  23.366
  268   HG13  ILE  34          3HG1      ILE  34  -7.265  35.820  21.874
  269   HG21  ILE  34          1HG2      ILE  34  -9.310  33.920  24.245
  270   HG22  ILE  34          2HG2      ILE  34 -10.404  35.260  23.901
  271   HG23  ILE  34          3HG2      ILE  34 -10.696  33.677  23.181
  272   HD11  ILE  34          1HD1      ILE  34  -9.145  37.118  23.301
  273   HD12  ILE  34          2HD1      ILE  34  -8.078  36.566  24.592
  274   HD13  ILE  34          3HD1      ILE  34  -7.437  37.555  23.280
  275    H    ASN  35           H        ASN  35  -6.497  34.481  20.652
  276    HA   ASN  35           HA       ASN  35  -7.459  34.740  17.879
  277    HB2  ASN  35          2HB       ASN  35  -6.825  36.840  19.329
  278    HB3  ASN  35          3HB       ASN  35  -5.176  36.369  18.928
  279   HD21  ASN  35          1HD2      ASN  35  -8.276  36.535  17.201
  280   HD22  ASN  35          2HD2      ASN  35  -7.664  37.414  15.845
  281    H    LEU  36           H        LEU  36  -6.355  32.341  18.834
  282    HA   LEU  36           HA       LEU  36  -3.742  32.304  17.472
  283    HB2  LEU  36          2HB       LEU  36  -3.546  31.781  19.837
  284    HB3  LEU  36          3HB       LEU  36  -4.764  30.517  19.676
  285    HG   LEU  36           HG       LEU  36  -2.480  30.143  17.898
  286   HD11  LEU  36          1HD1      LEU  36  -0.992  30.912  19.445
  287   HD12  LEU  36          2HD1      LEU  36  -1.186  29.256  20.018
  288   HD13  LEU  36          3HD1      LEU  36  -2.058  30.569  20.808
  289   HD21  LEU  36          1HD2      LEU  36  -3.132  28.171  19.970
  290   HD22  LEU  36          2HD2      LEU  36  -2.982  27.979  18.223
  291   HD23  LEU  36          3HD2      LEU  36  -4.476  28.612  18.917
  292    H    ASN  37           H        ASN  37  -6.807  30.635  17.955
  293    HA   ASN  37           HA       ASN  37  -6.370  28.396  16.359
  294    HB2  ASN  37          2HB       ASN  37  -8.338  28.688  17.822
  295    HB3  ASN  37          3HB       ASN  37  -8.960  29.918  16.726
  296   HD21  ASN  37          1HD2      ASN  37 -10.720  28.144  17.031
  297   HD22  ASN  37          2HD2      ASN  37 -10.769  26.957  15.776
  298    H    ASP  38           H        ASP  38  -7.746  31.551  15.456
  299    HA   ASP  38           HA       ASP  38  -8.179  31.005  12.752
  300    HB2  ASP  38          2HB       ASP  38  -8.656  33.137  14.357
  301    HB3  ASP  38          3HB       ASP  38  -7.301  33.750  13.413
  302    H    THR  39           H        THR  39  -5.266  31.818  14.478
  303    HA   THR  39           HA       THR  39  -3.732  32.459  12.135
  304    HB   THR  39           HB       THR  39  -2.076  31.658  14.350
  305    HG1  THR  39           HG1      THR  39  -2.931  33.326  15.800
  306   HG21  THR  39          1HG2      THR  39  -1.761  33.387  12.441
  307   HG22  THR  39          2HG2      THR  39  -1.105  33.750  14.038
  308   HG23  THR  39          3HG2      THR  39  -2.622  34.485  13.519
  309    H    PHE  40           H        PHE  40  -3.734  29.719  14.419
  310    HA   PHE  40           HA       PHE  40  -1.863  28.148  13.065
  311    HB2  PHE  40          2HB       PHE  40  -2.712  27.765  15.397
  312    HB3  PHE  40          3HB       PHE  40  -4.192  27.121  14.694
  313    HD1  PHE  40           HD1      PHE  40  -0.681  26.629  13.592
  314    HD2  PHE  40           HD2      PHE  40  -4.171  24.876  15.284
  315    HE1  PHE  40           HE1      PHE  40   0.365  24.407  13.439
  316    HE2  PHE  40           HE2      PHE  40  -3.131  22.652  15.134
  317    HZ   PHE  40           HZ       PHE  40  -0.860  22.415  14.211
  318    H    ASP  41           H        ASP  41  -5.384  28.305  12.760
  319    HA   ASP  41           HA       ASP  41  -5.752  26.168  11.006
  320    HB2  ASP  41          2HB       ASP  41  -7.438  27.848  12.217
  321    HB3  ASP  41          3HB       ASP  41  -7.418  28.605  10.626
  322    H    THR  42           H        THR  42  -5.574  29.628  10.146
  323    HA   THR  42           HA       THR  42  -5.449  29.273   7.385
  324    HB   THR  42           HB       THR  42  -5.628  31.454   8.919
  325    HG1  THR  42           HG1      THR  42  -5.845  32.371   7.010
  326   HG21  THR  42          1HG2      THR  42  -3.687  32.749   9.027
  327   HG22  THR  42          2HG2      THR  42  -2.846  31.760   7.834
  328   HG23  THR  42          3HG2      THR  42  -3.124  31.136   9.459
  329    H    PHE  43           H        PHE  43  -3.027  28.835   9.805
  330    HA   PHE  43           HA       PHE  43  -0.766  29.063   8.063
  331    HB2  PHE  43          2HB       PHE  43  -0.682  29.392  10.551
  332    HB3  PHE  43          3HB       PHE  43  -0.916  27.656  10.735
  333    HD1  PHE  43           HD1      PHE  43   1.101  27.035  11.749
  334    HD2  PHE  43           HD2      PHE  43   1.153  29.354   8.180
  335    HE1  PHE  43           HE1      PHE  43   3.530  26.690  11.563
  336    HE2  PHE  43           HE2      PHE  43   3.582  29.012   7.988
  337    HZ   PHE  43           HZ       PHE  43   4.774  27.677   9.681
  338    H    ALA  44           H        ALA  44  -2.489  26.321   9.535
  339    HA   ALA  44           HA       ALA  44  -0.949  24.327   8.229
  340    HB1  ALA  44          1HB       ALA  44  -2.693  22.776   8.981
  341    HB2  ALA  44          2HB       ALA  44  -2.170  23.853  10.277
  342    HB3  ALA  44          3HB       ALA  44  -3.701  24.145   9.451
  343    H    LEU  45           H        LEU  45  -4.156  25.711   7.563
  344    HA   LEU  45           HA       LEU  45  -4.957  24.186   5.438
  345    HB2  LEU  45          2HB       LEU  45  -5.992  26.305   6.613
  346    HB3  LEU  45          3HB       LEU  45  -5.284  27.139   5.231
  347    HG   LEU  45           HG       LEU  45  -7.535  26.735   4.668
  348   HD11  LEU  45          1HD1      LEU  45  -7.378  25.405   2.713
  349   HD12  LEU  45          2HD1      LEU  45  -6.049  24.458   3.380
  350   HD13  LEU  45          3HD1      LEU  45  -5.796  26.149   2.948
  351   HD21  LEU  45          1HD2      LEU  45  -7.089  24.201   6.093
  352   HD22  LEU  45          2HD2      LEU  45  -8.125  24.096   4.669
  353   HD23  LEU  45          3HD2      LEU  45  -8.535  25.204   5.980
  354    H    ASP  46           H        ASP  46  -3.173  27.261   5.110
  355    HA   ASP  46           HA       ASP  46  -2.696  27.221   2.414
  356    HB2  ASP  46          2HB       ASP  46  -1.849  28.773   4.520
  357    HB3  ASP  46          3HB       ASP  46  -0.342  28.061   3.950
  358    H    PHE  47           H        PHE  47  -0.739  25.672   4.940
  359    HA   PHE  47           HA       PHE  47   1.298  24.675   3.334
  360    HB2  PHE  47          2HB       PHE  47   0.288  24.197   6.016
  361    HB3  PHE  47          3HB       PHE  47   0.897  22.718   5.279
  362    HD1  PHE  47           HD1      PHE  47   3.182  23.367   3.807
  363    HD2  PHE  47           HD2      PHE  47   1.815  25.157   7.419
  364    HE1  PHE  47           HE1      PHE  47   5.485  24.052   4.335
  365    HE2  PHE  47           HE2      PHE  47   4.116  25.845   7.952
  366    HZ   PHE  47           HZ       PHE  47   5.955  25.293   6.410
  367    H    SER  48           H        SER  48  -1.701  23.041   4.347
  368    HA   SER  48           HA       SER  48  -1.356  20.642   3.027
  369    HB2  SER  48          2HB       SER  48  -3.255  21.399   4.609
  370    HB3  SER  48          3HB       SER  48  -4.047  21.988   3.148
  371    HG   SER  48           HG       SER  48  -3.154  19.325   3.572
  372    H    ARG  49           H        ARG  49  -2.783  23.644   1.781
  373    HA   ARG  49           HA       ARG  49  -3.664  22.857  -0.681
  374    HB2  ARG  49          2HB       ARG  49  -3.168  25.287   0.567
  375    HB3  ARG  49          3HB       ARG  49  -2.162  25.344  -0.874
  376    HG2  ARG  49          2HG       ARG  49  -4.848  24.366  -1.409
  377    HG3  ARG  49          3HG       ARG  49  -4.824  25.995  -0.730
  378    HD2  ARG  49          2HD       ARG  49  -2.850  26.216  -2.543
  379    HD3  ARG  49          3HD       ARG  49  -3.853  25.003  -3.336
  380    HE   ARG  49           HE       ARG  49  -5.391  26.631  -3.779
  381   HH11  ARG  49          1HH1      ARG  49  -3.926  29.349  -1.231
  382   HH12  ARG  49          2HH1      ARG  49  -3.269  27.745  -1.255
  383   HH21  ARG  49          1HH2      ARG  49  -5.630  29.912  -2.655
  384   HH22  ARG  49          2HH2      ARG  49  -6.264  28.738  -3.758
  385    H    GLU  50           H        GLU  50  -0.331  23.580   0.259
  386    HA   GLU  50           HA       GLU  50   0.683  23.091  -2.397
  387    HB2  GLU  50          2HB       GLU  50   1.720  24.727  -0.820
  388    HB3  GLU  50          3HB       GLU  50   2.214  23.378   0.192
  389    HG2  GLU  50          2HG       GLU  50   3.128  22.759  -2.373
  390    HG3  GLU  50          3HG       GLU  50   3.477  24.471  -2.141
  391    H    LYS  51           H        LYS  51   0.287  21.313   0.577
  392    HA   LYS  51           HA       LYS  51   2.057  19.194   0.101
  393    HB2  LYS  51          2HB       LYS  51   1.143  18.229   1.952
  394    HB3  LYS  51          3HB       LYS  51   0.498  19.850   2.169
  395    HG2  LYS  51          2HG       LYS  51  -1.419  18.689   2.453
  396    HG3  LYS  51          3HG       LYS  51  -1.471  18.833   0.695
  397    HD2  LYS  51          2HD       LYS  51  -0.251  16.612   0.617
  398    HD3  LYS  51          3HD       LYS  51  -0.594  16.472   2.343
  399    HE2  LYS  51          2HE       LYS  51  -2.701  15.858   1.958
  400    HE3  LYS  51          3HE       LYS  51  -2.958  17.196   0.839
  401    HZ1  LYS  51          1HZ       LYS  51  -1.520  15.660  -0.711
  402    HZ2  LYS  51          2HZ       LYS  51  -3.192  15.450  -0.573
  403    HZ3  LYS  51          3HZ       LYS  51  -2.140  14.443   0.287
  404    H    LYS  52           H        LYS  52  -1.110  19.886  -1.168
  405    HA   LYS  52           HA       LYS  52  -1.483  17.234  -2.258
  406    HB2  LYS  52          2HB       LYS  52  -3.048  19.762  -2.807
  407    HB3  LYS  52          3HB       LYS  52  -3.542  18.121  -3.201
  408    HG2  LYS  52          2HG       LYS  52  -3.785  17.562  -0.895
  409    HG3  LYS  52          3HG       LYS  52  -3.055  19.089  -0.394
  410    HD2  LYS  52          2HD       LYS  52  -5.339  19.460  -2.159
  411    HD3  LYS  52          3HD       LYS  52  -5.755  18.589  -0.682
  412    HE2  LYS  52          2HE       LYS  52  -5.467  20.403   0.608
  413    HE3  LYS  52          3HE       LYS  52  -4.015  20.904  -0.257
  414    HZ1  LYS  52          1HZ       LYS  52  -5.706  22.541  -0.572
  415    HZ2  LYS  52          2HZ       LYS  52  -6.826  21.381  -1.080
  416    HZ3  LYS  52          3HZ       LYS  52  -5.483  21.737  -2.044
  417    H    LEU  53           H        LEU  53  -1.105  20.495  -3.657
  418    HA   LEU  53           HA       LEU  53  -0.904  19.793  -6.316
  419    HB2  LEU  53          2HB       LEU  53  -0.839  22.109  -5.059
  420    HB3  LEU  53          3HB       LEU  53   0.901  21.914  -5.263
  421    HG   LEU  53           HG       LEU  53  -0.815  21.603  -7.669
  422   HD11  LEU  53          1HD1      LEU  53  -1.822  23.553  -6.748
  423   HD12  LEU  53          2HD1      LEU  53  -0.708  24.080  -8.009
  424   HD13  LEU  53          3HD1      LEU  53  -0.254  24.231  -6.311
  425   HD21  LEU  53          1HD2      LEU  53   1.242  21.527  -8.514
  426   HD22  LEU  53          2HD2      LEU  53   1.961  22.063  -6.995
  427   HD23  LEU  53          3HD2      LEU  53   1.367  23.250  -8.158
  428    H    LEU  54           H        LEU  54   1.422  19.394  -3.773
  429    HA   LEU  54           HA       LEU  54   3.694  19.006  -5.462
  430    HB2  LEU  54          2HB       LEU  54   3.988  19.704  -3.173
  431    HB3  LEU  54          3HB       LEU  54   3.175  18.253  -2.591
  432    HG   LEU  54           HG       LEU  54   5.756  18.414  -2.456
  433   HD11  LEU  54          1HD1      LEU  54   5.890  16.100  -2.422
  434   HD12  LEU  54          2HD1      LEU  54   4.742  15.913  -3.748
  435   HD13  LEU  54          3HD1      LEU  54   4.172  16.399  -2.152
  436   HD21  LEU  54          1HD2      LEU  54   7.005  17.895  -4.347
  437   HD22  LEU  54          2HD2      LEU  54   5.819  19.052  -4.951
  438   HD23  LEU  54          3HD2      LEU  54   5.596  17.327  -5.243
  439    H    GLU  55           H        GLU  55   1.822  16.722  -3.454
  440    HA   GLU  55           HA       GLU  55   2.980  14.392  -4.475
  441    HB2  GLU  55          2HB       GLU  55   1.405  14.760  -2.430
  442    HB3  GLU  55          3HB       GLU  55   0.115  14.467  -3.588
  443    HG2  GLU  55          2HG       GLU  55   1.628  12.354  -4.142
  444    HG3  GLU  55          3HG       GLU  55   2.122  12.606  -2.469
  445    H    CYS  56           H        CYS  56  -0.092  15.955  -5.379
  446    HA   CYS  56           HA       CYS  56   0.146  14.691  -8.021
  447    HB2  CYS  56          2HB       CYS  56  -2.359  14.426  -8.009
  448    HB3  CYS  56          3HB       CYS  56  -1.498  13.370  -6.896
  449    HG   CYS  56           HG       CYS  56  -4.029  14.526  -5.940
  450    H    LEU  57           H        LEU  57  -1.614  15.735  -9.528
  451    HA   LEU  57           HA       LEU  57  -1.054  18.568  -9.518
  452    HB2  LEU  57          2HB       LEU  57  -1.966  16.569 -11.442
  453    HB3  LEU  57          3HB       LEU  57  -2.776  18.125 -11.610
  454    HG   LEU  57           HG       LEU  57  -0.147  18.865 -11.455
  455   HD11  LEU  57          1HD1      LEU  57   0.715  16.640 -11.537
  456   HD12  LEU  57          2HD1      LEU  57   1.001  17.391 -13.107
  457   HD13  LEU  57          3HD1      LEU  57  -0.315  16.234 -12.911
  458   HD21  LEU  57          1HD2      LEU  57  -1.853  18.240 -13.858
  459   HD22  LEU  57          2HD2      LEU  57  -0.334  19.133 -13.929
  460   HD23  LEU  57          3HD2      LEU  57  -1.700  19.785 -13.022
  461    H    ASP  58           H        ASP  58  -2.423  20.186  -9.036
  462    HA   ASP  58           HA       ASP  58  -5.230  20.039  -9.124
  463    HB2  ASP  58          2HB       ASP  58  -4.095  18.864  -6.798
  464    HB3  ASP  58          3HB       ASP  58  -4.851  20.379  -6.311
  465    H    TYR  59           H        TYR  59  -6.259  21.967  -8.075
  466    HA   TYR  59           HA       TYR  59  -4.484  24.151  -7.394
  467    HB2  TYR  59          2HB       TYR  59  -5.869  23.946 -10.018
  468    HB3  TYR  59          3HB       TYR  59  -5.855  25.522  -9.234
  469    HD1  TYR  59           HD1      TYR  59  -4.125  23.422 -11.436
  470    HD2  TYR  59           HD2      TYR  59  -3.466  26.266  -8.341
  471    HE1  TYR  59           HE1      TYR  59  -1.855  23.820 -12.294
  472    HE2  TYR  59           HE2      TYR  59  -1.194  26.673  -9.191
  473    HH   TYR  59           HH       TYR  59  -0.018  26.425 -11.494
  474    H    LEU  60           H        LEU  60  -7.787  24.027  -8.707
  475    HA   LEU  60           HA       LEU  60  -8.730  25.434  -6.323
  476    HB2  LEU  60          2HB       LEU  60 -10.729  25.908  -7.592
  477    HB3  LEU  60          3HB       LEU  60  -9.297  26.359  -8.515
  478    HG   LEU  60           HG       LEU  60  -9.865  23.776  -9.360
  479   HD11  LEU  60          1HD1      LEU  60 -12.370  25.296  -8.760
  480   HD12  LEU  60          2HD1      LEU  60 -12.006  23.591  -8.497
  481   HD13  LEU  60          3HD1      LEU  60 -12.295  24.189 -10.131
  482   HD21  LEU  60          1HD2      LEU  60  -9.135  25.214 -10.983
  483   HD22  LEU  60          2HD2      LEU  60 -10.186  26.527 -10.451
  484   HD23  LEU  60          3HD2      LEU  60 -10.858  25.172 -11.359
  Start of MODEL   12
    1    H    LEU   1           H        LEU   1   9.046  -0.988   3.826
    2    HA   LEU   1           HA       LEU   1   8.447   0.735   2.468
    3    HB2  LEU   1          2HB       LEU   1  10.696   1.727   4.005
    4    HB3  LEU   1          3HB       LEU   1  10.598   2.487   2.418
    5    HG   LEU   1           HG       LEU   1   9.462   3.823   4.104
    6   HD11  LEU   1          1HD1      LEU   1   7.428   2.537   2.295
    7   HD12  LEU   1          2HD1      LEU   1   8.625   3.713   1.753
    8   HD13  LEU   1          3HD1      LEU   1   7.411   4.177   2.945
    9   HD21  LEU   1          1HD2      LEU   1   8.017   3.028   5.626
   10   HD22  LEU   1          2HD2      LEU   1   8.752   1.468   5.253
   11   HD23  LEU   1          3HD2      LEU   1   7.241   1.941   4.474
   12    H    LYS   2           H        LYS   2   8.385   0.665   0.326
   13    HA   LYS   2           HA       LYS   2  10.897   0.342  -1.165
   14    HB2  LYS   2          2HB       LYS   2   8.355  -1.246  -1.526
   15    HB3  LYS   2          3HB       LYS   2   9.626  -1.178  -2.740
   16    HG2  LYS   2          2HG       LYS   2  10.925  -2.618  -1.632
   17    HG3  LYS   2          3HG       LYS   2  10.583  -1.874  -0.068
   18    HD2  LYS   2          2HD       LYS   2   9.098  -3.458   0.427
   19    HD3  LYS   2          3HD       LYS   2   8.239  -3.198  -1.093
   20    HE2  LYS   2          2HE       LYS   2   9.540  -4.778  -2.228
   21    HE3  LYS   2          3HE       LYS   2  10.796  -4.765  -0.991
   22    HZ1  LYS   2          1HZ       LYS   2   9.782  -6.411   0.059
   23    HZ2  LYS   2          2HZ       LYS   2   8.662  -6.515  -1.204
   24    HZ3  LYS   2          3HZ       LYS   2   8.329  -5.547   0.143
   25    H    GLU   3           H        GLU   3  10.163   0.470  -3.684
   26    HA   GLU   3           HA       GLU   3   9.499   1.850  -5.366
   27    HB2  GLU   3          2HB       GLU   3   7.232   1.212  -4.439
   28    HB3  GLU   3          3HB       GLU   3   7.260   2.723  -3.540
   29    HG2  GLU   3          2HG       GLU   3   6.269   3.626  -5.307
   30    HG3  GLU   3          3HG       GLU   3   7.838   3.522  -6.103
   31    H    ASN   4           H        ASN   4  11.034   3.368  -5.590
   32    HA   ASN   4           HA       ASN   4  11.276   5.533  -3.675
   33    HB2  ASN   4          2HB       ASN   4  12.840   4.929  -6.195
   34    HB3  ASN   4          3HB       ASN   4  13.224   6.210  -5.050
   35   HD21  ASN   4          1HD2      ASN   4  14.814   5.712  -3.746
   36   HD22  ASN   4          2HD2      ASN   4  15.182   4.139  -3.133
   37    H    ASP   5           H        ASP   5   8.850   5.816  -4.667
   38    HA   ASP   5           HA       ASP   5   9.063   8.248  -6.255
   39    HB2  ASP   5          2HB       ASP   5   7.222   5.987  -7.062
   40    HB3  ASP   5          3HB       ASP   5   7.348   7.559  -7.846
   41    H    HIS   6           H        HIS   6   6.503   6.034  -5.120
   42    HA   HIS   6           HA       HIS   6   4.876   8.243  -4.252
   43    HB2  HIS   6          2HB       HIS   6   4.122   5.926  -5.180
   44    HB3  HIS   6          3HB       HIS   6   4.340   5.382  -3.519
   45    HD1  HIS   6           HD1      HIS   6   2.217   7.660  -5.618
   46    HD2  HIS   6           HD2      HIS   6   2.375   6.191  -1.735
   47    HE1  HIS   6           HE1      HIS   6   0.024   8.302  -4.567
   48    H    ALA   7           H        ALA   7   7.155   6.063  -2.811
   49    HA   ALA   7           HA       ALA   7   6.345   6.364  -0.109
   50    HB1  ALA   7          1HB       ALA   7   8.641   5.519   0.405
   51    HB2  ALA   7          2HB       ALA   7   7.713   4.499  -0.697
   52    HB3  ALA   7          3HB       ALA   7   8.979   5.554  -1.326
   53    H    ARG   8           H        ARG   8   8.430   8.208  -2.236
   54    HA   ARG   8           HA       ARG   8   9.458   9.860  -0.098
   55    HB2  ARG   8          2HB       ARG   8  10.560  11.116  -1.923
   56    HB3  ARG   8          3HB       ARG   8  10.903   9.393  -1.984
   57    HG2  ARG   8          2HG       ARG   8   9.332   9.093  -3.782
   58    HG3  ARG   8          3HG       ARG   8   8.830  10.781  -3.667
   59    HD2  ARG   8          2HD       ARG   8  11.717  10.332  -4.034
   60    HD3  ARG   8          3HD       ARG   8  10.698   9.861  -5.393
   61    HE   ARG   8           HE       ARG   8   9.900  12.403  -4.595
   62   HH11  ARG   8          1HH1      ARG   8  13.256  12.268  -6.772
   63   HH12  ARG   8          2HH1      ARG   8  12.715  10.853  -5.933
   64   HH21  ARG   8          1HH2      ARG   8  12.054  14.214  -6.636
   65   HH22  ARG   8          2HH2      ARG   8  10.602  14.273  -5.695
   66    H    PHE   9           H        PHE   9   6.945  10.006  -2.526
   67    HA   PHE   9           HA       PHE   9   6.403  12.789  -2.259
   68    HB2  PHE   9          2HB       PHE   9   5.233  10.496  -3.672
   69    HB3  PHE   9          3HB       PHE   9   4.054  11.703  -3.170
   70    HD1  PHE   9           HD1      PHE   9   7.533  12.491  -4.062
   71    HD2  PHE   9           HD2      PHE   9   3.477  12.455  -5.351
   72    HE1  PHE   9           HE1      PHE   9   8.140  13.882  -5.998
   73    HE2  PHE   9           HE2      PHE   9   4.078  13.846  -7.290
   74    HZ   PHE   9           HZ       PHE   9   6.412  14.560  -7.616
   75    H    LEU  10           H        LEU  10   4.897   9.866  -0.919
   76    HA   LEU  10           HA       LEU  10   2.901  11.226   0.554
   77    HB2  LEU  10          2HB       LEU  10   3.390   8.634  -0.068
   78    HB3  LEU  10          3HB       LEU  10   3.869   8.664   1.628
   79    HG   LEU  10           HG       LEU  10   1.277   9.916   1.145
   80   HD11  LEU  10          1HD1      LEU  10   1.849   7.258   0.018
   81   HD12  LEU  10          2HD1      LEU  10   0.579   8.415  -0.380
   82   HD13  LEU  10          3HD1      LEU  10   0.408   7.368   1.029
   83   HD21  LEU  10          1HD2      LEU  10   0.675   8.332   2.996
   84   HD22  LEU  10          2HD2      LEU  10   1.986   9.452   3.367
   85   HD23  LEU  10          3HD2      LEU  10   2.347   7.772   2.968
   86    H    GLN  11           H        GLN  11   6.014   9.810   1.548
   87    HA   GLN  11           HA       GLN  11   5.892  10.570   4.238
   88    HB2  GLN  11          2HB       GLN  11   8.186   9.982   2.383
   89    HB3  GLN  11          3HB       GLN  11   8.460  10.449   4.056
   90    HG2  GLN  11          2HG       GLN  11   7.127   8.538   4.802
   91    HG3  GLN  11          3HG       GLN  11   6.879   8.064   3.122
   92   HE21  GLN  11          1HE2      GLN  11   8.642   7.444   5.798
   93   HE22  GLN  11          2HE2      GLN  11  10.053   6.756   5.076
   94    H    THR  12           H        THR  12   6.753  12.360   1.378
   95    HA   THR  12           HA       THR  12   7.987  14.541   2.782
   96    HB   THR  12           HB       THR  12   7.117  14.139  -0.069
   97    HG1  THR  12           HG1      THR  12   9.625  14.604   1.208
   98   HG21  THR  12          1HG2      THR  12   8.161  16.381  -0.522
   99   HG22  THR  12          2HG2      THR  12   8.113  16.679   1.216
  100   HG23  THR  12          3HG2      THR  12   6.613  16.441   0.319
  101    H    ALA  13           H        ALA  13   4.944  14.239   0.938
  102    HA   ALA  13           HA       ALA  13   3.855  16.706   1.504
  103    HB1  ALA  13          1HB       ALA  13   1.676  14.982   1.538
  104    HB2  ALA  13          2HB       ALA  13   2.364  15.792   0.130
  105    HB3  ALA  13          3HB       ALA  13   2.881  14.159   0.548
  106    H    LYS  14           H        LYS  14   3.641  13.732   3.424
  107    HA   LYS  14           HA       LYS  14   1.984  14.850   5.447
  108    HB2  LYS  14          2HB       LYS  14   2.542  12.343   4.827
  109    HB3  LYS  14          3HB       LYS  14   3.820  12.561   6.015
  110    HG2  LYS  14          2HG       LYS  14   2.346  12.786   7.764
  111    HG3  LYS  14          3HG       LYS  14   1.025  13.320   6.722
  112    HD2  LYS  14          2HD       LYS  14   1.255  10.904   5.723
  113    HD3  LYS  14          3HD       LYS  14   2.013  10.559   7.279
  114    HE2  LYS  14          2HE       LYS  14   0.075  10.829   8.435
  115    HE3  LYS  14          3HE       LYS  14  -0.540  12.058   7.331
  116    HZ1  LYS  14          1HZ       LYS  14  -0.654   9.125   7.082
  117    HZ2  LYS  14          2HZ       LYS  14  -0.731  10.095   5.698
  118    HZ3  LYS  14          3HZ       LYS  14  -1.898  10.259   6.912
  119    H    ASN  15           H        ASN  15   5.478  14.252   5.221
  120    HA   ASN  15           HA       ASN  15   6.225  15.084   7.759
  121    HB2  ASN  15          2HB       ASN  15   7.871  14.036   6.409
  122    HB3  ASN  15          3HB       ASN  15   7.665  15.211   5.113
  123   HD21  ASN  15          1HD2      ASN  15   9.058  14.587   8.227
  124   HD22  ASN  15          2HD2      ASN  15  10.108  15.959   8.259
  125    H    ILE  16           H        ILE  16   5.200  16.947   5.025
  126    HA   ILE  16           HA       ILE  16   6.272  19.450   5.864
  127    HB   ILE  16           HB       ILE  16   3.995  18.826   3.981
  128   HG12  ILE  16          2HG1      ILE  16   6.629  19.906   3.101
  129   HG13  ILE  16          3HG1      ILE  16   6.560  18.213   3.577
  130   HG21  ILE  16          1HG2      ILE  16   4.390  21.170   3.171
  131   HG22  ILE  16          2HG2      ILE  16   3.654  21.042   4.768
  132   HG23  ILE  16          3HG2      ILE  16   5.368  21.428   4.616
  133   HD11  ILE  16          1HD1      ILE  16   5.876  19.347   1.106
  134   HD12  ILE  16          2HD1      ILE  16   5.708  17.667   1.615
  135   HD13  ILE  16          3HD1      ILE  16   4.371  18.796   1.841
  136    H    THR  17           H        THR  17   2.979  18.087   5.979
  137    HA   THR  17           HA       THR  17   1.951  20.243   7.548
  138    HB   THR  17           HB       THR  17   0.495  17.676   7.627
  139    HG1  THR  17           HG1      THR  17   1.030  19.037   5.180
  140   HG21  THR  17          1HG2      THR  17  -0.445  19.854   8.357
  141   HG22  THR  17          2HG2      THR  17  -1.385  19.093   7.073
  142   HG23  THR  17          3HG2      THR  17  -0.305  20.436   6.698
  143    H    GLU  18           H        GLU  18   3.589  17.296   8.251
  144    HA   GLU  18           HA       GLU  18   2.666  17.128  10.983
  145    HB2  GLU  18          2HB       GLU  18   3.442  15.192   9.428
  146    HB3  GLU  18          3HB       GLU  18   5.062  15.675   9.910
  147    HG2  GLU  18          2HG       GLU  18   4.584  14.017  11.424
  148    HG3  GLU  18          3HG       GLU  18   4.140  15.469  12.320
  149    H    ARG  19           H        ARG  19   5.436  18.383   9.249
  150    HA   ARG  19           HA       ARG  19   7.020  18.846  11.593
  151    HB2  ARG  19          2HB       ARG  19   8.200  18.540   9.546
  152    HB3  ARG  19          3HB       ARG  19   7.247  19.774   8.734
  153    HG2  ARG  19          2HG       ARG  19   8.262  21.478  10.203
  154    HG3  ARG  19          3HG       ARG  19   9.272  20.219  10.915
  155    HD2  ARG  19          2HD       ARG  19   9.462  20.094   8.064
  156    HD3  ARG  19          3HD       ARG  19   9.766  21.747   8.597
  157    HE   ARG  19           HE       ARG  19  11.470  19.488   8.959
  158   HH11  ARG  19          1HH1      ARG  19  11.974  22.750  11.224
  159   HH12  ARG  19          2HH1      ARG  19  10.487  22.516  10.366
  160   HH21  ARG  19          1HH2      ARG  19  13.649  21.196  11.061
  161   HH22  ARG  19          2HH2      ARG  19  13.433  19.784  10.083
  162    H    VAL  20           H        VAL  20   4.746  20.700   9.675
  163    HA   VAL  20           HA       VAL  20   5.337  23.228  10.853
  164    HB   VAL  20           HB       VAL  20   4.246  23.074   8.669
  165   HG11  VAL  20          1HG1      VAL  20   2.894  21.067   9.138
  166   HG12  VAL  20          2HG1      VAL  20   1.843  22.038  10.169
  167   HG13  VAL  20          3HG1      VAL  20   1.940  22.375   8.440
  168   HG21  VAL  20          1HG2      VAL  20   3.895  25.145   9.682
  169   HG22  VAL  20          2HG2      VAL  20   2.274  24.633   9.213
  170   HG23  VAL  20          3HG2      VAL  20   2.797  24.475  10.889
  171    H    SER  21           H        SER  21   3.058  20.641  11.556
  172    HA   SER  21           HA       SER  21   1.505  22.050  13.453
  173    HB2  SER  21          2HB       SER  21   1.965  19.114  12.943
  174    HB3  SER  21          3HB       SER  21   0.919  19.680  14.246
  175    HG   SER  21           HG       SER  21  -0.561  19.897  12.787
  176    H    MET  22           H        MET  22   4.004  19.554  13.971
  177    HA   MET  22           HA       MET  22   4.182  19.865  16.743
  178    HB2  MET  22          2HB       MET  22   5.112  17.953  15.449
  179    HB3  MET  22          3HB       MET  22   6.389  19.010  14.863
  180    HG2  MET  22          2HG       MET  22   7.138  19.355  17.176
  181    HG3  MET  22          3HG       MET  22   5.888  18.243  17.728
  182    HE1  MET  22          1HE       MET  22   9.224  18.884  16.388
  183    HE2  MET  22          2HE       MET  22   9.956  17.323  16.019
  184    HE3  MET  22          3HE       MET  22   8.881  18.091  14.850
  185    H    ALA  23           H        ALA  23   5.571  21.706  14.141
  186    HA   ALA  23           HA       ALA  23   7.601  23.008  15.641
  187    HB1  ALA  23          1HB       ALA  23   6.228  23.715  13.057
  188    HB2  ALA  23          2HB       ALA  23   7.546  24.664  13.746
  189    HB3  ALA  23          3HB       ALA  23   7.819  22.985  13.278
  190    H    THR  24           H        THR  24   4.327  24.000  14.660
  191    HA   THR  24           HA       THR  24   4.454  26.459  16.130
  192    HB   THR  24           HB       THR  24   1.831  25.295  15.318
  193    HG1  THR  24           HG1      THR  24   2.655  24.913  13.393
  194   HG21  THR  24          1HG2      THR  24   1.516  27.663  14.540
  195   HG22  THR  24          2HG2      THR  24   3.103  28.029  15.215
  196   HG23  THR  24          3HG2      THR  24   1.799  27.488  16.271
  197    H    ALA  25           H        ALA  25   3.543  23.206  16.831
  198    HA   ALA  25           HA       ALA  25   1.946  23.874  19.144
  199    HB1  ALA  25          1HB       ALA  25   1.548  21.587  19.379
  200    HB2  ALA  25          2HB       ALA  25   1.674  21.819  17.635
  201    HB3  ALA  25          3HB       ALA  25   3.033  21.147  18.535
  202    H    SER  26           H        SER  26   5.244  23.610  18.470
  203    HA   SER  26           HA       SER  26   5.857  23.262  21.333
  204    HB2  SER  26          2HB       SER  26   6.696  21.571  19.417
  205    HB3  SER  26          3HB       SER  26   7.994  22.762  19.330
  206    HG   SER  26           HG       SER  26   8.763  21.931  21.086
  207    H    SER  27           H        SER  27   5.604  25.515  19.012
  208    HA   SER  27           HA       SER  27   7.990  27.024  19.813
  209    HB2  SER  27          2HB       SER  27   6.103  27.228  17.480
  210    HB3  SER  27          3HB       SER  27   7.134  28.588  17.924
  211    HG   SER  27           HG       SER  27   7.823  26.640  16.407
  212    H    GLN  28           H        GLN  28   4.480  27.122  19.824
  213    HA   GLN  28           HA       GLN  28   4.607  29.552  21.486
  214    HB2  GLN  28          2HB       GLN  28   2.742  28.713  19.331
  215    HB3  GLN  28          3HB       GLN  28   2.048  29.571  20.699
  216    HG2  GLN  28          2HG       GLN  28   4.395  30.945  19.878
  217    HG3  GLN  28          3HG       GLN  28   3.401  30.629  18.457
  218   HE21  GLN  28          1HE2      GLN  28   4.047  33.095  20.055
  219   HE22  GLN  28          2HE2      GLN  28   2.508  33.802  20.394
  220    H    VAL  29           H        VAL  29   1.976  27.249  20.910
  221    HA   VAL  29           HA       VAL  29   2.176  25.800  23.289
  222    HB   VAL  29           HB       VAL  29   1.776  27.858  24.480
  223   HG11  VAL  29          1HG1      VAL  29   0.734  29.134  22.683
  224   HG12  VAL  29          2HG1      VAL  29  -0.716  28.135  22.801
  225   HG13  VAL  29          3HG1      VAL  29  -0.255  29.183  24.143
  226   HG21  VAL  29          1HG2      VAL  29  -0.055  27.196  25.825
  227   HG22  VAL  29          2HG2      VAL  29  -0.829  26.350  24.485
  228   HG23  VAL  29          3HG2      VAL  29   0.652  25.708  25.196
  229    H    LEU  30           H        LEU  30   0.096  27.231  20.857
  230    HA   LEU  30           HA       LEU  30  -1.584  26.365  19.590
  231    HB2  LEU  30          2HB       LEU  30   0.098  24.375  19.684
  232    HB3  LEU  30          3HB       LEU  30  -1.109  23.650  20.744
  233    HG   LEU  30           HG       LEU  30  -2.576  24.465  18.544
  234   HD11  LEU  30          1HD1      LEU  30   0.202  23.851  17.763
  235   HD12  LEU  30          2HD1      LEU  30  -1.021  24.824  16.948
  236   HD13  LEU  30          3HD1      LEU  30  -1.068  23.065  16.825
  237   HD21  LEU  30          1HD2      LEU  30  -2.027  21.821  18.066
  238   HD22  LEU  30          2HD2      LEU  30  -3.263  22.432  19.166
  239   HD23  LEU  30          3HD2      LEU  30  -1.672  21.985  19.786
  240    H    ILE  31           H        ILE  31  -2.807  27.623  21.294
  241    HA   ILE  31           HA       ILE  31  -4.920  25.917  22.318
  242    HB   ILE  31           HB       ILE  31  -4.892  27.006  24.554
  243   HG12  ILE  31          2HG1      ILE  31  -2.214  27.750  24.824
  244   HG13  ILE  31          3HG1      ILE  31  -2.723  28.480  23.306
  245   HG21  ILE  31          1HG2      ILE  31  -2.446  25.411  23.804
  246   HG22  ILE  31          2HG2      ILE  31  -3.019  25.668  25.451
  247   HG23  ILE  31          3HG2      ILE  31  -4.012  24.772  24.302
  248   HD11  ILE  31          1HD1      ILE  31  -2.982  29.848  25.439
  249   HD12  ILE  31          2HD1      ILE  31  -4.364  29.768  24.346
  250   HD13  ILE  31          3HD1      ILE  31  -4.339  28.783  25.808
  251    HA   PRO  32           HA       PRO  32  -7.471  29.287  21.125
  252    HB2  PRO  32          2HB       PRO  32  -9.557  28.987  22.836
  253    HB3  PRO  32          3HB       PRO  32  -9.264  27.894  21.478
  254    HG2  PRO  32          2HG       PRO  32  -8.587  27.542  24.373
  255    HG3  PRO  32          3HG       PRO  32  -9.270  26.368  23.233
  256    HD2  PRO  32          2HD       PRO  32  -6.647  26.390  23.905
  257    HD3  PRO  32          3HD       PRO  32  -7.217  25.891  22.300
  258    H    GLU  33           H        GLU  33  -7.144  31.378  21.513
  259    HA   GLU  33           HA       GLU  33  -7.179  32.319  24.302
  260    HB2  GLU  33          2HB       GLU  33  -5.042  32.497  22.357
  261    HB3  GLU  33          3HB       GLU  33  -5.554  34.097  22.875
  262    HG2  GLU  33          2HG       GLU  33  -4.944  31.935  24.855
  263    HG3  GLU  33          3HG       GLU  33  -3.676  32.950  24.171
  264    H    ILE  34           H        ILE  34  -6.865  33.942  21.154
  265    HA   ILE  34           HA       ILE  34  -9.512  35.121  21.468
  266    HB   ILE  34           HB       ILE  34  -8.497  37.406  20.909
  267   HG12  ILE  34          2HG1      ILE  34  -6.052  36.025  22.037
  268   HG13  ILE  34          3HG1      ILE  34  -6.233  36.626  20.393
  269   HG21  ILE  34          1HG2      ILE  34  -8.180  37.943  23.263
  270   HG22  ILE  34          2HG2      ILE  34  -9.549  36.853  23.048
  271   HG23  ILE  34          3HG2      ILE  34  -8.011  36.229  23.643
  272   HD11  ILE  34          1HD1      ILE  34  -4.966  38.248  21.477
  273   HD12  ILE  34          2HD1      ILE  34  -6.600  38.912  21.471
  274   HD13  ILE  34          3HD1      ILE  34  -5.952  38.176  22.937
  275    H    ASN  35           H        ASN  35  -6.559  34.870  19.533
  276    HA   ASN  35           HA       ASN  35  -8.169  34.520  17.144
  277    HB2  ASN  35          2HB       ASN  35  -7.559  37.038  17.535
  278    HB3  ASN  35          3HB       ASN  35  -5.963  36.544  16.975
  279   HD21  ASN  35          1HD2      ASN  35  -6.331  38.009  15.217
  280   HD22  ASN  35          2HD2      ASN  35  -7.266  37.503  13.855
  281    H    LEU  36           H        LEU  36  -6.265  32.985  18.843
  282    HA   LEU  36           HA       LEU  36  -3.844  32.654  17.380
  283    HB2  LEU  36          2HB       LEU  36  -4.018  32.085  19.742
  284    HB3  LEU  36          3HB       LEU  36  -5.201  30.834  19.365
  285    HG   LEU  36           HG       LEU  36  -2.534  30.624  18.079
  286   HD11  LEU  36          1HD1      LEU  36  -1.489  30.874  20.051
  287   HD12  LEU  36          2HD1      LEU  36  -2.090  29.246  20.362
  288   HD13  LEU  36          3HD1      LEU  36  -2.967  30.643  20.985
  289   HD21  LEU  36          1HD2      LEU  36  -3.017  28.197  18.764
  290   HD22  LEU  36          2HD2      LEU  36  -4.009  28.916  17.495
  291   HD23  LEU  36          3HD2      LEU  36  -4.643  28.773  19.136
  292    H    ASN  37           H        ASN  37  -6.973  31.034  17.379
  293    HA   ASN  37           HA       ASN  37  -6.339  28.819  15.811
  294    HB2  ASN  37          2HB       ASN  37  -8.763  30.215  16.642
  295    HB3  ASN  37          3HB       ASN  37  -8.918  29.495  15.042
  296   HD21  ASN  37          1HD2      ASN  37  -7.499  28.622  18.180
  297   HD22  ASN  37          2HD2      ASN  37  -8.157  27.025  18.222
  298    H    ASP  38           H        ASP  38  -7.583  31.994  14.785
  299    HA   ASP  38           HA       ASP  38  -7.660  31.543  12.051
  300    HB2  ASP  38          2HB       ASP  38  -8.292  33.643  13.581
  301    HB3  ASP  38          3HB       ASP  38  -6.741  34.218  12.976
  302    H    THR  39           H        THR  39  -4.940  32.168  14.133
  303    HA   THR  39           HA       THR  39  -3.101  32.776  12.014
  304    HB   THR  39           HB       THR  39  -1.720  31.846  14.336
  305    HG1  THR  39           HG1      THR  39  -3.839  33.682  14.868
  306   HG21  THR  39          1HG2      THR  39  -0.760  33.520  12.971
  307   HG22  THR  39          2HG2      THR  39  -1.168  34.326  14.486
  308   HG23  THR  39          3HG2      THR  39  -2.199  34.534  13.070
  309    H    PHE  40           H        PHE  40  -3.448  29.996  14.225
  310    HA   PHE  40           HA       PHE  40  -1.541  28.363  13.001
  311    HB2  PHE  40          2HB       PHE  40  -2.667  28.015  15.251
  312    HB3  PHE  40          3HB       PHE  40  -4.039  27.357  14.365
  313    HD1  PHE  40           HD1      PHE  40  -0.391  26.923  13.786
  314    HD2  PHE  40           HD2      PHE  40  -4.082  25.100  14.868
  315    HE1  PHE  40           HE1      PHE  40   0.695  24.715  13.757
  316    HE2  PHE  40           HE2      PHE  40  -3.002  22.890  14.841
  317    HZ   PHE  40           HZ       PHE  40  -0.611  22.695  14.286
  318    H    ASP  41           H        ASP  41  -4.993  28.747  12.364
  319    HA   ASP  41           HA       ASP  41  -5.346  26.637  10.576
  320    HB2  ASP  41          2HB       ASP  41  -7.015  28.438  11.616
  321    HB3  ASP  41          3HB       ASP  41  -6.770  29.199  10.046
  322    H    THR  42           H        THR  42  -4.802  30.068   9.754
  323    HA   THR  42           HA       THR  42  -4.439  29.700   7.016
  324    HB   THR  42           HB       THR  42  -4.571  31.890   8.548
  325    HG1  THR  42           HG1      THR  42  -4.853  32.368   6.490
  326   HG21  THR  42          1HG2      THR  42  -2.544  33.011   8.840
  327   HG22  THR  42          2HG2      THR  42  -1.688  31.954   7.717
  328   HG23  THR  42          3HG2      THR  42  -2.163  31.354   9.306
  329    H    PHE  43           H        PHE  43  -2.312  29.052   9.655
  330    HA   PHE  43           HA       PHE  43   0.116  29.076   8.134
  331    HB2  PHE  43          2HB       PHE  43  -0.117  29.374  10.666
  332    HB3  PHE  43          3HB       PHE  43  -0.314  27.626  10.741
  333    HD1  PHE  43           HD1      PHE  43   1.609  26.902  11.825
  334    HD2  PHE  43           HD2      PHE  43   1.939  29.609   8.558
  335    HE1  PHE  43           HE1      PHE  43   4.054  26.627  11.849
  336    HE2  PHE  43           HE2      PHE  43   4.384  29.338   8.575
  337    HZ   PHE  43           HZ       PHE  43   5.445  27.845  10.222
  338    H    ALA  44           H        ALA  44  -1.883  26.473   9.521
  339    HA   ALA  44           HA       ALA  44  -0.427  24.377   8.280
  340    HB1  ALA  44          1HB       ALA  44  -1.825  22.966   9.372
  341    HB2  ALA  44          2HB       ALA  44  -2.172  24.427  10.297
  342    HB3  ALA  44          3HB       ALA  44  -3.260  23.922   9.004
  343    H    LEU  45           H        LEU  45  -3.519  25.951   7.499
  344    HA   LEU  45           HA       LEU  45  -4.334  24.464   5.351
  345    HB2  LEU  45          2HB       LEU  45  -5.285  26.644   6.487
  346    HB3  LEU  45          3HB       LEU  45  -4.487  27.429   5.126
  347    HG   LEU  45           HG       LEU  45  -6.742  27.148   4.498
  348   HD11  LEU  45          1HD1      LEU  45  -5.361  24.788   3.248
  349   HD12  LEU  45          2HD1      LEU  45  -4.968  26.458   2.841
  350   HD13  LEU  45          3HD1      LEU  45  -6.591  25.836   2.540
  351   HD21  LEU  45          1HD2      LEU  45  -7.216  25.436   6.281
  352   HD22  LEU  45          2HD2      LEU  45  -6.580  24.219   5.174
  353   HD23  LEU  45          3HD2      LEU  45  -8.008  25.155   4.730
  354    H    ASP  46           H        ASP  46  -2.376  27.436   5.074
  355    HA   ASP  46           HA       ASP  46  -1.809  27.347   2.395
