*HEADER    IMMUNE SYSTEM                           24-JUL-01   1JNJ              
*TITLE     NMR SOLUTION STRUCTURE OF THE HUMAN BETA2-MICROGLOBULIN               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: BETA2-MICROGLOBULIN;                                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: B2M;                                                           
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21DE3;                                   
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PHN1                                      
*KEYWDS    IMMUNOGLOBULIN CONSTANT DOMAIN                                        
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    G.VERDONE, A.CORAZZA, P.VIGLINO, F.PETTIROSSI, S.GIORGETTI,           
*AUTHOR   2 P.MANGIONE, A.ANDREOLA, M.STOPPINI, V.BELLOTTI, G.ESPOSITO           
*REVDAT   1   27-FEB-02 1JNJ    0                                                


1 ILE HA 1 ILE HB 2.93455
1 ILE HA 1 ILE QD1 4.22182
1 ILE HA 1 ILE QG1 3.98182
1 ILE HA 1 ILE QG2 3.56727
1 ILE HA 2 GLN HN 2.91273
1 ILE QG2 2 GLN HN 5.45455
2 GLN HA 2 GLN QG 4.03636
2 GLN HA 3 ARG+ HN 2.74909
2 GLN HN 2 GLN HG2 4.37455
2 GLN HN 2 GLN HG3 4.37455
2 GLN HN 2 GLN QB 4.01455
2 GLN HN 2 GLN QG 4.02545
2 GLN QB 86 THR QG2 3.72
2 GLN QG 3 ARG+ HN 6.41455
3 ARG+ HA 3 ARG+ HB2 2.93818
3 ARG+ HA 3 ARG+ HB3 2.83818
3 ARG+ HA 3 ARG+ QB 2.76545
3 ARG+ HA 3 ARG+ QD 4.75636
3 ARG+ HA 3 ARG+ QG 3.6
3 ARG+ HA 4 THR HN 2.72727
3 ARG+ HN 31 HIS HN 3.67636
3 ARG+ QB 3 ARG+ QD 3.77455
4 THR HA 4 THR HB 3.1
4 THR HA 4 THR QG2 3.6
4 THR HA 5 PRO HD2 2.55273
4 THR HA 5 PRO HD3 2.55273
4 THR HA 86 THR QG2 4.04
4 THR HA 87 LEU QD1 4.20
4 THR HN 4 THR HB 3.31636
4 THR HN 4 THR QG2 4.50545
5 PRO HA 30 PHE HA 4.02
5 PRO HA 30 PHE HB2 3.59273
5 PRO HA 30 PHE HB3 3.39273
5 PRO HA 30 PHE QB 3.01091
5 PRO HA 30 PHE QD 4.24727
5 PRO HA 6 LYS+ HN 2.79273
5 PRO QG 35 ILE QD1 4.98545
6 LYS+ HA 6 LYS+ HB2 2.56
6 LYS+ HN 6 LYS+ HB2 3.06
6 LYS+ HN 6 LYS+ HB3 3.85
6 LYS+ HA 6 LYS+ HG2 2.61818
6 LYS+ HA 6 LYS+ HG3 2.61818
6 LYS+ HA 7 ILE HN 2.98909
6 LYS+ HN 28 SER HN 3.24727
6 LYS+ HN 6 LYS+ HG2 4.51636
6 LYS+ HN 6 LYS+ HG3 4.51636
6 LYS+ HN 6 LYS+ QG 4.27818
7 ILE HA 27 VAL HA 2.79273
7 ILE HA 7 ILE HB 2.94545
7 ILE HA 7 ILE QG1 3.77455
7 ILE HA 7 ILE QG2 2.92364
7 ILE HN 7 ILE HB 3.61091
8 GLN HB2 8 GLN HE21 5.84727
8 GLN HB2 8 GLN HE22 5.84727
8 GLN HB3 8 GLN HE21 5.84727
8 GLN HB3 8 GLN HE22 5.84727
8 GLN HN 26 TYR HB2 4.93091
8 GLN HN 26 TYR HB3 4.93091
8 GLN HN 26 TYR HN 3.83091
8 GLN HN 26 TYR QB 4.60364
8 GLN HN 27 VAL HA 3.21273
8 GLN HN 8 GLN HB2 3.56
8 GLN HN 8 GLN HB3 3.56
8 GLN HN 8 GLN QB 3.33091
8 GLN HN 8 GLN QE2 4.86545
8 GLN HN 8 GLN QG 3.91636
8 GLN QB 8 GLN QE2 4.63636
8 GLN QG 8 GLN QE2 3.73091
8 GLN QG 26 TYR QE 4.97
8 GLN QE2 26 TYR QE 3.69
9 VAL QQG 10 TYR HN 6.48
9 VAL QQG 23 LEU QQD 7.81
9 VAL QQG 80 CYSS QB 7.37
9 VAL QQG 95 TRP HB3 6.51
9 VAL QQG 95 TRP HD1 6.12
9 VAL HA 25 CYSS HA 2.70545
9 VAL HA 26 TYR HN 4.00364
9 VAL HA 9 VAL HB 3.00182
9 VAL HB 95 TRP HD1 3.89455
9 VAL HN 9 VAL HA 2.96727
9 VAL HN 9 VAL HB 3.22909
10 TYR HA 10 TYR HB2 3.00727
10 TYR HA 10 TYR HB3 2.60727
10 TYR HA 10 TYR QD 3.64545
10 TYR HN 10 TYR QD 4.06909
10 TYR HN 11 SER HN 5.45455
10 TYR HN 24 ASN HN 3.71455
10 TYR HN 25 CYSS HA 3.66545
10 TYR QB 11 SER HN 4.65818
10 TYR QD 11 SER HN 4.33091
10 TYR QE 26 TYR QB 3.80727
11 SER HA 11 SER QB 2.85818
11 SER HA 12 ARG+ HN 3.01091
11 SER HA 23 LEU HA 3.522
11 SER HA 23 LEU QQD 6.19
11 SER HA 24 ASN HN 5.45455
11 SER HA 95 TRP HE1 3.51455
11 SER QB 70 PHE HZ 4.58
11 SER HB2 70 PHE HZ 5.00
11 SER HB3 70 PHE HZ 5.00
11 SER HN 95 TRP HE1 4.34364
11 SER QB 95 TRP HZ2 4.8
12 ARG+ HA 12 ARG+ HB3 2.95
12 ARG+ HB3 13 HIS HN 4.04
12 ARG+ HN 12 ARG+ HB2 3.21
12 ARG+ HA 12 ARG+ QG 3.90545
12 ARG+ HN 13 HIS HN 3.54545
12 ARG+ HN 22 PHE HN 4.71636
13 HIS HA 13 HIS HB2 3.05
13 HIS HA 13 HIS HB3 2.57
13 HIS HB3 13 HIS HD2 3.64
13 HIS HB3 14 PRO HD2 3.35
13 HIS HB3 14 PRO HD3 3.35
13 HIS HB3 14 PRO QD 3.07
13 HIS HN 13 HIS HB2 3.73
13 HIS HA 14 PRO HD2 2.77273
13 HIS HA 14 PRO HD3 2.67273
13 HIS HD2 21 ASN HA 3.57818
14 PRO HA 15 ALA HN 2.73818
15 ALA HA 16 GLU- HN 2.76
15 ALA HA 21 ASN HD21 3.92
15 ALA HA 21 ASN HD22 3.92
15 ALA QB 16 GLU- HN 3.76364
15 ALA QB 72 PRO QB 5.24
15 ALA QB 72 PRO QD 5.88
15 ALA QB 95 TRP HH2 3.71
15 ALA QB 95 TRP HZ2 3.73
16 GLU- HA 17 ASN HN 2.78182
17 ASN HA 18 GLY HN 2.62909
17 ASN HN 17 ASN HB2 3.40364
17 ASN HN 17 ASN HB3 3.40364
17 ASN QB 17 ASN QD2 3.69818
18 GLY HN 71 THR QG2 4.26
19 LYS+ HA 19 LYS+ HB2 3.02
19 LYS+ HB2 19 LYS+ QD 3.71
19 LYS+ HB2 20 SER HN 3.99
19 LYS+ HB3 20 SER HN 3.63
19 LYS+ HN 19 LYS+ HB2 3.26
19 LYS+ HN 19 LYS+ HB3 3.13
19 LYS+ HA 19 LYS+ HD2 4.17818
19 LYS+ HA 19 LYS+ HD3 4.17818
19 LYS+ HA 19 LYS+ QD 4.00364
19 LYS+ HA 20 SER HN 2.32909
19 LYS+ HA 71 THR QG2 6.54545
19 LYS+ HN 71 THR QG2 4.49
20 SER HA 20 SER HB3 2.86
20 SER HA 20 SER HB2 2.81
20 SER HB3 21 ASN HN 3.72
20 SER HB2 21 ASN HN 4.79
20 SER HN 20 SER HB3 3.15
20 SER HA 21 ASN HN 2.65091
20 SER HA 71 THR HA 3.58909
20 SER HA 71 THR HB 4.11636
20 SER HA 71 THR QG2 3.63273
21 ASN HA 21 ASN HB2 3.22909
21 ASN HA 21 ASN HB3 3.22909
21 ASN HA 21 ASN QB 2.94545
21 ASN HA 22 PHE HN 3.38182
21 ASN HN 21 ASN QB 4.06909
21 ASN HN 22 PHE HN 4.25455
21 ASN HN 70 PHE HN 4.2
21 ASN HN 71 THR HA 3.489
21 ASN QB 70 PHE QD 4.06909
22 PHE HA 22 PHE HB2 3.26182
22 PHE HA 22 PHE HB3 3.26182
22 PHE HA 22 PHE QB 2.82545
22 PHE HA 22 PHE QD 3.76364
22 PHE HA 69 GLU- HA 2.34
22 PHE HA 69 GLU- HA 2.34
22 PHE HA 70 PHE HN 3.43636
22 PHE HB2 23 LEU HN 4.56909
22 PHE HB3 23 LEU HN 4.06909
22 PHE HN 22 PHE QB 4.01455
22 PHE HN 22 PHE QD 4.52727
22 PHE HN 70 PHE QD 4.69818
22 PHE HZ 69 GLU- QB 4.98
22 PHE HZ 69 GLU- QG 4.82
22 PHE QB 23 LEU HN 3.99636
22 PHE QD 23 LEU HN 4.26545
22 PHE QD 69 GLU- HA 4.19
22 PHE QE 69 GLU- QB 5.30
22 PHE QE 69 GLU- QG 5.13
23 LEU HA 23 LEU HB3 2.96
23 LEU HB2 23 LEU QD1 3.37
23 LEU HB2 23 LEU QD2 3.37
23 LEU HB2 23 LEU QQD 2.91
23 LEU HB2 24 ASN HN 4.29
23 LEU HB2 70 PHE QD 3.69
23 LEU HB3 23 LEU QQD 3.14
23 LEU HB3 70 PHE QD 4.47
23 LEU HN 23 LEU HB2 3.75
23 LEU QQD 78 TYR HB2 5.35
23 LEU QQD 78 TYR HB3 5.09
23 LEU QQD 95 TRP HB2 6.12
23 LEU QQD 95 TRP HB3 6.39
23 LEU HA 23 LEU HG 3.15273
23 LEU HA 23 LEU QD1 4.74545
23 LEU HA 23 LEU QD2 4.74545
23 LEU HA 23 LEU QQD 3.65455
23 LEU HG 24 ASN HN 4.02545
23 LEU HN 68 THR HN 3.62182
23 LEU HN 69 GLU- HA 3.55636
23 LEU HN 70 PHE QD 4.14182
23 LEU QD1 70 PHE QD 5.19273
23 LEU QD2 70 PHE QD 5.19273
23 LEU QQD 24 ASN HN 5.88
23 LEU QQD 39 LEU QQD 7.09091
23 LEU QQD 68 THR QG2 5.48727
23 LEU QQD 70 PHE HZ 6.03273
23 LEU QQD 70 PHE QD 4.54909
23 LEU QQD 78 TYR QD 5.72727
23 LEU QQD 78 TYR QE 7.11273
23 LEU QQD 95 TRP HD1 6.08727
24 ASN HA 24 ASN HB2 2.93
24 ASN HB3 25 CYSS HN 3.82
24 ASN HN 24 ASN HB2 3.71
24 ASN HA 25 CYSS HN 2.77091
24 ASN HA 67 TYR HA 2.65091
24 ASN HA 68 THR HN 3.79636
25 CYSS HA 25 CYSS HB3 2.89
25 CYSS HA 25 CYSS HB2 3.02
25 CYSS HB3 27 VAL QG2 4.54
25 CYSS HB2 27 VAL QG2 4.78
25 CYSS HB2 37 VAL QG1 5.10
25 CYSS HN 25 CYSS HB3 4.03
25 CYSS HA 26 TYR HN 2.73818
25 CYSS HN 65 LEU QQD 6.19
25 CYSS HN 66 TYR HN 3.79636
25 CYSS HN 67 TYR HA 4.14545
26 TYR HA 26 TYR QB 2.80364
26 TYR HA 26 TYR QD 3.12
26 TYR HA 65 LEU QQD 8.25818
26 TYR HA 66 TYR HN 3.26182
26 TYR HB2 65 LEU QD1 4.38
26 TYR HB2 65 LEU QD2 4.70
26 TYR HN 26 TYR QB 3.79636
26 TYR QD 27 VAL HN 4.59273
26 TYR QD 65 LEU HG 4.06909
26 TYR QD 65 LEU QD1 4.99
26 TYR QD 65 LEU QD2 5.00
26 TYR QE 65 LEU HA 5.00
27 VAL HB 37 VAL QG1 5.94
27 VAL HN 27 VAL QG2 4.72
27 VAL QG1 30 PHE QE 5.13
27 VAL QG1 35 ILE QD1 4.41
27 VAL QG1 37 VAL QG1 7.45
27 VAL QG2 30 PHE QD 6.74
27 VAL QG2 35 ILE QD1 5.23
27 VAL QG2 37 VAL QG1 5.78
27 VAL QG2 37 VAL QG2 5.36
27 VAL QG2 64 LEU HN 5.97
27 VAL HA 27 VAL HB 3.0545
27 VAL HB 30 PHE QE 4.06
27 VAL HN 64 LEU HN 3.53455
27 VAL HN 65 LEU HA 5.45455
28 SER HA 28 SER HB2 2.74
28 SER HA 28 SER HB3 2.86
28 SER HA 63 TYR HB3 3.22
28 SER HB2 63 TYR HB2 3.74
28 SER HB2 63 TYR QE 5.18
28 SER HA 29 GLY HN 3.48
28 SER HA 63 TYR HA 2.90182
28 SER HA 63 TYR QD 3.99455
28 SER HA 64 LEU HN 3.93818
29 GLY HN 30 PHE HN 3.46909
29 GLY HN 63 TYR HA 5.45455
30 PHE HA 30 PHE HB2 2.71636
30 PHE HA 30 PHE HB3 2.71636
30 PHE HA 30 PHE QB 2.47636
30 PHE HA 30 PHE QD 3.62
30 PHE HA 31 HIS HN 2.88
30 PHE HN 30 PHE QB 4.21091
30 PHE HN 62 PHE HN 4.19455
30 PHE HZ 35 ILE QD1 4.69091
30 PHE HZ 35 ILE QG2 3.50182
30 PHE QD 35 ILE QD1 4.42909
30 PHE QD 35 ILE QG2 5.25091
30 PHE QE 35 ILE QD1 3.91636
30 PHE QE 35 ILE QG2 4.09091
30 PHE QE 63 TYR HA 3.30909
31 HIS HA 31 HIS HD2 3.87636
31 HIS HA 32 PRO HA 2.88
31 HIS HA 62 PHE QD 4.12727
31 HIS HA 62 PHE QE 5.22182
31 HIS HD2 32 PRO HA 3.07636
31 HIS HN 31 HIS HD2 4.77818
31 HIS HN 84 HIS HE1 3.64364
32 PRO HA 33 SER HN 3.70909
32 PRO QD 84 HIS HE1 5.44
33 SER HA 33 SER HB2 2.67273
33 SER HA 33 SER HB3 2.67273
33 SER HA 62 PHE HZ 4.22909
33 SER HA 62 PHE QD 4.24364
33 SER HN 34 ASP- HN 4.09091
33 SER QB 54 LEU QQD 6.96
33 SER QB 62 PHE QD 4.61455
34 ASP- HA 34 ASP- QB 2.84727
34 ASP- HA 35 ILE HN 2.49818
34 ASP- HN 34 ASP- HB2 3.07636
34 ASP- HN 34 ASP- HB3 3.07636
34 ASP- HN 34 ASP- QB 2.82545
35 ILE QD1 37 VAL QG2 5.62
35 ILE HA 35 ILE QD1 4.57091
35 ILE HA 35 ILE QG1 3.94909
35 ILE HA 35 ILE QG2 3.79818
35 ILE HB 35 ILE QD1 3.29455
35 ILE HB 84 HIS HA 3.20909
35 ILE HB 84 HIS HD2 2.67273
35 ILE HG12 84 HIS HD2 4.26182
35 ILE HG13 84 HIS HD2 3.86182
35 ILE HN 35 ILE QD1 5.75455
35 ILE HN 35 ILE QG1 5.05091
35 ILE HN 35 ILE QG2 3.44727
35 ILE QD1 36 GLU- HN 5.22727
35 ILE QD1 84 HIS HA 4.31273
35 ILE QD1 84 HIS HB2 5.45455
35 ILE QD1 84 HIS HB3 5.45455
35 ILE QD1 84 HIS HD2 3.82
35 ILE QD1 84 HIS QB 4.71273
35 ILE QG1 36 GLU- HN 4.13455
35 ILE QG1 84 HIS HA 4.03636
35 ILE QG1 84 HIS HD2 3.81455
35 ILE QG2 35 ILE QD1 3.20727
35 ILE QG2 64 LEU QD1 4.04
35 ILE QG2 64 LEU QD2 3.84
35 ILE QG2 64 LEU QQD 3.52727
35 ILE QG2 84 HIS HD2 4.36909
36 GLU- HA 36 GLU- HB3 2.74
36 GLU- HB3 36 GLU- QG 2.67
36 GLU- HN 36 GLU- HB2 3.17
36 GLU- HN 36 GLU- HB3 3.62
36 GLU- HA 36 GLU- HG2 3.16364
36 GLU- HA 36 GLU- HG3 3.26364
36 GLU- HA 36 GLU- QG 2.98182
36 GLU- HA 37 VAL HN 2.4
36 GLU- HN 36 GLU- HG2 3.1
36 GLU- HN 36 GLU- HG3 3.0
36 GLU- HN 83 ASN HN 3.70909
36 GLU- HN 87 LEU QQD 7.57
37 VAL HN 37 VAL QG2 4.66
37 VAL QG1 38 ASP- HN 4.91
37 VAL QG1 66 TYR QB 6.73
37 VAL QG1 66 TYR QD 5.07
37 VAL QG1 66 TYR QE 6.19
37 VAL QG1 82 VAL HA 5.00
37 VAL QG1 82 VAL QG2 5.34
37 VAL QG1 82 VAL QG1 6.52
37 VAL QG2 38 ASP- HN 5.64
37 VAL QG2 64 LEU QQD 6.42
37 VAL QG2 66 TYR QD 5.39
37 VAL QG2 66 TYR QE 5.01
37 VAL QG2 82 VAL HA 5.07
37 VAL QG2 82 VAL QG2 6.93
37 VAL HB 66 TYR QD 4.24364
37 VAL HB 66 TYR QE 4.47455
37 VAL HN 37 VAL HB 3.50182
38 ASP- HA 38 ASP- QB 2.90182
38 ASP- HB2 40 LEU QD2 4.46
38 ASP- HN 38 ASP- QB 4.10182
38 ASP- HN 81 ARG+ HN 3.72
38 ASP- QB 40 LEU QQD 6.34909
38 ASP- QB 45 ARG+ QD 5.04
39 LEU QQD 49 VAL QG1 6.91
39 LEU QQD 49 VAL QG2 7.09
39 LEU HA 39 LEU HG 2.70545
39 LEU HA 39 LEU QB 2.76
39 LEU HA 39 LEU QQD 4.68
39 LEU HA 80 CYSS HA 3.06545
39 LEU HA 81 ARG+ HN 3.77455
39 LEU HN 39 LEU HG 3.45091
39 LEU HN 39 LEU QB 3.80727
39 LEU HN 39 LEU QB 3.88
39 LEU HN 39 LEU QQD 4.77818
39 LEU HN 46 ILE HN 3.86182
39 LEU QB 39 LEU QQD 2.84727
39 LEU QQD 46 ILE QG2 5.92364
39 LEU QQD 67 TYR HA 5.33455
39 LEU QQD 68 THR HA 6.44727
39 LEU QQD 68 THR HB 5.54
39 LEU QQD 68 THR HN 6.26
39 LEU QQD 81 ARG+ HN 6.20
40 LEU HA 40 LEU HB2 2.86909
40 LEU HA 40 LEU HB3 2.86909
40 LEU HA 40 LEU QB 2.69818
40 LEU HA 40 LEU QD1 4.38545
40 LEU HA 40 LEU QD2 4.38545
40 LEU HA 40 LEU QQD 3.37091
40 LEU HA 41 LYS+ HN 3.05455
40 LEU HA 45 ARG+ HA 2.66182
40 LEU HB2 40 LEU HG 2.58545
40 LEU HB3 40 LEU HG 2.58545
40 LEU HN 40 LEU QB 4.04727
40 LEU HN 40 LEU QQD 6.85091
40 LEU HN 79 ALA HN 2.98909
40 LEU HN 80 CYSS HA 3.69818
40 LEU QD1 41 LYS+ HN 4.33091
40 LEU QD2 41 LYS+ HN 4.43091
40 LEU QQD 41 LYS+ HN 3.72
40 LEU QQD 45 ARG+ HA 4.68
40 LEU QQD 45 ARG+ HN 6.65455
40 LEU QQD 45 ARG+ QD 6.34909
40 LEU QQD 45 ARG+ QG 6.29455
41 LYS+ HA 41 LYS+ HG2 3.22
41 LYS+ HA 41 LYS+ HG3 3.12
41 LYS+ HA 41 LYS+ QB 2.86909
41 LYS+ HA 41 LYS+ QG 2.81455
41 LYS+ HA 78 TYR HA 2.80364
41 LYS+ HA 78 TYR QD 4.10909
41 LYS+ HA 79 ALA HN 3.36
41 LYS+ HG2 41 LYS+ HE2 4.50545
41 LYS+ HG2 41 LYS+ HE3 4.50545
41 LYS+ HG2 42 ASN HN 5.45455
41 LYS+ HG3 41 LYS+ HE2 4.50545
41 LYS+ HG3 41 LYS+ HE3 4.50545
41 LYS+ HG3 42 ASN HN 5.45455
41 LYS+ HN 41 LYS+ HB2 3.36
41 LYS+ HN 41 LYS+ HB3 3.56
41 LYS+ HN 41 LYS+ HD2 3.56
41 LYS+ HN 41 LYS+ HD3 3.36
41 LYS+ HN 41 LYS+ QB 3.14182
41 LYS+ HN 41 LYS+ QE 4.26727
41 LYS+ HN 41 LYS+ QG 3.86182
41 LYS+ HN 44 GLU- HN 3.8
41 LYS+ QB 41 LYS+ QE 4.84364
41 LYS+ QB 42 ASN HN 6.61455
41 LYS+ QB 78 TYR QD 5.29091
41 LYS+ QB 78 TYR QE 4.68
41 LYS+ QD 41 LYS+ QE 2.42182
41 LYS+ QD 42 ASN QD2 5.83
41 LYS+ QD 78 TYR QD 5.06182
41 LYS+ QD 78 TYR QE 4.15636
41 LYS+ QG 41 LYS+ QE 3.55636
41 LYS+ QG 42 ASN HN 4.93091
41 LYS+ QG 78 TYR QE 4.89818
42 ASN HA 42 ASN HB2 2.83
42 ASN HA 42 ASN HB3 2.68
42 ASN HB3 42 ASN QD2 3.70
42 ASN HB3 43 GLY HN 4.14
42 ASN HN 42 ASN HB3 4.19
42 ASN HN 43 GLY HN 3.61091
42 ASN HN 77 GLU- HN 4.01455
42 ASN HN 78 TYR HA 4.71091
42 ASN QD2 44 GLU- HN 3.93818
44 GLU- HA 44 GLU- QG 3.81818
44 GLU- HA 45 ARG+ HN 2.70545
44 GLU- HN 44 GLU- HB2 3.26182
44 GLU- HN 44 GLU- HB3 3.26182
44 GLU- HN 44 GLU- QB 2.97818
44 GLU- HN 44 GLU- QG 4.65818
45 ARG+ HA 45 ARG+ QB 2.76
45 ARG+ HA 45 ARG+ QG 3.76364
45 ARG+ HN 45 ARG+ QB 3.77455
45 ARG+ QG 45 ARG+ QD 2.68364
46 ILE HA 46 ILE HB 3.04727
46 ILE HA 46 ILE QG1 3.70909
46 ILE HA 46 ILE QG2 2.92364
46 ILE HA 47 GLU- HN 2.85818
46 ILE HN 46 ILE HB 2.66182
46 ILE HN 46 ILE QG1 3.69818
46 ILE HN 47 GLU- HN 4.30909
46 ILE QD1 78 TYR QD 4.13
46 ILE QD1 78 TYR QE 3.92
47 GLU- HA 47 GLU- HG2 3.20727
47 GLU- HA 47 GLU- HG3 3.20727
47 GLU- HA 47 GLU- QB 2.74909
47 GLU- HA 47 GLU- QG 2.91273
47 GLU- HA 48 LYS+ HN 3.64545
47 GLU- HN 47 GLU- HB2 3.85091
47 GLU- HN 47 GLU- HB3 3.85091
47 GLU- HN 47 GLU- HG2 4.39636
47 GLU- HN 47 GLU- HG3 4.39636
47 GLU- HN 47 GLU- QB 3.43636
47 GLU- HN 47 GLU- QG 4.10182
47 GLU- HN 48 LYS+ HN 3.66545
48 LYS+ HA 48 LYS+ QB 2.84727
48 LYS+ HA 49 VAL HN 2.44364
48 LYS+ HN 48 LYS+ QG 4.53818
49 VAL QG1 50 GLU- HN 5.34
49 VAL QG1 68 THR HB 4.66
49 VAL QG2 50 GLU- HN 5.58
49 VAL QG2 68 THR HB 4.54
49 VAL HA 49 VAL HB 3.03273
49 VAL HA 50 GLU- HN 2.65091
49 VAL HA 68 THR HA 3.37091
49 VAL HA 68 THR HB 2.88
49 VAL HB 50 GLU- HN 5.45455
49 VAL HN 49 VAL HA 3.14182
49 VAL HN 49 VAL HB 3.19636
50 GLU- HA 50 GLU- HB2 2.76
50 GLU- HA 50 GLU- HB3 2.94
50 GLU- HB3 50 GLU- QG 2.53
50 GLU- HB3 67 TYR QE 3.95
50 GLU- HN 50 GLU- HB2 4.13
50 GLU- HN 50 GLU- HB3 3.22
50 GLU- HA 50 GLU- QG 3.76364
50 GLU- HA 51 HIS HN 2.65091
50 GLU- HN 50 GLU- QG 4.40182
50 GLU- HN 67 TYR HN 3.76364
50 GLU- HN 68 THR HA 3.36
50 GLU- HN 68 THR HB 4.23273
50 GLU- QG 51 HIS HN 4.64727
50 GLU- QG 67 TYR QE 5.21455
51 HIS HA 51 HIS HB2 2.92364
51 HIS HA 51 HIS HB3 2.92364
51 HIS HA 51 HIS QB 2.59636
51 HIS HA 66 TYR HA 2.71636
51 HIS HA 67 TYR HN 3.42545
51 HIS HA 67 TYR QE 4.13455
51 HIS HN 51 HIS HD2 3.37091
51 HIS QB 51 HIS HD2 3.55636
51 HIS QB 52 SER HN 4.42909
52 SER HN 52 SER HA 2.87091
52 SER HN 52 SER HB2 3.78545
52 SER HN 52 SER HB3 3.78545
52 SER HA 53 ASP- HN 4.0
52 SER HN 65 LEU HN 3.8
52 SER HN 66 TYR HA 3.661
52 SER HN 67 TYR QE 4.77818
54 LEU HA 54 LEU QD1 4.04727
54 LEU HA 54 LEU QD2 4.04727
54 LEU HA 54 LEU QQD 3.22909
54 LEU HA 55 SER HN 2.74909
54 LEU HG 55 SER HN 4.61091
54 LEU HG 62 PHE QD 4.58364
54 LEU QD1 55 SER HN 5.45455
54 LEU QD1 62 PHE QD 4.36364
54 LEU QD2 55 SER HN 5.45455
54 LEU QD2 62 PHE QD 4.56364
54 LEU QQD 55 SER HN 4.50545
54 LEU QQD 62 PHE QB 6.30
54 LEU QQD 62 PHE QD 4.20727
54 LEU QQD 62 PHE QE 5.62909
55 SER HA 55 SER QB 2.92364
55 SER HN 55 SER HA 2.94909
55 SER HN 55 SER HB2 3.21818
55 SER HN 55 SER HB3 3.21818
55 SER HN 63 TYR HN 3.8
55 SER QB 63 TYR QE 4.54909
56 PHE HA 56 PHE QD 3.88364
56 PHE HA 57 SER HN 3.39273
56 PHE HA 62 PHE HA 2.82545
56 PHE HA 62 PHE HN 3.92364
56 PHE HA 62 PHE QD 4.76727
56 PHE HA 62 PHE QE 5.60727
56 PHE HA 63 TYR HN 3.91636
56 PHE HA 63 TYR QD 5.45455
56 PHE HA 63 TYR QE 4.65091
56 PHE HN 56 PHE QB 3.96
56 PHE QB 62 PHE HA 4.35273
56 PHE QB 62 PHE HZ 5.29091
56 PHE QB 62 PHE QD 4.50545
56 PHE QB 62 PHE QE 4.53818
56 PHE QD 62 PHE HA 4.16909
56 PHE QD 62 PHE HZ 5.16181
56 PHE QD 62 PHE QD 5.26909
56 PHE QD 62 PHE QE 4.93091
56 PHE QE 58 LYS+ QG 4.73
57 SER HA 57 SER HB2 3.21818
57 SER HA 57 SER HB3 3.21818
57 SER HA 63 TYR QE 4.52
57 SER HB2 63 TYR QE 5.00
57 SER HB3 63 TYR QE 5.00
57 SER QB 63 TYR QE 4.73
58 LYS+ HA 58 LYS+ QD 5.36727
58 LYS+ HA 58 LYS+ QG 4.14545
58 LYS+ HA 59 ASP- HA 4.38727
58 LYS+ QG 58 LYS+ QE 3.77455
59 ASP- HA 59 ASP- QB 2.78182
59 ASP- HA 60 TRP HD1 4.34
59 ASP- HN 59 ASP- QB 4.12364
59 ASP- QB 60 TRP HD1 5.04
59 ASP- QB 61 SER QB 5.18
60 TRP HA 60 TRP HD1 4.09091
60 TRP HA 60 TRP HE3 4.04727
60 TRP HA 60 TRP QB 2.91273
60 TRP QB 60 TRP HD1 3.78545
60 TRP QB 60 TRP HE3 3.67636
62 PHE HA 62 PHE QD 3.28364
62 PHE HA 62 PHE QE 4.66545
62 PHE HA 63 TYR HN 2.79273
62 PHE HN 62 PHE QB 4.04727
62 PHE QB 63 TYR HN 4.68
62 PHE QD 63 TYR HN 3.98182
62 PHE QE 63 TYR HN 5.31273
63 TYR HA 63 TYR HB2 2.86
63 TYR HA 63 TYR HB3 2.73
63 TYR HB2 64 LEU HN 3.72
63 TYR HB3 64 LEU HN 3.72
63 TYR HA 63 TYR QD 3.59273
63 TYR HN 63 TYR QD 3.90545
63 TYR QD 64 LEU HN 6.54545
63 TYR QE 64 LEU HN 5.66727
64 LEU HA 64 LEU QD1 6.54545
64 LEU HA 64 LEU QD2 6.54545
64 LEU HG 65 LEU HN 3.94727
64 LEU HG 66 TYR QE 4.09091
64 LEU HN 64 LEU HG 4.17455
64 LEU QD1 66 TYR QD 4.96182
64 LEU QD1 66 TYR QE 4.52182
64 LEU QD2 66 TYR QD 4.76182
64 LEU QD2 66 TYR QE 4.52182
64 LEU QQD 66 TYR QE 3.84545
65 LEU QQD 67 TYR HB3 5.64
65 LEU HA 65 LEU HG 2.55273
65 LEU HA 65 LEU QD1 4.71273
65 LEU HA 65 LEU QD2 4.71273
65 LEU HA 65 LEU QQD 3.54545
65 LEU HG 66 TYR HN 3.89818
65 LEU HN 65 LEU QB 3.84
65 LEU HN 65 LEU QD1 5.04364
65 LEU HN 65 LEU QD2 5.14364
65 LEU HN 65 LEU QQD 4.84364
65 LEU QB 65 LEU HG 2.71636
65 LEU QB 66 TYR HN 4.40727
65 LEU QD1 67 TYR QD 5.54909
65 LEU QD1 67 TYR QE 5.24727
65 LEU QD2 67 TYR QD 5.14909
65 LEU QD2 67 TYR QE 4.84727
65 LEU QQD 66 TYR HN 6.28364
65 LEU QQD 67 TYR QD 4.5309
66 TYR HA 66 TYR HB2 3.00182
66 TYR HA 66 TYR HB3 2.90182
66 TYR HA 66 TYR QB 2.79636
66 TYR HA 66 TYR QD 3.85091
66 TYR HA 67 TYR HN 2.61818
66 TYR HA 67 TYR QD 4.30909
66 TYR HN 66 TYR QD 4.14182
67 TYR HA 67 TYR HB2 2.80
67 TYR HA 67 TYR HB3 2.55
67 TYR HB2 68 THR HN 3.84
67 TYR HB3 68 THR HN 3.29
67 TYR HN 67 TYR HB3 3.60
67 TYR HA 68 THR HN 2.88
67 TYR HN 67 TYR QD 4.21091
67 TYR HN 67 TYR QE 5.14909
67 TYR QD 68 THR HN 4.45091
68 THR HA 68 THR HB 2.49818
68 THR HA 68 THR QG2 3.77636
68 THR HA 69 GLU- HN 2.84
68 THR HN 68 THR HB 4.02545
68 THR HN 68 THR QG2 4.11273
68 THR QG2 69 GLU- HN 6.54545
68 THR QG2 70 PHE HN 4.11273
68 THR QG2 70 PHE QB 4.77818
68 THR QG2 70 PHE QD 5.45455
69 GLU- HA 69 GLU- HB2 2.79273
69 GLU- HA 69 GLU- HB3 2.79273
69 GLU- HA 69 GLU- QB 2.68727
69 GLU- HA 70 PHE HN 2.90182
69 GLU- HN 69 GLU- QB 3.86182
69 GLU- HN 69 GLU- QG 6.41455
69 GLU- HN 70 PHE HN 3.82182
70 PHE HA 70 PHE HB2 2.52
70 PHE HA 70 PHE HB3 2.72
70 PHE HA 70 PHE QD 3.67091
70 PHE HA 71 THR HN 2.79273
70 PHE HN 70 PHE HA 2.98909
70 PHE HN 70 PHE QD 3.36
70 PHE HN 71 THR HN 4.52
70 PHE HZ 95 TRP HZ2 4.0690
70 PHE QB 71 THR HN 4.24364
70 PHE QD 71 THR HN 3.90909
70 PHE QD 72 PRO QG 5.64
70 PHE QD 78 TYR QD 4.62
70 PHE QD 78 TYR QE 4.70364
70 PHE QD 95 TRP HE3 5.20909
70 PHE QD 95 TRP HH2 4.67818
70 PHE QD 95 TRP HZ3 4.03455
71 THR HA 71 THR QG2 3.14182
71 THR HA 72 PRO HD2 3.21818
71 THR HA 72 PRO HD3 3.21818
71 THR HA 72 PRO QD 2.98909
71 THR HN 71 THR HB 3.15273
71 THR HN 71 THR QG2 4.82182
72 PRO HA 73 THR HN 2.47636
72 PRO QB 73 THR HN 4.29818
73 THR HA 73 THR HB 2.55636
73 THR HA 73 THR QG2 3.46
73 THR HA 74 GLU- HN 2.56364
73 THR HB 74 GLU- HN 3.84
73 THR HN 73 THR QG2 4.42909
74 GLU- HA 74 GLU- QG 4.06909
74 GLU- HA 76 ASP- HN 4.57273
74 GLU- HN 74 GLU- QB 3.90545
75 LYS+ HA 75 LYS+ QB 2.86909
75 LYS+ HA 76 ASP- HN 3.43636
75 LYS+ HN 75 LYS+ QG 4.89818
75 LYS+ HN 76 ASP- HN 3.28364
76 ASP- HA 76 ASP- HB2 3.01455
76 ASP- HA 76 ASP- HB3 2.81455
76 ASP- HA 77 GLU- HN 2.64
76 ASP- HN 76 ASP- QB 4.18909
76 ASP- QB 78 TYR QE 5.14
77 GLU- HA 77 GLU- HB2 2.64
77 GLU- HA 77 GLU- HB3 3.07
77 GLU- HN 77 GLU- HB2 3.22
77 GLU- HN 77 GLU- HB3 3.33
77 GLU- HA 77 GLU- QG 4.14545
77 GLU- HA 78 TYR HN 2.60727
77 GLU- HN 77 GLU- HA 3.13091
77 GLU- HN 77 GLU- QG 7.50545
78 TYR HA 78 TYR HB2 3.07
78 TYR HA 78 TYR HB3 2.87
78 TYR HB2 95 TRP HE3 3.12
78 TYR HB3 95 TRP HE3 3.54
78 TYR HN 78 TYR HB2 3.70
78 TYR HN 78 TYR HB3 3.93
78 TYR HA 78 TYR QD 3.31636
78 TYR HA 79 ALA HN 2.70545
78 TYR HN 78 TYR QD 3.86182
78 TYR HN 79 ALA HN 4.51636
78 TYR HN 95 TRP HE3 3.90545
78 TYR QD 79 ALA HN 4.3527
78 TYR QD 95 TRP HE3 4.14
79 ALA HA 80 CYSS HN 2.71636
79 ALA HA 94 LYS+ HA 2.41091
79 ALA HA 95 TRP HN 3.15273
79 ALA HN 79 ALA HA 2.90182
79 ALA HN 79 ALA QB 3.65455
79 ALA QB 80 CYSS HN 3.45818
79 ALA QB 94 LYS+ HA 3.01091
79 ALA QB 95 TRP HN 4.40727
80 CYSS HA 81 ARG+ HN 2.76
80 CYSS HN 80 CYSS QB 3.94909
80 CYSS HN 94 LYS+ HA 3.52364
81 ARG+ HA 81 ARG+ HB2 2.59
81 ARG+ HA 81 ARG+ HB3 2.98
81 ARG+ HN 81 ARG+ HB2 3.46
81 ARG+ HN 81 ARG+ HB3 3.76
81 ARG+ HA 81 ARG+ HG2 3.04364
81 ARG+ HA 81 ARG+ HG3 3.04364
81 ARG+ HA 81 ARG+ QG 2.74909
81 ARG+ HA 92 ILE HA 2.56364
81 ARG+ HA 92 ILE QD1 3.21818
81 ARG+ HA 92 ILE QG2 3.6
81 ARG+ HN 81 ARG+ QG 4.96364
82 VAL HN 82 VAL QG2 4.18
82 VAL HN 82 VAL QG1 4.36
82 VAL HA 82 VAL HB 3.29455
82 VAL HN 91 LYS+ HN 3.29636
82 VAL HN 92 ILE HA 3.13818
83 ASN HA 83 ASN HB2 3.10909
83 ASN HA 83 ASN HB3 3.10909
83 ASN HA 83 ASN QB 2.73818
83 ASN HA 84 HIS HN 2.65091
83 ASN HA 90 PRO HA 2.83636
83 ASN HA 91 LYS+ HN 3.94909
83 ASN HN 83 ASN QB 4.04727
84 HIS HN 87 LEU HB2 3.95
84 HIS HA 84 HIS HD2 3.12727
84 HIS HB2 84 HIS HD2 4.27636
84 HIS HB3 84 HIS HD2 4.27636
84 HIS HD2 85 VAL HN 3.30545
84 HIS HE1 86 THR QG2 3.66
84 HIS HN 84 HIS HA 3.16364
84 HIS HN 84 HIS QB 3.94909
84 HIS HN 87 LEU HN 3.44
84 HIS HN 87 LEU QQD 5.74909
84 HIS QB 84 HIS HD2 3.89455
84 HIS QB 87 LEU HN 4.86545
84 HIS QB 87 LEU QQD 6.44727
85 VAL HN 85 VAL QG1 4.35
85 VAL QG1 86 THR HA 5.24
85 VAL QG1 86 THR HN 5.43
85 VAL HA 85 VAL HB 2.64727
85 VAL HA 86 THR HN 3.53455
85 VAL HN 85 VAL HA 3.16364
85 VAL HN 85 VAL HB 3.10909
86 THR HA 86 THR HB 2.84
86 THR HA 86 THR QG2 3.55636
86 THR HA 87 LEU HN 3.62182
86 THR HN 86 THR QG2 4.32727
86 THR QG2 87 LEU HN 4.63636
87 LEU HA 87 LEU HB3 2.74
87 LEU HB2 87 LEU QQD 2.85
87 LEU HB2 89 GLN HN 4.02
87 LEU HB3 89 GLN HN 3.57
87 LEU HN 87 LEU HB3 3.54
87 LEU HA 87 LEU HG 2.80364
87 LEU HA 87 LEU QQD 4.58182
87 LEU HG 89 GLN HN 4.29091
87 LEU HN 87 LEU HG 4.20727
87 LEU HN 87 LEU QQD 5.61818
87 LEU QQD 89 GLN HN 6.49091
88 SER HA 88 SER QB 2.77091
88 SER HA 89 GLN HN 3.54545
88 SER QB 89 GLN HN 4.49455
89 GLN HA 89 GLN HB2 2.97
89 GLN HA 89 GLN HB3 2.87
89 GLN HN 89 GLN HB2 3.75
89 GLN HA 89 GLN HG2 3.84
89 GLN HA 89 GLN HG3 3.84
89 GLN HA 89 GLN QG 3.57818
89 GLN HA 90 PRO HD2 2.76
89 GLN HA 90 PRO HD3 2.76
89 GLN HA 90 PRO QD 2.43273
89 GLN HN 89 GLN HA 2.94545
89 GLN HN 89 GLN HG2 4.29818
89 GLN HN 89 GLN HG3 4.29818
89 GLN HN 89 GLN QG 3.78545
91 LYS+ HA 92 ILE HN 2.41091
91 LYS+ HN 91 LYS+ QB 3.70909
92 ILE HA 92 ILE QD1 2.96727
92 ILE HA 92 ILE QG1 4.17818
92 ILE HA 92 ILE QG2 3.16364
92 ILE HN 92 ILE QD1 4.08
92 ILE HN 92 ILE QG1 4.34182
92 ILE QG2 92 ILE QD1 3.77455
93 VAL HN 93 VAL QG1 4.79
93 VAL QG1 94 LYS+ HN 4.50
93 VAL HA 94 LYS+ HN 2.74909
93 VAL HN 93 VAL HB 3.04364
94 LYS+ HA 94 LYS+ QG 3.67636
94 LYS+ HA 95 TRP HN 2.50909
94 LYS+ HN 94 LYS+ QB 3.44727
94 LYS+ QB 95 TRP HN 3.94909
95 TRP HB2 95 TRP HD1 3.65
95 TRP HB2 95 TRP HE3 3.68
95 TRP HB3 95 TRP HD1 3.95
95 TRP HB3 95 TRP HE3 2.91
95 TRP HN 95 TRP HB2 3.32
95 TRP HN 95 TRP HB3 3.11
95 TRP HD1 96 ASP- HN 3.42545
95 TRP HE1 97 ARG+ HA 3.92
95 TRP HZ2 97 ARG+ HA 3.90545
96 ASP- HN 96 ASP- HB2 3.58
96 ASP- HN 96 ASP- HB3 3.76
96 ASP- HA 96 ASP- HB2 2.74
96 ASP- HA 97 ARG+ HN 2.75
96 ASP- HB3 97 ARG+ HN 3.86
97 ARG+ HA 97 ARG+ HB2 3.04364
97 ARG+ HA 97 ARG+ HB3 3.04364
97 ARG+ HA 97 ARG+ QB 2.81455
97 ARG+ HA 98 ASP- HN 3.41455
97 ARG+ HN 97 ARG+ HB2 3.84
97 ARG+ HN 97 ARG+ HB3 3.84
97 ARG+ HN 97 ARG+ QB 3.57818
97 ARG+ HN 98 ASP- HN 3.78545
97 ARG+ QB 97 ARG+ QD 3.86182
97 ARG+ QB 97 ARG+ QG 2.71636
97 ARG+ QG 98 ASP- HA 7.50545
97 ARG+ QG 99 MET QG 8.45455
98 ASP- HN 98 ASP- HB2 3.30545
98 ASP- HN 98 ASP- HB3 3.30545
98 ASP- HN 99 MET HN 3.40364
99 MET HA 99 MET QG 4.40727
99 MET HN 99 MET HB2 3.99273
99 MET HN 99 MET HB3 3.99273
99 MET HN 99 MET QB 3.68727




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   0          1H        MET   0  -8.108 -23.112  -6.316
    2   2H    MET   0          2H        MET   0  -7.482 -21.603  -6.085
    3   3H    MET   0          3H        MET   0  -6.564 -22.773  -6.803
    4    HA   MET   0           HA       MET   0  -7.422 -22.572  -4.044
    5   1HB   MET   0          1HB       MET   0  -7.768 -24.867  -4.933
    6   2HB   MET   0          2HB       MET   0  -6.058 -24.954  -5.375
    7   1HG   MET   0          1HG       MET   0  -6.654 -26.155  -3.286
    8   2HG   MET   0          2HG       MET   0  -5.404 -24.947  -3.047
    9   1HE   MET   0          1HE       MET   0  -5.589 -25.071  -0.523
   10   2HE   MET   0          2HE       MET   0  -7.077 -24.847   0.424
   11   3HE   MET   0          3HE       MET   0  -6.874 -26.302  -0.580
   12    H    ILE   1           H        ILE   1  -5.432 -22.797  -2.584
   13    HA   ILE   1           HA       ILE   1  -3.465 -22.069  -1.838
   14    HB   ILE   1           HB       ILE   1  -2.398 -22.085  -4.672
   15   1HG1  ILE   1          1HG1      ILE   1  -3.321 -24.306  -4.253
   16   2HG1  ILE   1          2HG1      ILE   1  -1.569 -24.333  -4.276
   17   1HG2  ILE   1          1HG2      ILE   1  -1.068 -22.119  -1.948
   18   2HG2  ILE   1          2HG2      ILE   1  -0.236 -22.584  -3.448
   19   3HG2  ILE   1          3HG2      ILE   1  -0.859 -20.949  -3.261
   20   1HD1  ILE   1          1HD1      ILE   1  -1.501 -24.439  -1.804
   21   2HD1  ILE   1          2HD1      ILE   1  -3.279 -24.374  -1.748
   22   3HD1  ILE   1          3HD1      ILE   1  -2.462 -25.756  -2.493
   23    H    GLN   2           H        GLN   2  -5.353 -20.368  -1.847
   24    HA   GLN   2           HA       GLN   2  -4.580 -17.844  -3.208
   25   1HB   GLN   2          1HB       GLN   2  -7.156 -18.912  -2.060
   26   2HB   GLN   2          2HB       GLN   2  -6.953 -17.277  -2.717
   27   1HG   GLN   2          1HG       GLN   2  -6.484 -18.068  -4.908
   28   2HG   GLN   2          2HG       GLN   2  -6.227 -19.724  -4.367
   29   1HE2  GLN   2          2HE2      GLN   2  -8.910 -17.381  -3.722
   30   2HE2  GLN   2          1HE2      GLN   2 -10.169 -18.440  -4.319
   31    H    ARG   3           H        ARG   3  -2.824 -17.603  -1.363
   32    HA   ARG   3           HA       ARG   3  -3.870 -16.785   1.256
   33   1HB   ARG   3          1HB       ARG   3  -1.149 -16.873  -0.017
   34   2HB   ARG   3          2HB       ARG   3  -1.448 -15.916   1.447
   35   1HG   ARG   3          1HG       ARG   3  -2.141 -17.741   2.731
   36   2HG   ARG   3          2HG       ARG   3  -2.177 -18.840   1.336
   37   1HD   ARG   3          1HD       ARG   3   0.134 -18.899   1.133
   38   2HD   ARG   3          2HD       ARG   3   0.415 -17.409   2.034
   39    HE   ARG   3           HE       ARG   3   0.080 -20.123   3.063
   40   1HH1  ARG   3          1HH2      ARG   3  -0.009 -16.657   3.941
   41   2HH1  ARG   3          2HH2      ARG   3   0.218 -16.981   5.638
   42   1HH2  ARG   3          1HH1      ARG   3   0.431 -20.486   5.281
   43   2HH2  ARG   3          2HH1      ARG   3   0.492 -19.151   6.401
   44    H    THR   4           H        THR   4  -5.182 -15.101   1.159
   45    HA   THR   4           HA       THR   4  -5.067 -12.982  -0.696
   46    HB   THR   4           HB       THR   4  -7.101 -13.827   0.328
   47    HG1  THR   4           HG1      THR   4  -6.696 -11.098   0.941
   48   1HG2  THR   4          1HG2      THR   4  -6.257 -12.366   2.864
   49   2HG2  THR   4          2HG2      THR   4  -7.785 -13.216   2.564
   50   3HG2  THR   4          3HG2      THR   4  -6.271 -14.136   2.675
   51    HA   PRO   5           HA       PRO   5  -2.173 -10.160   1.238
   52   1HB   PRO   5          1HB       PRO   5  -3.124  -7.713   0.388
   53   2HB   PRO   5          2HB       PRO   5  -2.244  -8.878  -0.648
   54   1HG   PRO   5          1HG       PRO   5  -5.240  -8.535  -0.359
   55   2HG   PRO   5          2HG       PRO   5  -4.286  -8.577  -1.871
   56   1HD   PRO   5          1HD       PRO   5  -5.509 -10.789  -1.017
   57   2HD   PRO   5          2HD       PRO   5  -3.825 -10.934  -1.571
   58    H    LYS   6           H        LYS   6  -2.068  -9.843   3.351
   59    HA   LYS   6           HA       LYS   6  -4.257  -8.621   4.912
   60   1HB   LYS   6          1HB       LYS   6  -2.884 -10.544   5.788
   61   2HB   LYS   6          2HB       LYS   6  -1.461  -9.491   5.714
   62   1HG   LYS   6          1HG       LYS   6  -2.892  -7.824   7.121
   63   2HG   LYS   6          2HG       LYS   6  -3.947  -9.211   7.428
   64   1HD   LYS   6          1HD       LYS   6  -2.041 -10.460   8.397
   65   2HD   LYS   6          2HD       LYS   6  -0.937  -9.137   7.958
   66   1HE   LYS   6          1HE       LYS   6  -2.289  -7.581   9.404
   67   2HE   LYS   6          2HE       LYS   6  -3.235  -8.977   9.955
   68   1HZ   LYS   6          1HZ       LYS   6  -1.204  -9.912  10.810
   69   2HZ   LYS   6          2HZ       LYS   6  -0.331  -8.627  10.254
   70   3HZ   LYS   6          3HZ       LYS   6  -1.451  -8.408  11.441
   71    H    ILE   7           H        ILE   7  -4.408  -6.463   4.504
   72    HA   ILE   7           HA       ILE   7  -2.062  -4.839   3.869
   73    HB   ILE   7           HB       ILE   7  -3.581  -3.096   3.415
   74   1HG1  ILE   7          1HG1      ILE   7  -6.161  -3.744   3.608
   75   2HG1  ILE   7          2HG1      ILE   7  -5.617  -4.664   5.008
   76   1HG2  ILE   7          1HG2      ILE   7  -4.867  -5.670   2.439
   77   2HG2  ILE   7          2HG2      ILE   7  -4.871  -4.083   1.664
   78   3HG2  ILE   7          3HG2      ILE   7  -3.355  -4.984   1.801
   79   1HD1  ILE   7          1HD1      ILE   7  -4.719  -2.531   5.998
   80   2HD1  ILE   7          2HD1      ILE   7  -5.172  -1.669   4.519
   81   3HD1  ILE   7          3HD1      ILE   7  -6.421  -2.372   5.557
   82    H    GLN   8           H        GLN   8  -0.996  -3.389   5.298
   83    HA   GLN   8           HA       GLN   8  -2.514  -2.398   7.594
   84   1HB   GLN   8          1HB       GLN   8  -0.262  -2.464   8.769
   85   2HB   GLN   8          2HB       GLN   8  -1.278  -3.910   8.808
   86   1HG   GLN   8          1HG       GLN   8   1.057  -3.537   6.908
   87   2HG   GLN   8          2HG       GLN   8   1.215  -4.249   8.519
   88   1HE2  GLN   8          2HE2      GLN   8   1.641  -5.389   5.719
   89   2HE2  GLN   8          1HE2      GLN   8   0.672  -6.853   5.733
   90    H    VAL   9           H        VAL   9  -2.906  -0.597   6.309
   91    HA   VAL   9           HA       VAL   9  -0.604   0.826   5.110
   92    HB   VAL   9           HB       VAL   9  -3.584   1.305   4.793
   93   1HG1  VAL   9          1HG1      VAL   9  -1.149   2.425   3.324
   94   2HG1  VAL   9          2HG1      VAL   9  -2.835   2.659   2.832
   95   3HG1  VAL   9          3HG1      VAL   9  -2.251   3.330   4.367
   96   1HG2  VAL   9          1HG2      VAL   9  -1.584  -0.125   2.982
   97   2HG2  VAL   9          2HG2      VAL   9  -2.942  -0.872   3.836
   98   3HG2  VAL   9          3HG2      VAL   9  -3.252   0.294   2.546
   99    H    TYR  10           H        TYR  10   0.420   2.040   6.595
  100    HA   TYR  10           HA       TYR  10  -1.187   3.622   8.563
  101   1HB   TYR  10          1HB       TYR  10   0.733   3.373  10.046
  102   2HB   TYR  10          2HB       TYR  10  -0.118   1.890   9.654
  103    HD1  TYR  10           HD1      TYR  10   0.966   0.053   8.588
  104    HD2  TYR  10           HD2      TYR  10   3.053   3.774   9.168
  105    HE1  TYR  10           HE1      TYR  10   3.076  -1.024   7.868
  106    HE2  TYR  10           HE2      TYR  10   5.178   2.678   8.497
  107    HH   TYR  10           HH       TYR  10   5.308  -0.720   7.381
  108    H    SER  11           H        SER  11  -0.288   5.590   9.301
  109    HA   SER  11           HA       SER  11   1.353   7.151   7.421
  110   1HB   SER  11          1HB       SER  11   0.896   8.956   9.133
  111   2HB   SER  11          2HB       SER  11  -0.527   8.282   8.328
  112    HG   SER  11           HG       SER  11  -0.774   8.463  10.616
  113    H    ARG  12           H        ARG  12   3.557   7.379   7.776
  114    HA   ARG  12           HA       ARG  12   4.791   6.053  10.081
  115   1HB   ARG  12          1HB       ARG  12   5.567   6.335   7.508
  116   2HB   ARG  12          2HB       ARG  12   6.426   7.712   8.204
  117   1HG   ARG  12          1HG       ARG  12   6.606   4.798   9.086
  118   2HG   ARG  12          2HG       ARG  12   7.802   5.683   8.127
  119   1HD   ARG  12          1HD       ARG  12   8.186   7.232  10.034
  120   2HD   ARG  12          2HD       ARG  12   7.011   6.305  10.996
  121    HE   ARG  12           HE       ARG  12   9.067   4.612   9.916
  122   1HH1  ARG  12          1HH2      ARG  12   8.420   6.935  12.525
  123   2HH1  ARG  12          2HH2      ARG  12   9.533   6.185  13.640
  124   1HH2  ARG  12          1HH1      ARG  12  10.518   3.636  11.389
  125   2HH2  ARG  12          2HH1      ARG  12  10.736   4.300  12.988
  126    H    HIS  13           H        HIS  13   4.594   9.323   8.683
  127    HA   HIS  13           HA       HIS  13   5.626  10.637  11.150
  128   1HB   HIS  13          1HB       HIS  13   5.303  11.463   8.252
  129   2HB   HIS  13          2HB       HIS  13   5.883  12.550   9.515
  130    HD2  HIS  13           HD2      HIS  13   7.976  12.426   7.383
  131    HE1  HIS  13           HE1      HIS  13   9.777   9.132   9.337
  132    HE2  HIS  13           HE2      HIS  13  10.134  10.950   7.580
  133    HA   PRO  14           HA       PRO  14   1.559  12.268  11.893
  134   1HB   PRO  14          1HB       PRO  14   1.926  14.745  12.965
  135   2HB   PRO  14          2HB       PRO  14   2.450  13.241  13.771
  136   1HG   PRO  14          1HG       PRO  14   4.143  15.111  12.102