  356    HB2  ASP  46          2HB       ASP  46  -0.995  28.912   4.475
  357    HB3  ASP  46          3HB       ASP  46   0.505  28.085   4.065
  358    H    PHE  47           H        PHE  47   0.075  25.814   4.997
  359    HA   PHE  47           HA       PHE  47   2.050  24.660   3.411
  360    HB2  PHE  47          2HB       PHE  47   1.049  24.330   6.135
  361    HB3  PHE  47          3HB       PHE  47   1.681  22.833   5.456
  362    HD1  PHE  47           HD1      PHE  47   3.966  23.363   4.011
  363    HD2  PHE  47           HD2      PHE  47   2.547  25.469   7.427
  364    HE1  PHE  47           HE1      PHE  47   6.260  24.107   4.501
  365    HE2  PHE  47           HE2      PHE  47   4.838  26.218   7.921
  366    HZ   PHE  47           HZ       PHE  47   6.698  25.537   6.457
  367    H    SER  48           H        SER  48  -0.918  23.120   4.652
  368    HA   SER  48           HA       SER  48  -0.676  20.674   3.400
  369    HB2  SER  48          2HB       SER  48  -2.556  21.798   4.991
  370    HB3  SER  48          3HB       SER  48  -3.414  21.804   3.450
  371    HG   SER  48           HG       SER  48  -3.571  19.850   4.845
  372    H    ARG  49           H        ARG  49  -2.129  23.651   2.132
  373    HA   ARG  49           HA       ARG  49  -3.207  22.816  -0.223
  374    HB2  ARG  49          2HB       ARG  49  -2.461  25.271   0.871
  375    HB3  ARG  49          3HB       ARG  49  -1.616  25.203  -0.670
  376    HG2  ARG  49          2HG       ARG  49  -4.513  24.515  -0.565
  377    HG3  ARG  49          3HG       ARG  49  -4.015  26.207  -0.516
  378    HD2  ARG  49          2HD       ARG  49  -2.601  24.738  -2.568
  379    HD3  ARG  49          3HD       ARG  49  -4.348  24.621  -2.778
  380    HE   ARG  49           HE       ARG  49  -3.477  27.300  -2.285
  381   HH11  ARG  49          1HH1      ARG  49  -3.945  25.987  -6.037
  382   HH12  ARG  49          2HH1      ARG  49  -3.834  24.852  -4.734
  383   HH21  ARG  49          1HH2      ARG  49  -3.824  28.236  -5.615
  384   HH22  ARG  49          2HH2      ARG  49  -3.622  28.805  -3.992
  385    H    GLU  50           H        GLU  50   0.221  23.512   0.378
  386    HA   GLU  50           HA       GLU  50   1.003  22.820  -2.297
  387    HB2  GLU  50          2HB       GLU  50   2.189  24.139  -0.107
  388    HB3  GLU  50          3HB       GLU  50   3.187  22.728  -0.424
  389    HG2  GLU  50          2HG       GLU  50   3.481  23.407  -2.725
  390    HG3  GLU  50          3HG       GLU  50   2.403  24.780  -2.480
  391    H    LYS  51           H        LYS  51   0.844  21.201   0.803
  392    HA   LYS  51           HA       LYS  51   2.427  18.959   0.196
  393    HB2  LYS  51          2HB       LYS  51   1.805  18.194   2.237
  394    HB3  LYS  51          3HB       LYS  51   1.191  19.831   2.427
  395    HG2  LYS  51          2HG       LYS  51  -0.641  18.665   3.085
  396    HG3  LYS  51          3HG       LYS  51  -0.974  18.762   1.354
  397    HD2  LYS  51          2HD       LYS  51   0.445  16.517   1.345
  398    HD3  LYS  51          3HD       LYS  51  -0.141  16.439   3.008
  399    HE2  LYS  51          2HE       LYS  51  -2.435  16.614   2.232
  400    HE3  LYS  51          3HE       LYS  51  -1.881  16.786   0.568
  401    HZ1  LYS  51          1HZ       LYS  51  -0.949  14.561   0.685
  402    HZ2  LYS  51          2HZ       LYS  51  -2.605  14.530   1.031
  403    HZ3  LYS  51          3HZ       LYS  51  -1.477  14.395   2.284
  404    H    LYS  52           H        LYS  52  -0.837  19.800  -0.645
  405    HA   LYS  52           HA       LYS  52  -1.620  17.146  -1.414
  406    HB2  LYS  52          2HB       LYS  52  -3.350  18.651  -0.721
  407    HB3  LYS  52          3HB       LYS  52  -2.845  19.864  -1.890
  408    HG2  LYS  52          2HG       LYS  52  -4.837  18.812  -2.686
  409    HG3  LYS  52          3HG       LYS  52  -3.490  18.308  -3.709
  410    HD2  LYS  52          2HD       LYS  52  -3.386  16.175  -2.665
  411    HD3  LYS  52          3HD       LYS  52  -4.488  16.678  -1.380
  412    HE2  LYS  52          2HE       LYS  52  -6.098  17.127  -3.426
  413    HE3  LYS  52          3HE       LYS  52  -5.063  15.930  -4.203
  414    HZ1  LYS  52          1HZ       LYS  52  -5.603  14.339  -2.549
  415    HZ2  LYS  52          2HZ       LYS  52  -7.064  15.009  -3.074
  416    HZ3  LYS  52          3HZ       LYS  52  -6.400  15.486  -1.593
  417    H    LEU  53           H        LEU  53  -0.821  20.124  -3.199
  418    HA   LEU  53           HA       LEU  53  -1.057  19.170  -5.777
  419    HB2  LEU  53          2HB       LEU  53  -0.470  21.528  -4.862
  420    HB3  LEU  53          3HB       LEU  53   1.199  20.986  -5.027
  421    HG   LEU  53           HG       LEU  53   0.784  20.599  -7.442
  422   HD11  LEU  53          1HD1      LEU  53  -1.498  22.233  -7.798
  423   HD12  LEU  53          2HD1      LEU  53  -1.919  20.968  -6.645
  424   HD13  LEU  53          3HD1      LEU  53  -1.283  20.537  -8.232
  425   HD21  LEU  53          1HD2      LEU  53   1.667  22.762  -6.411
  426   HD22  LEU  53          2HD2      LEU  53   0.062  23.423  -6.720
  427   HD23  LEU  53          3HD2      LEU  53   1.050  22.842  -8.061
  428    H    LEU  54           H        LEU  54   1.419  18.536  -3.427
  429    HA   LEU  54           HA       LEU  54   3.376  17.548  -5.253
  430    HB2  LEU  54          2HB       LEU  54   3.656  18.369  -2.818
  431    HB3  LEU  54          3HB       LEU  54   3.187  16.728  -2.378
  432    HG   LEU  54           HG       LEU  54   5.551  17.402  -4.126
  433   HD11  LEU  54          1HD1      LEU  54   6.056  18.305  -2.002
  434   HD12  LEU  54          2HD1      LEU  54   6.856  16.735  -2.072
  435   HD13  LEU  54          3HD1      LEU  54   5.355  16.920  -1.164
  436   HD21  LEU  54          1HD2      LEU  54   6.188  15.050  -3.450
  437   HD22  LEU  54          2HD2      LEU  54   4.834  15.195  -4.570
  438   HD23  LEU  54          3HD2      LEU  54   4.535  14.868  -2.862
  439    H    GLU  55           H        GLU  55   1.312  15.856  -2.880
  440    HA   GLU  55           HA       GLU  55   1.877  13.268  -3.777
  441    HB2  GLU  55          2HB       GLU  55   0.658  14.075  -1.633
  442    HB3  GLU  55          3HB       GLU  55  -0.794  14.015  -2.623
  443    HG2  GLU  55          2HG       GLU  55  -0.959  11.893  -2.000
  444    HG3  GLU  55          3HG       GLU  55   0.378  11.579  -3.105
  445    H    CYS  56           H        CYS  56  -1.065  15.190  -4.405
  446    HA   CYS  56           HA       CYS  56  -1.283  13.837  -7.007
  447    HB2  CYS  56          2HB       CYS  56  -3.122  13.702  -4.790
  448    HB3  CYS  56          3HB       CYS  56  -3.902  14.450  -6.178
  449    HG   CYS  56           HG       CYS  56  -4.365  12.272  -7.450
  450    H    LEU  57           H        LEU  57  -3.296  15.068  -8.184
  451    HA   LEU  57           HA       LEU  57  -2.530  17.911  -8.139
  452    HB2  LEU  57          2HB       LEU  57  -2.666  16.023 -10.248
  453    HB3  LEU  57          3HB       LEU  57  -3.935  17.216 -10.520
  454    HG   LEU  57           HG       LEU  57  -1.856  18.854 -10.016
  455   HD11  LEU  57          1HD1      LEU  57  -0.261  17.312 -11.768
  456   HD12  LEU  57          2HD1      LEU  57  -0.672  16.294 -10.388
  457   HD13  LEU  57          3HD1      LEU  57   0.115  17.852 -10.132
  458   HD21  LEU  57          1HD2      LEU  57  -2.891  17.634 -12.542
  459   HD22  LEU  57          2HD2      LEU  57  -1.560  18.789 -12.593
  460   HD23  LEU  57          3HD2      LEU  57  -3.116  19.265 -11.912
  461    H    ASP  58           H        ASP  58  -4.044  19.426  -7.802
  462    HA   ASP  58           HA       ASP  58  -6.850  18.880  -8.234
  463    HB2  ASP  58          2HB       ASP  58  -5.696  18.529  -5.637
  464    HB3  ASP  58          3HB       ASP  58  -6.771  19.924  -5.597
  465    H    TYR  59           H        TYR  59  -8.196  20.836  -7.661
  466    HA   TYR  59           HA       TYR  59  -6.668  23.333  -7.745
  467    HB2  TYR  59          2HB       TYR  59  -7.595  22.323 -10.063
  468    HB3  TYR  59          3HB       TYR  59  -9.025  23.206  -9.540
  469    HD1  TYR  59           HD1      TYR  59  -9.189  25.498  -9.933
  470    HD2  TYR  59           HD2      TYR  59  -5.372  23.630 -10.125
  471    HE1  TYR  59           HE1      TYR  59  -8.215  27.590 -10.784
  472    HE2  TYR  59           HE2      TYR  59  -4.386  25.717 -10.975
  473    HH   TYR  59           HH       TYR  59  -4.890  27.749 -11.895
  474    H    LEU  60           H        LEU  60  -7.326  24.273  -5.916
  475    HA   LEU  60           HA       LEU  60  -8.662  25.102  -4.268
  476    HB2  LEU  60          2HB       LEU  60  -9.458  26.184  -6.578
  477    HB3  LEU  60          3HB       LEU  60 -10.954  25.369  -6.125
  478    HG   LEU  60           HG       LEU  60 -10.686  26.616  -3.878
  479   HD11  LEU  60          1HD1      LEU  60  -9.399  28.832  -5.233
  480   HD12  LEU  60          2HD1      LEU  60  -8.330  27.441  -5.062
  481   HD13  LEU  60          3HD1      LEU  60  -9.091  28.148  -3.637
  482   HD21  LEU  60          1HD2      LEU  60 -11.728  28.669  -4.903
  483   HD22  LEU  60          2HD2      LEU  60 -12.493  27.135  -5.319
  484   HD23  LEU  60          3HD2      LEU  60 -11.430  27.935  -6.479
  Start of MODEL   13
    1    H    LEU   1           H        LEU   1  10.529  -2.306   1.986
    2    HA   LEU   1           HA       LEU   1  11.416  -1.065   0.035
    3    HB2  LEU   1          2HB       LEU   1   8.953  -2.278  -1.205
    4    HB3  LEU   1          3HB       LEU   1   9.917  -1.006  -1.952
    5    HG   LEU   1           HG       LEU   1  11.121  -3.655  -1.211
    6   HD11  LEU   1          1HD1      LEU   1   9.564  -2.932  -3.677
    7   HD12  LEU   1          2HD1      LEU   1   9.343  -4.316  -2.608
    8   HD13  LEU   1          3HD1      LEU   1  10.762  -4.226  -3.652
    9   HD21  LEU   1          1HD2      LEU   1  11.898  -1.264  -2.779
   10   HD22  LEU   1          2HD2      LEU   1  12.416  -2.835  -3.390
   11   HD23  LEU   1          3HD2      LEU   1  12.876  -2.325  -1.765
   12    H    LYS   2           H        LYS   2  10.615   1.043  -0.588
   13    HA   LYS   2           HA       LYS   2   8.072   1.910   0.492
   14    HB2  LYS   2          2HB       LYS   2  10.474   2.197   2.009
   15    HB3  LYS   2          3HB       LYS   2   9.959   3.795   1.484
   16    HG2  LYS   2          2HG       LYS   2   7.959   3.675   2.645
   17    HG3  LYS   2          3HG       LYS   2   8.003   1.913   2.735
   18    HD2  LYS   2          2HD       LYS   2  10.289   3.175   4.028
   19    HD3  LYS   2          3HD       LYS   2   8.745   3.659   4.735
   20    HE2  LYS   2          2HE       LYS   2   9.578   0.801   4.256
   21    HE3  LYS   2          3HE       LYS   2   9.768   1.646   5.791
   22    HZ1  LYS   2          1HZ       LYS   2   7.412   1.897   5.962
   23    HZ2  LYS   2          2HZ       LYS   2   7.743   0.266   5.662
   24    HZ3  LYS   2          3HZ       LYS   2   7.167   1.254   4.416
   25    H    GLU   3           H        GLU   3  11.168   3.433  -0.424
   26    HA   GLU   3           HA       GLU   3   9.959   5.544  -1.848
   27    HB2  GLU   3          2HB       GLU   3  12.400   5.242  -0.914
   28    HB3  GLU   3          3HB       GLU   3  12.716   4.599  -2.519
   29    HG2  GLU   3          2HG       GLU   3  12.439   6.615  -3.539
   30    HG3  GLU   3          3HG       GLU   3  11.310   7.203  -2.319
   31    H    ASN   4           H        ASN   4   9.010   5.554  -3.768
   32    HA   ASN   4           HA       ASN   4  10.003   3.909  -5.932
   33    HB2  ASN   4          2HB       ASN   4   7.524   3.277  -4.459
   34    HB3  ASN   4          3HB       ASN   4   7.365   3.302  -6.213
   35   HD21  ASN   4          1HD2      ASN   4   8.101   1.628  -7.364
   36   HD22  ASN   4          2HD2      ASN   4   8.954   0.278  -6.706
   37    H    ASP   5           H        ASP   5   7.138   5.817  -4.993
   38    HA   ASP   5           HA       ASP   5   7.714   7.924  -6.796
   39    HB2  ASP   5          2HB       ASP   5   6.309   5.659  -7.893
   40    HB3  ASP   5          3HB       ASP   5   5.267   7.080  -7.910
   41    H    HIS   6           H        HIS   6   4.621   6.387  -5.934
   42    HA   HIS   6           HA       HIS   6   3.475   8.833  -5.062
   43    HB2  HIS   6          2HB       HIS   6   2.292   6.708  -5.928
   44    HB3  HIS   6          3HB       HIS   6   2.447   6.116  -4.276
   45    HD1  HIS   6           HD1      HIS   6  -0.217   6.139  -4.281
   46    HD2  HIS   6           HD2      HIS   6   1.621   9.860  -4.481
   47    HE1  HIS   6           HE1      HIS   6  -2.006   7.805  -3.691
   48    H    ALA   7           H        ALA   7   5.019   6.139  -3.407
   49    HA   ALA   7           HA       ALA   7   4.328   6.702  -0.780
   50    HB1  ALA   7          1HB       ALA   7   6.635   5.345  -2.075
   51    HB2  ALA   7          2HB       ALA   7   6.739   5.723  -0.355
   52    HB3  ALA   7          3HB       ALA   7   5.429   4.707  -0.957
   53    H    ARG   8           H        ARG   8   6.732   8.205  -2.846
   54    HA   ARG   8           HA       ARG   8   7.902   9.739  -0.702
   55    HB2  ARG   8          2HB       ARG   8   9.316   9.086  -2.551
   56    HB3  ARG   8          3HB       ARG   8   8.242   9.870  -3.701
   57    HG2  ARG   8          2HG       ARG   8   9.348  11.772  -3.486
   58    HG3  ARG   8          3HG       ARG   8   9.059  11.778  -1.745
   59    HD2  ARG   8          2HD       ARG   8  11.043  10.563  -1.317
   60    HD3  ARG   8          3HD       ARG   8  11.245  10.155  -3.020
   61    HE   ARG   8           HE       ARG   8  12.051  12.580  -1.712
   62   HH11  ARG   8          1HH1      ARG   8  11.971  12.318  -5.706
   63   HH12  ARG   8          2HH1      ARG   8  11.136  11.142  -4.747
   64   HH21  ARG   8          1HH2      ARG   8  13.121  14.020  -4.691
   65   HH22  ARG   8          2HH2      ARG   8  13.155  14.135  -2.964
   66    H    PHE   9           H        PHE   9   5.791  10.400  -3.479
   67    HA   PHE   9           HA       PHE   9   5.519  13.155  -3.101
   68    HB2  PHE   9          2HB       PHE   9   4.010  11.047  -4.532
   69    HB3  PHE   9          3HB       PHE   9   3.121  12.523  -4.172
   70    HD1  PHE   9           HD1      PHE   9   4.850  14.685  -4.574
   71    HD2  PHE   9           HD2      PHE   9   4.754  10.994  -6.692
   72    HE1  PHE   9           HE1      PHE   9   5.880  15.779  -6.522
   73    HE2  PHE   9           HE2      PHE   9   5.784  12.082  -8.643
   74    HZ   PHE   9           HZ       PHE   9   6.349  14.478  -8.559
   75    H    LEU  10           H        LEU  10   3.535  10.477  -1.873
   76    HA   LEU  10           HA       LEU  10   1.702  12.125  -0.472
   77    HB2  LEU  10          2HB       LEU  10   1.876   9.455  -1.103
   78    HB3  LEU  10          3HB       LEU  10   2.111   9.459   0.643
   79    HG   LEU  10           HG       LEU  10  -0.207  10.937  -0.522
   80   HD11  LEU  10          1HD1      LEU  10  -1.029   8.328   0.240
   81   HD12  LEU  10          2HD1      LEU  10   0.248   8.177  -0.966
   82   HD13  LEU  10          3HD1      LEU  10  -1.194   9.125  -1.325
   83   HD21  LEU  10          1HD2      LEU  10   0.567  10.909   1.943
   84   HD22  LEU  10          2HD2      LEU  10  -0.124   9.286   1.975
   85   HD23  LEU  10          3HD2      LEU  10  -1.144  10.672   1.585
   86    H    GLN  11           H        GLN  11   4.621  10.374   0.514
   87    HA   GLN  11           HA       GLN  11   4.514  10.837   3.248
   88    HB2  GLN  11          2HB       GLN  11   6.144   9.326   2.329
   89    HB3  GLN  11          3HB       GLN  11   6.897  10.620   1.406
   90    HG2  GLN  11          2HG       GLN  11   8.238  11.113   3.090
   91    HG3  GLN  11          3HG       GLN  11   6.868  11.309   4.182
   92   HE21  GLN  11          1HE2      GLN  11   5.877   9.105   4.821
   93   HE22  GLN  11          2HE2      GLN  11   7.014   7.909   5.332
   94    H    THR  12           H        THR  12   6.015  12.831   0.717
   95    HA   THR  12           HA       THR  12   7.029  14.844   2.360
   96    HB   THR  12           HB       THR  12   6.033  15.017  -0.488
   97    HG1  THR  12           HG1      THR  12   8.675  14.846   0.573
   98   HG21  THR  12          1HG2      THR  12   7.108  17.068   1.335
   99   HG22  THR  12          2HG2      THR  12   6.122  17.244  -0.116
  100   HG23  THR  12          3HG2      THR  12   7.862  17.001  -0.257
  101    H    ALA  13           H        ALA  13   3.906  14.705   0.654
  102    HA   ALA  13           HA       ALA  13   2.858  17.140   1.405
  103    HB1  ALA  13          1HB       ALA  13   1.703  14.527   0.644
  104    HB2  ALA  13          2HB       ALA  13   0.621  15.679   1.427
  105    HB3  ALA  13          3HB       ALA  13   1.459  16.126  -0.059
  106    H    LYS  14           H        LYS  14   2.747  14.076   3.193
  107    HA   LYS  14           HA       LYS  14   1.257  15.122   5.380
  108    HB2  LYS  14          2HB       LYS  14   1.857  12.619   4.556
  109    HB3  LYS  14          3HB       LYS  14   3.034  12.801   5.851
  110    HG2  LYS  14          2HG       LYS  14   1.461  12.777   7.472
  111    HG3  LYS  14          3HG       LYS  14   0.260  13.599   6.473
  112    HD2  LYS  14          2HD       LYS  14  -0.691  11.658   5.951
  113    HD3  LYS  14          3HD       LYS  14   0.845  11.027   5.353
  114    HE2  LYS  14          2HE       LYS  14   1.451  10.473   7.706
  115    HE3  LYS  14          3HE       LYS  14  -0.172  10.960   8.191
  116    HZ1  LYS  14          1HZ       LYS  14   0.320   8.488   7.713
  117    HZ2  LYS  14          2HZ       LYS  14   0.185   8.933   6.087
  118    HZ3  LYS  14          3HZ       LYS  14  -1.121   9.164   7.138
  119    H    ASN  15           H        ASN  15   4.710  14.471   4.867
  120    HA   ASN  15           HA       ASN  15   5.646  15.160   7.392
  121    HB2  ASN  15          2HB       ASN  15   6.817  14.315   5.093
  122    HB3  ASN  15          3HB       ASN  15   7.342  15.996   5.121
  123   HD21  ASN  15          1HD2      ASN  15   9.391  15.920   5.738
  124   HD22  ASN  15          2HD2      ASN  15   9.983  15.130   7.155
  125    H    ILE  16           H        ILE  16   4.464  17.161   4.835
  126    HA   ILE  16           HA       ILE  16   5.678  19.597   5.696
  127    HB   ILE  16           HB       ILE  16   3.284  19.102   3.927
  128   HG12  ILE  16          2HG1      ILE  16   5.853  20.216   2.928
  129   HG13  ILE  16          3HG1      ILE  16   5.838  18.510   3.364
  130   HG21  ILE  16          1HG2      ILE  16   2.820  21.254   4.409
  131   HG22  ILE  16          2HG2      ILE  16   4.450  21.585   4.992
  132   HG23  ILE  16          3HG2      ILE  16   4.118  21.578   3.260
  133   HD11  ILE  16          1HD1      ILE  16   3.535  18.975   1.817
  134   HD12  ILE  16          2HD1      ILE  16   4.881  19.768   0.999
  135   HD13  ILE  16          3HD1      ILE  16   4.974  18.051   1.387
  136    H    THR  17           H        THR  17   2.365  18.313   5.967
  137    HA   THR  17           HA       THR  17   1.531  20.426   7.719
  138    HB   THR  17           HB       THR  17  -0.074  17.951   7.692
  139    HG1  THR  17           HG1      THR  17  -0.541  18.001   5.560
  140   HG21  THR  17          1HG2      THR  17  -0.733  20.818   7.005
  141   HG22  THR  17          2HG2      THR  17  -0.855  20.109   8.616
  142   HG23  THR  17          3HG2      THR  17  -1.885  19.519   7.312
  143    H    GLU  18           H        GLU  18   3.174  17.473   8.132
  144    HA   GLU  18           HA       GLU  18   2.315  17.054  10.866
  145    HB2  GLU  18          2HB       GLU  18   2.834  15.134   9.413
  146    HB3  GLU  18          3HB       GLU  18   4.494  15.694   9.271
  147    HG2  GLU  18          2HG       GLU  18   4.189  13.844  10.884
  148    HG3  GLU  18          3HG       GLU  18   4.904  15.293  11.586
  149    H    ARG  19           H        ARG  19   5.136  18.285   9.150
  150    HA   ARG  19           HA       ARG  19   6.770  18.580  11.461
  151    HB2  ARG  19          2HB       ARG  19   7.865  18.446   9.349
  152    HB3  ARG  19          3HB       ARG  19   6.903  19.763   8.691
  153    HG2  ARG  19          2HG       ARG  19   8.006  21.322  10.231
  154    HG3  ARG  19          3HG       ARG  19   8.993  19.994  10.846
  155    HD2  ARG  19          2HD       ARG  19   9.137  20.060   7.987
  156    HD3  ARG  19          3HD       ARG  19   9.505  21.659   8.633
  157    HE   ARG  19           HE       ARG  19  10.929  19.742  10.101
  158   HH11  ARG  19          1HH1      ARG  19  12.527  20.890   6.615
  159   HH12  ARG  19          2HH1      ARG  19  10.838  21.138   6.913
  160   HH21  ARG  19          1HH2      ARG  19  13.842  19.907   8.211
  161   HH22  ARG  19          2HH2      ARG  19  13.153  19.410   9.720
  162    H    VAL  20           H        VAL  20   4.461  20.633   9.802
  163    HA   VAL  20           HA       VAL  20   5.133  23.044  11.152
  164    HB   VAL  20           HB       VAL  20   3.913  23.109   9.051
  165   HG11  VAL  20          1HG1      VAL  20   1.713  22.292   8.762
  166   HG12  VAL  20          2HG1      VAL  20   2.622  20.989   9.530
  167   HG13  VAL  20          3HG1      VAL  20   1.522  21.982  10.487
  168   HG21  VAL  20          1HG2      VAL  20   2.017  24.608   9.770
  169   HG22  VAL  20          2HG2      VAL  20   2.430  24.198  11.435
  170   HG23  VAL  20          3HG2      VAL  20   3.604  25.028  10.414
  171    H    SER  21           H        SER  21   2.660  20.558  11.688
  172    HA   SER  21           HA       SER  21   1.308  21.770  13.801
  173    HB2  SER  21          2HB       SER  21   0.160  19.915  13.115
  174    HB3  SER  21          3HB       SER  21   1.628  18.987  12.813
  175    HG   SER  21           HG       SER  21   0.642  18.111  14.598
  176    H    MET  22           H        MET  22   4.049  19.503  13.897
  177    HA   MET  22           HA       MET  22   4.329  19.373  16.670
  178    HB2  MET  22          2HB       MET  22   5.476  17.917  14.965
  179    HB3  MET  22          3HB       MET  22   6.588  19.246  14.671
  180    HG2  MET  22          2HG       MET  22   7.444  19.127  16.885
  181    HG3  MET  22          3HG       MET  22   6.184  17.996  17.372
  182    HE1  MET  22          1HE       MET  22   8.958  18.825  15.147
  183    HE2  MET  22          2HE       MET  22  10.094  17.503  15.419
  184    HE3  MET  22          3HE       MET  22   8.981  17.443  14.051
  185    H    ALA  23           H        ALA  23   5.716  21.638  14.332
  186    HA   ALA  23           HA       ALA  23   7.359  23.033  16.157
  187    HB1  ALA  23          1HB       ALA  23   6.239  23.682  13.457
  188    HB2  ALA  23          2HB       ALA  23   7.141  24.888  14.376
  189    HB3  ALA  23          3HB       ALA  23   7.910  23.366  13.926
  190    H    THR  24           H        THR  24   4.253  24.043  14.711
  191    HA   THR  24           HA       THR  24   3.846  26.302  16.268
  192    HB   THR  24           HB       THR  24   1.458  24.669  15.552
  193    HG1  THR  24           HG1      THR  24   1.753  25.173  13.352
  194   HG21  THR  24          1HG2      THR  24   2.223  27.499  15.806
  195   HG22  THR  24          2HG2      THR  24   0.670  26.714  16.092
  196   HG23  THR  24          3HG2      THR  24   1.158  27.132  14.450
  197    H    ALA  25           H        ALA  25   3.356  22.941  17.040
  198    HA   ALA  25           HA       ALA  25   1.770  23.450  19.389
  199    HB1  ALA  25          1HB       ALA  25   1.815  21.099  19.746
  200    HB2  ALA  25          2HB       ALA  25   1.631  21.359  18.011
  201    HB3  ALA  25          3HB       ALA  25   3.200  20.899  18.672
  202    H    SER  26           H        SER  26   5.136  23.205  18.622
  203    HA   SER  26           HA       SER  26   5.859  23.016  21.456
  204    HB2  SER  26          2HB       SER  26   7.167  22.289  18.927
  205    HB3  SER  26          3HB       SER  26   8.236  23.080  20.085
  206    HG   SER  26           HG       SER  26   8.108  20.761  20.306
  207    H    SER  27           H        SER  27   5.001  25.384  19.463
  208    HA   SER  27           HA       SER  27   7.092  27.262  20.321
  209    HB2  SER  27          2HB       SER  27   6.952  27.765  18.112
  210    HB3  SER  27          3HB       SER  27   5.335  27.079  17.956
  211    HG   SER  27           HG       SER  27   4.836  29.137  17.826
  212    H    GLN  28           H        GLN  28   3.567  26.881  20.154
  213    HA   GLN  28           HA       GLN  28   3.340  28.879  22.308
  214    HB2  GLN  28          2HB       GLN  28   1.448  28.300  20.028
  215    HB3  GLN  28          3HB       GLN  28   1.020  29.291  21.416
  216    HG2  GLN  28          2HG       GLN  28   3.457  30.292  20.431
  217    HG3  GLN  28          3HG       GLN  28   2.413  30.021  19.037
  218   HE21  GLN  28          1HE2      GLN  28   0.748  31.370  18.669
  219   HE22  GLN  28          2HE2      GLN  28   0.337  32.714  19.674
  220    H    VAL  29           H        VAL  29   3.446  25.754  21.999
  221    HA   VAL  29           HA       VAL  29   2.677  23.987  23.214
  222    HB   VAL  29           HB       VAL  29   1.026  25.872  24.875
  223   HG11  VAL  29          1HG1      VAL  29   0.604  23.752  25.636
  224   HG12  VAL  29          2HG1      VAL  29   2.207  23.157  25.198
  225   HG13  VAL  29          3HG1      VAL  29   2.001  24.172  26.626
  226   HG21  VAL  29          1HG2      VAL  29   4.005  25.453  24.954
  227   HG22  VAL  29          2HG2      VAL  29   3.125  26.973  24.794
  228   HG23  VAL  29          3HG2      VAL  29   3.085  26.088  26.319
  229    H    LEU  30           H        LEU  30   1.015  25.521  21.063
  230    HA   LEU  30           HA       LEU  30  -1.007  25.329  20.026
  231    HB2  LEU  30          2HB       LEU  30   0.034  22.907  20.220
  232    HB3  LEU  30          3HB       LEU  30  -1.378  22.639  21.241
  233    HG   LEU  30           HG       LEU  30  -2.796  23.397  19.310
  234   HD11  LEU  30          1HD1      LEU  30  -0.205  23.955  18.212
  235   HD12  LEU  30          2HD1      LEU  30  -1.800  24.361  17.580
  236   HD13  LEU  30          3HD1      LEU  30  -1.066  22.806  17.188
  237   HD21  LEU  30          1HD2      LEU  30  -2.992  21.262  18.578
  238   HD22  LEU  30          2HD2      LEU  30  -1.930  20.953  19.952
  239   HD23  LEU  30          3HD2      LEU  30  -1.257  21.070  18.325
  240    H    ILE  31           H        ILE  31  -1.453  26.857  22.076
  241    HA   ILE  31           HA       ILE  31  -4.003  25.894  23.162
  242    HB   ILE  31           HB       ILE  31  -3.514  26.979  25.331
  243   HG12  ILE  31          2HG1      ILE  31  -0.728  27.039  25.403
  244   HG13  ILE  31          3HG1      ILE  31  -1.138  27.814  23.876
  245   HG21  ILE  31          1HG2      ILE  31  -1.290  25.061  25.066
  246   HG22  ILE  31          2HG2      ILE  31  -2.650  25.076  26.186
  247   HG23  ILE  31          3HG2      ILE  31  -2.873  24.494  24.537
  248   HD11  ILE  31          1HD1      ILE  31  -1.220  28.892  26.491
  249   HD12  ILE  31          2HD1      ILE  31  -1.605  29.678  24.960
  250   HD13  ILE  31          3HD1      ILE  31  -2.868  28.845  25.865
  251    HA   PRO  32           HA       PRO  32  -5.585  29.801  21.929
  252    HB2  PRO  32          2HB       PRO  32  -7.556  30.156  23.762
  253    HB3  PRO  32          3HB       PRO  32  -7.668  28.980  22.447
  254    HG2  PRO  32          2HG       PRO  32  -6.928  28.549  25.315
  255    HG3  PRO  32          3HG       PRO  32  -7.983  27.576  24.274
  256    HD2  PRO  32          2HD       PRO  32  -5.420  26.884  24.803
  257    HD3  PRO  32          3HD       PRO  32  -6.209  26.512  23.257
  258    H    GLU  33           H        GLU  33  -6.229  31.996  22.866
  259    HA   GLU  33           HA       GLU  33  -5.343  32.884  25.362
  260    HB2  GLU  33          2HB       GLU  33  -3.230  32.500  23.442
  261    HB3  GLU  33          3HB       GLU  33  -3.374  34.206  23.842
  262    HG2  GLU  33          2HG       GLU  33  -3.402  32.297  26.098
  263    HG3  GLU  33          3HG       GLU  33  -1.877  32.507  25.240
  264    H    ILE  34           H        ILE  34  -5.287  33.916  21.952
  265    HA   ILE  34           HA       ILE  34  -7.189  36.034  22.609
  266    HB   ILE  34           HB       ILE  34  -4.591  36.568  21.163
  267   HG12  ILE  34          2HG1      ILE  34  -4.414  36.375  23.644
  268   HG13  ILE  34          3HG1      ILE  34  -4.025  37.982  23.040
  269   HG21  ILE  34          1HG2      ILE  34  -7.140  38.011  21.298
  270   HG22  ILE  34          2HG2      ILE  34  -5.717  38.994  21.640
  271   HG23  ILE  34          3HG2      ILE  34  -5.836  38.115  20.116
  272   HD11  ILE  34          1HD1      ILE  34  -6.734  37.259  24.110
  273   HD12  ILE  34          2HD1      ILE  34  -5.430  37.886  25.120
  274   HD13  ILE  34          3HD1      ILE  34  -6.074  38.865  23.802
  275    H    ASN  35           H        ASN  35  -5.256  34.574  19.999
  276    HA   ASN  35           HA       ASN  35  -7.631  34.077  18.450
  277    HB2  ASN  35          2HB       ASN  35  -6.420  36.538  18.059
  278    HB3  ASN  35          3HB       ASN  35  -5.747  35.545  16.770
  279   HD21  ASN  35          1HD2      ASN  35  -6.823  36.559  15.129
  280   HD22  ASN  35          2HD2      ASN  35  -8.532  36.447  14.906
  281    H    LEU  36           H        LEU  36  -5.385  32.604  19.638
  282    HA   LEU  36           HA       LEU  36  -3.468  31.781  17.815
  283    HB2  LEU  36          2HB       LEU  36  -3.290  31.103  20.081
  284    HB3  LEU  36          3HB       LEU  36  -4.857  30.298  20.032
  285    HG   LEU  36           HG       LEU  36  -3.213  29.061  18.087
  286   HD11  LEU  36          1HD1      LEU  36  -1.571  28.185  19.988
  287   HD12  LEU  36          2HD1      LEU  36  -1.790  29.837  20.564
  288   HD13  LEU  36          3HD1      LEU  36  -1.169  29.545  18.939
  289   HD21  LEU  36          1HD2      LEU  36  -4.699  27.612  18.968
  290   HD22  LEU  36          2HD2      LEU  36  -4.666  28.375  20.558
  291   HD23  LEU  36          3HD2      LEU  36  -3.379  27.264  20.085
  292    H    ASN  37           H        ASN  37  -6.811  30.735  18.182
  293    HA   ASN  37           HA       ASN  37  -6.776  28.504  16.512
  294    HB2  ASN  37          2HB       ASN  37  -8.820  30.329  17.585
  295    HB3  ASN  37          3HB       ASN  37  -9.270  29.541  16.075
  296   HD21  ASN  37          1HD2      ASN  37 -10.672  28.033  16.684
  297   HD22  ASN  37          2HD2      ASN  37 -10.370  26.808  17.864
  298    H    ASP  38           H        ASP  38  -7.536  31.888  15.707
  299    HA   ASP  38           HA       ASP  38  -7.973  31.505  12.971
  300    HB2  ASP  38          2HB       ASP  38  -7.122  33.885  14.602
  301    HB3  ASP  38          3HB       ASP  38  -7.261  33.991  12.849
  302    H    THR  39           H        THR  39  -5.018  32.600  14.636
  303    HA   THR  39           HA       THR  39  -3.372  32.775  12.399
  304    HB   THR  39           HB       THR  39  -2.046  31.778  14.836
  305    HG1  THR  39           HG1      THR  39  -2.531  33.718  15.985
  306   HG21  THR  39          1HG2      THR  39  -1.747  34.067  12.920
  307   HG22  THR  39          2HG2      THR  39  -0.621  32.756  13.271
  308   HG23  THR  39          3HG2      THR  39  -0.867  34.046  14.448
  309    H    PHE  40           H        PHE  40  -3.835  30.032  14.620
  310    HA   PHE  40           HA       PHE  40  -2.059  28.264  13.386
  311    HB2  PHE  40          2HB       PHE  40  -3.239  28.010  15.636
  312    HB3  PHE  40          3HB       PHE  40  -4.624  27.416  14.726
  313    HD1  PHE  40           HD1      PHE  40  -0.996  26.801  14.201
  314    HD2  PHE  40           HD2      PHE  40  -4.783  25.168  15.254
  315    HE1  PHE  40           HE1      PHE  40  -0.019  24.542  14.200
  316    HE2  PHE  40           HE2      PHE  40  -3.812  22.908  15.255
  317    HZ   PHE  40           HZ       PHE  40  -1.427  22.592  14.728
  318    H    ASP  41           H        ASP  41  -5.395  29.065  12.656
  319    HA   ASP  41           HA       ASP  41  -5.839  26.946  10.814
  320    HB2  ASP  41          2HB       ASP  41  -7.485  28.676  12.035
  321    HB3  ASP  41          3HB       ASP  41  -7.320  29.502  10.487
  322    H    THR  42           H        THR  42  -5.343  30.435  10.248
  323    HA   THR  42           HA       THR  42  -5.055  30.269   7.475
  324    HB   THR  42           HB       THR  42  -5.294  32.357   9.029
  325    HG1  THR  42           HG1      THR  42  -3.543  32.633   6.813
  326   HG21  THR  42          1HG2      THR  42  -2.300  32.319   8.651
  327   HG22  THR  42          2HG2      THR  42  -3.107  31.926  10.170
  328   HG23  THR  42          3HG2      THR  42  -3.260  33.542   9.482
  329    H    PHE  43           H        PHE  43  -2.812  29.595  10.036
  330    HA   PHE  43           HA       PHE  43  -0.437  29.758   8.463
  331    HB2  PHE  43          2HB       PHE  43  -0.392  29.956  10.914
  332    HB3  PHE  43          3HB       PHE  43  -0.944  28.291  11.061
  333    HD1  PHE  43           HD1      PHE  43   0.902  27.451  12.286
  334    HD2  PHE  43           HD2      PHE  43   1.519  29.458   8.584
  335    HE1  PHE  43           HE1      PHE  43   3.237  26.676  12.259
  336    HE2  PHE  43           HE2      PHE  43   3.854  28.685   8.550
  337    HZ   PHE  43           HZ       PHE  43   4.716  27.292  10.389
  338    H    ALA  44           H        ALA  44  -2.124  26.934   9.850
  339    HA   ALA  44           HA       ALA  44  -0.706  24.978   8.468
  340    HB1  ALA  44          1HB       ALA  44  -2.244  24.610  10.404
  341    HB2  ALA  44          2HB       ALA  44  -3.598  24.769   9.284
  342    HB3  ALA  44          3HB       ALA  44  -2.437  23.457   9.084
  343    H    LEU  45           H        LEU  45  -3.761  26.575   7.598
  344    HA   LEU  45           HA       LEU  45  -4.482  25.223   5.347
  345    HB2  LEU  45          2HB       LEU  45  -5.422  27.394   6.504
  346    HB3  LEU  45          3HB       LEU  45  -4.517  28.199   5.225
  347    HG   LEU  45           HG       LEU  45  -6.737  28.025   4.453
  348   HD11  LEU  45          1HD1      LEU  45  -5.270  25.700   3.221
  349   HD12  LEU  45          2HD1      LEU  45  -4.965  27.392   2.833
  350   HD13  LEU  45          3HD1      LEU  45  -6.537  26.677   2.480
  351   HD21  LEU  45          1HD2      LEU  45  -7.054  25.128   4.550
  352   HD22  LEU  45          2HD2      LEU  45  -8.180  26.409   4.998
  353   HD23  LEU  45          3HD2      LEU  45  -6.950  25.874   6.145
  354    H    ASP  46           H        ASP  46  -2.398  28.121   5.294
  355    HA   ASP  46           HA       ASP  46  -1.685  28.123   2.653
  356    HB2  ASP  46          2HB       ASP  46  -0.879  29.504   4.893
  357    HB3  ASP  46          3HB       ASP  46   0.596  28.671   4.410
  358    H    PHE  47           H        PHE  47  -0.145  26.283   5.268
  359    HA   PHE  47           HA       PHE  47   1.929  25.146   3.797
  360    HB2  PHE  47          2HB       PHE  47   0.655  24.694   6.367
  361    HB3  PHE  47          3HB       PHE  47   1.164  23.181   5.625
  362    HD1  PHE  47           HD1      PHE  47   3.618  23.685   4.335
  363    HD2  PHE  47           HD2      PHE  47   2.152  25.380   7.954
  364    HE1  PHE  47           HE1      PHE  47   5.929  24.101   5.072
  365    HE2  PHE  47           HE2      PHE  47   4.460  25.800   8.696
  366    HZ   PHE  47           HZ       PHE  47   6.352  25.161   7.255
  367    H    SER  48           H        SER  48  -1.328  23.864   4.431
  368    HA   SER  48           HA       SER  48  -1.125  21.451   3.104
  369    HB2  SER  48          2HB       SER  48  -3.099  22.507   4.460
  370    HB3  SER  48          3HB       SER  48  -3.643  23.070   2.880
  371    HG   SER  48           HG       SER  48  -3.498  20.834   2.203
  372    H    ARG  49           H        ARG  49  -2.020  24.619   1.774
  373    HA   ARG  49           HA       ARG  49  -2.665  23.936  -0.803
  374    HB2  ARG  49          2HB       ARG  49  -2.895  26.206  -0.096
  375    HB3  ARG  49          3HB       ARG  49  -1.174  26.342   0.240
  376    HG2  ARG  49          2HG       ARG  49  -1.696  27.518  -1.789
  377    HG3  ARG  49          3HG       ARG  49  -0.715  26.100  -2.170
  378    HD2  ARG  49          2HD       ARG  49  -2.312  25.247  -3.467
  379    HD3  ARG  49          3HD       ARG  49  -3.535  25.474  -2.217
  380    HE   ARG  49           HE       ARG  49  -3.097  27.970  -3.283
  381   HH11  ARG  49          1HH1      ARG  49  -5.106  25.530  -5.741
  382   HH12  ARG  49          2HH1      ARG  49  -4.123  24.865  -4.478
  383   HH21  ARG  49          1HH2      ARG  49  -5.254  27.801  -6.004
  384   HH22  ARG  49          2HH2      ARG  49  -4.387  28.857  -4.942
  385    H    GLU  50           H        GLU  50   0.570  24.411   0.560
  386    HA   GLU  50           HA       GLU  50   1.947  24.010  -1.897
  387    HB2  GLU  50          2HB       GLU  50   2.824  25.172   0.196
  388    HB3  GLU  50          3HB       GLU  50   3.089  23.564   0.856
  389    HG2  GLU  50          2HG       GLU  50   4.678  23.043  -0.827
  390    HG3  GLU  50          3HG       GLU  50   4.272  24.491  -1.745
  391    H    LYS  51           H        LYS  51   0.871  21.903   0.687
  392    HA   LYS  51           HA       LYS  51   2.369  19.620   0.042
  393    HB2  LYS  51          2HB       LYS  51   1.366  19.278   2.049
  394    HB3  LYS  51          3HB       LYS  51  -0.059  20.213   1.615
  395    HG2  LYS  51          2HG       LYS  51   0.210  17.678   0.173
  396    HG3  LYS  51          3HG       LYS  51   0.005  17.516   1.919
  397    HD2  LYS  51          2HD       LYS  51  -2.128  18.238   1.859
  398    HD3  LYS  51          3HD       LYS  51  -1.782  19.467   0.640
  399    HE2  LYS  51          2HE       LYS  51  -3.328  17.528  -0.011
  400    HE3  LYS  51          3HE       LYS  51  -2.029  17.958  -1.123
  401    HZ1  LYS  51          1HZ       LYS  51  -2.494  15.476  -0.325
  402    HZ2  LYS  51          2HZ       LYS  51  -1.399  15.942   0.876
  403    HZ3  LYS  51          3HZ       LYS  51  -0.953  16.028  -0.753
  404    H    LYS  52           H        LYS  52  -0.573  20.938  -1.312
  405    HA   LYS  52           HA       LYS  52  -1.259  18.600  -2.816
  406    HB2  LYS  52          2HB       LYS  52  -2.184  21.360  -3.535
  407    HB3  LYS  52          3HB       LYS  52  -3.050  19.834  -3.660
  408    HG2  LYS  52          2HG       LYS  52  -2.730  19.937  -1.004
  409    HG3  LYS  52          3HG       LYS  52  -2.749  21.664  -1.366
  410    HD2  LYS  52          2HD       LYS  52  -4.857  21.186  -2.721
  411    HD3  LYS  52          3HD       LYS  52  -4.876  19.612  -1.922
  412    HE2  LYS  52          2HE       LYS  52  -4.595  21.135   0.234
  413    HE3  LYS  52          3HE       LYS  52  -5.370  22.324  -0.811
  414    HZ1  LYS  52          1HZ       LYS  52  -6.607  20.342   0.646
  415    HZ2  LYS  52          2HZ       LYS  52  -6.704  19.824  -0.961
  416    HZ3  LYS  52          3HZ       LYS  52  -7.318  21.338  -0.522
  417    H    LEU  53           H        LEU  53  -0.078  21.819  -3.810
  418    HA   LEU  53           HA       LEU  53   0.378  21.284  -6.475
  419    HB2  LEU  53          2HB       LEU  53   0.539  23.513  -5.599
  420    HB3  LEU  53          3HB       LEU  53   1.912  23.063  -4.590
  421    HG   LEU  53           HG       LEU  53   2.311  22.677  -7.479
  422   HD11  LEU  53          1HD1      LEU  53   1.461  25.267  -6.361
  423   HD12  LEU  53          2HD1      LEU  53   1.389  24.661  -8.016
  424   HD13  LEU  53          3HD1      LEU  53   2.903  25.299  -7.376
  425   HD21  LEU  53          1HD2      LEU  53   4.146  22.316  -6.023
  426   HD22  LEU  53          2HD2      LEU  53   3.876  23.847  -5.189
  427   HD23  LEU  53          3HD2      LEU  53   4.457  23.840  -6.855
  428    H    LEU  54           H        LEU  54   2.231  20.306  -3.701
  429    HA   LEU  54           HA       LEU  54   4.576  19.561  -5.181
  430    HB2  LEU  54          2HB       LEU  54   4.770  20.186  -2.858
  431    HB3  LEU  54          3HB       LEU  54   3.665  18.897  -2.386
  432    HG   LEU  54           HG       LEU  54   6.216  18.605  -2.020
  433   HD11  LEU  54          1HD1      LEU  54   4.888  16.326  -3.433
  434   HD12  LEU  54          2HD1      LEU  54   4.287  16.901  -1.878
  435   HD13  LEU  54          3HD1      LEU  54   5.940  16.302  -2.018
  436   HD21  LEU  54          1HD2      LEU  54   6.136  17.529  -4.809
  437   HD22  LEU  54          2HD2      LEU  54   7.527  17.917  -3.796
  438   HD23  LEU  54          3HD2      LEU  54   6.572  19.213  -4.517
  439    H    GLU  55           H        GLU  55   2.087  17.677  -3.449
  440    HA   GLU  55           HA       GLU  55   2.916  15.173  -4.427
  441    HB2  GLU  55          2HB       GLU  55   1.299  15.796  -2.471
  442    HB3  GLU  55          3HB       GLU  55   0.058  15.729  -3.715
  443    HG2  GLU  55          2HG       GLU  55   1.243  13.397  -4.202
  444    HG3  GLU  55          3HG       GLU  55   1.643  13.554  -2.493
  445    H    CYS  56           H        CYS  56  -0.045  16.952  -5.321
  446    HA   CYS  56           HA       CYS  56  -1.203  17.096  -7.273
  447    HB2  CYS  56          2HB       CYS  56   1.307  17.610  -8.008
  448    HB3  CYS  56          3HB       CYS  56   1.095  16.102  -8.890
  449    HG   CYS  56           HG       CYS  56   0.633  18.101 -10.716
  450    H    LEU  57           H        LEU  57  -2.738  15.575  -7.299
  451    HA   LEU  57           HA       LEU  57  -1.977  12.854  -8.136
  452    HB2  LEU  57          2HB       LEU  57  -2.832  12.892  -5.875
  453    HB3  LEU  57          3HB       LEU  57  -4.268  13.767  -6.403
  454    HG   LEU  57           HG       LEU  57  -4.486  11.556  -7.924
  455   HD11  LEU  57          1HD1      LEU  57  -3.987   9.880  -5.777
  456   HD12  LEU  57          2HD1      LEU  57  -2.559  10.910  -5.864
  457   HD13  LEU  57          3HD1      LEU  57  -3.061   9.978  -7.275
  458   HD21  LEU  57          1HD2      LEU  57  -5.463  11.250  -5.151
  459   HD22  LEU  57          2HD2      LEU  57  -6.333  11.145  -6.682
  460   HD23  LEU  57          3HD2      LEU  57  -5.934  12.723  -6.000
  461    H    ASP  58           H        ASP  58  -4.105  15.561  -8.651
  462    HA   ASP  58           HA       ASP  58  -4.896  14.446 -11.214
  463    HB2  ASP  58          2HB       ASP  58  -6.671  14.508  -8.926
  464    HB3  ASP  58          3HB       ASP  58  -7.303  15.495 -10.241
  465    H    TYR  59           H        TYR  59  -6.120  17.088  -9.164
  466    HA   TYR  59           HA       TYR  59  -4.737  19.142 -10.529
  467    HB2  TYR  59          2HB       TYR  59  -6.604  18.232 -12.174
  468    HB3  TYR  59          3HB       TYR  59  -7.644  19.265 -11.200
  469    HD1  TYR  59           HD1      TYR  59  -8.057  21.321 -12.140
  470    HD2  TYR  59           HD2      TYR  59  -4.235  19.545 -12.725
  471    HE1  TYR  59           HE1      TYR  59  -7.358  23.275 -13.459
  472    HE2  TYR  59           HE2      TYR  59  -3.525  21.495 -14.045
  473    HH   TYR  59           HH       TYR  59  -4.153  23.415 -14.977
  474    H    LEU  60           H        LEU  60  -5.464  21.308  -9.864
  475    HA   LEU  60           HA       LEU  60  -5.983  22.790  -8.219
  476    HB2  LEU  60          2HB       LEU  60  -8.250  22.245  -8.996
  477    HB3  LEU  60          3HB       LEU  60  -8.328  20.937  -7.817
  478    HG   LEU  60           HG       LEU  60  -7.791  23.064  -6.211
  479   HD11  LEU  60          1HD1      LEU  60  -8.131  24.432  -8.413
  480   HD12  LEU  60          2HD1      LEU  60  -8.814  25.002  -6.891
  481   HD13  LEU  60          3HD1      LEU  60  -9.841  24.179  -8.065
  482   HD21  LEU  60          1HD2      LEU  60  -9.496  21.361  -5.848
  483   HD22  LEU  60          2HD2      LEU  60 -10.501  22.083  -7.105
  484   HD23  LEU  60          3HD2      LEU  60 -10.164  22.978  -5.622
  Start of MODEL   14
    1    H    LEU   1           H        LEU   1   4.511   2.655   1.480
    2    HA   LEU   1           HA       LEU   1   6.513   4.164   2.806
    3    HB2  LEU   1          2HB       LEU   1   5.553   1.330   3.059
    4    HB3  LEU   1          3HB       LEU   1   6.878   1.955   4.040
    5    HG   LEU   1           HG       LEU   1   5.011   3.820   4.558
    6   HD11  LEU   1          1HD1      LEU   1   2.891   2.486   4.989
    7   HD12  LEU   1          2HD1      LEU   1   3.538   1.299   3.858
    8   HD13  LEU   1          3HD1      LEU   1   3.219   2.947   3.319
    9   HD21  LEU   1          1HD2      LEU   1   4.394   1.947   6.440
   10   HD22  LEU   1          2HD2      LEU   1   5.808   3.001   6.486
   11   HD23  LEU   1          3HD2      LEU   1   5.949   1.363   5.845
   12    H    LYS   2           H        LYS   2   6.581   1.796   0.281
   13    HA   LYS   2           HA       LYS   2   9.503   2.046   0.174
   14    HB2  LYS   2          2HB       LYS   2   7.914  -0.516   0.046
   15    HB3  LYS   2          3HB       LYS   2   9.566  -0.392  -0.543
   16    HG2  LYS   2          2HG       LYS   2  10.448  -0.164   1.565
   17    HG3  LYS   2          3HG       LYS   2   8.946   0.473   2.240
   18    HD2  LYS   2          2HD       LYS   2   7.946  -1.811   1.874
   19    HD3  LYS   2          3HD       LYS   2   9.574  -2.378   1.492
   20    HE2  LYS   2          2HE       LYS   2   9.872  -0.982   3.871
   21    HE3  LYS   2          3HE       LYS   2   8.346  -1.843   4.065
   22    HZ1  LYS   2          1HZ       LYS   2  10.917  -2.866   4.309
   23    HZ2  LYS   2          2HZ       LYS   2  10.255  -3.567   2.920
   24    HZ3  LYS   2          3HZ       LYS   2   9.455  -3.712   4.404
   25    H    GLU   3           H        GLU   3   9.347   3.468  -1.555
   26    HA   GLU   3           HA       GLU   3   8.970   2.225  -4.123
   27    HB2  GLU   3          2HB       GLU   3   6.923   4.003  -2.976
   28    HB3  GLU   3          3HB       GLU   3   7.439   4.434  -4.601
   29    HG2  GLU   3          2HG       GLU   3   6.306   1.795  -3.707
   30    HG3  GLU   3          3HG       GLU   3   5.517   3.002  -4.721
   31    H    ASN   4           H        ASN   4   9.287   3.971  -5.905
   32    HA   ASN   4           HA       ASN   4  11.367   5.846  -4.988
   33    HB2  ASN   4          2HB       ASN   4  12.255   5.513  -7.406
   34    HB3  ASN   4          3HB       ASN   4  12.571   4.261  -6.208
   35   HD21  ASN   4          1HD2      ASN   4  10.647   5.156  -8.978
   36   HD22  ASN   4          2HD2      ASN   4  10.143   3.555  -9.390
   37    H    ASP   5           H        ASP   5   8.793   6.719  -5.013
   38    HA   ASP   5           HA       ASP   5   8.904   8.997  -6.629
   39    HB2  ASP   5          2HB       ASP   5   7.948   6.708  -8.018
   40    HB3  ASP   5          3HB       ASP   5   6.575   7.780  -7.754
   41    H    HIS   6           H        HIS   6   6.179   6.848  -5.815
   42    HA   HIS   6           HA       HIS   6   4.678   8.989  -4.668
   43    HB2  HIS   6          2HB       HIS   6   3.833   6.792  -5.777
   44    HB3  HIS   6          3HB       HIS   6   4.073   6.088  -4.181
   45    HD1  HIS   6           HD1      HIS   6   1.868   5.924  -3.088
   46    HD2  HIS   6           HD2      HIS   6   2.275   9.476  -5.204
   47    HE1  HIS   6           HE1      HIS   6  -0.254   7.205  -2.665
   48    H    ALA   7           H        ALA   7   6.940   6.667  -3.460
   49    HA   ALA   7           HA       ALA   7   6.177   6.700  -0.734
   50    HB1  ALA   7          1HB       ALA   7   8.274   5.554  -2.323
   51    HB2  ALA   7          2HB       ALA   7   8.939   6.244  -0.842
   52    HB3  ALA   7          3HB       ALA   7   7.652   5.042  -0.754
   53    H    ARG   8           H        ARG   8   8.572   8.568  -2.574
   54    HA   ARG   8           HA       ARG   8   9.401  10.101  -0.301
   55    HB2  ARG   8          2HB       ARG   8  10.601  11.482  -1.998
   56    HB3  ARG   8          3HB       ARG   8  10.974   9.766  -2.087
   57    HG2  ARG   8          2HG       ARG   8   9.718   9.480  -4.046
   58    HG3  ARG   8          3HG       ARG   8   8.894  11.027  -3.841
   59    HD2  ARG   8          2HD       ARG   8  11.397  11.922  -3.962
   60    HD3  ARG   8          3HD       ARG   8  11.607  10.434  -4.885
   61    HE   ARG   8           HE       ARG   8   9.367  11.714  -5.904
   62   HH11  ARG   8          1HH1      ARG   8  12.869  13.286  -7.040
   63   HH12  ARG   8          2HH1      ARG   8  12.783  12.314  -5.609
   64   HH21  ARG   8          1HH2      ARG   8  10.981  13.672  -8.280
   65   HH22  ARG   8          2HH2      ARG   8   9.466  12.992  -7.791
   66    H    PHE   9           H        PHE   9   6.929  10.378  -2.713
   67    HA   PHE   9           HA       PHE   9   6.456  13.179  -2.370
   68    HB2  PHE   9          2HB       PHE   9   5.348  10.999  -3.962
   69    HB3  PHE   9          3HB       PHE   9   4.109  12.103  -3.375
   70    HD1  PHE   9           HD1      PHE   9   7.597  12.948  -4.280
   71    HD2  PHE   9           HD2      PHE   9   3.484  13.191  -5.351
   72    HE1  PHE   9           HE1      PHE   9   8.162  14.531  -6.078
   73    HE2  PHE   9           HE2      PHE   9   4.043  14.773  -7.151
   74    HZ   PHE   9           HZ       PHE   9   6.384  15.444  -7.517
   75    H    LEU  10           H        LEU  10   5.048  10.215  -1.068
   76    HA   LEU  10           HA       LEU  10   2.949  11.509   0.354
   77    HB2  LEU  10          2HB       LEU  10   3.484   8.944  -0.313
   78    HB3  LEU  10          3HB       LEU  10   3.958   8.940   1.384
   79    HG   LEU  10           HG       LEU  10   1.276  10.000   0.597
   80   HD11  LEU  10          1HD1      LEU  10   2.197   7.269   0.244
   81   HD12  LEU  10          2HD1      LEU  10   0.705   8.040  -0.291
   82   HD13  LEU  10          3HD1      LEU  10   0.823   7.387   1.343
   83   HD21  LEU  10          1HD2      LEU  10   0.889   9.970   2.793
   84   HD22  LEU  10          2HD2      LEU  10   2.628   9.742   2.984
   85   HD23  LEU  10          3HD2      LEU  10   1.551   8.345   2.971
   86    H    GLN  11           H        GLN  11   6.041  10.087   1.415
   87    HA   GLN  11           HA       GLN  11   5.849  10.831   4.103
   88    HB2  GLN  11          2HB       GLN  11   7.649   9.422   2.599
   89    HB3  GLN  11          3HB       GLN  11   8.566  10.873   2.983
   90    HG2  GLN  11          2HG       GLN  11   8.576  10.438   5.238
   91    HG3  GLN  11          3HG       GLN  11   7.123   9.443   5.161
   92   HE21  GLN  11          1HE2      GLN  11   7.312   7.327   4.206
   93   HE22  GLN  11          2HE2      GLN  11   8.813   6.477   4.301
   94    H    THR  12           H        THR  12   6.792  12.639   1.281
   95    HA   THR  12           HA       THR  12   8.001  14.804   2.726
   96    HB   THR  12           HB       THR  12   7.177  14.429  -0.141
   97    HG1  THR  12           HG1      THR  12   9.470  14.730  -0.392
   98   HG21  THR  12          1HG2      THR  12   6.677  16.707   0.127
   99   HG22  THR  12          2HG2      THR  12   8.333  16.695  -0.480
  100   HG23  THR  12          3HG2      THR  12   8.025  16.962   1.235
  101    H    ALA  13           H        ALA  13   4.988  14.535   0.830
  102    HA   ALA  13           HA       ALA  13   3.897  16.999   1.404
  103    HB1  ALA  13          1HB       ALA  13   2.375  16.134   0.041
  104    HB2  ALA  13          2HB       ALA  13   2.956  14.498   0.356
  105    HB3  ALA  13          3HB       ALA  13   1.733  15.217   1.404
  106    H    LYS  14           H        LYS  14   3.639  14.006   3.293
  107    HA   LYS  14           HA       LYS  14   1.958  15.112   5.301
  108    HB2  LYS  14          2HB       LYS  14   2.145  12.682   4.846
  109    HB3  LYS  14          3HB       LYS  14   3.790  12.711   5.469
  110    HG2  LYS  14          2HG       LYS  14   3.005  12.336   7.500
  111    HG3  LYS  14          3HG       LYS  14   2.143  13.876   7.440
  112    HD2  LYS  14          2HD       LYS  14   0.406  12.471   6.047
  113    HD3  LYS  14          3HD       LYS  14   1.154  11.116   6.896
  114    HE2  LYS  14          2HE       LYS  14   0.754  12.427   9.032
  115    HE3  LYS  14          3HE       LYS  14  -0.264  13.496   8.069
  116    HZ1  LYS  14          1HZ       LYS  14  -1.438  11.643   9.257
  117    HZ2  LYS  14          2HZ       LYS  14  -0.685  10.566   8.192
  118    HZ3  LYS  14          3HZ       LYS  14  -1.744  11.743   7.596
  119    H    ASN  15           H        ASN  15   5.454  14.509   5.119
  120    HA   ASN  15           HA       ASN  15   6.159  15.321   7.679
  121    HB2  ASN  15          2HB       ASN  15   7.797  14.250   6.304
  122    HB3  ASN  15          3HB       ASN  15   7.669  15.500   5.070
  123   HD21  ASN  15          1HD2      ASN  15   8.291  15.286   8.560
  124   HD22  ASN  15          2HD2      ASN  15   9.628  16.381   8.559
  125    H    ILE  16           H        ILE  16   5.191  17.198   4.936
  126    HA   ILE  16           HA       ILE  16   6.274  19.690   5.781
  127    HB   ILE  16           HB       ILE  16   4.005  19.071   3.889
  128   HG12  ILE  16          2HG1      ILE  16   6.641  20.180   3.043
  129   HG13  ILE  16          3HG1      ILE  16   6.568  18.478   3.488
  130   HG21  ILE  16          1HG2      ILE  16   3.469  21.230   4.235
  131   HG22  ILE  16          2HG2      ILE  16   5.044  21.619   4.925
  132   HG23  ILE  16          3HG2      ILE  16   4.844  21.537   3.175
  133   HD11  ILE  16          1HD1      ILE  16   5.833  19.714   1.045
  134   HD12  ILE  16          2HD1      ILE  16   5.813  18.002   1.471
  135   HD13  ILE  16          3HD1      ILE  16   4.391  19.001   1.767
  136    H    THR  17           H        THR  17   2.973  18.350   5.901
  137    HA   THR  17           HA       THR  17   1.972  20.517   7.479
  138    HB   THR  17           HB       THR  17   0.503  17.941   7.480
  139    HG1  THR  17           HG1      THR  17   0.761  19.499   5.107
  140   HG21  THR  17          1HG2      THR  17  -1.213  19.313   7.865
  141   HG22  THR  17          2HG2      THR  17  -0.865  20.237   6.404
  142   HG23  THR  17          3HG2      THR  17  -0.064  20.649   7.919
  143    H    GLU  18           H        GLU  18   3.508  17.496   8.152
  144    HA   GLU  18           HA       GLU  18   2.583  17.308  10.871
  145    HB2  GLU  18          2HB       GLU  18   3.171  15.291   9.612
  146    HB3  GLU  18          3HB       GLU  18   4.825  15.864   9.447
  147    HG2  GLU  18          2HG       GLU  18   5.268  14.680  11.268
  148    HG3  GLU  18          3HG       GLU  18   4.414  15.936  12.163
  149    H    ARG  19           H        ARG  19   5.487  18.435   9.218
  150    HA   ARG  19           HA       ARG  19   7.003  18.902  11.577
  151    HB2  ARG  19          2HB       ARG  19   7.977  18.628   9.295
  152    HB3  ARG  19          3HB       ARG  19   7.320  20.203   8.867
  153    HG2  ARG  19          2HG       ARG  19   8.723  20.726  11.171
  154    HG3  ARG  19          3HG       ARG  19   9.721  19.520  10.355
  155    HD2  ARG  19          2HD       ARG  19   9.446  20.951   8.265
  156    HD3  ARG  19          3HD       ARG  19   8.823  22.202   9.340
  157    HE   ARG  19           HE       ARG  19  11.549  21.453   8.987
  158   HH11  ARG  19          1HH1      ARG  19  10.456  23.437  12.288
  159   HH12  ARG  19          2HH1      ARG  19   9.257  22.640  11.324
  160   HH21  ARG  19          1HH2      ARG  19  12.662  23.357  11.675
  161   HH22  ARG  19          2HH2      ARG  19  13.136  22.499  10.248
  162    H    VAL  20           H        VAL  20   5.061  21.006   9.477
  163    HA   VAL  20           HA       VAL  20   5.554  23.441  10.715
  164    HB   VAL  20           HB       VAL  20   4.344  23.354   8.632
  165   HG11  VAL  20          1HG1      VAL  20   1.990  22.190  10.104
  166   HG12  VAL  20          2HG1      VAL  20   2.176  22.429   8.366
  167   HG13  VAL  20          3HG1      VAL  20   3.143  21.211   9.198
  168   HG21  VAL  20          1HG2      VAL  20   2.658  24.476  10.867
  169   HG22  VAL  20          2HG2      VAL  20   3.945  25.309   9.996
  170   HG23  VAL  20          3HG2      VAL  20   2.458  24.865   9.159
  171    H    SER  21           H        SER  21   3.083  21.009  11.474
  172    HA   SER  21           HA       SER  21   1.755  22.416  13.487
  173    HB2  SER  21          2HB       SER  21   1.979  19.583  12.666
  174    HB3  SER  21          3HB       SER  21   1.478  19.855  14.335
  175    HG   SER  21           HG       SER  21  -0.043  19.955  12.236
  176    H    MET  22           H        MET  22   4.299  19.940  13.849
  177    HA   MET  22           HA       MET  22   4.618  20.188  16.610
  178    HB2  MET  22          2HB       MET  22   6.433  19.252  14.408
  179    HB3  MET  22          3HB       MET  22   7.009  19.333  16.068
  180    HG2  MET  22          2HG       MET  22   4.818  17.964  16.546
  181    HG3  MET  22          3HG       MET  22   4.984  17.538  14.844
  182    HE1  MET  22          1HE       MET  22   8.596  17.387  14.881
  183    HE2  MET  22          2HE       MET  22   8.229  15.694  14.550
  184    HE3  MET  22          3HE       MET  22   7.223  16.967  13.856
  185    H    ALA  23           H        ALA  23   5.870  22.113  13.982
  186    HA   ALA  23           HA       ALA  23   7.896  23.461  15.441
  187    HB1  ALA  23          1HB       ALA  23   8.373  24.011  13.340
  188    HB2  ALA  23          2HB       ALA  23   6.753  23.580  12.791
  189    HB3  ALA  23          3HB       ALA  23   7.068  25.194  13.430
  190    H    THR  24           H        THR  24   4.616  24.476  14.474
  191    HA   THR  24           HA       THR  24   4.568  26.947  15.723
  192    HB   THR  24           HB       THR  24   2.055  25.378  15.855
  193    HG1  THR  24           HG1      THR  24   2.489  24.556  13.930
  194   HG21  THR  24          1HG2      THR  24   1.689  27.607  14.277
  195   HG22  THR  24          2HG2      THR  24   2.941  28.120  15.408
  196   HG23  THR  24          3HG2      THR  24   1.400  27.515  16.013
  197    H    ALA  25           H        ALA  25   3.787  23.761  17.057
  198    HA   ALA  25           HA       ALA  25   2.908  24.675  19.582
  199    HB1  ALA  25          1HB       ALA  25   4.127  22.060  19.701
  200    HB2  ALA  25          2HB       ALA  25   2.437  22.525  19.896
  201    HB3  ALA  25          3HB       ALA  25   3.088  22.221  18.285
  202    H    SER  26           H        SER  26   6.027  23.249  18.595
  203    HA   SER  26           HA       SER  26   7.303  23.665  21.075
  204    HB2  SER  26          2HB       SER  26   8.261  22.059  19.602
  205    HB3  SER  26          3HB       SER  26   8.375  23.228  18.286
  206    HG   SER  26           HG       SER  26   9.930  23.038  20.630
  207    H    SER  27           H        SER  27   6.408  25.839  18.648
  208    HA   SER  27           HA       SER  27   8.470  27.786  19.376
  209    HB2  SER  27          2HB       SER  27   6.392  27.774  17.179
  210    HB3  SER  27          3HB       SER  27   7.469  29.133  17.499
  211    HG   SER  27           HG       SER  27   8.515  26.550  17.108
  212    H    GLN  28           H        GLN  28   5.167  27.017  19.922
  213    HA   GLN  28           HA       GLN  28   4.894  29.421  21.570
  214    HB2  GLN  28          2HB       GLN  28   3.064  28.566  19.354
  215    HB3  GLN  28          3HB       GLN  28   2.422  29.439  20.739
  216    HG2  GLN  28          2HG       GLN  28   4.342  31.118  20.218
  217    HG3  GLN  28          3HG       GLN  28   4.307  30.363  18.625
  218   HE21  GLN  28          1HE2      GLN  28   3.295  32.963  20.174
  219   HE22  GLN  28          2HE2      GLN  28   1.795  33.267  19.374
  220    H    VAL  29           H        VAL  29   2.552  26.929  20.632
  221    HA   VAL  29           HA       VAL  29   2.828  25.273  22.869
  222    HB   VAL  29           HB       VAL  29   2.121  27.164  24.207
  223   HG11  VAL  29          1HG1      VAL  29   0.961  28.429  22.471
  224   HG12  VAL  29          2HG1      VAL  29  -0.337  27.235  22.459
  225   HG13  VAL  29          3HG1      VAL  29  -0.060  28.222  23.894
  226   HG21  VAL  29          1HG2      VAL  29  -0.061  25.105  23.887
  227   HG22  VAL  29          2HG2      VAL  29   1.360  24.979  24.925
  228   HG23  VAL  29          3HG2      VAL  29   0.120  26.185  25.270
  229    H    LEU  30           H        LEU  30   0.699  26.687  20.469
  230    HA   LEU  30           HA       LEU  30  -0.798  25.760  19.028
  231    HB2  LEU  30          2HB       LEU  30   1.109  23.975  19.050
  232    HB3  LEU  30          3HB       LEU  30  -0.064  23.015  19.949
  233    HG   LEU  30           HG       LEU  30  -1.477  23.895  17.732
  234   HD11  LEU  30          1HD1      LEU  30   1.399  23.543  17.089
  235   HD12  LEU  30          2HD1      LEU  30   0.191  24.595  16.351
  236   HD13  LEU  30          3HD1      LEU  30   0.211  22.873  15.971
  237   HD21  LEU  30          1HD2      LEU  30  -0.014  21.274  17.971
  238   HD22  LEU  30          2HD2      LEU  30  -1.531  21.596  17.131
  239   HD23  LEU  30          3HD2      LEU  30  -1.465  21.667  18.893
  240    H    ILE  31           H        ILE  31  -2.200  26.699  20.833
  241    HA   ILE  31           HA       ILE  31  -4.175  24.683  21.521
  242    HB   ILE  31           HB       ILE  31  -4.348  25.449  23.871
  243   HG12  ILE  31          2HG1      ILE  31  -1.822  26.461  24.423
  244   HG13  ILE  31          3HG1      ILE  31  -2.288  27.297  22.946
  245   HG21  ILE  31          1HG2      ILE  31  -3.180  23.389  23.359
  246   HG22  ILE  31          2HG2      ILE  31  -1.685  24.279  23.079
  247   HG23  ILE  31          3HG2      ILE  31  -2.384  24.218  24.697
  248   HD11  ILE  31          1HD1      ILE  31  -2.889  28.230  25.338
  249   HD12  ILE  31          2HD1      ILE  31  -3.972  28.432  23.960
  250   HD13  ILE  31          3HD1      ILE  31  -4.275  27.157  25.140
  251    HA   PRO  32           HA       PRO  32  -6.995  27.925  20.615
  252    HB2  PRO  32          2HB       PRO  32  -9.115  27.208  22.152
  253    HB3  PRO  32          3HB       PRO  32  -8.652  26.335  20.686
  254    HG2  PRO  32          2HG       PRO  32  -8.073  25.672  23.547
  255    HG3  PRO  32          3HG       PRO  32  -8.582  24.598  22.231
  256    HD2  PRO  32          2HD       PRO  32  -6.008  24.780  23.050
  257    HD3  PRO  32          3HD       PRO  32  -6.452  24.444  21.364
  258    H    GLU  33           H        GLU  33  -7.491  29.940  21.317
  259    HA   GLU  33           HA       GLU  33  -7.585  30.506  24.174
  260    HB2  GLU  33          2HB       GLU  33  -5.332  31.165  22.469
  261    HB3  GLU  33          3HB       GLU  33  -6.050  32.610  23.166
  262    HG2  GLU  33          2HG       GLU  33  -5.475  30.283  24.931
  263    HG3  GLU  33          3HG       GLU  33  -4.150  31.323  24.410
  264    H    ILE  34           H        ILE  34  -7.178  32.568  21.307
  265    HA   ILE  34           HA       ILE  34  -9.960  33.404  21.451
  266    HB   ILE  34           HB       ILE  34  -7.704  35.383  21.794
  267   HG12  ILE  34          2HG1      ILE  34  -9.939  34.562  23.662
  268   HG13  ILE  34          3HG1      ILE  34  -8.233  34.177  23.860
  269   HG21  ILE  34          1HG2      ILE  34  -9.455  36.267  20.362
  270   HG22  ILE  34          2HG2      ILE  34 -10.676  35.827  21.554
  271   HG23  ILE  34          3HG2      ILE  34  -9.483  37.069  21.932
  272   HD11  ILE  34          1HD1      ILE  34  -7.747  36.579  24.070
  273   HD12  ILE  34          2HD1      ILE  34  -9.475  36.914  23.957
  274   HD13  ILE  34          3HD1      ILE  34  -8.844  35.988  25.318
  275    H    ASN  35           H        ASN  35  -7.027  34.854  20.049
  276    HA   ASN  35           HA       ASN  35  -8.270  34.570  17.396
  277    HB2  ASN  35          2HB       ASN  35  -7.678  36.894  18.402
  278    HB3  ASN  35          3HB       ASN  35  -6.019  36.467  17.994
  279   HD21  ASN  35          1HD2      ASN  35  -5.414  37.372  16.178
  280   HD22  ASN  35          2HD2      ASN  35  -6.387  37.587  14.767
  281    H    LEU  36           H        LEU  36  -6.722  32.509  18.765
  282    HA   LEU  36           HA       LEU  36  -4.223  32.425  17.257
  283    HB2  LEU  36          2HB       LEU  36  -4.231  31.845  19.655
  284    HB3  LEU  36          3HB       LEU  36  -5.314  30.500  19.304
  285    HG   LEU  36           HG       LEU  36  -2.727  30.565  17.856
  286   HD11  LEU  36          1HD1      LEU  36  -1.468  30.694  19.678
  287   HD12  LEU  36          2HD1      LEU  36  -2.191  29.179  20.216
  288   HD13  LEU  36          3HD1      LEU  36  -2.886  30.717  20.727
  289   HD21  LEU  36          1HD2      LEU  36  -3.813  28.659  17.296
  290   HD22  LEU  36          2HD2      LEU  36  -4.728  28.604  18.803
  291   HD23  LEU  36          3HD2      LEU  36  -3.046  28.071  18.772
  292    H    ASN  37           H        ASN  37  -7.297  30.730  17.551
  293    HA   ASN  37           HA       ASN  37  -6.763  28.539  15.911
  294    HB2  ASN  37          2HB       ASN  37  -8.957  29.479  17.290
  295    HB3  ASN  37          3HB       ASN  37  -9.472  29.613  15.611
  296   HD21  ASN  37          1HD2      ASN  37  -8.747  27.503  18.213
  297   HD22  ASN  37          2HD2      ASN  37  -9.171  26.025  17.425
  298    H    ASP  38           H        ASP  38  -7.151  31.853  15.122
  299    HA   ASP  38           HA       ASP  38  -7.851  31.398  12.355
  300    HB2  ASP  38          2HB       ASP  38  -8.686  33.402  13.439
  301    HB3  ASP  38          3HB       ASP  38  -7.047  33.908  13.838
  302    H    THR  39           H        THR  39  -5.023  32.740  14.062
  303    HA   THR  39           HA       THR  39  -3.357  33.026  11.851
  304    HB   THR  39           HB       THR  39  -1.911  32.175  14.240
  305    HG1  THR  39           HG1      THR  39  -3.194  33.098  15.641
  306   HG21  THR  39          1HG2      THR  39  -2.059  34.650  12.535
  307   HG22  THR  39          2HG2      THR  39  -0.756  33.467  12.641
  308   HG23  THR  39          3HG2      THR  39  -1.060  34.568  13.985
  309    H    PHE  40           H        PHE  40  -3.626  30.280  14.101
  310    HA   PHE  40           HA       PHE  40  -1.696  28.653  12.892
  311    HB2  PHE  40          2HB       PHE  40  -2.743  28.290  15.148
  312    HB3  PHE  40          3HB       PHE  40  -4.181  27.698  14.322
  313    HD1  PHE  40           HD1      PHE  40  -0.585  27.105  13.585
  314    HD2  PHE  40           HD2      PHE  40  -4.305  25.443  14.815
  315    HE1  PHE  40           HE1      PHE  40   0.398  24.851  13.500
  316    HE2  PHE  40           HE2      PHE  40  -3.328  23.187  14.733
  317    HZ   PHE  40           HZ       PHE  40  -0.973  22.888  14.076
  318    H    ASP  41           H        ASP  41  -5.162  28.977  12.288
  319    HA   ASP  41           HA       ASP  41  -5.494  26.852  10.515
  320    HB2  ASP  41          2HB       ASP  41  -6.969  29.258  11.252
  321    HB3  ASP  41          3HB       ASP  41  -7.195  28.824   9.559
  322    H    THR  42           H        THR  42  -5.030  30.288   9.667
  323    HA   THR  42           HA       THR  42  -4.682  29.901   6.927
  324    HB   THR  42           HB       THR  42  -4.887  32.103   8.418
  325    HG1  THR  42           HG1      THR  42  -3.467  32.068   5.946
  326   HG21  THR  42          1HG2      THR  42  -1.997  32.251   7.623
  327   HG22  THR  42          2HG2      THR  42  -2.471  31.651   9.212
  328   HG23  THR  42          3HG2      THR  42  -2.901  33.290   8.725
  329    H    PHE  43           H        PHE  43  -2.514  29.364   9.561
  330    HA   PHE  43           HA       PHE  43  -0.099  29.445   8.025
  331    HB2  PHE  43          2HB       PHE  43  -0.252  29.795  10.522
  332    HB3  PHE  43          3HB       PHE  43  -0.533  28.064  10.677
  333    HD1  PHE  43           HD1      PHE  43   1.364  27.324  11.806
  334    HD2  PHE  43           HD2      PHE  43   1.795  29.809   8.377
  335    HE1  PHE  43           HE1      PHE  43   3.793  26.933  11.833
  336    HE2  PHE  43           HE2      PHE  43   4.225  29.421   8.398
  337    HZ   PHE  43           HZ       PHE  43   5.227  27.981  10.127
  338    H    ALA  44           H        ALA  44  -1.984  26.786   9.469
  339    HA   ALA  44           HA       ALA  44  -0.474  24.731   8.229
  340    HB1  ALA  44          1HB       ALA  44  -1.674  23.385   9.537
  341    HB2  ALA  44          2HB       ALA  44  -2.411  24.847  10.193
  342    HB3  ALA  44          3HB       ALA  44  -3.200  23.976   8.878
  343    H    LEU  45           H        LEU  45  -3.624  26.191   7.465
  344    HA   LEU  45           HA       LEU  45  -4.427  24.656   5.351
  345    HB2  LEU  45          2HB       LEU  45  -5.970  26.248   5.849
  346    HB3  LEU  45          3HB       LEU  45  -4.758  27.506   6.078
  347    HG   LEU  45           HG       LEU  45  -4.561  27.788   3.673
  348   HD11  LEU  45          1HD1      LEU  45  -4.952  25.902   2.507
  349   HD12  LEU  45          2HD1      LEU  45  -6.602  26.522   2.454
  350   HD13  LEU  45          3HD1      LEU  45  -6.153  25.311   3.655
  351   HD21  LEU  45          1HD2      LEU  45  -6.620  28.874   3.291
  352   HD22  LEU  45          2HD2      LEU  45  -6.353  28.952   5.033
  353   HD23  LEU  45          3HD2      LEU  45  -7.487  27.777   4.367
  354    H    ASP  46           H        ASP  46  -2.466  27.623   5.044
  355    HA   ASP  46           HA       ASP  46  -1.946  27.521   2.346
  356    HB2  ASP  46          2HB       ASP  46  -1.129  29.120   4.396
  357    HB3  ASP  46          3HB       ASP  46   0.376  28.300   3.988
  358    H    PHE  47           H        PHE  47  -0.016  26.040   4.945
  359    HA   PHE  47           HA       PHE  47   1.948  24.883   3.345
  360    HB2  PHE  47          2HB       PHE  47   1.015  24.616   6.090
  361    HB3  PHE  47          3HB       PHE  47   1.598  23.088   5.438
  362    HD1  PHE  47           HD1      PHE  47   3.844  23.594   3.876
  363    HD2  PHE  47           HD2      PHE  47   2.581  25.692   7.358
  364    HE1  PHE  47           HE1      PHE  47   6.164  24.302   4.287
  365    HE2  PHE  47           HE2      PHE  47   4.899  26.404   7.774
  366    HZ   PHE  47           HZ       PHE  47   6.694  25.710   6.237
  367    H    SER  48           H        SER  48  -0.931  23.276   4.710
  368    HA   SER  48           HA       SER  48  -0.679  20.843   3.435
  369    HB2  SER  48          2HB       SER  48  -2.416  21.660   5.196
  370    HB3  SER  48          3HB       SER  48  -3.388  22.095   3.790
  371    HG   SER  48           HG       SER  48  -3.031  19.853   3.102
  372    H    ARG  49           H        ARG  49  -2.278  23.781   2.259
  373    HA   ARG  49           HA       ARG  49  -3.466  22.935  -0.034
  374    HB2  ARG  49          2HB       ARG  49  -3.319  25.303   0.873
  375    HB3  ARG  49          3HB       ARG  49  -1.768  25.426   0.052
  376    HG2  ARG  49          2HG       ARG  49  -3.159  24.659  -2.031
  377    HG3  ARG  49          3HG       ARG  49  -4.513  25.284  -1.087
  378    HD2  ARG  49          2HD       ARG  49  -3.591  27.453  -1.015
  379    HD3  ARG  49          3HD       ARG  49  -2.017  26.885  -1.571
  380    HE   ARG  49           HE       ARG  49  -4.247  27.615  -3.194
  381   HH11  ARG  49          1HH1      ARG  49  -1.310  25.374  -4.734
  382   HH12  ARG  49          2HH1      ARG  49  -1.473  25.520  -3.015
  383   HH21  ARG  49          1HH2      ARG  49  -2.771  26.462  -6.122
  384   HH22  ARG  49          2HH2      ARG  49  -4.043  27.431  -5.458
  385    H    GLU  50           H        GLU  50  -0.020  23.684   0.368
  386    HA   GLU  50           HA       GLU  50   0.613  22.985  -2.348
  387    HB2  GLU  50          2HB       GLU  50   1.963  24.207  -0.111
  388    HB3  GLU  50          3HB       GLU  50   2.971  22.951  -0.816
  389    HG2  GLU  50          2HG       GLU  50   2.426  24.074  -3.064
  390    HG3  GLU  50          3HG       GLU  50   1.916  25.446  -2.082
  391    H    LYS  51           H        LYS  51   0.697  21.406   0.779
  392    HA   LYS  51           HA       LYS  51   2.282  19.189   0.086
  393    HB2  LYS  51          2HB       LYS  51   1.833  18.445   2.179
  394    HB3  LYS  51          3HB       LYS  51   1.195  20.070   2.391
  395    HG2  LYS  51          2HG       LYS  51  -0.551  18.866   3.203
  396    HG3  LYS  51          3HG       LYS  51  -1.019  18.940   1.503
  397    HD2  LYS  51          2HD       LYS  51   0.467  16.726   1.422
  398    HD3  LYS  51          3HD       LYS  51  -0.037  16.650   3.112
  399    HE2  LYS  51          2HE       LYS  51  -2.356  16.718   2.475
  400    HE3  LYS  51          3HE       LYS  51  -1.926  16.984   0.786
  401    HZ1  LYS  51          1HZ       LYS  51  -2.539  14.618   1.622
  402    HZ2  LYS  51          2HZ       LYS  51  -0.935  14.581   2.156
  403    HZ3  LYS  51          3HZ       LYS  51  -1.274  14.818   0.516
  404    H    LYS  52           H        LYS  52  -1.051  19.953  -0.524
  405    HA   LYS  52           HA       LYS  52  -1.838  17.273  -1.191
  406    HB2  LYS  52          2HB       LYS  52  -3.547  18.750  -0.405
  407    HB3  LYS  52          3HB       LYS  52  -3.139  19.963  -1.611
  408    HG2  LYS  52          2HG       LYS  52  -5.168  18.861  -2.253
  409    HG3  LYS  52          3HG       LYS  52  -3.886  18.405  -3.377
  410    HD2  LYS  52          2HD       LYS  52  -3.640  16.269  -2.354
  411    HD3  LYS  52          3HD       LYS  52  -4.671  16.732  -0.997
  412    HE2  LYS  52          2HE       LYS  52  -6.376  17.161  -3.023
  413    HE3  LYS  52          3HE       LYS  52  -5.391  15.885  -3.738
  414    HZ1  LYS  52          1HZ       LYS  52  -7.086  14.758  -2.650
  415    HZ2  LYS  52          2HZ       LYS  52  -7.054  15.778  -1.301
  416    HZ3  LYS  52          3HZ       LYS  52  -5.803  14.666  -1.550
  417    H    LEU  53           H        LEU  53  -1.290  20.235  -3.098
  418    HA   LEU  53           HA       LEU  53  -1.658  19.187  -5.626
  419    HB2  LEU  53          2HB       LEU  53  -1.376  21.555  -5.231
  420    HB3  LEU  53          3HB       LEU  53   0.290  21.300  -4.718
  421    HG   LEU  53           HG       LEU  53  -0.464  20.477  -7.475
  422   HD11  LEU  53          1HD1      LEU  53  -1.502  22.701  -7.171
  423   HD12  LEU  53          2HD1      LEU  53  -0.182  22.706  -8.340
  424   HD13  LEU  53          3HD1      LEU  53   0.076  23.344  -6.716
  425   HD21  LEU  53          1HD2      LEU  53   1.941  21.238  -5.946
  426   HD22  LEU  53          2HD2      LEU  53   1.892  21.763  -7.629
  427   HD23  LEU  53          3HD2      LEU  53   1.739  20.050  -7.234
  428    H    LEU  54           H        LEU  54   0.989  18.738  -3.435
  429    HA   LEU  54           HA       LEU  54   2.894  17.837  -5.354
  430    HB2  LEU  54          2HB       LEU  54   3.643  18.669  -3.232
  431    HB3  LEU  54          3HB       LEU  54   2.696  17.456  -2.372
  432    HG   LEU  54           HG       LEU  54   4.834  16.542  -4.237
  433   HD11  LEU  54          1HD1      LEU  54   6.027  18.212  -3.034
  434   HD12  LEU  54          2HD1      LEU  54   6.436  16.654  -2.316
  435   HD13  LEU  54          3HD1      LEU  54   5.292  17.725  -1.506
  436   HD21  LEU  54          1HD2      LEU  54   5.024  14.931  -2.183
  437   HD22  LEU  54          2HD2      LEU  54   3.719  14.738  -3.354
  438   HD23  LEU  54          3HD2      LEU  54   3.411  15.543  -1.814
  439    H    GLU  55           H        GLU  55   1.071  16.038  -2.864
  440    HA   GLU  55           HA       GLU  55   1.709  13.491  -3.880
  441    HB2  GLU  55          2HB       GLU  55   0.576  14.356  -1.597
  442    HB3  GLU  55          3HB       GLU  55  -0.867  13.825  -2.450
  443    HG2  GLU  55          2HG       GLU  55   0.892  11.742  -2.827
  444    HG3  GLU  55          3HG       GLU  55   1.226  12.270  -1.179
  445    H    CYS  56           H        CYS  56  -1.301  15.381  -4.158
  446    HA   CYS  56           HA       CYS  56  -2.063  13.686  -6.437
  447    HB2  CYS  56          2HB       CYS  56  -3.534  14.202  -4.239
  448    HB3  CYS  56          3HB       CYS  56  -4.043  15.548  -5.251
  449    HG   CYS  56           HG       CYS  56  -5.482  14.203  -6.966
  450    H    LEU  57           H        LEU  57  -2.663  14.592  -8.387
  451    HA   LEU  57           HA       LEU  57  -1.741  17.339  -8.797
  452    HB2  LEU  57          2HB       LEU  57  -1.407  14.981 -10.237
  453    HB3  LEU  57          3HB       LEU  57  -2.551  15.927 -11.188
  454    HG   LEU  57           HG       LEU  57  -0.524  17.722 -10.536
  455   HD11  LEU  57          1HD1      LEU  57   0.978  16.029  -9.819
  456   HD12  LEU  57          2HD1      LEU  57   1.482  16.514 -11.438
  457   HD13  LEU  57          3HD1      LEU  57   0.593  15.009 -11.206
  458   HD21  LEU  57          1HD2      LEU  57  -0.829  16.127 -13.076
  459   HD22  LEU  57          2HD2      LEU  57  -0.095  17.721 -12.898
  460   HD23  LEU  57          3HD2      LEU  57  -1.828  17.514 -12.640
  461    H    ASP  58           H        ASP  58  -3.069  18.113 -11.018
  462    HA   ASP  58           HA       ASP  58  -4.985  19.090 -11.759
  463    HB2  ASP  58          2HB       ASP  58  -5.672  16.561 -11.587
  464    HB3  ASP  58          3HB       ASP  58  -6.652  17.123 -10.234
  465    H    TYR  59           H        TYR  59  -3.926  20.425  -9.743
  466    HA   TYR  59           HA       TYR  59  -4.311  21.888  -8.042
  467    HB2  TYR  59          2HB       TYR  59  -6.451  22.078  -9.837
  468    HB3  TYR  59          3HB       TYR  59  -7.196  22.049  -8.243
  469    HD1  TYR  59           HD1      TYR  59  -4.451  23.742 -10.124
  470    HD2  TYR  59           HD2      TYR  59  -7.371  24.024  -7.041
  471    HE1  TYR  59           HE1      TYR  59  -3.904  26.122  -9.832
  472    HE2  TYR  59           HE2      TYR  59  -6.833  26.406  -6.742
  473    HH   TYR  59           HH       TYR  59  -4.197  27.821  -7.636
  474    H    LEU  60           H        LEU  60  -6.250  22.294  -6.215
  475    HA   LEU  60           HA       LEU  60  -5.835  20.334  -4.307
  476    HB2  LEU  60          2HB       LEU  60  -8.021  22.377  -4.594
  477    HB3  LEU  60          3HB       LEU  60  -7.880  21.331  -3.183
  478    HG   LEU  60           HG       LEU  60  -5.361  22.506  -3.481
  479   HD11  LEU  60          1HD1      LEU  60  -6.018  24.224  -4.906
  480   HD12  LEU  60          2HD1      LEU  60  -6.122  24.955  -3.304
  481   HD13  LEU  60          3HD1      LEU  60  -7.587  24.407  -4.121
  482   HD21  LEU  60          1HD2      LEU  60  -6.543  23.933  -1.496
  483   HD22  LEU  60          2HD2      LEU  60  -5.891  22.305  -1.308
  484   HD23  LEU  60          3HD2      LEU  60  -7.615  22.536  -1.601
  Start of MODEL   15
    1    H    LEU   1           H        LEU   1  13.729  -5.954  -4.512
    2    HA   LEU   1           HA       LEU   1  12.154  -4.527  -5.434
    3    HB2  LEU   1          2HB       LEU   1  10.098  -6.101  -3.893
    4    HB3  LEU   1          3HB       LEU   1   9.781  -4.876  -5.120
    5    HG   LEU   1           HG       LEU   1  11.087  -7.552  -5.611
    6   HD11  LEU   1          1HD1      LEU   1   9.081  -8.373  -6.321
    7   HD12  LEU   1          2HD1      LEU   1   8.442  -6.780  -6.723
    8   HD13  LEU   1          3HD1      LEU   1   8.525  -7.297  -5.039
    9   HD21  LEU   1          1HD2      LEU   1  11.203  -5.180  -7.101
   10   HD22  LEU   1          2HD2      LEU   1  10.040  -6.218  -7.927
   11   HD23  LEU   1          3HD2      LEU   1  11.676  -6.800  -7.615
   12    H    LYS   2           H        LYS   2  11.652  -2.520  -4.710
   13    HA   LYS   2           HA       LYS   2  10.683  -1.914  -2.132
   14    HB2  LYS   2          2HB       LYS   2  13.320  -2.576  -2.002
   15    HB3  LYS   2          3HB       LYS   2  13.426  -0.840  -2.268
   16    HG2  LYS   2          2HG       LYS   2  11.913  -0.506  -0.330
   17    HG3  LYS   2          3HG       LYS   2  11.983  -2.244  -0.030
   18    HD2  LYS   2          2HD       LYS   2  14.540  -1.912  -0.002
   19    HD3  LYS   2          3HD       LYS   2  14.166  -0.198   0.197
   20    HE2  LYS   2          2HE       LYS   2  14.419  -1.000   2.381
   21    HE3  LYS   2          3HE       LYS   2  12.674  -0.935   2.137
   22    HZ1  LYS   2          1HZ       LYS   2  12.785  -3.336   1.563
   23    HZ2  LYS   2          2HZ       LYS   2  13.196  -2.994   3.167
   24    HZ3  LYS   2          3HZ       LYS   2  14.409  -3.339   2.040
   25    H    GLU   3           H        GLU   3  10.136  -1.193  -4.823
   26    HA   GLU   3           HA       GLU   3  11.150   1.263  -5.641
   27    HB2  GLU   3          2HB       GLU   3   8.667  -0.273  -6.155
   28    HB3  GLU   3          3HB       GLU   3   8.619   1.440  -6.545
   29    HG2  GLU   3          2HG       GLU   3  10.806  -0.357  -7.534
   30    HG3  GLU   3          3HG       GLU   3   9.282  -0.163  -8.397
   31    H    ASN   4           H        ASN   4   9.581   3.264  -5.811
   32    HA   ASN   4           HA       ASN   4   7.911   3.825  -3.585
   33    HB2  ASN   4          2HB       ASN   4  10.540   3.957  -2.892
   34    HB3  ASN   4          3HB       ASN   4  10.252   5.613  -3.415
   35   HD21  ASN   4          1HD2      ASN   4   9.258   3.105  -1.187
   36   HD22  ASN   4          2HD2      ASN   4   8.532   4.159  -0.026
   37    H    ASP   5           H        ASP   5   6.438   5.050  -4.542
   38    HA   ASP   5           HA       ASP   5   7.326   7.352  -6.125
   39    HB2  ASP   5          2HB       ASP   5   5.692   5.070  -7.056
   40    HB3  ASP   5          3HB       ASP   5   5.094   6.666  -7.499
   41    H    HIS   6           H        HIS   6   4.165   5.898  -5.375
   42    HA   HIS   6           HA       HIS   6   3.017   8.422  -4.724
   43    HB2  HIS   6          2HB       HIS   6   1.778   6.421  -5.646
   44    HB3  HIS   6          3HB       HIS   6   1.900   5.700  -4.044
   45    HD1  HIS   6           HD1      HIS   6   0.919   9.234  -5.064
   46    HD2  HIS   6           HD2      HIS   6  -0.572   5.963  -2.983