  137   2HG   PRO  14          2HG       PRO  14   4.511  14.444  13.717
  138   1HD   PRO  14          1HD       PRO  14   5.486  13.339  11.443
  139   2HD   PRO  14          2HD       PRO  14   5.013  12.310  12.813
  140    H    ALA  15           H        ALA  15   0.190  12.654  10.250
  141    HA   ALA  15           HA       ALA  15   0.840  13.916   7.842
  142   1HB   ALA  15          1HB       ALA  15  -1.926  13.349   8.952
  143   2HB   ALA  15          2HB       ALA  15  -1.465  13.528   7.245
  144   3HB   ALA  15          3HB       ALA  15  -0.872  12.147   8.191
  145    H    GLU  16           H        GLU  16   1.076  15.977   7.333
  146    HA   GLU  16           HA       GLU  16  -0.769  18.058   8.347
  147   1HB   GLU  16          1HB       GLU  16   2.267  18.079   8.615
  148   2HB   GLU  16          2HB       GLU  16   1.265  19.540   8.692
  149   1HG   GLU  16          1HG       GLU  16   0.028  18.569  10.628
  150   2HG   GLU  16          2HG       GLU  16   1.104  17.162  10.594
  151    H    ASN  17           H        ASN  17  -1.327  19.452   6.724
  152    HA   ASN  17           HA       ASN  17  -0.573  18.925   4.042
  153   1HB   ASN  17          1HB       ASN  17  -1.970  20.848   3.533
  154   2HB   ASN  17          2HB       ASN  17  -2.759  19.828   4.733
  155   1HD2  ASN  17          2HD2      ASN  17  -1.645  23.030   4.029
  156   2HD2  ASN  17          1HD2      ASN  17  -1.985  23.719   5.601
  157    H    GLY  18           H        GLY  18   0.776  20.021   2.626
  158   1HA   GLY  18          1HA       GLY  18   2.457  21.428   1.918
  159   2HA   GLY  18          2HA       GLY  18   2.373  22.333   3.434
  160    H    LYS  19           H        LYS  19   2.822  20.380   5.323
  161    HA   LYS  19           HA       LYS  19   5.688  20.024   5.147
  162   1HB   LYS  19          1HB       LYS  19   4.531  20.828   7.095
  163   2HB   LYS  19          2HB       LYS  19   3.649  19.288   7.174
  164   1HG   LYS  19          1HG       LYS  19   5.420  19.484   8.889
  165   2HG   LYS  19          2HG       LYS  19   5.674  18.094   7.850
  166   1HD   LYS  19          1HD       LYS  19   7.080  20.689   7.168
  167   2HD   LYS  19          2HD       LYS  19   7.633  19.749   8.559
  168   1HE   LYS  19          1HE       LYS  19   7.937  17.736   7.182
  169   2HE   LYS  19          2HE       LYS  19   7.412  18.607   5.738
  170   1HZ   LYS  19          1HZ       LYS  19   9.768  19.214   7.363
  171   2HZ   LYS  19          2HZ       LYS  19   9.747  18.546   5.858
  172   3HZ   LYS  19          3HZ       LYS  19   9.257  20.105   6.069
  173    H    SER  20           H        SER  20   5.497  18.728   3.451
  174    HA   SER  20           HA       SER  20   4.664  16.329   2.739
  175   1HB   SER  20          1HB       SER  20   6.843  15.695   1.763
  176   2HB   SER  20          2HB       SER  20   6.299  17.340   1.428
  177    HG   SER  20           HG       SER  20   8.119  16.598   3.489
  178    H    ASN  21           H        ASN  21   4.518  14.374   3.487
  179    HA   ASN  21           HA       ASN  21   5.705  13.745   6.146
  180   1HB   ASN  21          1HB       ASN  21   3.228  14.491   5.661
  181   2HB   ASN  21          2HB       ASN  21   3.009  12.838   5.122
  182   1HD2  ASN  21          2HD2      ASN  21   2.150  11.624   6.790
  183   2HD2  ASN  21          1HD2      ASN  21   2.518  11.813   8.484
  184    H    PHE  22           H        PHE  22   4.283  11.011   6.031
  185    HA   PHE  22           HA       PHE  22   5.522   9.727   3.755
  186   1HB   PHE  22          1HB       PHE  22   6.939   9.709   6.285
  187   2HB   PHE  22          2HB       PHE  22   6.439   8.079   5.868
  188    HD1  PHE  22           HD1      PHE  22   6.891   7.193   3.509
  189    HD2  PHE  22           HD2      PHE  22   8.845  10.674   5.135
  190    HE1  PHE  22           HE1      PHE  22   8.654   7.016   1.772
  191    HE2  PHE  22           HE2      PHE  22  10.629  10.464   3.427
  192    HZ   PHE  22           HZ       PHE  22  10.515   8.661   1.718
  193    H    LEU  23           H        LEU  23   4.125   8.434   2.978
  194    HA   LEU  23           HA       LEU  23   1.997   7.148   4.606
  195   1HB   LEU  23          1HB       LEU  23   1.169   8.599   2.906
  196   2HB   LEU  23          2HB       LEU  23   2.281   7.948   1.704
  197    HG   LEU  23           HG       LEU  23   0.967   5.806   1.804
  198   1HD1  LEU  23          1HD1      LEU  23  -0.722   7.474   3.713
  199   2HD1  LEU  23          2HD1      LEU  23  -1.237   5.932   2.987
  200   3HD1  LEU  23          3HD1      LEU  23   0.125   5.967   4.119
  201   1HD2  LEU  23          1HD2      LEU  23   0.433   7.617   0.164
  202   2HD2  LEU  23          2HD2      LEU  23  -1.046   6.781   0.681
  203   3HD2  LEU  23          3HD2      LEU  23  -0.636   8.373   1.358
  204    H    ASN  24           H        ASN  24   2.230   4.980   4.957
  205    HA   ASN  24           HA       ASN  24   4.154   3.422   3.258
  206   1HB   ASN  24          1HB       ASN  24   3.618   3.498   6.227
  207   2HB   ASN  24          2HB       ASN  24   4.356   2.108   5.412
  208   1HD2  ASN  24          2HD2      ASN  24   5.059   5.591   4.660
  209   2HD2  ASN  24          1HD2      ASN  24   6.729   5.479   5.159
  210    H    CYS  25           H        CYS  25   2.635   2.453   1.875
  211    HA   CYS  25           HA       CYS  25   0.471   0.855   3.098
  212   1HB   CYS  25          1HB       CYS  25   1.475   0.558   0.268
  213   2HB   CYS  25          2HB       CYS  25  -0.019  -0.014   0.988
  214    H    TYR  26           H        TYR  26   1.011  -1.063   4.061
  215    HA   TYR  26           HA       TYR  26   3.386  -2.555   3.056
  216   1HB   TYR  26          1HB       TYR  26   3.907  -1.555   5.249
  217   2HB   TYR  26          2HB       TYR  26   2.428  -2.173   5.909
  218    HD1  TYR  26           HD1      TYR  26   3.367  -3.472   7.710
  219    HD2  TYR  26           HD2      TYR  26   4.848  -4.061   3.716
  220    HE1  TYR  26           HE1      TYR  26   4.145  -5.744   8.331
  221    HE2  TYR  26           HE2      TYR  26   5.629  -6.308   4.322
  222    HH   TYR  26           HH       TYR  26   5.931  -7.834   6.024
  223    H    VAL  27           H        VAL  27   2.786  -4.516   2.300
  224    HA   VAL  27           HA       VAL  27   0.197  -5.677   3.232
  225    HB   VAL  27           HB       VAL  27   1.350  -5.954   0.420
  226   1HG1  VAL  27          1HG1      VAL  27  -1.481  -6.385   1.471
  227   2HG1  VAL  27          2HG1      VAL  27  -0.812  -6.883  -0.099
  228   3HG1  VAL  27          3HG1      VAL  27  -0.307  -7.691   1.393
  229   1HG2  VAL  27          1HG2      VAL  27  -0.838  -4.098   1.351
  230   2HG2  VAL  27          2HG2      VAL  27   0.747  -3.602   0.716
  231   3HG2  VAL  27          3HG2      VAL  27  -0.386  -4.461  -0.342
  232    H    SER  28           H        SER  28   0.362  -7.876   3.771
  233    HA   SER  28           HA       SER  28   2.591  -9.417   2.819
  234   1HB   SER  28          1HB       SER  28   3.568  -9.942   5.032
  235   2HB   SER  28          2HB       SER  28   3.676  -8.219   4.749
  236    HG   SER  28           HG       SER  28   2.319  -7.855   6.304
  237    H    GLY  29           H        GLY  29   2.558 -11.607   4.428
  238   1HA   GLY  29          1HA       GLY  29   1.310 -13.382   5.190
  239   2HA   GLY  29          2HA       GLY  29  -0.187 -12.476   4.947
  240    H    PHE  30           H        PHE  30   0.567 -11.796   2.118
  241    HA   PHE  30           HA       PHE  30  -0.810 -13.966   0.918
  242   1HB   PHE  30          1HB       PHE  30  -0.743 -12.657  -1.092
  243   2HB   PHE  30          2HB       PHE  30  -1.194 -11.700   0.276
  244    HD1  PHE  30           HD1      PHE  30   0.177  -9.742   0.951
  245    HD2  PHE  30           HD2      PHE  30   1.463 -12.400  -2.188
  246    HE1  PHE  30           HE1      PHE  30   1.978  -8.170   0.318
  247    HE2  PHE  30           HE2      PHE  30   3.205 -10.793  -2.846
  248    HZ   PHE  30           HZ       PHE  30   3.463  -8.691  -1.588
  249    H    HIS  31           H        HIS  31  -0.123 -15.013  -1.070
  250    HA   HIS  31           HA       HIS  31   2.413 -14.705  -2.248
  251   1HB   HIS  31          1HB       HIS  31   3.598 -16.569  -1.911
  252   2HB   HIS  31          2HB       HIS  31   2.934 -16.383  -0.303
  253    HD2  HIS  31           HD2      HIS  31   1.755 -18.436  -3.512
  254    HE1  HIS  31           HE1      HIS  31   1.852 -20.945  -0.111
  255    HE2  HIS  31           HE2      HIS  31   1.321 -20.855  -2.611
  256    HA   PRO  32           HA       PRO  32   3.260 -16.185  -4.174
  257   1HB   PRO  32          1HB       PRO  32   3.219 -16.250  -6.889
  258   2HB   PRO  32          2HB       PRO  32   2.607 -17.601  -5.915
  259   1HG   PRO  32          1HG       PRO  32   0.982 -15.331  -7.105
  260   2HG   PRO  32          2HG       PRO  32   0.733 -17.090  -7.336
  261   1HD   PRO  32          1HD       PRO  32  -0.597 -15.658  -5.403
  262   2HD   PRO  32          2HD       PRO  32  -0.099 -17.350  -5.147
  263    H    SER  33           H        SER  33   4.233 -14.720  -6.429
  264    HA   SER  33           HA       SER  33   4.656 -12.261  -5.042
  265   1HB   SER  33          1HB       SER  33   6.394 -11.956  -6.758
  266   2HB   SER  33          2HB       SER  33   6.407 -13.656  -6.240
  267    HG   SER  33           HG       SER  33   5.117 -14.124  -8.086
  268    H    ASP  34           H        ASP  34   2.391 -12.984  -7.559
  269    HA   ASP  34           HA       ASP  34   2.765 -10.509  -8.979
  270   1HB   ASP  34          1HB       ASP  34   2.077 -12.570 -10.078
  271   2HB   ASP  34          2HB       ASP  34   0.585 -12.618  -9.136
  272    H    ILE  35           H        ILE  35   2.547  -8.987  -7.199
  273    HA   ILE  35           HA       ILE  35  -0.288  -8.138  -6.916
  274    HB   ILE  35           HB       ILE  35   0.571  -9.083  -4.900
  275   1HG1  ILE  35          1HG1      ILE  35   0.185  -6.097  -4.527
  276   2HG1  ILE  35          2HG1      ILE  35  -1.121  -7.230  -4.825
  277   1HG2  ILE  35          1HG2      ILE  35   2.942  -8.471  -5.145
  278   2HG2  ILE  35          2HG2      ILE  35   2.498  -6.776  -4.759
  279   3HG2  ILE  35          3HG2      ILE  35   2.257  -8.074  -3.568
  280   1HD1  ILE  35          1HD1      ILE  35  -0.290  -8.534  -2.766
  281   2HD1  ILE  35          2HD1      ILE  35   0.688  -7.119  -2.396
  282   3HD1  ILE  35          3HD1      ILE  35  -1.066  -6.953  -2.489
  283    H    GLU  36           H        GLU  36  -0.766  -6.036  -6.952
  284    HA   GLU  36           HA       GLU  36   1.227  -4.080  -7.974
  285   1HB   GLU  36          1HB       GLU  36  -1.683  -4.133  -8.761
  286   2HB   GLU  36          2HB       GLU  36  -0.296  -3.350  -9.534
  287   1HG   GLU  36          1HG       GLU  36   0.573  -5.682 -10.045
  288   2HG   GLU  36          2HG       GLU  36  -0.933  -6.325  -9.412
  289    H    VAL  37           H        VAL  37   1.271  -2.180  -6.809
  290    HA   VAL  37           HA       VAL  37  -1.057  -1.307  -5.212
  291    HB   VAL  37           HB       VAL  37   1.704  -1.887  -4.093
  292   1HG1  VAL  37          1HG1      VAL  37  -0.706  -0.885  -2.538
  293   2HG1  VAL  37          2HG1      VAL  37   0.878  -1.311  -1.891
  294   3HG1  VAL  37          3HG1      VAL  37   0.718   0.104  -2.932
  295   1HG2  VAL  37          1HG2      VAL  37   0.535  -3.950  -4.244
  296   2HG2  VAL  37          2HG2      VAL  37   0.256  -3.436  -2.574
  297   3HG2  VAL  37          3HG2      VAL  37  -1.014  -3.209  -3.770
  298    H    ASP  38           H        ASP  38  -1.153   0.200  -6.910
  299    HA   ASP  38           HA       ASP  38   0.854   2.330  -7.078
  300   1HB   ASP  38          1HB       ASP  38  -1.990   2.320  -8.181
  301   2HB   ASP  38          2HB       ASP  38  -0.614   3.308  -8.664
  302    H    LEU  39           H        LEU  39   0.806   4.159  -5.746
  303    HA   LEU  39           HA       LEU  39  -1.399   4.405  -3.781
  304   1HB   LEU  39          1HB       LEU  39   1.199   5.955  -4.067
  305   2HB   LEU  39          2HB       LEU  39  -0.061   6.200  -2.846
  306    HG   LEU  39           HG       LEU  39   0.339   3.511  -2.558
  307   1HD1  LEU  39          1HD1      LEU  39   3.098   4.639  -3.145
  308   2HD1  LEU  39          2HD1      LEU  39   2.711   3.009  -2.562
  309   3HD1  LEU  39          3HD1      LEU  39   2.235   3.490  -4.196
  310   1HD2  LEU  39          1HD2      LEU  39   0.275   5.065  -0.725
  311   2HD2  LEU  39          2HD2      LEU  39   1.809   4.169  -0.604
  312   3HD2  LEU  39          3HD2      LEU  39   1.791   5.814  -1.254
  313    H    LEU  40           H        LEU  40  -2.934   6.022  -3.890
  314    HA   LEU  40           HA       LEU  40  -3.166   7.458  -6.474
  315   1HB   LEU  40          1HB       LEU  40  -3.707   4.908  -6.526
  316   2HB   LEU  40          2HB       LEU  40  -5.095   5.324  -5.542
  317    HG   LEU  40           HG       LEU  40  -5.757   5.097  -7.817
  318   1HD1  LEU  40          1HD1      LEU  40  -5.667   8.106  -7.349
  319   2HD1  LEU  40          2HD1      LEU  40  -6.822   7.196  -8.327
  320   3HD1  LEU  40          3HD1      LEU  40  -6.816   6.994  -6.564
  321   1HD2  LEU  40          1HD2      LEU  40  -3.439   5.528  -8.758
  322   2HD2  LEU  40          2HD2      LEU  40  -4.784   6.216  -9.691
  323   3HD2  LEU  40          3HD2      LEU  40  -3.819   7.261  -8.648
  324    H    LYS  41           H        LYS  41  -3.856   9.498  -5.797
  325    HA   LYS  41           HA       LYS  41  -5.146   9.803  -3.270
  326   1HB   LYS  41          1HB       LYS  41  -4.596  11.768  -5.504
  327   2HB   LYS  41          2HB       LYS  41  -4.896  12.165  -3.787
  328   1HG   LYS  41          1HG       LYS  41  -2.884  11.305  -3.079
  329   2HG   LYS  41          2HG       LYS  41  -2.591  10.324  -4.514
  330   1HD   LYS  41          1HD       LYS  41  -1.168  12.193  -4.518
  331   2HD   LYS  41          2HD       LYS  41  -2.215  12.215  -5.923
  332   1HE   LYS  41          1HE       LYS  41  -3.600  13.919  -5.102
  333   2HE   LYS  41          2HE       LYS  41  -3.034  13.712  -3.431
  334   1HZ   LYS  41          1HZ       LYS  41  -0.946  14.623  -4.043
  335   2HZ   LYS  41          2HZ       LYS  41  -1.395  14.761  -5.629
  336   3HZ   LYS  41          3HZ       LYS  41  -2.135  15.684  -4.475
  337    H    ASN  42           H        ASN  42  -6.635  12.158  -4.778
  338    HA   ASN  42           HA       ASN  42  -9.266  10.997  -4.715
  339   1HB   ASN  42          1HB       ASN  42 -10.046  13.160  -5.250
  340   2HB   ASN  42          2HB       ASN  42  -8.660  13.420  -4.190
  341   1HD2  ASN  42          2HD2      ASN  42  -6.447  13.743  -5.511
  342   2HD2  ASN  42          1HD2      ASN  42  -6.593  14.742  -6.937
  343    H    GLY  43           H        GLY  43  -6.950  11.857  -7.282
  344   1HA   GLY  43          1HA       GLY  43  -7.803   9.724  -8.961
  345   2HA   GLY  43          2HA       GLY  43  -8.452  11.259  -9.580
  346    H    GLU  44           H        GLU  44  -5.382  10.715  -7.835
  347    HA   GLU  44           HA       GLU  44  -3.772  11.283 -10.278
  348   1HB   GLU  44          1HB       GLU  44  -4.075  13.400  -9.172
  349   2HB   GLU  44          2HB       GLU  44  -3.686  12.708  -7.594
  350   1HG   GLU  44          1HG       GLU  44  -1.359  12.225  -8.399
  351   2HG   GLU  44          2HG       GLU  44  -1.773  12.956  -9.958
  352    H    ARG  45           H        ARG  45  -2.417   9.619 -10.520
  353    HA   ARG  45           HA       ARG  45  -1.744   7.838  -8.309
  354   1HB   ARG  45          1HB       ARG  45  -2.222   7.005 -10.605
  355   2HB   ARG  45          2HB       ARG  45  -0.764   7.828 -11.185
  356   1HG   ARG  45          1HG       ARG  45   0.649   6.487  -9.704
  357   2HG   ARG  45          2HG       ARG  45  -0.768   5.751  -8.937
  358   1HD   ARG  45          1HD       ARG  45  -0.084   5.474 -11.889
  359   2HD   ARG  45          2HD       ARG  45   0.413   4.332 -10.618
  360    HE   ARG  45           HE       ARG  45  -2.426   4.782 -10.556
  361   1HH1  ARG  45          1HH2      ARG  45   0.094   3.010 -12.321
  362   2HH1  ARG  45          2HH2      ARG  45  -0.952   1.678 -12.733
  363   1HH2  ARG  45          1HH1      ARG  45  -3.791   3.024 -11.107
  364   2HH2  ARG  45          2HH1      ARG  45  -3.168   1.689 -12.042
  365    H    ILE  46           H        ILE  46   0.070   7.823  -7.106
  366    HA   ILE  46           HA       ILE  46   2.053   9.939  -7.404
  367    HB   ILE  46           HB       ILE  46   1.371   7.775  -5.387
  368   1HG1  ILE  46          1HG1      ILE  46   1.102  10.765  -4.948
  369   2HG1  ILE  46          2HG1      ILE  46  -0.194   9.888  -5.762
  370   1HG2  ILE  46          1HG2      ILE  46   3.411  10.007  -5.303
  371   2HG2  ILE  46          2HG2      ILE  46   2.901   9.019  -3.903
  372   3HG2  ILE  46          3HG2      ILE  46   3.734   8.251  -5.269
  373   1HD1  ILE  46          1HD1      ILE  46  -0.338   8.289  -3.859
  374   2HD1  ILE  46          2HD1      ILE  46   0.820   9.305  -2.962
  375   3HD1  ILE  46          3HD1      ILE  46  -0.746   9.943  -3.490
  376    H    GLU  47           H        GLU  47   3.392   9.350  -9.085
  377    HA   GLU  47           HA       GLU  47   4.221   6.608  -9.582
  378   1HB   GLU  47          1HB       GLU  47   5.186   9.268 -10.706
  379   2HB   GLU  47          2HB       GLU  47   5.674   7.664 -11.282
  380   1HG   GLU  47          1HG       GLU  47   3.235   7.139 -11.700
  381   2HG   GLU  47          2HG       GLU  47   2.852   8.831 -11.352
  382    H    LYS  48           H        LYS  48   5.351   9.195  -7.521
  383    HA   LYS  48           HA       LYS  48   8.117   8.245  -7.334
  384   1HB   LYS  48          1HB       LYS  48   6.480  10.455  -6.057
  385   2HB   LYS  48          2HB       LYS  48   8.070  10.011  -5.432
  386   1HG   LYS  48          1HG       LYS  48   8.214  11.897  -6.933
  387   2HG   LYS  48          2HG       LYS  48   9.173  10.521  -7.495
  388   1HD   LYS  48          1HD       LYS  48   7.523   9.963  -9.189
  389   2HD   LYS  48          2HD       LYS  48   6.399  11.196  -8.585
  390   1HE   LYS  48          1HE       LYS  48   9.164  11.725  -9.782
  391   2HE   LYS  48          2HE       LYS  48   7.632  11.833 -10.663
  392   1HZ   LYS  48          1HZ       LYS  48   8.406  13.486  -8.367
  393   2HZ   LYS  48          2HZ       LYS  48   8.312  13.962  -9.942
  394   3HZ   LYS  48          3HZ       LYS  48   6.943  13.541  -9.127
  395    H    VAL  49           H        VAL  49   7.305   6.023  -6.847
  396    HA   VAL  49           HA       VAL  49   6.687   5.616  -3.950
  397    HB   VAL  49           HB       VAL  49   6.516   3.635  -6.250
  398   1HG1  VAL  49          1HG1      VAL  49   6.835   2.561  -4.071
  399   2HG1  VAL  49          2HG1      VAL  49   5.538   3.545  -3.360
  400   3HG1  VAL  49          3HG1      VAL  49   5.169   2.334  -4.604
  401   1HG2  VAL  49          1HG2      VAL  49   4.364   5.363  -4.971
  402   2HG2  VAL  49          2HG2      VAL  49   4.867   5.319  -6.674
  403   3HG2  VAL  49          3HG2      VAL  49   4.032   3.931  -5.973
  404    H    GLU  50           H        GLU  50   8.318   4.805  -2.681
  405    HA   GLU  50           HA       GLU  50  10.643   3.440  -3.956
  406   1HB   GLU  50          1HB       GLU  50  11.020   5.592  -2.554
  407   2HB   GLU  50          2HB       GLU  50  10.607   4.586  -1.159
  408   1HG   GLU  50          1HG       GLU  50  12.437   3.024  -1.761
  409   2HG   GLU  50          2HG       GLU  50  12.832   4.061  -3.146
  410    H    HIS  51           H        HIS  51  11.317   1.487  -2.653
  411    HA   HIS  51           HA       HIS  51   9.135   0.375  -0.980
  412   1HB   HIS  51          1HB       HIS  51   9.332  -1.810  -2.117
  413   2HB   HIS  51          2HB       HIS  51   8.704  -0.543  -3.162
  414    HD2  HIS  51           HD2      HIS  51  12.585  -1.370  -2.661
  415    HE1  HIS  51           HE1      HIS  51  11.448  -2.157  -6.648
  416    HE2  HIS  51           HE2      HIS  51  13.405  -2.136  -4.992
  417    H    SER  52           H        SER  52   9.802  -1.595   0.121
  418    HA   SER  52           HA       SER  52  12.675  -1.526   0.943
  419   1HB   SER  52          1HB       SER  52  10.926  -1.209   2.724
  420   2HB   SER  52          2HB       SER  52  10.364  -2.861   2.381
  421    HG   SER  52           HG       SER  52  12.985  -2.101   3.177
  422    H    ASP  53           H        ASP  53  11.265  -2.774  -1.514
  423    HA   ASP  53           HA       ASP  53  11.588  -4.485  -2.883
  424   1HB   ASP  53          1HB       ASP  53  13.798  -5.377  -0.984
  425   2HB   ASP  53          2HB       ASP  53  13.573  -5.895  -2.649
  426    H    LEU  54           H        LEU  54  11.631  -6.977  -3.100
  427    HA   LEU  54           HA       LEU  54   9.456  -7.996  -1.513
  428   1HB   LEU  54          1HB       LEU  54  10.013  -8.511  -3.985
  429   2HB   LEU  54          2HB       LEU  54  11.158  -9.684  -3.341
  430    HG   LEU  54           HG       LEU  54   9.143 -10.833  -3.837
  431   1HD1  LEU  54          1HD1      LEU  54  10.172 -11.459  -1.651
  432   2HD1  LEU  54          2HD1      LEU  54   8.908 -10.491  -0.851
  433   3HD1  LEU  54          3HD1      LEU  54   8.459 -11.860  -1.830
  434   1HD2  LEU  54          1HD2      LEU  54   7.529  -8.845  -2.197
  435   2HD2  LEU  54          2HD2      LEU  54   7.620  -8.898  -3.971
  436   3HD2  LEU  54          3HD2      LEU  54   6.913 -10.226  -3.061
  437    H    SER  55           H        SER  55   9.651  -8.765   0.425
  438    HA   SER  55           HA       SER  55  12.061 -10.292   1.304
  439   1HB   SER  55          1HB       SER  55  12.078  -8.065   2.387
  440   2HB   SER  55          2HB       SER  55  10.405  -8.300   2.921
  441    HG   SER  55           HG       SER  55  12.662  -9.880   3.631
  442    H    PHE  56           H        PHE  56  11.035 -12.292   0.825
  443    HA   PHE  56           HA       PHE  56   8.309 -12.739   1.838
  444   1HB   PHE  56          1HB       PHE  56   8.325 -14.767   0.705
  445   2HB   PHE  56          2HB       PHE  56   8.903 -13.517  -0.363
  446    HD1  PHE  56           HD1      PHE  56  11.389 -13.417  -0.913
  447    HD2  PHE  56           HD2      PHE  56   9.450 -16.771   0.971
  448    HE1  PHE  56           HE1      PHE  56  13.147 -14.929  -1.797
  449    HE2  PHE  56           HE2      PHE  56  11.194 -18.284   0.069
  450    HZ   PHE  56           HZ       PHE  56  13.055 -17.367  -1.300
  451    H    SER  57           H        SER  57  10.759 -12.299   3.643
  452    HA   SER  57           HA       SER  57  11.665 -12.981   5.543
  453   1HB   SER  57          1HB       SER  57   9.328 -12.679   6.192
  454   2HB   SER  57          2HB       SER  57   8.996 -14.403   5.923
  455    HG   SER  57           HG       SER  57  10.327 -14.868   7.630
  456    H    LYS  58           H        LYS  58  12.443 -14.770   3.393
  457    HA   LYS  58           HA       LYS  58  11.770 -17.053   2.615
  458   1HB   LYS  58          1HB       LYS  58  14.203 -16.032   2.895
  459   2HB   LYS  58          2HB       LYS  58  14.366 -17.167   4.232
  460   1HG   LYS  58          1HG       LYS  58  14.020 -19.056   2.734
  461   2HG   LYS  58          2HG       LYS  58  13.615 -17.998   1.380
  462   1HD   LYS  58          1HD       LYS  58  16.309 -17.679   2.721
  463   2HD   LYS  58          2HD       LYS  58  16.028 -19.077   1.685
  464   1HE   LYS  58          1HE       LYS  58  17.058 -17.320   0.379
  465   2HE   LYS  58          2HE       LYS  58  15.432 -17.650  -0.225
  466   1HZ   LYS  58          1HZ       LYS  58  16.193 -15.413   1.523
  467   2HZ   LYS  58          2HZ       LYS  58  15.913 -15.319  -0.095
  468   3HZ   LYS  58          3HZ       LYS  58  14.681 -15.700   0.929
  469    H    ASP  59           H        ASP  59  10.061 -16.907   4.712
  470    HA   ASP  59           HA       ASP  59  10.300 -19.598   5.916
  471   1HB   ASP  59          1HB       ASP  59   8.428 -17.271   6.412
  472   2HB   ASP  59          2HB       ASP  59   8.344 -18.854   7.219
  473    H    TRP  60           H        TRP  60   7.105 -18.508   5.538
  474    HA   TRP  60           HA       TRP  60   6.572 -19.671   2.896
  475   1HB   TRP  60          1HB       TRP  60   5.164 -20.646   5.409
  476   2HB   TRP  60          2HB       TRP  60   4.750 -21.055   3.743
  477    HD1  TRP  60           HD1      TRP  60   7.305 -21.786   6.436
  478    HE1  TRP  60           HE1      TRP  60   8.725 -23.854   5.780
  479    HE3  TRP  60           HE3      TRP  60   5.726 -22.361   1.607
  480    HZ2  TRP  60           HZ2      TRP  60   9.099 -25.509   3.482
  481    HZ3  TRP  60           HZ3      TRP  60   6.641 -24.182   0.205
  482    HH2  TRP  60           HH2      TRP  60   8.292 -25.784   1.139
  483    H    SER  61           H        SER  61   6.648 -17.174   3.047
  484    HA   SER  61           HA       SER  61   3.887 -16.205   3.032
  485   1HB   SER  61          1HB       SER  61   4.775 -15.740   5.367
  486   2HB   SER  61          2HB       SER  61   6.056 -14.757   4.632
  487    HG   SER  61           HG       SER  61   3.247 -14.369   4.359
  488    H    PHE  62           H        PHE  62   4.454 -13.560   2.451
  489    HA   PHE  62           HA       PHE  62   6.608 -13.201   0.585
  490   1HB   PHE  62          1HB       PHE  62   4.523 -14.691  -0.483
  491   2HB   PHE  62          2HB       PHE  62   4.063 -13.059  -0.933
  492    HD1  PHE  62           HD1      PHE  62   6.691 -15.680  -1.160
  493    HD2  PHE  62           HD2      PHE  62   5.354 -11.852  -2.638
  494    HE1  PHE  62           HE1      PHE  62   8.386 -15.782  -2.889
  495    HE2  PHE  62           HE2      PHE  62   6.996 -11.996  -4.436
  496    HZ   PHE  62           HZ       PHE  62   8.546 -13.947  -4.605
  497    H    TYR  63           H        TYR  63   6.949 -10.927   0.706
  498    HA   TYR  63           HA       TYR  63   4.625  -9.165   0.731
  499   1HB   TYR  63          1HB       TYR  63   5.077  -8.167   2.947
  500   2HB   TYR  63          2HB       TYR  63   4.569  -9.852   3.009
  501    HD1  TYR  63           HD1      TYR  63   5.724 -11.510   4.147
  502    HD2  TYR  63           HD2      TYR  63   7.466  -7.643   3.386
  503    HE1  TYR  63           HE1      TYR  63   7.259 -11.829   6.031
  504    HE2  TYR  63           HE2      TYR  63   9.105  -8.003   5.172
  505    HH   TYR  63           HH       TYR  63   9.811  -9.420   6.876
  506    H    LEU  64           H        LEU  64   5.312  -6.898   1.317
  507    HA   LEU  64           HA       LEU  64   7.995  -6.052   0.969
  508   1HB   LEU  64          1HB       LEU  64   7.905  -4.992  -1.206
  509   2HB   LEU  64          2HB       LEU  64   7.694  -6.722  -1.377
  510    HG   LEU  64           HG       LEU  64   5.608  -4.567  -1.666
  511   1HD1  LEU  64          1HD1      LEU  64   6.554  -6.714  -3.622
  512   2HD1  LEU  64          2HD1      LEU  64   5.384  -5.444  -3.966
  513   3HD1  LEU  64          3HD1      LEU  64   7.074  -5.010  -3.662
  514   1HD2  LEU  64          1HD2      LEU  64   5.314  -7.582  -1.587
  515   2HD2  LEU  64          2HD2      LEU  64   4.323  -6.378  -0.704
  516   3HD2  LEU  64          3HD2      LEU  64   4.148  -6.587  -2.451
  517    H    LEU  65           H        LEU  65   8.163  -3.789   1.275
  518    HA   LEU  65           HA       LEU  65   5.721  -2.439   2.290
  519   1HB   LEU  65          1HB       LEU  65   8.114  -2.918   3.500
  520   2HB   LEU  65          2HB       LEU  65   8.501  -1.394   2.695
  521    HG   LEU  65           HG       LEU  65   6.195  -1.897   4.632
  522   1HD1  LEU  65          1HD1      LEU  65   8.445  -2.000   5.634
  523   2HD1  LEU  65          2HD1      LEU  65   8.824  -0.406   4.947
  524   3HD1  LEU  65          3HD1      LEU  65   7.553  -0.567   6.182
  525   1HD2  LEU  65          1HD2      LEU  65   7.094   0.553   3.092
  526   2HD2  LEU  65          2HD2      LEU  65   5.461  -0.113   3.250
  527   3HD2  LEU  65          3HD2      LEU  65   6.207   0.697   4.629
  528    H    TYR  66           H        TYR  66   5.113  -0.473   1.289
  529    HA   TYR  66           HA       TYR  66   6.705   0.417  -1.039
  530   1HB   TYR  66          1HB       TYR  66   3.686   0.193  -1.255
  531   2HB   TYR  66          2HB       TYR  66   4.894   0.203  -2.514
  532    HD1  TYR  66           HD1      TYR  66   4.697  -1.779  -3.800
  533    HD2  TYR  66           HD2      TYR  66   3.949  -2.067   0.456
  534    HE1  TYR  66           HE1      TYR  66   3.461  -3.893  -4.110
  535    HE2  TYR  66           HE2      TYR  66   2.820  -4.172   0.118
  536    HH   TYR  66           HH       TYR  66   2.064  -5.440  -3.140
  537    H    TYR  67           H        TYR  67   7.297   2.266   0.024
  538    HA   TYR  67           HA       TYR  67   5.164   3.992   1.125
  539   1HB   TYR  67          1HB       TYR  67   7.156   5.064   2.309
  540   2HB   TYR  67          2HB       TYR  67   6.398   3.573   2.813
  541    HD1  TYR  67           HD1      TYR  67   8.943   3.947   0.092
  542    HD2  TYR  67           HD2      TYR  67   8.067   2.519   4.039
  543    HE1  TYR  67           HE1      TYR  67  11.101   2.735   0.124
  544    HE2  TYR  67           HE2      TYR  67  10.245   1.338   4.099
  545    HH   TYR  67           HH       TYR  67  12.416   1.219   1.251
  546    H    THR  68           H        THR  68   5.090   6.102   0.852
  547    HA   THR  68           HA       THR  68   6.786   7.465  -1.218
  548    HB   THR  68           HB       THR  68   4.668   6.704  -2.095
  549    HG1  THR  68           HG1      THR  68   5.716   8.492  -2.952
  550   1HG2  THR  68          1HG2      THR  68   2.612   7.923  -1.520
  551   2HG2  THR  68          2HG2      THR  68   3.223   7.053  -0.091
  552   3HG2  THR  68          3HG2      THR  68   3.443   8.812  -0.246
  553    H    GLU  69           H        GLU  69   6.839   9.855  -0.930
  554    HA   GLU  69           HA       GLU  69   6.518  10.797   1.861
  555   1HB   GLU  69          1HB       GLU  69   7.773  12.846   0.675
  556   2HB   GLU  69          2HB       GLU  69   8.583  11.460   1.376
  557   1HG   GLU  69          1HG       GLU  69   9.567  12.043  -0.756
  558   2HG   GLU  69          2HG       GLU  69   8.923  10.410  -0.772
  559    H    PHE  70           H        PHE  70   4.155  10.691   1.588
  560    HA   PHE  70           HA       PHE  70   2.898  12.307  -0.414
  561   1HB   PHE  70          1HB       PHE  70   0.895  11.613   0.362
  562   2HB   PHE  70          2HB       PHE  70   1.903  10.220   0.711
  563    HD1  PHE  70           HD1      PHE  70   2.931  10.425   3.214
  564    HD2  PHE  70           HD2      PHE  70  -0.711  12.320   1.928
  565    HE1  PHE  70           HE1      PHE  70   1.983  10.208   5.505
  566    HE2  PHE  70           HE2      PHE  70  -1.315  12.676   4.294
  567    HZ   PHE  70           HZ       PHE  70  -0.014  11.556   6.095
  568    H    THR  71           H        THR  71   2.094  14.261  -0.340
  569    HA   THR  71           HA       THR  71   2.137  15.907   2.143
  570    HB   THR  71           HB       THR  71   2.202  16.860  -0.692
  571    HG1  THR  71           HG1      THR  71   4.388  17.066  -0.276
  572   1HG2  THR  71          1HG2      THR  71   2.793  18.149   2.024
  573   2HG2  THR  71          2HG2      THR  71   2.990  18.931   0.443
  574   3HG2  THR  71          3HG2      THR  71   1.371  18.495   1.021
  575    HA   PRO  72           HA       PRO  72  -2.365  15.406   1.117
  576   1HB   PRO  72          1HB       PRO  72  -3.457  15.646   3.568
  577   2HB   PRO  72          2HB       PRO  72  -2.497  14.228   3.082
  578   1HG   PRO  72          1HG       PRO  72  -1.553  16.632   4.680
  579   2HG   PRO  72          2HG       PRO  72  -1.297  14.912   5.060
  580   1HD   PRO  72          1HD       PRO  72   0.549  16.499   3.738
  581   2HD   PRO  72          2HD       PRO  72   0.432  14.738   3.467
  582    H    THR  73           H        THR  73  -2.195  17.402  -0.175
  583    HA   THR  73           HA       THR  73  -2.232  19.963   1.147
  584    HB   THR  73           HB       THR  73  -2.501  20.940  -1.036
  585    HG1  THR  73           HG1      THR  73  -2.932  18.283  -1.900
  586   1HG2  THR  73          1HG2      THR  73  -0.442  20.164  -2.052
  587   2HG2  THR  73          2HG2      THR  73  -0.251  20.170  -0.288
  588   3HG2  THR  73          3HG2      THR  73  -0.507  18.638  -1.154
  589    H    GLU  74           H        GLU  74  -3.880  20.942   2.056
  590    HA   GLU  74           HA       GLU  74  -5.916  21.488   2.772
  591   1HB   GLU  74          1HB       GLU  74  -6.514  21.283  -0.207
  592   2HB   GLU  74          2HB       GLU  74  -7.598  22.014   0.993
  593   1HG   GLU  74          1HG       GLU  74  -5.823  23.629   1.614
  594   2HG   GLU  74          2HG       GLU  74  -4.749  22.921   0.396
  595    H    LYS  75           H        LYS  75  -7.448  19.504   0.292
  596    HA   LYS  75           HA       LYS  75  -8.628  17.799   2.447
  597   1HB   LYS  75          1HB       LYS  75 -10.750  17.925   1.268
  598   2HB   LYS  75          2HB       LYS  75 -10.199  19.525   1.770
  599   1HG   LYS  75          1HG       LYS  75  -9.426  20.021  -0.524
  600   2HG   LYS  75          2HG       LYS  75  -9.909  18.396  -1.054
  601   1HD   LYS  75          1HD       LYS  75 -12.259  18.897  -0.429
  602   2HD   LYS  75          2HD       LYS  75 -11.770  20.530   0.076
  603   1HE   LYS  75          1HE       LYS  75 -10.984  21.004  -2.238
  604   2HE   LYS  75          2HE       LYS  75 -11.476  19.373  -2.737
  605   1HZ   LYS  75          1HZ       LYS  75 -13.264  21.466  -1.715
  606   2HZ   LYS  75          2HZ       LYS  75 -13.117  20.999  -3.288
  607   3HZ   LYS  75          3HZ       LYS  75 -13.724  19.950  -2.172
  608    H    ASP  76           H        ASP  76  -6.272  17.302   0.620
  609    HA   ASP  76           HA       ASP  76  -7.076  15.312  -1.292
  610   1HB   ASP  76          1HB       ASP  76  -4.516  15.651   0.312
  611   2HB   ASP  76          2HB       ASP  76  -4.766  14.409  -0.929
  612    H    GLU  77           H        GLU  77  -7.560  13.200  -1.085
  613    HA   GLU  77           HA       GLU  77  -7.285  11.844   1.566
  614   1HB   GLU  77          1HB       GLU  77  -9.643  12.222   0.976
  615   2HB   GLU  77          2HB       GLU  77  -9.401  11.385  -0.569
  616   1HG   GLU  77          1HG       GLU  77  -8.783   9.307   0.670
  617   2HG   GLU  77          2HG       GLU  77  -8.972  10.171   2.205
  618    H    TYR  78           H        TYR  78  -5.290  10.966   1.217
  619    HA   TYR  78           HA       TYR  78  -4.507   9.718  -1.281
  620   1HB   TYR  78          1HB       TYR  78  -3.291  10.016   1.440
  621   2HB   TYR  78          2HB       TYR  78  -2.646   8.845   0.284
  622    HD1  TYR  78           HD1      TYR  78  -0.932   9.569  -1.116
  623    HD2  TYR  78           HD2      TYR  78  -3.738  12.452   0.406
  624    HE1  TYR  78           HE1      TYR  78   0.366  11.404  -2.185
  625    HE2  TYR  78           HE2      TYR  78  -2.507  14.250  -0.783
  626    HH   TYR  78           HH       TYR  78  -0.439  14.842  -1.662
  627    H    ALA  79           H        ALA  79  -4.694   7.609  -1.844
  628    HA   ALA  79           HA       ALA  79  -5.563   5.608   0.139
  629   1HB   ALA  79          1HB       ALA  79  -7.650   6.408  -0.883
  630   2HB   ALA  79          2HB       ALA  79  -6.983   6.179  -2.512
  631   3HB   ALA  79          3HB       ALA  79  -7.293   4.778  -1.479
  632    H    CYS  80           H        CYS  80  -5.554   3.367  -1.043
  633    HA   CYS  80           HA       CYS  80  -3.049   3.217  -2.650
  634   1HB   CYS  80          1HB       CYS  80  -2.823   3.105  -0.074
  635   2HB   CYS  80          2HB       CYS  80  -3.514   1.487  -0.206
  636    H    ARG  81           H        ARG  81  -3.331   1.963  -4.376
  637    HA   ARG  81           HA       ARG  81  -5.627   0.282  -4.789
  638   1HB   ARG  81          1HB       ARG  81  -4.375   1.279  -6.650
  639   2HB   ARG  81          2HB       ARG  81  -2.934   0.382  -6.145
  640   1HG   ARG  81          1HG       ARG  81  -4.164  -1.772  -6.555
  641   2HG   ARG  81          2HG       ARG  81  -5.536  -0.825  -7.161
  642   1HD   ARG  81          1HD       ARG  81  -4.073   0.063  -8.969
  643   2HD   ARG  81          2HD       ARG  81  -2.706  -0.829  -8.245
  644    HE   ARG  81           HE       ARG  81  -4.955  -2.535  -8.847
  645   1HH1  ARG  81          1HH2      ARG  81  -2.052  -1.059 -10.329
  646   2HH1  ARG  81          2HH2      ARG  81  -1.793  -2.434 -11.385
  647   1HH2  ARG  81          1HH1      ARG  81  -4.635  -4.224 -10.331
  648   2HH2  ARG  81          2HH1      ARG  81  -3.293  -4.175 -11.441
  649    H    VAL  82           H        VAL  82  -5.837  -1.982  -4.283
  650    HA   VAL  82           HA       VAL  82  -3.360  -3.447  -3.578
  651    HB   VAL  82           HB       VAL  82  -6.038  -3.732  -2.147
  652   1HG1  VAL  82          1HG1      VAL  82  -4.662  -5.798  -2.387
  653   2HG1  VAL  82          2HG1      VAL  82  -3.287  -4.942  -1.657
  654   3HG1  VAL  82          3HG1      VAL  82  -4.763  -5.248  -0.706
  655   1HG2  VAL  82          1HG2      VAL  82  -3.426  -2.448  -1.217
  656   2HG2  VAL  82          2HG2      VAL  82  -4.988  -1.626  -1.427
  657   3HG2  VAL  82          3HG2      VAL  82  -4.799  -2.837  -0.167
  658    H    ASN  83           H        ASN  83  -3.120  -4.974  -5.085
  659    HA   ASN  83           HA       ASN  83  -5.468  -6.476  -6.055
  660   1HB   ASN  83          1HB       ASN  83  -5.248  -4.431  -7.467
  661   2HB   ASN  83          2HB       ASN  83  -3.673  -4.997  -8.002
  662   1HD2  ASN  83          2HD2      ASN  83  -3.583  -6.776  -9.510
  663   2HD2  ASN  83          1HD2      ASN  83  -5.033  -7.424 -10.249
  664    H    HIS  84           H        HIS  84  -4.229  -8.035  -4.690
  665    HA   HIS  84           HA       HIS  84  -1.714  -9.213  -5.715
  666   1HB   HIS  84          1HB       HIS  84  -2.337  -9.326  -3.331
  667   2HB   HIS  84          2HB       HIS  84  -3.816 -10.181  -3.768
  668    HD2  HIS  84           HD2      HIS  84   0.108 -10.935  -4.178
  669    HE1  HIS  84           HE1      HIS  84  -2.030 -14.512  -3.529
  670    HE2  HIS  84           HE2      HIS  84   0.298 -13.496  -3.913
  671    H    VAL  85           H        VAL  85  -1.923 -11.464  -6.748
  672    HA   VAL  85           HA       VAL  85  -3.748 -11.589  -8.803
  673    HB   VAL  85           HB       VAL  85  -1.647 -12.822  -8.676
  674   1HG1  VAL  85          1HG1      VAL  85  -1.867 -13.798  -6.404
  675   2HG1  VAL  85          2HG1      VAL  85  -3.137 -14.893  -7.001
  676   3HG1  VAL  85          3HG1      VAL  85  -1.488 -15.008  -7.639
  677   1HG2  VAL  85          1HG2      VAL  85  -3.356 -13.334 -10.399
  678   2HG2  VAL  85          2HG2      VAL  85  -2.350 -14.733  -9.988
  679   3HG2  VAL  85          3HG2      VAL  85  -4.004 -14.622  -9.361
  680    H    THR  86           H        THR  86  -4.305 -12.822  -5.504
  681    HA   THR  86           HA       THR  86  -6.625 -14.378  -6.067
  682    HB   THR  86           HB       THR  86  -7.150 -13.981  -3.642
  683    HG1  THR  86           HG1      THR  86  -6.220 -11.898  -3.486
  684   1HG2  THR  86          1HG2      THR  86  -4.296 -14.790  -4.330
  685   2HG2  THR  86          2HG2      THR  86  -5.135 -15.138  -2.801
  686   3HG2  THR  86          3HG2      THR  86  -5.729 -15.833  -4.331
  687    H    LEU  87           H        LEU  87  -6.204 -10.882  -5.461
  688    HA   LEU  87           HA       LEU  87  -9.052 -10.307  -5.353
  689   1HB   LEU  87          1HB       LEU  87  -6.573  -8.610  -5.695
  690   2HB   LEU  87          2HB       LEU  87  -8.182  -7.952  -5.885
  691    HG   LEU  87           HG       LEU  87  -8.836  -8.518  -3.637
  692   1HD1  LEU  87          1HD1      LEU  87  -6.048  -9.700  -3.340
  693   2HD1  LEU  87          2HD1      LEU  87  -7.124  -9.298  -1.982
  694   3HD1  LEU  87          3HD1      LEU  87  -7.611 -10.539  -3.137
  695   1HD2  LEU  87          1HD2      LEU  87  -7.702  -6.383  -4.112
  696   2HD2  LEU  87          2HD2      LEU  87  -7.343  -6.937  -2.466
  697   3HD2  LEU  87          3HD2      LEU  87  -6.129  -7.127  -3.750
  698    H    SER  88           H        SER  88 -10.226 -10.909  -7.068
  699    HA   SER  88           HA       SER  88  -9.404 -10.751  -9.818
  700   1HB   SER  88          1HB       SER  88 -12.182 -10.938  -8.583
  701   2HB   SER  88          2HB       SER  88 -11.756 -11.275 -10.273
  702    HG   SER  88           HG       SER  88 -10.699 -12.643  -8.015
  703    H    GLN  89           H        GLN  89 -10.282  -8.279  -7.597
  704    HA   GLN  89           HA       GLN  89 -10.629  -6.348  -9.779
  705   1HB   GLN  89          1HB       GLN  89 -12.573  -6.620  -7.457
  706   2HB   GLN  89          2HB       GLN  89 -12.451  -5.206  -8.520
  707   1HG   GLN  89          1HG       GLN  89 -12.911  -6.688 -10.489
  708   2HG   GLN  89          2HG       GLN  89 -13.201  -8.036  -9.371
  709   1HE2  GLN  89          2HE2      GLN  89 -15.207  -7.515 -11.046
  710   2HE2  GLN  89          1HE2      GLN  89 -16.522  -6.688 -10.239
  711    HA   PRO  90           HA       PRO  90  -7.617  -4.607  -7.025
  712   1HB   PRO  90          1HB       PRO  90  -7.299  -2.097  -8.053
  713   2HB   PRO  90          2HB       PRO  90  -6.817  -3.566  -8.947
  714   1HG   PRO  90          1HG       PRO  90  -9.396  -2.022  -9.263
  715   2HG   PRO  90          2HG       PRO  90  -8.263  -2.551 -10.539
  716   1HD   PRO  90          1HD       PRO  90 -10.472  -4.007  -9.899
  717   2HD   PRO  90          2HD       PRO  90  -8.929  -4.811 -10.326
  718    H    LYS  91           H        LYS  91  -8.204  -4.261  -4.967
  719    HA   LYS  91           HA       LYS  91 -10.522  -2.581  -4.252
  720   1HB   LYS  91          1HB       LYS  91  -8.581  -4.259  -2.607
  721   2HB   LYS  91          2HB       LYS  91  -9.944  -3.364  -1.941
  722   1HG   LYS  91          1HG       LYS  91 -10.057  -5.691  -3.909
  723   2HG   LYS  91          2HG       LYS  91 -10.495  -5.730  -2.206
  724   1HD   LYS  91          1HD       LYS  91 -11.947  -4.303  -4.475
  725   2HD   LYS  91          2HD       LYS  91 -12.503  -5.689  -3.549
  726   1HE   LYS  91          1HE       LYS  91 -12.127  -2.855  -2.460
  727   2HE   LYS  91          2HE       LYS  91 -13.658  -3.636  -2.854
  728   1HZ   LYS  91          1HZ       LYS  91 -13.232  -5.245  -1.154
  729   2HZ   LYS  91          2HZ       LYS  91 -11.785  -4.543  -0.786
  730   3HZ   LYS  91          3HZ       LYS  91 -13.188  -3.721  -0.530
  731    H    ILE  92           H        ILE  92 -10.142  -0.435  -4.340
  732    HA   ILE  92           HA       ILE  92  -7.488   0.624  -3.777
  733    HB   ILE  92           HB       ILE  92  -9.999   2.215  -4.323
  734   1HG1  ILE  92          1HG1      ILE  92  -9.945   0.660  -6.152
  735   2HG1  ILE  92          2HG1      ILE  92  -9.373   2.227  -6.703
  736   1HG2  ILE  92          1HG2      ILE  92  -8.040   3.449  -3.511
  737   2HG2  ILE  92          2HG2      ILE  92  -7.009   2.698  -4.735
  738   3HG2  ILE  92          3HG2      ILE  92  -8.306   3.808  -5.228
  739   1HD1  ILE  92          1HD1      ILE  92  -7.608  -0.175  -6.050
  740   2HD1  ILE  92          2HD1      ILE  92  -8.037   0.417  -7.659
  741   3HD1  ILE  92          3HD1      ILE  92  -7.023   1.413  -6.606
  742    H    VAL  93           H        VAL  93  -7.414  -0.297  -1.647
  743    HA   VAL  93           HA       VAL  93  -9.186   0.466   0.468
  744    HB   VAL  93           HB       VAL  93  -6.327  -0.593   0.493
  745   1HG1  VAL  93          1HG1      VAL  93  -8.354  -0.311   2.754
  746   2HG1  VAL  93          2HG1      VAL  93  -6.877  -1.290   2.838
  747   3HG1  VAL  93          3HG1      VAL  93  -6.754   0.460   2.646
  748   1HG2  VAL  93          1HG2      VAL  93  -7.931  -2.168  -0.539
  749   2HG2  VAL  93          2HG2      VAL  93  -7.411  -2.751   1.044
  750   3HG2  VAL  93          3HG2      VAL  93  -9.010  -2.002   0.863
  751    H    LYS  94           H        LYS  94  -9.441   2.553   1.097
  752    HA   LYS  94           HA       LYS  94  -7.389   4.543   0.814
  753   1HB   LYS  94          1HB       LYS  94  -8.799   5.999   2.107
  754   2HB   LYS  94          2HB       LYS  94  -9.673   5.222   0.783
  755   1HG   LYS  94          1HG       LYS  94 -10.758   3.672   2.363
  756   2HG   LYS  94          2HG       LYS  94  -9.832   4.370   3.715
  757   1HD   LYS  94          1HD       LYS  94 -10.812   6.579   3.285
  758   2HD   LYS  94          2HD       LYS  94 -11.696   5.945   1.883
  759   1HE   LYS  94          1HE       LYS  94 -12.959   4.421   3.413
  760   2HE   LYS  94          2HE       LYS  94 -12.105   5.142   4.794
  761   1HZ   LYS  94          1HZ       LYS  94 -13.021   7.266   4.139
  762   2HZ   LYS  94          2HZ       LYS  94 -13.839   6.566   2.896
  763   3HZ   LYS  94          3HZ       LYS  94 -14.221   6.175   4.452
  764    H    TRP  95           H        TRP  95  -6.078   5.476   2.365
  765    HA   TRP  95           HA       TRP  95  -4.786   3.592   4.027
  766   1HB   TRP  95          1HB       TRP  95  -3.303   5.069   3.204
  767   2HB   TRP  95          2HB       TRP  95  -4.452   6.373   3.158
  768    HD1  TRP  95           HD1      TRP  95  -3.040   4.812   6.412
  769    HE1  TRP  95           HE1      TRP  95  -2.227   6.791   7.877
  770    HE3  TRP  95           HE3      TRP  95  -3.434   8.590   3.007
  771    HZ2  TRP  95           HZ2      TRP  95  -2.151   9.680   7.683
  772    HZ3  TRP  95           HZ3      TRP  95  -2.924  10.915   3.649
  773    HH2  TRP  95           HH2      TRP  95  -2.404  11.479   5.998
  774    H    ASP  96           H        ASP  96  -5.753   6.705   5.398
  775    HA   ASP  96           HA       ASP  96  -7.535   6.116   7.433
  776   1HB   ASP  96          1HB       ASP  96  -5.892   4.406   8.252
  777   2HB   ASP  96          2HB       ASP  96  -4.611   5.616   8.215
  778    H    ARG  97           H        ARG  97  -7.018   7.830   9.300
  779    HA   ARG  97           HA       ARG  97  -4.881   9.662   8.723
  780   1HB   ARG  97          1HB       ARG  97  -6.294  11.677   9.119
  781   2HB   ARG  97          2HB       ARG  97  -6.413  10.962   7.512
  782   1HG   ARG  97          1HG       ARG  97  -8.486  10.216   9.590
  783   2HG   ARG  97          2HG       ARG  97  -8.538  11.809   8.832
  784   1HD   ARG  97          1HD       ARG  97  -8.658  10.791   6.585
  785   2HD   ARG  97          2HD       ARG  97  -8.533   9.182   7.283
  786    HE   ARG  97           HE       ARG  97 -10.697   9.196   7.938
  787   1HH1  ARG  97          1HH2      ARG  97  -9.836  12.511   6.985
  788   2HH1  ARG  97          2HH2      ARG  97 -11.487  13.072   7.000
  789   1HH2  ARG  97          1HH1      ARG  97 -12.846   9.953   7.963
  790   2HH2  ARG  97          2HH1      ARG  97 -13.204  11.613   7.563
  791    H    ASP  98           H        ASP  98  -4.109   8.476  10.477
  792    HA   ASP  98           HA       ASP  98  -5.050   8.087  13.013
  793   1HB   ASP  98          1HB       ASP  98  -2.846   7.388  12.182
  794   2HB   ASP  98          2HB       ASP  98  -2.294   9.068  12.153
  795    H    MET  99           H        MET  99  -3.661  11.109  11.705
  796    HA   MET  99           HA       MET  99  -5.602  12.667  13.089
  797   1HB   MET  99          1HB       MET  99  -3.837  14.283  14.050
  798   2HB   MET  99          2HB       MET  99  -4.208  12.814  14.942
  799   1HG   MET  99          1HG       MET  99  -1.829  13.244  14.956
  800   2HG   MET  99          2HG       MET  99  -2.208  11.716  14.182
  801   1HE   MET  99          1HE       MET  99  -2.192  15.464  12.648
  802   2HE   MET  99          2HE       MET  99  -0.880  15.310  13.843
  803   3HE   MET  99          3HE       MET  99  -0.497  15.471  12.117
  Start of MODEL    2
    1   1H    MET   0          1H        MET   0  -8.004 -24.362  -5.061
    2   2H    MET   0          2H        MET   0  -6.448 -24.736  -4.656
    3   3H    MET   0          3H        MET   0  -7.658 -24.981  -3.568
    4    HA   MET   0           HA       MET   0  -6.712 -22.428  -4.591
    5   1HB   MET   0          1HB       MET   0  -8.286 -21.355  -3.043
    6   2HB   MET   0          2HB       MET   0  -9.081 -22.301  -4.305
    7   1HG   MET   0          1HG       MET   0  -9.432 -24.159  -2.635
    8   2HG   MET   0          2HG       MET   0  -8.728 -23.117  -1.395
    9   1HE   MET   0          1HE       MET   0 -11.775 -24.019  -3.533
   10   2HE   MET   0          2HE       MET   0 -12.906 -22.678  -3.255
   11   3HE   MET   0          3HE       MET   0 -11.486 -22.433  -4.293
   12    H    ILE   1           H        ILE   1  -4.923 -21.714  -3.578
   13    HA   ILE   1           HA       ILE   1  -4.433 -22.323  -0.757
   14    HB   ILE   1           HB       ILE   1  -2.061 -23.082  -1.292
   15   1HG1  ILE   1          1HG1      ILE   1  -1.590 -24.165  -3.386
   16   2HG1  ILE   1          2HG1      ILE   1  -3.189 -23.792  -4.037
   17   1HG2  ILE   1          1HG2      ILE   1  -4.192 -25.045  -2.176
   18   2HG2  ILE   1          2HG2      ILE   1  -2.597 -25.388  -1.496
   19   3HG2  ILE   1          3HG2      ILE   1  -3.830 -24.623  -0.484
   20   1HD1  ILE   1          1HD1      ILE   1  -2.653 -21.428  -4.153
   21   2HD1  ILE   1          2HD1      ILE   1  -1.134 -21.684  -3.255
   22   3HD1  ILE   1          3HD1      ILE   1  -1.330 -22.337  -4.892
   23    H    GLN   2           H        GLN   2  -4.865 -19.993  -2.724
   24    HA   GLN   2           HA       GLN   2  -2.408 -18.467  -2.532
   25   1HB   GLN   2          1HB       GLN   2  -5.245 -17.677  -3.340
   26   2HB   GLN   2          2HB       GLN   2  -3.829 -16.628  -3.382
   27   1HG   GLN   2          1HG       GLN   2  -4.034 -17.380  -5.584
   28   2HG   GLN   2          2HG       GLN   2  -2.691 -18.301  -4.900
   29   1HE2  GLN   2          2HE2      GLN   2  -3.249 -19.569  -6.942
   30   2HE2  GLN   2          1HE2      GLN   2  -4.433 -20.848  -6.788
   31    H    ARG   3           H        ARG   3  -1.794 -17.094  -0.947
   32    HA   ARG   3           HA       ARG   3  -3.578 -16.682   1.360
   33   1HB   ARG   3          1HB       ARG   3  -0.673 -16.151   0.830
   34   2HB   ARG   3          2HB       ARG   3  -1.491 -15.525   2.270
   35   1HG   ARG   3          1HG       ARG   3  -1.458 -18.493   1.575
   36   2HG   ARG   3          2HG       ARG   3  -0.186 -17.683   2.498
   37   1HD   ARG   3          1HD       ARG   3  -1.578 -18.584   4.142
   38   2HD   ARG   3          2HD       ARG   3  -1.955 -16.856   4.107
   39    HE   ARG   3           HE       ARG   3  -3.690 -18.426   2.386
   40   1HH1  ARG   3          1HH2      ARG   3  -3.150 -17.632   5.798
   41   2HH1  ARG   3          2HH2      ARG   3  -4.838 -17.754   6.228
   42   1HH2  ARG   3          1HH1      ARG   3  -5.907 -18.534   2.942
   43   2HH2  ARG   3          2HH1      ARG   3  -6.414 -18.282   4.593
   44    H    THR   4           H        THR   4  -4.201 -14.764   2.152
   45    HA   THR   4           HA       THR   4  -4.998 -12.869   0.117
   46    HB   THR   4           HB       THR   4  -5.635 -13.131   3.088
   47    HG1  THR   4           HG1      THR   4  -6.211 -14.936   1.780
   48   1HG2  THR   4          1HG2      THR   4  -7.208 -11.668   0.928
   49   2HG2  THR   4          2HG2      THR   4  -7.672 -11.877   2.623
   50   3HG2  THR   4          3HG2      THR   4  -6.266 -10.879   2.223
   51    HA   PRO   5           HA       PRO   5  -1.906  -9.799   1.396
   52   1HB   PRO   5          1HB       PRO   5  -3.065  -7.487   0.464
   53   2HB   PRO   5          2HB       PRO   5  -2.281  -8.706  -0.583
   54   1HG   PRO   5          1HG       PRO   5  -5.225  -8.414   0.051
   55   2HG   PRO   5          2HG       PRO   5  -4.462  -8.595  -1.555
   56   1HD   PRO   5          1HD       PRO   5  -5.526 -10.712  -0.264
   57   2HD   PRO   5          2HD       PRO   5  -3.986 -10.902  -1.146
   58    H    LYS   6           H        LYS   6  -1.810  -9.739   3.574
   59    HA   LYS   6           HA       LYS   6  -3.853  -8.426   5.220
   60   1HB   LYS   6          1HB       LYS   6  -2.454 -10.360   6.008
   61   2HB   LYS   6          2HB       LYS   6  -1.033  -9.300   5.940
   62   1HG   LYS   6          1HG       LYS   6  -2.433  -7.666   7.394
   63   2HG   LYS   6          2HG       LYS   6  -3.521  -9.021   7.666
   64   1HD   LYS   6          1HD       LYS   6  -0.541  -8.857   8.336
   65   2HD   LYS   6          2HD       LYS   6  -1.873  -8.779   9.492
   66   1HE   LYS   6          1HE       LYS   6  -1.081 -11.203   7.805
   67   2HE   LYS   6          2HE       LYS   6  -0.824 -10.984   9.541
   68   1HZ   LYS   6          1HZ       LYS   6  -3.212 -10.877   9.806
   69   2HZ   LYS   6          2HZ       LYS   6  -3.424 -11.180   8.199
   70   3HZ   LYS   6          3HZ       LYS   6  -2.724 -12.315   9.166
   71    H    ILE   7           H        ILE   7  -4.030  -6.297   4.737
   72    HA   ILE   7           HA       ILE   7  -1.739  -4.653   3.974
   73    HB   ILE   7           HB       ILE   7  -3.361  -2.921   3.617
   74   1HG1  ILE   7          1HG1      ILE   7  -5.907  -3.892   3.868
   75   2HG1  ILE   7          2HG1      ILE   7  -5.184  -4.608   5.303
   76   1HG2  ILE   7          1HG2      ILE   7  -4.395  -5.574   2.558
   77   2HG2  ILE   7          2HG2      ILE   7  -4.697  -3.967   1.894
   78   3HG2  ILE   7          3HG2      ILE   7  -3.051  -4.621   1.884
   79   1HD1  ILE   7          1HD1      ILE   7  -4.406  -2.263   5.954
   80   2HD1  ILE   7          2HD1      ILE   7  -5.258  -1.657   4.521
   81   3HD1  ILE   7          3HD1      ILE   7  -6.165  -2.435   5.828
   82    H    GLN   8           H        GLN   8  -0.593  -3.215   5.367
   83    HA   GLN   8           HA       GLN   8  -1.984  -2.291   7.783
   84   1HB   GLN   8          1HB       GLN   8   0.415  -2.281   8.709
   85   2HB   GLN   8          2HB       GLN   8  -0.575  -3.732   8.884
   86   1HG   GLN   8          1HG       GLN   8   1.452  -3.388   6.653
   87   2HG   GLN   8          2HG       GLN   8   1.889  -3.992   8.258
   88   1HE2  GLN   8          2HE2      GLN   8   2.393  -5.493   5.984
   89   2HE2  GLN   8          1HE2      GLN   8   1.407  -6.938   6.066
   90    H    VAL   9           H        VAL   9  -2.576  -0.585   6.456
   91    HA   VAL   9           HA       VAL   9  -0.528   0.993   5.069
   92    HB   VAL   9           HB       VAL   9  -3.521   1.436   5.370
   93   1HG1  VAL   9          1HG1      VAL   9  -1.403   2.716   3.586
   94   2HG1  VAL   9          2HG1      VAL   9  -3.162   2.954   3.437
   95   3HG1  VAL   9          3HG1      VAL   9  -2.308   3.513   4.880
   96   1HG2  VAL   9          1HG2      VAL   9  -3.054  -0.650   4.139
   97   2HG2  VAL   9          2HG2      VAL   9  -3.650   0.599   3.044
   98   3HG2  VAL   9          3HG2      VAL   9  -1.920   0.203   3.081
   99    H    TYR  10           H        TYR  10   0.767   1.944   6.605
  100    HA   TYR  10           HA       TYR  10  -0.581   3.486   8.799
  101   1HB   TYR  10          1HB       TYR  10   1.377   3.180  10.114
  102   2HB   TYR  10          2HB       TYR  10   0.624   1.662   9.653
  103    HD1  TYR  10           HD1      TYR  10   3.573   3.866   9.125
  104    HD2  TYR  10           HD2      TYR  10   1.820  -0.002   8.438
  105    HE1  TYR  10           HE1      TYR  10   5.750   3.022   8.284
  106    HE2  TYR  10           HE2      TYR  10   3.978  -0.829   7.542
  107    HH   TYR  10           HH       TYR  10   6.153  -0.305   7.034
  108    H    SER  11           H        SER  11   0.174   5.475   9.396
  109    HA   SER  11           HA       SER  11   1.582   7.144   7.449
  110   1HB   SER  11          1HB       SER  11   1.260   8.846   9.327
  111   2HB   SER  11          2HB       SER  11  -0.187   8.218   8.528
  112    HG   SER  11           HG       SER  11  -0.374   8.231  10.813
  113    H    ARG  12           H        ARG  12   3.857   6.971   7.454
  114    HA   ARG  12           HA       ARG  12   5.250   5.753   9.688
  115   1HB   ARG  12          1HB       ARG  12   5.804   5.663   7.193
  116   2HB   ARG  12          2HB       ARG  12   6.585   7.224   7.407
  117   1HG   ARG  12          1HG       ARG  12   7.272   4.753   9.078
  118   2HG   ARG  12          2HG       ARG  12   7.981   5.080   7.500
  119   1HD   ARG  12          1HD       ARG  12   9.550   5.780   9.124
  120   2HD   ARG  12          2HD       ARG  12   8.904   7.222   8.321
  121    HE   ARG  12           HE       ARG  12   7.381   6.674  10.668
  122   1HH1  ARG  12          1HH2      ARG  12  10.695   7.697   9.916
  123   2HH1  ARG  12          2HH2      ARG  12  10.775   8.808  11.261
  124   1HH2  ARG  12          1HH1      ARG  12   7.442   8.206  12.297
  125   2HH2  ARG  12          2HH1      ARG  12   8.917   9.073  12.662
  126    H    HIS  13           H        HIS  13   5.582   9.005   8.151
  127    HA   HIS  13           HA       HIS  13   6.544  10.232  10.634
  128   1HB   HIS  13          1HB       HIS  13   5.800  11.279   7.891
  129   2HB   HIS  13          2HB       HIS  13   6.304  12.323   9.227
  130    HD2  HIS  13           HD2      HIS  13   8.477  13.132   7.706
  131    HE1  HIS  13           HE1      HIS  13  10.496   9.420   7.918
  132    HE2  HIS  13           HE2      HIS  13  10.740  11.883   7.283
  133    HA   PRO  14           HA       PRO  14   2.411  11.413  11.931
  134   1HB   PRO  14          1HB       PRO  14   2.830  13.595  13.488
  135   2HB   PRO  14          2HB       PRO  14   3.459  11.978  13.916
  136   1HG   PRO  14          1HG       PRO  14   4.967  14.243  12.598
  137   2HG   PRO  14          2HG       PRO  14   5.481  13.232  13.976
  138   1HD   PRO  14          1HD       PRO  14   6.239  12.757  11.378
  139   2HD   PRO  14          2HD       PRO  14   6.041  11.438  12.557
  140    H    ALA  15           H        ALA  15   0.860  12.261  10.576
  141    HA   ALA  15           HA       ALA  15   1.524  13.915   8.416
  142   1HB   ALA  15          1HB       ALA  15  -0.381  12.380   8.370
  143   2HB   ALA  15          2HB       ALA  15  -1.248  13.416   9.537
  144   3HB   ALA  15          3HB       ALA  15  -0.855  14.024   7.925
  145    H    GLU  16           H        GLU  16   1.291  15.966   7.885
  146    HA   GLU  16           HA       GLU  16   0.160  17.995   9.712
  147   1HB   GLU  16          1HB       GLU  16   3.046  17.879   8.748
  148   2HB   GLU  16          2HB       GLU  16   2.252  19.387   9.249
  149   1HG   GLU  16          1HG       GLU  16   1.826  18.388  11.492
  150   2HG   GLU  16          2HG       GLU  16   2.697  16.927  10.990
  151    H    ASN  17           H        ASN  17  -1.031  19.360   8.493
  152    HA   ASN  17           HA       ASN  17  -1.615  18.899   5.852
  153   1HB   ASN  17          1HB       ASN  17  -2.864  20.973   5.944
  154   2HB   ASN  17          2HB       ASN  17  -3.046  20.091   7.458
  155   1HD2  ASN  17          2HD2      ASN  17  -1.934  23.057   5.989
  156   2HD2  ASN  17          1HD2      ASN  17  -1.431  23.839   7.473
  157    H    GLY  18           H        GLY  18  -0.700  19.310   3.933
  158   1HA   GLY  18          1HA       GLY  18   0.456  20.353   2.284
  159   2HA   GLY  18          2HA       GLY  18   0.609  21.776   3.317
  160    H    LYS  19           H        LYS  19   1.932  19.272   5.131
  161    HA   LYS  19           HA       LYS  19   4.689  20.087   4.364
  162   1HB   LYS  19          1HB       LYS  19   3.886  20.655   6.542
  163   2HB   LYS  19          2HB       LYS  19   3.634  18.911   6.836
  164   1HG   LYS  19          1HG       LYS  19   5.991  18.445   6.652
  165   2HG   LYS  19          2HG       LYS  19   6.347  20.113   6.134
  166   1HD   LYS  19          1HD       LYS  19   5.763  21.018   8.243
  167   2HD   LYS  19          2HD       LYS  19   4.870  19.558   8.691
  168   1HE   LYS  19          1HE       LYS  19   7.004  18.278   8.836
  169   2HE   LYS  19          2HE       LYS  19   7.903  19.766   8.474
  170   1HZ   LYS  19          1HZ       LYS  19   6.163  19.258  10.788
  171   2HZ   LYS  19          2HZ       LYS  19   7.804  19.370  10.810
  172   3HZ   LYS  19          3HZ       LYS  19   6.890  20.706  10.480
  173    H    SER  20           H        SER  20   5.658  18.680   3.292
  174    HA   SER  20           HA       SER  20   5.132  16.201   2.469
  175   1HB   SER  20          1HB       SER  20   7.550  15.770   2.069
  176   2HB   SER  20          2HB       SER  20   6.820  17.242   1.427
  177    HG   SER  20           HG       SER  20   8.265  17.080   3.877
  178    H    ASN  21           H        ASN  21   4.859  14.336   3.428
  179    HA   ASN  21           HA       ASN  21   6.112  13.640   6.049
  180   1HB   ASN  21          1HB       ASN  21   3.621  14.420   5.655
  181   2HB   ASN  21          2HB       ASN  21   3.380  12.757   5.173
  182   1HD2  ASN  21          2HD2      ASN  21   2.680  11.540   6.928
  183   2HD2  ASN  21          1HD2      ASN  21   3.115  11.814   8.593
  184    H    PHE  22           H        PHE  22   4.824  10.911   5.973
  185    HA   PHE  22           HA       PHE  22   5.834   9.656   3.533
  186   1HB   PHE  22          1HB       PHE  22   7.267   9.394   6.140
  187   2HB   PHE  22          2HB       PHE  22   6.988   7.916   5.235
  188    HD1  PHE  22           HD1      PHE  22   7.926   7.469   3.051
  189    HD2  PHE  22           HD2      PHE  22   8.832  11.112   5.169
  190    HE1  PHE  22           HE1      PHE  22   9.920   7.807   1.619
  191    HE2  PHE  22           HE2      PHE  22  10.822  11.451   3.728
  192    HZ   PHE  22           HZ       PHE  22  11.379   9.790   1.962
  193    H    LEU  23           H        LEU  23   4.427   8.263   2.882
  194    HA   LEU  23           HA       LEU  23   2.547   6.937   4.779
  195   1HB   LEU  23          1HB       LEU  23   1.445   8.465   3.275
  196   2HB   LEU  23          2HB       LEU  23   2.302   7.798   1.883
  197    HG   LEU  23           HG       LEU  23   0.994   5.656   2.275
  198   1HD1  LEU  23          1HD1      LEU  23  -0.317   7.438   4.385
  199   2HD1  LEU  23          2HD1      LEU  23  -0.978   5.889   3.807
  200   3HD1  LEU  23          3HD1      LEU  23   0.551   5.923   4.691
  201   1HD2  LEU  23          1HD2      LEU  23   0.260   7.422   0.677
  202   2HD2  LEU  23          2HD2      LEU  23  -1.129   6.626   1.442
  203   3HD2  LEU  23          3HD2      LEU  23  -0.611   8.238   1.987
  204    H    ASN  24           H        ASN  24   2.537   4.742   4.827
  205    HA   ASN  24           HA       ASN  24   4.229   3.222   2.869
  206   1HB   ASN  24          1HB       ASN  24   3.965   3.044   5.870
  207   2HB   ASN  24          2HB       ASN  24   4.734   1.806   4.866
  208   1HD2  ASN  24          2HD2      ASN  24   6.723   2.107   6.080
  209   2HD2  ASN  24          1HD2      ASN  24   7.749   3.490   5.752
  210    H    CYS  25           H        CYS  25   2.633   2.241   1.629
  211    HA   CYS  25           HA       CYS  25   0.293   0.994   2.935
  212   1HB   CYS  25          1HB       CYS  25   1.187   0.825   0.035
  213   2HB   CYS  25          2HB       CYS  25  -0.346   0.286   0.699
  214    H    TYR  26           H        TYR  26   1.936  -0.336   4.321
  215    HA   TYR  26           HA       TYR  26   3.582  -2.233   2.874
  216   1HB   TYR  26          1HB       TYR  26   4.281  -1.358   5.033
  217   2HB   TYR  26          2HB       TYR  26   2.836  -1.946   5.798
  218    HD1  TYR  26           HD1      TYR  26   4.960  -3.901   3.370
  219    HD2  TYR  26           HD2      TYR  26   3.970  -3.241   7.502
  220    HE1  TYR  26           HE1      TYR  26   6.019  -6.039   3.950
  221    HE2  TYR  26           HE2      TYR  26   4.982  -5.423   8.086
  222    HH   TYR  26           HH       TYR  26   6.454  -7.571   5.623
  223    H    VAL  27           H        VAL  27   3.083  -4.396   2.368
  224    HA   VAL  27           HA       VAL  27   0.520  -5.499   3.386
  225    HB   VAL  27           HB       VAL  27   1.427  -5.898   0.504
  226   1HG1  VAL  27          1HG1      VAL  27  -1.280  -6.263   1.865
  227   2HG1  VAL  27          2HG1      VAL  27  -0.830  -6.716   0.206
  228   3HG1  VAL  27          3HG1      VAL  27  -0.133  -7.571   1.585
  229   1HG2  VAL  27          1HG2      VAL  27  -0.586  -3.899   1.548
  230   2HG2  VAL  27          2HG2      VAL  27   0.925  -3.531   0.684
  231   3HG2  VAL  27          3HG2      VAL  27  -0.374  -4.383  -0.163
  232    H    SER  28           H        SER  28   0.680  -7.670   3.922
  233    HA   SER  28           HA       SER  28   2.804  -9.235   2.793
  234   1HB   SER  28          1HB       SER  28   3.897  -9.825   4.965
  235   2HB   SER  28          2HB       SER  28   3.998  -8.091   4.726
  236    HG   SER  28           HG       SER  28   3.264  -8.657   6.820
  237    H    GLY  29           H        GLY  29   2.831 -11.465   4.357
  238   1HA   GLY  29          1HA       GLY  29   1.563 -13.216   5.172
  239   2HA   GLY  29          2HA       GLY  29   0.076 -12.298   4.926
  240    H    PHE  30           H        PHE  30   0.528 -11.594   2.167
  241    HA   PHE  30           HA       PHE  30  -0.825 -13.752   1.030
  242   1HB   PHE  30          1HB       PHE  30  -0.906 -12.444  -0.977
  243   2HB   PHE  30          2HB       PHE  30  -1.201 -11.481   0.430
  244    HD1  PHE  30           HD1      PHE  30   1.155 -12.218  -2.283
  245    HD2  PHE  30           HD2      PHE  30   0.370  -9.626   1.071
  246    HE1  PHE  30           HE1      PHE  30   2.949 -10.704  -3.039
  247    HE2  PHE  30           HE2      PHE  30   2.159  -8.113   0.300
  248    HZ   PHE  30           HZ       PHE  30   3.450  -8.672  -1.746
  249    H    HIS  31           H        HIS  31  -0.289 -14.619  -1.156
  250    HA   HIS  31           HA       HIS  31   2.251 -14.812  -2.318
  251   1HB   HIS  31          1HB       HIS  31   3.110 -16.842  -1.844
  252   2HB   HIS  31          2HB       HIS  31   2.596 -16.358  -0.243
  253    HD2  HIS  31           HD2      HIS  31   1.347 -18.661  -3.170
  254    HE1  HIS  31           HE1      HIS  31   0.162 -20.338   0.534
  255    HE2  HIS  31           HE2      HIS  31   0.213 -20.728  -1.985
  256    HA   PRO  32           HA       PRO  32   2.919 -16.211  -4.184
  257   1HB   PRO  32          1HB       PRO  32   2.841 -16.434  -6.875
  258   2HB   PRO  32          2HB       PRO  32   2.188 -17.708  -5.834
  259   1HG   PRO  32          1HG       PRO  32   0.611 -15.428  -7.063
  260   2HG   PRO  32          2HG       PRO  32   0.328 -17.182  -7.297
  261   1HD   PRO  32          1HD       PRO  32  -0.984 -15.790  -5.358
  262   2HD   PRO  32          2HD       PRO  32  -0.408 -17.452  -5.061
  263    H    SER  33           H        SER  33   3.587 -14.738  -6.728
  264    HA   SER  33           HA       SER  33   4.298 -12.433  -5.194
  265   1HB   SER  33          1HB       SER  33   5.938 -12.119  -6.989
  266   2HB   SER  33          2HB       SER  33   5.884 -13.831  -6.517
  267    HG   SER  33           HG       SER  33   4.529 -14.199  -8.326
  268    H    ASP  34           H        ASP  34   2.053 -12.847  -7.867
  269    HA   ASP  34           HA       ASP  34   2.516 -10.233  -8.971
  270   1HB   ASP  34          1HB       ASP  34   1.888 -12.058 -10.392
  271   2HB   ASP  34          2HB       ASP  34   0.430 -12.383  -9.451
  272    H    ILE  35           H        ILE  35   2.223  -8.828  -7.172
  273    HA   ILE  35           HA       ILE  35  -0.628  -8.068  -6.840
  274    HB   ILE  35           HB       ILE  35   0.287  -9.002  -4.834
  275   1HG1  ILE  35          1HG1      ILE  35  -0.065  -6.010  -4.422
  276   2HG1  ILE  35          2HG1      ILE  35  -1.397  -7.111  -4.722
  277   1HG2  ILE  35          1HG2      ILE  35   2.641  -8.401  -5.139
  278   2HG2  ILE  35          2HG2      ILE  35   2.223  -6.691  -4.818
  279   3HG2  ILE  35          3HG2      ILE  35   2.013  -7.927  -3.559
  280   1HD1  ILE  35          1HD1      ILE  35  -0.576  -8.467  -2.706
  281   2HD1  ILE  35          2HD1      ILE  35   0.451  -7.085  -2.318
  282   3HD1  ILE  35          3HD1      ILE  35  -1.299  -6.872  -2.379
  283    H    GLU  36           H        GLU  36  -1.150  -5.938  -6.808