   47    HE1  HIS   6           HE1      HIS   6  -1.288   9.986  -4.124
   48    H    ALA   7           H        ALA   7   4.661   5.972  -2.922
   49    HA   ALA   7           HA       ALA   7   3.659   6.581  -0.346
   50    HB1  ALA   7          1HB       ALA   7   5.525   5.306   0.501
   51    HB2  ALA   7          2HB       ALA   7   4.844   4.489  -0.906
   52    HB3  ALA   7          3HB       ALA   7   6.343   5.406  -1.059
   53    H    ARG   8           H        ARG   8   6.756   7.468  -1.886
   54    HA   ARG   8           HA       ARG   8   7.648   9.183   0.126
   55    HB2  ARG   8          2HB       ARG   8   9.177   8.431  -1.560
   56    HB3  ARG   8          3HB       ARG   8   8.211   9.155  -2.838
   57    HG2  ARG   8          2HG       ARG   8   9.123  11.179  -2.554
   58    HG3  ARG   8          3HG       ARG   8   9.122  11.043  -0.795
   59    HD2  ARG   8          2HD       ARG   8  11.159   9.906  -0.763
   60    HD3  ARG   8          3HD       ARG   8  11.041   9.460  -2.464
   61    HE   ARG   8           HE       ARG   8  12.170  11.846  -1.400
   62   HH11  ARG   8          1HH1      ARG   8  11.005  11.757  -5.229
   63   HH12  ARG   8          2HH1      ARG   8  10.417  10.562  -4.120
   64   HH21  ARG   8          1HH2      ARG   8  12.446  13.384  -4.505
   65   HH22  ARG   8          2HH2      ARG   8  12.950  13.424  -2.849
   66    H    PHE   9           H        PHE   9   5.720   9.863  -2.768
   67    HA   PHE   9           HA       PHE   9   5.618  12.637  -2.570
   68    HB2  PHE   9          2HB       PHE   9   4.023  10.542  -3.893
   69    HB3  PHE   9          3HB       PHE   9   3.155  12.042  -3.580
   70    HD1  PHE   9           HD1      PHE   9   4.892  14.169  -4.073
   71    HD2  PHE   9           HD2      PHE   9   4.771  10.400  -6.046
   72    HE1  PHE   9           HE1      PHE   9   5.924  15.182  -6.064
   73    HE2  PHE   9           HE2      PHE   9   5.804  11.406  -8.039
   74    HZ   PHE   9           HZ       PHE   9   6.383  13.800  -8.050
   75    H    LEU  10           H        LEU  10   3.443  10.203  -1.168
   76    HA   LEU  10           HA       LEU  10   1.745  12.084   0.110
   77    HB2  LEU  10          2HB       LEU  10   1.664   9.393  -0.373
   78    HB3  LEU  10          3HB       LEU  10   1.949   9.448   1.366
   79    HG   LEU  10           HG       LEU  10  -0.214  11.194   0.403
   80   HD11  LEU  10          1HD1      LEU  10  -1.171   9.655  -0.903
   81   HD12  LEU  10          2HD1      LEU  10  -1.560   8.822   0.601
   82   HD13  LEU  10          3HD1      LEU  10  -0.123   8.366  -0.313
   83   HD21  LEU  10          1HD2      LEU  10   0.137   9.216   2.648
   84   HD22  LEU  10          2HD2      LEU  10  -1.333  10.152   2.379
   85   HD23  LEU  10          3HD2      LEU  10   0.182  10.976   2.749
   86    H    GLN  11           H        GLN  11   4.422  10.065   1.289
   87    HA   GLN  11           HA       GLN  11   4.361  10.770   3.965
   88    HB2  GLN  11          2HB       GLN  11   5.925   9.148   2.529
   89    HB3  GLN  11          3HB       GLN  11   7.028  10.510   2.675
   90    HG2  GLN  11          2HG       GLN  11   7.425  10.122   4.841
   91    HG3  GLN  11          3HG       GLN  11   5.743   9.720   5.183
   92   HE21  GLN  11          1HE2      GLN  11   5.128   7.627   5.254
   93   HE22  GLN  11          2HE2      GLN  11   6.199   6.291   5.023
   94    H    THR  12           H        THR  12   5.447  12.599   1.220
   95    HA   THR  12           HA       THR  12   6.935  14.538   2.715
   96    HB   THR  12           HB       THR  12   5.854  14.622  -0.107
   97    HG1  THR  12           HG1      THR  12   7.625  13.564  -0.549
   98   HG21  THR  12          1HG2      THR  12   7.286  16.634   1.531
   99   HG22  THR  12          2HG2      THR  12   6.160  16.856   0.191
  100   HG23  THR  12          3HG2      THR  12   7.838  16.420  -0.130
  101    H    ALA  13           H        ALA  13   3.846  14.732   0.935
  102    HA   ALA  13           HA       ALA  13   3.067  17.257   1.721
  103    HB1  ALA  13          1HB       ALA  13   1.562  16.554   0.215
  104    HB2  ALA  13          2HB       ALA  13   1.708  14.867   0.707
  105    HB3  ALA  13          3HB       ALA  13   0.675  15.965   1.622
  106    H    LYS  14           H        LYS  14   2.797  14.220   3.474
  107    HA   LYS  14           HA       LYS  14   1.205  15.321   5.594
  108    HB2  LYS  14          2HB       LYS  14   1.658  12.794   4.741
  109    HB3  LYS  14          3HB       LYS  14   2.776  12.865   6.097
  110    HG2  LYS  14          2HG       LYS  14   1.071  13.196   7.645
  111    HG3  LYS  14          3HG       LYS  14  -0.081  13.705   6.408
  112    HD2  LYS  14          2HD       LYS  14  -0.825  11.575   6.776
  113    HD3  LYS  14          3HD       LYS  14   0.355  11.259   5.502
  114    HE2  LYS  14          2HE       LYS  14   1.067  11.135   8.420
  115    HE3  LYS  14          3HE       LYS  14   0.417   9.745   7.552
  116    HZ1  LYS  14          1HZ       LYS  14   2.470   9.317   6.885
  117    HZ2  LYS  14          2HZ       LYS  14   3.061  10.742   7.577
  118    HZ3  LYS  14          3HZ       LYS  14   2.468  10.755   5.993
  119    H    ASN  15           H        ASN  15   4.617  14.413   5.215
  120    HA   ASN  15           HA       ASN  15   5.478  15.007   7.798
  121    HB2  ASN  15          2HB       ASN  15   6.961  13.822   6.363
  122    HB3  ASN  15          3HB       ASN  15   6.910  15.092   5.144
  123   HD21  ASN  15          1HD2      ASN  15   8.093  16.974   5.454
  124   HD22  ASN  15          2HD2      ASN  15   9.359  17.080   6.625
  125    H    ILE  16           H        ILE  16   4.552  17.094   5.223
  126    HA   ILE  16           HA       ILE  16   5.956  19.416   6.155
  127    HB   ILE  16           HB       ILE  16   3.636  19.180   4.235
  128   HG12  ILE  16          2HG1      ILE  16   6.396  19.884   3.374
  129   HG13  ILE  16          3HG1      ILE  16   6.095  18.207   3.818
  130   HG21  ILE  16          1HG2      ILE  16   4.383  21.462   3.509
  131   HG22  ILE  16          2HG2      ILE  16   3.641  21.394   5.107
  132   HG23  ILE  16          3HG2      ILE  16   5.393  21.517   4.954
  133   HD11  ILE  16          1HD1      ILE  16   5.296  17.862   1.790
  134   HD12  ILE  16          2HD1      ILE  16   3.981  18.984   2.140
  135   HD13  ILE  16          3HD1      ILE  16   5.468  19.572   1.397
  136    H    THR  17           H        THR  17   2.493  18.555   6.067
  137    HA   THR  17           HA       THR  17   1.731  20.698   7.782
  138    HB   THR  17           HB       THR  17  -0.068  18.358   7.628
  139    HG1  THR  17           HG1      THR  17   1.009  19.625   5.359
  140   HG21  THR  17          1HG2      THR  17  -0.408  21.292   6.993
  141   HG22  THR  17          2HG2      THR  17  -0.791  20.517   8.530
  142   HG23  THR  17          3HG2      THR  17  -1.702  20.099   7.079
  143    H    GLU  18           H        GLU  18   3.058  17.608   8.339
  144    HA   GLU  18           HA       GLU  18   1.954  17.289  10.992
  145    HB2  GLU  18          2HB       GLU  18   2.465  15.327   9.589
  146    HB3  GLU  18          3HB       GLU  18   4.167  15.766   9.604
  147    HG2  GLU  18          2HG       GLU  18   3.893  14.043  11.189
  148    HG3  GLU  18          3HG       GLU  18   4.106  15.538  12.099
  149    H    ARG  19           H        ARG  19   5.007  18.282   9.532
  150    HA   ARG  19           HA       ARG  19   6.450  18.483  11.971
  151    HB2  ARG  19          2HB       ARG  19   7.400  18.319   9.608
  152    HB3  ARG  19          3HB       ARG  19   7.036  20.033   9.454
  153    HG2  ARG  19          2HG       ARG  19   8.427  19.816  11.853
  154    HG3  ARG  19          3HG       ARG  19   9.262  18.732  10.738
  155    HD2  ARG  19          2HD       ARG  19   9.378  20.577   9.096
  156    HD3  ARG  19          3HD       ARG  19   8.633  21.647  10.283
  157    HE   ARG  19           HE       ARG  19  10.968  20.397  11.323
  158   HH11  ARG  19          1HH1      ARG  19  11.296  23.924   9.458
  159   HH12  ARG  19          2HH1      ARG  19   9.878  22.956   9.229
  160   HH21  ARG  19          1HH2      ARG  19  12.981  23.187  10.824
  161   HH22  ARG  19          2HH2      ARG  19  12.840  21.663  11.632
  162    H    VAL  20           H        VAL  20   4.395  20.664  10.163
  163    HA   VAL  20           HA       VAL  20   5.123  23.016  11.623
  164    HB   VAL  20           HB       VAL  20   4.201  23.196   9.370
  165   HG11  VAL  20          1HG1      VAL  20   2.687  21.268   9.468
  166   HG12  VAL  20          2HG1      VAL  20   1.632  22.159  10.567
  167   HG13  VAL  20          3HG1      VAL  20   1.860  22.722   8.910
  168   HG21  VAL  20          1HG2      VAL  20   3.303  24.645  11.661
  169   HG22  VAL  20          2HG2      VAL  20   3.573  25.226  10.018
  170   HG23  VAL  20          3HG2      VAL  20   2.000  24.574  10.475
  171    H    SER  21           H        SER  21   2.614  20.568  11.895
  172    HA   SER  21           HA       SER  21   1.018  21.904  13.808
  173    HB2  SER  21          2HB       SER  21   0.192  19.995  12.491
  174    HB3  SER  21          3HB       SER  21   1.327  18.930  13.320
  175    HG   SER  21           HG       SER  21  -1.046  19.301  14.080
  176    H    MET  22           H        MET  22   3.926  20.006  14.041
  177    HA   MET  22           HA       MET  22   3.730  19.863  16.950
  178    HB2  MET  22          2HB       MET  22   5.121  18.370  14.886
  179    HB3  MET  22          3HB       MET  22   6.211  18.845  16.182
  180    HG2  MET  22          2HG       MET  22   4.593  17.857  17.801
  181    HG3  MET  22          3HG       MET  22   3.680  17.243  16.425
  182    HE1  MET  22          1HE       MET  22   5.494  14.691  14.791
  183    HE2  MET  22          2HE       MET  22   5.004  16.354  14.467
  184    HE3  MET  22          3HE       MET  22   6.717  15.940  14.553
  185    H    ALA  23           H        ALA  23   5.768  21.276  14.425
  186    HA   ALA  23           HA       ALA  23   7.715  22.428  16.066
  187    HB1  ALA  23          1HB       ALA  23   8.059  22.287  13.700
  188    HB2  ALA  23          2HB       ALA  23   6.662  23.318  13.386
  189    HB3  ALA  23          3HB       ALA  23   8.096  23.988  14.165
  190    H    THR  24           H        THR  24   4.543  23.604  15.070
  191    HA   THR  24           HA       THR  24   4.915  26.164  16.361
  192    HB   THR  24           HB       THR  24   2.257  25.117  15.432
  193    HG1  THR  24           HG1      THR  24   4.498  25.813  13.890
  194   HG21  THR  24          1HG2      THR  24   1.655  27.342  15.237
  195   HG22  THR  24          2HG2      THR  24   3.323  27.885  15.048
  196   HG23  THR  24          3HG2      THR  24   2.731  27.389  16.633
  197    H    ALA  25           H        ALA  25   3.368  23.097  17.057
  198    HA   ALA  25           HA       ALA  25   2.018  24.085  19.409
  199    HB1  ALA  25          1HB       ALA  25   1.020  22.298  18.083
  200    HB2  ALA  25          2HB       ALA  25   2.403  21.259  18.430
  201    HB3  ALA  25          3HB       ALA  25   1.330  21.764  19.735
  202    H    SER  26           H        SER  26   5.167  23.413  18.752
  203    HA   SER  26           HA       SER  26   5.708  22.607  21.536
  204    HB2  SER  26          2HB       SER  26   7.236  21.914  19.019
  205    HB3  SER  26          3HB       SER  26   7.845  21.616  20.647
  206    HG   SER  26           HG       SER  26   6.815  19.770  19.852
  207    H    SER  27           H        SER  27   6.003  25.022  19.232
  208    HA   SER  27           HA       SER  27   8.409  26.171  20.448
  209    HB2  SER  27          2HB       SER  27   6.887  26.794  17.919
  210    HB3  SER  27          3HB       SER  27   8.126  27.876  18.555
  211    HG   SER  27           HG       SER  27   9.123  26.504  17.130
  212    H    GLN  28           H        GLN  28   4.979  26.536  20.300
  213    HA   GLN  28           HA       GLN  28   5.187  29.023  21.867
  214    HB2  GLN  28          2HB       GLN  28   3.316  28.211  19.696
  215    HB3  GLN  28          3HB       GLN  28   2.679  29.205  20.999
  216    HG2  GLN  28          2HG       GLN  28   3.947  31.020  20.426
  217    HG3  GLN  28          3HG       GLN  28   5.203  30.041  19.669
  218   HE21  GLN  28          1HE2      GLN  28   1.884  31.166  19.291
  219   HE22  GLN  28          2HE2      GLN  28   1.882  31.145  17.564
  220    H    VAL  29           H        VAL  29   2.425  26.892  21.269
  221    HA   VAL  29           HA       VAL  29   2.446  25.450  23.645
  222    HB   VAL  29           HB       VAL  29   2.250  27.468  24.898
  223   HG11  VAL  29          1HG1      VAL  29   0.056  28.185  22.966
  224   HG12  VAL  29          2HG1      VAL  29   0.311  29.027  24.495
  225   HG13  VAL  29          3HG1      VAL  29   1.569  29.042  23.259
  226   HG21  VAL  29          1HG2      VAL  29   0.328  27.031  26.162
  227   HG22  VAL  29          2HG2      VAL  29  -0.582  26.480  24.755
  228   HG23  VAL  29          3HG2      VAL  29   0.715  25.482  25.413
  229    H    LEU  30           H        LEU  30   0.597  27.044  21.152
  230    HA   LEU  30           HA       LEU  30  -1.105  26.303  19.831
  231    HB2  LEU  30          2HB       LEU  30   0.225  24.082  20.235
  232    HB3  LEU  30          3HB       LEU  30  -1.166  23.671  21.236
  233    HG   LEU  30           HG       LEU  30  -2.614  24.047  19.227
  234   HD11  LEU  30          1HD1      LEU  30  -1.790  24.920  17.366
  235   HD12  LEU  30          2HD1      LEU  30  -0.581  23.642  17.260
  236   HD13  LEU  30          3HD1      LEU  30  -0.233  25.111  18.171
  237   HD21  LEU  30          1HD2      LEU  30  -0.681  21.885  19.653
  238   HD22  LEU  30          2HD2      LEU  30  -1.352  21.958  18.024
  239   HD23  LEU  30          3HD2      LEU  30  -2.427  21.819  19.416
  240    H    ILE  31           H        ILE  31  -2.399  27.834  21.020
  241    HA   ILE  31           HA       ILE  31  -4.626  26.525  22.361
  242    HB   ILE  31           HB       ILE  31  -4.628  28.322  24.147
  243   HG12  ILE  31          2HG1      ILE  31  -1.761  28.641  24.172
  244   HG13  ILE  31          3HG1      ILE  31  -2.422  29.242  22.655
  245   HG21  ILE  31          1HG2      ILE  31  -4.096  26.060  24.717
  246   HG22  ILE  31          2HG2      ILE  31  -2.454  26.238  24.102
  247   HG23  ILE  31          3HG2      ILE  31  -2.954  27.116  25.547
  248   HD11  ILE  31          1HD1      ILE  31  -2.367  31.070  24.134
  249   HD12  ILE  31          2HD1      ILE  31  -4.056  30.569  24.043
  250   HD13  ILE  31          3HD1      ILE  31  -3.079  30.129  25.444
  251    HA   PRO  32           HA       PRO  32  -5.925  29.811  19.391
  252    HB2  PRO  32          2HB       PRO  32  -7.973  28.363  18.354
  253    HB3  PRO  32          3HB       PRO  32  -6.311  28.230  17.769
  254    HG2  PRO  32          2HG       PRO  32  -7.798  26.456  19.667
  255    HG3  PRO  32          3HG       PRO  32  -6.721  26.011  18.331
  256    HD2  PRO  32          2HD       PRO  32  -5.915  26.007  20.915
  257    HD3  PRO  32          3HD       PRO  32  -4.817  26.389  19.573
  258    H    GLU  33           H        GLU  33  -6.574  30.989  21.310
  259    HA   GLU  33           HA       GLU  33  -9.121  30.360  22.525
  260    HB2  GLU  33          2HB       GLU  33  -7.401  31.267  23.949
  261    HB3  GLU  33          3HB       GLU  33  -7.204  32.664  22.900
  262    HG2  GLU  33          2HG       GLU  33  -9.533  33.329  23.446
  263    HG3  GLU  33          3HG       GLU  33  -9.592  32.002  24.605
  264    H    ILE  34           H        ILE  34  -7.800  32.971  20.508
  265    HA   ILE  34           HA       ILE  34 -10.276  33.318  19.136
  266    HB   ILE  34           HB       ILE  34 -10.924  34.513  21.133
  267   HG12  ILE  34          2HG1      ILE  34 -10.284  36.829  19.406
  268   HG13  ILE  34          3HG1      ILE  34 -11.106  35.490  18.613
  269   HG21  ILE  34          1HG2      ILE  34  -9.695  36.349  22.050
  270   HG22  ILE  34          2HG2      ILE  34  -8.598  34.977  21.903
  271   HG23  ILE  34          3HG2      ILE  34  -8.527  36.292  20.730
  272   HD11  ILE  34          1HD1      ILE  34 -12.753  37.031  19.354
  273   HD12  ILE  34          2HD1      ILE  34 -12.844  35.611  20.397
  274   HD13  ILE  34          3HD1      ILE  34 -12.061  37.081  20.976
  275    H    ASN  35           H        ASN  35  -7.130  34.669  19.990
  276    HA   ASN  35           HA       ASN  35  -6.925  35.875  17.323
  277    HB2  ASN  35          2HB       ASN  35  -5.866  36.541  19.962
  278    HB3  ASN  35          3HB       ASN  35  -4.629  36.568  18.709
  279   HD21  ASN  35          1HD2      ASN  35  -7.749  37.856  19.663
  280   HD22  ASN  35          2HD2      ASN  35  -7.648  39.303  18.723
  281    H    LEU  36           H        LEU  36  -5.265  33.654  19.518
  282    HA   LEU  36           HA       LEU  36  -3.022  33.072  18.000
  283    HB2  LEU  36          2HB       LEU  36  -3.322  32.289  20.279
  284    HB3  LEU  36          3HB       LEU  36  -4.633  31.232  19.762
  285    HG   LEU  36           HG       LEU  36  -2.269  30.250  20.219
  286   HD11  LEU  36          1HD1      LEU  36  -3.522  28.574  19.445
  287   HD12  LEU  36          2HD1      LEU  36  -2.770  28.902  17.884
  288   HD13  LEU  36          3HD1      LEU  36  -4.340  29.606  18.272
  289   HD21  LEU  36          1HD2      LEU  36  -1.391  32.050  18.491
  290   HD22  LEU  36          2HD2      LEU  36  -1.796  30.781  17.334
  291   HD23  LEU  36          3HD2      LEU  36  -0.645  30.458  18.632
  292    H    ASN  37           H        ASN  37  -6.248  31.609  17.858
  293    HA   ASN  37           HA       ASN  37  -5.776  29.579  16.046
  294    HB2  ASN  37          2HB       ASN  37  -7.936  30.090  17.272
  295    HB3  ASN  37          3HB       ASN  37  -8.261  31.295  16.030
  296   HD21  ASN  37          1HD2      ASN  37  -6.938  28.006  15.936
  297   HD22  ASN  37          2HD2      ASN  37  -8.083  27.396  14.794
  298    H    ASP  38           H        ASP  38  -6.637  32.959  15.359
  299    HA   ASP  38           HA       ASP  38  -6.742  32.807  12.587
  300    HB2  ASP  38          2HB       ASP  38  -6.190  34.992  14.541
  301    HB3  ASP  38          3HB       ASP  38  -5.855  35.299  12.839
  302    H    THR  39           H        THR  39  -3.997  32.892  14.728
  303    HA   THR  39           HA       THR  39  -2.082  33.481  12.662
  304    HB   THR  39           HB       THR  39  -0.886  32.230  14.965
  305    HG1  THR  39           HG1      THR  39  -2.302  34.540  15.711
  306   HG21  THR  39          1HG2      THR  39   0.538  33.716  14.013
  307   HG22  THR  39          2HG2      THR  39  -0.220  34.834  15.147
  308   HG23  THR  39          3HG2      THR  39  -0.762  34.775  13.470
  309    H    PHE  40           H        PHE  40  -2.792  30.603  14.646
  310    HA   PHE  40           HA       PHE  40  -1.037  28.860  13.348
  311    HB2  PHE  40          2HB       PHE  40  -2.306  28.498  15.537
  312    HB3  PHE  40          3HB       PHE  40  -3.674  28.012  14.540
  313    HD1  PHE  40           HD1      PHE  40  -0.044  27.315  14.127
  314    HD2  PHE  40           HD2      PHE  40  -3.925  25.739  14.883
  315    HE1  PHE  40           HE1      PHE  40   0.863  25.031  14.005
  316    HE2  PHE  40           HE2      PHE  40  -3.024  23.453  14.763
  317    HZ   PHE  40           HZ       PHE  40  -0.627  23.096  14.325
  318    H    ASP  41           H        ASP  41  -4.415  29.650  12.673
  319    HA   ASP  41           HA       ASP  41  -4.917  27.742  10.702
  320    HB2  ASP  41          2HB       ASP  41  -6.450  29.573  11.860
  321    HB3  ASP  41          3HB       ASP  41  -6.070  30.477  10.397
  322    H    THR  42           H        THR  42  -4.081  31.170  10.163
  323    HA   THR  42           HA       THR  42  -3.668  31.008   7.424
  324    HB   THR  42           HB       THR  42  -3.610  33.054   9.147
  325    HG1  THR  42           HG1      THR  42  -3.538  34.077   7.297
  326   HG21  THR  42          1HG2      THR  42  -1.469  33.948   9.520
  327   HG22  THR  42          2HG2      THR  42  -0.713  32.844   8.370
  328   HG23  THR  42          3HG2      THR  42  -1.307  32.238   9.916
  329    H    PHE  43           H        PHE  43  -1.643  29.970  10.035
  330    HA   PHE  43           HA       PHE  43   0.786  29.846   8.521
  331    HB2  PHE  43          2HB       PHE  43   0.594  30.021  11.055
  332    HB3  PHE  43          3HB       PHE  43   0.173  28.311  11.045
  333    HD1  PHE  43           HD1      PHE  43   1.974  27.266  12.065
  334    HD2  PHE  43           HD2      PHE  43   2.682  30.118   8.987
  335    HE1  PHE  43           HE1      PHE  43   4.363  26.678  12.075
  336    HE2  PHE  43           HE2      PHE  43   5.072  29.534   8.990
  337    HZ   PHE  43           HZ       PHE  43   5.915  27.812  10.535
  338    H    ALA  44           H        ALA  44  -1.556  27.422   9.658
  339    HA   ALA  44           HA       ALA  44  -0.288  25.226   8.387
  340    HB1  ALA  44          1HB       ALA  44  -1.665  24.246   9.836
  341    HB2  ALA  44          2HB       ALA  44  -2.679  25.684   9.959
  342    HB3  ALA  44          3HB       ALA  44  -2.951  24.522   8.660
  343    H    LEU  45           H        LEU  45  -3.085  27.231   7.492
  344    HA   LEU  45           HA       LEU  45  -3.917  25.975   5.206
  345    HB2  LEU  45          2HB       LEU  45  -4.668  28.199   6.407
  346    HB3  LEU  45          3HB       LEU  45  -3.677  28.943   5.153
  347    HG   LEU  45           HG       LEU  45  -5.896  28.991   4.357
  348   HD11  LEU  45          1HD1      LEU  45  -4.150  28.211   2.755
  349   HD12  LEU  45          2HD1      LEU  45  -5.789  27.702   2.352
  350   HD13  LEU  45          3HD1      LEU  45  -4.666  26.556   3.082
  351   HD21  LEU  45          1HD2      LEU  45  -6.415  26.951   6.030
  352   HD22  LEU  45          2HD2      LEU  45  -6.381  26.084   4.494
  353   HD23  LEU  45          3HD2      LEU  45  -7.492  27.436   4.720
  354    H    ASP  46           H        ASP  46  -1.588  28.681   5.246
  355    HA   ASP  46           HA       ASP  46  -0.832  28.652   2.611
  356    HB2  ASP  46          2HB       ASP  46   0.025  29.963   4.870
  357    HB3  ASP  46          3HB       ASP  46   1.443  29.017   4.426
  358    H    PHE  47           H        PHE  47   0.545  26.707   5.245
  359    HA   PHE  47           HA       PHE  47   2.545  25.421   3.804
  360    HB2  PHE  47          2HB       PHE  47   1.159  25.016   6.339
  361    HB3  PHE  47          3HB       PHE  47   1.652  23.499   5.593
  362    HD1  PHE  47           HD1      PHE  47   4.150  23.652   4.566
  363    HD2  PHE  47           HD2      PHE  47   2.632  25.931   7.825
  364    HE1  PHE  47           HE1      PHE  47   6.443  23.989   5.394
  365    HE2  PHE  47           HE2      PHE  47   4.922  26.273   8.657
  366    HZ   PHE  47           HZ       PHE  47   6.831  25.302   7.441
  367    H    SER  48           H        SER  48  -0.787  24.323   4.416
  368    HA   SER  48           HA       SER  48  -0.721  21.932   3.040
  369    HB2  SER  48          2HB       SER  48  -2.630  22.709   4.419
  370    HB3  SER  48          3HB       SER  48  -3.051  23.863   3.154
  371    HG   SER  48           HG       SER  48  -3.975  22.311   2.090
  372    H    ARG  49           H        ARG  49  -1.433  25.170   1.775
  373    HA   ARG  49           HA       ARG  49  -2.148  24.612  -0.801
  374    HB2  ARG  49          2HB       ARG  49  -1.808  26.887   0.406
  375    HB3  ARG  49          3HB       ARG  49  -0.178  26.809  -0.251
  376    HG2  ARG  49          2HG       ARG  49  -1.600  26.300  -2.475
  377    HG3  ARG  49          3HG       ARG  49  -2.744  27.318  -1.598
  378    HD2  ARG  49          2HD       ARG  49  -1.304  29.140  -1.584
  379    HD3  ARG  49          3HD       ARG  49   0.121  28.139  -1.860
  380    HE   ARG  49           HE       ARG  49  -1.631  27.987  -4.074
  381   HH11  ARG  49          1HH1      ARG  49   1.048  30.960  -3.979
  382   HH12  ARG  49          2HH1      ARG  49   0.635  30.124  -2.519
  383   HH21  ARG  49          1HH2      ARG  49   0.063  30.366  -5.960
  384   HH22  ARG  49          2HH2      ARG  49  -1.095  29.080  -6.003
  385    H    GLU  50           H        GLU  50   1.134  24.726   0.520
  386    HA   GLU  50           HA       GLU  50   2.352  24.125  -2.018
  387    HB2  GLU  50          2HB       GLU  50   3.231  24.956   0.598
  388    HB3  GLU  50          3HB       GLU  50   4.189  23.589   0.047
  389    HG2  GLU  50          2HG       GLU  50   3.987  25.312  -2.148
  390    HG3  GLU  50          3HG       GLU  50   4.309  26.337  -0.752
  391    H    LYS  51           H        LYS  51   1.281  22.349   0.786
  392    HA   LYS  51           HA       LYS  51   2.680  19.954   0.389
  393    HB2  LYS  51          2HB       LYS  51   1.411  19.129   2.085
  394    HB3  LYS  51          3HB       LYS  51   1.013  20.829   2.298
  395    HG2  LYS  51          2HG       LYS  51  -1.082  19.967   2.316
  396    HG3  LYS  51          3HG       LYS  51  -0.905  20.208   0.577
  397    HD2  LYS  51          2HD       LYS  51   0.025  17.798   0.569
  398    HD3  LYS  51          3HD       LYS  51  -0.726  17.668   2.161
  399    HE2  LYS  51          2HE       LYS  51  -2.877  18.382   1.134
  400    HE3  LYS  51          3HE       LYS  51  -2.093  18.332  -0.444
  401    HZ1  LYS  51          1HZ       LYS  51  -2.237  15.994   1.374
  402    HZ2  LYS  51          2HZ       LYS  51  -1.765  16.009  -0.250
  403    HZ3  LYS  51          3HZ       LYS  51  -3.379  16.300   0.164
  404    H    LYS  52           H        LYS  52  -0.132  21.275  -1.180
  405    HA   LYS  52           HA       LYS  52  -0.875  18.785  -2.440
  406    HB2  LYS  52          2HB       LYS  52  -2.635  20.350  -1.925
  407    HB3  LYS  52          3HB       LYS  52  -1.827  21.626  -2.826
  408    HG2  LYS  52          2HG       LYS  52  -3.627  20.831  -4.154
  409    HG3  LYS  52          3HG       LYS  52  -2.129  20.256  -4.890
  410    HD2  LYS  52          2HD       LYS  52  -3.370  18.331  -4.945
  411    HD3  LYS  52          3HD       LYS  52  -2.589  18.150  -3.372
  412    HE2  LYS  52          2HE       LYS  52  -4.518  18.647  -2.210
  413    HE3  LYS  52          3HE       LYS  52  -5.218  19.552  -3.551
  414    HZ1  LYS  52          1HZ       LYS  52  -6.287  17.374  -3.131
  415    HZ2  LYS  52          2HZ       LYS  52  -4.840  16.609  -3.558
  416    HZ3  LYS  52          3HZ       LYS  52  -5.678  17.532  -4.702
  417    H    LEU  53           H        LEU  53   0.393  21.915  -3.586
  418    HA   LEU  53           HA       LEU  53   0.753  21.284  -6.248
  419    HB2  LEU  53          2HB       LEU  53   1.053  23.523  -5.504
  420    HB3  LEU  53          3HB       LEU  53   2.364  23.053  -4.425
  421    HG   LEU  53           HG       LEU  53   2.911  22.451  -7.228
  422   HD11  LEU  53          1HD1      LEU  53   2.560  25.329  -6.399
  423   HD12  LEU  53          2HD1      LEU  53   1.571  24.461  -7.573
  424   HD13  LEU  53          3HD1      LEU  53   3.276  24.764  -7.909
  425   HD21  LEU  53          1HD2      LEU  53   4.767  22.305  -5.899
  426   HD22  LEU  53          2HD2      LEU  53   4.271  23.645  -4.865
  427   HD23  LEU  53          3HD2      LEU  53   4.927  23.965  -6.471
  428    H    LEU  54           H        LEU  54   2.604  20.275  -3.488
  429    HA   LEU  54           HA       LEU  54   4.906  19.409  -4.946
  430    HB2  LEU  54          2HB       LEU  54   5.077  19.973  -2.602
  431    HB3  LEU  54          3HB       LEU  54   3.911  18.719  -2.186
  432    HG   LEU  54           HG       LEU  54   6.437  18.308  -1.777
  433   HD11  LEU  54          1HD1      LEU  54   4.436  16.680  -1.740
  434   HD12  LEU  54          2HD1      LEU  54   6.068  16.020  -1.852
  435   HD13  LEU  54          3HD1      LEU  54   5.059  16.127  -3.295
  436   HD21  LEU  54          1HD2      LEU  54   6.911  18.987  -4.217
  437   HD22  LEU  54          2HD2      LEU  54   6.358  17.361  -4.619
  438   HD23  LEU  54          3HD2      LEU  54   7.748  17.583  -3.555
  439    H    GLU  55           H        GLU  55   2.339  17.585  -3.262
  440    HA   GLU  55           HA       GLU  55   3.062  15.094  -4.388
  441    HB2  GLU  55          2HB       GLU  55   1.485  15.799  -2.335
  442    HB3  GLU  55          3HB       GLU  55   0.247  15.536  -3.554
  443    HG2  GLU  55          2HG       GLU  55   1.621  13.297  -3.917
  444    HG3  GLU  55          3HG       GLU  55   2.058  13.601  -2.236
  445    H    CYS  56           H        CYS  56   1.607  17.768  -5.771
  446    HA   CYS  56           HA       CYS  56   0.465  18.156  -7.702
  447    HB2  CYS  56          2HB       CYS  56   2.580  16.756  -8.392
  448    HB3  CYS  56          3HB       CYS  56   1.390  15.514  -8.763
  449    HG   CYS  56           HG       CYS  56   1.139  16.377 -11.165
  450    H    LEU  57           H        LEU  57  -1.628  17.993  -6.871
  451    HA   LEU  57           HA       LEU  57  -3.128  15.716  -7.883
  452    HB2  LEU  57          2HB       LEU  57  -2.657  16.262  -5.039
  453    HB3  LEU  57          3HB       LEU  57  -4.348  16.018  -5.469
  454    HG   LEU  57           HG       LEU  57  -2.377  14.011  -6.427
  455   HD11  LEU  57          1HD1      LEU  57  -3.427  13.910  -3.615
  456   HD12  LEU  57          2HD1      LEU  57  -1.834  14.555  -4.008
  457   HD13  LEU  57          3HD1      LEU  57  -2.220  12.874  -4.376
  458   HD21  LEU  57          1HD2      LEU  57  -4.899  13.255  -5.119
  459   HD22  LEU  57          2HD2      LEU  57  -4.194  12.702  -6.638
  460   HD23  LEU  57          3HD2      LEU  57  -5.070  14.233  -6.577
  461    H    ASP  58           H        ASP  58  -5.427  16.109  -7.984
  462    HA   ASP  58           HA       ASP  58  -6.001  18.895  -8.520
  463    HB2  ASP  58          2HB       ASP  58  -7.912  16.569  -8.751
  464    HB3  ASP  58          3HB       ASP  58  -8.001  18.126  -9.570
  465    H    TYR  59           H        TYR  59  -7.945  19.949  -7.710
  466    HA   TYR  59           HA       TYR  59  -9.371  18.966  -5.470
  467    HB2  TYR  59          2HB       TYR  59  -6.953  19.600  -4.623
  468    HB3  TYR  59          3HB       TYR  59  -7.599  21.237  -4.667
  469    HD1  TYR  59           HD1      TYR  59  -8.564  22.048  -2.738
  470    HD2  TYR  59           HD2      TYR  59  -8.577  17.849  -3.420
  471    HE1  TYR  59           HE1      TYR  59  -9.607  21.701  -0.538
  472    HE2  TYR  59           HE2      TYR  59  -9.621  17.489  -1.222
  473    HH   TYR  59           HH       TYR  59 -10.325  20.214   0.946
  474    H    LEU  60           H        LEU  60 -10.654  20.785  -4.403
  475    HA   LEU  60           HA       LEU  60 -11.124  23.010  -6.259
  476    HB2  LEU  60          2HB       LEU  60 -12.739  20.878  -6.313
  477    HB3  LEU  60          3HB       LEU  60 -13.499  21.770  -4.998
  478    HG   LEU  60           HG       LEU  60 -14.599  22.213  -7.127
  479   HD11  LEU  60          1HD1      LEU  60 -14.958  24.376  -6.637
  480   HD12  LEU  60          2HD1      LEU  60 -13.245  24.788  -6.704
  481   HD13  LEU  60          3HD1      LEU  60 -13.916  24.038  -5.255
  482   HD21  LEU  60          1HD2      LEU  60 -12.828  23.858  -8.498
  483   HD22  LEU  60          2HD2      LEU  60 -13.359  22.245  -8.973
  484   HD23  LEU  60          3HD2      LEU  60 -11.869  22.447  -8.049
  Start of MODEL   16
    1    H    LEU   1           H        LEU   1   6.583   3.708   2.743
    2    HA   LEU   1           HA       LEU   1   7.717   3.506   0.777
    3    HB2  LEU   1          2HB       LEU   1   9.559   1.661   2.268
    4    HB3  LEU   1          3HB       LEU   1   9.947   2.753   0.940
    5    HG   LEU   1           HG       LEU   1   9.085   3.746   3.646
    6   HD11  LEU   1          1HD1      LEU   1  11.864   3.140   2.654
    7   HD12  LEU   1          2HD1      LEU   1  11.044   2.427   4.043
    8   HD13  LEU   1          3HD1      LEU   1  11.503   4.130   4.069
    9   HD21  LEU   1          1HD2      LEU   1  10.107   5.808   2.921
   10   HD22  LEU   1          2HD2      LEU   1   8.925   5.286   1.720
   11   HD23  LEU   1          3HD2      LEU   1  10.649   5.053   1.422
   12    H    LYS   2           H        LYS   2   7.856   2.260  -1.063
   13    HA   LYS   2           HA       LYS   2   7.639  -0.610  -0.951
   14    HB2  LYS   2          2HB       LYS   2   5.526  -0.685  -2.273
   15    HB3  LYS   2          3HB       LYS   2   5.312  -0.095  -0.630
   16    HG2  LYS   2          2HG       LYS   2   4.958   2.096  -1.331
   17    HG3  LYS   2          3HG       LYS   2   5.681   1.805  -2.914
   18    HD2  LYS   2          2HD       LYS   2   3.169   0.412  -2.028
   19    HD3  LYS   2          3HD       LYS   2   3.136   1.998  -2.802
   20    HE2  LYS   2          2HE       LYS   2   4.327   1.061  -4.735
   21    HE3  LYS   2          3HE       LYS   2   4.325  -0.522  -3.960
   22    HZ1  LYS   2          1HZ       LYS   2   1.979  -0.637  -4.113
   23    HZ2  LYS   2          2HZ       LYS   2   2.536  -0.163  -5.639
   24    HZ3  LYS   2          3HZ       LYS   2   1.849   0.979  -4.597
   25    H    GLU   3           H        GLU   3   9.576   1.115  -2.012
   26    HA   GLU   3           HA       GLU   3  10.782   1.554  -3.895
   27    HB2  GLU   3          2HB       GLU   3  10.348  -1.060  -3.868
   28    HB3  GLU   3          3HB       GLU   3   9.431  -0.691  -5.321
   29    HG2  GLU   3          2HG       GLU   3  12.090   0.522  -5.239
   30    HG3  GLU   3          3HG       GLU   3  12.090  -1.240  -5.242
   31    H    ASN   4           H        ASN   4   9.800   3.522  -4.429
   32    HA   ASN   4           HA       ASN   4   8.737   3.716  -7.009
   33    HB2  ASN   4          2HB       ASN   4   6.776   2.914  -5.240
   34    HB3  ASN   4          3HB       ASN   4   6.550   4.659  -5.306
   35   HD21  ASN   4          1HD2      ASN   4   7.183   1.950  -7.509
   36   HD22  ASN   4          2HD2      ASN   4   6.073   2.463  -8.730
   37    H    ASP   5           H        ASP   5   7.348   6.048  -6.971
   38    HA   ASP   5           HA       ASP   5   9.148   7.916  -5.570
   39    HB2  ASP   5          2HB       ASP   5   9.187   7.612  -8.226
   40    HB3  ASP   5          3HB       ASP   5   7.856   8.761  -8.114
   41    H    HIS   6           H        HIS   6   6.034   6.816  -5.841
   42    HA   HIS   6           HA       HIS   6   4.657   9.323  -5.497
   43    HB2  HIS   6          2HB       HIS   6   3.685   7.237  -6.584
   44    HB3  HIS   6          3HB       HIS   6   3.547   6.568  -4.961
   45    HD1  HIS   6           HD1      HIS   6   1.484   7.148  -3.690
   46    HD2  HIS   6           HD2      HIS   6   2.092   9.667  -6.938
   47    HE1  HIS   6           HE1      HIS   6  -0.581   8.578  -3.829
   48    H    ALA   7           H        ALA   7   5.238   6.483  -3.421
   49    HA   ALA   7           HA       ALA   7   4.132   7.475  -1.078
   50    HB1  ALA   7          1HB       ALA   7   5.537   5.195  -1.829
   51    HB2  ALA   7          2HB       ALA   7   6.490   5.906  -0.526
   52    HB3  ALA   7          3HB       ALA   7   4.791   5.515  -0.263
   53    H    ARG   8           H        ARG   8   7.468   7.763  -2.266
   54    HA   ARG   8           HA       ARG   8   8.547   9.100  -0.066
   55    HB2  ARG   8          2HB       ARG   8   9.971   8.181  -1.791
   56    HB3  ARG   8          3HB       ARG   8   9.280   9.264  -2.992
   57    HG2  ARG   8          2HG       ARG   8  10.449  11.079  -2.234
   58    HG3  ARG   8          3HG       ARG   8  10.589  10.441  -0.594
   59    HD2  ARG   8          2HD       ARG   8  12.680   9.891  -1.150
   60    HD3  ARG   8          3HD       ARG   8  11.959   8.592  -2.099
   61    HE   ARG   8           HE       ARG   8  12.166  11.100  -3.498
   62   HH11  ARG   8          1HH1      ARG   8  14.829   8.163  -4.050
   63   HH12  ARG   8          2HH1      ARG   8  13.763   8.115  -2.685
   64   HH21  ARG   8          1HH2      ARG   8  14.717   9.903  -5.535
   65   HH22  ARG   8          2HH2      ARG   8  13.565  11.174  -5.298
   66    H    PHE   9           H        PHE   9   7.137  10.432  -3.049
   67    HA   PHE   9           HA       PHE   9   7.480  13.135  -2.441
   68    HB2  PHE   9          2HB       PHE   9   6.230  11.620  -4.475
   69    HB3  PHE   9          3HB       PHE   9   5.021  12.750  -3.875
   70    HD1  PHE   9           HD1      PHE   9   4.831  14.523  -5.316
   71    HD2  PHE   9           HD2      PHE   9   8.705  13.014  -4.402
   72    HE1  PHE   9           HE1      PHE   9   5.844  16.320  -6.658
   73    HE2  PHE   9           HE2      PHE   9   9.724  14.808  -5.742
   74    HZ   PHE   9           HZ       PHE   9   8.294  16.465  -6.871
   75    H    LEU  10           H        LEU  10   4.921  10.884  -1.561
   76    HA   LEU  10           HA       LEU  10   3.153  12.808  -0.465
   77    HB2  LEU  10          2HB       LEU  10   3.194  10.015  -0.868
   78    HB3  LEU  10          3HB       LEU  10   2.892  10.282   0.848
   79    HG   LEU  10           HG       LEU  10   1.260  11.808  -1.118
   80   HD11  LEU  10          1HD1      LEU  10   0.591   9.957  -2.164
   81   HD12  LEU  10          2HD1      LEU  10  -0.236   9.548  -0.661
   82   HD13  LEU  10          3HD1      LEU  10   1.373   8.903  -0.986
   83   HD21  LEU  10          1HD2      LEU  10   1.059  12.174   1.306
   84   HD22  LEU  10          2HD2      LEU  10   0.622  10.477   1.513
   85   HD23  LEU  10          3HD2      LEU  10  -0.433  11.554   0.597
   86    H    GLN  11           H        GLN  11   5.636  10.722   0.969
   87    HA   GLN  11           HA       GLN  11   5.220  11.350   3.647
   88    HB2  GLN  11          2HB       GLN  11   7.097   9.890   2.170
   89    HB3  GLN  11          3HB       GLN  11   8.040  11.083   3.053
   90    HG2  GLN  11          2HG       GLN  11   7.850   9.924   4.923
   91    HG3  GLN  11          3HG       GLN  11   6.092   9.926   4.795
   92   HE21  GLN  11          1HE2      GLN  11   8.665   7.978   5.093
   93   HE22  GLN  11          2HE2      GLN  11   8.056   6.542   4.350
   94    H    THR  12           H        THR  12   6.759  13.175   1.116
   95    HA   THR  12           HA       THR  12   8.076  15.036   2.850
   96    HB   THR  12           HB       THR  12   7.506  15.021  -0.106
   97    HG1  THR  12           HG1      THR  12   9.296  13.874   0.194
   98   HG21  THR  12          1HG2      THR  12   8.588  17.248   1.591
   99   HG22  THR  12          2HG2      THR  12   7.373  17.317   0.315
  100   HG23  THR  12          3HG2      THR  12   9.070  17.070  -0.095
  101    H    ALA  13           H        ALA  13   5.288  15.364   0.644
  102    HA   ALA  13           HA       ALA  13   4.490  17.907   1.321
  103    HB1  ALA  13          1HB       ALA  13   3.342  15.664  -0.035
  104    HB2  ALA  13          2HB       ALA  13   2.117  16.439   0.971
  105    HB3  ALA  13          3HB       ALA  13   2.996  17.382  -0.233
  106    H    LYS  14           H        LYS  14   3.612  14.862   2.918
  107    HA   LYS  14           HA       LYS  14   1.903  16.066   4.845
  108    HB2  LYS  14          2HB       LYS  14   2.861  13.409   4.204
  109    HB3  LYS  14          3HB       LYS  14   2.866  13.677   5.942
  110    HG2  LYS  14          2HG       LYS  14   0.421  14.646   4.776
  111    HG3  LYS  14          3HG       LYS  14   0.701  12.957   4.343
  112    HD2  LYS  14          2HD       LYS  14   1.261  13.567   7.149
  113    HD3  LYS  14          3HD       LYS  14  -0.421  13.834   6.684
  114    HE2  LYS  14          2HE       LYS  14   1.003  11.307   5.931
  115    HE3  LYS  14          3HE       LYS  14   0.289  11.498   7.532
  116    HZ1  LYS  14          1HZ       LYS  14  -1.683  12.305   5.844
  117    HZ2  LYS  14          2HZ       LYS  14  -1.580  10.789   6.587
  118    HZ3  LYS  14          3HZ       LYS  14  -0.989  11.003   5.016
  119    H    ASN  15           H        ASN  15   5.277  14.963   4.941
  120    HA   ASN  15           HA       ASN  15   5.814  15.479   7.618
  121    HB2  ASN  15          2HB       ASN  15   7.410  14.267   6.298
  122    HB3  ASN  15          3HB       ASN  15   7.615  15.625   5.196
  123   HD21  ASN  15          1HD2      ASN  15   9.613  16.323   5.443
  124   HD22  ASN  15          2HD2      ASN  15  10.383  16.674   6.949
  125    H    ILE  16           H        ILE  16   5.450  17.663   4.949
  126    HA   ILE  16           HA       ILE  16   6.777  19.898   6.096
  127    HB   ILE  16           HB       ILE  16   4.644  19.763   3.964
  128   HG12  ILE  16          2HG1      ILE  16   7.489  20.502   3.457
  129   HG13  ILE  16          3HG1      ILE  16   7.115  18.806   3.743
  130   HG21  ILE  16          1HG2      ILE  16   4.400  21.952   4.392
  131   HG22  ILE  16          2HG2      ILE  16   5.899  22.041   5.315
  132   HG23  ILE  16          3HG2      ILE  16   5.943  22.115   3.554
  133   HD11  ILE  16          1HD1      ILE  16   6.561  18.622   1.614