  284    HA   GLU  36           HA       GLU  36   0.782  -3.997  -7.979
  285   1HB   GLU  36          1HB       GLU  36  -2.193  -3.959  -8.474
  286   2HB   GLU  36          2HB       GLU  36  -0.881  -3.207  -9.377
  287   1HG   GLU  36          1HG       GLU  36  -0.085  -5.546  -9.956
  288   2HG   GLU  36          2HG       GLU  36  -1.552  -6.170  -9.217
  289    H    VAL  37           H        VAL  37   1.103  -2.225  -6.678
  290    HA   VAL  37           HA       VAL  37  -1.100  -1.165  -5.018
  291    HB   VAL  37           HB       VAL  37   1.649  -1.853  -3.946
  292   1HG1  VAL  37          1HG1      VAL  37  -0.743  -0.920  -2.317
  293   2HG1  VAL  37          2HG1      VAL  37   0.896  -1.246  -1.757
  294   3HG1  VAL  37          3HG1      VAL  37   0.587   0.149  -2.796
  295   1HG2  VAL  37          1HG2      VAL  37  -1.061  -3.179  -3.552
  296   2HG2  VAL  37          2HG2      VAL  37   0.451  -3.905  -4.152
  297   3HG2  VAL  37          3HG2      VAL  37   0.294  -3.439  -2.452
  298    H    ASP  38           H        ASP  38  -1.080   0.374  -6.783
  299    HA   ASP  38           HA       ASP  38   1.014   2.437  -6.726
  300   1HB   ASP  38          1HB       ASP  38  -1.865   2.597  -7.754
  301   2HB   ASP  38          2HB       ASP  38  -0.583   3.779  -7.991
  302    H    LEU  39           H        LEU  39   0.670   4.503  -5.764
  303    HA   LEU  39           HA       LEU  39  -1.341   4.615  -3.566
  304   1HB   LEU  39          1HB       LEU  39   1.307   6.099  -3.831
  305   2HB   LEU  39          2HB       LEU  39   0.080   6.298  -2.567
  306    HG   LEU  39           HG       LEU  39   0.346   3.639  -2.353
  307   1HD1  LEU  39          1HD1      LEU  39   3.134   4.513  -3.180
  308   2HD1  LEU  39          2HD1      LEU  39   2.668   2.922  -2.555
  309   3HD1  LEU  39          3HD1      LEU  39   2.111   3.432  -4.150
  310   1HD2  LEU  39          1HD2      LEU  39   0.686   5.281  -0.541
  311   2HD2  LEU  39          2HD2      LEU  39   1.999   4.080  -0.527
  312   3HD2  LEU  39          3HD2      LEU  39   2.278   5.681  -1.219
  313    H    LEU  40           H        LEU  40  -2.645   6.396  -3.420
  314    HA   LEU  40           HA       LEU  40  -3.146   7.806  -6.000
  315   1HB   LEU  40          1HB       LEU  40  -3.934   5.297  -5.610
  316   2HB   LEU  40          2HB       LEU  40  -5.145   6.036  -4.588
  317    HG   LEU  40           HG       LEU  40  -6.014   5.514  -6.752
  318   1HD1  LEU  40          1HD1      LEU  40  -6.898   7.570  -5.719
  319   2HD1  LEU  40          2HD1      LEU  40  -5.695   8.542  -6.603
  320   3HD1  LEU  40          3HD1      LEU  40  -6.938   7.645  -7.491
  321   1HD2  LEU  40          1HD2      LEU  40  -3.718   5.710  -7.915
  322   2HD2  LEU  40          2HD2      LEU  40  -5.157   6.205  -8.829
  323   3HD2  LEU  40          3HD2      LEU  40  -4.123   7.433  -8.094
  324    H    LYS  41           H        LYS  41  -3.786   9.951  -5.462
  325    HA   LYS  41           HA       LYS  41  -4.696  10.515  -2.731
  326   1HB   LYS  41          1HB       LYS  41  -4.421  12.389  -5.098
  327   2HB   LYS  41          2HB       LYS  41  -4.744  12.822  -3.407
  328   1HG   LYS  41          1HG       LYS  41  -2.646  13.001  -3.019
  329   2HG   LYS  41          2HG       LYS  41  -2.526  11.250  -3.149
  330   1HD   LYS  41          1HD       LYS  41  -0.862  12.072  -4.595
  331   2HD   LYS  41          2HD       LYS  41  -2.165  11.588  -5.666
  332   1HE   LYS  41          1HE       LYS  41  -1.233  13.708  -6.378
  333   2HE   LYS  41          2HE       LYS  41  -2.886  14.013  -5.801
  334   1HZ   LYS  41          1HZ       LYS  41  -2.080  14.927  -3.864
  335   2HZ   LYS  41          2HZ       LYS  41  -0.524  14.419  -4.126
  336   3HZ   LYS  41          3HZ       LYS  41  -1.193  15.595  -5.077
  337    H    ASN  42           H        ASN  42  -6.506  12.663  -4.024
  338    HA   ASN  42           HA       ASN  42  -9.031  11.366  -3.653
  339   1HB   ASN  42          1HB       ASN  42  -9.978  13.473  -4.271
  340   2HB   ASN  42          2HB       ASN  42  -8.524  13.865  -3.350
  341   1HD2  ASN  42          2HD2      ASN  42  -6.442  14.195  -4.856
  342   2HD2  ASN  42          1HD2      ASN  42  -6.736  15.026  -6.361
  343    H    GLY  43           H        GLY  43  -7.090  12.180  -6.548
  344   1HA   GLY  43          1HA       GLY  43  -8.130   9.921  -7.978
  345   2HA   GLY  43          2HA       GLY  43  -8.877  11.423  -8.554
  346    H    GLU  44           H        GLU  44  -5.535  11.113  -7.315
  347    HA   GLU  44           HA       GLU  44  -4.432  11.410 -10.079
  348   1HB   GLU  44          1HB       GLU  44  -4.446  13.578  -8.860
  349   2HB   GLU  44          2HB       GLU  44  -3.510  12.823  -7.562
  350   1HG   GLU  44          1HG       GLU  44  -1.676  12.345  -9.223
  351   2HG   GLU  44          2HG       GLU  44  -2.625  13.188 -10.460
  352    H    ARG  45           H        ARG  45  -2.833   9.974 -10.519
  353    HA   ARG  45           HA       ARG  45  -2.090   7.976  -8.487
  354   1HB   ARG  45          1HB       ARG  45  -2.721   7.257 -10.755
  355   2HB   ARG  45          2HB       ARG  45  -1.384   8.205 -11.438
  356   1HG   ARG  45          1HG       ARG  45   0.256   6.811 -10.228
  357   2HG   ARG  45          2HG       ARG  45  -1.057   5.919  -9.432
  358   1HD   ARG  45          1HD       ARG  45  -1.810   5.052 -11.594
  359   2HD   ARG  45          2HD       ARG  45  -0.612   6.060 -12.431
  360    HE   ARG  45           HE       ARG  45   0.265   4.025 -10.423
  361   1HH1  ARG  45          1HH2      ARG  45   0.265   5.001 -13.863
  362   2HH1  ARG  45          2HH2      ARG  45   1.428   3.780 -14.298
  363   1HH2  ARG  45          1HH1      ARG  45   1.716   2.459 -11.038
  364   2HH2  ARG  45          2HH1      ARG  45   2.293   2.348 -12.688
  365    H    ILE  46           H        ILE  46  -0.185   7.853  -7.425
  366    HA   ILE  46           HA       ILE  46   1.713  10.026  -7.670
  367    HB   ILE  46           HB       ILE  46   1.283   7.679  -5.774
  368   1HG1  ILE  46          1HG1      ILE  46   0.749  10.674  -5.487
  369   2HG1  ILE  46          2HG1      ILE  46  -0.515   9.485  -5.819
  370   1HG2  ILE  46          1HG2      ILE  46   3.156  10.046  -5.614
  371   2HG2  ILE  46          2HG2      ILE  46   2.888   8.810  -4.346
  372   3HG2  ILE  46          3HG2      ILE  46   3.627   8.347  -5.884
  373   1HD1  ILE  46          1HD1      ILE  46   1.096   9.665  -3.269
  374   2HD1  ILE  46          2HD1      ILE  46  -0.632   9.985  -3.555
  375   3HD1  ILE  46          3HD1      ILE  46  -0.024   8.346  -3.663
  376    H    GLU  47           H        GLU  47   3.415   9.798  -8.958
  377    HA   GLU  47           HA       GLU  47   4.251   7.179 -10.018
  378   1HB   GLU  47          1HB       GLU  47   5.197  10.008 -10.609
  379   2HB   GLU  47          2HB       GLU  47   5.752   8.532 -11.421
  380   1HG   GLU  47          1HG       GLU  47   3.379   8.051 -12.093
  381   2HG   GLU  47          2HG       GLU  47   2.900   9.625 -11.435
  382    H    LYS  48           H        LYS  48   5.417   9.665  -7.727
  383    HA   LYS  48           HA       LYS  48   8.018   8.424  -7.419
  384   1HB   LYS  48          1HB       LYS  48   7.737  10.821  -7.184
  385   2HB   LYS  48          2HB       LYS  48   6.595  10.606  -5.853
  386   1HG   LYS  48          1HG       LYS  48   8.869  11.295  -5.142
  387   2HG   LYS  48          2HG       LYS  48   8.346   9.800  -4.381
  388   1HD   LYS  48          1HD       LYS  48   9.726   8.477  -5.949
  389   2HD   LYS  48          2HD       LYS  48  10.224   9.972  -6.777
  390   1HE   LYS  48          1HE       LYS  48  11.297  10.765  -4.697
  391   2HE   LYS  48          2HE       LYS  48  10.708   9.336  -3.825
  392   1HZ   LYS  48          1HZ       LYS  48  12.036   7.972  -5.247
  393   2HZ   LYS  48          2HZ       LYS  48  12.582   9.285  -6.082
  394   3HZ   LYS  48          3HZ       LYS  48  12.974   9.091  -4.493
  395    H    VAL  49           H        VAL  49   6.878   6.288  -7.143
  396    HA   VAL  49           HA       VAL  49   6.327   5.686  -4.265
  397    HB   VAL  49           HB       VAL  49   5.712   4.097  -6.782
  398   1HG1  VAL  49          1HG1      VAL  49   5.148   3.582  -3.828
  399   2HG1  VAL  49          2HG1      VAL  49   4.409   2.680  -5.170
  400   3HG1  VAL  49          3HG1      VAL  49   6.154   2.597  -4.903
  401   1HG2  VAL  49          1HG2      VAL  49   3.959   5.749  -4.915
  402   2HG2  VAL  49          2HG2      VAL  49   4.279   6.037  -6.631
  403   3HG2  VAL  49          3HG2      VAL  49   3.343   4.618  -6.144
  404    H    GLU  50           H        GLU  50   8.200   5.013  -3.267
  405    HA   GLU  50           HA       GLU  50  10.245   3.489  -4.813
  406   1HB   GLU  50          1HB       GLU  50  10.833   5.579  -3.392
  407   2HB   GLU  50          2HB       GLU  50  10.562   4.528  -1.994
  408   1HG   GLU  50          1HG       GLU  50  12.278   2.965  -2.842
  409   2HG   GLU  50          2HG       GLU  50  12.520   4.015  -4.251
  410    H    HIS  51           H        HIS  51  11.017   1.495  -3.496
  411    HA   HIS  51           HA       HIS  51   9.058   0.491  -1.581
  412   1HB   HIS  51          1HB       HIS  51   8.544  -1.549  -2.836
  413   2HB   HIS  51          2HB       HIS  51   8.031  -0.134  -3.752
  414    HD2  HIS  51           HD2      HIS  51   9.601   0.428  -6.063
  415    HE1  HIS  51           HE1      HIS  51  11.593  -3.309  -6.013
  416    HE2  HIS  51           HE2      HIS  51  11.136  -1.217  -7.410
  417    H    SER  52           H        SER  52   9.787  -1.190  -0.355
  418    HA   SER  52           HA       SER  52  12.651  -1.851  -0.378
  419   1HB   SER  52          1HB       SER  52  11.345  -1.668   1.759
  420   2HB   SER  52          2HB       SER  52  10.366  -3.059   1.234
  421    HG   SER  52           HG       SER  52  12.128  -3.653   2.577
  422    H    ASP  53           H        ASP  53  13.389  -3.970  -0.990
  423    HA   ASP  53           HA       ASP  53  12.224  -5.005  -3.346
  424   1HB   ASP  53          1HB       ASP  53  13.951  -6.740  -3.163
  425   2HB   ASP  53          2HB       ASP  53  14.621  -5.151  -2.785
  426    H    LEU  54           H        LEU  54  11.723  -7.393  -3.662
  427    HA   LEU  54           HA       LEU  54   9.504  -8.137  -2.019
  428   1HB   LEU  54          1HB       LEU  54   9.862  -8.711  -4.477
  429   2HB   LEU  54          2HB       LEU  54  10.973  -9.965  -3.931
  430    HG   LEU  54           HG       LEU  54   8.891 -11.008  -4.287
  431   1HD1  LEU  54          1HD1      LEU  54   9.965 -11.668  -2.150
  432   2HD1  LEU  54          2HD1      LEU  54   8.792 -10.619  -1.302
  433   3HD1  LEU  54          3HD1      LEU  54   8.229 -11.971  -2.246
  434   1HD2  LEU  54          1HD2      LEU  54   7.485  -8.895  -2.618
  435   2HD2  LEU  54          2HD2      LEU  54   7.428  -9.051  -4.392
  436   3HD2  LEU  54          3HD2      LEU  54   6.737 -10.297  -3.350
  437    H    SER  55           H        SER  55   9.711  -8.814  -0.047
  438    HA   SER  55           HA       SER  55  12.140 -10.285   0.896
  439   1HB   SER  55          1HB       SER  55  11.927  -7.941   1.711
  440   2HB   SER  55          2HB       SER  55  10.353  -8.343   2.418
  441    HG   SER  55           HG       SER  55  12.145  -8.500   3.884
  442    H    PHE  56           H        PHE  56  10.595 -12.045  -0.120
  443    HA   PHE  56           HA       PHE  56   8.305 -12.885   1.411
  444   1HB   PHE  56          1HB       PHE  56   8.409 -14.886   0.145
  445   2HB   PHE  56          2HB       PHE  56   8.884 -13.611  -0.934
  446    HD1  PHE  56           HD1      PHE  56  11.309 -13.415  -1.615
  447    HD2  PHE  56           HD2      PHE  56   9.793 -16.695   0.720
  448    HE1  PHE  56           HE1      PHE  56  13.359 -14.722  -2.132
  449    HE2  PHE  56           HE2      PHE  56  11.839 -18.016   0.196
  450    HZ   PHE  56           HZ       PHE  56  13.620 -17.029  -1.242
  451    H    SER  57           H        SER  57   8.294 -13.826   3.459
  452    HA   SER  57           HA       SER  57  10.794 -14.206   4.850
  453   1HB   SER  57          1HB       SER  57   8.754 -13.622   6.049
  454   2HB   SER  57          2HB       SER  57   8.042 -15.207   5.675
  455    HG   SER  57           HG       SER  57   9.622 -16.122   6.990
  456    H    LYS  58           H        LYS  58  12.013 -16.075   4.906
  457    HA   LYS  58           HA       LYS  58  11.519 -18.102   2.933
  458   1HB   LYS  58          1HB       LYS  58  13.604 -18.001   5.151
  459   2HB   LYS  58          2HB       LYS  58  13.606 -19.082   3.744
  460   1HG   LYS  58          1HG       LYS  58  13.657 -17.050   2.241
  461   2HG   LYS  58          2HG       LYS  58  13.762 -16.031   3.672
  462   1HD   LYS  58          1HD       LYS  58  15.960 -16.270   2.759
  463   2HD   LYS  58          2HD       LYS  58  15.887 -17.063   4.334
  464   1HE   LYS  58          1HE       LYS  58  17.192 -18.357   2.678
  465   2HE   LYS  58          2HE       LYS  58  15.805 -19.275   3.267
  466   1HZ   LYS  58          1HZ       LYS  58  15.943 -17.810   0.720
  467   2HZ   LYS  58          2HZ       LYS  58  16.053 -19.444   0.907
  468   3HZ   LYS  58          3HZ       LYS  58  14.643 -18.670   1.261
  469    H    ASP  59           H        ASP  59  10.094 -17.812   5.933
  470    HA   ASP  59           HA       ASP  59   9.700 -20.587   6.446
  471   1HB   ASP  59          1HB       ASP  59   7.968 -18.143   7.125
  472   2HB   ASP  59          2HB       ASP  59   7.778 -19.761   7.814
  473    H    TRP  60           H        TRP  60   7.056 -18.393   5.456
  474    HA   TRP  60           HA       TRP  60   6.535 -19.442   2.872
  475   1HB   TRP  60          1HB       TRP  60   4.591 -20.741   3.211
  476   2HB   TRP  60          2HB       TRP  60   5.994 -21.528   3.880
  477    HD1  TRP  60           HD1      TRP  60   6.212 -21.340   6.656
  478    HE1  TRP  60           HE1      TRP  60   4.315 -21.551   8.427
  479    HE3  TRP  60           HE3      TRP  60   2.283 -20.250   3.682
  480    HZ2  TRP  60           HZ2      TRP  60   1.446 -21.315   8.479
  481    HZ3  TRP  60           HZ3      TRP  60  -0.069 -20.315   4.569
  482    HH2  TRP  60           HH2      TRP  60  -0.477 -20.821   6.970
  483    H    SER  61           H        SER  61   6.769 -16.965   3.267
  484    HA   SER  61           HA       SER  61   4.065 -15.928   2.886
  485   1HB   SER  61          1HB       SER  61   4.455 -15.616   5.346
  486   2HB   SER  61          2HB       SER  61   5.897 -14.652   4.969
  487    HG   SER  61           HG       SER  61   4.527 -13.210   3.842
  488    H    PHE  62           H        PHE  62   4.161 -13.773   1.893
  489    HA   PHE  62           HA       PHE  62   6.602 -13.239   0.284
  490   1HB   PHE  62          1HB       PHE  62   4.406 -14.669  -0.602
  491   2HB   PHE  62          2HB       PHE  62   3.970 -13.030  -1.072
  492    HD1  PHE  62           HD1      PHE  62   5.197 -11.921  -2.904
  493    HD2  PHE  62           HD2      PHE  62   6.497 -15.721  -1.331
  494    HE1  PHE  62           HE1      PHE  62   6.763 -12.168  -4.761
  495    HE2  PHE  62           HE2      PHE  62   8.024 -16.001  -3.217
  496    HZ   PHE  62           HZ       PHE  62   8.169 -14.224  -4.986
  497    H    TYR  63           H        TYR  63   6.976 -10.931   0.347
  498    HA   TYR  63           HA       TYR  63   4.708  -9.110   0.538
  499   1HB   TYR  63          1HB       TYR  63   5.315  -8.137   2.748
  500   2HB   TYR  63          2HB       TYR  63   4.729  -9.795   2.804
  501    HD1  TYR  63           HD1      TYR  63   7.725  -7.732   3.192
  502    HD2  TYR  63           HD2      TYR  63   5.841 -11.562   3.755
  503    HE1  TYR  63           HE1      TYR  63   9.406  -8.289   4.898
  504    HE2  TYR  63           HE2      TYR  63   7.403 -12.077   5.543
  505    HH   TYR  63           HH       TYR  63  10.146  -9.896   6.420
  506    H    LEU  64           H        LEU  64   5.507  -6.855   1.120
  507    HA   LEU  64           HA       LEU  64   8.165  -6.055   0.572
  508   1HB   LEU  64          1HB       LEU  64   7.978  -5.083  -1.624
  509   2HB   LEU  64          2HB       LEU  64   7.718  -6.811  -1.728
  510    HG   LEU  64           HG       LEU  64   5.661  -4.614  -1.965
  511   1HD1  LEU  64          1HD1      LEU  64   6.424  -6.815  -3.936
  512   2HD1  LEU  64          2HD1      LEU  64   5.290  -5.502  -4.225
  513   3HD1  LEU  64          3HD1      LEU  64   7.010  -5.133  -4.027
  514   1HD2  LEU  64          1HD2      LEU  64   5.324  -7.619  -1.797
  515   2HD2  LEU  64          2HD2      LEU  64   4.401  -6.379  -0.892
  516   3HD2  LEU  64          3HD2      LEU  64   4.131  -6.624  -2.624
  517    H    LEU  65           H        LEU  65   8.347  -3.750   0.778
  518    HA   LEU  65           HA       LEU  65   5.971  -2.443   1.995
  519   1HB   LEU  65          1HB       LEU  65   8.377  -2.944   3.078
  520   2HB   LEU  65          2HB       LEU  65   8.805  -1.455   2.231
  521    HG   LEU  65           HG       LEU  65   6.580  -1.833   4.297
  522   1HD1  LEU  65          1HD1      LEU  65   8.860  -1.956   5.184
  523   2HD1  LEU  65          2HD1      LEU  65   9.263  -0.412   4.402
  524   3HD1  LEU  65          3HD1      LEU  65   8.057  -0.465   5.709
  525   1HD2  LEU  65          1HD2      LEU  65   7.375   0.512   2.560
  526   2HD2  LEU  65          2HD2      LEU  65   5.752  -0.080   2.968
  527   3HD2  LEU  65          3HD2      LEU  65   6.706   0.784   4.180
  528    H    TYR  66           H        TYR  66   5.204  -0.536   1.043
  529    HA   TYR  66           HA       TYR  66   6.568   0.400  -1.433
  530   1HB   TYR  66          1HB       TYR  66   3.556   0.122  -1.228
  531   2HB   TYR  66          2HB       TYR  66   4.566   0.231  -2.653
  532    HD1  TYR  66           HD1      TYR  66   4.613  -1.795  -3.935
  533    HD2  TYR  66           HD2      TYR  66   3.975  -2.084   0.334
  534    HE1  TYR  66           HE1      TYR  66   3.430  -3.944  -4.223
  535    HE2  TYR  66           HE2      TYR  66   2.935  -4.258   0.024
  536    HH   TYR  66           HH       TYR  66   1.992  -5.456  -3.214
  537    H    TYR  67           H        TYR  67   7.286   2.291  -0.570
  538    HA   TYR  67           HA       TYR  67   5.337   4.015   0.839
  539   1HB   TYR  67          1HB       TYR  67   7.506   5.058   1.731
  540   2HB   TYR  67          2HB       TYR  67   6.743   3.615   2.359
  541    HD1  TYR  67           HD1      TYR  67   8.496   2.491   3.391
  542    HD2  TYR  67           HD2      TYR  67   8.974   3.870  -0.640
  543    HE1  TYR  67           HE1      TYR  67  10.592   1.173   3.191
  544    HE2  TYR  67           HE2      TYR  67  11.102   2.601  -0.832
  545    HH   TYR  67           HH       TYR  67  12.540   1.136   0.180
  546    H    THR  68           H        THR  68   5.199   6.100   0.540
  547    HA   THR  68           HA       THR  68   6.730   7.510  -1.629
  548    HB   THR  68           HB       THR  68   4.495   6.891  -2.297
  549    HG1  THR  68           HG1      THR  68   5.512   8.731  -3.128
  550   1HG2  THR  68          1HG2      THR  68   2.548   8.030  -1.346
  551   2HG2  THR  68          2HG2      THR  68   3.383   7.185  -0.020
  552   3HG2  THR  68          3HG2      THR  68   3.572   8.934  -0.223
  553    H    GLU  69           H        GLU  69   6.799   9.950  -1.238
  554    HA   GLU  69           HA       GLU  69   6.794  10.673   1.642
  555   1HB   GLU  69          1HB       GLU  69   7.959  12.793   0.635
  556   2HB   GLU  69          2HB       GLU  69   8.830  11.311   0.980
  557   1HG   GLU  69          1HG       GLU  69   9.526  12.293  -1.141
  558   2HG   GLU  69          2HG       GLU  69   8.915  10.652  -1.328
  559    H    PHE  70           H        PHE  70   4.392  10.549   1.555
  560    HA   PHE  70           HA       PHE  70   2.993  12.192  -0.316
  561   1HB   PHE  70          1HB       PHE  70   1.033  11.477   0.587
  562   2HB   PHE  70          2HB       PHE  70   2.064  10.097   0.904
  563    HD1  PHE  70           HD1      PHE  70  -0.414  12.297   2.259
  564    HD2  PHE  70           HD2      PHE  70   3.219  10.259   3.298
  565    HE1  PHE  70           HE1      PHE  70  -0.803  12.736   4.659
  566    HE2  PHE  70           HE2      PHE  70   2.435  10.108   5.664
  567    HZ   PHE  70           HZ       PHE  70   0.530  11.543   6.373
  568    H    THR  71           H        THR  71   2.222  14.157  -0.183
  569    HA   THR  71           HA       THR  71   2.594  15.805   2.268
  570    HB   THR  71           HB       THR  71   2.192  16.676  -0.579
  571    HG1  THR  71           HG1      THR  71   4.413  17.053  -0.438
  572   1HG2  THR  71          1HG2      THR  71   3.088  18.117   1.958
  573   2HG2  THR  71          2HG2      THR  71   2.996  18.834   0.338
  574   3HG2  THR  71          3HG2      THR  71   1.512  18.340   1.175
  575    HA   PRO  72           HA       PRO  72  -2.025  15.285   2.061
  576   1HB   PRO  72          1HB       PRO  72  -2.655  16.008   4.609
  577   2HB   PRO  72          2HB       PRO  72  -2.020  14.422   4.166
  578   1HG   PRO  72          1HG       PRO  72  -0.563  16.790   5.301
  579   2HG   PRO  72          2HG       PRO  72  -0.371  15.078   5.772
  580   1HD   PRO  72          1HD       PRO  72   1.332  16.425   4.072
  581   2HD   PRO  72          2HD       PRO  72   1.052  14.666   3.952
  582    H    THR  73           H        THR  73  -1.656  17.038   0.515
  583    HA   THR  73           HA       THR  73  -1.933  19.815   1.390
  584    HB   THR  73           HB       THR  73  -0.317  19.130  -0.331
  585    HG1  THR  73           HG1      THR  73  -1.033  21.242  -0.249
  586   1HG2  THR  73          1HG2      THR  73  -2.768  18.773  -2.104
  587   2HG2  THR  73          2HG2      THR  73  -1.061  18.655  -2.583
  588   3HG2  THR  73          3HG2      THR  73  -1.762  17.435  -1.497
  589    H    GLU  74           H        GLU  74  -3.524  21.217   0.451
  590    HA   GLU  74           HA       GLU  74  -5.677  21.857   0.483
  591   1HB   GLU  74          1HB       GLU  74  -5.067  21.584  -1.892
  592   2HB   GLU  74          2HB       GLU  74  -5.824  19.993  -1.917
  593   1HG   GLU  74          1HG       GLU  74  -8.001  21.145  -1.176
  594   2HG   GLU  74          2HG       GLU  74  -7.150  22.684  -1.304
  595    H    LYS  75           H        LYS  75  -6.973  18.881  -0.805
  596    HA   LYS  75           HA       LYS  75  -8.086  18.097   1.829
  597   1HB   LYS  75          1HB       LYS  75 -10.320  17.940   0.893
  598   2HB   LYS  75          2HB       LYS  75  -9.697  19.585   0.727
  599   1HG   LYS  75          1HG       LYS  75  -9.057  18.999  -1.683
  600   2HG   LYS  75          2HG       LYS  75  -9.944  17.481  -1.465
  601   1HD   LYS  75          1HD       LYS  75 -11.991  18.805  -0.887
  602   2HD   LYS  75          2HD       LYS  75 -11.066  20.300  -1.154
  603   1HE   LYS  75          1HE       LYS  75 -10.635  19.580  -3.514
  604   2HE   LYS  75          2HE       LYS  75 -11.646  18.148  -3.241
  605   1HZ   LYS  75          1HZ       LYS  75 -13.481  19.609  -2.807
  606   2HZ   LYS  75          2HZ       LYS  75 -12.530  20.940  -3.022
  607   3HZ   LYS  75          3HZ       LYS  75 -12.835  19.933  -4.289
  608    H    ASP  76           H        ASP  76  -5.933  17.135  -0.051
  609    HA   ASP  76           HA       ASP  76  -6.797  14.665  -1.248
  610   1HB   ASP  76          1HB       ASP  76  -4.082  15.747  -0.405
  611   2HB   ASP  76          2HB       ASP  76  -4.315  14.175  -1.175
  612    H    GLU  77           H        GLU  77  -7.553  12.981  -0.096
  613    HA   GLU  77           HA       GLU  77  -6.124  12.147   2.398
  614   1HB   GLU  77          1HB       GLU  77  -8.569  12.464   2.703
  615   2HB   GLU  77          2HB       GLU  77  -8.871  11.266   1.429
  616   1HG   GLU  77          1HG       GLU  77  -7.712   9.535   2.748
  617   2HG   GLU  77          2HG       GLU  77  -7.240  10.733   3.963
  618    H    TYR  78           H        TYR  78  -4.528  10.797   1.820
  619    HA   TYR  78           HA       TYR  78  -4.470   9.647  -0.814
  620   1HB   TYR  78          1HB       TYR  78  -2.568   9.570   1.539
  621   2HB   TYR  78          2HB       TYR  78  -2.313   8.621   0.083
  622    HD1  TYR  78           HD1      TYR  78  -3.267  12.229   0.865
  623    HD2  TYR  78           HD2      TYR  78  -0.616   9.512  -1.177
  624    HE1  TYR  78           HE1      TYR  78  -2.129  14.130  -0.200
  625    HE2  TYR  78           HE2      TYR  78   0.576  11.452  -2.175
  626    HH   TYR  78           HH       TYR  78  -0.211  14.815  -1.316
  627    H    ALA  79           H        ALA  79  -4.139   7.451  -1.312
  628    HA   ALA  79           HA       ALA  79  -5.232   5.414   0.513
  629   1HB   ALA  79          1HB       ALA  79  -7.213   6.375  -0.608
  630   2HB   ALA  79          2HB       ALA  79  -6.430   6.205  -2.193
  631   3HB   ALA  79          3HB       ALA  79  -6.903   4.765  -1.282
  632    H    CYS  80           H        CYS  80  -5.257   3.251  -0.591
  633    HA   CYS  80           HA       CYS  80  -2.777   2.882  -2.232
  634   1HB   CYS  80          1HB       CYS  80  -3.870   1.005  -0.118
  635   2HB   CYS  80          2HB       CYS  80  -2.328   0.895  -0.965
  636    H    ARG  81           H        ARG  81  -3.164   1.787  -4.110
  637    HA   ARG  81           HA       ARG  81  -5.602   0.268  -4.655
  638   1HB   ARG  81          1HB       ARG  81  -4.182   1.188  -6.484
  639   2HB   ARG  81          2HB       ARG  81  -2.847   0.185  -5.903
  640   1HG   ARG  81          1HG       ARG  81  -4.409  -1.860  -6.307
  641   2HG   ARG  81          2HG       ARG  81  -5.438  -0.737  -7.192
  642   1HD   ARG  81          1HD       ARG  81  -2.521  -1.432  -7.732
  643   2HD   ARG  81          2HD       ARG  81  -3.899  -1.989  -8.680
  644    HE   ARG  81           HE       ARG  81  -2.459   0.486  -8.910
  645   1HH1  ARG  81          1HH2      ARG  81  -5.726  -0.851  -9.369
  646   2HH1  ARG  81          2HH2      ARG  81  -6.151   0.334 -10.576
  647   1HH2  ARG  81          1HH1      ARG  81  -3.001   1.954 -10.444
  648   2HH2  ARG  81          2HH1      ARG  81  -4.592   1.986 -11.188
  649    H    VAL  82           H        VAL  82  -5.900  -1.937  -3.973
  650    HA   VAL  82           HA       VAL  82  -3.455  -3.473  -3.271
  651    HB   VAL  82           HB       VAL  82  -6.085  -3.520  -1.731
  652   1HG1  VAL  82          1HG1      VAL  82  -4.907  -5.697  -1.905
  653   2HG1  VAL  82          2HG1      VAL  82  -3.416  -4.929  -1.310
  654   3HG1  VAL  82          3HG1      VAL  82  -4.850  -5.048  -0.259
  655   1HG2  VAL  82          1HG2      VAL  82  -3.353  -2.412  -0.930
  656   2HG2  VAL  82          2HG2      VAL  82  -4.834  -1.460  -1.180
  657   3HG2  VAL  82          3HG2      VAL  82  -4.748  -2.606   0.146
  658    H    ASN  83           H        ASN  83  -3.336  -4.710  -5.066
  659    HA   ASN  83           HA       ASN  83  -5.701  -6.389  -5.724
  660   1HB   ASN  83          1HB       ASN  83  -5.488  -4.372  -7.287
  661   2HB   ASN  83          2HB       ASN  83  -3.976  -5.044  -7.836
  662   1HD2  ASN  83          2HD2      ASN  83  -4.494  -5.693  -9.946
  663   2HD2  ASN  83          1HD2      ASN  83  -5.771  -6.834 -10.309
  664    H    HIS  84           H        HIS  84  -4.556  -8.058  -4.539
  665    HA   HIS  84           HA       HIS  84  -1.990  -9.119  -5.566
  666   1HB   HIS  84          1HB       HIS  84  -2.599  -9.380  -3.214
  667   2HB   HIS  84          2HB       HIS  84  -4.084 -10.210  -3.678
  668    HD2  HIS  84           HD2      HIS  84  -0.173 -10.914  -4.080
  669    HE1  HIS  84           HE1      HIS  84  -2.356 -14.543  -3.871
  670    HE2  HIS  84           HE2      HIS  84   0.009 -13.515  -4.037
  671    H    VAL  85           H        VAL  85  -2.076 -11.244  -6.779
  672    HA   VAL  85           HA       VAL  85  -3.928 -11.335  -8.829
  673    HB   VAL  85           HB       VAL  85  -1.750 -12.435  -8.841
  674   1HG1  VAL  85          1HG1      VAL  85  -1.754 -13.581  -6.664
  675   2HG1  VAL  85          2HG1      VAL  85  -3.042 -14.677  -7.223
  676   3HG1  VAL  85          3HG1      VAL  85  -1.451 -14.709  -7.994
  677   1HG2  VAL  85          1HG2      VAL  85  -4.025 -14.311  -9.583
  678   2HG2  VAL  85          2HG2      VAL  85  -3.450 -12.935 -10.551
  679   3HG2  VAL  85          3HG2      VAL  85  -2.380 -14.312 -10.246
  680    H    THR  86           H        THR  86  -4.210 -12.936  -5.643
  681    HA   THR  86           HA       THR  86  -6.495 -14.485  -6.441
  682    HB   THR  86           HB       THR  86  -4.801 -14.985  -4.618
  683    HG1  THR  86           HG1      THR  86  -7.594 -15.355  -4.361
  684   1HG2  THR  86          1HG2      THR  86  -6.877 -13.698  -2.828
  685   2HG2  THR  86          2HG2      THR  86  -5.277 -14.353  -2.407
  686   3HG2  THR  86          3HG2      THR  86  -5.417 -12.817  -3.298
  687    H    LEU  87           H        LEU  87  -6.194 -11.131  -5.419
  688    HA   LEU  87           HA       LEU  87  -9.010 -10.848  -4.667
  689   1HB   LEU  87          1HB       LEU  87  -6.716  -8.980  -5.271
  690   2HB   LEU  87          2HB       LEU  87  -8.355  -8.398  -5.483
  691    HG   LEU  87           HG       LEU  87  -8.964  -8.843  -3.228
  692   1HD1  LEU  87          1HD1      LEU  87  -7.615 -10.842  -2.689
  693   2HD1  LEU  87          2HD1      LEU  87  -6.124  -9.895  -2.851
  694   3HD1  LEU  87          3HD1      LEU  87  -7.261  -9.548  -1.535
  695   1HD2  LEU  87          1HD2      LEU  87  -7.865  -6.705  -3.810
  696   2HD2  LEU  87          2HD2      LEU  87  -7.502  -7.169  -2.138
  697   3HD2  LEU  87          3HD2      LEU  87  -6.281  -7.397  -3.405
  698    H    SER  88           H        SER  88  -7.057  -9.934  -7.528
  699    HA   SER  88           HA       SER  88  -7.534  -9.609  -9.687
  700   1HB   SER  88          1HB       SER  88 -10.244 -10.950  -9.324
  701   2HB   SER  88          2HB       SER  88  -9.437 -10.538 -10.834
  702    HG   SER  88           HG       SER  88  -8.273 -12.232  -8.885
  703    H    GLN  89           H        GLN  89 -10.186  -8.795  -7.435
  704    HA   GLN  89           HA       GLN  89 -11.007  -6.445  -8.963
  705   1HB   GLN  89          1HB       GLN  89 -11.731  -7.418  -6.181
  706   2HB   GLN  89          2HB       GLN  89 -12.484  -6.058  -7.018
  707   1HG   GLN  89          1HG       GLN  89 -12.538  -8.983  -7.893
  708   2HG   GLN  89          2HG       GLN  89 -13.865  -8.088  -7.149
  709   1HE2  GLN  89          2HE2      GLN  89 -13.543  -9.441  -9.873
  710   2HE2  GLN  89          1HE2      GLN  89 -14.025  -8.201 -11.013
  711    HA   PRO  90           HA       PRO  90  -7.577  -4.425  -6.819
  712   1HB   PRO  90          1HB       PRO  90  -7.526  -2.016  -8.102
  713   2HB   PRO  90          2HB       PRO  90  -7.039  -3.529  -8.912
  714   1HG   PRO  90          1HG       PRO  90  -9.731  -2.158  -9.085
  715   2HG   PRO  90          2HG       PRO  90  -8.719  -2.778 -10.420
  716   1HD   PRO  90          1HD       PRO  90 -10.784  -4.214  -9.328
  717   2HD   PRO  90          2HD       PRO  90  -9.304  -5.004  -9.954
  718    H    LYS  91           H        LYS  91  -8.209  -4.190  -4.759
  719    HA   LYS  91           HA       LYS  91 -10.510  -2.575  -3.966
  720   1HB   LYS  91          1HB       LYS  91  -8.415  -4.231  -2.509
  721   2HB   LYS  91          2HB       LYS  91  -9.650  -3.330  -1.647
  722   1HG   LYS  91          1HG       LYS  91 -10.653  -5.128  -3.830
  723   2HG   LYS  91          2HG       LYS  91  -9.905  -5.913  -2.440
  724   1HD   LYS  91          1HD       LYS  91 -12.295  -5.740  -2.108
  725   2HD   LYS  91          2HD       LYS  91 -11.416  -4.809  -0.886
  726   1HE   LYS  91          1HE       LYS  91 -11.928  -2.707  -2.093
  727   2HE   LYS  91          2HE       LYS  91 -12.739  -3.632  -3.377
  728   1HZ   LYS  91          1HZ       LYS  91 -13.546  -3.499  -0.556
  729   2HZ   LYS  91          2HZ       LYS  91 -14.281  -2.730  -1.814
  730   3HZ   LYS  91          3HZ       LYS  91 -14.307  -4.375  -1.727
  731    H    ILE  92           H        ILE  92 -10.079  -0.394  -4.382
  732    HA   ILE  92           HA       ILE  92  -7.511   0.748  -3.669
  733    HB   ILE  92           HB       ILE  92  -9.941   2.318  -4.526
  734   1HG1  ILE  92          1HG1      ILE  92  -9.851   0.610  -6.200
  735   2HG1  ILE  92          2HG1      ILE  92  -9.217   2.114  -6.847
  736   1HG2  ILE  92          1HG2      ILE  92  -6.919   2.677  -4.805
  737   2HG2  ILE  92          2HG2      ILE  92  -8.142   3.756  -5.506
  738   3HG2  ILE  92          3HG2      ILE  92  -7.995   3.594  -3.747
  739   1HD1  ILE  92          1HD1      ILE  92  -7.546  -0.270  -5.942
  740   2HD1  ILE  92          2HD1      ILE  92  -7.877   0.245  -7.604
  741   3HD1  ILE  92          3HD1      ILE  92  -6.889   1.267  -6.556
  742    H    VAL  93           H        VAL  93  -8.014  -0.202  -1.382
  743    HA   VAL  93           HA       VAL  93  -9.898   1.278   0.267
  744    HB   VAL  93           HB       VAL  93  -7.821  -0.864   0.846
  745   1HG1  VAL  93          1HG1      VAL  93  -7.980   0.437   2.895
  746   2HG1  VAL  93          2HG1      VAL  93  -9.754   0.519   2.762
  747   3HG1  VAL  93          3HG1      VAL  93  -8.946  -1.027   3.098
  748   1HG2  VAL  93          1HG2      VAL  93  -9.916  -1.482  -0.418
  749   2HG2  VAL  93          2HG2      VAL  93  -9.802  -2.269   1.165
  750   3HG2  VAL  93          3HG2      VAL  93 -10.876  -0.873   0.937
  751    H    LYS  94           H        LYS  94  -9.485   2.939   1.675
  752    HA   LYS  94           HA       LYS  94  -7.157   4.468   0.993
  753   1HB   LYS  94          1HB       LYS  94  -8.085   6.264   2.122
  754   2HB   LYS  94          2HB       LYS  94  -9.424   5.448   1.318
  755   1HG   LYS  94          1HG       LYS  94 -10.175   4.486   3.447
  756   2HG   LYS  94          2HG       LYS  94  -8.726   5.086   4.276
  757   1HD   LYS  94          1HD       LYS  94  -9.335   7.411   3.703
  758   2HD   LYS  94          2HD       LYS  94 -10.860   6.837   3.001
  759   1HE   LYS  94          1HE       LYS  94 -11.545   5.944   5.199
  760   2HE   LYS  94          2HE       LYS  94  -9.969   6.383   5.891
  761   1HZ   LYS  94          1HZ       LYS  94 -11.924   8.291   4.821
  762   2HZ   LYS  94          2HZ       LYS  94 -11.627   7.994   6.419
  763   3HZ   LYS  94          3HZ       LYS  94 -10.463   8.670   5.469
  764    H    TRP  95           H        TRP  95  -5.974   5.697   2.707
  765    HA   TRP  95           HA       TRP  95  -4.769   3.945   4.743
  766   1HB   TRP  95          1HB       TRP  95  -3.225   5.302   3.582
  767   2HB   TRP  95          2HB       TRP  95  -4.320   6.657   3.548
  768    HD1  TRP  95           HD1      TRP  95  -3.084   5.067   6.836
  769    HE1  TRP  95           HE1      TRP  95  -2.065   7.022   8.246
  770    HE3  TRP  95           HE3      TRP  95  -3.237   8.794   3.364
  771    HZ2  TRP  95           HZ2      TRP  95  -1.758   9.848   7.989
  772    HZ3  TRP  95           HZ3      TRP  95  -2.584  11.101   3.958
  773    HH2  TRP  95           HH2      TRP  95  -1.956  11.655   6.294
  774    H    ASP  96           H        ASP  96  -5.441   7.272   5.438
  775    HA   ASP  96           HA       ASP  96  -7.695   7.307   7.077
  776   1HB   ASP  96          1HB       ASP  96  -6.487   5.493   8.385
  777   2HB   ASP  96          2HB       ASP  96  -5.084   6.555   8.511
  778    H    ARG  97           H        ARG  97  -6.940   9.145   8.924
  779    HA   ARG  97           HA       ARG  97  -4.449  10.363   8.473
  780   1HB   ARG  97          1HB       ARG  97  -5.602  11.555   6.614
  781   2HB   ARG  97          2HB       ARG  97  -6.851  12.118   7.730
  782   1HG   ARG  97          1HG       ARG  97  -5.155  13.424   8.968
  783   2HG   ARG  97          2HG       ARG  97  -3.871  12.762   7.928
  784   1HD   ARG  97          1HD       ARG  97  -4.917  13.784   5.948
  785   2HD   ARG  97          2HD       ARG  97  -6.249  14.402   6.954
  786    HE   ARG  97           HE       ARG  97  -3.841  15.332   8.078
  787   1HH1  ARG  97          1HH2      ARG  97  -5.715  15.767   5.085
  788   2HH1  ARG  97          2HH2      ARG  97  -5.119  17.383   4.804
  789   1HH2  ARG  97          1HH1      ARG  97  -3.076  17.457   7.687
  790   2HH2  ARG  97          2HH1      ARG  97  -3.628  18.338   6.284
  791    H    ASP  98           H        ASP  98  -7.670  11.371   9.594
  792    HA   ASP  98           HA       ASP  98  -7.045  10.848  12.386
  793   1HB   ASP  98          1HB       ASP  98  -6.089  13.121  12.020
  794   2HB   ASP  98          2HB       ASP  98  -7.648  13.684  11.412
  795    H    MET  99           H        MET  99  -8.685   9.323  11.229
  796    HA   MET  99           HA       MET  99 -11.470  10.374  11.522
  797   1HB   MET  99          1HB       MET  99 -10.374   8.420   9.452
  798   2HB   MET  99          2HB       MET  99 -12.067   8.867   9.650
  799   1HG   MET  99          1HG       MET  99  -9.784  10.696   8.799
  800   2HG   MET  99          2HG       MET  99 -11.065  10.059   7.778
  801   1HE   MET  99          1HE       MET  99 -13.648  10.588   9.981
  802   2HE   MET  99          2HE       MET  99 -14.223  12.015   9.097
  803   3HE   MET  99          3HE       MET  99 -13.646  10.592   8.199
  Start of MODEL    3
    1   1H    MET   0          1H        MET   0  -1.579 -25.423   0.830
    2   2H    MET   0          2H        MET   0  -1.742 -23.792   0.687
    3   3H    MET   0          3H        MET   0  -3.066 -24.765   0.562
    4    HA   MET   0           HA       MET   0  -0.778 -24.759  -1.256
    5   1HB   MET   0          1HB       MET   0  -3.446 -26.218  -1.444
    6   2HB   MET   0          2HB       MET   0  -2.250 -26.098  -2.748
    7   1HG   MET   0          1HG       MET   0  -0.547 -27.151  -1.264
    8   2HG   MET   0          2HG       MET   0  -1.796 -27.393  -0.032
    9   1HE   MET   0          1HE       MET   0  -1.065 -29.916   0.078
   10   2HE   MET   0          2HE       MET   0  -1.024 -30.999  -1.332
   11   3HE   MET   0          3HE       MET   0   0.136 -29.656  -1.209
   12    H    ILE   1           H        ILE   1  -4.276 -23.888  -1.006
   13    HA   ILE   1           HA       ILE   1  -4.370 -22.158  -3.218
   14    HB   ILE   1           HB       ILE   1  -6.340 -21.153  -2.115
   15   1HG1  ILE   1          1HG1      ILE   1  -7.249 -22.047  -0.073
   16   2HG1  ILE   1          2HG1      ILE   1  -5.844 -23.084   0.197
   17   1HG2  ILE   1          1HG2      ILE   1  -6.507 -23.216  -3.469
   18   2HG2  ILE   1          2HG2      ILE   1  -6.341 -24.184  -1.987
   19   3HG2  ILE   1          3HG2      ILE   1  -7.732 -23.105  -2.196
   20   1HD1  ILE   1          1HD1      ILE   1  -5.676 -20.047   0.066
   21   2HD1  ILE   1          2HD1      ILE   1  -5.978 -20.943   1.566
   22   3HD1  ILE   1          3HD1      ILE   1  -4.460 -21.190   0.711
   23    H    GLN   2           H        GLN   2  -4.959 -19.741  -2.925
   24    HA   GLN   2           HA       GLN   2  -2.453 -18.474  -2.063
   25   1HB   GLN   2          1HB       GLN   2  -4.833 -17.580  -3.729
   26   2HB   GLN   2          2HB       GLN   2  -3.469 -16.539  -3.304
   27   1HG   GLN   2          1HG       GLN   2  -3.116 -17.445  -5.530
   28   2HG   GLN   2          2HG       GLN   2  -1.904 -18.075  -4.404
   29   1HE2  GLN   2          2HE2      GLN   2  -1.408 -20.169  -4.858
   30   2HE2  GLN   2          1HE2      GLN   2  -2.562 -21.394  -5.335
   31    H    ARG   3           H        ARG   3  -2.274 -17.277  -0.239
   32    HA   ARG   3           HA       ARG   3  -4.596 -16.926   1.492
   33   1HB   ARG   3          1HB       ARG   3  -1.734 -16.028   1.816
   34   2HB   ARG   3          2HB       ARG   3  -2.990 -15.988   3.070
   35   1HG   ARG   3          1HG       ARG   3  -3.258 -18.530   2.658
   36   2HG   ARG   3          2HG       ARG   3  -1.741 -18.428   1.753
   37   1HD   ARG   3          1HD       ARG   3  -2.203 -17.807   4.690
   38   2HD   ARG   3          2HD       ARG   3  -1.256 -19.139   3.993
   39    HE   ARG   3           HE       ARG   3  -0.323 -16.490   3.196
   40   1HH1  ARG   3          1HH2      ARG   3  -0.031 -18.970   5.729
   41   2HH1  ARG   3          2HH2      ARG   3   1.424 -18.268   6.391
   42   1HH2  ARG   3          1HH1      ARG   3   1.499 -15.591   4.085
   43   2HH2  ARG   3          2HH1      ARG   3   2.296 -16.307   5.471
   44    H    THR   4           H        THR   4  -5.354 -14.940   2.300
   45    HA   THR   4           HA       THR   4  -5.690 -12.945   0.298
   46    HB   THR   4           HB       THR   4  -6.480 -12.930   3.244
   47    HG1  THR   4           HG1      THR   4  -8.412 -13.841   2.420
   48   1HG2  THR   4          1HG2      THR   4  -7.764 -11.528   0.858
   49   2HG2  THR   4          2HG2      THR   4  -8.353 -11.514   2.527
   50   3HG2  THR   4          3HG2      THR   4  -6.820 -10.721   2.138
   51    HA   PRO   5           HA       PRO   5  -2.236 -10.332   1.610
   52   1HB   PRO   5          1HB       PRO   5  -2.990  -7.906   0.552
   53   2HB   PRO   5          2HB       PRO   5  -2.372  -9.261  -0.436
   54   1HG   PRO   5          1HG       PRO   5  -5.256  -8.515   0.087
   55   2HG   PRO   5          2HG       PRO   5  -4.475  -8.854  -1.484
   56   1HD   PRO   5          1HD       PRO   5  -5.879 -10.754  -0.177
   57   2HD   PRO   5          2HD       PRO   5  -4.358 -11.194  -1.002
   58    H    LYS   6           H        LYS   6  -2.083  -9.947   3.729
   59    HA   LYS   6           HA       LYS   6  -4.111  -8.461   5.240
   60   1HB   LYS   6          1HB       LYS   6  -2.792 -10.431   6.157
   61   2HB   LYS   6          2HB       LYS   6  -1.353  -9.394   6.125
   62   1HG   LYS   6          1HG       LYS   6  -2.845  -7.690   7.439
   63   2HG   LYS   6          2HG       LYS   6  -3.935  -9.052   7.701
   64   1HD   LYS   6          1HD       LYS   6  -0.990  -8.922   8.518
   65   2HD   LYS   6          2HD       LYS   6  -2.375  -8.651   9.590
   66   1HE   LYS   6          1HE       LYS   6  -3.169 -10.987   9.107
   67   2HE   LYS   6          2HE       LYS   6  -1.692 -11.259   8.157
   68   1HZ   LYS   6          1HZ       LYS   6  -1.790 -10.565  11.008
   69   2HZ   LYS   6          2HZ       LYS   6  -1.483 -12.059  10.386
   70   3HZ   LYS   6          3HZ       LYS   6  -0.421 -10.826  10.129
   71    H    ILE   7           H        ILE   7  -4.145  -6.339   4.756
   72    HA   ILE   7           HA       ILE   7  -1.708  -4.870   3.968
   73    HB   ILE   7           HB       ILE   7  -4.633  -4.146   3.845
   74   1HG1  ILE   7          1HG1      ILE   7  -2.970  -4.766   1.408
   75   2HG1  ILE   7          2HG1      ILE   7  -3.646  -6.115   2.325
   76   1HG2  ILE   7          1HG2      ILE   7  -2.086  -2.798   2.859
   77   2HG2  ILE   7          2HG2      ILE   7  -3.666  -2.406   2.178
   78   3HG2  ILE   7          3HG2      ILE   7  -3.358  -2.140   3.899
   79   1HD1  ILE   7          1HD1      ILE   7  -5.916  -5.124   2.138
   80   2HD1  ILE   7          2HD1      ILE   7  -5.241  -3.901   1.033
   81   3HD1  ILE   7          3HD1      ILE   7  -5.193  -5.619   0.604
   82    H    GLN   8           H        GLN   8  -0.676  -3.537   5.528
   83    HA   GLN   8           HA       GLN   8  -2.326  -2.381   7.711
   84   1HB   GLN   8          1HB       GLN   8  -0.188  -2.705   9.022
   85   2HB   GLN   8          2HB       GLN   8  -1.266  -4.090   8.846
   86   1HG   GLN   8          1HG       GLN   8   1.185  -3.637   7.110
   87   2HG   GLN   8          2HG       GLN   8   1.246  -4.507   8.648
   88   1HE2  GLN   8          2HE2      GLN   8   1.822  -5.420   5.842
   89   2HE2  GLN   8          1HE2      GLN   8   0.801  -6.831   5.639
   90    H    VAL   9           H        VAL   9  -2.496  -0.383   6.791
   91    HA   VAL   9           HA       VAL   9  -0.149   0.893   5.613
   92    HB   VAL   9           HB       VAL   9  -2.966   1.974   5.953
   93   1HG1  VAL   9          1HG1      VAL   9  -1.377   3.760   5.547
   94   2HG1  VAL   9          2HG1      VAL   9  -0.557   2.828   4.294
   95   3HG1  VAL   9          3HG1      VAL   9  -2.207   3.426   4.022
   96   1HG2  VAL   9          1HG2      VAL   9  -3.116  -0.033   4.628
   97   2HG2  VAL   9          2HG2      VAL   9  -3.231   1.350   3.538
   98   3HG2  VAL   9          3HG2      VAL   9  -1.714   0.430   3.643
   99    H    TYR  10           H        TYR  10   1.097   2.398   6.557
  100    HA   TYR  10           HA       TYR  10   0.301   3.509   9.213
  101   1HB   TYR  10          1HB       TYR  10   3.098   3.307   8.156
  102   2HB   TYR  10          2HB       TYR  10   2.548   3.494   9.812
  103    HD1  TYR  10           HD1      TYR  10   3.904   1.214   7.542
  104    HD2  TYR  10           HD2      TYR  10   0.824   1.467  10.541
  105    HE1  TYR  10           HE1      TYR  10   4.079  -1.233   7.912
  106    HE2  TYR  10           HE2      TYR  10   0.951  -0.999  10.866
  107    HH   TYR  10           HH       TYR  10   3.516  -2.970   9.364
  108    H    SER  11           H        SER  11   0.990   5.592   9.703
  109    HA   SER  11           HA       SER  11   1.992   7.384   7.573
  110   1HB   SER  11          1HB       SER  11   0.610   9.225   8.790
  111   2HB   SER  11          2HB       SER  11  -0.040   8.270   7.474
  112    HG   SER  11           HG       SER  11  -0.392   7.743  10.256
  113    H    ARG  12           H        ARG  12   3.815   8.444   8.349
  114    HA   ARG  12           HA       ARG  12   4.800   7.673  10.933
  115   1HB   ARG  12          1HB       ARG  12   5.925   9.692   8.960
  116   2HB   ARG  12          2HB       ARG  12   6.754   9.030  10.385
  117   1HG   ARG  12          1HG       ARG  12   6.360   6.697   9.428
  118   2HG   ARG  12          2HG       ARG  12   5.767   7.485   7.957
  119   1HD   ARG  12          1HD       ARG  12   7.997   8.701   7.854
  120   2HD   ARG  12          2HD       ARG  12   8.567   7.617   9.138
  121    HE   ARG  12           HE       ARG  12   7.577   5.850   7.320
  122   1HH1  ARG  12          1HH2      ARG  12   9.975   8.460   7.039
  123   2HH1  ARG  12          2HH2      ARG  12  10.589   7.887   5.509
  124   1HH2  ARG  12          1HH1      ARG  12   8.421   5.113   5.314
  125   2HH2  ARG  12          2HH1      ARG  12   9.723   5.980   4.544
  126    H    HIS  13           H        HIS  13   3.952  10.962   9.659
  127    HA   HIS  13           HA       HIS  13   3.306  11.801  12.452
  128   1HB   HIS  13          1HB       HIS  13   3.461  13.476   9.946
  129   2HB   HIS  13          2HB       HIS  13   3.206  14.048  11.595
  130    HD2  HIS  13           HD2      HIS  13   5.962  13.969   9.187
  131    HE1  HIS  13           HE1      HIS  13   7.873  13.275  12.900
  132    HE2  HIS  13           HE2      HIS  13   8.261  13.889  10.452
  133    HA   PRO  14           HA       PRO  14  -0.942  11.101  11.251
  134   1HB   PRO  14          1HB       PRO  14  -2.348  12.427  13.130
  135   2HB   PRO  14          2HB       PRO  14  -1.209  11.131  13.573
  136   1HG   PRO  14          1HG       PRO  14  -0.660  14.114  13.595
  137   2HG   PRO  14          2HG       PRO  14  -0.391  12.943  14.917
  138   1HD   PRO  14          1HD       PRO  14   1.581  13.698  13.160
  139   2HD   PRO  14          2HD       PRO  14   1.519  12.054  13.847
  140    H    ALA  15           H        ALA  15  -0.180  12.372   9.268
  141    HA   ALA  15           HA       ALA  15  -0.525  13.779   7.589
  142   1HB   ALA  15          1HB       ALA  15  -2.836  13.354   7.782
  143   2HB   ALA  15          2HB       ALA  15  -3.036  14.641   8.995
  144   3HB   ALA  15          3HB       ALA  15  -2.577  15.052   7.338
  145    H    GLU  16           H        GLU  16   0.132  15.754   6.885
  146    HA   GLU  16           HA       GLU  16   0.933  17.846   8.871
  147   1HB   GLU  16          1HB       GLU  16   2.634  16.421   6.800
  148   2HB   GLU  16          2HB       GLU  16   3.156  17.869   7.665
  149   1HG   GLU  16          1HG       GLU  16   2.394  15.334   9.160
  150   2HG   GLU  16          2HG       GLU  16   3.986  15.544   8.428
  151    H    ASN  17           H        ASN  17  -0.763  19.175   7.967
  152    HA   ASN  17           HA       ASN  17  -1.400  19.312   5.281
  153   1HB   ASN  17          1HB       ASN  17  -2.765  20.179   7.146
  154   2HB   ASN  17          2HB       ASN  17  -1.667  21.557   7.306
  155   1HD2  ASN  17          2HD2      ASN  17  -4.107  22.384   6.969
  156   2HD2  ASN  17          1HD2      ASN  17  -4.477  22.840   5.320
  157    H    GLY  18           H        GLY  18  -0.145  19.835   3.576
  158   1HA   GLY  18          1HA       GLY  18   0.957  21.315   2.176
  159   2HA   GLY  18          2HA       GLY  18   1.316  22.389   3.526
  160    H    LYS  19           H        LYS  19   2.521  20.236   5.200
  161    HA   LYS  19           HA       LYS  19   5.205  20.372   3.964
  162   1HB   LYS  19          1HB       LYS  19   4.792  21.396   6.133
  163   2HB   LYS  19          2HB       LYS  19   4.303  19.819   6.776
  164   1HG   LYS  19          1HG       LYS  19   7.073  20.285   5.634
  165   2HG   LYS  19          2HG       LYS  19   6.666  20.737   7.290
  166   1HD   LYS  19          1HD       LYS  19   5.714  18.051   6.915
  167   2HD   LYS  19          2HD       LYS  19   7.370  18.152   6.277
  168   1HE   LYS  19          1HE       LYS  19   8.188  18.952   8.415
  169   2HE   LYS  19          2HE       LYS  19   6.533  19.078   9.058
  170   1HZ   LYS  19          1HZ       LYS  19   7.681  16.548   8.141
  171   2HZ   LYS  19          2HZ       LYS  19   7.745  17.073   9.709
  172   3HZ   LYS  19          3HZ       LYS  19   6.289  16.804   9.005
  173    H    SER  20           H        SER  20   6.213  18.700   3.399
  174    HA   SER  20           HA       SER  20   5.242  16.309   2.751
  175   1HB   SER  20          1HB       SER  20   7.533  15.382   2.573
  176   2HB   SER  20          2HB       SER  20   7.167  16.907   1.770
  177    HG   SER  20           HG       SER  20   8.179  17.968   3.574
  178    H    ASN  21           H        ASN  21   4.723  14.435   3.711
  179    HA   ASN  21           HA       ASN  21   5.652  13.723   6.474
  180   1HB   ASN  21          1HB       ASN  21   3.306  14.462   6.014
  181   2HB   ASN  21          2HB       ASN  21   3.074  12.988   5.105
  182   1HD2  ASN  21          2HD2      ASN  21   1.519  13.680   7.264
  183   2HD2  ASN  21          1HD2      ASN  21   1.802  12.579   8.602
  184    H    PHE  22           H        PHE  22   4.410  10.979   6.096
  185    HA   PHE  22           HA       PHE  22   5.470   9.897   3.678
  186   1HB   PHE  22          1HB       PHE  22   7.281   9.943   5.836
  187   2HB   PHE  22          2HB       PHE  22   6.658   8.303   5.803
  188    HD1  PHE  22           HD1      PHE  22   6.648   7.078   3.468
  189    HD2  PHE  22           HD2      PHE  22   8.997  10.585   4.349
  190    HE1  PHE  22           HE1      PHE  22   8.194   6.539   1.586
  191    HE2  PHE  22           HE2      PHE  22  10.581   9.975   2.539
  192    HZ   PHE  22           HZ       PHE  22  10.162   7.962   1.144
  193    H    LEU  23           H        LEU  23   4.186   8.423   3.027
  194    HA   LEU  23           HA       LEU  23   2.199   7.085   4.768
  195   1HB   LEU  23          1HB       LEU  23   1.373   8.583   3.015
  196   2HB   LEU  23          2HB       LEU  23   2.367   7.764   1.814
  197    HG   LEU  23           HG       LEU  23   0.941   5.718   2.141
  198   1HD1  LEU  23          1HD1      LEU  23   0.181   6.077   4.449
  199   2HD1  LEU  23          2HD1      LEU  23  -0.537   7.639   4.002
  200   3HD1  LEU  23          3HD1      LEU  23  -1.210   6.122   3.363
  201   1HD2  LEU  23          1HD2      LEU  23   0.450   7.405   0.377
  202   2HD2  LEU  23          2HD2      LEU  23  -1.064   6.754   1.041
  203   3HD2  LEU  23          3HD2      LEU  23  -0.481   8.355   1.552
  204    H    ASN  24           H        ASN  24   2.287   4.854   4.911
  205    HA   ASN  24           HA       ASN  24   4.206   3.385   3.150
  206   1HB   ASN  24          1HB       ASN  24   4.090   3.199   6.164
  207   2HB   ASN  24          2HB       ASN  24   5.171   2.348   5.056
  208   1HD2  ASN  24          2HD2      ASN  24   4.277   5.596   6.311
  209   2HD2  ASN  24          1HD2      ASN  24   5.832   6.337   6.014
  210    H    CYS  25           H        CYS  25   2.645   2.293   2.024
  211    HA   CYS  25           HA       CYS  25   0.572   0.791   3.506
  212   1HB   CYS  25          1HB       CYS  25   1.044   1.025   0.532
  213   2HB   CYS  25          2HB       CYS  25  -0.278   0.184   1.324
  214    H    TYR  26           H        TYR  26   1.847  -0.728   4.631
  215    HA   TYR  26           HA       TYR  26   3.599  -2.522   3.126
  216   1HB   TYR  26          1HB       TYR  26   4.154  -1.839   5.424
  217   2HB   TYR  26          2HB       TYR  26   2.633  -2.445   6.003
  218    HD1  TYR  26           HD1      TYR  26   3.461  -3.995   7.625
  219    HD2  TYR  26           HD2      TYR  26   4.917  -4.224   3.581
  220    HE1  TYR  26           HE1      TYR  26   4.328  -6.267   8.065
  221    HE2  TYR  26           HE2      TYR  26   5.728  -6.497   3.995
  222    HH   TYR  26           HH       TYR  26   5.496  -8.064   7.216
  223    H    VAL  27           H        VAL  27   2.982  -4.557   2.360
  224    HA   VAL  27           HA       VAL  27   0.369  -5.644   3.252
  225    HB   VAL  27           HB       VAL  27   1.313  -5.938   0.363
  226   1HG1  VAL  27          1HG1      VAL  27  -0.306  -7.585   1.250
  227   2HG1  VAL  27          2HG1      VAL  27  -1.348  -6.290   1.801
  228   3HG1  VAL  27          3HG1      VAL  27  -1.076  -6.524   0.058
  229   1HG2  VAL  27          1HG2      VAL  27   0.970  -3.546   0.661
  230   2HG2  VAL  27          2HG2      VAL  27  -0.319  -4.289  -0.297
  231   3HG2  VAL  27          3HG2      VAL  27  -0.608  -3.869   1.416
  232    H    SER  28           H        SER  28   0.428  -7.845   3.677
  233    HA   SER  28           HA       SER  28   2.539  -9.464   2.631
  234   1HB   SER  28          1HB       SER  28   3.534 -10.107   4.829
  235   2HB   SER  28          2HB       SER  28   3.775  -8.404   4.569
  236    HG   SER  28           HG       SER  28   2.967  -8.772   6.640
  237    H    GLY  29           H        GLY  29   2.479 -11.721   4.008
  238   1HA   GLY  29          1HA       GLY  29   1.139 -13.438   4.829
  239   2HA   GLY  29          2HA       GLY  29  -0.317 -12.467   4.609
  240    H    PHE  30           H        PHE  30   0.194 -11.714   1.844
  241    HA   PHE  30           HA       PHE  30  -1.137 -13.932   0.634
  242   1HB   PHE  30          1HB       PHE  30  -1.243 -12.516  -1.322
  243   2HB   PHE  30          2HB       PHE  30  -1.614 -11.600   0.086
  244    HD1  PHE  30           HD1      PHE  30   0.921 -12.232  -2.519
  245    HD2  PHE  30           HD2      PHE  30  -0.124  -9.706   0.820
  246    HE1  PHE  30           HE1      PHE  30   2.787 -10.735  -3.081
  247    HE2  PHE  30           HE2      PHE  30   1.798  -8.248   0.276
  248    HZ   PHE  30           HZ       PHE  30   3.249  -8.784  -1.649
  249    H    HIS  31           H        HIS  31  -0.478 -14.733  -1.551
  250    HA   HIS  31           HA       HIS  31   2.179 -14.766  -2.544
  251   1HB   HIS  31          1HB       HIS  31   2.960 -16.887  -2.074
  252   2HB   HIS  31          2HB       HIS  31   2.459 -16.302  -0.500
  253    HD2  HIS  31           HD2      HIS  31   1.259 -18.678  -3.323
  254    HE1  HIS  31           HE1      HIS  31  -0.592 -19.869   0.310
  255    HE2  HIS  31           HE2      HIS  31  -0.307 -20.496  -2.146
  256    HA   PRO  32           HA       PRO  32   3.051 -16.145  -4.310
  257   1HB   PRO  32          1HB       PRO  32   3.296 -16.360  -6.990
  258   2HB   PRO  32          2HB       PRO  32   2.514 -17.627  -6.036
  259   1HG   PRO  32          1HG       PRO  32   1.089 -15.336  -7.437
  260   2HG   PRO  32          2HG       PRO  32   0.847 -17.092  -7.704
  261   1HD   PRO  32          1HD       PRO  32  -0.682 -15.705  -5.910
  262   2HD   PRO  32          2HD       PRO  32  -0.138 -17.375  -5.588
  263    H    SER  33           H        SER  33   3.947 -14.642  -6.809
  264    HA   SER  33           HA       SER  33   4.441 -12.201  -5.416
  265   1HB   SER  33          1HB       SER  33   6.042 -11.861  -7.260
  266   2HB   SER  33          2HB       SER  33   6.122 -13.554  -6.729
  267    HG   SER  33           HG       SER  33   4.714 -12.579  -8.975
  268    H    ASP  34           H        ASP  34   2.100 -12.968  -7.870
  269    HA   ASP  34           HA       ASP  34   2.323 -10.452  -9.240
  270   1HB   ASP  34          1HB       ASP  34   1.714 -12.518 -10.370
  271   2HB   ASP  34          2HB       ASP  34   0.271 -12.688  -9.369
  272    H    ILE  35           H        ILE  35   2.097  -9.029  -7.352
  273    HA   ILE  35           HA       ILE  35  -0.756  -8.282  -7.019
  274    HB   ILE  35           HB       ILE  35   0.173  -9.113  -4.988
  275   1HG1  ILE  35          1HG1      ILE  35  -0.192  -6.122  -4.666
  276   2HG1  ILE  35          2HG1      ILE  35  -1.517  -7.233  -4.927
  277   1HG2  ILE  35          1HG2      ILE  35   2.112  -6.815  -5.057
  278   2HG2  ILE  35          2HG2      ILE  35   1.909  -8.009  -3.752
  279   3HG2  ILE  35          3HG2      ILE  35   2.521  -8.538  -5.319
  280   1HD1  ILE  35          1HD1      ILE  35  -0.682  -8.537  -2.880
  281   2HD1  ILE  35          2HD1      ILE  35   0.344  -7.140  -2.534
  282   3HD1  ILE  35          3HD1      ILE  35  -1.407  -6.939  -2.589
  283    H    GLU  36           H        GLU  36  -1.343  -6.264  -7.136
  284    HA   GLU  36           HA       GLU  36   0.418  -4.346  -8.572
  285   1HB   GLU  36          1HB       GLU  36  -2.593  -4.541  -8.801
  286   2HB   GLU  36          2HB       GLU  36  -1.438  -3.750  -9.872
  287   1HG   GLU  36          1HG       GLU  36  -0.487  -6.063 -10.352
  288   2HG   GLU  36          2HG       GLU  36  -1.830  -6.742  -9.445
  289    H    VAL  37           H        VAL  37   0.882  -2.611  -7.255
  290    HA   VAL  37           HA       VAL  37  -1.234  -1.542  -5.469
  291    HB   VAL  37           HB       VAL  37   1.640  -2.009  -4.625
  292   1HG1  VAL  37          1HG1      VAL  37   0.538  -0.075  -3.473
  293   2HG1  VAL  37          2HG1      VAL  37  -0.778  -1.162  -2.969
  294   3HG1  VAL  37          3HG1      VAL  37   0.873  -1.427  -2.383
  295   1HG2  VAL  37          1HG2      VAL  37  -0.925  -3.567  -4.133
  296   2HG2  VAL  37          2HG2      VAL  37   0.660  -4.140  -4.718
  297   3HG2  VAL  37          3HG2      VAL  37   0.436  -3.655  -3.025
  298    H    ASP  38           H        ASP  38  -1.646   0.056  -6.937
  299    HA   ASP  38           HA       ASP  38   0.474   2.071  -7.439
  300   1HB   ASP  38          1HB       ASP  38  -1.272   3.165  -8.840
  301   2HB   ASP  38          2HB       ASP  38  -0.770   1.572  -9.417
  302    H    LEU  39           H        LEU  39   0.532   3.865  -6.234
  303    HA   LEU  39           HA       LEU  39  -1.467   4.249  -4.088
  304   1HB   LEU  39          1HB       LEU  39   1.266   5.489  -4.583
  305   2HB   LEU  39          2HB       LEU  39   0.156   5.833  -3.236
  306    HG   LEU  39           HG       LEU  39   0.270   3.279  -2.772
  307   1HD1  LEU  39          1HD1      LEU  39   1.479   2.398  -4.647
  308   2HD1  LEU  39          2HD1      LEU  39   2.758   3.612  -4.467
  309   3HD1  LEU  39          3HD1      LEU  39   2.559   2.324  -3.264
  310   1HD2  LEU  39          1HD2      LEU  39   2.692   5.057  -2.259
  311   2HD2  LEU  39          2HD2      LEU  39   1.191   5.070  -1.306
  312   3HD2  LEU  39          3HD2      LEU  39   2.223   3.632  -1.306
  313    H    LEU  40           H        LEU  40  -2.923   5.903  -4.237
  314    HA   LEU  40           HA       LEU  40  -2.930   7.577  -6.686
  315   1HB   LEU  40          1HB       LEU  40  -3.764   5.124  -6.975
  316   2HB   LEU  40          2HB       LEU  40  -5.127   5.627  -5.993
  317    HG   LEU  40           HG       LEU  40  -5.718   5.677  -8.303
  318   1HD1  LEU  40          1HD1      LEU  40  -6.613   7.549  -6.917
  319   2HD1  LEU  40          2HD1      LEU  40  -5.312   8.591  -7.549
  320   3HD1  LEU  40          3HD1      LEU  40  -6.515   7.911  -8.653
  321   1HD2  LEU  40          1HD2      LEU  40  -3.372   5.895  -9.191
  322   2HD2  LEU  40          2HD2      LEU  40  -4.586   6.876 -10.036
  323   3HD2  LEU  40          3HD2      LEU  40  -3.489   7.641  -8.883
  324    H    LYS  41           H        LYS  41  -3.403   9.607  -5.897
  325    HA   LYS  41           HA       LYS  41  -4.578   9.913  -3.350
  326   1HB   LYS  41          1HB       LYS  41  -3.972  11.925  -5.527
  327   2HB   LYS  41          2HB       LYS  41  -4.102  12.252  -3.777
  328   1HG   LYS  41          1HG       LYS  41  -2.125  11.265  -3.272
  329   2HG   LYS  41          2HG       LYS  41  -1.988  10.280  -4.723
  330   1HD   LYS  41          1HD       LYS  41  -0.476  12.102  -4.803
  331   2HD   LYS  41          2HD       LYS  41  -1.622  12.223  -6.136
  332   1HE   LYS  41          1HE       LYS  41  -2.915  13.924  -5.050
  333   2HE   LYS  41          2HE       LYS  41  -2.051  13.641  -3.521
  334   1HZ   LYS  41          1HZ       LYS  41  -0.868  14.816  -5.934
  335   2HZ   LYS  41          2HZ       LYS  41  -1.358  15.626  -4.572
  336   3HZ   LYS  41          3HZ       LYS  41  -0.102  14.562  -4.489
  337    H    ASN  42           H        ASN  42  -5.905  12.483  -4.502
  338    HA   ASN  42           HA       ASN  42  -8.649  11.622  -4.549
  339   1HB   ASN  42          1HB       ASN  42  -8.955  14.059  -5.413
  340   2HB   ASN  42          2HB       ASN  42  -8.320  13.796  -3.789
  341   1HD2  ASN  42          2HD2      ASN  42  -6.861  14.114  -7.119
  342   2HD2  ASN  42          1HD2      ASN  42  -5.568  15.153  -6.561
  343    H    GLY  43           H        GLY  43  -6.236  12.200  -7.068
  344   1HA   GLY  43          1HA       GLY  43  -7.472  10.480  -8.927
  345   2HA   GLY  43          2HA       GLY  43  -7.997  12.135  -9.310
  346    H    GLU  44           H        GLU  44  -4.894  11.004  -7.962
  347    HA   GLU  44           HA       GLU  44  -3.386  11.513 -10.437
  348   1HB   GLU  44          1HB       GLU  44  -3.613  13.731  -9.373
  349   2HB   GLU  44          2HB       GLU  44  -3.054  13.075  -7.832
  350   1HG   GLU  44          1HG       GLU  44  -0.842  12.545  -8.875
  351   2HG   GLU  44          2HG       GLU  44  -1.409  13.255 -10.396
  352    H    ARG  45           H        ARG  45  -1.747   9.986 -10.509
  353    HA   ARG  45           HA       ARG  45  -1.415   8.232  -8.184
  354   1HB   ARG  45          1HB       ARG  45  -0.192   6.792  -9.549
  355   2HB   ARG  45          2HB       ARG  45  -1.590   7.323 -10.491
  356   1HG   ARG  45          1HG       ARG  45  -0.157   8.907 -11.749
  357   2HG   ARG  45          2HG       ARG  45   1.246   8.429 -10.766
  358   1HD   ARG  45          1HD       ARG  45   0.939   6.079 -11.497
  359   2HD   ARG  45          2HD       ARG  45  -0.348   6.605 -12.602
  360    HE   ARG  45           HE       ARG  45   1.766   8.253 -13.239
  361   1HH1  ARG  45          1HH2      ARG  45   1.388   4.725 -13.106
  362   2HH1  ARG  45          2HH2      ARG  45   2.691   4.419 -14.225
  363   1HH2  ARG  45          1HH1      ARG  45   3.476   7.835 -14.700
  364   2HH2  ARG  45          2HH1      ARG  45   3.872   6.197 -15.146
  365    H    ILE  46           H        ILE  46   0.655   7.722  -7.183
  366    HA   ILE  46           HA       ILE  46   2.190  10.065  -6.604
  367    HB   ILE  46           HB       ILE  46   2.364   7.116  -5.905
  368   1HG1  ILE  46          1HG1      ILE  46   0.246   8.143  -5.101
  369   2HG1  ILE  46          2HG1      ILE  46   1.324   7.634  -3.803
  370   1HG2  ILE  46          1HG2      ILE  46   4.500   8.211  -5.590
  371   2HG2  ILE  46          2HG2      ILE  46   3.719   9.511  -4.656
  372   3HG2  ILE  46          3HG2      ILE  46   3.716   7.815  -4.054
  373   1HD1  ILE  46          1HD1      ILE  46   1.213  10.538  -4.641
  374   2HD1  ILE  46          2HD1      ILE  46   0.083   9.782  -3.524
  375   3HD1  ILE  46          3HD1      ILE  46   1.814   9.796  -3.135
  376    H    GLU  47           H        GLU  47   4.082  10.594  -7.455
  377    HA   GLU  47           HA       GLU  47   5.340   9.076  -9.633
  378   1HB   GLU  47          1HB       GLU  47   6.241  11.575  -8.131
  379   2HB   GLU  47          2HB       GLU  47   7.025  10.875  -9.558
  380   1HG   GLU  47          1HG       GLU  47   4.949  11.251 -10.871
  381   2HG   GLU  47          2HG       GLU  47   4.202  12.034  -9.466
  382    H    LYS  48           H        LYS  48   6.352  10.252  -6.394
  383    HA   LYS  48           HA       LYS  48   8.724   8.580  -6.361
  384   1HB   LYS  48          1HB       LYS  48   7.495  10.461  -4.307
  385   2HB   LYS  48          2HB       LYS  48   9.083   9.681  -4.163
  386   1HG   LYS  48          1HG       LYS  48   9.867  10.829  -6.192
  387   2HG   LYS  48          2HG       LYS  48   8.277  11.599  -6.388
  388   1HD   LYS  48          1HD       LYS  48   8.532  12.695  -4.170
  389   2HD   LYS  48          2HD       LYS  48  10.103  11.906  -3.962
  390   1HE   LYS  48          1HE       LYS  48  10.438  14.201  -4.663
  391   2HE   LYS  48          2HE       LYS  48  10.979  13.112  -5.952
  392   1HZ   LYS  48          1HZ       LYS  48   8.380  14.489  -5.864
  393   2HZ   LYS  48          2HZ       LYS  48   9.678  14.966  -6.760
  394   3HZ   LYS  48          3HZ       LYS  48   8.928  13.539  -7.095
  395    H    VAL  49           H        VAL  49   7.327   6.572  -6.594
  396    HA   VAL  49           HA       VAL  49   6.503   5.501  -3.930
  397    HB   VAL  49           HB       VAL  49   6.277   4.231  -6.689
  398   1HG1  VAL  49          1HG1      VAL  49   6.444   2.578  -4.852
  399   2HG1  VAL  49          2HG1      VAL  49   5.180   3.436  -3.948
  400   3HG1  VAL  49          3HG1      VAL  49   4.796   2.632  -5.487
  401   1HG2  VAL  49          1HG2      VAL  49   4.768   6.140  -6.563
  402   2HG2  VAL  49          2HG2      VAL  49   3.841   4.645  -6.425
  403   3HG2  VAL  49          3HG2      VAL  49   4.179   5.605  -4.968
  404    H    GLU  50           H        GLU  50   8.313   4.923  -2.813
  405    HA   GLU  50           HA       GLU  50  10.499   3.449  -4.200
  406   1HB   GLU  50          1HB       GLU  50  10.962   5.376  -2.562
  407   2HB   GLU  50          2HB       GLU  50  10.401   4.282  -1.294
  408   1HG   GLU  50          1HG       GLU  50  12.170   2.648  -1.975
  409   2HG   GLU  50          2HG       GLU  50  12.719   3.819  -3.187
  410    H    HIS  51           H        HIS  51  11.031   1.312  -3.079
  411    HA   HIS  51           HA       HIS  51   8.897   0.227  -1.415
  412   1HB   HIS  51          1HB       HIS  51   8.454  -1.714  -2.794
  413   2HB   HIS  51          2HB       HIS  51   8.127  -0.273  -3.754
  414    HD2  HIS  51           HD2      HIS  51  10.159   0.284  -5.740
  415    HE1  HIS  51           HE1      HIS  51  11.791  -3.618  -5.563
  416    HE2  HIS  51           HE2      HIS  51  11.765  -1.438  -6.891
  417    H    SER  52           H        SER  52   9.524  -1.515  -0.206
  418    HA   SER  52           HA       SER  52  12.401  -2.115   0.001
  419   1HB   SER  52          1HB       SER  52  11.008  -1.970   2.041
  420   2HB   SER  52          2HB       SER  52  10.002  -3.306   1.441
  421    HG   SER  52           HG       SER  52  11.665  -3.984   2.875
  422    H    ASP  53           H        ASP  53  13.298  -3.695  -1.237
  423    HA   ASP  53           HA       ASP  53  11.962  -4.964  -3.328
  424   1HB   ASP  53          1HB       ASP  53  14.576  -5.714  -1.962
  425   2HB   ASP  53          2HB       ASP  53  14.054  -6.295  -3.550
  426    H    LEU  54           H        LEU  54  11.693  -7.267  -3.775
  427    HA   LEU  54           HA       LEU  54   9.766  -8.177  -2.075
  428   1HB   LEU  54          1HB       LEU  54   9.992  -8.745  -4.475
  429   2HB   LEU  54          2HB       LEU  54  11.286  -9.885  -4.108
  430    HG   LEU  54           HG       LEU  54   8.899 -10.805  -4.504