  134   HD12  ILE  16          2HD1      ILE  16   5.223  19.737   1.890
  135   HD13  ILE  16          3HD1      ILE  16   6.791  20.353   1.369
  136    H    THR  17           H        THR  17   3.326  19.054   5.824
  137    HA   THR  17           HA       THR  17   2.528  21.233   7.525
  138    HB   THR  17           HB       THR  17   0.634  19.003   7.045
  139    HG1  THR  17           HG1      THR  17   1.257  18.936   5.001
  140   HG21  THR  17          1HG2      THR  17  -0.925  20.776   6.709
  141   HG22  THR  17          2HG2      THR  17   0.368  21.959   6.514
  142   HG23  THR  17          3HG2      THR  17   0.074  21.227   8.090
  143    H    GLU  18           H        GLU  18   3.667  18.076   8.027
  144    HA   GLU  18           HA       GLU  18   2.302  17.686  10.556
  145    HB2  GLU  18          2HB       GLU  18   2.844  15.793   9.004
  146    HB3  GLU  18          3HB       GLU  18   4.546  16.058   9.355
  147    HG2  GLU  18          2HG       GLU  18   4.188  14.467  10.896
  148    HG3  GLU  18          3HG       GLU  18   3.604  15.828  11.854
  149    H    ARG  19           H        ARG  19   5.510  18.549   9.383
  150    HA   ARG  19           HA       ARG  19   6.759  18.515  11.944
  151    HB2  ARG  19          2HB       ARG  19   7.895  18.355   9.663
  152    HB3  ARG  19          3HB       ARG  19   7.685  20.098   9.552
  153    HG2  ARG  19          2HG       ARG  19   8.840  19.746  12.032
  154    HG3  ARG  19          3HG       ARG  19   9.648  18.549  11.017
  155    HD2  ARG  19          2HD       ARG  19  10.070  20.367   9.354
  156    HD3  ARG  19          3HD       ARG  19   9.435  21.515  10.532
  157    HE   ARG  19           HE       ARG  19  11.397  21.349  11.711
  158   HH11  ARG  19          1HH1      ARG  19  12.870  18.276   9.610
  159   HH12  ARG  19          2HH1      ARG  19  11.231  18.782   9.365
  160   HH21  ARG  19          1HH2      ARG  19  14.191  19.363  11.134
  161   HH22  ARG  19          2HH2      ARG  19  13.556  20.692  12.043
  162    H    VAL  20           H        VAL  20   5.082  20.937  10.045
  163    HA   VAL  20           HA       VAL  20   5.866  23.181  11.607
  164    HB   VAL  20           HB       VAL  20   5.041  23.485   9.340
  165   HG11  VAL  20          1HG1      VAL  20   3.306  21.563   9.705
  166   HG12  VAL  20          2HG1      VAL  20   2.243  22.887  10.187
  167   HG13  VAL  20          3HG1      VAL  20   2.960  22.871   8.575
  168   HG21  VAL  20          1HG2      VAL  20   3.294  25.242   9.819
  169   HG22  VAL  20          2HG2      VAL  20   3.366  24.735  11.507
  170   HG23  VAL  20          3HG2      VAL  20   4.801  25.396  10.722
  171    H    SER  21           H        SER  21   2.990  21.102  11.593
  172    HA   SER  21           HA       SER  21   1.509  22.453  13.533
  173    HB2  SER  21          2HB       SER  21   0.729  20.547  12.051
  174    HB3  SER  21          3HB       SER  21   1.531  19.452  13.177
  175    HG   SER  21           HG       SER  21  -0.528  19.596  13.897
  176    H    MET  22           H        MET  22   3.756  19.719  13.929
  177    HA   MET  22           HA       MET  22   3.553  19.426  16.682
  178    HB2  MET  22          2HB       MET  22   5.304  18.514  14.594
  179    HB3  MET  22          3HB       MET  22   6.254  18.951  16.008
  180    HG2  MET  22          2HG       MET  22   5.478  17.233  17.228
  181    HG3  MET  22          3HG       MET  22   3.856  17.344  16.550
  182    HE1  MET  22          1HE       MET  22   7.404  16.949  15.172
  183    HE2  MET  22          2HE       MET  22   7.413  15.498  16.174
  184    HE3  MET  22          3HE       MET  22   7.413  15.355  14.416
  185    H    ALA  23           H        ALA  23   5.621  21.587  14.793
  186    HA   ALA  23           HA       ALA  23   7.107  22.609  16.966
  187    HB1  ALA  23          1HB       ALA  23   7.035  24.637  15.082
  188    HB2  ALA  23          2HB       ALA  23   8.228  23.341  15.187
  189    HB3  ALA  23          3HB       ALA  23   6.823  23.163  14.136
  190    H    THR  24           H        THR  24   3.955  23.351  15.697
  191    HA   THR  24           HA       THR  24   3.722  25.864  17.098
  192    HB   THR  24           HB       THR  24   1.146  25.017  16.396
  193    HG1  THR  24           HG1      THR  24   2.925  24.484  14.242
  194   HG21  THR  24          1HG2      THR  24   1.367  27.172  15.812
  195   HG22  THR  24          2HG2      THR  24   2.002  26.563  14.284
  196   HG23  THR  24          3HG2      THR  24   3.108  27.018  15.580
  197    H    ALA  25           H        ALA  25   2.825  22.522  17.618
  198    HA   ALA  25           HA       ALA  25   1.142  23.109  19.888
  199    HB1  ALA  25          1HB       ALA  25   1.145  21.058  18.187
  200    HB2  ALA  25          2HB       ALA  25   2.158  20.363  19.453
  201    HB3  ALA  25          3HB       ALA  25   0.531  20.925  19.835
  202    H    SER  26           H        SER  26   4.272  21.461  19.430
  203    HA   SER  26           HA       SER  26   4.860  21.055  22.124
  204    HB2  SER  26          2HB       SER  26   6.073  20.278  19.900
  205    HB3  SER  26          3HB       SER  26   7.081  21.687  20.227
  206    HG   SER  26           HG       SER  26   6.788  19.321  21.691
  207    H    SER  27           H        SER  27   5.515  23.828  20.035
  208    HA   SER  27           HA       SER  27   7.115  25.284  21.822
  209    HB2  SER  27          2HB       SER  27   7.021  25.923  19.498
  210    HB3  SER  27          3HB       SER  27   5.286  26.220  19.601
  211    HG   SER  27           HG       SER  27   7.074  27.618  21.266
  212    H    GLN  28           H        GLN  28   3.623  25.559  21.163
  213    HA   GLN  28           HA       GLN  28   3.333  26.923  23.756
  214    HB2  GLN  28          2HB       GLN  28   2.170  27.404  21.117
  215    HB3  GLN  28          3HB       GLN  28   0.969  27.348  22.400
  216    HG2  GLN  28          2HG       GLN  28   3.435  29.051  22.563
  217    HG3  GLN  28          3HG       GLN  28   1.927  29.614  21.842
  218   HE21  GLN  28          1HE2      GLN  28   3.380  30.547  24.214
  219   HE22  GLN  28          2HE2      GLN  28   2.255  30.452  25.521
  220    H    VAL  29           H        VAL  29   0.983  25.277  21.667
  221    HA   VAL  29           HA       VAL  29   0.681  22.930  23.125
  222    HB   VAL  29           HB       VAL  29  -0.008  24.157  25.041
  223   HG11  VAL  29          1HG1      VAL  29  -1.949  25.621  23.255
  224   HG12  VAL  29          2HG1      VAL  29  -1.807  25.813  25.003
  225   HG13  VAL  29          3HG1      VAL  29  -0.473  26.290  23.952
  226   HG21  VAL  29          1HG2      VAL  29  -1.349  22.162  24.477
  227   HG22  VAL  29          2HG2      VAL  29  -2.263  23.358  25.396
  228   HG23  VAL  29          3HG2      VAL  29  -2.513  23.203  23.657
  229    H    LEU  30           H        LEU  30  -0.738  25.427  21.160
  230    HA   LEU  30           HA       LEU  30  -1.991  25.301  19.258
  231    HB2  LEU  30          2HB       LEU  30  -0.648  23.068  19.078
  232    HB3  LEU  30          3HB       LEU  30  -2.194  22.331  19.494
  233    HG   LEU  30           HG       LEU  30  -2.839  24.036  17.422
  234   HD11  LEU  30          1HD1      LEU  30  -0.863  24.554  16.469
  235   HD12  LEU  30          2HD1      LEU  30  -1.032  22.950  15.757
  236   HD13  LEU  30          3HD1      LEU  30  -0.029  23.176  17.190
  237   HD21  LEU  30          1HD2      LEU  30  -3.341  21.523  18.020
  238   HD22  LEU  30          2HD2      LEU  30  -2.068  21.221  16.836
  239   HD23  LEU  30          3HD2      LEU  30  -3.513  22.119  16.369
  240    H    ILE  31           H        ILE  31  -3.612  26.286  20.641
  241    HA   ILE  31           HA       ILE  31  -6.035  24.693  20.689
  242    HB   ILE  31           HB       ILE  31  -6.568  25.417  23.039
  243   HG12  ILE  31          2HG1      ILE  31  -3.857  25.558  23.964
  244   HG13  ILE  31          3HG1      ILE  31  -4.109  26.795  22.738
  245   HG21  ILE  31          1HG2      ILE  31  -5.325  23.592  24.078
  246   HG22  ILE  31          2HG2      ILE  31  -5.931  23.125  22.491
  247   HG23  ILE  31          3HG2      ILE  31  -4.231  23.543  22.696
  248   HD11  ILE  31          1HD1      ILE  31  -5.802  27.830  23.978
  249   HD12  ILE  31          2HD1      ILE  31  -5.985  26.438  25.047
  250   HD13  ILE  31          3HD1      ILE  31  -4.540  27.443  25.147
  251    HA   PRO  32           HA       PRO  32  -7.910  28.511  19.599
  252    HB2  PRO  32          2HB       PRO  32 -10.406  28.178  20.614
  253    HB3  PRO  32          3HB       PRO  32  -9.827  27.313  19.186
  254    HG2  PRO  32          2HG       PRO  32 -10.010  26.376  22.023
  255    HG3  PRO  32          3HG       PRO  32 -10.432  25.515  20.531
  256    HD2  PRO  32          2HD       PRO  32  -8.105  25.091  21.850
  257    HD3  PRO  32          3HD       PRO  32  -8.240  24.957  20.085
  258    H    GLU  33           H        GLU  33  -7.326  30.364  20.541
  259    HA   GLU  33           HA       GLU  33  -8.072  30.797  23.360
  260    HB2  GLU  33          2HB       GLU  33  -5.687  30.767  23.198
  261    HB3  GLU  33          3HB       GLU  33  -5.708  31.817  21.789
  262    HG2  GLU  33          2HG       GLU  33  -6.347  33.693  23.080
  263    HG3  GLU  33          3HG       GLU  33  -6.695  32.690  24.487
  264    H    ILE  34           H        ILE  34  -6.994  33.007  20.799
  265    HA   ILE  34           HA       ILE  34  -9.608  34.271  20.699
  266    HB   ILE  34           HB       ILE  34  -7.159  35.806  21.577
  267   HG12  ILE  34          2HG1      ILE  34  -9.750  35.180  23.010
  268   HG13  ILE  34          3HG1      ILE  34  -8.167  34.512  23.392
  269   HG21  ILE  34          1HG2      ILE  34  -8.521  37.106  20.039
  270   HG22  ILE  34          2HG2      ILE  34  -9.959  36.765  21.000
  271   HG23  ILE  34          3HG2      ILE  34  -8.658  37.745  21.677
  272   HD11  ILE  34          1HD1      ILE  34  -8.278  36.146  24.958
  273   HD12  ILE  34          2HD1      ILE  34  -7.558  37.072  23.640
  274   HD13  ILE  34          3HD1      ILE  34  -9.288  37.191  23.960
  275    H    ASN  35           H        ASN  35  -6.333  35.390  19.876
  276    HA   ASN  35           HA       ASN  35  -7.210  35.610  17.078
  277    HB2  ASN  35          2HB       ASN  35  -6.362  37.650  18.447
  278    HB3  ASN  35          3HB       ASN  35  -4.764  36.955  18.191
  279   HD21  ASN  35          1HD2      ASN  35  -7.101  38.977  16.958
  280   HD22  ASN  35          2HD2      ASN  35  -6.508  39.118  15.341
  281    H    LEU  36           H        LEU  36  -5.300  33.768  19.123
  282    HA   LEU  36           HA       LEU  36  -2.995  33.201  17.726
  283    HB2  LEU  36          2HB       LEU  36  -3.367  32.290  19.906
  284    HB3  LEU  36          3HB       LEU  36  -4.766  31.378  19.341
  285    HG   LEU  36           HG       LEU  36  -2.162  30.765  18.066
  286   HD11  LEU  36          1HD1      LEU  36  -1.136  30.572  20.056
  287   HD12  LEU  36          2HD1      LEU  36  -2.063  29.076  20.173
  288   HD13  LEU  36          3HD1      LEU  36  -2.653  30.542  20.956
  289   HD21  LEU  36          1HD2      LEU  36  -3.742  29.350  17.257
  290   HD22  LEU  36          2HD2      LEU  36  -4.721  29.423  18.722
  291   HD23  LEU  36          3HD2      LEU  36  -3.268  28.422  18.680
  292    H    ASN  37           H        ASN  37  -6.258  31.996  17.171
  293    HA   ASN  37           HA       ASN  37  -5.696  29.973  15.340
  294    HB2  ASN  37          2HB       ASN  37  -8.096  31.815  15.292
  295    HB3  ASN  37          3HB       ASN  37  -7.997  30.197  14.604
  296   HD21  ASN  37          1HD2      ASN  37  -9.771  31.356  16.659
  297   HD22  ASN  37          2HD2      ASN  37  -9.611  30.324  18.036
  298    H    ASP  38           H        ASP  38  -6.429  33.402  14.724
  299    HA   ASP  38           HA       ASP  38  -6.239  33.360  11.952
  300    HB2  ASP  38          2HB       ASP  38  -6.584  35.308  13.920
  301    HB3  ASP  38          3HB       ASP  38  -5.125  35.799  13.065
  302    H    THR  39           H        THR  39  -3.740  33.349  14.377
  303    HA   THR  39           HA       THR  39  -1.613  34.007  12.555
  304    HB   THR  39           HB       THR  39  -0.560  32.701  14.844
  305    HG1  THR  39           HG1      THR  39  -2.290  34.739  15.714
  306   HG21  THR  39          1HG2      THR  39   0.602  34.498  13.832
  307   HG22  THR  39          2HG2      THR  39   0.099  35.087  15.417
  308   HG23  THR  39          3HG2      THR  39  -0.788  35.574  13.972
  309    H    PHE  40           H        PHE  40  -2.530  31.054  14.334
  310    HA   PHE  40           HA       PHE  40  -0.651  29.356  13.156
  311    HB2  PHE  40          2HB       PHE  40  -2.022  28.833  15.182
  312    HB3  PHE  40          3HB       PHE  40  -3.408  28.581  14.125
  313    HD1  PHE  40           HD1      PHE  40   0.126  27.565  13.610
  314    HD2  PHE  40           HD2      PHE  40  -3.877  26.317  14.344
  315    HE1  PHE  40           HE1      PHE  40   0.802  25.221  13.292
  316    HE2  PHE  40           HE2      PHE  40  -3.207  23.971  14.028
  317    HZ   PHE  40           HZ       PHE  40  -0.865  23.420  13.502
  318    H    ASP  41           H        ASP  41  -3.930  30.208  12.158
  319    HA   ASP  41           HA       ASP  41  -4.242  28.378  10.077
  320    HB2  ASP  41          2HB       ASP  41  -5.881  30.165  11.125
  321    HB3  ASP  41          3HB       ASP  41  -5.316  31.152   9.781
  322    H    THR  42           H        THR  42  -3.334  31.814   9.736
  323    HA   THR  42           HA       THR  42  -2.626  31.738   7.060
  324    HB   THR  42           HB       THR  42  -2.715  33.719   8.860
  325    HG1  THR  42           HG1      THR  42  -1.636  34.981   7.194
  326   HG21  THR  42          1HG2      THR  42   0.243  33.429   8.374
  327   HG22  THR  42          2HG2      THR  42  -0.538  32.875   9.856
  328   HG23  THR  42          3HG2      THR  42  -0.582  34.583   9.420
  329    H    PHE  43           H        PHE  43  -0.859  30.650   9.851
  330    HA   PHE  43           HA       PHE  43   1.693  30.505   8.574
  331    HB2  PHE  43          2HB       PHE  43   1.353  30.653  11.053
  332    HB3  PHE  43          3HB       PHE  43   0.753  28.998  11.019
  333    HD1  PHE  43           HD1      PHE  43   2.348  27.825  12.240
  334    HD2  PHE  43           HD2      PHE  43   3.598  30.453   9.134
  335    HE1  PHE  43           HE1      PHE  43   4.651  26.987  12.462
  336    HE2  PHE  43           HE2      PHE  43   5.902  29.618   9.350
  337    HZ   PHE  43           HZ       PHE  43   6.431  27.883  11.015
  338    H    ALA  44           H        ALA  44  -0.543  27.946   9.663
  339    HA   ALA  44           HA       ALA  44   0.741  25.814   8.418
  340    HB1  ALA  44          1HB       ALA  44  -0.928  25.407  10.082
  341    HB2  ALA  44          2HB       ALA  44  -2.170  26.184   9.100
  342    HB3  ALA  44          3HB       ALA  44  -1.461  24.657   8.577
  343    H    LEU  45           H        LEU  45  -1.905  27.859   7.213
  344    HA   LEU  45           HA       LEU  45  -2.513  26.642   4.850
  345    HB2  LEU  45          2HB       LEU  45  -3.281  28.914   5.948
  346    HB3  LEU  45          3HB       LEU  45  -2.123  29.593   4.806
  347    HG   LEU  45           HG       LEU  45  -4.232  29.739   3.766
  348   HD11  LEU  45          1HD1      LEU  45  -2.962  27.235   2.675
  349   HD12  LEU  45          2HD1      LEU  45  -2.388  28.871   2.355
  350   HD13  LEU  45          3HD1      LEU  45  -3.989  28.375   1.806
  351   HD21  LEU  45          1HD2      LEU  45  -5.906  28.442   4.424
  352   HD22  LEU  45          2HD2      LEU  45  -4.786  27.365   5.259
  353   HD23  LEU  45          3HD2      LEU  45  -5.172  27.092   3.559
  354    H    ASP  46           H        ASP  46  -0.077  29.236   5.134
  355    HA   ASP  46           HA       ASP  46   0.970  29.144   2.605
  356    HB2  ASP  46          2HB       ASP  46   1.623  30.455   4.912
  357    HB3  ASP  46          3HB       ASP  46   3.022  29.406   4.698
  358    H    PHE  47           H        PHE  47   2.026  27.202   5.393
  359    HA   PHE  47           HA       PHE  47   4.052  25.779   4.108
  360    HB2  PHE  47          2HB       PHE  47   2.545  25.558   6.594
  361    HB3  PHE  47          3HB       PHE  47   2.998  23.986   5.944
  362    HD1  PHE  47           HD1      PHE  47   5.573  24.213   4.872
  363    HD2  PHE  47           HD2      PHE  47   3.964  26.246   8.248
  364    HE1  PHE  47           HE1      PHE  47   7.842  24.491   5.782
  365    HE2  PHE  47           HE2      PHE  47   6.230  26.527   9.163
  366    HZ   PHE  47           HZ       PHE  47   8.173  25.650   7.929
  367    H    SER  48           H        SER  48   0.752  24.618   4.817
  368    HA   SER  48           HA       SER  48   0.861  22.272   3.353
  369    HB2  SER  48          2HB       SER  48  -1.045  23.494   4.866
  370    HB3  SER  48          3HB       SER  48  -1.735  23.675   3.254
  371    HG   SER  48           HG       SER  48  -1.579  21.432   2.992
  372    H    ARG  49           H        ARG  49   0.550  25.537   2.253
  373    HA   ARG  49           HA       ARG  49  -0.632  25.168  -0.243
  374    HB2  ARG  49          2HB       ARG  49   0.027  27.349   0.976
  375    HB3  ARG  49          3HB       ARG  49   1.595  27.135   0.210
  376    HG2  ARG  49          2HG       ARG  49   0.157  28.650  -1.054
  377    HG3  ARG  49          3HG       ARG  49   0.563  27.206  -1.983
  378    HD2  ARG  49          2HD       ARG  49  -1.571  26.413  -1.941
  379    HD3  ARG  49          3HD       ARG  49  -1.922  27.133  -0.370
  380    HE   ARG  49           HE       ARG  49  -2.765  28.949  -1.458
  381   HH11  ARG  49          1HH1      ARG  49  -1.031  28.237  -4.995
  382   HH12  ARG  49          2HH1      ARG  49  -0.659  27.231  -3.634
  383   HH21  ARG  49          1HH2      ARG  49  -2.511  29.971  -4.771
  384   HH22  ARG  49          2HH2      ARG  49  -3.263  30.280  -3.242
  385    H    GLU  50           H        GLU  50   2.836  25.220   0.582
  386    HA   GLU  50           HA       GLU  50   3.735  24.568  -2.013
  387    HB2  GLU  50          2HB       GLU  50   4.925  25.296   0.377
  388    HB3  GLU  50          3HB       GLU  50   5.475  23.644   0.141
  389    HG2  GLU  50          2HG       GLU  50   5.704  25.786  -1.954
  390    HG3  GLU  50          3HG       GLU  50   6.973  25.414  -0.788
  391    H    LYS  51           H        LYS  51   2.746  22.628   0.729
  392    HA   LYS  51           HA       LYS  51   3.776  20.150  -0.087
  393    HB2  LYS  51          2HB       LYS  51   3.031  19.984   2.058
  394    HB3  LYS  51          3HB       LYS  51   1.682  21.079   1.787
  395    HG2  LYS  51          2HG       LYS  51   1.450  18.519   0.389
  396    HG3  LYS  51          3HG       LYS  51   1.471  18.395   2.149
  397    HD2  LYS  51          2HD       LYS  51  -0.490  19.562   2.390
  398    HD3  LYS  51          3HD       LYS  51  -0.261  20.465   0.890
  399    HE2  LYS  51          2HE       LYS  51  -2.109  18.776   0.833
  400    HE3  LYS  51          3HE       LYS  51  -0.893  18.585  -0.428
  401    HZ1  LYS  51          1HZ       LYS  51  -0.115  16.668   0.480
  402    HZ2  LYS  51          2HZ       LYS  51  -1.723  16.558   0.992
  403    HZ3  LYS  51          3HZ       LYS  51  -0.530  17.095   2.064
  404    H    LYS  52           H        LYS  52   0.600  21.633  -0.671
  405    HA   LYS  52           HA       LYS  52  -0.553  19.540  -2.107
  406    HB2  LYS  52          2HB       LYS  52  -1.896  21.387  -1.340
  407    HB3  LYS  52          3HB       LYS  52  -0.977  22.524  -2.318
  408    HG2  LYS  52          2HG       LYS  52  -3.046  22.145  -3.413
  409    HG3  LYS  52          3HG       LYS  52  -1.797  21.317  -4.347
  410    HD2  LYS  52          2HD       LYS  52  -3.408  19.685  -4.262
  411    HD3  LYS  52          3HD       LYS  52  -2.468  19.280  -2.824
  412    HE2  LYS  52          2HE       LYS  52  -4.081  20.061  -1.385
  413    HE3  LYS  52          3HE       LYS  52  -4.743  21.187  -2.569
  414    HZ1  LYS  52          1HZ       LYS  52  -6.348  19.650  -2.732
  415    HZ2  LYS  52          2HZ       LYS  52  -5.391  18.406  -2.103
  416    HZ3  LYS  52          3HZ       LYS  52  -5.253  18.836  -3.733
  417    H    LEU  53           H        LEU  53   1.160  22.405  -3.357
  418    HA   LEU  53           HA       LEU  53   1.041  21.820  -6.056
  419    HB2  LEU  53          2HB       LEU  53   2.404  23.647  -4.398
  420    HB3  LEU  53          3HB       LEU  53   3.619  22.900  -5.433
  421    HG   LEU  53           HG       LEU  53   1.859  23.518  -7.318
  422   HD11  LEU  53          1HD1      LEU  53   0.152  24.410  -5.903
  423   HD12  LEU  53          2HD1      LEU  53   0.877  25.746  -6.796
  424   HD13  LEU  53          3HD1      LEU  53   1.302  25.484  -5.105
  425   HD21  LEU  53          1HD2      LEU  53   3.913  25.279  -6.012
  426   HD22  LEU  53          2HD2      LEU  53   3.067  25.756  -7.485
  427   HD23  LEU  53          3HD2      LEU  53   4.066  24.302  -7.473
  428    H    LEU  54           H        LEU  54   3.029  20.409  -3.575
  429    HA   LEU  54           HA       LEU  54   4.870  19.148  -5.382
  430    HB2  LEU  54          2HB       LEU  54   5.785  19.524  -3.290
  431    HB3  LEU  54          3HB       LEU  54   4.327  19.002  -2.448
  432    HG   LEU  54           HG       LEU  54   5.849  16.963  -3.986
  433   HD11  LEU  54          1HD1      LEU  54   7.165  16.624  -1.784
  434   HD12  LEU  54          2HD1      LEU  54   6.818  18.331  -1.509
  435   HD13  LEU  54          3HD1      LEU  54   7.720  17.834  -2.941
  436   HD21  LEU  54          1HD2      LEU  54   3.745  17.053  -2.077
  437   HD22  LEU  54          2HD2      LEU  54   5.107  16.190  -1.361
  438   HD23  LEU  54          3HD2      LEU  54   4.431  15.651  -2.899
  439    H    GLU  55           H        GLU  55   2.142  18.027  -3.391
  440    HA   GLU  55           HA       GLU  55   2.236  15.339  -4.206
  441    HB2  GLU  55          2HB       GLU  55   0.994  16.063  -2.231
  442    HB3  GLU  55          3HB       GLU  55  -0.116  16.976  -3.243
  443    HG2  GLU  55          2HG       GLU  55  -0.844  14.880  -4.300
  444    HG3  GLU  55          3HG       GLU  55   0.227  13.987  -3.222
  445    H    CYS  56           H        CYS  56   0.415  18.107  -5.463
  446    HA   CYS  56           HA       CYS  56  -0.617  18.475  -7.455
  447    HB2  CYS  56          2HB       CYS  56   1.703  17.264  -8.120
  448    HB3  CYS  56          3HB       CYS  56   0.560  16.098  -8.776
  449    HG   CYS  56           HG       CYS  56   0.636  17.383 -11.015
  450    H    LEU  57           H        LEU  57  -2.201  17.548  -9.005
  451    HA   LEU  57           HA       LEU  57  -4.103  16.383  -9.442
  452    HB2  LEU  57          2HB       LEU  57  -2.995  14.065  -7.904
  453    HB3  LEU  57          3HB       LEU  57  -4.052  14.054  -9.314
  454    HG   LEU  57           HG       LEU  57  -1.165  14.911  -9.406
  455   HD11  LEU  57          1HD1      LEU  57  -1.918  12.337 -10.589
  456   HD12  LEU  57          2HD1      LEU  57  -1.957  12.381  -8.827
  457   HD13  LEU  57          3HD1      LEU  57  -0.475  12.797  -9.686
  458   HD21  LEU  57          1HD2      LEU  57  -3.367  14.884 -11.289
  459   HD22  LEU  57          2HD2      LEU  57  -1.990  13.946 -11.868
  460   HD23  LEU  57          3HD2      LEU  57  -1.779  15.639 -11.419
  461    H    ASP  58           H        ASP  58  -6.012  15.333  -8.410
  462    HA   ASP  58           HA       ASP  58  -6.266  15.179  -5.599
  463    HB2  ASP  58          2HB       ASP  58  -7.421  17.148  -5.041
  464    HB3  ASP  58          3HB       ASP  58  -6.082  17.707  -6.040
  465    H    TYR  59           H        TYR  59  -8.894  15.628  -5.177
  466    HA   TYR  59           HA       TYR  59 -10.344  14.241  -7.314
  467    HB2  TYR  59          2HB       TYR  59  -9.476  12.655  -5.478
  468    HB3  TYR  59          3HB       TYR  59 -10.681  13.410  -4.440
  469    HD1  TYR  59           HD1      TYR  59 -10.129  11.179  -7.280
  470    HD2  TYR  59           HD2      TYR  59 -13.064  13.067  -4.847
  471    HE1  TYR  59           HE1      TYR  59 -11.837   9.644  -8.161
  472    HE2  TYR  59           HE2      TYR  59 -14.780  11.537  -5.720
  473    HH   TYR  59           HH       TYR  59 -15.242  10.010  -7.323
  474    H    LEU  60           H        LEU  60 -12.545  14.671  -7.407
  475    HA   LEU  60           HA       LEU  60 -14.438  15.910  -7.193
  476    HB2  LEU  60          2HB       LEU  60 -14.035  14.870  -4.787
  477    HB3  LEU  60          3HB       LEU  60 -13.822  16.568  -4.362
  478    HG   LEU  60           HG       LEU  60 -16.278  15.626  -5.806
  479   HD11  LEU  60          1HD1      LEU  60 -16.387  14.228  -3.953
  480   HD12  LEU  60          2HD1      LEU  60 -17.290  15.653  -3.440
  481   HD13  LEU  60          3HD1      LEU  60 -15.632  15.416  -2.889
  482   HD21  LEU  60          1HD2      LEU  60 -17.001  17.714  -5.509
  483   HD22  LEU  60          2HD2      LEU  60 -15.331  18.119  -5.108
  484   HD23  LEU  60          3HD2      LEU  60 -16.481  17.743  -3.824
  Start of MODEL   17
    1    H    LEU   1           H        LEU   1  10.994   0.594   1.381
    2    HA   LEU   1           HA       LEU   1   9.261   2.511   0.793
    3    HB2  LEU   1          2HB       LEU   1  10.442   3.248   3.467
    4    HB3  LEU   1          3HB       LEU   1   9.449   4.295   2.456
    5    HG   LEU   1           HG       LEU   1   7.715   2.309   2.747
    6   HD11  LEU   1          1HD1      LEU   1   9.711   1.932   4.916
    7   HD12  LEU   1          2HD1      LEU   1   8.748   0.741   4.043
    8   HD13  LEU   1          3HD1      LEU   1   8.002   1.725   5.302
    9   HD21  LEU   1          1HD2      LEU   1   8.268   4.404   4.846
   10   HD22  LEU   1          2HD2      LEU   1   6.743   3.549   4.617
   11   HD23  LEU   1          3HD2      LEU   1   7.340   4.639   3.364
   12    H    LYS   2           H        LYS   2  11.442   1.637  -0.423
   13    HA   LYS   2           HA       LYS   2  13.186   4.002  -0.487
   14    HB2  LYS   2          2HB       LYS   2  13.934   1.210   0.011
   15    HB3  LYS   2          3HB       LYS   2  14.865   1.973  -1.271
   16    HG2  LYS   2          2HG       LYS   2  15.250   3.878   0.386
   17    HG3  LYS   2          3HG       LYS   2  14.662   2.755   1.615
   18    HD2  LYS   2          2HD       LYS   2  16.534   1.495   1.541
   19    HD3  LYS   2          3HD       LYS   2  16.714   1.680  -0.205
   20    HE2  LYS   2          2HE       LYS   2  18.352   3.131   0.179
   21    HE3  LYS   2          3HE       LYS   2  17.158   4.223   0.880
   22    HZ1  LYS   2          1HZ       LYS   2  19.184   2.650   2.175
   23    HZ2  LYS   2          2HZ       LYS   2  17.662   2.490   2.895
   24    HZ3  LYS   2          3HZ       LYS   2  18.362   4.021   2.729
   25    H    GLU   3           H        GLU   3  13.475   4.833  -2.463
   26    HA   GLU   3           HA       GLU   3  13.271   5.154  -4.706
   27    HB2  GLU   3          2HB       GLU   3  13.688   2.171  -4.924
   28    HB3  GLU   3          3HB       GLU   3  14.012   3.382  -6.157
   29    HG2  GLU   3          2HG       GLU   3  15.693   4.367  -4.530
   30    HG3  GLU   3          3HG       GLU   3  15.506   2.877  -3.607
   31    H    ASN   4           H        ASN   4  11.049   5.713  -4.511
   32    HA   ASN   4           HA       ASN   4   9.316   3.916  -5.990
   33    HB2  ASN   4          2HB       ASN   4   8.445   4.968  -3.291
   34    HB3  ASN   4          3HB       ASN   4   7.527   3.916  -4.364
   35   HD21  ASN   4          1HD2      ASN   4   9.974   4.117  -1.971
   36   HD22  ASN   4          2HD2      ASN   4  10.270   2.422  -1.814
   37    H    ASP   5           H        ASP   5   6.951   5.150  -5.857
   38    HA   ASP   5           HA       ASP   5   7.540   7.918  -6.680
   39    HB2  ASP   5          2HB       ASP   5   5.558   5.927  -7.780
   40    HB3  ASP   5          3HB       ASP   5   5.468   7.650  -8.136
   41    H    HIS   6           H        HIS   6   4.612   6.053  -5.866
   42    HA   HIS   6           HA       HIS   6   3.297   8.266  -4.698
   43    HB2  HIS   6          2HB       HIS   6   2.253   6.129  -5.641
   44    HB3  HIS   6          3HB       HIS   6   2.665   5.378  -4.102
   45    HD1  HIS   6           HD1      HIS   6   0.150   5.043  -3.561
   46    HD2  HIS   6           HD2      HIS   6   1.290   9.012  -4.017
   47    HE1  HIS   6           HE1      HIS   6  -1.763   6.400  -2.654
   48    H    ALA   7           H        ALA   7   5.524   5.919  -3.464
   49    HA   ALA   7           HA       ALA   7   4.907   6.151  -0.711
   50    HB1  ALA   7          1HB       ALA   7   7.704   5.587  -1.487
   51    HB2  ALA   7          2HB       ALA   7   6.641   4.737  -0.365
   52    HB3  ALA   7          3HB       ALA   7   6.471   4.487  -2.103
   53    H    ARG   8           H        ARG   8   7.278   7.796  -2.781
   54    HA   ARG   8           HA       ARG   8   8.293   9.421  -0.652
   55    HB2  ARG   8          2HB       ARG   8   9.489  10.622  -2.455
   56    HB3  ARG   8          3HB       ARG   8   9.723   8.880  -2.529
   57    HG2  ARG   8          2HG       ARG   8   8.217   8.679  -4.365
   58    HG3  ARG   8          3HG       ARG   8   7.711  10.362  -4.202
   59    HD2  ARG   8          2HD       ARG   8  10.468  10.499  -4.462
   60    HD3  ARG   8          3HD       ARG   8   9.992   9.232  -5.591
   61    HE   ARG   8           HE       ARG   8   8.994  10.823  -6.906
   62   HH11  ARG   8          1HH1      ARG   8   9.262  13.796  -4.238
   63   HH12  ARG   8          2HH1      ARG   8   9.669  12.178  -3.771
   64   HH21  ARG   8          1HH2      ARG   8   8.570  14.233  -6.378
   65   HH22  ARG   8          2HH2      ARG   8   8.455  12.948  -7.533
   66    H    PHE   9           H        PHE   9   5.762   9.708  -3.027
   67    HA   PHE   9           HA       PHE   9   5.411  12.526  -2.809
   68    HB2  PHE   9          2HB       PHE   9   3.936  10.267  -4.048
   69    HB3  PHE   9          3HB       PHE   9   3.003  11.716  -3.686
   70    HD1  PHE   9           HD1      PHE   9   4.574  13.937  -4.312
   71    HD2  PHE   9           HD2      PHE   9   4.537  10.147  -6.249
   72    HE1  PHE   9           HE1      PHE   9   5.403  14.988  -6.377
   73    HE2  PHE   9           HE2      PHE   9   5.366  11.191  -8.316
   74    HZ   PHE   9           HZ       PHE   9   5.801  13.614  -8.382
   75    H    LEU  10           H        LEU  10   3.955   9.728  -1.228
   76    HA   LEU  10           HA       LEU  10   2.035  11.261   0.239
   77    HB2  LEU  10          2HB       LEU  10   2.285   8.636  -0.371
   78    HB3  LEU  10          3HB       LEU  10   2.848   8.637   1.299
   79    HG   LEU  10           HG       LEU  10   0.276  10.004   0.724
   80   HD11  LEU  10          1HD1      LEU  10  -0.734   7.613   1.138
   81   HD12  LEU  10          2HD1      LEU  10   0.761   7.091   0.364
   82   HD13  LEU  10          3HD1      LEU  10  -0.343   8.168  -0.490
   83   HD21  LEU  10          1HD2      LEU  10  -0.087   9.690   2.924
   84   HD22  LEU  10          2HD2      LEU  10   1.663   9.473   2.979
   85   HD23  LEU  10          3HD2      LEU  10   0.601   8.065   2.915
   86    H    GLN  11           H        GLN  11   5.064   9.611   1.130
   87    HA   GLN  11           HA       GLN  11   5.156  10.287   3.806
   88    HB2  GLN  11          2HB       GLN  11   6.735   8.764   2.573
   89    HB3  GLN  11          3HB       GLN  11   7.555  10.200   1.974
   90    HG2  GLN  11          2HG       GLN  11   8.447  10.717   4.019
   91    HG3  GLN  11          3HG       GLN  11   7.172   9.882   4.907
   92   HE21  GLN  11          1HE2      GLN  11   9.981   9.362   2.841
   93   HE22  GLN  11          2HE2      GLN  11  10.410   7.825   3.503
   94    H    THR  12           H        THR  12   5.787  12.262   1.010
   95    HA   THR  12           HA       THR  12   7.086  14.379   2.446
   96    HB   THR  12           HB       THR  12   5.857  14.337  -0.316
   97    HG1  THR  12           HG1      THR  12   7.927  13.115   0.413
   98   HG21  THR  12          1HG2      THR  12   7.363  16.382  -0.611
   99   HG22  THR  12          2HG2      THR  12   7.411  16.453   1.150
  100   HG23  THR  12          3HG2      THR  12   5.873  16.607   0.302
  101    H    ALA  13           H        ALA  13   3.899  14.114   0.861
  102    HA   ALA  13           HA       ALA  13   2.813  16.517   1.648
  103    HB1  ALA  13          1HB       ALA  13   1.284  15.574   0.319
  104    HB2  ALA  13          2HB       ALA  13   1.772  13.939   0.765
  105    HB3  ALA  13          3HB       ALA  13   0.653  14.837   1.791
  106    H    LYS  14           H        LYS  14   2.841  13.456   3.442
  107    HA   LYS  14           HA       LYS  14   1.375  14.455   5.666
  108    HB2  LYS  14          2HB       LYS  14   2.999  12.004   5.117
  109    HB3  LYS  14          3HB       LYS  14   2.548  12.373   6.777
  110    HG2  LYS  14          2HG       LYS  14   0.546  12.199   4.543
  111    HG3  LYS  14          3HG       LYS  14   1.018  10.812   5.528
  112    HD2  LYS  14          2HD       LYS  14   0.153  11.795   7.497
  113    HD3  LYS  14          3HD       LYS  14  -0.000  13.376   6.729
  114    HE2  LYS  14          2HE       LYS  14  -1.668  12.305   5.159
  115    HE3  LYS  14          3HE       LYS  14  -1.637  10.901   6.224
  116    HZ1  LYS  14          1HZ       LYS  14  -3.467  12.452   6.708
  117    HZ2  LYS  14          2HZ       LYS  14  -2.338  13.651   7.094
  118    HZ3  LYS  14          3HZ       LYS  14  -2.428  12.243   8.027
  119    H    ASN  15           H        ASN  15   4.836  13.933   5.065
  120    HA   ASN  15           HA       ASN  15   5.785  14.701   7.575
  121    HB2  ASN  15          2HB       ASN  15   7.244  13.607   5.991
  122    HB3  ASN  15          3HB       ASN  15   7.073  14.938   4.849
  123   HD21  ASN  15          1HD2      ASN  15   7.686  14.857   8.338
  124   HD22  ASN  15          2HD2      ASN  15   9.159  15.759   8.273
  125    H    ILE  16           H        ILE  16   4.462  16.577   5.019
  126    HA   ILE  16           HA       ILE  16   5.675  19.069   5.727
  127    HB   ILE  16           HB       ILE  16   3.255  18.422   4.048
  128   HG12  ILE  16          2HG1      ILE  16   5.755  19.670   3.005
  129   HG13  ILE  16          3HG1      ILE  16   5.797  17.958   3.413
  130   HG21  ILE  16          1HG2      ILE  16   2.857  20.594   4.929
  131   HG22  ILE  16          2HG2      ILE  16   4.528  21.081   4.650
  132   HG23  ILE  16          3HG2      ILE  16   3.450  20.805   3.282
  133   HD11  ILE  16          1HD1      ILE  16   4.603  17.386   1.617
  134   HD12  ILE  16          2HD1      ILE  16   3.494  18.746   1.798
  135   HD13  ILE  16          3HD1      ILE  16   5.054  18.980   1.011
  136    H    THR  17           H        THR  17   2.402  17.732   6.178
  137    HA   THR  17           HA       THR  17   1.607  19.896   7.893
  138    HB   THR  17           HB       THR  17   0.066  17.353   7.894
  139    HG1  THR  17           HG1      THR  17  -0.821  18.183   5.781
  140   HG21  THR  17          1HG2      THR  17  -1.577  19.456   7.202
  141   HG22  THR  17          2HG2      THR  17  -0.381  20.212   8.255
  142   HG23  THR  17          3HG2      THR  17  -1.324  18.838   8.833
  143    H    GLU  18           H        GLU  18   3.165  16.861   8.314
  144    HA   GLU  18           HA       GLU  18   2.434  16.512  11.073
  145    HB2  GLU  18          2HB       GLU  18   4.395  15.168   9.234
  146    HB3  GLU  18          3HB       GLU  18   4.386  14.820  10.957
  147    HG2  GLU  18          2HG       GLU  18   1.755  14.671   9.689
  148    HG3  GLU  18          3HG       GLU  18   2.926  13.503   9.080
  149    H    ARG  19           H        ARG  19   5.190  17.812   9.302
  150    HA   ARG  19           HA       ARG  19   6.856  18.183  11.573
  151    HB2  ARG  19          2HB       ARG  19   7.589  18.100   9.145
  152    HB3  ARG  19          3HB       ARG  19   6.982  19.743   8.994
  153    HG2  ARG  19          2HG       ARG  19   8.626  19.784  11.243
  154    HG3  ARG  19          3HG       ARG  19   9.484  18.801  10.055
  155    HD2  ARG  19          2HD       ARG  19   9.166  20.605   8.393
  156    HD3  ARG  19          3HD       ARG  19   8.408  21.588   9.645
  157    HE   ARG  19           HE       ARG  19  10.964  20.727  10.490
  158   HH11  ARG  19          1HH1      ARG  19  10.719  24.092   8.334
  159   HH12  ARG  19          2HH1      ARG  19   9.410  22.956   8.312
  160   HH21  ARG  19          1HH2      ARG  19  12.585  23.669   9.593
  161   HH22  ARG  19          2HH2      ARG  19  12.692  22.215  10.526
  162    H    VAL  20           H        VAL  20   4.744  20.372   9.736
  163    HA   VAL  20           HA       VAL  20   5.251  22.730  11.099
  164    HB   VAL  20           HB       VAL  20   3.906  22.759   9.107
  165   HG11  VAL  20          1HG1      VAL  20   1.705  21.377  10.626
  166   HG12  VAL  20          2HG1      VAL  20   1.753  21.772   8.907
  167   HG13  VAL  20          3HG1      VAL  20   2.826  20.533   9.559
  168   HG21  VAL  20          1HG2      VAL  20   2.874  24.597   9.812
  169   HG22  VAL  20          2HG2      VAL  20   1.714  23.647  10.741
  170   HG23  VAL  20          3HG2      VAL  20   3.250  24.119  11.468
  171    H    SER  21           H        SER  21   2.896  20.186  11.863
  172    HA   SER  21           HA       SER  21   1.776  21.480  14.111
  173    HB2  SER  21          2HB       SER  21   1.293  19.121  12.695
  174    HB3  SER  21          3HB       SER  21   1.720  18.583  14.319
  175    HG   SER  21           HG       SER  21  -0.209  19.162  14.877
  176    H    MET  22           H        MET  22   4.503  19.292  13.712
  177    HA   MET  22           HA       MET  22   4.987  18.660  16.381
  178    HB2  MET  22          2HB       MET  22   6.125  17.846  14.161
  179    HB3  MET  22          3HB       MET  22   7.265  19.142  14.500
  180    HG2  MET  22          2HG       MET  22   7.852  18.158  16.602
  181    HG3  MET  22          3HG       MET  22   6.590  16.940  16.433
  182    HE1  MET  22          1HE       MET  22   8.985  18.094  13.405
  183    HE2  MET  22          2HE       MET  22   9.796  18.431  14.934
  184    HE3  MET  22          3HE       MET  22  10.410  17.165  13.871
  185    H    ALA  23           H        ALA  23   6.052  21.441  14.469
  186    HA   ALA  23           HA       ALA  23   7.680  22.578  16.497
  187    HB1  ALA  23          1HB       ALA  23   7.710  24.567  15.107
  188    HB2  ALA  23          2HB       ALA  23   7.930  23.125  14.115
  189    HB3  ALA  23          3HB       ALA  23   6.367  23.942  14.149
  190    H    THR  24           H        THR  24   4.432  23.464  15.316
  191    HA   THR  24           HA       THR  24   3.887  25.487  17.129
  192    HB   THR  24           HB       THR  24   1.433  24.204  16.774
  193    HG1  THR  24           HG1      THR  24   2.684  24.133  14.258
  194   HG21  THR  24          1HG2      THR  24   1.149  26.359  16.242
  195   HG22  THR  24          2HG2      THR  24   1.693  25.925  14.621
  196   HG23  THR  24          3HG2      THR  24   2.845  26.551  15.800
  197    H    ALA  25           H        ALA  25   3.254  22.005  17.435
  198    HA   ALA  25           HA       ALA  25   2.016  22.145  19.971
  199    HB1  ALA  25          1HB       ALA  25   3.517  19.791  18.840
  200    HB2  ALA  25          2HB       ALA  25   2.228  19.769  20.044
  201    HB3  ALA  25          3HB       ALA  25   1.870  20.224  18.378
  202    H    SER  26           H        SER  26   5.303  22.321  18.981
  203    HA   SER  26           HA       SER  26   6.283  21.712  21.671
  204    HB2  SER  26          2HB       SER  26   7.750  22.201  19.070
  205    HB3  SER  26          3HB       SER  26   8.542  21.881  20.613
  206    HG   SER  26           HG       SER  26   8.085  19.838  20.409
  207    H    SER  27           H        SER  27   5.216  24.334  19.936
  208    HA   SER  27           HA       SER  27   6.951  26.203  21.408
  209    HB2  SER  27          2HB       SER  27   6.970  26.399  18.916
  210    HB3  SER  27          3HB       SER  27   5.251  26.788  18.973
  211    HG   SER  27           HG       SER  27   5.991  28.756  19.160
  212    H    GLN  28           H        GLN  28   3.971  24.803  21.525
  213    HA   GLN  28           HA       GLN  28   2.084  25.214  22.727
  214    HB2  GLN  28          2HB       GLN  28   3.957  26.090  24.336
  215    HB3  GLN  28          3HB       GLN  28   3.314  27.672  23.916
  216    HG2  GLN  28          2HG       GLN  28   1.695  27.428  25.395
  217    HG3  GLN  28          3HG       GLN  28   1.137  25.972  24.572
  218   HE21  GLN  28          1HE2      GLN  28   1.514  26.858  27.473
  219   HE22  GLN  28          2HE2      GLN  28   2.325  25.518  28.202
  220    H    VAL  29           H        VAL  29   1.709  25.938  20.282
  221    HA   VAL  29           HA       VAL  29   0.444  28.595  20.426
  222    HB   VAL  29           HB       VAL  29   1.538  27.463  17.863
  223   HG11  VAL  29          1HG1      VAL  29  -0.190  29.457  18.200
  224   HG12  VAL  29          2HG1      VAL  29   1.307  30.364  18.429
  225   HG13  VAL  29          3HG1      VAL  29   1.034  29.474  16.931
  226   HG21  VAL  29          1HG2      VAL  29   3.454  27.614  19.278
  227   HG22  VAL  29          2HG2      VAL  29   3.477  29.013  18.204
  228   HG23  VAL  29          3HG2      VAL  29   2.957  29.196  19.879
  229    H    LEU  30           H        LEU  30  -0.831  26.170  21.072
  230    HA   LEU  30           HA       LEU  30  -2.783  26.007  18.877
  231    HB2  LEU  30          2HB       LEU  30  -1.776  23.736  20.583
  232    HB3  LEU  30          3HB       LEU  30  -3.129  23.626  19.459
  233    HG   LEU  30           HG       LEU  30  -1.313  24.413  17.719
  234   HD11  LEU  30          1HD1      LEU  30   0.677  24.686  18.720
  235   HD12  LEU  30          2HD1      LEU  30   0.774  22.929  18.605
  236   HD13  LEU  30          3HD1      LEU  30   0.236  23.686  20.104
  237   HD21  LEU  30          1HD2      LEU  30  -2.512  22.354  17.504
  238   HD22  LEU  30          2HD2      LEU  30  -1.601  21.625  18.826
  239   HD23  LEU  30          3HD2      LEU  30  -0.794  22.009  17.306
  240    H    ILE  31           H        ILE  31  -2.903  27.718  21.132
  241    HA   ILE  31           HA       ILE  31  -5.385  26.735  22.319
  242    HB   ILE  31           HB       ILE  31  -4.739  27.455  24.568
  243   HG12  ILE  31          2HG1      ILE  31  -2.080  27.633  24.769
  244   HG13  ILE  31          3HG1      ILE  31  -2.257  28.260  23.133
  245   HG21  ILE  31          1HG2      ILE  31  -4.227  25.106  23.483
  246   HG22  ILE  31          2HG2      ILE  31  -2.559  25.588  23.792
  247   HG23  ILE  31          3HG2      ILE  31  -3.710  25.491  25.125
  248   HD11  ILE  31          1HD1      ILE  31  -4.046  29.393  25.189
  249   HD12  ILE  31          2HD1      ILE  31  -2.334  29.803  25.297
  250   HD13  ILE  31          3HD1      ILE  31  -3.237  30.169  23.828
  251    HA   PRO  32           HA       PRO  32  -6.786  30.843  21.649
  252    HB2  PRO  32          2HB       PRO  32  -8.641  31.074  23.617
  253    HB3  PRO  32          3HB       PRO  32  -8.887  30.078  22.178
  254    HG2  PRO  32          2HG       PRO  32  -8.038  29.256  24.928
  255    HG3  PRO  32          3HG       PRO  32  -9.198  28.478  23.836
  256    HD2  PRO  32          2HD       PRO  32  -6.658  27.589  24.136
  257    HD3  PRO  32          3HD       PRO  32  -7.542  27.454  22.603
  258    H    GLU  33           H        GLU  33  -6.755  32.978  22.490
  259    HA   GLU  33           HA       GLU  33  -6.041  33.637  25.133
  260    HB2  GLU  33          2HB       GLU  33  -3.755  34.134  25.011
  261    HB3  GLU  33          3HB       GLU  33  -3.892  32.570  24.221
  262    HG2  GLU  33          2HG       GLU  33  -4.022  33.876  22.036
  263    HG3  GLU  33          3HG       GLU  33  -3.465  35.261  22.974
  264    H    ILE  34           H        ILE  34  -6.029  34.500  21.734
  265    HA   ILE  34           HA       ILE  34  -7.446  36.907  22.187
  266    HB   ILE  34           HB       ILE  34  -5.286  37.742  22.951
  267   HG12  ILE  34          2HG1      ILE  34  -5.462  39.012  20.277
  268   HG13  ILE  34          3HG1      ILE  34  -6.945  38.978  21.224
  269   HG21  ILE  34          1HG2      ILE  34  -4.024  37.548  20.292
  270   HG22  ILE  34          2HG2      ILE  34  -3.311  37.431  21.901
  271   HG23  ILE  34          3HG2      ILE  34  -4.151  36.045  21.206
  272   HD11  ILE  34          1HD1      ILE  34  -5.825  41.041  21.632
  273   HD12  ILE  34          2HD1      ILE  34  -5.700  40.050  23.086
  274   HD13  ILE  34          3HD1      ILE  34  -4.316  40.207  22.005
  275    H    ASN  35           H        ASN  35  -5.358  35.041  20.052
  276    HA   ASN  35           HA       ASN  35  -7.222  34.907  17.974
  277    HB2  ASN  35          2HB       ASN  35  -6.147  37.413  18.013
  278    HB3  ASN  35          3HB       ASN  35  -5.044  36.588  16.915
  279   HD21  ASN  35          1HD2      ASN  35  -5.585  36.721  14.873
  280   HD22  ASN  35          2HD2      ASN  35  -7.189  36.867  14.245
  281    H    LEU  36           H        LEU  36  -5.344  33.260  19.393
  282    HA   LEU  36           HA       LEU  36  -3.113  32.648  17.733
  283    HB2  LEU  36          2HB       LEU  36  -3.089  32.110  20.087
  284    HB3  LEU  36          3HB       LEU  36  -4.488  31.055  19.891
  285    HG   LEU  36           HG       LEU  36  -2.047  30.406  18.328
  286   HD11  LEU  36          1HD1      LEU  36  -1.553  29.005  20.572
  287   HD12  LEU  36          2HD1      LEU  36  -2.166  30.504  21.269
  288   HD13  LEU  36          3HD1      LEU  36  -0.777  30.540  20.182
  289   HD21  LEU  36          1HD2      LEU  36  -2.855  28.097  19.221
  290   HD22  LEU  36          2HD2      LEU  36  -3.750  28.902  17.932
  291   HD23  LEU  36          3HD2      LEU  36  -4.342  28.971  19.593
  292    H    ASN  37           H        ASN  37  -6.382  31.363  18.046
  293    HA   ASN  37           HA       ASN  37  -6.128  29.090  16.455
  294    HB2  ASN  37          2HB       ASN  37  -8.138  29.999  17.879
  295    HB3  ASN  37          3HB       ASN  37  -8.628  30.739  16.358
  296   HD21  ASN  37          1HD2      ASN  37  -9.314  28.265  18.212
  297   HD22  ASN  37          2HD2      ASN  37  -9.694  27.052  17.042
  298    H    ASP  38           H        ASP  38  -7.072  32.390  15.520
  299    HA   ASP  38           HA       ASP  38  -7.464  31.922  12.801
  300    HB2  ASP  38          2HB       ASP  38  -6.742  34.342  14.410
  301    HB3  ASP  38          3HB       ASP  38  -6.710  34.435  12.652
  302    H    THR  39           H        THR  39  -4.531  32.319  14.636
  303    HA   THR  39           HA       THR  39  -2.852  32.707  12.326
  304    HB   THR  39           HB       THR  39  -1.307  31.833  14.550
  305    HG1  THR  39           HG1      THR  39  -2.901  34.002  15.361
  306   HG21  THR  39          1HG2      THR  39  -0.865  33.569  12.705
  307   HG22  THR  39          2HG2      THR  39  -0.265  33.921  14.326
  308   HG23  THR  39          3HG2      THR  39  -1.739  34.694  13.743
  309    H    PHE  40           H        PHE  40  -3.316  30.083  14.693
  310    HA   PHE  40           HA       PHE  40  -1.589  28.235  13.504
  311    HB2  PHE  40          2HB       PHE  40  -2.657  28.083  15.796
  312    HB3  PHE  40          3HB       PHE  40  -4.122  27.531  14.990
  313    HD1  PHE  40           HD1      PHE  40  -0.571  26.702  14.272
  314    HD2  PHE  40           HD2      PHE  40  -4.361  25.317  15.628
  315    HE1  PHE  40           HE1      PHE  40   0.287  24.396  14.304
  316    HE2  PHE  40           HE2      PHE  40  -3.509  23.010  15.664
  317    HZ   PHE  40           HZ       PHE  40  -1.182  22.546  15.002
  318    H    ASP  41           H        ASP  41  -5.052  28.792  13.006
  319    HA   ASP  41           HA       ASP  41  -5.568  26.664  11.278
  320    HB2  ASP  41          2HB       ASP  41  -7.113  28.554  12.368
  321    HB3  ASP  41          3HB       ASP  41  -6.937  29.255  10.762
  322    H    THR  42           H        THR  42  -4.966  30.061  10.362
  323    HA   THR  42           HA       THR  42  -4.747  29.625   7.617
  324    HB   THR  42           HB       THR  42  -4.773  31.851   9.084
  325    HG1  THR  42           HG1      THR  42  -4.799  32.710   7.142
  326   HG21  THR  42          1HG2      THR  42  -1.922  31.879   8.168
  327   HG22  THR  42          2HG2      THR  42  -2.335  31.248   9.762
  328   HG23  THR  42          3HG2      THR  42  -2.727  32.915   9.344
  329    H    PHE  43           H        PHE  43  -2.534  28.936  10.161
  330    HA   PHE  43           HA       PHE  43  -0.159  28.911   8.563
  331    HB2  PHE  43          2HB       PHE  43  -0.219  29.207  11.066
  332    HB3  PHE  43          3HB       PHE  43  -0.616  27.496  11.193
  333    HD1  PHE  43           HD1      PHE  43   1.278  26.707  12.334
  334    HD2  PHE  43           HD2      PHE  43   1.745  29.021   8.792
  335    HE1  PHE  43           HE1      PHE  43   3.674  26.150  12.289
  336    HE2  PHE  43           HE2      PHE  43   4.141  28.467   8.741
  337    HZ   PHE  43           HZ       PHE  43   5.109  27.028  10.490
  338    H    ALA  44           H        ALA  44  -2.204  26.346   9.953
  339    HA   ALA  44           HA       ALA  44  -0.837  24.227   8.652
  340    HB1  ALA  44          1HB       ALA  44  -3.471  23.400   9.217
  341    HB2  ALA  44          2HB       ALA  44  -2.007  23.085  10.150
  342    HB3  ALA  44          3HB       ALA  44  -2.991  24.504  10.506
  343    H    LEU  45           H        LEU  45  -3.888  25.913   7.954
  344    HA   LEU  45           HA       LEU  45  -4.803  24.491   5.806
  345    HB2  LEU  45          2HB       LEU  45  -6.236  26.165   6.371
  346    HB3  LEU  45          3HB       LEU  45  -4.943  27.339   6.608
  347    HG   LEU  45           HG       LEU  45  -4.764  27.666   4.209
  348   HD11  LEU  45          1HD1      LEU  45  -6.887  26.549   2.987
  349   HD12  LEU  45          2HD1      LEU  45  -6.499  25.287   4.156
  350   HD13  LEU  45          3HD1      LEU  45  -5.276  25.832   3.008
  351   HD21  LEU  45          1HD2      LEU  45  -6.343  29.212   4.390
  352   HD22  LEU  45          2HD2      LEU  45  -6.958  28.384   5.821
  353   HD23  LEU  45          3HD2      LEU  45  -7.604  27.990   4.228
  354    H    ASP  46           H        ASP  46  -2.676  27.346   5.555
  355    HA   ASP  46           HA       ASP  46  -2.177  27.285   2.854
  356    HB2  ASP  46          2HB       ASP  46  -1.227  28.747   4.968
  357    HB3  ASP  46          3HB       ASP  46   0.215  27.874   4.457
  358    H    PHE  47           H        PHE  47  -0.393  25.561   5.400
  359    HA   PHE  47           HA       PHE  47   1.533  24.358   3.791
  360    HB2  PHE  47          2HB       PHE  47   0.487  23.992   6.487
  361    HB3  PHE  47          3HB       PHE  47   1.001  22.474   5.759
  362    HD1  PHE  47           HD1      PHE  47   3.318  23.031   4.252
  363    HD2  PHE  47           HD2      PHE  47   2.077  24.795   7.922
  364    HE1  PHE  47           HE1      PHE  47   5.659  23.570   4.781
  365    HE2  PHE  47           HE2      PHE  47   4.417  25.337   8.456
  366    HZ   PHE  47           HZ       PHE  47   6.212  24.725   6.884
  367    H    SER  48           H        SER  48  -1.591  23.021   4.866
  368    HA   SER  48           HA       SER  48  -1.486  20.584   3.575
  369    HB2  SER  48          2HB       SER  48  -3.320  21.729   5.131
  370    HB3  SER  48          3HB       SER  48  -4.095  22.031   3.576
  371    HG   SER  48           HG       SER  48  -4.823  20.067   4.052
  372    H    ARG  49           H        ARG  49  -2.583  23.704   2.300
  373    HA   ARG  49           HA       ARG  49  -3.594  22.974  -0.137
  374    HB2  ARG  49          2HB       ARG  49  -3.210  25.328   0.973
  375    HB3  ARG  49          3HB       ARG  49  -1.752  25.327  -0.010
  376    HG2  ARG  49          2HG       ARG  49  -4.287  24.638  -1.369
  377    HG3  ARG  49          3HG       ARG  49  -4.069  26.314  -0.862
  378    HD2  ARG  49          2HD       ARG  49  -1.664  25.827  -1.987
  379    HD3  ARG  49          3HD       ARG  49  -2.686  24.764  -2.954
  380    HE   ARG  49           HE       ARG  49  -2.585  27.609  -3.069
  381   HH11  ARG  49          1HH1      ARG  49  -5.778  25.683  -4.524
  382   HH12  ARG  49          2HH1      ARG  49  -4.701  24.870  -3.437
  383   HH21  ARG  49          1HH2      ARG  49  -5.374  27.855  -5.129
  384   HH22  ARG  49          2HH2      ARG  49  -3.994  28.690  -4.500
  385    H    GLU  50           H        GLU  50  -0.185  23.426   0.720
  386    HA   GLU  50           HA       GLU  50   0.725  22.766  -1.933
  387    HB2  GLU  50          2HB       GLU  50   1.859  24.286  -0.137
  388    HB3  GLU  50          3HB       GLU  50   2.498  22.771   0.484
  389    HG2  GLU  50          2HG       GLU  50   3.533  22.310  -1.671
  390    HG3  GLU  50          3HG       GLU  50   2.878  23.816  -2.312
  391    H    LYS  51           H        LYS  51  -0.038  21.058   0.949
  392    HA   LYS  51           HA       LYS  51   1.577  18.747   0.404
  393    HB2  LYS  51          2HB       LYS  51   0.904  18.007   2.436
  394    HB3  LYS  51          3HB       LYS  51   0.391  19.676   2.645
  395    HG2  LYS  51          2HG       LYS  51  -1.509  18.607   3.285
  396    HG3  LYS  51          3HG       LYS  51  -1.832  18.763   1.557
  397    HD2  LYS  51          2HD       LYS  51  -0.517  16.427   1.549
  398    HD3  LYS  51          3HD       LYS  51  -1.212  16.360   3.170
  399    HE2  LYS  51          2HE       LYS  51  -3.425  16.597   2.308
  400    HE3  LYS  51          3HE       LYS  51  -2.818  16.952   0.691
  401    HZ1  LYS  51          1HZ       LYS  51  -2.122  14.746   0.404
  402    HZ2  LYS  51          2HZ       LYS  51  -3.662  14.626   1.092
  403    HZ3  LYS  51          3HZ       LYS  51  -2.288  14.374   2.046
  404    H    LYS  52           H        LYS  52  -1.594  19.851  -0.461
  405    HA   LYS  52           HA       LYS  52  -2.571  17.266  -1.266
  406    HB2  LYS  52          2HB       LYS  52  -4.203  18.856  -0.549
  407    HB3  LYS  52          3HB       LYS  52  -3.600  20.074  -1.665
  408    HG2  LYS  52          2HG       LYS  52  -5.672  19.165  -2.485
  409    HG3  LYS  52          3HG       LYS  52  -4.349  18.686  -3.552
  410    HD2  LYS  52          2HD       LYS  52  -4.308  16.483  -2.623
  411    HD3  LYS  52          3HD       LYS  52  -5.436  16.942  -1.346
  412    HE2  LYS  52          2HE       LYS  52  -6.905  17.588  -3.494
  413    HE3  LYS  52          3HE       LYS  52  -5.935  16.289  -4.188
  414    HZ1  LYS  52          1HZ       LYS  52  -6.697  14.799  -2.503
  415    HZ2  LYS  52          2HZ       LYS  52  -8.053  15.533  -3.199
  416    HZ3  LYS  52          3HZ       LYS  52  -7.505  16.038  -1.681
  417    H    LEU  53           H        LEU  53  -1.426  20.183  -2.942
  418    HA   LEU  53           HA       LEU  53  -1.700  19.112  -5.552
  419    HB2  LEU  53          2HB       LEU  53  -1.605  21.506  -5.132
  420    HB3  LEU  53          3HB       LEU  53   0.044  21.349  -4.531
  421    HG   LEU  53           HG       LEU  53  -0.415  20.407  -7.290
  422   HD11  LEU  53          1HD1      LEU  53  -1.014  23.168  -6.415
  423   HD12  LEU  53          2HD1      LEU  53  -1.637  22.248  -7.785
  424   HD13  LEU  53          3HD1      LEU  53  -0.035  22.981  -7.870
  425   HD21  LEU  53          1HD2      LEU  53   1.796  20.554  -7.255
  426   HD22  LEU  53          2HD2      LEU  53   1.735  21.202  -5.616
  427   HD23  LEU  53          3HD2      LEU  53   1.681  22.296  -6.999
  428    H    LEU  54           H        LEU  54   0.644  18.696  -3.085
  429    HA   LEU  54           HA       LEU  54   2.740  17.833  -4.898
  430    HB2  LEU  54          2HB       LEU  54   3.394  19.032  -2.916
  431    HB3  LEU  54          3HB       LEU  54   2.548  17.875  -1.891
  432    HG   LEU  54           HG       LEU  54   5.099  17.735  -2.011
  433   HD11  LEU  54          1HD1      LEU  54   4.701  15.772  -1.068
  434   HD12  LEU  54          2HD1      LEU  54   4.415  15.050  -2.651
  435   HD13  LEU  54          3HD1      LEU  54   3.077  15.774  -1.758
  436   HD21  LEU  54          1HD2      LEU  54   4.866  15.992  -4.359
  437   HD22  LEU  54          2HD2      LEU  54   6.149  17.109  -3.894
  438   HD23  LEU  54          3HD2      LEU  54   4.700  17.714  -4.698
  439    H    GLU  55           H        GLU  55   0.184  16.456  -3.013
  440    HA   GLU  55           HA       GLU  55   1.175  13.820  -2.791
  441    HB2  GLU  55          2HB       GLU  55  -0.634  14.448  -1.380
  442    HB3  GLU  55          3HB       GLU  55  -1.614  14.959  -2.747
  443    HG2  GLU  55          2HG       GLU  55  -0.844  12.178  -2.955
  444    HG3  GLU  55          3HG       GLU  55  -1.712  12.517  -1.458
  445    H    CYS  56           H        CYS  56  -1.177  15.222  -5.075
  446    HA   CYS  56           HA       CYS  56  -0.341  13.201  -7.038
  447    HB2  CYS  56          2HB       CYS  56  -2.453  12.425  -6.149
  448    HB3  CYS  56          3HB       CYS  56  -3.178  14.011  -6.380
  449    HG   CYS  56           HG       CYS  56  -3.855  11.782  -8.271
  450    H    LEU  57           H        LEU  57  -2.725  15.841  -7.050
  451    HA   LEU  57           HA       LEU  57  -1.092  17.540  -8.676
  452    HB2  LEU  57          2HB       LEU  57  -2.885  15.643  -9.933
  453    HB3  LEU  57          3HB       LEU  57  -3.297  17.305 -10.349
  454    HG   LEU  57           HG       LEU  57  -0.454  16.490 -10.611
  455   HD11  LEU  57          1HD1      LEU  57  -0.880  15.565 -12.848
  456   HD12  LEU  57          2HD1      LEU  57  -2.614  15.635 -12.533
  457   HD13  LEU  57          3HD1      LEU  57  -1.585  14.576 -11.570
  458   HD21  LEU  57          1HD2      LEU  57  -1.447  17.840 -12.863
  459   HD22  LEU  57          2HD2      LEU  57  -0.430  18.488 -11.576
  460   HD23  LEU  57          3HD2      LEU  57  -2.186  18.611 -11.459
  461    H    ASP  58           H        ASP  58  -4.601  16.953  -8.457
  462    HA   ASP  58           HA       ASP  58  -6.328  18.321  -7.879
  463    HB2  ASP  58          2HB       ASP  58  -5.125  17.965  -5.666
  464    HB3  ASP  58          3HB       ASP  58  -4.409  19.557  -5.905
  465    H    TYR  59           H        TYR  59  -6.395  19.461  -9.846
  466    HA   TYR  59           HA       TYR  59  -4.841  21.616 -10.604
  467    HB2  TYR  59          2HB       TYR  59  -6.699  20.372 -11.900
  468    HB3  TYR  59          3HB       TYR  59  -7.796  21.536 -11.166
  469    HD1  TYR  59           HD1      TYR  59  -8.350  23.330 -12.491
  470    HD2  TYR  59           HD2      TYR  59  -4.480  21.612 -12.903
  471    HE1  TYR  59           HE1      TYR  59  -7.827  24.950 -14.266
  472    HE2  TYR  59           HE2      TYR  59  -3.945  23.229 -14.678
  473    HH   TYR  59           HH       TYR  59  -6.032  25.911 -15.411
  474    H    LEU  60           H        LEU  60  -7.901  21.677  -8.787
  475    HA   LEU  60           HA       LEU  60  -7.081  23.911  -7.226
  476    HB2  LEU  60          2HB       LEU  60  -7.878  24.733  -9.624
  477    HB3  LEU  60          3HB       LEU  60  -9.463  24.586  -8.866
  478    HG   LEU  60           HG       LEU  60  -8.750  26.859  -8.688
  479   HD11  LEU  60          1HD1      LEU  60  -8.861  27.198  -6.320
  480   HD12  LEU  60          2HD1      LEU  60  -8.301  25.555  -6.010
  481   HD13  LEU  60          3HD1      LEU  60  -9.886  25.824  -6.735
  482   HD21  LEU  60          1HD2      LEU  60  -6.682  27.582  -7.860
  483   HD22  LEU  60          2HD2      LEU  60  -6.286  26.235  -8.928
  484   HD23  LEU  60          3HD2      LEU  60  -6.301  26.001  -7.179
  Start of MODEL   18
    1    H    LEU   1           H        LEU   1   3.843   1.166   2.778
    2    HA   LEU   1           HA       LEU   1   4.029   0.314   0.630
    3    HB2  LEU   1          2HB       LEU   1   2.484   2.636   0.177
    4    HB3  LEU   1          3HB       LEU   1   3.815   2.664  -0.979
    5    HG   LEU   1           HG       LEU   1   1.832   0.413  -0.641
    6   HD11  LEU   1          1HD1      LEU   1   1.671   1.506  -3.200
    7   HD12  LEU   1          2HD1      LEU   1   1.717   2.889  -2.108
    8   HD13  LEU   1          3HD1      LEU   1   0.485   1.644  -1.902
    9   HD21  LEU   1          1HD2      LEU   1   3.587  -0.719  -1.520
   10   HD22  LEU   1          2HD2      LEU   1   4.336   0.732  -2.185
   11   HD23  LEU   1          3HD2      LEU   1   2.974  -0.019  -3.018
   12    H    LYS   2           H        LYS   2   5.776   0.212  -0.826
   13    HA   LYS   2           HA       LYS   2   7.942   2.132  -0.269
   14    HB2  LYS   2          2HB       LYS   2   8.152  -0.834  -0.817
   15    HB3  LYS   2          3HB       LYS   2   9.523   0.258  -0.671
   16    HG2  LYS   2          2HG       LYS   2   9.132   0.616   1.617
   17    HG3  LYS   2          3HG       LYS   2   7.513  -0.082   1.531
   18    HD2  LYS   2          2HD       LYS   2   8.332  -2.091   2.014
   19    HD3  LYS   2          3HD       LYS   2   9.399  -2.015   0.610
   20    HE2  LYS   2          2HE       LYS   2  10.943  -2.237   2.286
   21    HE3  LYS   2          3HE       LYS   2  10.831  -0.480   2.193
   22    HZ1  LYS   2          1HZ       LYS   2   9.286  -0.509   4.043
   23    HZ2  LYS   2          2HZ       LYS   2  10.736  -1.264   4.478
   24    HZ3  LYS   2          3HZ       LYS   2   9.369  -2.197   4.126
   25    H    GLU   3           H        GLU   3   9.012   3.000  -1.971
   26    HA   GLU   3           HA       GLU   3   9.160   1.889  -4.550
   27    HB2  GLU   3          2HB       GLU   3   6.667   3.032  -4.037
   28    HB3  GLU   3          3HB       GLU   3   7.529   4.252  -4.963
   29    HG2  GLU   3          2HG       GLU   3   7.873   1.621  -6.103
   30    HG3  GLU   3          3HG       GLU   3   6.170   2.052  -5.956
   31    H    ASN   4           H        ASN   4   9.731   3.749  -6.206
   32    HA   ASN   4           HA       ASN   4  11.557   5.582  -4.798
   33    HB2  ASN   4          2HB       ASN   4  12.307   3.641  -6.509
   34    HB3  ASN   4          3HB       ASN   4  12.041   4.950  -7.656
   35   HD21  ASN   4          1HD2      ASN   4  13.101   7.039  -7.081
   36   HD22  ASN   4          2HD2      ASN   4  14.688   6.962  -6.404
   37    H    ASP   5           H        ASP   5   8.823   6.204  -5.323
   38    HA   ASP   5           HA       ASP   5   9.189   8.702  -6.696
   39    HB2  ASP   5          2HB       ASP   5   7.984   6.429  -8.076
   40    HB3  ASP   5          3HB       ASP   5   6.919   7.832  -8.024
   41    H    HIS   6           H        HIS   6   6.303   6.689  -6.176
   42    HA   HIS   6           HA       HIS   6   4.763   8.751  -5.076
   43    HB2  HIS   6          2HB       HIS   6   3.928   6.560  -6.028
   44    HB3  HIS   6          3HB       HIS   6   4.393   5.808  -4.505
   45    HD1  HIS   6           HD1      HIS   6   2.613   9.126  -4.976
   46    HD2  HIS   6           HD2      HIS   6   1.961   5.349  -3.373
   47    HE1  HIS   6           HE1      HIS   6   0.385   9.263  -3.817
   48    H    ALA   7           H        ALA   7   6.864   6.365  -3.567
   49    HA   ALA   7           HA       ALA   7   6.135   6.678  -0.905
   50    HB1  ALA   7          1HB       ALA   7   8.573   5.785  -2.322
   51    HB2  ALA   7          2HB       ALA   7   8.751   6.219  -0.621
   52    HB3  ALA   7          3HB       ALA   7   7.605   4.965  -1.096
   53    H    ARG   8           H        ARG   8   8.703   8.404  -2.680
   54    HA   ARG   8           HA       ARG   8   9.460  10.113  -0.605
   55    HB2  ARG   8          2HB       ARG   8  10.883   9.919  -2.507
   56    HB3  ARG   8          3HB       ARG   8   9.600  10.420  -3.601
   57    HG2  ARG   8          2HG       ARG   8  11.187  12.209  -3.317
   58    HG3  ARG   8          3HG       ARG   8   9.644  12.661  -2.592
   59    HD2  ARG   8          2HD       ARG   8  10.462  12.570  -0.459
   60    HD3  ARG   8          3HD       ARG   8  11.670  11.351  -0.861
   61    HE   ARG   8           HE       ARG   8  11.974  14.210  -0.999
   62   HH11  ARG   8          1HH1      ARG   8  14.703  11.737  -2.569
   63   HH12  ARG   8          2HH1      ARG   8  13.132  11.136  -2.151
   64   HH21  ARG   8          1HH2      ARG   8  15.217  13.942  -2.224
   65   HH22  ARG   8          2HH2      ARG   8  14.037  15.013  -1.546
   66    H    PHE   9           H        PHE   9   7.087  10.585  -3.203
   67    HA   PHE   9           HA       PHE   9   6.365  13.213  -2.590
   68    HB2  PHE   9          2HB       PHE   9   5.192  10.986  -4.130
   69    HB3  PHE   9          3HB       PHE   9   4.037  12.186  -3.558
   70    HD1  PHE   9           HD1      PHE   9   7.512  13.002  -4.413
   71    HD2  PHE   9           HD2      PHE   9   3.463  13.012  -5.724
   72    HE1  PHE   9           HE1      PHE   9   8.125  14.478  -6.285
   73    HE2  PHE   9           HE2      PHE   9   4.069  14.486  -7.598
   74    HZ   PHE   9           HZ       PHE   9   6.402  15.220  -7.881
   75    H    LEU  10           H        LEU  10   5.163  10.141  -1.331
   76    HA   LEU  10           HA       LEU  10   3.076  11.290   0.230
   77    HB2  LEU  10          2HB       LEU  10   3.831   8.739  -0.517
   78    HB3  LEU  10          3HB       LEU  10   4.119   8.763   1.221
   79    HG   LEU  10           HG       LEU  10   1.512   9.843   0.475
   80   HD11  LEU  10          1HD1      LEU  10   0.531   8.062  -0.530
   81   HD12  LEU  10          2HD1      LEU  10   1.644   6.898   0.189
   82   HD13  LEU  10          3HD1      LEU  10   2.156   7.871  -1.189
   83   HD21  LEU  10          1HD2      LEU  10   0.949   7.927   2.173
   84   HD22  LEU  10          2HD2      LEU  10   1.725   9.415   2.718
   85   HD23  LEU  10          3HD2      LEU  10   2.689   7.960   2.462
   86    H    GLN  11           H        GLN  11   6.215   9.864   1.150
   87    HA   GLN  11           HA       GLN  11   6.124  10.541   3.850
   88    HB2  GLN  11          2HB       GLN  11   7.896   9.223   2.231
   89    HB3  GLN  11          3HB       GLN  11   8.796  10.678   2.639
   90    HG2  GLN  11          2HG       GLN  11   8.436  10.211   5.022
   91    HG3  GLN  11          3HG       GLN  11   7.590   8.727   4.587
   92   HE21  GLN  11          1HE2      GLN  11   8.750   6.942   4.506
   93   HE22  GLN  11          2HE2      GLN  11  10.469   6.854   4.368
   94    H    THR  12           H        THR  12   6.919  12.461   1.058
   95    HA   THR  12           HA       THR  12   8.152  14.599   2.514
   96    HB   THR  12           HB       THR  12   7.146  14.348  -0.314
   97    HG1  THR  12           HG1      THR  12   9.444  14.664  -0.681
   98   HG21  THR  12          1HG2      THR  12   8.268  16.787   1.063
   99   HG22  THR  12          2HG2      THR  12   6.714  16.633   0.243
  100   HG23  THR  12          3HG2      THR  12   8.210  16.592  -0.688
  101    H    ALA  13           H        ALA  13   5.044  14.342   0.776
  102    HA   ALA  13           HA       ALA  13   3.946  16.760   1.515
  103    HB1  ALA  13          1HB       ALA  13   2.432  15.896   0.133
  104    HB2  ALA  13          2HB       ALA  13   2.964  14.247   0.466
  105    HB3  ALA  13          3HB       ALA  13   1.785  15.024   1.523
  106    H    LYS  14           H        LYS  14   4.091  13.753   3.339
  107    HA   LYS  14           HA       LYS  14   2.388  14.659   5.453
  108    HB2  LYS  14          2HB       LYS  14   3.722  12.227   4.716
  109    HB3  LYS  14          3HB       LYS  14   4.075  12.593   6.399
  110    HG2  LYS  14          2HG       LYS  14   2.136  11.636   6.890
  111    HG3  LYS  14          3HG       LYS  14   1.358  13.054   6.182
  112    HD2  LYS  14          2HD       LYS  14   1.718  11.743   3.938
  113    HD3  LYS  14          3HD       LYS  14   1.806  10.345   5.011
  114    HE2  LYS  14          2HE       LYS  14  -0.396  10.384   5.421
  115    HE3  LYS  14          3HE       LYS  14  -0.422  12.137   5.607
  116    HZ1  LYS  14          1HZ       LYS  14  -1.305  12.313   3.601
  117    HZ2  LYS  14          2HZ       LYS  14  -1.323  10.629   3.443
  118    HZ3  LYS  14          3HZ       LYS  14   0.014  11.515   2.904
  119    H    ASN  15           H        ASN  15   5.901  14.297   5.068
  120    HA   ASN  15           HA       ASN  15   6.675  15.106   7.616
  121    HB2  ASN  15          2HB       ASN  15   8.164  14.120   5.846
  122    HB3  ASN  15          3HB       ASN  15   8.174  15.694   5.056
  123   HD21  ASN  15          1HD2      ASN  15  10.105  16.539   5.367
  124   HD22  ASN  15          2HD2      ASN  15  10.936  16.636   6.879
  125    H    ILE  16           H        ILE  16   5.477  16.954   4.947
  126    HA   ILE  16           HA       ILE  16   6.461  19.494   5.785
  127    HB   ILE  16           HB       ILE  16   4.141  18.805   3.978
  128   HG12  ILE  16          2HG1      ILE  16   6.739  19.940   3.038
  129   HG13  ILE  16          3HG1      ILE  16   6.673  18.230   3.448
  130   HG21  ILE  16          1HG2      ILE  16   4.493  21.175   3.165
  131   HG22  ILE  16          2HG2      ILE  16   3.748  21.000   4.753
  132   HG23  ILE  16          3HG2      ILE  16   5.452  21.433   4.622
  133   HD11  ILE  16          1HD1      ILE  16   5.680  17.741   1.532
  134   HD12  ILE  16          2HD1      ILE  16   4.452  18.984   1.775
  135   HD13  ILE  16          3HD1      ILE  16   5.995  19.401   1.030
  136    H    THR  17           H        THR  17   3.216  18.021   5.945
  137    HA   THR  17           HA       THR  17   2.164  20.092   7.603
  138    HB   THR  17           HB       THR  17   0.825  17.447   7.610
  139    HG1  THR  17           HG1      THR  17   0.537  17.350   5.495
  140   HG21  THR  17          1HG2      THR  17  -0.948  19.297   6.694
  141   HG22  THR  17          2HG2      THR  17   0.138  20.305   7.651
  142   HG23  THR  17          3HG2      THR  17  -0.677  18.932   8.398
  143    H    GLU  18           H        GLU  18   4.014  17.281   8.198
  144    HA   GLU  18           HA       GLU  18   3.128  16.922  10.925
  145    HB2  GLU  18          2HB       GLU  18   5.263  15.657   9.227
  146    HB3  GLU  18          3HB       GLU  18   5.186  15.358  10.958
  147    HG2  GLU  18          2HG       GLU  18   2.686  14.987   9.428
  148    HG3  GLU  18          3HG       GLU  18   3.974  13.815   9.157
  149    H    ARG  19           H        ARG  19   5.699  18.559   9.228
  150    HA   ARG  19           HA       ARG  19   7.280  19.051  11.576
  151    HB2  ARG  19          2HB       ARG  19   8.083  18.939   9.129
  152    HB3  ARG  19          3HB       ARG  19   7.480  20.585   8.997
  153    HG2  ARG  19          2HG       ARG  19   9.010  20.670  11.279
  154    HG3  ARG  19          3HG       ARG  19   9.913  19.581  10.224
  155    HD2  ARG  19          2HD       ARG  19   9.736  21.297   8.423
  156    HD3  ARG  19          3HD       ARG  19   9.008  22.387   9.602
  157    HE   ARG  19           HE       ARG  19  11.086  22.762  10.487
  158   HH11  ARG  19          1HH1      ARG  19  12.926  19.791   8.534
  159   HH12  ARG  19          2HH1      ARG  19  11.201  19.938   8.455
  160   HH21  ARG  19          1HH2      ARG  19  14.151  21.293   9.755
  161   HH22  ARG  19          2HH2      ARG  19  13.357  22.579  10.599
  162    H    VAL  20           H        VAL  20   4.808  20.752   9.763
  163    HA   VAL  20           HA       VAL  20   5.160  23.282  11.007
  164    HB   VAL  20           HB       VAL  20   3.996  23.114   8.884
  165   HG11  VAL  20          1HG1      VAL  20   1.802  22.103   8.681
  166   HG12  VAL  20          2HG1      VAL  20   2.965  20.909   9.260
  167   HG13  VAL  20          3HG1      VAL  20   1.827  21.651  10.385
  168   HG21  VAL  20          1HG2      VAL  20   3.421  25.035  10.150
  169   HG22  VAL  20          2HG2      VAL  20   1.913  24.401   9.490
  170   HG23  VAL  20          3HG2      VAL  20   2.326  24.114  11.181
  171    H    SER  21           H        SER  21   3.154  20.468  11.708
  172    HA   SER  21           HA       SER  21   1.608  21.680  13.752
  173    HB2  SER  21          2HB       SER  21   0.711  19.708  12.799
  174    HB3  SER  21          3HB       SER  21   2.209  18.811  13.044
  175    HG   SER  21           HG       SER  21   0.278  19.589  14.948
  176    H    MET  22           H        MET  22   4.425  19.503  13.887
  177    HA   MET  22           HA       MET  22   4.725  19.412  16.645
  178    HB2  MET  22          2HB       MET  22   5.961  18.035  14.935
  179    HB3  MET  22          3HB       MET  22   6.998  19.428  14.658
  180    HG2  MET  22          2HG       MET  22   7.645  19.371  17.042
  181    HG3  MET  22          3HG       MET  22   6.685  17.906  17.232
  182    HE1  MET  22          1HE       MET  22   9.906  19.532  15.827
  183    HE2  MET  22          2HE       MET  22  10.561  18.281  14.770
  184    HE3  MET  22          3HE       MET  22   9.084  19.134  14.318
  185    H    ALA  23           H        ALA  23   5.988  21.763  14.320
  186    HA   ALA  23           HA       ALA  23   7.615  23.239  16.033
  187    HB1  ALA  23          1HB       ALA  23   7.873  23.768  13.798
  188    HB2  ALA  23          2HB       ALA  23   6.136  23.904  13.521
  189    HB3  ALA  23          3HB       ALA  23   6.989  25.166  14.410
  190    H    THR  24           H        THR  24   4.187  23.747  15.215
  191    HA   THR  24           HA       THR  24   3.718  26.012  16.742
  192    HB   THR  24           HB       THR  24   1.504  24.084  16.806
  193    HG1  THR  24           HG1      THR  24   2.128  24.986  14.230
  194   HG21  THR  24          1HG2      THR  24   0.619  26.146  17.006
  195   HG22  THR  24          2HG2      THR  24   0.745  26.189  15.247
  196   HG23  THR  24          3HG2      THR  24   2.005  26.921  16.241
  197    H    ALA  25           H        ALA  25   3.454  22.600  17.698
  198    HA   ALA  25           HA       ALA  25   2.603  23.108  20.348
  199    HB1  ALA  25          1HB       ALA  25   2.221  20.929  20.164
  200    HB2  ALA  25          2HB       ALA  25   3.263  20.814  18.745
  201    HB3  ALA  25          3HB       ALA  25   3.954  20.660  20.360
  202    H    SER  26           H        SER  26   5.591  23.549  18.841
  203    HA   SER  26           HA       SER  26   7.122  23.221  21.309
  204    HB2  SER  26          2HB       SER  26   7.743  22.797  18.622
  205    HB3  SER  26          3HB       SER  26   8.622  24.265  19.049
  206    HG   SER  26           HG       SER  26   9.818  22.348  19.489
  207    H    SER  27           H        SER  27   6.366  25.710  18.892
  208    HA   SER  27           HA       SER  27   7.743  27.820  20.132
  209    HB2  SER  27          2HB       SER  27   7.085  28.137  17.874
  210    HB3  SER  27          3HB       SER  27   5.400  27.759  18.231
  211    HG   SER  27           HG       SER  27   6.152  30.087  18.005
  212    H    GLN  28           H        GLN  28   4.894  26.200  21.027
  213    HA   GLN  28           HA       GLN  28   3.491  26.453  22.804
  214    HB2  GLN  28          2HB       GLN  28   5.717  27.348  23.832
  215    HB3  GLN  28          3HB       GLN  28   4.949  28.923  23.674
  216    HG2  GLN  28          2HG       GLN  28   3.197  28.319  25.141
  217    HG3  GLN  28          3HG       GLN  28   3.664  26.619  25.108
  218   HE21  GLN  28          1HE2      GLN  28   5.884  26.160  25.934
  219   HE22  GLN  28          2HE2      GLN  28   6.412  27.042  27.323
  220    H    VAL  29           H        VAL  29   2.284  27.186  20.702
  221    HA   VAL  29           HA       VAL  29   1.186  29.877  21.203
  222    HB   VAL  29           HB       VAL  29   1.196  28.474  18.533
  223   HG11  VAL  29          1HG1      VAL  29  -0.465  30.035  18.358
  224   HG12  VAL  29          2HG1      VAL  29   0.274  31.116  19.541
  225   HG13  VAL  29          3HG1      VAL  29   0.924  31.021  17.904
  226   HG21  VAL  29          1HG2      VAL  29   3.087  30.590  19.556
  227   HG22  VAL  29          2HG2      VAL  29   3.496  28.912  19.196
  228   HG23  VAL  29          3HG2      VAL  29   3.011  30.000  17.896
  229    H    LEU  30           H        LEU  30   0.563  26.591  21.246
  230    HA   LEU  30           HA       LEU  30  -2.190  26.654  20.437
  231    HB2  LEU  30          2HB       LEU  30  -0.523  24.603  21.875
  232    HB3  LEU  30          3HB       LEU  30  -2.225  24.362  21.487
  233    HG   LEU  30           HG       LEU  30  -1.459  24.828  19.043
  234   HD11  LEU  30          1HD1      LEU  30   0.966  23.616  19.062
  235   HD12  LEU  30          2HD1      LEU  30   1.077  24.623  20.505
  236   HD13  LEU  30          3HD1      LEU  30   0.718  25.358  18.942
  237   HD21  LEU  30          1HD2      LEU  30  -1.147  22.345  20.669
  238   HD22  LEU  30          2HD2      LEU  30  -0.662  22.339  18.973
  239   HD23  LEU  30          3HD2      LEU  30  -2.325  22.729  19.413
  240    H    ILE  31           H        ILE  31  -2.325  28.642  22.017
  241    HA   ILE  31           HA       ILE  31  -3.676  27.643  24.410
  242    HB   ILE  31           HB       ILE  31  -2.682  29.584  25.714
  243   HG12  ILE  31          2HG1      ILE  31  -0.207  29.542  24.192
  244   HG13  ILE  31          3HG1      ILE  31  -1.541  30.181  23.239
  245   HG21  ILE  31          1HG2      ILE  31  -0.766  27.411  24.884
  246   HG22  ILE  31          2HG2      ILE  31  -0.759  28.309  26.401
  247   HG23  ILE  31          3HG2      ILE  31  -2.084  27.203  26.038
  248   HD11  ILE  31          1HD1      ILE  31  -1.696  31.369  25.791
  249   HD12  ILE  31          2HD1      ILE  31  -0.016  31.461  25.262
  250   HD13  ILE  31          3HD1      ILE  31  -1.298  32.126  24.250
  251    HA   PRO  32           HA       PRO  32  -6.747  30.617  23.410
  252    HB2  PRO  32          2HB       PRO  32  -7.698  31.249  25.874
  253    HB3  PRO  32          3HB       PRO  32  -8.017  29.697  25.090
  254    HG2  PRO  32          2HG       PRO  32  -5.985  30.381  27.179
  255    HG3  PRO  32          3HG       PRO  32  -7.039  28.959  27.066
  256    HD2  PRO  32          2HD       PRO  32  -4.434  28.904  26.328
  257    HD3  PRO  32          3HD       PRO  32  -5.673  27.913  25.532
  258    H    GLU  33           H        GLU  33  -6.219  32.572  22.656
  259    HA   GLU  33           HA       GLU  33  -5.196  34.566  24.562
  260    HB2  GLU  33          2HB       GLU  33  -3.776  33.502  22.382
  261    HB3  GLU  33          3HB       GLU  33  -4.293  35.104  21.874
  262    HG2  GLU  33          2HG       GLU  33  -2.817  34.522  24.430
  263    HG3  GLU  33          3HG       GLU  33  -2.058  35.057  22.932
  264    H    ILE  34           H        ILE  34  -6.712  34.078  21.384
  265    HA   ILE  34           HA       ILE  34  -8.862  35.810  21.895
  266    HB   ILE  34           HB       ILE  34  -7.245  37.609  21.776
  267   HG12  ILE  34          2HG1      ILE  34  -8.916  37.443  19.258
  268   HG13  ILE  34          3HG1      ILE  34  -9.475  38.008  20.828
  269   HG21  ILE  34          1HG2      ILE  34  -5.877  38.020  19.830
  270   HG22  ILE  34          2HG2      ILE  34  -5.556  36.398  20.442
  271   HG23  ILE  34          3HG2      ILE  34  -6.564  36.617  19.012
  272   HD11  ILE  34          1HD1      ILE  34  -7.408  39.663  20.483
  273   HD12  ILE  34          2HD1      ILE  34  -7.830  39.366  18.797
  274   HD13  ILE  34          3HD1      ILE  34  -9.037  40.014  19.907
  275    H    ASN  35           H        ASN  35  -6.721  34.413  19.470
  276    HA   ASN  35           HA       ASN  35  -8.955  33.234  18.102
  277    HB2  ASN  35          2HB       ASN  35  -7.466  35.549  16.914
  278    HB3  ASN  35          3HB       ASN  35  -8.086  34.280  15.862
  279   HD21  ASN  35          1HD2      ASN  35  -8.804  37.157  16.277
  280   HD22  ASN  35          2HD2      ASN  35 -10.513  37.146  16.529
  281    H    LEU  36           H        LEU  36  -7.197  31.760  19.269
  282    HA   LEU  36           HA       LEU  36  -4.795  31.222  17.867
  283    HB2  LEU  36          2HB       LEU  36  -4.789  30.485  20.061
  284    HB3  LEU  36          3HB       LEU  36  -6.403  29.789  19.936
  285    HG   LEU  36           HG       LEU  36  -5.439  27.984  18.509
  286   HD11  LEU  36          1HD1      LEU  36  -2.955  29.529  19.075
  287   HD12  LEU  36          2HD1      LEU  36  -3.480  28.742  17.587
  288   HD13  LEU  36          3HD1      LEU  36  -2.864  27.774  18.926
  289   HD21  LEU  36          1HD2      LEU  36  -5.832  27.407  20.748
  290   HD22  LEU  36          2HD2      LEU  36  -4.491  28.394  21.330
  291   HD23  LEU  36          3HD2      LEU  36  -4.169  26.906  20.438
  292    H    ASN  37           H        ASN  37  -8.027  29.786  17.766
  293    HA   ASN  37           HA       ASN  37  -7.514  27.624  16.102
  294    HB2  ASN  37          2HB       ASN  37  -9.942  29.331  16.557
  295    HB3  ASN  37          3HB       ASN  37  -9.967  28.062  15.336
  296   HD21  ASN  37          1HD2      ASN  37 -11.675  28.007  17.472
  297   HD22  ASN  37          2HD2      ASN  37 -11.249  26.703  18.522
  298    H    ASP  38           H        ASP  38  -8.430  30.942  15.215
  299    HA   ASP  38           HA       ASP  38  -8.501  30.592  12.448
  300    HB2  ASP  38          2HB       ASP  38  -8.377  32.847  14.307
  301    HB3  ASP  38          3HB       ASP  38  -7.587  33.178  12.767
  302    H    THR  39           H        THR  39  -5.818  31.808  14.457
  303    HA   THR  39           HA       THR  39  -3.930  32.070  12.426
  304    HB   THR  39           HB       THR  39  -2.893  31.142  15.036
  305    HG1  THR  39           HG1      THR  39  -4.096  32.438  16.183
  306   HG21  THR  39          1HG2      THR  39  -1.430  32.135  13.360
  307   HG22  THR  39          2HG2      THR  39  -1.512  33.167  14.788
  308   HG23  THR  39          3HG2      THR  39  -2.419  33.594  13.337
  309    H    PHE  40           H        PHE  40  -4.509  29.309  14.598