  431   1HD1  LEU  54          1HD1      LEU  54  10.187 -11.686  -1.900
  432   2HD1  LEU  54          2HD1      LEU  54   9.011 -12.555  -2.855
  433   3HD1  LEU  54          3HD1      LEU  54  10.614 -12.250  -3.531
  434   1HD2  LEU  54          1HD2      LEU  54   7.846  -9.000  -3.042
  435   2HD2  LEU  54          2HD2      LEU  54   7.251 -10.642  -2.829
  436   3HD2  LEU  54          3HD2      LEU  54   8.403 -10.010  -1.676
  437    H    SER  55           H        SER  55   9.738  -9.159  -0.189
  438    HA   SER  55           HA       SER  55  11.902 -11.040   0.613
  439   1HB   SER  55          1HB       SER  55  12.236  -8.851   1.751
  440   2HB   SER  55          2HB       SER  55  10.590  -8.947   2.407
  441    HG   SER  55           HG       SER  55  12.290  -9.760   3.800
  442    H    PHE  56           H        PHE  56  10.656 -12.853   0.160
  443    HA   PHE  56           HA       PHE  56   7.903 -13.000   1.166
  444   1HB   PHE  56          1HB       PHE  56   7.781 -15.085   0.042
  445   2HB   PHE  56          2HB       PHE  56   8.528 -13.938  -1.047
  446    HD1  PHE  56           HD1      PHE  56   8.764 -17.127   0.598
  447    HD2  PHE  56           HD2      PHE  56  11.068 -14.105  -1.429
  448    HE1  PHE  56           HE1      PHE  56  10.701 -18.684   0.478
  449    HE2  PHE  56           HE2      PHE  56  13.035 -15.639  -1.467
  450    HZ   PHE  56           HZ       PHE  56  12.836 -17.933  -0.543
  451    H    SER  57           H        SER  57  10.436 -12.801   2.937
  452    HA   SER  57           HA       SER  57  11.616 -13.810   4.512
  453   1HB   SER  57          1HB       SER  57   9.418 -13.910   5.733
  454   2HB   SER  57          2HB       SER  57   9.186 -15.559   5.119
  455    HG   SER  57           HG       SER  57  11.325 -14.594   6.720
  456    H    LYS  58           H        LYS  58  11.606 -16.655   5.221
  457    HA   LYS  58           HA       LYS  58  12.312 -18.033   2.665
  458   1HB   LYS  58          1HB       LYS  58  12.853 -18.567   5.572
  459   2HB   LYS  58          2HB       LYS  58  13.143 -19.768   4.294
  460   1HG   LYS  58          1HG       LYS  58  14.652 -18.345   3.114
  461   2HG   LYS  58          2HG       LYS  58  14.242 -16.936   4.106
  462   1HD   LYS  58          1HD       LYS  58  15.192 -18.034   6.106
  463   2HD   LYS  58          2HD       LYS  58  15.635 -19.454   5.126
  464   1HE   LYS  58          1HE       LYS  58  17.116 -18.057   3.728
  465   2HE   LYS  58          2HE       LYS  58  16.607 -16.600   4.604
  466   1HZ   LYS  58          1HZ       LYS  58  18.053 -18.869   5.777
  467   2HZ   LYS  58          2HZ       LYS  58  18.693 -17.400   5.388
  468   3HZ   LYS  58          3HZ       LYS  58  17.566 -17.516   6.583
  469    H    ASP  59           H        ASP  59   9.923 -17.943   5.256
  470    HA   ASP  59           HA       ASP  59   8.931 -20.562   4.692
  471   1HB   ASP  59          1HB       ASP  59   7.811 -18.302   6.418
  472   2HB   ASP  59          2HB       ASP  59   7.301 -19.996   6.503
  473    H    TRP  60           H        TRP  60   6.262 -20.467   4.845
  474    HA   TRP  60           HA       TRP  60   5.477 -19.856   2.141
  475   1HB   TRP  60          1HB       TRP  60   3.958 -20.954   4.533
  476   2HB   TRP  60          2HB       TRP  60   3.329 -20.851   2.889
  477    HD1  TRP  60           HD1      TRP  60   6.128 -22.639   4.855
  478    HE1  TRP  60           HE1      TRP  60   6.705 -24.854   3.665
  479    HE3  TRP  60           HE3      TRP  60   3.103 -22.192   0.741
  480    HZ2  TRP  60           HZ2      TRP  60   5.993 -26.213   1.257
  481    HZ3  TRP  60           HZ3      TRP  60   3.065 -23.977  -0.970
  482    HH2  TRP  60           HH2      TRP  60   4.526 -25.973  -0.742
  483    H    SER  61           H        SER  61   5.848 -17.520   2.242
  484    HA   SER  61           HA       SER  61   3.281 -16.210   2.444
  485   1HB   SER  61          1HB       SER  61   4.347 -15.828   4.754
  486   2HB   SER  61          2HB       SER  61   5.621 -14.922   3.925
  487    HG   SER  61           HG       SER  61   2.851 -14.365   3.615
  488    H    PHE  62           H        PHE  62   4.065 -13.643   1.873
  489    HA   PHE  62           HA       PHE  62   6.228 -13.383   0.012
  490   1HB   PHE  62          1HB       PHE  62   4.064 -14.669  -1.117
  491   2HB   PHE  62          2HB       PHE  62   3.731 -12.994  -1.514
  492    HD1  PHE  62           HD1      PHE  62   5.279 -11.789  -3.097
  493    HD2  PHE  62           HD2      PHE  62   6.124 -15.836  -1.825
  494    HE1  PHE  62           HE1      PHE  62   6.919 -12.027  -4.871
  495    HE2  PHE  62           HE2      PHE  62   7.772 -16.060  -3.577
  496    HZ   PHE  62           HZ       PHE  62   8.220 -14.153  -5.139
  497    H    TYR  63           H        TYR  63   6.717 -11.103   0.240
  498    HA   TYR  63           HA       TYR  63   4.507  -9.208   0.476
  499   1HB   TYR  63          1HB       TYR  63   5.034  -8.453   2.762
  500   2HB   TYR  63          2HB       TYR  63   4.450 -10.123   2.708
  501    HD1  TYR  63           HD1      TYR  63   7.351  -8.036   3.364
  502    HD2  TYR  63           HD2      TYR  63   5.663 -11.998   3.424
  503    HE1  TYR  63           HE1      TYR  63   9.105  -8.719   4.900
  504    HE2  TYR  63           HE2      TYR  63   7.435 -12.734   4.936
  505    HH   TYR  63           HH       TYR  63  10.084 -10.529   6.031
  506    H    LEU  64           H        LEU  64   5.296  -7.047   1.159
  507    HA   LEU  64           HA       LEU  64   7.971  -6.217   0.700
  508   1HB   LEU  64          1HB       LEU  64   7.844  -5.307  -1.530
  509   2HB   LEU  64          2HB       LEU  64   7.588  -7.041  -1.596
  510    HG   LEU  64           HG       LEU  64   5.541  -4.842  -1.951
  511   1HD1  LEU  64          1HD1      LEU  64   6.374  -7.095  -3.835
  512   2HD1  LEU  64          2HD1      LEU  64   5.198  -5.831  -4.186
  513   3HD1  LEU  64          3HD1      LEU  64   6.901  -5.398  -3.982
  514   1HD2  LEU  64          1HD2      LEU  64   5.197  -7.845  -1.721
  515   2HD2  LEU  64          2HD2      LEU  64   4.256  -6.584  -0.859
  516   3HD2  LEU  64          3HD2      LEU  64   4.027  -6.869  -2.589
  517    H    LEU  65           H        LEU  65   8.110  -3.885   0.839
  518    HA   LEU  65           HA       LEU  65   5.702  -2.634   2.043
  519   1HB   LEU  65          1HB       LEU  65   8.163  -3.111   3.111
  520   2HB   LEU  65          2HB       LEU  65   8.469  -1.531   2.381
  521    HG   LEU  65           HG       LEU  65   6.285  -2.264   4.393
  522   1HD1  LEU  65          1HD1      LEU  65   8.537  -2.272   5.318
  523   2HD1  LEU  65          2HD1      LEU  65   8.846  -0.657   4.646
  524   3HD1  LEU  65          3HD1      LEU  65   7.626  -0.875   5.925
  525   1HD2  LEU  65          1HD2      LEU  65   6.910   0.321   2.939
  526   2HD2  LEU  65          2HD2      LEU  65   5.342  -0.486   3.135
  527   3HD2  LEU  65          3HD2      LEU  65   6.096   0.308   4.520
  528    H    TYR  66           H        TYR  66   4.997  -0.626   1.161
  529    HA   TYR  66           HA       TYR  66   6.382   0.297  -1.304
  530   1HB   TYR  66          1HB       TYR  66   3.371  -0.074  -1.150
  531   2HB   TYR  66          2HB       TYR  66   4.385   0.137  -2.562
  532    HD1  TYR  66           HD1      TYR  66   3.919  -2.390   0.304
  533    HD2  TYR  66           HD2      TYR  66   4.547  -1.825  -3.940
  534    HE1  TYR  66           HE1      TYR  66   2.905  -4.538  -0.135
  535    HE2  TYR  66           HE2      TYR  66   3.421  -3.986  -4.350
  536    HH   TYR  66           HH       TYR  66   2.005  -5.569  -3.450
  537    H    TYR  67           H        TYR  67   7.040   2.152  -0.370
  538    HA   TYR  67           HA       TYR  67   5.044   3.894   0.962
  539   1HB   TYR  67          1HB       TYR  67   7.041   4.679   2.250
  540   2HB   TYR  67          2HB       TYR  67   6.257   3.152   2.544
  541    HD1  TYR  67           HD1      TYR  67   8.696   3.430  -0.227
  542    HD2  TYR  67           HD2      TYR  67   8.026   2.290   3.856
  543    HE1  TYR  67           HE1      TYR  67  10.793   2.124  -0.252
  544    HE2  TYR  67           HE2      TYR  67  10.190   1.084   3.874
  545    HH   TYR  67           HH       TYR  67  12.274   0.862   0.967
  546    H    THR  68           H        THR  68   5.126   6.008   0.872
  547    HA   THR  68           HA       THR  68   6.811   7.450  -1.147
  548    HB   THR  68           HB       THR  68   4.820   6.724  -2.154
  549    HG1  THR  68           HG1      THR  68   5.734   8.699  -2.719
  550   1HG2  THR  68          1HG2      THR  68   3.287   8.475  -0.182
  551   2HG2  THR  68          2HG2      THR  68   2.625   7.566  -1.545
  552   3HG2  THR  68          3HG2      THR  68   3.290   6.693  -0.152
  553    H    GLU  69           H        GLU  69   7.045   9.749  -0.790
  554    HA   GLU  69           HA       GLU  69   6.670  10.773   1.930
  555   1HB   GLU  69          1HB       GLU  69   7.888  12.766   0.923
  556   2HB   GLU  69          2HB       GLU  69   8.780  11.254   1.050
  557   1HG   GLU  69          1HG       GLU  69   8.624  10.797  -1.292
  558   2HG   GLU  69          2HG       GLU  69   7.429  12.077  -1.547
  559    H    PHE  70           H        PHE  70   4.258  10.655   1.763
  560    HA   PHE  70           HA       PHE  70   2.940  12.272  -0.204
  561   1HB   PHE  70          1HB       PHE  70   0.973  11.550   0.605
  562   2HB   PHE  70          2HB       PHE  70   2.001  10.187   1.010
  563    HD1  PHE  70           HD1      PHE  70  -0.557  12.453   2.117
  564    HD2  PHE  70           HD2      PHE  70   2.958  10.412   3.490
  565    HE1  PHE  70           HE1      PHE  70  -1.148  12.945   4.446
  566    HE2  PHE  70           HE2      PHE  70   2.067  10.451   5.833
  567    HZ   PHE  70           HZ       PHE  70   0.030  11.774   6.311
  568    H    THR  71           H        THR  71   2.106  14.225  -0.090
  569    HA   THR  71           HA       THR  71   2.476  15.943   2.323
  570    HB   THR  71           HB       THR  71   2.532  16.651  -0.585
  571    HG1  THR  71           HG1      THR  71   4.720  16.681  -0.257
  572   1HG2  THR  71          1HG2      THR  71   3.554  18.730   0.279
  573   2HG2  THR  71          2HG2      THR  71   1.914  18.547   0.927
  574   3HG2  THR  71          3HG2      THR  71   3.316  18.164   1.943
  575    HA   PRO  72           HA       PRO  72  -2.103  15.769   1.446
  576   1HB   PRO  72          1HB       PRO  72  -3.138  16.091   3.919
  577   2HB   PRO  72          2HB       PRO  72  -2.344  14.590   3.384
  578   1HG   PRO  72          1HG       PRO  72  -1.111  16.857   4.974
  579   2HG   PRO  72          2HG       PRO  72  -1.064  15.114   5.355
  580   1HD   PRO  72          1HD       PRO  72   0.980  16.392   4.051
  581   2HD   PRO  72          2HD       PRO  72   0.557  14.714   3.674
  582    H    THR  73           H        THR  73  -1.639  17.746   0.208
  583    HA   THR  73           HA       THR  73  -1.724  20.359   1.369
  584    HB   THR  73           HB       THR  73  -2.143  21.095  -0.975
  585    HG1  THR  73           HG1      THR  73  -1.970  18.316  -1.560
  586   1HG2  THR  73          1HG2      THR  73   0.122  19.078  -0.651
  587   2HG2  THR  73          2HG2      THR  73   0.052  20.415  -1.812
  588   3HG2  THR  73          3HG2      THR  73   0.152  20.760  -0.075
  589    H    GLU  74           H        GLU  74  -3.380  20.811   2.669
  590    HA   GLU  74           HA       GLU  74  -5.385  21.290   3.461
  591   1HB   GLU  74          1HB       GLU  74  -5.430  22.831   1.544
  592   2HB   GLU  74          2HB       GLU  74  -6.276  21.631   0.566
  593   1HG   GLU  74          1HG       GLU  74  -8.113  21.619   2.344
  594   2HG   GLU  74          2HG       GLU  74  -7.246  22.929   3.155
  595    H    LYS  75           H        LYS  75  -6.974  19.780   0.673
  596    HA   LYS  75           HA       LYS  75  -8.021  17.640   2.476
  597   1HB   LYS  75          1HB       LYS  75  -9.504  19.597   1.624
  598   2HB   LYS  75          2HB       LYS  75  -9.427  18.785   0.055
  599   1HG   LYS  75          1HG       LYS  75 -10.276  16.675   1.355
  600   2HG   LYS  75          2HG       LYS  75 -10.596  17.784   2.690
  601   1HD   LYS  75          1HD       LYS  75 -11.737  17.978  -0.137
  602   2HD   LYS  75          2HD       LYS  75 -12.587  17.342   1.279
  603   1HE   LYS  75          1HE       LYS  75 -12.431  19.557   2.387
  604   2HE   LYS  75          2HE       LYS  75 -11.600  20.218   0.964
  605   1HZ   LYS  75          1HZ       LYS  75 -14.310  19.107   0.973
  606   2HZ   LYS  75          2HZ       LYS  75 -13.913  20.707   0.930
  607   3HZ   LYS  75          3HZ       LYS  75 -13.519  19.728  -0.335
  608    H    ASP  76           H        ASP  76  -5.539  17.634   0.704
  609    HA   ASP  76           HA       ASP  76  -6.175  15.942  -1.551
  610   1HB   ASP  76          1HB       ASP  76  -4.276  17.502  -1.471
  611   2HB   ASP  76          2HB       ASP  76  -3.525  16.481  -0.236
  612    H    GLU  77           H        GLU  77  -7.162  14.038  -0.984
  613    HA   GLU  77           HA       GLU  77  -6.299  12.461   1.336
  614   1HB   GLU  77          1HB       GLU  77  -8.679  12.642   0.801
  615   2HB   GLU  77          2HB       GLU  77  -8.399  11.953  -0.812
  616   1HG   GLU  77          1HG       GLU  77  -7.663   9.822   0.185
  617   2HG   GLU  77          2HG       GLU  77  -7.776  10.525   1.806
  618    H    TYR  78           H        TYR  78  -4.894  10.811   1.230
  619    HA   TYR  78           HA       TYR  78  -3.922   9.817  -1.408
  620   1HB   TYR  78          1HB       TYR  78  -2.575   9.956   1.275
  621   2HB   TYR  78          2HB       TYR  78  -2.047   8.918  -0.049
  622    HD1  TYR  78           HD1      TYR  78  -0.326   9.748  -1.365
  623    HD2  TYR  78           HD2      TYR  78  -3.074  12.508   0.447
  624    HE1  TYR  78           HE1      TYR  78   0.938  11.682  -2.330
  625    HE2  TYR  78           HE2      TYR  78  -1.834  14.408  -0.523
  626    HH   TYR  78           HH       TYR  78   1.190  13.937  -2.411
  627    H    ALA  79           H        ALA  79  -3.897   7.595  -1.813
  628    HA   ALA  79           HA       ALA  79  -4.959   5.748   0.200
  629   1HB   ALA  79          1HB       ALA  79  -6.378   6.299  -2.453
  630   2HB   ALA  79          2HB       ALA  79  -6.747   4.963  -1.360
  631   3HB   ALA  79          3HB       ALA  79  -7.020   6.638  -0.835
  632    H    CYS  80           H        CYS  80  -4.907   3.530  -0.571
  633    HA   CYS  80           HA       CYS  80  -2.821   2.994  -2.645
  634   1HB   CYS  80          1HB       CYS  80  -3.158   1.831   0.134
  635   2HB   CYS  80          2HB       CYS  80  -2.261   1.010  -1.151
  636    H    ARG  81           H        ARG  81  -3.706   1.965  -4.296
  637    HA   ARG  81           HA       ARG  81  -6.150   0.324  -4.044
  638   1HB   ARG  81          1HB       ARG  81  -5.826   1.630  -6.053
  639   2HB   ARG  81          2HB       ARG  81  -4.239   0.892  -6.325
  640   1HG   ARG  81          1HG       ARG  81  -5.168  -1.274  -6.673
  641   2HG   ARG  81          2HG       ARG  81  -6.764  -0.779  -6.131
  642   1HD   ARG  81          1HD       ARG  81  -5.420   0.349  -8.633
  643   2HD   ARG  81          2HD       ARG  81  -6.487  -1.039  -8.634
  644    HE   ARG  81           HE       ARG  81  -8.339   0.250  -8.105
  645   1HH1  ARG  81          1HH2      ARG  81  -5.452   2.366  -8.401
  646   2HH1  ARG  81          2HH2      ARG  81  -6.422   3.798  -8.567
  647   1HH2  ARG  81          1HH1      ARG  81  -9.528   2.160  -8.286
  648   2HH2  ARG  81          2HH1      ARG  81  -8.724   3.694  -8.493
  649    H    VAL  82           H        VAL  82  -6.032  -1.927  -3.717
  650    HA   VAL  82           HA       VAL  82  -3.363  -3.220  -4.010
  651    HB   VAL  82           HB       VAL  82  -5.396  -3.664  -1.779
  652   1HG1  VAL  82          1HG1      VAL  82  -4.316  -5.748  -2.401
  653   2HG1  VAL  82          2HG1      VAL  82  -2.729  -4.944  -2.492
  654   3HG1  VAL  82          3HG1      VAL  82  -3.533  -5.157  -0.927
  655   1HG2  VAL  82          1HG2      VAL  82  -2.617  -2.399  -1.776
  656   2HG2  VAL  82          2HG2      VAL  82  -4.150  -1.585  -1.390
  657   3HG2  VAL  82          3HG2      VAL  82  -3.526  -2.842  -0.321
  658    H    ASN  83           H        ASN  83  -3.457  -4.733  -5.529
  659    HA   ASN  83           HA       ASN  83  -5.837  -6.492  -5.641
  660   1HB   ASN  83          1HB       ASN  83  -6.069  -4.784  -7.453
  661   2HB   ASN  83          2HB       ASN  83  -4.537  -5.313  -8.128
  662   1HD2  ASN  83          2HD2      ASN  83  -5.002  -6.539  -9.964
  663   2HD2  ASN  83          1HD2      ASN  83  -6.247  -7.767 -10.034
  664    H    HIS  84           H        HIS  84  -4.664  -8.159  -4.637
  665    HA   HIS  84           HA       HIS  84  -2.134  -9.212  -5.743
  666   1HB   HIS  84          1HB       HIS  84  -2.692  -9.491  -3.390
  667   2HB   HIS  84          2HB       HIS  84  -4.181 -10.329  -3.822
  668    HD2  HIS  84           HD2      HIS  84  -0.265 -10.988  -4.330
  669    HE1  HIS  84           HE1      HIS  84  -2.389 -14.641  -4.208
  670    HE2  HIS  84           HE2      HIS  84  -0.039 -13.569  -4.365
  671    H    VAL  85           H        VAL  85  -2.228 -11.321  -6.990
  672    HA   VAL  85           HA       VAL  85  -4.189 -11.477  -8.955
  673    HB   VAL  85           HB       VAL  85  -2.035 -12.496  -9.180
  674   1HG1  VAL  85          1HG1      VAL  85  -1.656 -13.463  -6.967
  675   2HG1  VAL  85          2HG1      VAL  85  -2.956 -14.652  -7.227
  676   3HG1  VAL  85          3HG1      VAL  85  -1.489 -14.698  -8.218
  677   1HG2  VAL  85          1HG2      VAL  85  -3.911 -13.243 -10.610
  678   2HG2  VAL  85          2HG2      VAL  85  -2.683 -14.498 -10.376
  679   3HG2  VAL  85          3HG2      VAL  85  -4.217 -14.592  -9.493
  680    H    THR  86           H        THR  86  -4.265 -13.026  -5.732
  681    HA   THR  86           HA       THR  86  -6.570 -14.625  -6.379
  682    HB   THR  86           HB       THR  86  -4.769 -15.060  -4.622
  683    HG1  THR  86           HG1      THR  86  -6.583 -16.348  -5.062
  684   1HG2  THR  86          1HG2      THR  86  -6.814 -13.835  -2.762
  685   2HG2  THR  86          2HG2      THR  86  -5.164 -14.403  -2.412
  686   3HG2  THR  86          3HG2      THR  86  -5.422 -12.880  -3.303
  687    H    LEU  87           H        LEU  87  -6.199 -11.266  -5.378
  688    HA   LEU  87           HA       LEU  87  -9.026 -10.919  -4.683
  689   1HB   LEU  87          1HB       LEU  87  -6.677  -9.108  -5.238
  690   2HB   LEU  87          2HB       LEU  87  -8.287  -8.499  -5.557
  691    HG   LEU  87           HG       LEU  87  -9.023  -8.889  -3.327
  692   1HD1  LEU  87          1HD1      LEU  87  -7.712 -10.862  -2.660
  693   2HD1  LEU  87          2HD1      LEU  87  -6.205  -9.932  -2.797
  694   3HD1  LEU  87          3HD1      LEU  87  -7.392  -9.533  -1.536
  695   1HD2  LEU  87          1HD2      LEU  87  -6.336  -7.437  -3.402
  696   2HD2  LEU  87          2HD2      LEU  87  -7.899  -6.750  -3.896
  697   3HD2  LEU  87          3HD2      LEU  87  -7.615  -7.186  -2.201
  698    H    SER  88           H        SER  88  -6.975 -10.138  -7.517
  699    HA   SER  88           HA       SER  88  -7.354 -10.019  -9.708
  700   1HB   SER  88          1HB       SER  88  -8.601 -12.204  -9.475
  701   2HB   SER  88          2HB       SER  88 -10.109 -11.264  -9.406
  702    HG   SER  88           HG       SER  88  -9.382 -10.291 -11.419
  703    H    GLN  89           H        GLN  89 -10.026  -8.953  -7.626
  704    HA   GLN  89           HA       GLN  89 -10.512  -6.632  -9.406
  705   1HB   GLN  89          1HB       GLN  89 -12.572  -6.324  -7.980
  706   2HB   GLN  89          2HB       GLN  89 -12.578  -7.625  -9.177
  707   1HG   GLN  89          1HG       GLN  89 -12.405  -9.324  -7.559
  708   2HG   GLN  89          2HG       GLN  89 -11.838  -8.220  -6.300
  709   1HE2  GLN  89          2HE2      GLN  89 -14.688  -8.087  -8.531
  710   2HE2  GLN  89          1HE2      GLN  89 -15.861  -7.914  -7.243
  711    HA   PRO  90           HA       PRO  90  -8.027  -4.657  -6.336
  712   1HB   PRO  90          1HB       PRO  90  -8.490  -1.991  -6.895
  713   2HB   PRO  90          2HB       PRO  90  -7.533  -3.064  -7.961
  714   1HG   PRO  90          1HG       PRO  90 -10.467  -2.350  -8.194
  715   2HG   PRO  90          2HG       PRO  90  -9.220  -2.273  -9.476
  716   1HD   PRO  90          1HD       PRO  90 -10.866  -4.401  -9.257
  717   2HD   PRO  90          2HD       PRO  90  -9.132  -4.655  -9.633
  718    H    LYS  91           H        LYS  91  -8.146  -3.694  -4.327
  719    HA   LYS  91           HA       LYS  91 -10.789  -2.766  -3.299
  720   1HB   LYS  91          1HB       LYS  91  -8.863  -4.736  -1.987
  721   2HB   LYS  91          2HB       LYS  91 -10.221  -3.934  -1.172
  722   1HG   LYS  91          1HG       LYS  91 -11.788  -4.904  -2.846
  723   2HG   LYS  91          2HG       LYS  91 -10.433  -5.775  -3.593
  724   1HD   LYS  91          1HD       LYS  91 -10.068  -7.072  -1.558
  725   2HD   LYS  91          2HD       LYS  91 -11.246  -6.089  -0.674
  726   1HE   LYS  91          1HE       LYS  91 -12.247  -8.234  -1.316
  727   2HE   LYS  91          2HE       LYS  91 -13.071  -6.884  -2.111
  728   1HZ   LYS  91          1HZ       LYS  91 -11.075  -8.656  -3.336
  729   2HZ   LYS  91          2HZ       LYS  91 -12.697  -8.644  -3.636
  730   3HZ   LYS  91          3HZ       LYS  91 -11.773  -7.363  -4.082
  731    H    ILE  92           H        ILE  92 -10.524  -0.697  -2.735
  732    HA   ILE  92           HA       ILE  92  -7.830   0.365  -2.410
  733    HB   ILE  92           HB       ILE  92 -10.373   1.989  -2.243
  734   1HG1  ILE  92          1HG1      ILE  92 -10.812   0.728  -4.223
  735   2HG1  ILE  92          2HG1      ILE  92 -10.310   2.354  -4.664
  736   1HG2  ILE  92          1HG2      ILE  92  -7.551   2.528  -3.263
  737   2HG2  ILE  92          2HG2      ILE  92  -8.891   3.694  -3.244
  738   3HG2  ILE  92          3HG2      ILE  92  -8.241   3.059  -1.720
  739   1HD1  ILE  92          1HD1      ILE  92  -8.076   1.553  -5.273
  740   2HD1  ILE  92          2HD1      ILE  92  -8.489  -0.093  -4.743
  741   3HD1  ILE  92          3HD1      ILE  92  -9.330   0.626  -6.121
  742    H    VAL  93           H        VAL  93  -6.954   0.366  -0.349
  743    HA   VAL  93           HA       VAL  93  -8.681   0.022   1.945
  744    HB   VAL  93           HB       VAL  93  -5.673   0.282   1.628
  745   1HG1  VAL  93          1HG1      VAL  93  -6.165   1.173   3.859
  746   2HG1  VAL  93          2HG1      VAL  93  -7.233  -0.210   4.202
  747   3HG1  VAL  93          3HG1      VAL  93  -5.487  -0.448   3.998
  748   1HG2  VAL  93          1HG2      VAL  93  -6.620  -1.826   0.824
  749   2HG2  VAL  93          2HG2      VAL  93  -5.840  -2.129   2.389
  750   3HG2  VAL  93          3HG2      VAL  93  -7.594  -2.003   2.301
  751    H    LYS  94           H        LYS  94  -7.357   2.653   0.425
  752    HA   LYS  94           HA       LYS  94  -7.070   4.870   0.912
  753   1HB   LYS  94          1HB       LYS  94  -9.133   6.039   1.524
  754   2HB   LYS  94          2HB       LYS  94  -9.240   4.948   0.138
  755   1HG   LYS  94          1HG       LYS  94 -10.459   3.290   1.418
  756   2HG   LYS  94          2HG       LYS  94 -10.237   4.203   2.924
  757   1HD   LYS  94          1HD       LYS  94 -11.514   6.095   1.992
  758   2HD   LYS  94          2HD       LYS  94 -11.752   5.194   0.478
  759   1HE   LYS  94          1HE       LYS  94 -12.972   3.428   1.698
  760   2HE   LYS  94          2HE       LYS  94 -12.693   4.269   3.236
  761   1HZ   LYS  94          1HZ       LYS  94 -14.209   5.364   0.972
  762   2HZ   LYS  94          2HZ       LYS  94 -14.866   4.690   2.325
  763   3HZ   LYS  94          3HZ       LYS  94 -13.990   6.080   2.441
  764    H    TRP  95           H        TRP  95  -5.437   4.849   2.265
  765    HA   TRP  95           HA       TRP  95  -4.946   4.406   4.838
  766   1HB   TRP  95          1HB       TRP  95  -3.265   5.307   3.442
  767   2HB   TRP  95          2HB       TRP  95  -4.209   6.730   3.080
  768    HD1  TRP  95           HD1      TRP  95  -2.785   5.336   6.430
  769    HE1  TRP  95           HE1      TRP  95  -1.844   7.343   7.772
  770    HE3  TRP  95           HE3      TRP  95  -3.491   9.051   3.005
  771    HZ2  TRP  95           HZ2      TRP  95  -2.011  10.253   7.606
  772    HZ3  TRP  95           HZ3      TRP  95  -2.980  11.400   3.597
  773    HH2  TRP  95           HH2      TRP  95  -2.483  12.008   5.945
  774    H    ASP  96           H        ASP  96  -6.157   4.707   6.612
  775    HA   ASP  96           HA       ASP  96  -7.856   7.009   7.031
  776   1HB   ASP  96          1HB       ASP  96  -8.386   4.784   7.955
  777   2HB   ASP  96          2HB       ASP  96  -6.912   4.834   8.941
  778    H    ARG  97           H        ARG  97  -7.540   8.604   8.695
  779    HA   ARG  97           HA       ARG  97  -4.690   9.276   9.267
  780   1HB   ARG  97          1HB       ARG  97  -5.417  11.660   8.792
  781   2HB   ARG  97          2HB       ARG  97  -5.027  10.613   7.439
  782   1HG   ARG  97          1HG       ARG  97  -7.926  10.896   8.260
  783   2HG   ARG  97          2HG       ARG  97  -7.123  12.185   7.356
  784   1HD   ARG  97          1HD       ARG  97  -6.492  10.649   5.564
  785   2HD   ARG  97          2HD       ARG  97  -7.235   9.294   6.424
  786    HE   ARG  97           HE       ARG  97  -9.121  11.416   6.043
  787   1HH1  ARG  97          1HH2      ARG  97  -7.529   8.690   4.356
  788   2HH1  ARG  97          2HH2      ARG  97  -8.770   8.620   3.120
  789   1HH2  ARG  97          1HH1      ARG  97 -10.793  11.142   4.463
  790   2HH2  ARG  97          2HH1      ARG  97 -10.580   9.946   3.197
  791    H    ASP  98           H        ASP  98  -4.672   8.911  11.346
  792    HA   ASP  98           HA       ASP  98  -6.497   9.029  13.348
  793   1HB   ASP  98          1HB       ASP  98  -4.196   8.272  13.623
  794   2HB   ASP  98          2HB       ASP  98  -3.584   9.916  13.391
  795    H    MET  99           H        MET  99  -4.644  11.839  12.106
  796    HA   MET  99           HA       MET  99  -6.786  13.627  13.035
  797   1HB   MET  99          1HB       MET  99  -4.755  13.600  14.669
  798   2HB   MET  99          2HB       MET  99  -3.842  14.338  13.354
  799   1HG   MET  99          1HG       MET  99  -4.644  16.037  14.884
  800   2HG   MET  99          2HG       MET  99  -5.412  16.243  13.315
  801   1HE   MET  99          1HE       MET  99  -6.623  13.512  16.074
  802   2HE   MET  99          2HE       MET  99  -5.758  14.827  16.908
  803   3HE   MET  99          3HE       MET  99  -7.514  14.634  17.120
  Start of MODEL    4
    1   1H    MET   0          1H        MET   0  -8.614 -20.458  -4.666
    2   2H    MET   0          2H        MET   0  -8.200 -20.137  -3.099
    3   3H    MET   0          3H        MET   0  -7.214 -19.652  -4.322
    4    HA   MET   0           HA       MET   0  -7.847 -22.396  -3.563
    5   1HB   MET   0          1HB       MET   0  -6.134 -23.089  -5.211
    6   2HB   MET   0          2HB       MET   0  -7.558 -22.340  -5.910
    7   1HG   MET   0          1HG       MET   0  -6.424 -20.270  -6.337
    8   2HG   MET   0          2HG       MET   0  -4.980 -20.795  -5.464
    9   1HE   MET   0          1HE       MET   0  -5.148 -19.519  -8.385
   10   2HE   MET   0          2HE       MET   0  -3.568 -19.975  -7.696
   11   3HE   MET   0          3HE       MET   0  -4.019 -20.523  -9.322
   12    H    ILE   1           H        ILE   1  -4.626 -22.425  -4.065
   13    HA   ILE   1           HA       ILE   1  -4.049 -22.608  -1.319
   14    HB   ILE   1           HB       ILE   1  -2.032 -22.258  -3.538
   15   1HG1  ILE   1          1HG1      ILE   1  -2.083 -24.964  -2.983
   16   2HG1  ILE   1          2HG1      ILE   1  -3.798 -24.578  -2.861
   17   1HG2  ILE   1          1HG2      ILE   1  -1.832 -23.619  -0.820
   18   2HG2  ILE   1          2HG2      ILE   1  -0.546 -23.527  -2.042
   19   3HG2  ILE   1          3HG2      ILE   1  -1.105 -22.060  -1.245
   20   1HD1  ILE   1          1HD1      ILE   1  -3.692 -23.621  -5.184
   21   2HD1  ILE   1          2HD1      ILE   1  -1.949 -23.948  -5.212
   22   3HD1  ILE   1          3HD1      ILE   1  -3.107 -25.292  -5.133
   23    H    GLN   2           H        GLN   2  -3.583 -20.188  -3.626
   24    HA   GLN   2           HA       GLN   2  -1.828 -18.316  -2.664
   25   1HB   GLN   2          1HB       GLN   2  -4.480 -17.731  -4.034
   26   2HB   GLN   2          2HB       GLN   2  -3.114 -16.615  -3.886
   27   1HG   GLN   2          1HG       GLN   2  -1.698 -18.301  -5.125
   28   2HG   GLN   2          2HG       GLN   2  -3.150 -19.237  -5.454
   29   1HE2  GLN   2          2HE2      GLN   2  -1.216 -17.618  -7.227
   30   2HE2  GLN   2          1HE2      GLN   2  -2.305 -16.656  -8.202
   31    H    ARG   3           H        ARG   3  -1.655 -17.334  -0.694
   32    HA   ARG   3           HA       ARG   3  -3.977 -17.056   1.010
   33   1HB   ARG   3          1HB       ARG   3  -1.049 -16.711   1.297
   34   2HB   ARG   3          2HB       ARG   3  -1.990 -15.542   2.216
   35   1HG   ARG   3          1HG       ARG   3  -2.546 -18.514   2.387
   36   2HG   ARG   3          2HG       ARG   3  -1.415 -17.653   3.448
   37   1HD   ARG   3          1HD       ARG   3  -3.196 -16.119   4.187
   38   2HD   ARG   3          2HD       ARG   3  -4.369 -16.949   3.146
   39    HE   ARG   3           HE       ARG   3  -3.077 -18.798   4.918
   40   1HH1  ARG   3          1HH2      ARG   3  -5.574 -16.267   4.840
   41   2HH1  ARG   3          2HH2      ARG   3  -6.505 -16.970   6.135
   42   1HH2  ARG   3          1HH1      ARG   3  -4.313 -19.704   6.623
   43   2HH2  ARG   3          2HH1      ARG   3  -5.781 -18.929   7.158
   44    H    THR   4           H        THR   4  -4.827 -15.133   1.888
   45    HA   THR   4           HA       THR   4  -5.218 -13.078  -0.082
   46    HB   THR   4           HB       THR   4  -6.866 -12.324   1.701
   47    HG1  THR   4           HG1      THR   4  -5.710 -13.274   3.451
   48   1HG2  THR   4          1HG2      THR   4  -8.409 -14.197   1.350
   49   2HG2  THR   4          2HG2      THR   4  -7.531 -13.847  -0.151
   50   3HG2  THR   4          3HG2      THR   4  -7.074 -15.248   0.843
   51    HA   PRO   5           HA       PRO   5  -2.329 -10.247   1.835
   52   1HB   PRO   5          1HB       PRO   5  -3.190  -7.859   0.816
   53   2HB   PRO   5          2HB       PRO   5  -2.400  -9.120  -0.179
   54   1HG   PRO   5          1HG       PRO   5  -5.354  -8.558   0.151
   55   2HG   PRO   5          2HG       PRO   5  -4.436  -8.803  -1.363
   56   1HD   PRO   5          1HD       PRO   5  -5.844 -10.826  -0.151
   57   2HD   PRO   5          2HD       PRO   5  -4.293 -11.135  -0.993
   58    H    LYS   6           H        LYS   6  -2.321  -9.772   3.941
   59    HA   LYS   6           HA       LYS   6  -4.504  -8.381   5.329
   60   1HB   LYS   6          1HB       LYS   6  -3.012 -10.116   6.435
   61   2HB   LYS   6          2HB       LYS   6  -1.666  -8.981   6.242
   62   1HG   LYS   6          1HG       LYS   6  -3.271  -7.270   7.413
   63   2HG   LYS   6          2HG       LYS   6  -4.184  -8.706   7.905
   64   1HD   LYS   6          1HD       LYS   6  -2.101  -9.642   8.935
   65   2HD   LYS   6          2HD       LYS   6  -1.221  -8.177   8.469
   66   1HE   LYS   6          1HE       LYS   6  -3.587  -8.324  10.395
   67   2HE   LYS   6          2HE       LYS   6  -1.883  -8.084  10.826
   68   1HZ   LYS   6          1HZ       LYS   6  -3.583  -6.241   9.305
   69   2HZ   LYS   6          2HZ       LYS   6  -2.963  -6.012  10.814
   70   3HZ   LYS   6          3HZ       LYS   6  -1.966  -6.041   9.495
   71    H    ILE   7           H        ILE   7  -4.736  -6.315   4.647
   72    HA   ILE   7           HA       ILE   7  -2.456  -4.699   3.684
   73    HB   ILE   7           HB       ILE   7  -5.449  -4.292   3.617
   74   1HG1  ILE   7          1HG1      ILE   7  -3.658  -4.940   1.252
   75   2HG1  ILE   7          2HG1      ILE   7  -4.411  -6.223   2.200
   76   1HG2  ILE   7          1HG2      ILE   7  -4.302  -2.156   3.563
   77   2HG2  ILE   7          2HG2      ILE   7  -3.158  -2.739   2.336
   78   3HG2  ILE   7          3HG2      ILE   7  -4.870  -2.505   1.933
   79   1HD1  ILE   7          1HD1      ILE   7  -5.915  -4.078   0.674
   80   2HD1  ILE   7          2HD1      ILE   7  -5.812  -5.807   0.316
   81   3HD1  ILE   7          3HD1      ILE   7  -6.654  -5.262   1.775
   82    H    GLN   8           H        GLN   8  -1.463  -3.190   5.130
   83    HA   GLN   8           HA       GLN   8  -3.240  -1.783   7.027
   84   1HB   GLN   8          1HB       GLN   8  -1.147  -1.698   8.432
   85   2HB   GLN   8          2HB       GLN   8  -2.120  -3.169   8.509
   86   1HG   GLN   8          1HG       GLN   8   0.361  -2.898   6.783
   87   2HG   GLN   8          2HG       GLN   8   0.435  -3.388   8.474
   88   1HE2  GLN   8          2HE2      GLN   8   1.258  -4.884   6.054
   89   2HE2  GLN   8          1HE2      GLN   8   0.373  -6.392   6.131
   90    H    VAL   9           H        VAL   9  -3.342   0.252   6.362
   91    HA   VAL   9           HA       VAL   9  -1.093   1.434   4.795
   92    HB   VAL   9           HB       VAL   9  -4.057   2.112   4.809
   93   1HG1  VAL   9          1HG1      VAL   9  -2.691   4.088   4.365
   94   2HG1  VAL   9          2HG1      VAL   9  -1.680   3.193   3.234
   95   3HG1  VAL   9          3HG1      VAL   9  -3.391   3.522   2.842
   96   1HG2  VAL   9          1HG2      VAL   9  -2.338   0.661   2.750
   97   2HG2  VAL   9          2HG2      VAL   9  -3.668  -0.025   3.702
   98   3HG2  VAL   9          3HG2      VAL   9  -4.012   1.219   2.498
   99    H    TYR  10           H        TYR  10   0.140   2.377   6.385
  100    HA   TYR  10           HA       TYR  10  -1.247   4.142   8.383
  101   1HB   TYR  10          1HB       TYR  10   0.583   3.656   9.872
  102   2HB   TYR  10          2HB       TYR  10  -0.317   2.225   9.392