  310    HA   PHE  40           HA       PHE  40  -2.515  27.633  13.587
  311    HB2  PHE  40          2HB       PHE  40  -4.009  27.358  15.682
  312    HB3  PHE  40          3HB       PHE  40  -5.150  26.583  14.588
  313    HD1  PHE  40           HD1      PHE  40  -1.434  26.410  14.783
  314    HD2  PHE  40           HD2      PHE  40  -5.137  24.330  15.064
  315    HE1  PHE  40           HE1      PHE  40  -0.218  24.285  15.028
  316    HE2  PHE  40           HE2      PHE  40  -3.927  22.202  15.310
  317    HZ   PHE  40           HZ       PHE  40  -1.464  22.178  15.293
  318    H    ASP  41           H        ASP  41  -5.920  27.964  12.651
  319    HA   ASP  41           HA       ASP  41  -6.021  25.920  10.757
  320    HB2  ASP  41          2HB       ASP  41  -7.875  27.538  11.727
  321    HB3  ASP  41          3HB       ASP  41  -7.523  28.455  10.265
  322    H    THR  42           H        THR  42  -5.640  29.406  10.090
  323    HA   THR  42           HA       THR  42  -5.025  29.172   7.390
  324    HB   THR  42           HB       THR  42  -5.418  31.288   8.957
  325    HG1  THR  42           HG1      THR  42  -5.360  31.243   6.631
  326   HG21  THR  42          1HG2      THR  42  -3.517  32.475   9.563
  327   HG22  THR  42          2HG2      THR  42  -2.480  31.579   8.453
  328   HG23  THR  42          3HG2      THR  42  -3.054  30.816   9.936
  329    H    PHE  43           H        PHE  43  -3.089  28.496  10.158
  330    HA   PHE  43           HA       PHE  43  -0.546  28.736   8.866
  331    HB2  PHE  43          2HB       PHE  43  -0.948  28.884  11.359
  332    HB3  PHE  43          3HB       PHE  43  -1.180  27.139  11.350
  333    HD1  PHE  43           HD1      PHE  43   0.633  26.392  12.616
  334    HD2  PHE  43           HD2      PHE  43   1.285  29.103   9.400
  335    HE1  PHE  43           HE1      PHE  43   3.061  26.069  12.841
  336    HE2  PHE  43           HE2      PHE  43   3.714  28.785   9.620
  337    HZ   PHE  43           HZ       PHE  43   4.606  27.266  11.341
  338    H    ALA  44           H        ALA  44  -2.450  25.926   9.961
  339    HA   ALA  44           HA       ALA  44  -0.789  24.024   8.661
  340    HB1  ALA  44          1HB       ALA  44  -2.347  22.394   9.351
  341    HB2  ALA  44          2HB       ALA  44  -2.332  23.613  10.627
  342    HB3  ALA  44          3HB       ALA  44  -3.652  23.575   9.458
  343    H    LEU  45           H        LEU  45  -3.961  25.412   7.849
  344    HA   LEU  45           HA       LEU  45  -4.589  24.016   5.585
  345    HB2  LEU  45          2HB       LEU  45  -5.735  26.047   6.800
  346    HB3  LEU  45          3HB       LEU  45  -4.926  26.977   5.540
  347    HG   LEU  45           HG       LEU  45  -7.124  26.599   4.775
  348   HD11  LEU  45          1HD1      LEU  45  -6.779  25.497   2.735
  349   HD12  LEU  45          2HD1      LEU  45  -5.581  24.404   3.428
  350   HD13  LEU  45          3HD1      LEU  45  -5.189  26.107   3.194
  351   HD21  LEU  45          1HD2      LEU  45  -8.372  24.894   5.448
  352   HD22  LEU  45          2HD2      LEU  45  -6.983  24.273   6.339
  353   HD23  LEU  45          3HD2      LEU  45  -7.280  23.738   4.684
  354    H    ASP  46           H        ASP  46  -2.793  27.101   5.582
  355    HA   ASP  46           HA       ASP  46  -2.132  27.247   2.931
  356    HB2  ASP  46          2HB       ASP  46  -1.482  28.706   5.113
  357    HB3  ASP  46          3HB       ASP  46   0.068  27.934   4.789
  358    H    PHE  47           H        PHE  47  -0.192  25.657   5.463
  359    HA   PHE  47           HA       PHE  47   1.833  24.684   3.821
  360    HB2  PHE  47          2HB       PHE  47   0.917  24.252   6.532
  361    HB3  PHE  47          3HB       PHE  47   1.469  22.744   5.811
  362    HD1  PHE  47           HD1      PHE  47   3.722  23.244   4.281
  363    HD2  PHE  47           HD2      PHE  47   2.503  25.275   7.817
  364    HE1  PHE  47           HE1      PHE  47   6.057  23.891   4.711
  365    HE2  PHE  47           HE2      PHE  47   4.835  25.926   8.252
  366    HZ   PHE  47           HZ       PHE  47   6.616  25.234   6.698
  367    H    SER  48           H        SER  48  -1.037  22.921   4.996
  368    HA   SER  48           HA       SER  48  -0.674  20.562   3.615
  369    HB2  SER  48          2HB       SER  48  -2.520  21.299   5.326
  370    HB3  SER  48          3HB       SER  48  -3.435  21.705   3.874
  371    HG   SER  48           HG       SER  48  -3.942  19.628   4.214
  372    H    ARG  49           H        ARG  49  -2.283  23.522   2.512
  373    HA   ARG  49           HA       ARG  49  -3.348  22.766   0.128
  374    HB2  ARG  49          2HB       ARG  49  -3.195  25.107   1.221
  375    HB3  ARG  49          3HB       ARG  49  -1.712  25.281   0.291
  376    HG2  ARG  49          2HG       ARG  49  -3.142  24.658  -1.742
  377    HG3  ARG  49          3HG       ARG  49  -4.524  24.996  -0.697
  378    HD2  ARG  49          2HD       ARG  49  -2.862  27.166  -0.302
  379    HD3  ARG  49          3HD       ARG  49  -2.693  26.824  -2.024
  380    HE   ARG  49           HE       ARG  49  -5.419  26.800  -1.325
  381   HH11  ARG  49          1HH1      ARG  49  -3.755  30.351  -2.131
  382   HH12  ARG  49          2HH1      ARG  49  -2.751  29.002  -1.715
  383   HH21  ARG  49          1HH2      ARG  49  -6.031  30.103  -2.219
  384   HH22  ARG  49          2HH2      ARG  49  -6.752  28.568  -1.872
  385    H    GLU  50           H        GLU  50   0.058  23.552   0.735
  386    HA   GLU  50           HA       GLU  50   0.834  23.024  -1.982
  387    HB2  GLU  50          2HB       GLU  50   1.955  24.444   0.064
  388    HB3  GLU  50          3HB       GLU  50   2.932  22.982   0.082
  389    HG2  GLU  50          2HG       GLU  50   2.891  23.544  -2.567
  390    HG3  GLU  50          3HG       GLU  50   2.829  25.163  -1.872
  391    H    LYS  51           H        LYS  51   0.792  21.262   1.047
  392    HA   LYS  51           HA       LYS  51   2.445  19.111   0.298
  393    HB2  LYS  51          2HB       LYS  51   1.908  18.227   2.318
  394    HB3  LYS  51          3HB       LYS  51   1.263  19.838   2.603
  395    HG2  LYS  51          2HG       LYS  51  -0.520  18.604   3.266
  396    HG3  LYS  51          3HG       LYS  51  -0.911  18.761   1.551
  397    HD2  LYS  51          2HD       LYS  51   0.541  16.557   1.387
  398    HD3  LYS  51          3HD       LYS  51   0.060  16.397   3.078
  399    HE2  LYS  51          2HE       LYS  51  -2.289  16.579   2.427
  400    HE3  LYS  51          3HE       LYS  51  -1.813  16.755   0.739
  401    HZ1  LYS  51          1HZ       LYS  51  -2.439  14.424   1.888
  402    HZ2  LYS  51          2HZ       LYS  51  -0.758  14.413   2.072
  403    HZ3  LYS  51          3HZ       LYS  51  -1.439  14.568   0.531
  404    H    LYS  52           H        LYS  52  -0.875  19.862  -0.402
  405    HA   LYS  52           HA       LYS  52  -1.593  17.217  -1.256
  406    HB2  LYS  52          2HB       LYS  52  -3.344  18.652  -0.462
  407    HB3  LYS  52          3HB       LYS  52  -2.912  19.910  -1.613
  408    HG2  LYS  52          2HG       LYS  52  -4.891  18.822  -2.384
  409    HG3  LYS  52          3HG       LYS  52  -3.559  18.373  -3.452
  410    HD2  LYS  52          2HD       LYS  52  -3.357  16.229  -2.401
  411    HD3  LYS  52          3HD       LYS  52  -4.509  16.681  -1.143
  412    HE2  LYS  52          2HE       LYS  52  -5.833  17.117  -3.568
  413    HE3  LYS  52          3HE       LYS  52  -4.988  15.583  -3.764
  414    HZ1  LYS  52          1HZ       LYS  52  -7.041  16.312  -1.772
  415    HZ2  LYS  52          2HZ       LYS  52  -5.989  15.016  -1.501
  416    HZ3  LYS  52          3HZ       LYS  52  -7.021  15.001  -2.841
  417    H    LEU  53           H        LEU  53  -0.949  20.281  -2.958
  418    HA   LEU  53           HA       LEU  53  -1.215  19.403  -5.559
  419    HB2  LEU  53          2HB       LEU  53  -0.161  21.674  -4.233
  420    HB3  LEU  53          3HB       LEU  53   1.020  21.166  -5.438
  421    HG   LEU  53           HG       LEU  53  -1.716  21.289  -6.461
  422   HD11  LEU  53          1HD1      LEU  53  -2.199  23.163  -5.257
  423   HD12  LEU  53          2HD1      LEU  53  -1.344  23.898  -6.613
  424   HD13  LEU  53          3HD1      LEU  53  -0.506  23.627  -5.086
  425   HD21  LEU  53          1HD2      LEU  53   0.003  21.006  -8.024
  426   HD22  LEU  53          2HD2      LEU  53   1.006  22.253  -7.283
  427   HD23  LEU  53          3HD2      LEU  53  -0.450  22.705  -8.172
  428    H    LEU  54           H        LEU  54   1.334  18.777  -3.291
  429    HA   LEU  54           HA       LEU  54   3.288  17.937  -5.193
  430    HB2  LEU  54          2HB       LEU  54   3.559  18.662  -2.712
  431    HB3  LEU  54          3HB       LEU  54   3.212  16.970  -2.364
  432    HG   LEU  54           HG       LEU  54   5.497  17.951  -4.073
  433   HD11  LEU  54          1HD1      LEU  54   6.031  18.622  -1.896
  434   HD12  LEU  54          2HD1      LEU  54   6.834  17.065  -2.089
  435   HD13  LEU  54          3HD1      LEU  54   5.327  17.172  -1.180
  436   HD21  LEU  54          1HD2      LEU  54   4.417  15.284  -3.376
  437   HD22  LEU  54          2HD2      LEU  54   6.172  15.468  -3.368
  438   HD23  LEU  54          3HD2      LEU  54   5.253  15.827  -4.831
  439    H    GLU  55           H        GLU  55   1.353  16.070  -2.843
  440    HA   GLU  55           HA       GLU  55   1.990  13.540  -3.799
  441    HB2  GLU  55          2HB       GLU  55   0.716  14.202  -1.670
  442    HB3  GLU  55          3HB       GLU  55  -0.720  14.230  -2.683
  443    HG2  GLU  55          2HG       GLU  55   0.742  11.792  -3.089
  444    HG3  GLU  55          3HG       GLU  55   0.402  12.035  -1.376
  445    H    CYS  56           H        CYS  56  -1.148  15.143  -4.352
  446    HA   CYS  56           HA       CYS  56  -1.731  13.464  -6.593
  447    HB2  CYS  56          2HB       CYS  56  -3.795  14.660  -6.750
  448    HB3  CYS  56          3HB       CYS  56  -3.446  14.457  -5.037
  449    HG   CYS  56           HG       CYS  56  -2.506  17.341  -6.562
  450    H    LEU  57           H        LEU  57  -2.783  14.938  -8.541
  451    HA   LEU  57           HA       LEU  57  -0.823  16.939  -9.369
  452    HB2  LEU  57          2HB       LEU  57  -0.504  14.378 -10.191
  453    HB3  LEU  57          3HB       LEU  57  -1.544  15.005 -11.468
  454    HG   LEU  57           HG       LEU  57   0.709  15.196 -12.208
  455   HD11  LEU  57          1HD1      LEU  57  -0.296  17.877 -11.265
  456   HD12  LEU  57          2HD1      LEU  57  -0.704  17.076 -12.782
  457   HD13  LEU  57          3HD1      LEU  57   0.946  17.626 -12.492
  458   HD21  LEU  57          1HD2      LEU  57   2.445  16.319 -10.973
  459   HD22  LEU  57          2HD2      LEU  57   1.754  15.044  -9.970
  460   HD23  LEU  57          3HD2      LEU  57   1.314  16.728  -9.683
  461    H    ASP  58           H        ASP  58  -3.500  17.263  -8.553
  462    HA   ASP  58           HA       ASP  58  -4.525  18.689 -10.816
  463    HB2  ASP  58          2HB       ASP  58  -5.380  16.028 -10.533
  464    HB3  ASP  58          3HB       ASP  58  -6.710  17.017  -9.938
  465    H    TYR  59           H        TYR  59  -5.741  20.386 -10.180
  466    HA   TYR  59           HA       TYR  59  -7.216  20.401  -7.722
  467    HB2  TYR  59          2HB       TYR  59  -4.720  20.809  -7.129
  468    HB3  TYR  59          3HB       TYR  59  -4.978  22.403  -7.831
  469    HD1  TYR  59           HD1      TYR  59  -7.069  20.228  -5.620
  470    HD2  TYR  59           HD2      TYR  59  -5.132  23.979  -6.154
  471    HE1  TYR  59           HE1      TYR  59  -8.006  21.010  -3.484
  472    HE2  TYR  59           HE2      TYR  59  -6.062  24.770  -4.019
  473    HH   TYR  59           HH       TYR  59  -8.457  22.947  -2.271
  474    H    LEU  60           H        LEU  60  -5.524  22.865  -9.669
  475    HA   LEU  60           HA       LEU  60  -6.276  24.733 -10.731
  476    HB2  LEU  60          2HB       LEU  60  -7.603  22.560 -11.763
  477    HB3  LEU  60          3HB       LEU  60  -8.917  23.670 -11.378
  478    HG   LEU  60           HG       LEU  60  -6.578  24.233 -13.200
  479   HD11  LEU  60          1HD1      LEU  60  -8.349  24.348 -14.930
  480   HD12  LEU  60          2HD1      LEU  60  -9.503  23.751 -13.738
  481   HD13  LEU  60          3HD1      LEU  60  -8.147  22.739 -14.235
  482   HD21  LEU  60          1HD2      LEU  60  -7.289  26.227 -11.965
  483   HD22  LEU  60          2HD2      LEU  60  -8.949  25.962 -12.499
  484   HD23  LEU  60          3HD2      LEU  60  -7.692  26.341 -13.678
  Start of MODEL   19
    1    H    LEU   1           H        LEU   1   4.987   4.220   1.579
    2    HA   LEU   1           HA       LEU   1   7.138   3.924   2.620
    3    HB2  LEU   1          2HB       LEU   1   5.544   2.019   4.313
    4    HB3  LEU   1          3HB       LEU   1   7.306   2.023   4.290
    5    HG   LEU   1           HG       LEU   1   7.084   4.509   4.957
    6   HD11  LEU   1          1HD1      LEU   1   5.031   5.316   5.163
    7   HD12  LEU   1          2HD1      LEU   1   4.756   4.194   6.495
    8   HD13  LEU   1          3HD1      LEU   1   4.332   3.727   4.848
    9   HD21  LEU   1          1HD2      LEU   1   6.133   2.817   7.183
   10   HD22  LEU   1          2HD2      LEU   1   7.534   3.883   7.083
   11   HD23  LEU   1          3HD2      LEU   1   7.593   2.278   6.353
   12    H    LYS   2           H        LYS   2   5.863   2.972   0.257
   13    HA   LYS   2           HA       LYS   2   7.339   0.454  -0.101
   14    HB2  LYS   2          2HB       LYS   2   4.650   0.472  -0.031
   15    HB3  LYS   2          3HB       LYS   2   4.892   0.852  -1.731
   16    HG2  LYS   2          2HG       LYS   2   6.055  -1.172  -2.114
   17    HG3  LYS   2          3HG       LYS   2   6.188  -1.501  -0.385
   18    HD2  LYS   2          2HD       LYS   2   3.493  -1.217  -1.652
   19    HD3  LYS   2          3HD       LYS   2   4.384  -2.734  -1.803
   20    HE2  LYS   2          2HE       LYS   2   4.614  -2.122   0.875
   21    HE3  LYS   2          3HE       LYS   2   2.974  -1.607   0.484
   22    HZ1  LYS   2          1HZ       LYS   2   2.828  -3.849   1.121
   23    HZ2  LYS   2          2HZ       LYS   2   4.154  -4.305   0.175
   24    HZ3  LYS   2          3HZ       LYS   2   2.699  -3.861  -0.566
   25    H    GLU   3           H        GLU   3   8.147   0.081  -2.226
   26    HA   GLU   3           HA       GLU   3   9.177   0.684  -4.162
   27    HB2  GLU   3          2HB       GLU   3   6.578   1.583  -4.393
   28    HB3  GLU   3          3HB       GLU   3   7.523   3.017  -4.768
   29    HG2  GLU   3          2HG       GLU   3   8.519   2.033  -6.620
   30    HG3  GLU   3          3HG       GLU   3   8.128   0.401  -6.082
   31    H    ASN   4           H        ASN   4   9.905   2.907  -5.389
   32    HA   ASN   4           HA       ASN   4  11.085   4.616  -3.298
   33    HB2  ASN   4          2HB       ASN   4  12.385   3.613  -5.840
   34    HB3  ASN   4          3HB       ASN   4  13.093   4.811  -4.762
   35   HD21  ASN   4          1HD2      ASN   4  14.483   4.056  -3.351
   36   HD22  ASN   4          2HD2      ASN   4  14.534   2.445  -2.729
   37    H    ASP   5           H        ASP   5   8.671   5.215  -4.574
   38    HA   ASP   5           HA       ASP   5   9.427   7.686  -5.935
   39    HB2  ASP   5          2HB       ASP   5   7.406   5.729  -7.048
   40    HB3  ASP   5          3HB       ASP   5   7.712   7.345  -7.680
   41    H    HIS   6           H        HIS   6   6.374   5.945  -5.351
   42    HA   HIS   6           HA       HIS   6   4.952   8.243  -4.577
   43    HB2  HIS   6          2HB       HIS   6   3.926   6.109  -5.380
   44    HB3  HIS   6          3HB       HIS   6   4.329   5.379  -3.829
   45    HD1  HIS   6           HD1      HIS   6   2.591   8.640  -4.774
   46    HD2  HIS   6           HD2      HIS   6   2.085   5.310  -2.343
   47    HE1  HIS   6           HE1      HIS   6   0.433   9.029  -3.543
   48    H    ALA   7           H        ALA   7   6.872   5.948  -2.766
   49    HA   ALA   7           HA       ALA   7   5.981   6.681  -0.179
   50    HB1  ALA   7          1HB       ALA   7   8.251   5.133  -1.290
   51    HB2  ALA   7          2HB       ALA   7   8.407   5.735   0.361
   52    HB3  ALA   7          3HB       ALA   7   7.058   4.684  -0.070
   53    H    ARG   8           H        ARG   8   8.418   7.958  -2.345
   54    HA   ARG   8           HA       ARG   8   9.661   9.630  -0.373
   55    HB2  ARG   8          2HB       ARG   8  10.957   8.887  -2.276
   56    HB3  ARG   8          3HB       ARG   8   9.812   9.623  -3.390
   57    HG2  ARG   8          2HG       ARG   8  10.916  11.538  -3.322
   58    HG3  ARG   8          3HG       ARG   8  10.761  11.606  -1.566
   59    HD2  ARG   8          2HD       ARG   8  13.070  11.634  -1.958
   60    HD3  ARG   8          3HD       ARG   8  12.715   9.968  -1.501
   61    HE   ARG   8           HE       ARG   8  12.597  10.266  -4.311
   62   HH11  ARG   8          1HH1      ARG   8  16.144   9.466  -2.635
   63   HH12  ARG   8          2HH1      ARG   8  14.855  10.102  -1.666
   64   HH21  ARG   8          1HH2      ARG   8  15.819   9.084  -4.870
   65   HH22  ARG   8          2HH2      ARG   8  14.286   9.429  -5.596
   66    H    PHE   9           H        PHE   9   7.415  10.182  -3.072
   67    HA   PHE   9           HA       PHE   9   7.147  12.944  -2.788
   68    HB2  PHE   9          2HB       PHE   9   5.875  10.857  -4.277
   69    HB3  PHE   9          3HB       PHE   9   4.633  11.898  -3.590
   70    HD1  PHE   9           HD1      PHE   9   3.909  13.577  -4.959
   71    HD2  PHE   9           HD2      PHE   9   7.969  12.326  -5.217
   72    HE1  PHE   9           HE1      PHE   9   4.298  15.222  -6.748
   73    HE2  PHE   9           HE2      PHE   9   8.365  13.969  -7.006
   74    HZ   PHE   9           HZ       PHE   9   6.528  15.420  -7.773
   75    H    LEU  10           H        LEU  10   5.478  10.297  -1.168
   76    HA   LEU  10           HA       LEU  10   3.552  11.905   0.156
   77    HB2  LEU  10          2HB       LEU  10   4.000   9.210  -0.155
   78    HB3  LEU  10          3HB       LEU  10   4.337   9.469   1.555
   79    HG   LEU  10           HG       LEU  10   1.804  10.564   0.442
   80   HD11  LEU  10          1HD1      LEU  10   2.486   7.887   0.032
   81   HD12  LEU  10          2HD1      LEU  10   0.885   8.616  -0.086
   82   HD13  LEU  10          3HD1      LEU  10   1.416   7.893   1.433
   83   HD21  LEU  10          1HD2      LEU  10   1.150   9.515   2.774
   84   HD22  LEU  10          2HD2      LEU  10   1.950  11.083   2.661
   85   HD23  LEU  10          3HD2      LEU  10   2.887   9.640   3.052
   86    H    GLN  11           H        GLN  11   6.649  10.511   1.208
   87    HA   GLN  11           HA       GLN  11   6.664  11.376   3.832
   88    HB2  GLN  11          2HB       GLN  11   8.397   9.986   2.373
   89    HB3  GLN  11          3HB       GLN  11   9.209  11.544   2.291
   90    HG2  GLN  11          2HG       GLN  11  10.189  10.914   4.188
   91    HG3  GLN  11          3HG       GLN  11   8.660  11.352   4.949
   92   HE21  GLN  11          1HE2      GLN  11   6.988   9.402   4.471
   93   HE22  GLN  11          2HE2      GLN  11   7.571   7.879   5.043
   94    H    THR  12           H        THR  12   7.175  13.191   0.909
   95    HA   THR  12           HA       THR  12   8.333  15.483   2.180
   96    HB   THR  12           HB       THR  12   7.169  15.033  -0.563
   97    HG1  THR  12           HG1      THR  12   9.810  15.796   0.129
   98   HG21  THR  12          1HG2      THR  12   8.293  17.340  -0.991
   99   HG22  THR  12          2HG2      THR  12   8.057  17.579   0.740
  100   HG23  THR  12          3HG2      THR  12   6.669  17.285  -0.307
  101    H    ALA  13           H        ALA  13   5.167  14.963   0.612
  102    HA   ALA  13           HA       ALA  13   3.960  17.335   1.355
  103    HB1  ALA  13          1HB       ALA  13   2.427  16.383   0.058
  104    HB2  ALA  13          2HB       ALA  13   3.100  14.776   0.338
  105    HB3  ALA  13          3HB       ALA  13   1.918  15.445   1.463
  106    H    LYS  14           H        LYS  14   4.345  14.365   3.202
  107    HA   LYS  14           HA       LYS  14   2.664  15.191   5.365
  108    HB2  LYS  14          2HB       LYS  14   4.634  12.959   4.964
  109    HB3  LYS  14          3HB       LYS  14   3.939  13.266   6.550
  110    HG2  LYS  14          2HG       LYS  14   1.875  13.195   4.553
  111    HG3  LYS  14          3HG       LYS  14   2.859  11.732   4.483
  112    HD2  LYS  14          2HD       LYS  14   2.320  11.109   6.647
  113    HD3  LYS  14          3HD       LYS  14   1.899  12.756   7.123
  114    HE2  LYS  14          2HE       LYS  14  -0.026  12.531   5.436
  115    HE3  LYS  14          3HE       LYS  14   0.309  10.801   5.493
  116    HZ1  LYS  14          1HZ       LYS  14  -1.088  12.418   7.363
  117    HZ2  LYS  14          2HZ       LYS  14   0.198  11.619   8.117
  118    HZ3  LYS  14          3HZ       LYS  14  -0.975  10.732   7.282
  119    H    ASN  15           H        ASN  15   6.176  15.056   4.854
  120    HA   ASN  15           HA       ASN  15   6.960  15.970   7.377
  121    HB2  ASN  15          2HB       ASN  15   8.509  14.979   5.727
  122    HB3  ASN  15          3HB       ASN  15   8.350  16.419   4.726
  123   HD21  ASN  15          1HD2      ASN  15   9.365  15.290   7.906
  124   HD22  ASN  15          2HD2      ASN  15  10.557  16.515   8.159
  125    H    ILE  16           H        ILE  16   5.547  17.638   4.720
  126    HA   ILE  16           HA       ILE  16   6.466  20.258   5.387
  127    HB   ILE  16           HB       ILE  16   4.138  19.337   3.702
  128   HG12  ILE  16          2HG1      ILE  16   6.579  20.717   2.664
  129   HG13  ILE  16          3HG1      ILE  16   6.688  19.012   3.088
  130   HG21  ILE  16          1HG2      ILE  16   3.356  21.417   3.929
  131   HG22  ILE  16          2HG2      ILE  16   4.844  21.986   4.684
  132   HG23  ILE  16          3HG2      ILE  16   4.722  21.907   2.927
  133   HD11  ILE  16          1HD1      ILE  16   5.663  20.205   0.724
  134   HD12  ILE  16          2HD1      ILE  16   5.849  18.495   1.115
  135   HD13  ILE  16          3HD1      ILE  16   4.358  19.338   1.534
  136    H    THR  17           H        THR  17   3.323  18.624   5.800
  137    HA   THR  17           HA       THR  17   2.293  20.732   7.455
  138    HB   THR  17           HB       THR  17   1.027  18.027   7.410
  139    HG1  THR  17           HG1      THR  17   1.212  19.818   5.209
  140   HG21  THR  17          1HG2      THR  17  -0.421  19.375   8.507
  141   HG22  THR  17          2HG2      THR  17  -0.904  19.843   6.876
  142   HG23  THR  17          3HG2      THR  17   0.233  20.842   7.780
  143    H    GLU  18           H        GLU  18   4.141  17.890   7.973
  144    HA   GLU  18           HA       GLU  18   3.372  17.507  10.719
  145    HB2  GLU  18          2HB       GLU  18   4.124  15.592   9.455
  146    HB3  GLU  18          3HB       GLU  18   5.649  16.384   9.082
  147    HG2  GLU  18          2HG       GLU  18   6.373  16.235  11.339
  148    HG3  GLU  18          3HG       GLU  18   4.780  15.706  11.877
  149    H    ARG  19           H        ARG  19   6.037  19.039   8.991
  150    HA   ARG  19           HA       ARG  19   7.594  19.617  11.295
  151    HB2  ARG  19          2HB       ARG  19   8.384  19.566   8.877
  152    HB3  ARG  19          3HB       ARG  19   7.640  21.149   8.698
  153    HG2  ARG  19          2HG       ARG  19   9.142  21.584  10.887
  154    HG3  ARG  19          3HG       ARG  19  10.121  20.364  10.069
  155    HD2  ARG  19          2HD       ARG  19   9.957  21.763   7.994
  156    HD3  ARG  19          3HD       ARG  19   9.197  23.015   8.976
  157    HE   ARG  19           HE       ARG  19  11.527  22.437  10.278
  158   HH11  ARG  19          1HH1      ARG  19  12.167  24.303   6.795
  159   HH12  ARG  19          2HH1      ARG  19  10.685  23.443   7.054
  160   HH21  ARG  19          1HH2      ARG  19  13.757  24.371   8.443
  161   HH22  ARG  19          2HH2      ARG  19  13.482  23.565   9.950
  162    H    VAL  20           H        VAL  20   5.306  21.537   9.372
  163    HA   VAL  20           HA       VAL  20   5.547  23.962  10.702
  164    HB   VAL  20           HB       VAL  20   4.272  23.813   8.663
  165   HG11  VAL  20          1HG1      VAL  20   2.147  22.296  10.160
  166   HG12  VAL  20          2HG1      VAL  20   2.226  22.634   8.430
  167   HG13  VAL  20          3HG1      VAL  20   3.373  21.513   9.164
  168   HG21  VAL  20          1HG2      VAL  20   3.683  25.647  10.102
  169   HG22  VAL  20          2HG2      VAL  20   2.215  25.031   9.342
  170   HG23  VAL  20          3HG2      VAL  20   2.575  24.625  11.020
  171    H    SER  21           H        SER  21   3.434  21.207  11.436
  172    HA   SER  21           HA       SER  21   2.015  22.343  13.552
  173    HB2  SER  21          2HB       SER  21   1.040  20.351  13.076
  174    HB3  SER  21          3HB       SER  21   2.563  19.613  12.579
  175    HG   SER  21           HG       SER  21   1.321  19.095  14.753
  176    H    MET  22           H        MET  22   4.862  20.198  13.745
  177    HA   MET  22           HA       MET  22   5.252  20.434  16.502
  178    HB2  MET  22          2HB       MET  22   6.938  19.607  14.193
  179    HB3  MET  22          3HB       MET  22   7.754  19.955  15.711
  180    HG2  MET  22          2HG       MET  22   5.688  18.358  16.516
  181    HG3  MET  22          3HG       MET  22   6.102  17.680  14.944
  182    HE1  MET  22          1HE       MET  22   9.514  18.559  15.210
  183    HE2  MET  22          2HE       MET  22   9.864  16.836  15.343
  184    HE3  MET  22          3HE       MET  22   8.603  17.398  14.245
  185    H    ALA  23           H        ALA  23   6.158  22.531  13.870
  186    HA   ALA  23           HA       ALA  23   8.087  24.071  15.276
  187    HB1  ALA  23          1HB       ALA  23   7.336  25.794  13.411
  188    HB2  ALA  23          2HB       ALA  23   8.327  24.384  13.031
  189    HB3  ALA  23          3HB       ALA  23   6.590  24.350  12.727
  190    H    THR  24           H        THR  24   4.631  24.556  14.602
  191    HA   THR  24           HA       THR  24   4.508  26.998  16.105
  192    HB   THR  24           HB       THR  24   1.985  25.548  15.601
  193    HG1  THR  24           HG1      THR  24   2.316  26.359  13.276
  194   HG21  THR  24          1HG2      THR  24   1.473  27.820  14.558
  195   HG22  THR  24          2HG2      THR  24   3.045  28.331  15.174
  196   HG23  THR  24          3HG2      THR  24   1.792  27.793  16.292
  197    H    ALA  25           H        ALA  25   4.185  23.637  16.810
  198    HA   ALA  25           HA       ALA  25   2.667  23.972  19.228
  199    HB1  ALA  25          1HB       ALA  25   3.697  21.515  19.508
  200    HB2  ALA  25          2HB       ALA  25   2.293  21.864  18.498
  201    HB3  ALA  25          3HB       ALA  25   3.891  21.715  17.767
  202    H    SER  26           H        SER  26   5.997  24.102  18.341
  203    HA   SER  26           HA       SER  26   6.823  23.957  21.156
  204    HB2  SER  26          2HB       SER  26   7.931  22.749  18.963
  205    HB3  SER  26          3HB       SER  26   8.930  24.194  19.115
  206    HG   SER  26           HG       SER  26   9.758  23.440  20.909
  207    H    SER  27           H        SER  27   6.652  26.052  18.379
  208    HA   SER  27           HA       SER  27   8.394  28.084  19.233
  209    HB2  SER  27          2HB       SER  27   7.676  28.103  16.957
  210    HB3  SER  27          3HB       SER  27   5.976  28.132  17.422
  211    HG   SER  27           HG       SER  27   6.348  30.208  17.023
  212    H    GLN  28           H        GLN  28   4.869  27.764  19.605
  213    HA   GLN  28           HA       GLN  28   4.963  29.878  21.647
  214    HB2  GLN  28          2HB       GLN  28   2.910  29.023  19.675
  215    HB3  GLN  28          3HB       GLN  28   2.336  29.614  21.229
  216    HG2  GLN  28          2HG       GLN  28   4.085  31.552  20.646
  217    HG3  GLN  28          3HG       GLN  28   3.643  31.055  19.013
  218   HE21  GLN  28          1HE2      GLN  28   2.273  32.520  18.280
  219   HE22  GLN  28          2HE2      GLN  28   0.872  33.099  19.109
  220    H    VAL  29           H        VAL  29   2.599  27.293  21.122
  221    HA   VAL  29           HA       VAL  29   3.343  25.596  23.197
  222    HB   VAL  29           HB       VAL  29   2.959  27.357  24.769
  223   HG11  VAL  29          1HG1      VAL  29   1.578  28.785  23.324
  224   HG12  VAL  29          2HG1      VAL  29   0.217  27.685  23.553
  225   HG13  VAL  29          3HG1      VAL  29   0.868  28.582  24.926
  226   HG21  VAL  29          1HG2      VAL  29   0.394  25.884  25.054
  227   HG22  VAL  29          2HG2      VAL  29   1.889  24.948  25.033
  228   HG23  VAL  29          3HG2      VAL  29   1.652  26.206  26.247
  229    H    LEU  30           H        LEU  30   0.754  27.050  21.345
  230    HA   LEU  30           HA       LEU  30  -1.000  26.139  20.217
  231    HB2  LEU  30          2HB       LEU  30   0.851  24.323  19.871
  232    HB3  LEU  30          3HB       LEU  30  -0.146  23.381  20.977
  233    HG   LEU  30           HG       LEU  30  -1.940  24.296  19.072
  234   HD11  LEU  30          1HD1      LEU  30  -0.630  24.928  17.348
  235   HD12  LEU  30          2HD1      LEU  30  -0.563  23.191  17.051
  236   HD13  LEU  30          3HD1      LEU  30   0.754  23.990  17.911
  237   HD21  LEU  30          1HD2      LEU  30  -2.078  22.129  20.029
  238   HD22  LEU  30          2HD2      LEU  30  -0.491  21.678  19.406
  239   HD23  LEU  30          3HD2      LEU  30  -1.843  21.906  18.296
  240    H    ILE  31           H        ILE  31  -2.268  27.049  21.975
  241    HA   ILE  31           HA       ILE  31  -3.882  25.001  23.245
  242    HB   ILE  31           HB       ILE  31  -3.782  26.182  25.465
  243   HG12  ILE  31          2HG1      ILE  31  -1.111  27.194  25.165
  244   HG13  ILE  31          3HG1      ILE  31  -2.162  27.971  23.986
  245   HG21  ILE  31          1HG2      ILE  31  -2.679  24.041  25.078
  246   HG22  ILE  31          2HG2      ILE  31  -1.242  24.879  24.495
  247   HG23  ILE  31          3HG2      ILE  31  -1.738  25.047  26.179
  248   HD11  ILE  31          1HD1      ILE  31  -1.842  28.971  26.378
  249   HD12  ILE  31          2HD1      ILE  31  -3.420  29.003  25.590
  250   HD13  ILE  31          3HD1      ILE  31  -3.069  27.780  26.811
  251    HA   PRO  32           HA       PRO  32  -7.138  27.832  22.430
  252    HB2  PRO  32          2HB       PRO  32  -8.888  27.202  24.407
  253    HB3  PRO  32          3HB       PRO  32  -8.587  26.149  23.019
  254    HG2  PRO  32          2HG       PRO  32  -7.478  25.988  25.795
  255    HG3  PRO  32          3HG       PRO  32  -8.083  24.686  24.755
  256    HD2  PRO  32          2HD       PRO  32  -5.442  25.192  25.067
  257    HD3  PRO  32          3HD       PRO  32  -6.121  24.564  23.552
  258    H    GLU  33           H        GLU  33  -6.130  29.828  22.859
  259    HA   GLU  33           HA       GLU  33  -6.320  30.849  25.601
  260    HB2  GLU  33          2HB       GLU  33  -4.503  31.283  23.382
  261    HB3  GLU  33          3HB       GLU  33  -5.123  32.804  24.007
  262    HG2  GLU  33          2HG       GLU  33  -4.472  31.378  26.280
  263    HG3  GLU  33          3HG       GLU  33  -3.184  30.980  25.144
  264    H    ILE  34           H        ILE  34  -6.608  32.484  22.458
  265    HA   ILE  34           HA       ILE  34  -9.335  33.286  23.062
  266    HB   ILE  34           HB       ILE  34  -7.153  35.337  22.671
  267   HG12  ILE  34          2HG1      ILE  34  -8.910  34.725  25.057
  268   HG13  ILE  34          3HG1      ILE  34  -7.181  34.419  24.938
  269   HG21  ILE  34          1HG2      ILE  34  -8.937  36.991  22.950
  270   HG22  ILE  34          2HG2      ILE  34  -9.210  35.973  21.538
  271   HG23  ILE  34          3HG2      ILE  34 -10.127  35.692  23.017
  272   HD11  ILE  34          1HD1      ILE  34  -7.164  37.030  24.441
  273   HD12  ILE  34          2HD1      ILE  34  -8.636  36.943  25.408
  274   HD13  ILE  34          3HD1      ILE  34  -7.108  36.367  26.074
  275    H    ASN  35           H        ASN  35  -6.565  33.801  20.888
  276    HA   ASN  35           HA       ASN  35  -8.319  33.247  18.615
  277    HB2  ASN  35          2HB       ASN  35  -8.127  35.755  18.993
  278    HB3  ASN  35          3HB       ASN  35  -6.424  35.596  18.576
  279   HD21  ASN  35          1HD2      ASN  35  -8.475  37.101  17.219
  280   HD22  ASN  35          2HD2      ASN  35  -8.562  36.480  15.610
  281    H    LEU  36           H        LEU  36  -6.698  31.363  19.475
  282    HA   LEU  36           HA       LEU  36  -4.221  31.543  17.906
  283    HB2  LEU  36          2HB       LEU  36  -3.680  30.941  20.093
  284    HB3  LEU  36          3HB       LEU  36  -5.067  29.863  20.236
  285    HG   LEU  36           HG       LEU  36  -2.971  29.145  18.260
  286   HD11  LEU  36          1HD1      LEU  36  -2.617  28.928  21.243
  287   HD12  LEU  36          2HD1      LEU  36  -1.576  29.774  20.098
  288   HD13  LEU  36          3HD1      LEU  36  -1.679  28.013  20.062
  289   HD21  LEU  36          1HD2      LEU  36  -4.310  27.368  18.242
  290   HD22  LEU  36          2HD2      LEU  36  -5.167  27.911  19.685
  291   HD23  LEU  36          3HD2      LEU  36  -3.678  26.979  19.842
  292    H    ASN  37           H        ASN  37  -7.318  30.143  17.931
  293    HA   ASN  37           HA       ASN  37  -6.710  27.774  16.451
  294    HB2  ASN  37          2HB       ASN  37  -8.731  27.949  17.844
  295    HB3  ASN  37          3HB       ASN  37  -9.344  29.225  16.796
  296   HD21  ASN  37          1HD2      ASN  37  -8.203  25.876  16.703
  297   HD22  ASN  37          2HD2      ASN  37  -9.309  25.351  15.484
  298    H    ASP  38           H        ASP  38  -8.151  30.911  15.585
  299    HA   ASP  38           HA       ASP  38  -8.451  30.419  12.848
  300    HB2  ASP  38          2HB       ASP  38  -8.799  32.614  14.610
  301    HB3  ASP  38          3HB       ASP  38  -7.804  33.178  13.271
  302    H    THR  39           H        THR  39  -5.795  32.050  14.570
  303    HA   THR  39           HA       THR  39  -4.182  32.582  12.362
  304    HB   THR  39           HB       THR  39  -2.489  31.926  14.562
  305    HG1  THR  39           HG1      THR  39  -3.507  32.963  16.241
  306   HG21  THR  39          1HG2      THR  39  -1.945  33.707  13.092
  307   HG22  THR  39          2HG2      THR  39  -2.298  34.451  14.651
  308   HG23  THR  39          3HG2      THR  39  -3.499  34.496  13.360
  309    H    PHE  40           H        PHE  40  -3.989  29.819  14.612
  310    HA   PHE  40           HA       PHE  40  -1.949  28.450  13.278
  311    HB2  PHE  40          2HB       PHE  40  -2.850  27.984  15.600
  312    HB3  PHE  40          3HB       PHE  40  -4.187  27.140  14.825
  313    HD1  PHE  40           HD1      PHE  40  -0.570  27.171  13.964
  314    HD2  PHE  40           HD2      PHE  40  -3.896  24.907  15.354
  315    HE1  PHE  40           HE1      PHE  40   0.788  25.121  13.865
  316    HE2  PHE  40           HE2      PHE  40  -2.543  22.854  15.258
  317    HZ   PHE  40           HZ       PHE  40  -0.198  22.960  14.514
  318    H    ASP  41           H        ASP  41  -5.452  28.355  12.863
  319    HA   ASP  41           HA       ASP  41  -5.633  26.179  11.129
  320    HB2  ASP  41          2HB       ASP  41  -7.319  28.504  11.807
  321    HB3  ASP  41          3HB       ASP  41  -7.629  27.792  10.226
  322    H    THR  42           H        THR  42  -5.602  29.633  10.230
  323    HA   THR  42           HA       THR  42  -5.369  29.262   7.480
  324    HB   THR  42           HB       THR  42  -5.684  31.446   8.993
  325    HG1  THR  42           HG1      THR  42  -5.415  32.599   7.048
  326   HG21  THR  42          1HG2      THR  42  -3.198  31.257   9.617
  327   HG22  THR  42          2HG2      THR  42  -3.798  32.835   9.106
  328   HG23  THR  42          3HG2      THR  42  -2.882  31.833   7.981
  329    H    PHE  43           H        PHE  43  -2.997  28.990   9.984
  330    HA   PHE  43           HA       PHE  43  -0.706  29.270   8.288
  331    HB2  PHE  43          2HB       PHE  43  -0.793  29.638  10.816
  332    HB3  PHE  43          3HB       PHE  43  -0.766  27.884  10.966
  333    HD1  PHE  43           HD1      PHE  43   1.300  27.377  11.875
  334    HD2  PHE  43           HD2      PHE  43   1.071  30.099   8.611
  335    HE1  PHE  43           HE1      PHE  43   3.756  27.404  11.728
  336    HE2  PHE  43           HE2      PHE  43   3.526  30.129   8.458
  337    HZ   PHE  43           HZ       PHE  43   4.872  28.780  10.018
  338    H    ALA  44           H        ALA  44  -2.299  26.495   9.848
  339    HA   ALA  44           HA       ALA  44  -0.646  24.542   8.622
  340    HB1  ALA  44          1HB       ALA  44  -2.865  23.141   9.248
  341    HB2  ALA  44          2HB       ALA  44  -1.610  23.569  10.411
  342    HB3  ALA  44          3HB       ALA  44  -3.072  24.548  10.291
  343    H    LEU  45           H        LEU  45  -3.919  25.725   7.893
  344    HA   LEU  45           HA       LEU  45  -4.626  24.079   5.825
  345    HB2  LEU  45          2HB       LEU  45  -6.288  25.546   6.354
  346    HB3  LEU  45          3HB       LEU  45  -5.186  26.915   6.489
  347    HG   LEU  45           HG       LEU  45  -5.110  27.132   4.077
  348   HD11  LEU  45          1HD1      LEU  45  -5.464  25.346   2.810
  349   HD12  LEU  45          2HD1      LEU  45  -7.184  25.495   3.170
  350   HD13  LEU  45          3HD1      LEU  45  -6.162  24.457   4.164
  351   HD21  LEU  45          1HD2      LEU  45  -8.023  26.849   4.564
  352   HD22  LEU  45          2HD2      LEU  45  -7.113  28.193   3.875
  353   HD23  LEU  45          3HD2      LEU  45  -7.115  27.931   5.619
  354    H    ASP  46           H        ASP  46  -2.990  27.223   5.398
  355    HA   ASP  46           HA       ASP  46  -2.498  27.081   2.696
  356    HB2  ASP  46          2HB       ASP  46  -1.842  28.838   4.671
  357    HB3  ASP  46          3HB       ASP  46  -0.259  28.175   4.273
  358    H    PHE  47           H        PHE  47  -0.369  25.935   5.309
  359    HA   PHE  47           HA       PHE  47   1.689  24.944   3.719
  360    HB2  PHE  47          2HB       PHE  47   0.811  24.644   6.488
  361    HB3  PHE  47          3HB       PHE  47   1.601  23.199   5.866
  362    HD1  PHE  47           HD1      PHE  47   3.775  23.889   4.343
  363    HD2  PHE  47           HD2      PHE  47   2.183  26.054   7.644
  364    HE1  PHE  47           HE1      PHE  47   5.973  24.929   4.717
  365    HE2  PHE  47           HE2      PHE  47   4.379  27.099   8.022
  366    HZ   PHE  47           HZ       PHE  47   6.277  26.537   6.557
  367    H    SER  48           H        SER  48  -1.381  23.504   4.627
  368    HA   SER  48           HA       SER  48  -0.732  20.923   3.527
  369    HB2  SER  48          2HB       SER  48  -2.320  21.213   5.426
  370    HB3  SER  48          3HB       SER  48  -3.438  22.021   4.328
  371    HG   SER  48           HG       SER  48  -3.783  20.147   3.276
  372    H    ARG  49           H        ARG  49  -2.094  23.881   2.380
  373    HA   ARG  49           HA       ARG  49  -3.627  22.998   0.228
  374    HB2  ARG  49          2HB       ARG  49  -3.075  25.419   1.229
  375    HB3  ARG  49          3HB       ARG  49  -1.980  25.442  -0.147
  376    HG2  ARG  49          2HG       ARG  49  -4.878  24.740  -0.453
  377    HG3  ARG  49          3HG       ARG  49  -4.313  26.412  -0.468
  378    HD2  ARG  49          2HD       ARG  49  -2.594  25.090  -2.198
  379    HD3  ARG  49          3HD       ARG  49  -4.175  24.385  -2.536
  380    HE   ARG  49           HE       ARG  49  -4.779  26.350  -3.521
  381   HH11  ARG  49          1HH1      ARG  49  -1.874  28.594  -1.924
  382   HH12  ARG  49          2HH1      ARG  49  -2.059  26.943  -1.431
  383   HH21  ARG  49          1HH2      ARG  49  -3.289  29.491  -3.486
  384   HH22  ARG  49          2HH2      ARG  49  -4.545  28.522  -4.179
  385    H    GLU  50           H        GLU  50  -0.167  23.808   0.347
  386    HA   GLU  50           HA       GLU  50   0.256  23.041  -2.391
  387    HB2  GLU  50          2HB       GLU  50   1.690  24.481  -0.418
  388    HB3  GLU  50          3HB       GLU  50   2.699  23.123  -0.895
  389    HG2  GLU  50          2HG       GLU  50   1.487  25.149  -2.762
  390    HG3  GLU  50          3HG       GLU  50   3.164  25.115  -2.221
  391    H    LYS  51           H        LYS  51   0.593  21.549   0.754
  392    HA   LYS  51           HA       LYS  51   2.202  19.363   0.032
  393    HB2  LYS  51          2HB       LYS  51   1.884  18.664   2.162
  394    HB3  LYS  51          3HB       LYS  51   1.188  20.266   2.367
  395    HG2  LYS  51          2HG       LYS  51  -0.456  18.994   3.294
  396    HG3  LYS  51          3HG       LYS  51  -1.017  19.040   1.621