  103    HD1  TYR  10           HD1      TYR  10   2.945   3.944   9.184
  104    HD2  TYR  10           HD2      TYR  10   0.660   0.480   8.019
  105    HE1  TYR  10           HE1      TYR  10   5.046   2.729   8.640
  106    HE2  TYR  10           HE2      TYR  10   2.768  -0.742   7.543
  107    HH   TYR  10           HH       TYR  10   5.968   0.836   7.734
  108    H    SER  11           H        SER  11  -0.284   6.088   9.004
  109    HA   SER  11           HA       SER  11   1.508   7.370   7.050
  110   1HB   SER  11          1HB       SER  11   1.173   9.393   8.329
  111   2HB   SER  11          2HB       SER  11  -0.350   8.665   7.852
  112    HG   SER  11           HG       SER  11  -0.542   7.814   9.957
  113    H    ARG  12           H        ARG  12   3.653   8.037   7.604
  114    HA   ARG  12           HA       ARG  12   4.929   6.466   9.724
  115   1HB   ARG  12          1HB       ARG  12   5.781   6.921   7.245
  116   2HB   ARG  12          2HB       ARG  12   6.440   8.387   7.971
  117   1HG   ARG  12          1HG       ARG  12   8.204   6.901   8.291
  118   2HG   ARG  12          2HG       ARG  12   7.340   6.717   9.826
  119   1HD   ARG  12          1HD       ARG  12   6.029   4.804   8.509
  120   2HD   ARG  12          2HD       ARG  12   7.370   4.924   7.377
  121    HE   ARG  12           HE       ARG  12   8.808   3.943   8.871
  122   1HH1  ARG  12          1HH2      ARG  12   5.759   4.676  10.559
  123   2HH1  ARG  12          2HH2      ARG  12   6.124   3.641  11.913
  124   1HH2  ARG  12          1HH1      ARG  12   9.264   2.605  10.661
  125   2HH2  ARG  12          2HH1      ARG  12   8.128   2.471  11.977
  126    H    HIS  13           H        HIS  13   5.146   9.896   8.692
  127    HA   HIS  13           HA       HIS  13   5.394  10.886  11.467
  128   1HB   HIS  13          1HB       HIS  13   5.240  12.267   8.778
  129   2HB   HIS  13          2HB       HIS  13   5.447  13.097  10.322
  130    HD2  HIS  13           HD2      HIS  13   7.545  12.036   7.501
  131    HE1  HIS  13           HE1      HIS  13  10.077  11.664  10.874
  132    HE2  HIS  13           HE2      HIS  13  10.020  11.741   8.321
  133    HA   PRO  14           HA       PRO  14   1.017  11.049  11.720
  134   1HB   PRO  14          1HB       PRO  14   0.500  12.811  13.705
  135   2HB   PRO  14          2HB       PRO  14   1.569  11.409  13.956
  136   1HG   PRO  14          1HG       PRO  14   2.431  14.230  13.242
  137   2HG   PRO  14          2HG       PRO  14   2.979  13.249  14.635
  138   1HD   PRO  14          1HD       PRO  14   4.377  13.327  12.298
  139   2HD   PRO  14          2HD       PRO  14   4.241  11.812  13.232
  140    H    ALA  15           H        ALA  15   1.556  12.213   9.347
  141    HA   ALA  15           HA       ALA  15   0.818  13.559   7.734
  142   1HB   ALA  15          1HB       ALA  15  -1.609  14.079   9.480
  143   2HB   ALA  15          2HB       ALA  15  -1.509  14.101   7.704
  144   3HB   ALA  15          3HB       ALA  15  -1.327  12.580   8.582
  145    H    GLU  16           H        GLU  16  -0.440  15.923   7.416
  146    HA   GLU  16           HA       GLU  16   0.559  18.035   9.063
  147   1HB   GLU  16          1HB       GLU  16   2.457  16.811   7.257
  148   2HB   GLU  16          2HB       GLU  16   2.049  18.348   6.552
  149   1HG   GLU  16          1HG       GLU  16   2.978  17.888   9.428
  150   2HG   GLU  16          2HG       GLU  16   3.999  18.443   8.106
  151    H    ASN  17           H        ASN  17   0.753  19.994   7.035
  152    HA   ASN  17           HA       ASN  17  -1.583  19.647   5.251
  153   1HB   ASN  17          1HB       ASN  17  -2.427  20.851   7.234
  154   2HB   ASN  17          2HB       ASN  17  -1.205  22.107   7.003
  155   1HD2  ASN  17          2HD2      ASN  17  -1.215  23.173   4.754
  156   2HD2  ASN  17          1HD2      ASN  17  -2.755  23.379   3.939
  157    H    GLY  18           H        GLY  18  -0.323  19.520   3.410
  158   1HA   GLY  18          1HA       GLY  18   0.641  20.477   1.581
  159   2HA   GLY  18          2HA       GLY  18   0.811  22.006   2.444
  160    H    LYS  19           H        LYS  19   2.293  20.128   4.593
  161    HA   LYS  19           HA       LYS  19   4.996  20.465   3.449
  162   1HB   LYS  19          1HB       LYS  19   4.383  21.349   5.650
  163   2HB   LYS  19          2HB       LYS  19   4.012  19.688   6.150
  164   1HG   LYS  19          1HG       LYS  19   6.786  20.711   5.439
  165   2HG   LYS  19          2HG       LYS  19   6.114  20.553   7.067
  166   1HD   LYS  19          1HD       LYS  19   5.673  18.031   6.312
  167   2HD   LYS  19          2HD       LYS  19   6.993  18.417   5.174
  168   1HE   LYS  19          1HE       LYS  19   8.433  19.013   7.097
  169   2HE   LYS  19          2HE       LYS  19   7.102  18.615   8.210
  170   1HZ   LYS  19          1HZ       LYS  19   8.314  16.732   6.315
  171   2HZ   LYS  19          2HZ       LYS  19   8.658  16.812   7.931
  172   3HZ   LYS  19          3HZ       LYS  19   7.146  16.396   7.418
  173    H    SER  20           H        SER  20   5.761  18.857   2.539
  174    HA   SER  20           HA       SER  20   4.863  16.415   1.976
  175   1HB   SER  20          1HB       SER  20   6.855  17.482   0.955
  176   2HB   SER  20          2HB       SER  20   7.794  16.712   2.264
  177    HG   SER  20           HG       SER  20   7.651  15.422   0.358
  178    H    ASN  21           H        ASN  21   4.496  14.586   3.112
  179    HA   ASN  21           HA       ASN  21   5.720  14.111   5.798
  180   1HB   ASN  21          1HB       ASN  21   3.269  14.795   5.439
  181   2HB   ASN  21          2HB       ASN  21   3.030  13.177   4.816
  182   1HD2  ASN  21          2HD2      ASN  21   3.849  15.181   7.623
  183   2HD2  ASN  21          1HD2      ASN  21   3.556  13.964   8.844
  184    H    PHE  22           H        PHE  22   4.342  11.315   5.694
  185    HA   PHE  22           HA       PHE  22   5.491  10.043   3.389
  186   1HB   PHE  22          1HB       PHE  22   7.176  10.212   5.692
  187   2HB   PHE  22          2HB       PHE  22   6.626   8.549   5.584
  188    HD1  PHE  22           HD1      PHE  22   8.838  11.045   4.157
  189    HD2  PHE  22           HD2      PHE  22   6.909   7.264   3.405
  190    HE1  PHE  22           HE1      PHE  22  10.421  10.604   2.301
  191    HE2  PHE  22           HE2      PHE  22   8.476   6.853   1.511
  192    HZ   PHE  22           HZ       PHE  22  10.200   8.536   0.940
  193    H    LEU  23           H        LEU  23   4.152   8.557   2.768
  194    HA   LEU  23           HA       LEU  23   2.243   7.307   4.668
  195   1HB   LEU  23          1HB       LEU  23   1.264   8.732   2.937
  196   2HB   LEU  23          2HB       LEU  23   2.119   7.834   1.681
  197    HG   LEU  23           HG       LEU  23   0.708   5.854   2.246
  198   1HD1  LEU  23          1HD1      LEU  23  -0.548   7.796   4.247
  199   2HD1  LEU  23          2HD1      LEU  23  -1.214   6.209   3.782
  200   3HD1  LEU  23          3HD1      LEU  23   0.308   6.298   4.656
  201   1HD2  LEU  23          1HD2      LEU  23  -0.039   7.603   0.581
  202   2HD2  LEU  23          2HD2      LEU  23  -1.406   6.814   1.396
  203   3HD2  LEU  23          3HD2      LEU  23  -0.887   8.441   1.889
  204    H    ASN  24           H        ASN  24   2.176   5.102   4.824
  205    HA   ASN  24           HA       ASN  24   3.996   3.446   3.103
  206   1HB   ASN  24          1HB       ASN  24   3.378   3.389   6.062
  207   2HB   ASN  24          2HB       ASN  24   4.029   2.003   5.193
  208   1HD2  ASN  24          2HD2      ASN  24   5.089   5.403   4.560
  209   2HD2  ASN  24          1HD2      ASN  24   6.696   5.153   5.191
  210    H    CYS  25           H        CYS  25   2.491   2.546   1.666
  211    HA   CYS  25           HA       CYS  25   0.148   1.114   2.770
  212   1HB   CYS  25          1HB       CYS  25   1.520   0.538   0.121
  213   2HB   CYS  25          2HB       CYS  25  -0.099   0.105   0.631
  214    H    TYR  26           H        TYR  26   0.570  -0.852   3.863
  215    HA   TYR  26           HA       TYR  26   2.982  -2.387   3.018
  216   1HB   TYR  26          1HB       TYR  26   3.461  -1.326   5.168
  217   2HB   TYR  26          2HB       TYR  26   1.950  -1.891   5.814
  218    HD1  TYR  26           HD1      TYR  26   2.810  -3.136   7.691
  219    HD2  TYR  26           HD2      TYR  26   4.427  -3.883   3.768
  220    HE1  TYR  26           HE1      TYR  26   3.705  -5.309   8.467
  221    HE2  TYR  26           HE2      TYR  26   5.341  -6.015   4.544
  222    HH   TYR  26           HH       TYR  26   5.602  -7.471   6.318
  223    H    VAL  27           H        VAL  27   2.461  -4.375   2.345
  224    HA   VAL  27           HA       VAL  27  -0.176  -5.503   3.160
  225    HB   VAL  27           HB       VAL  27   1.067  -5.834   0.384
  226   1HG1  VAL  27          1HG1      VAL  27  -0.567  -7.557   1.239
  227   2HG1  VAL  27          2HG1      VAL  27  -1.733  -6.265   1.508
  228   3HG1  VAL  27          3HG1      VAL  27  -1.196  -6.648  -0.145
  229   1HG2  VAL  27          1HG2      VAL  27   0.482  -3.467   0.614
  230   2HG2  VAL  27          2HG2      VAL  27  -0.660  -4.330  -0.434
  231   3HG2  VAL  27          3HG2      VAL  27  -1.117  -3.929   1.249
  232    H    SER  28           H        SER  28  -0.019  -7.640   3.826
  233    HA   SER  28           HA       SER  28   2.296  -9.203   3.083
  234   1HB   SER  28          1HB       SER  28   3.093  -9.505   5.419
  235   2HB   SER  28          2HB       SER  28   3.208  -7.814   4.995
  236    HG   SER  28           HG       SER  28   1.034  -9.006   6.395
  237    H    GLY  29           H        GLY  29   2.326 -11.369   4.340
  238   1HA   GLY  29          1HA       GLY  29   1.156 -13.167   5.258
  239   2HA   GLY  29          2HA       GLY  29  -0.375 -12.312   5.083
  240    H    PHE  30           H        PHE  30   0.376 -11.620   2.186
  241    HA   PHE  30           HA       PHE  30  -1.063 -13.832   1.039
  242   1HB   PHE  30          1HB       PHE  30  -1.098 -12.489  -0.957
  243   2HB   PHE  30          2HB       PHE  30  -1.459 -11.512   0.415
  244    HD1  PHE  30           HD1      PHE  30   1.071 -12.247  -2.166
  245    HD2  PHE  30           HD2      PHE  30   0.013  -9.637   1.099
  246    HE1  PHE  30           HE1      PHE  30   2.912 -10.739  -2.788
  247    HE2  PHE  30           HE2      PHE  30   1.835  -8.109   0.429
  248    HZ   PHE  30           HZ       PHE  30   3.309  -8.697  -1.471
  249    H    HIS  31           H        HIS  31  -0.333 -14.622  -1.179
  250    HA   HIS  31           HA       HIS  31   2.369 -14.675  -2.051
  251   1HB   HIS  31          1HB       HIS  31   3.123 -16.790  -1.619
  252   2HB   HIS  31          2HB       HIS  31   2.464 -16.346  -0.057
  253    HD2  HIS  31           HD2      HIS  31   1.587 -18.527  -3.161
  254    HE1  HIS  31           HE1      HIS  31  -0.516 -20.048   0.199
  255    HE2  HIS  31           HE2      HIS  31   0.021 -20.474  -2.269
  256    HA   PRO  32           HA       PRO  32   3.324 -16.016  -3.867
  257   1HB   PRO  32          1HB       PRO  32   3.609 -16.083  -6.567
  258   2HB   PRO  32          2HB       PRO  32   2.868 -17.430  -5.685
  259   1HG   PRO  32          1HG       PRO  32   1.400 -15.115  -7.000
  260   2HG   PRO  32          2HG       PRO  32   1.197 -16.862  -7.344
  261   1HD   PRO  32          1HD       PRO  32  -0.401 -15.610  -5.525
  262   2HD   PRO  32          2HD       PRO  32   0.227 -17.260  -5.226
  263    H    SER  33           H        SER  33   4.492 -14.500  -6.048
  264    HA   SER  33           HA       SER  33   4.712 -12.014  -4.660
  265   1HB   SER  33          1HB       SER  33   6.551 -11.671  -6.269
  266   2HB   SER  33          2HB       SER  33   6.593 -13.358  -5.708
  267    HG   SER  33           HG       SER  33   6.790 -13.141  -7.988
  268    H    ASP  34           H        ASP  34   2.668 -12.907  -7.294
  269    HA   ASP  34           HA       ASP  34   3.017 -10.491  -8.810
  270   1HB   ASP  34          1HB       ASP  34   2.502 -12.632  -9.843
  271   2HB   ASP  34          2HB       ASP  34   0.978 -12.741  -8.958
  272    H    ILE  35           H        ILE  35   2.634  -8.948  -7.062
  273    HA   ILE  35           HA       ILE  35  -0.231  -8.171  -7.007
  274    HB   ILE  35           HB       ILE  35   0.476  -9.015  -4.923
  275   1HG1  ILE  35          1HG1      ILE  35   0.124  -6.012  -4.611
  276   2HG1  ILE  35          2HG1      ILE  35  -1.186  -7.100  -5.036
  277   1HG2  ILE  35          1HG2      ILE  35   2.860  -8.434  -4.997
  278   2HG2  ILE  35          2HG2      ILE  35   2.414  -6.722  -4.717
  279   3HG2  ILE  35          3HG2      ILE  35   2.067  -7.964  -3.493
  280   1HD1  ILE  35          1HD1      ILE  35  -0.541  -8.455  -2.920
  281   2HD1  ILE  35          2HD1      ILE  35   0.383  -7.027  -2.444
  282   3HD1  ILE  35          3HD1      ILE  35  -1.358  -6.893  -2.702
  283    H    GLU  36           H        GLU  36  -0.727  -6.013  -7.128
  284    HA   GLU  36           HA       GLU  36   1.379  -4.134  -8.067
  285   1HB   GLU  36          1HB       GLU  36  -1.398  -3.737  -9.052
  286   2HB   GLU  36          2HB       GLU  36   0.158  -3.400  -9.778
  287   1HG   GLU  36          1HG       GLU  36   0.515  -5.815 -10.182
  288   2HG   GLU  36          2HG       GLU  36  -1.057  -6.164  -9.479
  289    H    VAL  37           H        VAL  37   1.409  -2.179  -6.961
  290    HA   VAL  37           HA       VAL  37  -0.929  -1.344  -5.363
  291    HB   VAL  37           HB       VAL  37   1.855  -1.801  -4.221
  292   1HG1  VAL  37          1HG1      VAL  37   0.802   0.206  -3.168
  293   2HG1  VAL  37          2HG1      VAL  37  -0.616  -0.783  -2.758
  294   3HG1  VAL  37          3HG1      VAL  37   0.961  -1.151  -2.052
  295   1HG2  VAL  37          1HG2      VAL  37  -0.817  -3.201  -3.850
  296   2HG2  VAL  37          2HG2      VAL  37   0.747  -3.896  -4.338
  297   3HG2  VAL  37          3HG2      VAL  37   0.478  -3.347  -2.673
  298    H    ASP  38           H        ASP  38  -1.244   0.314  -6.793
  299    HA   ASP  38           HA       ASP  38   0.799   2.427  -7.050
  300   1HB   ASP  38          1HB       ASP  38  -2.171   2.653  -7.673
  301   2HB   ASP  38          2HB       ASP  38  -0.844   3.655  -8.247
  302    H    LEU  39           H        LEU  39   0.613   4.422  -5.940
  303    HA   LEU  39           HA       LEU  39  -1.499   4.629  -3.840
  304   1HB   LEU  39          1HB       LEU  39   1.086   6.192  -4.117
  305   2HB   LEU  39          2HB       LEU  39  -0.270   6.565  -3.035
  306    HG   LEU  39           HG       LEU  39   0.169   3.864  -2.527
  307   1HD1  LEU  39          1HD1      LEU  39   2.284   3.907  -3.784
  308   2HD1  LEU  39          2HD1      LEU  39   2.878   5.212  -2.731
  309   3HD1  LEU  39          3HD1      LEU  39   2.544   3.604  -2.058
  310   1HD2  LEU  39          1HD2      LEU  39  -0.385   5.401  -0.802
  311   2HD2  LEU  39          2HD2      LEU  39   1.247   4.832  -0.377
  312   3HD2  LEU  39          3HD2      LEU  39   1.024   6.412  -1.131
  313    H    LEU  40           H        LEU  40  -3.040   6.073  -4.095
  314    HA   LEU  40           HA       LEU  40  -3.216   7.588  -6.648
  315   1HB   LEU  40          1HB       LEU  40  -3.959   5.082  -6.615
  316   2HB   LEU  40          2HB       LEU  40  -5.286   5.640  -5.616
  317    HG   LEU  40           HG       LEU  40  -6.012   5.394  -7.860
  318   1HD1  LEU  40          1HD1      LEU  40  -5.698   8.395  -7.469
  319   2HD1  LEU  40          2HD1      LEU  40  -6.915   7.554  -8.438
  320   3HD1  LEU  40          3HD1      LEU  40  -6.924   7.375  -6.673
  321   1HD2  LEU  40          1HD2      LEU  40  -3.701   5.611  -8.882
  322   2HD2  LEU  40          2HD2      LEU  40  -5.018   6.376  -9.795
  323   3HD2  LEU  40          3HD2      LEU  40  -3.936   7.370  -8.816
  324    H    LYS  41           H        LYS  41  -3.822   9.683  -6.022
  325    HA   LYS  41           HA       LYS  41  -5.027  10.076  -3.422
  326   1HB   LYS  41          1HB       LYS  41  -4.403  12.010  -5.641
  327   2HB   LYS  41          2HB       LYS  41  -4.760  12.454  -3.956
  328   1HG   LYS  41          1HG       LYS  41  -2.749  12.080  -3.234
  329   2HG   LYS  41          2HG       LYS  41  -2.606  10.515  -4.018
  330   1HD   LYS  41          1HD       LYS  41  -0.930  11.971  -4.932
  331   2HD   LYS  41          2HD       LYS  41  -2.103  11.594  -6.176
  332   1HE   LYS  41          1HE       LYS  41  -1.455  13.944  -6.272
  333   2HE   LYS  41          2HE       LYS  41  -3.174  13.805  -5.889
  334   1HZ   LYS  41          1HZ       LYS  41  -2.658  14.186  -3.610
  335   2HZ   LYS  41          2HZ       LYS  41  -1.046  14.339  -3.926
  336   3HZ   LYS  41          3HZ       LYS  41  -2.137  15.427  -4.531
  337    H    ASN  42           H        ASN  42  -6.492  12.478  -4.625
  338    HA   ASN  42           HA       ASN  42  -9.176  11.468  -4.745
  339   1HB   ASN  42          1HB       ASN  42  -9.520  13.888  -5.759
  340   2HB   ASN  42          2HB       ASN  42  -9.064  13.680  -4.070
  341   1HD2  ASN  42          2HD2      ASN  42  -7.233  13.939  -7.212
  342   2HD2  ASN  42          1HD2      ASN  42  -6.032  15.021  -6.540
  343    H    GLY  43           H        GLY  43  -6.715  12.088  -7.198
  344   1HA   GLY  43          1HA       GLY  43  -7.814  10.261  -9.030
  345   2HA   GLY  43          2HA       GLY  43  -8.423  11.866  -9.485
  346    H    GLU  44           H        GLU  44  -5.271  10.895  -8.078
  347    HA   GLU  44           HA       GLU  44  -3.871  11.349 -10.638
  348   1HB   GLU  44          1HB       GLU  44  -3.864  13.530  -9.462
  349   2HB   GLU  44          2HB       GLU  44  -3.182  12.756  -8.025
  350   1HG   GLU  44          1HG       GLU  44  -1.161  12.107  -9.359
  351   2HG   GLU  44          2HG       GLU  44  -1.854  12.930 -10.767
  352    H    ARG  45           H        ARG  45  -2.282   9.846 -10.884
  353    HA   ARG  45           HA       ARG  45  -1.817   7.921  -8.679
  354   1HB   ARG  45          1HB       ARG  45  -2.522   7.129 -10.956
  355   2HB   ARG  45          2HB       ARG  45  -0.977   7.725 -11.592
  356   1HG   ARG  45          1HG       ARG  45   0.249   6.264 -10.004
  357   2HG   ARG  45          2HG       ARG  45  -1.280   5.703  -9.314
  358   1HD   ARG  45          1HD       ARG  45  -0.387   5.302 -12.198
  359   2HD   ARG  45          2HD       ARG  45  -0.219   4.126 -10.880
  360    HE   ARG  45           HE       ARG  45  -2.944   5.105 -11.352
  361   1HH1  ARG  45          1HH2      ARG  45  -0.589   2.530 -12.073
  362   2HH1  ARG  45          2HH2      ARG  45  -1.792   1.454 -12.723
  363   1HH2  ARG  45          1HH1      ARG  45  -4.503   3.651 -12.198
  364   2HH2  ARG  45          2HH1      ARG  45  -4.010   2.078 -12.770
  365    H    ILE  46           H        ILE  46   0.068   7.786  -7.587
  366    HA   ILE  46           HA       ILE  46   2.067   9.825  -7.987
  367    HB   ILE  46           HB       ILE  46   1.563   7.628  -5.931
  368   1HG1  ILE  46          1HG1      ILE  46   0.876  10.607  -5.973
  369   2HG1  ILE  46          2HG1      ILE  46  -0.285   9.275  -6.037
  370   1HG2  ILE  46          1HG2      ILE  46   3.908   8.353  -6.030
  371   2HG2  ILE  46          2HG2      ILE  46   3.377  10.051  -5.870
  372   3HG2  ILE  46          3HG2      ILE  46   3.111   8.881  -4.543
  373   1HD1  ILE  46          1HD1      ILE  46   1.397  10.088  -3.668
  374   2HD1  ILE  46          2HD1      ILE  46  -0.370  10.052  -3.879
  375   3HD1  ILE  46          3HD1      ILE  46   0.518   8.549  -3.741
  376    H    GLU  47           H        GLU  47   3.767   9.422  -9.253
  377    HA   GLU  47           HA       GLU  47   4.567   6.700 -10.026
  378   1HB   GLU  47          1HB       GLU  47   5.677   9.433 -10.774
  379   2HB   GLU  47          2HB       GLU  47   6.212   7.874 -11.431
  380   1HG   GLU  47          1HG       GLU  47   3.863   7.437 -12.213
  381   2HG   GLU  47          2HG       GLU  47   3.421   9.079 -11.715
  382    H    LYS  48           H        LYS  48   5.679   9.294  -7.848
  383    HA   LYS  48           HA       LYS  48   8.266   8.079  -7.361
  384   1HB   LYS  48          1HB       LYS  48   7.813  10.516  -7.332
  385   2HB   LYS  48          2HB       LYS  48   6.837  10.318  -5.869
  386   1HG   LYS  48          1HG       LYS  48   8.841   9.489  -4.649
  387   2HG   LYS  48          2HG       LYS  48   9.782   9.541  -6.152
  388   1HD   LYS  48          1HD       LYS  48   9.424  12.001  -6.274
  389   2HD   LYS  48          2HD       LYS  48   8.512  11.934  -4.749
  390   1HE   LYS  48          1HE       LYS  48  10.525  11.034  -3.595
  391   2HE   LYS  48          2HE       LYS  48  11.434  11.111  -5.117
  392   1HZ   LYS  48          1HZ       LYS  48  11.122  13.476  -5.117
  393   2HZ   LYS  48          2HZ       LYS  48  10.232  13.403  -3.729
  394   3HZ   LYS  48          3HZ       LYS  48  11.824  13.001  -3.699
  395    H    VAL  49           H        VAL  49   7.056   5.967  -6.963
  396    HA   VAL  49           HA       VAL  49   6.442   5.581  -4.065
  397    HB   VAL  49           HB       VAL  49   5.834   3.822  -6.468
  398   1HG1  VAL  49          1HG1      VAL  49   5.072   3.587  -3.519
  399   2HG1  VAL  49          2HG1      VAL  49   4.445   2.565  -4.829
  400   3HG1  VAL  49          3HG1      VAL  49   6.160   2.501  -4.407
  401   1HG2  VAL  49          1HG2      VAL  49   4.045   5.634  -4.790
  402   2HG2  VAL  49          2HG2      VAL  49   4.465   5.843  -6.498
  403   3HG2  VAL  49          3HG2      VAL  49   3.475   4.464  -6.003
  404    H    GLU  50           H        GLU  50   8.179   4.781  -2.934
  405    HA   GLU  50           HA       GLU  50  10.246   3.152  -4.348
  406   1HB   GLU  50          1HB       GLU  50  10.905   5.262  -3.038
  407   2HB   GLU  50          2HB       GLU  50  10.450   4.359  -1.585
  408   1HG   GLU  50          1HG       GLU  50  12.090   2.592  -2.196
  409   2HG   GLU  50          2HG       GLU  50  12.529   3.534  -3.634
  410    H    HIS  51           H        HIS  51  10.781   1.079  -3.234
  411    HA   HIS  51           HA       HIS  51   8.996   0.262  -1.097
  412   1HB   HIS  51          1HB       HIS  51   7.945  -1.588  -2.220
  413   2HB   HIS  51          2HB       HIS  51   7.627  -0.148  -3.182
  414    HD2  HIS  51           HD2      HIS  51   9.356   0.023  -5.556
  415    HE1  HIS  51           HE1      HIS  51   9.915  -4.171  -5.630
  416    HE2  HIS  51           HE2      HIS  51  10.179  -2.019  -6.976
  417    H    SER  52           H        SER  52   9.545  -1.687  -0.111
  418    HA   SER  52           HA       SER  52  12.394  -2.353  -0.193
  419   1HB   SER  52          1HB       SER  52  10.071  -3.516   1.403
  420   2HB   SER  52          2HB       SER  52  11.778  -3.956   1.599
  421    HG   SER  52           HG       SER  52  12.203  -1.769   2.081
  422    H    ASP  53           H        ASP  53  12.851  -3.261  -2.130
  423    HA   ASP  53           HA       ASP  53  11.984  -4.411  -4.115
  424   1HB   ASP  53          1HB       ASP  53  14.103  -5.850  -2.479
  425   2HB   ASP  53          2HB       ASP  53  13.768  -6.148  -4.192
  426    H    LEU  54           H        LEU  54  12.566  -7.071  -1.790
  427    HA   LEU  54           HA       LEU  54   9.819  -7.661  -1.618
  428   1HB   LEU  54          1HB       LEU  54  10.353  -8.749  -3.838
  429   2HB   LEU  54          2HB       LEU  54  11.527  -9.783  -3.038
  430    HG   LEU  54           HG       LEU  54   9.243 -10.794  -3.606
  431   1HD1  LEU  54          1HD1      LEU  54   9.982 -10.990  -0.683
  432   2HD1  LEU  54          2HD1      LEU  54   9.049 -12.118  -1.631
  433   3HD1  LEU  54          3HD1      LEU  54  10.754 -11.866  -2.020
  434   1HD2  LEU  54          1HD2      LEU  54   7.865  -8.854  -3.019
  435   2HD2  LEU  54          2HD2      LEU  54   7.344 -10.282  -2.115
  436   3HD2  LEU  54          3HD2      LEU  54   8.299  -9.081  -1.314
  437    H    SER  55           H        SER  55   9.471  -8.568   0.399
  438    HA   SER  55           HA       SER  55  11.736  -9.929   1.782
  439   1HB   SER  55          1HB       SER  55  11.629  -7.567   2.541
  440   2HB   SER  55          2HB       SER  55   9.924  -7.787   2.975
  441    HG   SER  55           HG       SER  55  12.162  -9.184   4.034
  442    H    PHE  56           H        PHE  56  10.699 -11.966   1.319
  443    HA   PHE  56           HA       PHE  56   7.966 -12.368   2.354
  444   1HB   PHE  56          1HB       PHE  56   8.031 -14.485   1.406
  445   2HB   PHE  56          2HB       PHE  56   8.622 -13.341   0.223
  446    HD1  PHE  56           HD1      PHE  56   9.088 -16.486   1.736
  447    HD2  PHE  56           HD2      PHE  56  11.226 -13.248  -0.133
  448    HE1  PHE  56           HE1      PHE  56  10.918 -18.042   1.130
  449    HE2  PHE  56           HE2      PHE  56  13.080 -14.789  -0.686
  450    HZ   PHE  56           HZ       PHE  56  12.926 -17.194  -0.074
  451    H    SER  57           H        SER  57  10.349 -11.705   4.130
  452    HA   SER  57           HA       SER  57  11.467 -12.326   5.949
  453   1HB   SER  57          1HB       SER  57  10.010 -12.942   7.842
  454   2HB   SER  57          2HB       SER  57   9.383 -11.638   6.842
  455    HG   SER  57           HG       SER  57   8.505 -14.291   7.057
  456    H    LYS  58           H        LYS  58  12.376 -14.209   4.330
  457    HA   LYS  58           HA       LYS  58  11.765 -16.453   3.398
  458   1HB   LYS  58          1HB       LYS  58  14.116 -15.633   4.242
  459   2HB   LYS  58          2HB       LYS  58  13.815 -16.638   5.666
  460   1HG   LYS  58          1HG       LYS  58  13.677 -18.644   4.166
  461   2HG   LYS  58          2HG       LYS  58  13.913 -17.587   2.759
  462   1HD   LYS  58          1HD       LYS  58  16.122 -16.895   3.655
  463   2HD   LYS  58          2HD       LYS  58  15.870 -17.928   5.078
  464   1HE   LYS  58          1HE       LYS  58  15.751 -19.925   3.606
  465   2HE   LYS  58          2HE       LYS  58  16.006 -18.892   2.184
  466   1HZ   LYS  58          1HZ       LYS  58  18.130 -18.281   3.094
  467   2HZ   LYS  58          2HZ       LYS  58  17.891 -19.246   4.409
  468   3HZ   LYS  58          3HZ       LYS  58  18.026 -19.915   2.910
  469    H    ASP  59           H        ASP  59   9.584 -16.118   4.945
  470    HA   ASP  59           HA       ASP  59   9.292 -18.722   6.322
  471   1HB   ASP  59          1HB       ASP  59   7.614 -16.205   6.194
  472   2HB   ASP  59          2HB       ASP  59   7.119 -17.670   7.041
  473    H    TRP  60           H        TRP  60   6.862 -19.478   6.041
  474    HA   TRP  60           HA       TRP  60   6.070 -19.824   3.221
  475   1HB   TRP  60          1HB       TRP  60   4.767 -20.648   5.841
  476   2HB   TRP  60          2HB       TRP  60   4.198 -21.070   4.227
  477    HD1  TRP  60           HD1      TRP  60   7.148 -21.761   6.595
  478    HE1  TRP  60           HE1      TRP  60   8.157 -24.073   6.034
  479    HE3  TRP  60           HE3      TRP  60   4.403 -22.880   2.417
  480    HZ2  TRP  60           HZ2      TRP  60   7.817 -26.109   4.059
  481    HZ3  TRP  60           HZ3      TRP  60   4.759 -25.022   1.233
  482    HH2  TRP  60           HH2      TRP  60   6.474 -26.633   2.028
  483    H    SER  61           H        SER  61   6.208 -17.300   3.261
  484    HA   SER  61           HA       SER  61   3.505 -16.224   3.319
  485   1HB   SER  61          1HB       SER  61   4.393 -15.874   5.693
  486   2HB   SER  61          2HB       SER  61   5.674 -14.866   4.991
  487    HG   SER  61           HG       SER  61   2.865 -14.474   4.761
  488    H    PHE  62           H        PHE  62   4.113 -13.569   2.860
  489    HA   PHE  62           HA       PHE  62   6.311 -13.097   1.124
  490   1HB   PHE  62          1HB       PHE  62   4.317 -14.565  -0.166
  491   2HB   PHE  62          2HB       PHE  62   3.898 -12.910  -0.577
  492    HD1  PHE  62           HD1      PHE  62   5.341 -11.620  -2.133
  493    HD2  PHE  62           HD2      PHE  62   6.556 -15.530  -0.729
  494    HE1  PHE  62           HE1      PHE  62   7.033 -11.745  -3.864
  495    HE2  PHE  62           HE2      PHE  62   8.294 -15.608  -2.403
  496    HZ   PHE  62           HZ       PHE  62   8.563 -13.721  -4.033
  497    H    TYR  63           H        TYR  63   6.596 -10.821   1.145
  498    HA   TYR  63           HA       TYR  63   4.265  -9.103   1.068
  499   1HB   TYR  63          1HB       TYR  63   4.661  -7.946   3.211
  500   2HB   TYR  63          2HB       TYR  63   4.238  -9.646   3.436
  501    HD1  TYR  63           HD1      TYR  63   7.047  -7.285   3.537
  502    HD2  TYR  63           HD2      TYR  63   5.473 -11.119   4.718
  503    HE1  TYR  63           HE1      TYR  63   8.685  -7.369   5.350
  504    HE2  TYR  63           HE2      TYR  63   7.039 -11.179   6.598
  505    HH   TYR  63           HH       TYR  63   8.590  -9.950   7.865
  506    H    LEU  64           H        LEU  64   4.960  -6.791   1.414
  507    HA   LEU  64           HA       LEU  64   7.674  -6.026   1.211
  508   1HB   LEU  64          1HB       LEU  64   7.806  -5.144  -1.025
  509   2HB   LEU  64          2HB       LEU  64   7.537  -6.878  -1.096
  510    HG   LEU  64           HG       LEU  64   5.545  -4.672  -1.647
  511   1HD1  LEU  64          1HD1      LEU  64   6.668  -6.853  -3.466
  512   2HD1  LEU  64          2HD1      LEU  64   5.459  -5.668  -3.936
  513   3HD1  LEU  64          3HD1      LEU  64   7.093  -5.121  -3.533
  514   1HD2  LEU  64          1HD2      LEU  64   5.207  -7.672  -1.485
  515   2HD2  LEU  64          2HD2      LEU  64   4.168  -6.415  -0.733
  516   3HD2  LEU  64          3HD2      LEU  64   4.122  -6.705  -2.477
  517    H    LEU  65           H        LEU  65   7.863  -3.732   1.359
  518    HA   LEU  65           HA       LEU  65   5.381  -2.392   2.300
  519   1HB   LEU  65          1HB       LEU  65   7.524  -3.016   3.723
  520   2HB   LEU  65          2HB       LEU  65   8.244  -1.622   2.917
  521    HG   LEU  65           HG       LEU  65   5.796  -1.730   4.739
  522   1HD1  LEU  65          1HD1      LEU  65   8.007  -1.821   5.798
  523   2HD1  LEU  65          2HD1      LEU  65   8.491  -0.344   4.933
  524   3HD1  LEU  65          3HD1      LEU  65   7.199  -0.276   6.146
  525   1HD2  LEU  65          1HD2      LEU  65   6.778   0.505   2.956
  526   2HD2  LEU  65          2HD2      LEU  65   5.126  -0.065   3.231
  527   3HD2  LEU  65          3HD2      LEU  65   5.949   0.851   4.489
  528    H    TYR  66           H        TYR  66   4.737  -0.561   1.166
  529    HA   TYR  66           HA       TYR  66   6.495   0.379  -1.043
  530   1HB   TYR  66          1HB       TYR  66   3.495   0.204  -1.354
  531   2HB   TYR  66          2HB       TYR  66   4.748   0.192  -2.569
  532    HD1  TYR  66           HD1      TYR  66   4.974  -1.910  -3.726
  533    HD2  TYR  66           HD2      TYR  66   3.470  -1.958   0.334
  534    HE1  TYR  66           HE1      TYR  66   3.783  -4.038  -4.143
  535    HE2  TYR  66           HE2      TYR  66   2.540  -4.163  -0.044
  536    HH   TYR  66           HH       TYR  66   1.698  -5.566  -1.670
  537    H    TYR  67           H        TYR  67   7.084   2.299  -0.157
  538    HA   TYR  67           HA       TYR  67   4.991   4.060   0.973
  539   1HB   TYR  67          1HB       TYR  67   7.053   5.132   2.064
  540   2HB   TYR  67          2HB       TYR  67   6.264   3.693   2.643
  541    HD1  TYR  67           HD1      TYR  67   8.844   4.146  -0.056
  542    HD2  TYR  67           HD2      TYR  67   7.848   2.380   3.728
  543    HE1  TYR  67           HE1      TYR  67  10.784   2.602  -0.263
  544    HE2  TYR  67           HE2      TYR  67   9.782   0.838   3.511
  545    HH   TYR  67           HH       TYR  67  11.323  -0.066   2.023
  546    H    THR  68           H        THR  68   4.929   6.165   0.613
  547    HA   THR  68           HA       THR  68   6.663   7.466  -1.469
  548    HB   THR  68           HB       THR  68   4.566   6.789  -2.390
  549    HG1  THR  68           HG1      THR  68   5.618   8.579  -3.191
  550   1HG2  THR  68          1HG2      THR  68   3.293   8.824  -0.493
  551   2HG2  THR  68          2HG2      THR  68   2.505   7.968  -1.822
  552   3HG2  THR  68          3HG2      THR  68   3.086   7.060  -0.402
  553    H    GLU  69           H        GLU  69   6.664   9.892  -1.261
  554    HA   GLU  69           HA       GLU  69   6.443  10.902   1.514
  555   1HB   GLU  69          1HB       GLU  69   7.590  12.903   0.512
  556   2HB   GLU  69          2HB       GLU  69   8.515  11.409   0.606
  557   1HG   GLU  69          1HG       GLU  69   8.290  10.967  -1.748
  558   2HG   GLU  69          2HG       GLU  69   7.128  12.289  -1.951
  559    H    PHE  70           H        PHE  70   4.037  10.716   1.434
  560    HA   PHE  70           HA       PHE  70   2.589  12.191  -0.547
  561   1HB   PHE  70          1HB       PHE  70   0.655  11.524   0.445
  562   2HB   PHE  70          2HB       PHE  70   1.727  10.200   0.863
  563    HD1  PHE  70           HD1      PHE  70  -0.696  12.615   2.042
  564    HD2  PHE  70           HD2      PHE  70   2.852  10.524   3.225
  565    HE1  PHE  70           HE1      PHE  70  -1.078  13.217   4.412
  566    HE2  PHE  70           HE2      PHE  70   2.071  10.563   5.611
  567    HZ   PHE  70           HZ       PHE  70   0.177  12.042   6.207
  568    H    THR  71           H        THR  71   1.851  14.183  -0.561
  569    HA   THR  71           HA       THR  71   2.408  16.035   1.701
  570    HB   THR  71           HB       THR  71   2.078  16.661  -1.213
  571    HG1  THR  71           HG1      THR  71   4.329  16.830  -1.084
  572   1HG2  THR  71          1HG2      THR  71   3.095  18.810  -0.482
  573   2HG2  THR  71          2HG2      THR  71   1.568  18.540   0.377
  574   3HG2  THR  71          3HG2      THR  71   3.107  18.232   1.196
  575    HA   PRO  72           HA       PRO  72  -2.233  15.838   1.503
  576   1HB   PRO  72          1HB       PRO  72  -2.839  16.493   4.072
  577   2HB   PRO  72          2HB       PRO  72  -2.214  14.899   3.591