  397    HD2  LYS  51          2HD       LYS  51   0.565  16.881   1.491
  398    HD3  LYS  51          3HD       LYS  51   0.105  16.796   3.193
  399    HE2  LYS  51          2HE       LYS  51  -2.192  16.658   2.665
  400    HE3  LYS  51          3HE       LYS  51  -1.914  17.142   0.992
  401    HZ1  LYS  51          1HZ       LYS  51  -0.455  14.787   1.689
  402    HZ2  LYS  51          2HZ       LYS  51  -1.525  15.049   0.405
  403    HZ3  LYS  51          3HZ       LYS  51  -2.119  14.582   1.918
  404    H    LYS  52           H        LYS  52  -1.186  20.004  -0.412
  405    HA   LYS  52           HA       LYS  52  -1.902  17.284  -1.002
  406    HB2  LYS  52          2HB       LYS  52  -3.630  18.675  -0.132
  407    HB3  LYS  52          3HB       LYS  52  -3.331  19.918  -1.340
  408    HG2  LYS  52          2HG       LYS  52  -5.354  18.725  -1.871
  409    HG3  LYS  52          3HG       LYS  52  -4.123  18.382  -3.089
  410    HD2  LYS  52          2HD       LYS  52  -5.112  16.302  -2.611
  411    HD3  LYS  52          3HD       LYS  52  -3.585  16.298  -1.726
  412    HE2  LYS  52          2HE       LYS  52  -4.604  16.320   0.292
  413    HE3  LYS  52          3HE       LYS  52  -5.918  17.356  -0.265
  414    HZ1  LYS  52          1HZ       LYS  52  -5.698  14.506  -1.041
  415    HZ2  LYS  52          2HZ       LYS  52  -7.039  15.525  -1.192
  416    HZ3  LYS  52          3HZ       LYS  52  -6.537  15.010   0.339
  417    H    LEU  53           H        LEU  53  -1.581  20.247  -2.959
  418    HA   LEU  53           HA       LEU  53  -2.059  19.157  -5.454
  419    HB2  LEU  53          2HB       LEU  53  -1.007  21.580  -4.403
  420    HB3  LEU  53          3HB       LEU  53   0.041  21.051  -5.717
  421    HG   LEU  53           HG       LEU  53  -1.678  22.622  -6.478
  422   HD11  LEU  53          1HD1      LEU  53  -0.782  20.817  -7.951
  423   HD12  LEU  53          2HD1      LEU  53  -2.386  21.396  -8.398
  424   HD13  LEU  53          3HD1      LEU  53  -2.208  19.859  -7.552
  425   HD21  LEU  53          1HD2      LEU  53  -3.698  20.493  -5.809
  426   HD22  LEU  53          2HD2      LEU  53  -3.997  22.123  -6.412
  427   HD23  LEU  53          3HD2      LEU  53  -3.381  21.886  -4.776
  428    H    LEU  54           H        LEU  54   0.719  18.826  -3.415
  429    HA   LEU  54           HA       LEU  54   2.530  17.970  -5.455
  430    HB2  LEU  54          2HB       LEU  54   3.520  18.859  -3.524
  431    HB3  LEU  54          3HB       LEU  54   2.543  17.852  -2.458
  432    HG   LEU  54           HG       LEU  54   4.458  16.495  -4.284
  433   HD11  LEU  54          1HD1      LEU  54   6.200  16.783  -2.458
  434   HD12  LEU  54          2HD1      LEU  54   5.233  18.147  -1.898
  435   HD13  LEU  54          3HD1      LEU  54   5.923  18.164  -3.521
  436   HD21  LEU  54          1HD2      LEU  54   2.934  15.936  -1.877
  437   HD22  LEU  54          2HD2      LEU  54   4.630  15.480  -1.719
  438   HD23  LEU  54          3HD2      LEU  54   3.661  14.826  -3.040
  439    H    GLU  55           H        GLU  55   0.810  16.233  -2.857
  440    HA   GLU  55           HA       GLU  55   1.560  13.655  -3.709
  441    HB2  GLU  55          2HB       GLU  55   0.567  14.397  -1.453
  442    HB3  GLU  55          3HB       GLU  55  -0.997  14.258  -2.242
  443    HG2  GLU  55          2HG       GLU  55  -0.326  11.884  -2.829
  444    HG3  GLU  55          3HG       GLU  55   1.003  12.094  -1.690
  445    H    CYS  56           H        CYS  56  -1.694  15.105  -3.903
  446    HA   CYS  56           HA       CYS  56  -2.111  13.578  -6.389
  447    HB2  CYS  56          2HB       CYS  56  -3.879  14.112  -4.051
  448    HB3  CYS  56          3HB       CYS  56  -4.629  14.039  -5.641
  449    HG   CYS  56           HG       CYS  56  -5.003  11.557  -4.509
  450    H    LEU  57           H        LEU  57  -3.067  14.589  -8.135
  451    HA   LEU  57           HA       LEU  57  -2.834  17.476  -8.162
  452    HB2  LEU  57          2HB       LEU  57  -3.579  15.543 -10.352
  453    HB3  LEU  57          3HB       LEU  57  -3.263  17.264 -10.567
  454    HG   LEU  57           HG       LEU  57  -0.978  16.214  -9.322
  455   HD11  LEU  57          1HD1      LEU  57  -1.914  13.986 -10.043
  456   HD12  LEU  57          2HD1      LEU  57  -0.301  14.373 -10.640
  457   HD13  LEU  57          3HD1      LEU  57  -1.696  14.529 -11.707
  458   HD21  LEU  57          1HD2      LEU  57  -1.321  18.033 -11.090
  459   HD22  LEU  57          2HD2      LEU  57  -1.255  16.721 -12.267
  460   HD23  LEU  57          3HD2      LEU  57   0.125  17.032 -11.213
  461    H    ASP  58           H        ASP  58  -4.537  18.820  -9.143
  462    HA   ASP  58           HA       ASP  58  -7.249  17.771  -8.748
  463    HB2  ASP  58          2HB       ASP  58  -6.955  18.899  -6.709
  464    HB3  ASP  58          3HB       ASP  58  -6.041  20.204  -7.459
  465    H    TYR  59           H        TYR  59  -5.553  20.767  -9.692
  466    HA   TYR  59           HA       TYR  59  -6.944  20.704 -12.259
  467    HB2  TYR  59          2HB       TYR  59  -8.162  22.134 -10.430
  468    HB3  TYR  59          3HB       TYR  59  -6.887  23.301 -10.764
  469    HD1  TYR  59           HD1      TYR  59  -6.574  24.020 -13.219
  470    HD2  TYR  59           HD2      TYR  59 -10.064  22.058 -11.778
  471    HE1  TYR  59           HE1      TYR  59  -7.835  24.848 -15.162
  472    HE2  TYR  59           HE2      TYR  59 -11.333  22.879 -13.718
  473    HH   TYR  59           HH       TYR  59  -9.780  24.458 -16.397
  474    H    LEU  60           H        LEU  60  -4.920  22.966 -10.382
  475    HA   LEU  60           HA       LEU  60  -2.736  22.633 -12.256
  476    HB2  LEU  60          2HB       LEU  60  -4.351  24.393 -13.163
  477    HB3  LEU  60          3HB       LEU  60  -3.819  25.399 -11.817
  478    HG   LEU  60           HG       LEU  60  -1.451  24.619 -12.998
  479   HD11  LEU  60          1HD1      LEU  60  -3.343  25.375 -15.212
  480   HD12  LEU  60          2HD1      LEU  60  -2.844  23.716 -14.885
  481   HD13  LEU  60          3HD1      LEU  60  -1.643  24.923 -15.341
  482   HD21  LEU  60          1HD2      LEU  60  -1.408  26.796 -12.429
  483   HD22  LEU  60          2HD2      LEU  60  -3.109  27.043 -12.828
  484   HD23  LEU  60          3HD2      LEU  60  -1.893  27.045 -14.106
  Start of MODEL   20
    1    H    LEU   1           H        LEU   1   9.278  -5.437  -5.938
    2    HA   LEU   1           HA       LEU   1  10.383  -3.723  -4.685
    3    HB2  LEU   1          2HB       LEU   1   7.866  -2.527  -5.833
    4    HB3  LEU   1          3HB       LEU   1   9.368  -1.672  -5.491
    5    HG   LEU   1           HG       LEU   1   9.231  -3.917  -7.486
    6   HD11  LEU   1          1HD1      LEU   1   9.220  -1.926  -9.143
    7   HD12  LEU   1          2HD1      LEU   1   8.493  -1.037  -7.805
    8   HD13  LEU   1          3HD1      LEU   1   7.697  -2.476  -8.443
    9   HD21  LEU   1          1HD2      LEU   1  11.086  -1.600  -7.632
   10   HD22  LEU   1          2HD2      LEU   1  11.329  -3.278  -8.118
   11   HD23  LEU   1          3HD2      LEU   1  11.390  -2.836  -6.411
   12    H    LYS   2           H        LYS   2   9.904  -1.679  -3.327
   13    HA   LYS   2           HA       LYS   2   7.936  -2.363  -1.242
   14    HB2  LYS   2          2HB       LYS   2  10.689  -2.321  -0.946
   15    HB3  LYS   2          3HB       LYS   2  10.191  -0.753  -0.324
   16    HG2  LYS   2          2HG       LYS   2   9.152  -3.427   0.590
   17    HG3  LYS   2          3HG       LYS   2  10.310  -2.409   1.449
   18    HD2  LYS   2          2HD       LYS   2   8.654  -0.683   1.736
   19    HD3  LYS   2          3HD       LYS   2   7.502  -1.569   0.734
   20    HE2  LYS   2          2HE       LYS   2   8.656  -2.777   3.226
   21    HE3  LYS   2          3HE       LYS   2   7.260  -1.703   3.293
   22    HZ1  LYS   2          1HZ       LYS   2   6.480  -3.931   3.176
   23    HZ2  LYS   2          2HZ       LYS   2   7.463  -4.284   1.846
   24    HZ3  LYS   2          3HZ       LYS   2   6.165  -3.213   1.676
   25    H    GLU   3           H        GLU   3   7.555  -0.639  -3.533
   26    HA   GLU   3           HA       GLU   3   6.638   1.378  -4.047
   27    HB2  GLU   3          2HB       GLU   3   6.111   1.061  -1.155
   28    HB3  GLU   3          3HB       GLU   3   5.973   2.698  -1.781
   29    HG2  GLU   3          2HG       GLU   3   4.231   2.136  -3.216
   30    HG3  GLU   3          3HG       GLU   3   4.589   0.412  -3.126
   31    H    ASN   4           H        ASN   4   8.457   2.332  -4.922
   32    HA   ASN   4           HA       ASN   4  10.006   4.068  -3.114
   33    HB2  ASN   4          2HB       ASN   4  11.772   3.992  -4.901
   34    HB3  ASN   4          3HB       ASN   4  11.463   2.447  -4.116
   35   HD21  ASN   4          1HD2      ASN   4  11.872   0.984  -5.629
   36   HD22  ASN   4          2HD2      ASN   4  11.169   0.952  -7.207
   37    H    ASP   5           H        ASP   5   7.419   4.619  -4.458
   38    HA   ASP   5           HA       ASP   5   8.260   7.056  -5.872
   39    HB2  ASP   5          2HB       ASP   5   7.286   5.051  -7.301
   40    HB3  ASP   5          3HB       ASP   5   5.747   5.683  -6.723
   41    H    HIS   6           H        HIS   6   5.481   5.407  -4.373
   42    HA   HIS   6           HA       HIS   6   4.142   7.875  -3.788
   43    HB2  HIS   6          2HB       HIS   6   3.119   5.513  -4.161
   44    HB3  HIS   6          3HB       HIS   6   3.495   5.260  -2.460
   45    HD1  HIS   6           HD1      HIS   6   0.864   5.060  -2.141
   46    HD2  HIS   6           HD2      HIS   6   2.259   8.811  -3.256
   47    HE1  HIS   6           HE1      HIS   6  -1.025   6.650  -1.662
   48    H    ALA   7           H        ALA   7   6.098   5.565  -1.976
   49    HA   ALA   7           HA       ALA   7   5.704   6.516   0.602
   50    HB1  ALA   7          1HB       ALA   7   7.282   5.035   1.160
   51    HB2  ALA   7          2HB       ALA   7   7.278   4.592  -0.547
   52    HB3  ALA   7          3HB       ALA   7   8.467   5.743   0.062
   53    H    ARG   8           H        ARG   8   8.186   7.504  -1.756
   54    HA   ARG   8           HA       ARG   8   9.428   9.439  -0.164
   55    HB2  ARG   8          2HB       ARG   8   9.160   9.696  -3.150
   56    HB3  ARG   8          3HB       ARG   8  10.503  10.184  -2.125
   57    HG2  ARG   8          2HG       ARG   8  10.295   7.452  -1.713
   58    HG3  ARG   8          3HG       ARG   8  10.001   7.662  -3.440
   59    HD2  ARG   8          2HD       ARG   8  12.341   7.375  -3.170
   60    HD3  ARG   8          3HD       ARG   8  12.072   9.084  -3.512
   61    HE   ARG   8           HE       ARG   8  12.844   9.598  -1.412
   62   HH11  ARG   8          1HH1      ARG   8  12.982   5.817  -0.101
   63   HH12  ARG   8          2HH1      ARG   8  12.233   6.177  -1.622
   64   HH21  ARG   8          1HH2      ARG   8  13.890   7.502   1.158
   65   HH22  ARG   8          2HH2      ARG   8  13.832   9.137   0.592
   66    H    PHE   9           H        PHE   9   6.926   9.868  -2.668
   67    HA   PHE   9           HA       PHE   9   6.567  12.602  -2.412
   68    HB2  PHE   9          2HB       PHE   9   5.101  10.378  -3.570
   69    HB3  PHE   9          3HB       PHE   9   4.014  11.602  -2.923
   70    HD1  PHE   9           HD1      PHE   9   3.156  12.703  -4.767
   71    HD2  PHE   9           HD2      PHE   9   7.345  11.984  -4.531
   72    HE1  PHE   9           HE1      PHE   9   3.502  14.073  -6.781
   73    HE2  PHE   9           HE2      PHE   9   7.697  13.353  -6.544
   74    HZ   PHE   9           HZ       PHE   9   5.775  14.401  -7.672
   75    H    LEU  10           H        LEU  10   4.919   9.982  -0.671
   76    HA   LEU  10           HA       LEU  10   3.179  11.556   0.840
   77    HB2  LEU  10          2HB       LEU  10   4.028   8.831   0.765
   78    HB3  LEU  10          3HB       LEU  10   4.002   9.376   2.441
   79    HG   LEU  10           HG       LEU  10   1.609   9.978   0.802
   80   HD11  LEU  10          1HD1      LEU  10   2.458   7.554   0.342
   81   HD12  LEU  10          2HD1      LEU  10   0.758   7.845   0.708
   82   HD13  LEU  10          3HD1      LEU  10   1.838   7.241   1.964
   83   HD21  LEU  10          1HD2      LEU  10   0.651  10.202   2.808
   84   HD22  LEU  10          2HD2      LEU  10   2.293  10.173   3.451
   85   HD23  LEU  10          3HD2      LEU  10   1.338   8.691   3.404
   86    H    GLN  11           H        GLN  11   6.488  10.495   1.533
   87    HA   GLN  11           HA       GLN  11   6.725  11.440   4.131
   88    HB2  GLN  11          2HB       GLN  11   8.600  10.814   1.932
   89    HB3  GLN  11          3HB       GLN  11   9.225  11.869   3.193
   90    HG2  GLN  11          2HG       GLN  11   8.236  10.034   4.781
   91    HG3  GLN  11          3HG       GLN  11   8.380   9.022   3.345
   92   HE21  GLN  11          1HE2      GLN  11  10.200   7.944   3.214
   93   HE22  GLN  11          2HE2      GLN  11  11.725   8.424   3.865
   94    H    THR  12           H        THR  12   6.763  13.166   1.107
   95    HA   THR  12           HA       THR  12   7.845  15.596   2.173
   96    HB   THR  12           HB       THR  12   6.444  14.952  -0.419
   97    HG1  THR  12           HG1      THR  12   9.104  15.840   0.068
   98   HG21  THR  12          1HG2      THR  12   7.413  17.320  -1.005
   99   HG22  THR  12          2HG2      THR  12   7.240  17.591   0.730
  100   HG23  THR  12          3HG2      THR  12   5.831  17.167  -0.242
  101    H    ALA  13           H        ALA  13   4.590  14.699   1.013
  102    HA   ALA  13           HA       ALA  13   3.230  16.988   1.707
  103    HB1  ALA  13          1HB       ALA  13   1.619  15.774   0.784
  104    HB2  ALA  13          2HB       ALA  13   2.545  14.291   1.019
  105    HB3  ALA  13          3HB       ALA  13   1.478  14.877   2.296
  106    H    LYS  14           H        LYS  14   3.902  14.163   3.748
  107    HA   LYS  14           HA       LYS  14   2.544  15.169   6.033
  108    HB2  LYS  14          2HB       LYS  14   3.880  12.779   5.298
  109    HB3  LYS  14          3HB       LYS  14   4.636  13.358   6.776
  110    HG2  LYS  14          2HG       LYS  14   2.753  13.057   8.025
  111    HG3  LYS  14          3HG       LYS  14   1.669  13.301   6.653
  112    HD2  LYS  14          2HD       LYS  14   2.225  11.114   5.780
  113    HD3  LYS  14          3HD       LYS  14   3.416  10.873   7.060
  114    HE2  LYS  14          2HE       LYS  14   0.481  11.324   7.569
  115    HE3  LYS  14          3HE       LYS  14   1.209   9.726   7.416
  116    HZ1  LYS  14          1HZ       LYS  14   1.275  11.568   9.624
  117    HZ2  LYS  14          2HZ       LYS  14   2.798  10.946   9.231
  118    HZ3  LYS  14          3HZ       LYS  14   1.526   9.895   9.604
  119    H    ASN  15           H        ASN  15   5.961  15.099   5.073
  120    HA   ASN  15           HA       ASN  15   7.062  16.226   7.365
  121    HB2  ASN  15          2HB       ASN  15   8.501  15.279   5.691
  122    HB3  ASN  15          3HB       ASN  15   7.930  16.419   4.477
  123   HD21  ASN  15          1HD2      ASN  15   9.460  17.808   4.005
  124   HD22  ASN  15          2HD2      ASN  15  10.529  18.572   5.127
  125    H    ILE  16           H        ILE  16   5.181  17.671   4.859
  126    HA   ILE  16           HA       ILE  16   6.010  20.369   5.286
  127    HB   ILE  16           HB       ILE  16   3.530  19.244   3.986
  128   HG12  ILE  16          2HG1      ILE  16   5.690  20.679   2.516
  129   HG13  ILE  16          3HG1      ILE  16   6.016  19.035   3.053
  130   HG21  ILE  16          1HG2      ILE  16   2.887  21.393   4.655
  131   HG22  ILE  16          2HG2      ILE  16   4.478  22.071   4.314
  132   HG23  ILE  16          3HG2      ILE  16   3.420  21.596   2.986
  133   HD11  ILE  16          1HD1      ILE  16   4.993  18.305   1.238
  134   HD12  ILE  16          2HD1      ILE  16   3.484  18.975   1.859
  135   HD13  ILE  16          3HD1      ILE  16   4.510  19.944   0.802
  136    H    THR  17           H        THR  17   3.047  18.596   6.178
  137    HA   THR  17           HA       THR  17   2.141  20.719   7.890
  138    HB   THR  17           HB       THR  17   0.957  18.026   8.215
  139    HG1  THR  17           HG1      THR  17   0.498  19.475   5.814
  140   HG21  THR  17          1HG2      THR  17  -1.055  19.690   7.555
  141   HG22  THR  17          2HG2      THR  17   0.118  20.859   8.161
  142   HG23  THR  17          3HG2      THR  17  -0.422  19.536   9.194
  143    H    GLU  18           H        GLU  18   4.316  18.151   8.234
  144    HA   GLU  18           HA       GLU  18   3.888  17.778  11.076
  145    HB2  GLU  18          2HB       GLU  18   5.791  16.616   9.064
  146    HB3  GLU  18          3HB       GLU  18   6.060  16.390  10.786
  147    HG2  GLU  18          2HG       GLU  18   3.505  15.639   9.395
  148    HG3  GLU  18          3HG       GLU  18   4.854  14.529   9.631
  149    H    ARG  19           H        ARG  19   6.213  19.344   8.936
  150    HA   ARG  19           HA       ARG  19   8.033  20.093  10.990
  151    HB2  ARG  19          2HB       ARG  19   8.474  19.941   8.471
  152    HB3  ARG  19          3HB       ARG  19   7.701  21.516   8.356
  153    HG2  ARG  19          2HG       ARG  19   9.515  21.939  10.343
  154    HG3  ARG  19          3HG       ARG  19  10.367  20.791   9.307
  155    HD2  ARG  19          2HD       ARG  19   9.984  22.235   7.379
  156    HD3  ARG  19          3HD       ARG  19   9.097  23.371   8.395
  157    HE   ARG  19           HE       ARG  19  11.632  23.018   9.506
  158   HH11  ARG  19          1HH1      ARG  19  11.426  25.508   6.378
  159   HH12  ARG  19          2HH1      ARG  19  10.177  24.335   6.631
  160   HH21  ARG  19          1HH2      ARG  19  13.194  25.633   7.830
  161   HH22  ARG  19          2HH2      ARG  19  13.284  24.558   9.184
  162    H    VAL  20           H        VAL  20   5.204  21.587   9.551
  163    HA   VAL  20           HA       VAL  20   5.588  24.168  10.684
  164    HB   VAL  20           HB       VAL  20   4.141  23.883   8.755
  165   HG11  VAL  20          1HG1      VAL  20   2.269  22.552   8.663
  166   HG12  VAL  20          2HG1      VAL  20   3.312  21.590   9.713
  167   HG13  VAL  20          3HG1      VAL  20   2.029  22.580  10.409
  168   HG21  VAL  20          1HG2      VAL  20   3.397  25.240  11.168
  169   HG22  VAL  20          2HG2      VAL  20   3.162  25.737   9.493
  170   HG23  VAL  20          3HG2      VAL  20   1.950  24.737  10.294
  171    H    SER  21           H        SER  21   3.662  21.345  11.641
  172    HA   SER  21           HA       SER  21   2.371  22.444  13.846
  173    HB2  SER  21          2HB       SER  21   2.448  19.964  12.665
  174    HB3  SER  21          3HB       SER  21   3.216  19.657  14.223
  175    HG   SER  21           HG       SER  21   1.310  19.739  15.074
  176    H    MET  22           H        MET  22   5.429  20.614  13.772
  177    HA   MET  22           HA       MET  22   6.030  20.844  16.492
  178    HB2  MET  22          2HB       MET  22   7.579  20.257  14.025
  179    HB3  MET  22          3HB       MET  22   8.494  20.703  15.459
  180    HG2  MET  22          2HG       MET  22   7.178  18.900  16.670
  181    HG3  MET  22          3HG       MET  22   6.662  18.362  15.073
  182    HE1  MET  22          1HE       MET  22   8.538  17.141  13.244
  183    HE2  MET  22          2HE       MET  22   8.855  18.876  13.264
  184    HE3  MET  22          3HE       MET  22  10.191  17.733  13.410
  185    H    ALA  23           H        ALA  23   6.825  22.956  13.768
  186    HA   ALA  23           HA       ALA  23   8.491  24.736  15.179
  187    HB1  ALA  23          1HB       ALA  23   7.312  26.251  13.188
  188    HB2  ALA  23          2HB       ALA  23   8.797  25.309  13.048
  189    HB3  ALA  23          3HB       ALA  23   7.256  24.605  12.558
  190    H    THR  24           H        THR  24   5.116  25.237  14.124
  191    HA   THR  24           HA       THR  24   4.642  27.580  15.528
  192    HB   THR  24           HB       THR  24   2.423  25.596  15.280
  193    HG1  THR  24           HG1      THR  24   2.888  25.302  13.241
  194   HG21  THR  24          1HG2      THR  24   1.263  27.466  15.633
  195   HG22  THR  24          2HG2      THR  24   1.835  28.069  14.077
  196   HG23  THR  24          3HG2      THR  24   2.731  28.439  15.550
  197    H    ALA  25           H        ALA  25   4.281  24.224  16.582
  198    HA   ALA  25           HA       ALA  25   3.046  24.717  19.050
  199    HB1  ALA  25          1HB       ALA  25   4.812  22.465  18.121
  200    HB2  ALA  25          2HB       ALA  25   4.015  22.483  19.694
  201    HB3  ALA  25          3HB       ALA  25   3.051  22.498  18.218
  202    H    SER  26           H        SER  26   6.428  24.747  18.086
  203    HA   SER  26           HA       SER  26   7.249  25.311  20.839
  204    HB2  SER  26          2HB       SER  26   8.480  24.001  18.596
  205    HB3  SER  26          3HB       SER  26   9.494  25.345  19.119
  206    HG   SER  26           HG       SER  26   9.802  24.402  21.022
  207    H    SER  27           H        SER  27   6.007  27.076  18.491
  208    HA   SER  27           HA       SER  27   7.915  29.296  18.685
  209    HB2  SER  27          2HB       SER  27   6.119  28.354  16.621
  210    HB3  SER  27          3HB       SER  27   5.809  30.050  16.990
  211    HG   SER  27           HG       SER  27   8.440  29.117  16.606
  212    H    GLN  28           H        GLN  28   4.608  28.374  19.414
  213    HA   GLN  28           HA       GLN  28   4.335  30.851  20.983
  214    HB2  GLN  28          2HB       GLN  28   2.279  29.475  19.261
  215    HB3  GLN  28          3HB       GLN  28   1.843  30.639  20.504
  216    HG2  GLN  28          2HG       GLN  28   3.089  32.369  19.388
  217    HG3  GLN  28          3HG       GLN  28   3.681  31.215  18.193
  218   HE21  GLN  28          1HE2      GLN  28   0.869  32.926  19.374
  219   HE22  GLN  28          2HE2      GLN  28  -0.077  32.758  17.938
  220    H    VAL  29           H        VAL  29   2.275  27.980  20.634
  221    HA   VAL  29           HA       VAL  29   3.026  26.683  22.995
  222    HB   VAL  29           HB       VAL  29   2.203  28.599  24.205
  223   HG11  VAL  29          1HG1      VAL  29  -0.446  28.189  22.826
  224   HG12  VAL  29          2HG1      VAL  29  -0.040  29.445  23.997
  225   HG13  VAL  29          3HG1      VAL  29   0.719  29.443  22.404
  226   HG21  VAL  29          1HG2      VAL  29   1.777  26.394  25.171
  227   HG22  VAL  29          2HG2      VAL  29   0.507  27.538  25.604
  228   HG23  VAL  29          3HG2      VAL  29   0.217  26.332  24.350
  229    H    LEU  30           H        LEU  30   0.470  27.476  20.731
  230    HA   LEU  30           HA       LEU  30  -1.028  26.182  19.610
  231    HB2  LEU  30          2HB       LEU  30   1.121  24.695  19.574
  232    HB3  LEU  30          3HB       LEU  30   0.213  23.699  20.710
  233    HG   LEU  30           HG       LEU  30  -1.546  24.112  18.599
  234   HD11  LEU  30          1HD1      LEU  30  -0.135  24.838  16.964
  235   HD12  LEU  30          2HD1      LEU  30   0.066  23.097  16.771
  236   HD13  LEU  30          3HD1      LEU  30   1.270  24.030  17.659
  237   HD21  LEU  30          1HD2      LEU  30   0.031  21.920  19.755
  238   HD22  LEU  30          2HD2      LEU  30  -0.514  21.657  18.098
  239   HD23  LEU  30          3HD2      LEU  30  -1.688  22.005  19.368
  240    H    ILE  31           H        ILE  31  -2.493  27.065  21.285
  241    HA   ILE  31           HA       ILE  31  -3.919  24.886  22.564
  242    HB   ILE  31           HB       ILE  31  -4.102  26.160  24.724
  243   HG12  ILE  31          2HG1      ILE  31  -1.574  27.505  24.530
  244   HG13  ILE  31          3HG1      ILE  31  -2.633  28.081  23.248
  245   HG21  ILE  31          1HG2      ILE  31  -1.359  25.166  23.960
  246   HG22  ILE  31          2HG2      ILE  31  -1.972  25.341  25.603
  247   HG23  ILE  31          3HG2      ILE  31  -2.708  24.171  24.508
  248   HD11  ILE  31          1HD1      ILE  31  -2.789  28.473  26.151
  249   HD12  ILE  31          2HD1      ILE  31  -3.324  29.509  24.828
  250   HD13  ILE  31          3HD1      ILE  31  -4.323  28.151  25.344
  251    HA   PRO  32           HA       PRO  32  -7.441  27.246  21.423
  252    HB2  PRO  32          2HB       PRO  32  -9.221  26.485  23.326
  253    HB3  PRO  32          3HB       PRO  32  -8.705  25.420  22.013
  254    HG2  PRO  32          2HG       PRO  32  -7.761  25.520  24.852
  255    HG3  PRO  32          3HG       PRO  32  -8.135  24.108  23.846
  256    HD2  PRO  32          2HD       PRO  32  -5.601  24.957  24.282
  257    HD3  PRO  32          3HD       PRO  32  -6.101  24.184  22.764
  258    H    GLU  33           H        GLU  33  -7.069  29.402  21.703
  259    HA   GLU  33           HA       GLU  33  -7.518  30.500  24.401
  260    HB2  GLU  33          2HB       GLU  33  -5.474  31.024  22.410
  261    HB3  GLU  33          3HB       GLU  33  -6.319  32.497  22.863
  262    HG2  GLU  33          2HG       GLU  33  -5.512  30.770  25.099
  263    HG3  GLU  33          3HG       GLU  33  -4.194  31.495  24.180
  264    H    ILE  34           H        ILE  34  -7.546  31.946  21.154
  265    HA   ILE  34           HA       ILE  34 -10.322  32.250  20.927
  266    HB   ILE  34           HB       ILE  34 -10.199  33.729  22.831
  267   HG12  ILE  34          2HG1      ILE  34 -10.479  35.296  20.257
  268   HG13  ILE  34          3HG1      ILE  34 -11.744  34.337  21.018
  269   HG21  ILE  34          1HG2      ILE  34  -7.781  34.272  22.560
  270   HG22  ILE  34          2HG2      ILE  34  -8.229  35.399  21.281
  271   HG23  ILE  34          3HG2      ILE  34  -8.796  35.666  22.930
  272   HD11  ILE  34          1HD1      ILE  34 -12.200  36.562  21.585
  273   HD12  ILE  34          2HD1      ILE  34 -11.473  35.855  23.028
  274   HD13  ILE  34          3HD1      ILE  34 -10.514  36.896  21.977
  275    H    ASN  35           H        ASN  35  -7.165  33.688  20.276
  276    HA   ASN  35           HA       ASN  35  -8.068  34.291  17.537
  277    HB2  ASN  35          2HB       ASN  35  -6.041  35.617  19.318
  278    HB3  ASN  35          3HB       ASN  35  -5.956  35.799  17.568
  279   HD21  ASN  35          1HD2      ASN  35  -7.793  36.723  16.484
  280   HD22  ASN  35          2HD2      ASN  35  -8.804  37.847  17.320
  281    H    LEU  36           H        LEU  36  -5.663  32.701  19.502
  282    HA   LEU  36           HA       LEU  36  -3.678  32.147  17.669
  283    HB2  LEU  36          2HB       LEU  36  -3.436  31.564  19.982
  284    HB3  LEU  36          3HB       LEU  36  -4.781  30.430  19.885
  285    HG   LEU  36           HG       LEU  36  -2.437  29.926  18.133
  286   HD11  LEU  36          1HD1      LEU  36  -1.486  30.571  20.348
  287   HD12  LEU  36          2HD1      LEU  36  -1.149  28.910  19.865
  288   HD13  LEU  36          3HD1      LEU  36  -2.397  29.242  21.066
  289   HD21  LEU  36          1HD2      LEU  36  -3.800  28.174  17.833
  290   HD22  LEU  36          2HD2      LEU  36  -4.684  28.477  19.328
  291   HD23  LEU  36          3HD2      LEU  36  -3.151  27.605  19.371
  292    H    ASN  37           H        ASN  37  -6.795  30.562  18.098
  293    HA   ASN  37           HA       ASN  37  -6.410  28.339  16.465
  294    HB2  ASN  37          2HB       ASN  37  -8.842  29.941  17.208
  295    HB3  ASN  37          3HB       ASN  37  -8.966  28.596  16.078
  296   HD21  ASN  37          1HD2      ASN  37 -10.359  28.527  18.396
  297   HD22  ASN  37          2HD2      ASN  37  -9.689  27.343  19.462
  298    H    ASP  38           H        ASP  38  -7.693  31.547  15.611
  299    HA   ASP  38           HA       ASP  38  -8.102  31.050  12.888
  300    HB2  ASP  38          2HB       ASP  38  -7.909  33.425  14.619
  301    HB3  ASP  38          3HB       ASP  38  -7.492  33.712  12.932
  302    H    THR  39           H        THR  39  -5.314  32.558  14.511
  303    HA   THR  39           HA       THR  39  -3.738  32.969  12.251
  304    HB   THR  39           HB       THR  39  -2.025  32.251  14.419
  305    HG1  THR  39           HG1      THR  39  -2.963  33.677  16.008
  306   HG21  THR  39          1HG2      THR  39  -1.540  33.984  12.786
  307   HG22  THR  39          2HG2      THR  39  -1.543  34.673  14.409
  308   HG23  THR  39          3HG2      THR  39  -2.923  34.926  13.341
  309    H    PHE  40           H        PHE  40  -3.623  30.234  14.539
  310    HA   PHE  40           HA       PHE  40  -1.701  28.738  13.169
  311    HB2  PHE  40          2HB       PHE  40  -2.527  28.342  15.518
  312    HB3  PHE  40          3HB       PHE  40  -3.962  27.600  14.819
  313    HD1  PHE  40           HD1      PHE  40  -0.392  27.335  13.810
  314    HD2  PHE  40           HD2      PHE  40  -3.834  25.353  15.341
  315    HE1  PHE  40           HE1      PHE  40   0.792  25.182  13.676
  316    HE2  PHE  40           HE2      PHE  40  -2.655  23.197  15.209
  317    HZ   PHE  40           HZ       PHE  40  -0.339  23.110  14.377
  318    H    ASP  41           H        ASP  41  -5.213  28.827  12.854
  319    HA   ASP  41           HA       ASP  41  -5.563  26.638  11.163
  320    HB2  ASP  41          2HB       ASP  41  -7.097  29.072  11.833
  321    HB3  ASP  41          3HB       ASP  41  -7.495  28.331  10.285
  322    H    THR  42           H        THR  42  -5.358  30.071  10.207
  323    HA   THR  42           HA       THR  42  -5.220  29.637   7.456
  324    HB   THR  42           HB       THR  42  -5.389  31.862   8.935
  325    HG1  THR  42           HG1      THR  42  -4.180  32.038   6.381
  326   HG21  THR  42          1HG2      THR  42  -2.907  31.575   9.504
  327   HG22  THR  42          2HG2      THR  42  -3.433  33.165   8.952
  328   HG23  THR  42          3HG2      THR  42  -2.597  32.078   7.843
  329    H    PHE  43           H        PHE  43  -2.798  29.315   9.910
  330    HA   PHE  43           HA       PHE  43  -0.541  29.443   8.152
  331    HB2  PHE  43          2HB       PHE  43  -0.509  29.891  10.649
  332    HB3  PHE  43          3HB       PHE  43  -0.634  28.149  10.879
  333    HD1  PHE  43           HD1      PHE  43   1.421  27.657  11.879
  334    HD2  PHE  43           HD2      PHE  43   1.315  29.931   8.283
  335    HE1  PHE  43           HE1      PHE  43   3.866  27.458  11.685
  336    HE2  PHE  43           HE2      PHE  43   3.759  29.735   8.082
  337    HZ   PHE  43           HZ       PHE  43   5.038  28.496   9.784
  338    H    ALA  44           H        ALA  44  -2.214  26.780   9.822
  339    HA   ALA  44           HA       ALA  44  -0.690  24.727   8.594
  340    HB1  ALA  44          1HB       ALA  44  -1.875  23.304   9.883
  341    HB2  ALA  44          2HB       ALA  44  -2.354  24.790  10.706
  342    HB3  ALA  44          3HB       ALA  44  -3.417  24.068   9.499
  343    H    LEU  45           H        LEU  45  -3.928  26.039   7.936
  344    HA   LEU  45           HA       LEU  45  -4.782  24.386   5.936
  345    HB2  LEU  45          2HB       LEU  45  -5.783  26.582   6.994
  346    HB3  LEU  45          3HB       LEU  45  -5.114  27.319   5.540
  347    HG   LEU  45           HG       LEU  45  -7.384  26.880   5.076
  348   HD11  LEU  45          1HD1      LEU  45  -5.716  26.206   3.334
  349   HD12  LEU  45          2HD1      LEU  45  -7.284  25.410   3.210
  350   HD13  LEU  45          3HD1      LEU  45  -5.906  24.542   3.888
  351   HD21  LEU  45          1HD2      LEU  45  -8.577  25.255   6.019
  352   HD22  LEU  45          2HD2      LEU  45  -7.135  24.851   6.951
  353   HD23  LEU  45          3HD2      LEU  45  -7.472  24.009   5.438
  354    H    ASP  46           H        ASP  46  -3.012  27.431   5.351
  355    HA   ASP  46           HA       ASP  46  -2.605  27.193   2.650
  356    HB2  ASP  46          2HB       ASP  46  -1.763  28.938   4.570
  357    HB3  ASP  46          3HB       ASP  46  -0.244  28.171   4.116
  358    H    PHE  47           H        PHE  47  -0.490  25.940   5.223
  359    HA   PHE  47           HA       PHE  47   1.457  24.796   3.595
  360    HB2  PHE  47          2HB       PHE  47   0.618  24.565   6.391
  361    HB3  PHE  47          3HB       PHE  47   1.339  23.089   5.757
  362    HD1  PHE  47           HD1      PHE  47   3.441  23.898   4.043
  363    HD2  PHE  47           HD2      PHE  47   2.133  25.716   7.663
  364    HE1  PHE  47           HE1      PHE  47   5.685  24.853   4.370
  365    HE2  PHE  47           HE2      PHE  47   4.375  26.675   7.995
  366    HZ   PHE  47           HZ       PHE  47   6.154  26.245   6.347
  367    H    SER  48           H        SER  48  -1.499  23.342   4.925
  368    HA   SER  48           HA       SER  48  -1.203  20.759   3.999
  369    HB2  SER  48          2HB       SER  48  -3.048  21.636   5.482
  370    HB3  SER  48          3HB       SER  48  -3.830  22.257   4.029
  371    HG   SER  48           HG       SER  48  -3.939  19.803   5.026
  372    H    ARG  49           H        ARG  49  -2.535  23.567   2.296
  373    HA   ARG  49           HA       ARG  49  -3.444  22.371  -0.013
  374    HB2  ARG  49          2HB       ARG  49  -3.398  24.882   0.760
  375    HB3  ARG  49          3HB       ARG  49  -1.928  24.944  -0.203
  376    HG2  ARG  49          2HG       ARG  49  -3.357  23.930  -2.080
  377    HG3  ARG  49          3HG       ARG  49  -4.736  24.420  -1.094
  378    HD2  ARG  49          2HD       ARG  49  -3.645  26.730  -1.038
  379    HD3  ARG  49          3HD       ARG  49  -2.620  26.144  -2.347
  380    HE   ARG  49           HE       ARG  49  -5.261  25.633  -3.058
  381   HH11  ARG  49          1HH1      ARG  49  -4.053  29.419  -3.539
  382   HH12  ARG  49          2HH1      ARG  49  -3.200  28.372  -2.454
  383   HH21  ARG  49          1HH2      ARG  49  -5.870  28.639  -4.696
  384   HH22  ARG  49          2HH2      ARG  49  -6.393  27.002  -4.490
  385    H    GLU  50           H        GLU  50  -0.138  23.371   0.778
  386    HA   GLU  50           HA       GLU  50   0.952  22.636  -1.749
  387    HB2  GLU  50          2HB       GLU  50   1.867  24.174   0.235
  388    HB3  GLU  50          3HB       GLU  50   2.681  22.677   0.669
  389    HG2  GLU  50          2HG       GLU  50   3.421  22.651  -1.812
  390    HG3  GLU  50          3HG       GLU  50   3.006  24.364  -1.771
  391    H    LYS  51           H        LYS  51   0.161  20.913   1.126
  392    HA   LYS  51           HA       LYS  51   1.915  18.686   0.651
  393    HB2  LYS  51          2HB       LYS  51   1.413  18.840   2.894
  394    HB3  LYS  51          3HB       LYS  51  -0.249  19.334   2.599
  395    HG2  LYS  51          2HG       LYS  51  -0.117  16.757   1.587
  396    HG3  LYS  51          3HG       LYS  51   0.842  16.701   3.068
  397    HD2  LYS  51          2HD       LYS  51  -1.122  16.435   4.113
  398    HD3  LYS  51          3HD       LYS  51  -1.341  18.165   3.840
  399    HE2  LYS  51          2HE       LYS  51  -3.299  16.882   3.124
  400    HE3  LYS  51          3HE       LYS  51  -2.530  17.704   1.767
  401    HZ1  LYS  51          1HZ       LYS  51  -1.706  15.728   0.930
  402    HZ2  LYS  51          2HZ       LYS  51  -3.233  15.267   1.493
  403    HZ3  LYS  51          3HZ       LYS  51  -1.852  14.905   2.401
  404    H    LYS  52           H        LYS  52  -1.595  19.214   0.366
  405    HA   LYS  52           HA       LYS  52  -2.116  16.671  -0.790
  406    HB2  LYS  52          2HB       LYS  52  -4.329  17.685  -1.381
  407    HB3  LYS  52          3HB       LYS  52  -3.905  17.813   0.321
  408    HG2  LYS  52          2HG       LYS  52  -2.912  20.147  -0.721
  409    HG3  LYS  52          3HG       LYS  52  -4.393  19.898  -1.650
  410    HD2  LYS  52          2HD       LYS  52  -5.196  19.306   0.901
  411    HD3  LYS  52          3HD       LYS  52  -4.033  20.607   1.166
  412    HE2  LYS  52          2HE       LYS  52  -5.290  21.837  -0.705
  413    HE3  LYS  52          3HE       LYS  52  -6.561  20.641  -0.451
  414    HZ1  LYS  52          1HZ       LYS  52  -5.620  21.849   1.982
  415    HZ2  LYS  52          2HZ       LYS  52  -7.202  21.627   1.428
  416    HZ3  LYS  52          3HZ       LYS  52  -6.305  22.964   0.910
  417    H    LEU  53           H        LEU  53  -1.235  19.793  -2.077
  418    HA   LEU  53           HA       LEU  53  -1.891  19.154  -4.796
  419    HB2  LEU  53          2HB       LEU  53  -1.885  21.457  -4.002
  420    HB3  LEU  53          3HB       LEU  53  -0.165  21.339  -3.640
  421    HG   LEU  53           HG       LEU  53  -0.774  20.735  -6.424
  422   HD11  LEU  53          1HD1      LEU  53  -2.337  22.315  -6.715
  423   HD12  LEU  53          2HD1      LEU  53  -0.980  23.436  -6.611
  424   HD13  LEU  53          3HD1      LEU  53  -1.965  23.110  -5.185
  425   HD21  LEU  53          1HD2      LEU  53   1.420  21.391  -5.084
  426   HD22  LEU  53          2HD2      LEU  53   0.912  23.015  -5.547
  427   HD23  LEU  53          3HD2      LEU  53   1.207  21.796  -6.787
  428    H    LEU  54           H        LEU  54   0.805  18.639  -2.713
  429    HA   LEU  54           HA       LEU  54   2.703  18.219  -4.851
  430    HB2  LEU  54          2HB       LEU  54   3.410  19.115  -2.681
  431    HB3  LEU  54          3HB       LEU  54   2.903  17.617  -1.903
  432    HG   LEU  54           HG       LEU  54   5.409  17.996  -2.369
  433   HD11  LEU  54          1HD1      LEU  54   3.838  15.746  -2.093
  434   HD12  LEU  54          2HD1      LEU  54   5.597  15.811  -1.986
  435   HD13  LEU  54          3HD1      LEU  54   4.822  15.394  -3.514
  436   HD21  LEU  54          1HD2      LEU  54   4.900  16.777  -5.024
  437   HD22  LEU  54          2HD2      LEU  54   6.234  17.794  -4.478
  438   HD23  LEU  54          3HD2      LEU  54   4.675  18.520  -4.871
  439    H    GLU  55           H        GLU  55   0.407  16.357  -3.091
  440    HA   GLU  55           HA       GLU  55   1.599  13.853  -4.066
  441    HB2  GLU  55          2HB       GLU  55   0.823  14.363  -1.566
  442    HB3  GLU  55          3HB       GLU  55  -0.727  13.841  -2.209
  443    HG2  GLU  55          2HG       GLU  55   0.676  11.820  -3.107
  444    HG3  GLU  55          3HG       GLU  55   1.782  12.294  -1.819
  445    H    CYS  56           H        CYS  56  -1.694  15.108  -3.504
  446    HA   CYS  56           HA       CYS  56  -2.643  13.574  -5.793
  447    HB2  CYS  56          2HB       CYS  56  -3.773  13.925  -3.393
  448    HB3  CYS  56          3HB       CYS  56  -4.487  15.302  -4.224
  449    HG   CYS  56           HG       CYS  56  -6.476  13.620  -4.618
  450    H    LEU  57           H        LEU  57  -4.167  14.622  -7.319
  451    HA   LEU  57           HA       LEU  57  -3.124  17.249  -8.091
  452    HB2  LEU  57          2HB       LEU  57  -4.334  14.960  -9.547
  453    HB3  LEU  57          3HB       LEU  57  -4.567  16.576 -10.211
  454    HG   LEU  57           HG       LEU  57  -1.864  15.380  -9.619
  455   HD11  LEU  57          1HD1      LEU  57  -2.993  14.052 -11.319
  456   HD12  LEU  57          2HD1      LEU  57  -1.683  14.998 -12.025
  457   HD13  LEU  57          3HD1      LEU  57  -3.355  15.515 -12.236
  458   HD21  LEU  57          1HD2      LEU  57  -1.673  17.302 -11.602
  459   HD22  LEU  57          2HD2      LEU  57  -1.210  17.488  -9.910
  460   HD23  LEU  57          3HD2      LEU  57  -2.814  17.990 -10.446
  461    H    ASP  58           H        ASP  58  -4.319  19.028  -7.921
  462    HA   ASP  58           HA       ASP  58  -7.123  19.110  -8.309
  463    HB2  ASP  58          2HB       ASP  58  -7.020  18.053  -6.037
  464    HB3  ASP  58          3HB       ASP  58  -6.236  19.516  -5.448
  465    H    TYR  59           H        TYR  59  -7.584  21.083  -9.028
  466    HA   TYR  59           HA       TYR  59  -7.340  23.271  -9.604
  467    HB2  TYR  59          2HB       TYR  59  -7.792  23.285  -7.018
  468    HB3  TYR  59          3HB       TYR  59  -6.121  23.829  -6.926
  469    HD1  TYR  59           HD1      TYR  59  -9.248  24.615  -8.822
  470    HD2  TYR  59           HD2      TYR  59  -5.743  26.103  -6.926
  471    HE1  TYR  59           HE1      TYR  59  -9.980  26.916  -9.290
  472    HE2  TYR  59           HE2      TYR  59  -6.465  28.409  -7.387
  473    HH   TYR  59           HH       TYR  59  -8.481  29.307  -9.543
  474    H    LEU  60           H        LEU  60  -5.681  22.767 -11.136
  475    HA   LEU  60           HA       LEU  60  -3.627  22.948 -12.104
  476    HB2  LEU  60          2HB       LEU  60  -4.256  25.339 -11.315
  477    HB3  LEU  60          3HB       LEU  60  -2.986  25.093 -10.118
  478    HG   LEU  60           HG       LEU  60  -1.741  24.423 -12.479
  479   HD11  LEU  60          1HD1      LEU  60  -3.124  26.989 -13.101
  480   HD12  LEU  60          2HD1      LEU  60  -3.911  25.463 -13.502
  481   HD13  LEU  60          3HD1      LEU  60  -2.329  25.844 -14.182
  482   HD21  LEU  60          1HD2      LEU  60  -0.695  25.695 -10.754
  483   HD22  LEU  60          2HD2      LEU  60  -1.839  27.022 -10.957
  484   HD23  LEU  60          3HD2      LEU  60  -0.664  26.669 -12.224