  578   1HG   PRO  72          1HG       PRO  72  -0.638  17.253   4.680
  579   2HG   PRO  72          2HG       PRO  72  -0.585  15.564   5.264
  580   1HD   PRO  72          1HD       PRO  72   1.232  16.634   3.532
  581   2HD   PRO  72          2HD       PRO  72   0.741  14.925   3.403
  582    H    THR  73           H        THR  73  -2.064  17.649  -0.007
  583    HA   THR  73           HA       THR  73  -2.004  20.387   0.982
  584    HB   THR  73           HB       THR  73  -2.814  20.862  -1.358
  585    HG1  THR  73           HG1      THR  73  -2.614  19.132  -2.817
  586   1HG2  THR  73          1HG2      THR  73  -0.604  20.392  -2.368
  587   2HG2  THR  73          2HG2      THR  73  -0.428  21.011  -0.716
  588   3HG2  THR  73          3HG2      THR  73  -0.226  19.273  -1.043
  589    H    GLU  74           H        GLU  74  -3.499  20.507   2.543
  590    HA   GLU  74           HA       GLU  74  -5.454  20.897   3.566
  591   1HB   GLU  74          1HB       GLU  74  -6.330  21.679   0.753
  592   2HB   GLU  74          2HB       GLU  74  -7.225  22.003   2.243
  593   1HG   GLU  74          1HG       GLU  74  -6.028  23.980   1.687
  594   2HG   GLU  74          2HG       GLU  74  -5.288  23.283   3.133
  595    H    LYS  75           H        LYS  75  -7.208  19.832   0.686
  596    HA   LYS  75           HA       LYS  75  -8.594  17.779   2.340
  597   1HB   LYS  75          1HB       LYS  75  -9.316  19.401  -0.116
  598   2HB   LYS  75          2HB       LYS  75 -10.173  17.913   0.275
  599   1HG   LYS  75          1HG       LYS  75 -11.411  19.765   1.101
  600   2HG   LYS  75          2HG       LYS  75 -10.859  18.757   2.445
  601   1HD   LYS  75          1HD       LYS  75  -9.110  20.360   3.003
  602   2HD   LYS  75          2HD       LYS  75  -9.494  21.350   1.579
  603   1HE   LYS  75          1HE       LYS  75 -11.378  20.791   3.924
  604   2HE   LYS  75          2HE       LYS  75 -10.365  22.235   3.762
  605   1HZ   LYS  75          1HZ       LYS  75 -11.524  22.785   1.765
  606   2HZ   LYS  75          2HZ       LYS  75 -12.483  21.449   1.891
  607   3HZ   LYS  75          3HZ       LYS  75 -12.575  22.639   3.024
  608    H    ASP  76           H        ASP  76  -5.973  17.825   0.204
  609    HA   ASP  76           HA       ASP  76  -6.682  15.768  -1.597
  610   1HB   ASP  76          1HB       ASP  76  -4.839  17.446  -1.779
  611   2HB   ASP  76          2HB       ASP  76  -3.886  16.416  -0.699
  612    H    GLU  77           H        GLU  77  -7.421  13.842  -0.906
  613    HA   GLU  77           HA       GLU  77  -6.217  12.460   1.420
  614   1HB   GLU  77          1HB       GLU  77  -8.653  12.632   1.332
  615   2HB   GLU  77          2HB       GLU  77  -8.694  11.793  -0.229
  616   1HG   GLU  77          1HG       GLU  77  -7.817   9.749   0.789
  617   2HG   GLU  77          2HG       GLU  77  -7.485  10.600   2.310
  618    H    TYR  78           H        TYR  78  -5.357  10.375   1.205
  619    HA   TYR  78           HA       TYR  78  -4.377   9.578  -1.504
  620   1HB   TYR  78          1HB       TYR  78  -2.922   9.638   1.140
  621   2HB   TYR  78          2HB       TYR  78  -2.408   8.664  -0.215
  622    HD1  TYR  78           HD1      TYR  78  -0.768   9.598  -1.638
  623    HD2  TYR  78           HD2      TYR  78  -3.396  12.231   0.537
  624    HE1  TYR  78           HE1      TYR  78   0.445  11.598  -2.519
  625    HE2  TYR  78           HE2      TYR  78  -2.308  14.180  -0.512
  626    HH   TYR  78           HH       TYR  78   0.655  13.851  -2.518
  627    H    ALA  79           H        ALA  79  -4.242   7.339  -1.897
  628    HA   ALA  79           HA       ALA  79  -5.355   5.481   0.092
  629   1HB   ALA  79          1HB       ALA  79  -6.615   5.992  -2.652
  630   2HB   ALA  79          2HB       ALA  79  -7.061   4.675  -1.558
  631   3HB   ALA  79          3HB       ALA  79  -7.356   6.362  -1.082
  632    H    CYS  80           H        CYS  80  -5.081   3.260  -0.484
  633    HA   CYS  80           HA       CYS  80  -2.772   2.802  -2.326
  634   1HB   CYS  80          1HB       CYS  80  -3.732   1.253   0.096
  635   2HB   CYS  80          2HB       CYS  80  -2.365   0.813  -0.930
  636    H    ARG  81           H        ARG  81  -3.372   1.883  -4.189
  637    HA   ARG  81           HA       ARG  81  -5.778   0.201  -4.483
  638   1HB   ARG  81          1HB       ARG  81  -5.055   1.543  -6.346
  639   2HB   ARG  81          2HB       ARG  81  -3.445   0.802  -6.324
  640   1HG   ARG  81          1HG       ARG  81  -4.306  -1.350  -6.876
  641   2HG   ARG  81          2HG       ARG  81  -5.984  -0.849  -6.682
  642   1HD   ARG  81          1HD       ARG  81  -4.073   0.088  -8.847
  643   2HD   ARG  81          2HD       ARG  81  -5.397  -1.046  -9.039
  644    HE   ARG  81           HE       ARG  81  -7.019   0.621  -8.654
  645   1HH1  ARG  81          1HH2      ARG  81  -3.745   2.001  -9.161
  646   2HH1  ARG  81          2HH2      ARG  81  -4.373   3.609  -9.392
  647   1HH2  ARG  81          1HH1      ARG  81  -7.765   2.709  -9.040
  648   2HH2  ARG  81          2HH1      ARG  81  -6.654   4.004  -9.395
  649    H    VAL  82           H        VAL  82  -5.729  -2.133  -4.398
  650    HA   VAL  82           HA       VAL  82  -3.082  -3.408  -4.066
  651    HB   VAL  82           HB       VAL  82  -5.519  -4.003  -2.337
  652   1HG1  VAL  82          1HG1      VAL  82  -2.656  -5.013  -2.313
  653   2HG1  VAL  82          2HG1      VAL  82  -3.925  -5.462  -1.151
  654   3HG1  VAL  82          3HG1      VAL  82  -4.075  -5.945  -2.847
  655   1HG2  VAL  82          1HG2      VAL  82  -2.922  -2.541  -1.660
  656   2HG2  VAL  82          2HG2      VAL  82  -4.571  -1.875  -1.577
  657   3HG2  VAL  82          3HG2      VAL  82  -4.075  -3.150  -0.464
  658    H    ASN  83           H        ASN  83  -2.881  -4.707  -5.748
  659    HA   ASN  83           HA       ASN  83  -5.258  -6.222  -6.799
  660   1HB   ASN  83          1HB       ASN  83  -2.844  -5.116  -8.269
  661   2HB   ASN  83          2HB       ASN  83  -4.135  -6.087  -8.989
  662   1HD2  ASN  83          2HD2      ASN  83  -3.867  -4.133 -10.459
  663   2HD2  ASN  83          1HD2      ASN  83  -4.959  -2.796 -10.146
  664    H    HIS  84           H        HIS  84  -4.348  -7.903  -5.047
  665    HA   HIS  84           HA       HIS  84  -1.766  -9.165  -5.744
  666   1HB   HIS  84          1HB       HIS  84  -2.639  -9.246  -3.433
  667   2HB   HIS  84          2HB       HIS  84  -4.054 -10.123  -4.017
  668    HD2  HIS  84           HD2      HIS  84  -0.112 -10.784  -4.048
  669    HE1  HIS  84           HE1      HIS  84  -2.207 -14.446  -3.947
  670    HE2  HIS  84           HE2      HIS  84   0.125 -13.367  -3.973
  671    H    VAL  85           H        VAL  85  -1.747 -11.216  -6.945
  672    HA   VAL  85           HA       VAL  85  -3.509 -11.519  -9.049
  673    HB   VAL  85           HB       VAL  85  -1.342 -12.524  -9.010
  674   1HG1  VAL  85          1HG1      VAL  85  -1.137 -13.333  -6.720
  675   2HG1  VAL  85          2HG1      VAL  85  -2.432 -14.523  -6.982
  676   3HG1  VAL  85          3HG1      VAL  85  -0.895 -14.666  -7.854
  677   1HG2  VAL  85          1HG2      VAL  85  -3.453 -14.691  -9.355
  678   2HG2  VAL  85          2HG2      VAL  85  -3.088 -13.415 -10.540
  679   3HG2  VAL  85          3HG2      VAL  85  -1.853 -14.615 -10.118
  680    H    THR  86           H        THR  86  -3.902 -12.927  -5.785
  681    HA   THR  86           HA       THR  86  -6.148 -14.540  -6.659
  682    HB   THR  86           HB       THR  86  -4.375 -14.962  -4.772
  683    HG1  THR  86           HG1      THR  86  -5.827 -16.430  -5.536
  684   1HG2  THR  86          1HG2      THR  86  -6.766 -14.070  -3.137
  685   2HG2  THR  86          2HG2      THR  86  -5.219 -14.733  -2.569
  686   3HG2  THR  86          3HG2      THR  86  -5.280 -13.104  -3.282
  687    H    LEU  87           H        LEU  87  -5.846 -11.226  -5.444
  688    HA   LEU  87           HA       LEU  87  -8.611 -10.936  -4.629
  689   1HB   LEU  87          1HB       LEU  87  -6.345  -9.121  -5.422
  690   2HB   LEU  87          2HB       LEU  87  -7.968  -8.519  -5.661
  691    HG   LEU  87           HG       LEU  87  -8.581  -8.706  -3.420
  692   1HD1  LEU  87          1HD1      LEU  87  -7.446 -10.799  -2.714
  693   2HD1  LEU  87          2HD1      LEU  87  -5.875  -9.996  -2.856
  694   3HD1  LEU  87          3HD1      LEU  87  -7.045  -9.459  -1.635
  695   1HD2  LEU  87          1HD2      LEU  87  -7.230  -6.746  -4.119
  696   2HD2  LEU  87          2HD2      LEU  87  -6.954  -7.121  -2.404
  697   3HD2  LEU  87          3HD2      LEU  87  -5.746  -7.575  -3.617
  698    H    SER  88           H        SER  88  -6.853 -10.415  -7.696
  699    HA   SER  88           HA       SER  88  -7.484 -10.463  -9.840
  700   1HB   SER  88          1HB       SER  88 -10.296 -11.351  -9.091
  701   2HB   SER  88          2HB       SER  88  -9.477 -11.473 -10.646
  702    HG   SER  88           HG       SER  88  -8.690 -12.779  -8.251
  703    H    GLN  89           H        GLN  89  -9.850  -8.953  -7.627
  704    HA   GLN  89           HA       GLN  89 -10.427  -6.828  -9.616
  705   1HB   GLN  89          1HB       GLN  89 -11.782  -7.589  -7.013
  706   2HB   GLN  89          2HB       GLN  89 -12.214  -6.194  -8.015
  707   1HG   GLN  89          1HG       GLN  89 -12.689  -7.726  -9.928
  708   2HG   GLN  89          2HG       GLN  89 -12.313  -9.115  -8.895
  709   1HE2  GLN  89          2HE2      GLN  89 -14.458  -6.215  -9.078
  710   2HE2  GLN  89          1HE2      GLN  89 -15.820  -6.976  -8.283
  711    HA   PRO  90           HA       PRO  90  -7.528  -4.422  -7.300
  712   1HB   PRO  90          1HB       PRO  90  -8.085  -1.858  -8.116
  713   2HB   PRO  90          2HB       PRO  90  -7.427  -3.093  -9.225
  714   1HG   PRO  90          1HG       PRO  90 -10.334  -2.324  -8.906
  715   2HG   PRO  90          2HG       PRO  90  -9.384  -2.453 -10.415
  716   1HD   PRO  90          1HD       PRO  90 -10.947  -4.502  -9.533
  717   2HD   PRO  90          2HD       PRO  90  -9.364  -4.820 -10.306
  718    H    LYS  91           H        LYS  91  -7.911  -4.578  -5.126
  719    HA   LYS  91           HA       LYS  91 -10.380  -3.487  -3.962
  720   1HB   LYS  91          1HB       LYS  91  -9.478  -5.767  -3.370
  721   2HB   LYS  91          2HB       LYS  91  -8.081  -4.970  -2.641
  722   1HG   LYS  91          1HG       LYS  91  -9.532  -5.439  -0.851
  723   2HG   LYS  91          2HG       LYS  91  -9.734  -3.705  -1.133
  724   1HD   LYS  91          1HD       LYS  91 -11.827  -4.226  -2.460
  725   2HD   LYS  91          2HD       LYS  91 -11.574  -5.947  -2.104
  726   1HE   LYS  91          1HE       LYS  91 -11.731  -5.418   0.343
  727   2HE   LYS  91          2HE       LYS  91 -12.043  -3.720  -0.068
  728   1HZ   LYS  91          1HZ       LYS  91 -14.005  -4.440  -1.239
  729   2HZ   LYS  91          2HZ       LYS  91 -13.714  -6.011  -0.835
  730   3HZ   LYS  91          3HZ       LYS  91 -14.057  -4.908   0.340
  731    H    ILE  92           H        ILE  92 -10.180  -1.241  -3.994
  732    HA   ILE  92           HA       ILE  92  -7.702   0.028  -3.227
  733    HB   ILE  92           HB       ILE  92 -10.378   1.421  -3.409
  734   1HG1  ILE  92          1HG1      ILE  92 -10.345   0.193  -5.467
  735   2HG1  ILE  92          2HG1      ILE  92  -9.933   1.872  -5.789
  736   1HG2  ILE  92          1HG2      ILE  92  -7.483   2.248  -3.908
  737   2HG2  ILE  92          2HG2      ILE  92  -8.904   3.289  -4.139
  738   3HG2  ILE  92          3HG2      ILE  92  -8.492   2.689  -2.522
  739   1HD1  ILE  92          1HD1      ILE  92  -7.533   1.266  -5.963
  740   2HD1  ILE  92          2HD1      ILE  92  -7.946  -0.432  -5.619
  741   3HD1  ILE  92          3HD1      ILE  92  -8.539   0.346  -7.093
  742    H    VAL  93           H        VAL  93  -7.065   0.404  -1.175
  743    HA   VAL  93           HA       VAL  93  -9.083   0.584   1.033
  744    HB   VAL  93           HB       VAL  93  -6.238  -0.508   1.064
  745   1HG1  VAL  93          1HG1      VAL  93  -6.650   0.769   3.129
  746   2HG1  VAL  93          2HG1      VAL  93  -8.210  -0.053   3.351
  747   3HG1  VAL  93          3HG1      VAL  93  -6.689  -0.961   3.474
  748   1HG2  VAL  93          1HG2      VAL  93  -8.961  -1.801   1.559
  749   2HG2  VAL  93          2HG2      VAL  93  -7.857  -2.145   0.209
  750   3HG2  VAL  93          3HG2      VAL  93  -7.401  -2.582   1.863
  751    H    LYS  94           H        LYS  94  -9.308   2.714   1.522
  752    HA   LYS  94           HA       LYS  94  -7.339   4.631   0.747
  753   1HB   LYS  94          1HB       LYS  94  -8.713   6.271   1.484
  754   2HB   LYS  94          2HB       LYS  94  -9.876   5.005   1.078
  755   1HG   LYS  94          1HG       LYS  94 -10.064   4.438   3.507
  756   2HG   LYS  94          2HG       LYS  94  -8.834   5.652   3.881
  757   1HD   LYS  94          1HD       LYS  94 -10.435   7.332   2.625
  758   2HD   LYS  94          2HD       LYS  94 -11.656   6.095   2.948
  759   1HE   LYS  94          1HE       LYS  94 -11.745   7.623   4.782
  760   2HE   LYS  94          2HE       LYS  94 -10.897   6.199   5.412
  761   1HZ   LYS  94          1HZ       LYS  94  -8.821   7.403   5.008
  762   2HZ   LYS  94          2HZ       LYS  94  -9.667   8.702   4.460
  763   3HZ   LYS  94          3HZ       LYS  94  -9.807   8.228   6.035
  764    H    TRP  95           H        TRP  95  -6.116   6.058   2.159
  765    HA   TRP  95           HA       TRP  95  -5.004   4.740   4.559
  766   1HB   TRP  95          1HB       TRP  95  -3.420   5.907   3.158
  767   2HB   TRP  95          2HB       TRP  95  -4.479   7.295   3.047
  768    HD1  TRP  95           HD1      TRP  95  -3.080   5.607   6.253
  769    HE1  TRP  95           HE1      TRP  95  -2.127   7.471   7.759
  770    HE3  TRP  95           HE3      TRP  95  -3.705   9.558   3.104
  771    HZ2  TRP  95           HZ2      TRP  95  -1.991  10.381   7.702
  772    HZ3  TRP  95           HZ3      TRP  95  -3.001  11.826   3.785
  773    HH2  TRP  95           HH2      TRP  95  -2.294  12.263   6.118
  774    H    ASP  96           H        ASP  96  -5.727   5.158   6.572
  775    HA   ASP  96           HA       ASP  96  -6.789   7.863   7.133
  776   1HB   ASP  96          1HB       ASP  96  -8.662   6.205   7.327
  777   2HB   ASP  96          2HB       ASP  96  -7.702   5.302   8.503
  778    H    ARG  97           H        ARG  97  -5.889   8.727   8.962
  779    HA   ARG  97           HA       ARG  97  -3.412   8.961   9.404
  780   1HB   ARG  97          1HB       ARG  97  -3.767   9.252  11.903
  781   2HB   ARG  97          2HB       ARG  97  -4.741  10.203  10.795
  782   1HG   ARG  97          1HG       ARG  97  -6.122   7.686  11.460
  783   2HG   ARG  97          2HG       ARG  97  -5.681   8.591  12.911
  784   1HD   ARG  97          1HD       ARG  97  -6.854  10.561  12.116
  785   2HD   ARG  97          2HD       ARG  97  -7.102   9.815  10.520
  786    HE   ARG  97           HE       ARG  97  -8.201   8.093  12.464
  787   1HH1  ARG  97          1HH2      ARG  97  -8.861  11.215  10.923
  788   2HH1  ARG  97          2HH2      ARG  97 -10.595  11.024  10.995
  789   1HH2  ARG  97          1HH1      ARG  97 -10.447   7.840  12.537
  790   2HH2  ARG  97          2HH1      ARG  97 -11.508   9.094  11.943
  791    H    ASP  98           H        ASP  98  -4.522   6.752  11.926
  792    HA   ASP  98           HA       ASP  98  -1.953   5.505  12.191
  793   1HB   ASP  98          1HB       ASP  98  -3.474   5.833  14.085
  794   2HB   ASP  98          2HB       ASP  98  -4.690   4.790  13.331
  795    H    MET  99           H        MET  99  -5.169   4.281  11.067
  796    HA   MET  99           HA       MET  99  -3.886   2.741   8.990
  797   1HB   MET  99          1HB       MET  99  -3.658   1.134  10.804
  798   2HB   MET  99          2HB       MET  99  -5.368   1.320  11.237
  799   1HG   MET  99          1HG       MET  99  -6.073   0.311   9.148
  800   2HG   MET  99          2HG       MET  99  -4.426   0.347   8.508
  801   1HE   MET  99          1HE       MET  99  -6.827  -1.206  11.150
  802   2HE   MET  99          2HE       MET  99  -5.860  -2.534  11.830
  803   3HE   MET  99          3HE       MET  99  -5.438  -0.852  12.210
  Start of MODEL    5
    1   1H    MET   0          1H        MET   0   0.996 -22.799   1.560
    2   2H    MET   0          2H        MET   0   0.484 -21.438   0.789
    3   3H    MET   0          3H        MET   0  -0.591 -22.359   1.632
    4    HA   MET   0           HA       MET   0   0.873 -23.123  -0.770
    5   1HB   MET   0          1HB       MET   0   0.516 -24.967   0.847
    6   2HB   MET   0          2HB       MET   0  -1.230 -24.763   0.721
    7   1HG   MET   0          1HG       MET   0   0.637 -25.364  -1.618
    8   2HG   MET   0          2HG       MET   0  -0.202 -26.595  -0.676
    9   1HE   MET   0          1HE       MET   0  -0.919 -27.582  -3.041
   10   2HE   MET   0          2HE       MET   0  -1.901 -26.682  -4.220
   11   3HE   MET   0          3HE       MET   0  -0.218 -26.196  -3.912
   12    H    ILE   1           H        ILE   1  -2.555 -23.197   0.344
   13    HA   ILE   1           HA       ILE   1  -3.637 -22.420  -2.136
   14    HB   ILE   1           HB       ILE   1  -5.714 -22.128  -1.032
   15   1HG1  ILE   1          1HG1      ILE   1  -5.201 -20.815   0.908
   16   2HG1  ILE   1          2HG1      ILE   1  -6.064 -22.276   1.365
   17   1HG2  ILE   1          1HG2      ILE   1  -4.223 -24.502   0.145
   18   2HG2  ILE   1          2HG2      ILE   1  -5.982 -24.305   0.044
   19   3HG2  ILE   1          3HG2      ILE   1  -5.015 -24.397  -1.436
   20   1HD1  ILE   1          1HD1      ILE   1  -3.863 -23.303   2.057
   21   2HD1  ILE   1          2HD1      ILE   1  -3.101 -21.718   1.761
   22   3HD1  ILE   1          3HD1      ILE   1  -4.359 -21.878   2.988
   23    H    GLN   2           H        GLN   2  -4.765 -20.442  -2.698
   24    HA   GLN   2           HA       GLN   2  -3.234 -18.149  -2.602
   25   1HB   GLN   2          1HB       GLN   2  -5.086 -16.966  -3.501
   26   2HB   GLN   2          2HB       GLN   2  -4.948 -18.540  -4.266
   27   1HG   GLN   2          1HG       GLN   2  -7.074 -17.607  -2.295
   28   2HG   GLN   2          2HG       GLN   2  -7.267 -18.038  -3.982
   29   1HE2  GLN   2          2HE2      GLN   2  -7.794 -19.186  -0.902
   30   2HE2  GLN   2          1HE2      GLN   2  -7.845 -20.900  -1.262
   31    H    ARG   3           H        ARG   3  -2.579 -17.024  -0.886
   32    HA   ARG   3           HA       ARG   3  -4.297 -16.657   1.487
   33   1HB   ARG   3          1HB       ARG   3  -1.434 -15.961   0.836
   34   2HB   ARG   3          2HB       ARG   3  -2.271 -15.382   2.290
   35   1HG   ARG   3          1HG       ARG   3  -2.744 -17.755   2.928
   36   2HG   ARG   3          2HG       ARG   3  -1.870 -18.298   1.487
   37   1HD   ARG   3          1HD       ARG   3  -0.439 -18.483   3.430
   38   2HD   ARG   3          2HD       ARG   3   0.202 -17.240   2.340
   39    HE   ARG   3           HE       ARG   3  -1.462 -15.909   4.158
   40   1HH1  ARG   3          1HH2      ARG   3   1.516 -17.851   4.360
   41   2HH1  ARG   3          2HH2      ARG   3   2.150 -16.956   5.709
   42   1HH2  ARG   3          1HH1      ARG   3  -0.596 -14.729   5.910
   43   2HH2  ARG   3          2HH1      ARG   3   0.940 -15.182   6.604
   44    H    THR   4           H        THR   4  -5.424 -14.818   1.919
   45    HA   THR   4           HA       THR   4  -5.731 -12.793  -0.086
   46    HB   THR   4           HB       THR   4  -7.229 -11.845   1.754
   47    HG1  THR   4           HG1      THR   4  -6.022 -12.863   3.459
   48   1HG2  THR   4          1HG2      THR   4  -7.689 -14.766   0.991
   49   2HG2  THR   4          2HG2      THR   4  -8.920 -13.621   1.558
   50   3HG2  THR   4          3HG2      THR   4  -8.119 -13.355  -0.002
   51    HA   PRO   5           HA       PRO   5  -2.538 -10.143   1.491
   52   1HB   PRO   5          1HB       PRO   5  -3.340  -7.670   0.576
   53   2HB   PRO   5          2HB       PRO   5  -2.722  -8.962  -0.494
   54   1HG   PRO   5          1HG       PRO   5  -5.594  -8.229   0.096
   55   2HG   PRO   5          2HG       PRO   5  -4.828  -8.534  -1.490
   56   1HD   PRO   5          1HD       PRO   5  -6.257 -10.458  -0.145
   57   2HD   PRO   5          2HD       PRO   5  -4.813 -10.874  -1.120
   58    H    LYS   6           H        LYS   6  -2.271  -9.716   3.610
   59    HA   LYS   6           HA       LYS   6  -4.356  -8.400   5.221
   60   1HB   LYS   6          1HB       LYS   6  -2.930 -10.284   6.086
   61   2HB   LYS   6          2HB       LYS   6  -1.531  -9.198   5.983
   62   1HG   LYS   6          1HG       LYS   6  -2.911  -7.543   7.381
   63   2HG   LYS   6          2HG       LYS   6  -4.068  -8.859   7.630
   64   1HD   LYS   6          1HD       LYS   6  -2.366 -10.227   8.730
   65   2HD   LYS   6          2HD       LYS   6  -1.093  -9.078   8.286
   66   1HE   LYS   6          1HE       LYS   6  -1.689  -8.828  10.647
   67   2HE   LYS   6          2HE       LYS   6  -2.040  -7.354   9.731
   68   1HZ   LYS   6          1HZ       LYS   6  -4.336  -8.024   9.665
   69   2HZ   LYS   6          2HZ       LYS   6  -4.003  -9.393  10.525
   70   3HZ   LYS   6          3HZ       LYS   6  -3.804  -7.911  11.219
   71    H    ILE   7           H        ILE   7  -4.572  -6.312   4.495
   72    HA   ILE   7           HA       ILE   7  -2.248  -4.623   3.920
   73    HB   ILE   7           HB       ILE   7  -3.872  -2.888   3.483
   74   1HG1  ILE   7          1HG1      ILE   7  -6.025  -4.890   4.307
   75   2HG1  ILE   7          2HG1      ILE   7  -5.620  -3.366   5.115
   76   1HG2  ILE   7          1HG2      ILE   7  -4.643  -5.500   2.123
   77   2HG2  ILE   7          2HG2      ILE   7  -4.846  -3.857   1.478
   78   3HG2  ILE   7          3HG2      ILE   7  -3.233  -4.490   1.729
   79   1HD1  ILE   7          1HD1      ILE   7  -6.235  -2.141   3.014
   80   2HD1  ILE   7          2HD1      ILE   7  -6.880  -3.680   2.381
   81   3HD1  ILE   7          3HD1      ILE   7  -7.570  -2.969   3.844
   82    H    GLN   8           H        GLN   8  -1.218  -3.269   5.404
   83    HA   GLN   8           HA       GLN   8  -2.797  -2.251   7.667
   84   1HB   GLN   8          1HB       GLN   8  -0.572  -2.242   8.850
   85   2HB   GLN   8          2HB       GLN   8  -1.495  -3.746   8.866
   86   1HG   GLN   8          1HG       GLN   8   0.606  -3.385   6.748
   87   2HG   GLN   8          2HG       GLN   8   1.153  -3.610   8.408
   88   1HE2  GLN   8          2HE2      GLN   8   2.208  -5.526   7.472
   89   2HE2  GLN   8          1HE2      GLN   8   1.289  -7.005   7.313
   90    H    VAL   9           H        VAL   9  -3.237  -0.517   6.310
   91    HA   VAL   9           HA       VAL   9  -1.069   0.948   4.994
   92    HB   VAL   9           HB       VAL   9  -4.059   1.478   5.173
   93   1HG1  VAL   9          1HG1      VAL   9  -1.840   2.740   3.513
   94   2HG1  VAL   9          2HG1      VAL   9  -3.589   2.961   3.209
   95   3HG1  VAL   9          3HG1      VAL   9  -2.864   3.538   4.707
   96   1HG2  VAL   9          1HG2      VAL   9  -3.635  -0.611   3.989
   97   2HG2  VAL   9          2HG2      VAL   9  -4.049   0.639   2.813
   98   3HG2  VAL   9          3HG2      VAL   9  -2.353   0.146   3.021
   99    H    TYR  10           H        TYR  10   0.199   1.967   6.472
  100    HA   TYR  10           HA       TYR  10  -1.128   3.709   8.541
  101   1HB   TYR  10          1HB       TYR  10   0.785   3.382   9.917
  102   2HB   TYR  10          2HB       TYR  10  -0.034   1.882   9.529
  103    HD1  TYR  10           HD1      TYR  10   3.013   3.940   8.863
  104    HD2  TYR  10           HD2      TYR  10   1.144   0.070   8.542
  105    HE1  TYR  10           HE1      TYR  10   5.192   2.928   8.250
  106    HE2  TYR  10           HE2      TYR  10   3.315  -0.932   7.924
  107    HH   TYR  10           HH       TYR  10   6.324   1.022   7.709
  108    H    SER  11           H        SER  11  -0.150   5.724   9.044
  109    HA   SER  11           HA       SER  11   1.698   6.868   7.025
  110   1HB   SER  11          1HB       SER  11   1.023   9.055   8.137
  111   2HB   SER  11          2HB       SER  11  -0.137   8.242   7.085
  112    HG   SER  11           HG       SER  11  -0.048   8.022   9.921
  113    H    ARG  12           H        ARG  12   3.844   7.032   7.750
  114    HA   ARG  12           HA       ARG  12   4.601   6.264  10.430
  115   1HB   ARG  12          1HB       ARG  12   6.169   7.697   8.250
  116   2HB   ARG  12          2HB       ARG  12   6.851   7.133   9.773
  117   1HG   ARG  12          1HG       ARG  12   6.483   4.831   9.201
  118   2HG   ARG  12          2HG       ARG  12   5.561   5.278   7.744
  119   1HD   ARG  12          1HD       ARG  12   7.519   6.378   6.784
  120   2HD   ARG  12          2HD       ARG  12   8.469   6.078   8.251
  121    HE   ARG  12           HE       ARG  12   7.743   3.564   7.492
  122   1HH1  ARG  12          1HH2      ARG  12   9.272   6.253   5.715
  123   2HH1  ARG  12          2HH2      ARG  12  10.250   5.202   4.730
  124   1HH2  ARG  12          1HH1      ARG  12   9.080   2.210   6.199
  125   2HH2  ARG  12          2HH1      ARG  12  10.140   2.909   5.001
  126    H    HIS  13           H        HIS  13   4.973   9.378   8.702
  127    HA   HIS  13           HA       HIS  13   5.715  10.786  11.099
  128   1HB   HIS  13          1HB       HIS  13   5.295  11.498   8.179
  129   2HB   HIS  13          2HB       HIS  13   5.707  12.719   9.384
  130    HD2  HIS  13           HD2      HIS  13   8.134  13.219   8.205
  131    HE1  HIS  13           HE1      HIS  13   9.818   9.433   9.062
  132    HE2  HIS  13           HE2      HIS  13  10.337  11.805   8.263
  133    HA   PRO  14           HA       PRO  14   1.765  12.508  12.197
  134   1HB   PRO  14          1HB       PRO  14   2.333  15.010  13.127
  135   2HB   PRO  14          2HB       PRO  14   2.843  13.516  13.961
  136   1HG   PRO  14          1HG       PRO  14   4.495  15.231  12.091
  137   2HG   PRO  14          2HG       PRO  14   4.953  14.601  13.698
  138   1HD   PRO  14          1HD       PRO  14   5.694  13.374  11.403
  139   2HD   PRO  14          2HD       PRO  14   5.273  12.410  12.830
  140    H    ALA  15           H        ALA  15   0.523  12.648  10.388
  141    HA   ALA  15           HA       ALA  15   0.901  14.005   8.031
  142   1HB   ALA  15          1HB       ALA  15  -1.755  13.448   9.396
  143   2HB   ALA  15          2HB       ALA  15  -1.487  13.706   7.657
  144   3HB   ALA  15          3HB       ALA  15  -0.808  12.276   8.463
  145    H    GLU  16           H        GLU  16   1.050  16.068   7.461
  146    HA   GLU  16           HA       GLU  16  -0.445  18.176   8.913
  147   1HB   GLU  16          1HB       GLU  16   1.586  19.562   8.996
  148   2HB   GLU  16          2HB       GLU  16   1.696  18.113  10.003
  149   1HG   GLU  16          1HG       GLU  16   3.089  16.999   8.267
  150   2HG   GLU  16          2HG       GLU  16   3.005  18.460   7.271
  151    H    ASN  17           H        ASN  17  -1.319  19.645   7.589
  152    HA   ASN  17           HA       ASN  17  -1.183  19.142   4.738
  153   1HB   ASN  17          1HB       ASN  17  -3.051  20.740   4.660
  154   2HB   ASN  17          2HB       ASN  17  -3.334  19.363   5.716
  155   1HD2  ASN  17          2HD2      ASN  17  -3.316  19.686   8.058
  156   2HD2  ASN  17          1HD2      ASN  17  -3.603  21.283   8.713
  157    H    GLY  18           H        GLY  18   1.130  19.747   4.682
  158   1HA   GLY  18          1HA       GLY  18   1.420  22.228   3.309
  159   2HA   GLY  18          2HA       GLY  18   2.040  22.409   4.962
  160    H    LYS  19           H        LYS  19   3.165  19.920   5.460
  161    HA   LYS  19           HA       LYS  19   5.571  20.061   3.686
  162   1HB   LYS  19          1HB       LYS  19   5.709  20.783   6.041
  163   2HB   LYS  19          2HB       LYS  19   5.421  19.071   6.473
  164   1HG   LYS  19          1HG       LYS  19   7.435  18.377   5.270
  165   2HG   LYS  19          2HG       LYS  19   7.617  20.001   4.576
  166   1HD   LYS  19          1HD       LYS  19   9.172  19.798   6.277
  167   2HD   LYS  19          2HD       LYS  19   7.931  20.926   6.855
  168   1HE   LYS  19          1HE       LYS  19   6.880  19.065   8.175
  169   2HE   LYS  19          2HE       LYS  19   8.160  17.967   7.633
  170   1HZ   LYS  19          1HZ       LYS  19   8.527  20.414   9.214
  171   2HZ   LYS  19          2HZ       LYS  19   8.533  18.878   9.808
  172   3HZ   LYS  19          3HZ       LYS  19   9.723  19.364   8.771
  173    H    SER  20           H        SER  20   6.150  18.328   2.699
  174    HA   SER  20           HA       SER  20   4.996  15.977   2.256
  175   1HB   SER  20          1HB       SER  20   7.194  14.941   1.757
  176   2HB   SER  20          2HB       SER  20   6.798  16.478   0.993
  177    HG   SER  20           HG       SER  20   8.104  17.497   2.625
  178    H    ASN  21           H        ASN  21   4.552  14.166   3.342
  179    HA   ASN  21           HA       ASN  21   5.622  13.707   6.093
  180   1HB   ASN  21          1HB       ASN  21   3.187  14.447   5.541
  181   2HB   ASN  21          2HB       ASN  21   2.937  12.770   5.090
  182   1HD2  ASN  21          2HD2      ASN  21   2.267  11.479   6.818
  183   2HD2  ASN  21          1HD2      ASN  21   2.520  11.851   8.502
  184    H    PHE  22           H        PHE  22   4.010  10.985   5.847
  185    HA   PHE  22           HA       PHE  22   5.496   9.525   3.828
  186   1HB   PHE  22          1HB       PHE  22   6.434   9.527   6.631
  187   2HB   PHE  22          2HB       PHE  22   6.063   7.924   6.004
  188    HD1  PHE  22           HD1      PHE  22   7.033   7.132   3.808
  189    HD2  PHE  22           HD2      PHE  22   8.519  10.568   5.947
  190    HE1  PHE  22           HE1      PHE  22   9.122   7.078   2.464
  191    HE2  PHE  22           HE2      PHE  22  10.625  10.467   4.639
  192    HZ   PHE  22           HZ       PHE  22  10.858   8.815   2.808
  193    H    LEU  23           H        LEU  23   3.976   8.347   2.965
  194    HA   LEU  23           HA       LEU  23   1.940   6.986   4.650
  195   1HB   LEU  23          1HB       LEU  23   0.992   8.512   3.026
  196   2HB   LEU  23          2HB       LEU  23   1.932   7.777   1.723
  197    HG   LEU  23           HG       LEU  23   0.567   5.688   2.065
  198   1HD1  LEU  23          1HD1      LEU  23  -0.811   7.459   4.136
  199   2HD1  LEU  23          2HD1      LEU  23  -1.431   5.900   3.524
  200   3HD1  LEU  23          3HD1      LEU  23   0.044   5.945   4.481
  201   1HD2  LEU  23          1HD2      LEU  23  -0.138   7.493   0.476
  202   2HD2  LEU  23          2HD2      LEU  23  -1.543   6.684   1.203
  203   3HD2  LEU  23          3HD2      LEU  23  -1.029   8.282   1.786
  204    H    ASN  24           H        ASN  24   1.877   4.786   4.653
  205    HA   ASN  24           HA       ASN  24   3.772   3.279   2.914
  206   1HB   ASN  24          1HB       ASN  24   3.444   3.317   5.909
  207   2HB   ASN  24          2HB       ASN  24   4.189   1.960   5.054
  208   1HD2  ASN  24          2HD2      ASN  24   6.329   2.065   4.575
  209   2HD2  ASN  24          1HD2      ASN  24   7.297   3.524   4.591
  210    H    CYS  25           H        CYS  25   2.376   2.230   1.625
  211    HA   CYS  25           HA       CYS  25   0.101   0.752   2.769
  212   1HB   CYS  25          1HB       CYS  25   1.277   0.646  -0.041
  213   2HB   CYS  25          2HB       CYS  25  -0.277  -0.002   0.478
  214    H    TYR  26           H        TYR  26   1.309  -0.559   4.274
  215    HA   TYR  26           HA       TYR  26   3.280  -2.502   3.212
  216   1HB   TYR  26          1HB       TYR  26   3.494  -1.304   5.385
  217   2HB   TYR  26          2HB       TYR  26   2.112  -2.137   5.997
  218    HD1  TYR  26           HD1      TYR  26   5.179  -1.984   6.831
  219    HD2  TYR  26           HD2      TYR  26   2.707  -5.029   5.029
  220    HE1  TYR  26           HE1      TYR  26   6.613  -3.743   7.794
  221    HE2  TYR  26           HE2      TYR  26   4.221  -6.754   5.886
  222    HH   TYR  26           HH       TYR  26   6.120  -7.217   7.101
  223    H    VAL  27           H        VAL  27   2.480  -4.390   2.288
  224    HA   VAL  27           HA       VAL  27  -0.169  -5.413   3.227
  225    HB   VAL  27           HB       VAL  27   0.978  -5.745   0.416
  226   1HG1  VAL  27          1HG1      VAL  27  -1.809  -6.185   1.589
  227   2HG1  VAL  27          2HG1      VAL  27  -1.311  -6.504  -0.091
  228   3HG1  VAL  27          3HG1      VAL  27  -0.663  -7.466   1.243
  229   1HG2  VAL  27          1HG2      VAL  27  -1.032  -3.729   1.441
  230   2HG2  VAL  27          2HG2      VAL  27   0.510  -3.409   0.606
  231   3HG2  VAL  27          3HG2      VAL  27  -0.827  -4.167  -0.278
  232    H    SER  28           H        SER  28  -0.084  -7.730   3.683
  233    HA   SER  28           HA       SER  28   2.222  -9.105   2.704
  234   1HB   SER  28          1HB       SER  28   3.617  -8.645   4.490
  235   2HB   SER  28          2HB       SER  28   2.338  -7.867   5.351
  236    HG   SER  28           HG       SER  28   2.920 -10.606   5.438
  237    H    GLY  29           H        GLY  29   2.509 -11.327   3.345
  238   1HA   GLY  29          1HA       GLY  29   1.748 -13.349   4.207
  239   2HA   GLY  29          2HA       GLY  29   0.107 -12.714   4.368
  240    H    PHE  30           H        PHE  30   0.567 -11.604   1.463
  241    HA   PHE  30           HA       PHE  30  -0.937 -13.847   0.346
  242   1HB   PHE  30          1HB       PHE  30  -1.668 -12.336  -1.342
  243   2HB   PHE  30          2HB       PHE  30  -1.896 -11.673   0.249
  244    HD1  PHE  30           HD1      PHE  30  -0.072 -11.468  -2.907
  245    HD2  PHE  30           HD2      PHE  30  -0.356  -9.716   1.016
  246    HE1  PHE  30           HE1      PHE  30   1.823 -10.031  -3.430
  247    HE2  PHE  30           HE2      PHE  30   1.550  -8.244   0.467
  248    HZ   PHE  30           HZ       PHE  30   2.650  -8.435  -1.725
  249    H    HIS  31           H        HIS  31  -0.297 -15.077  -1.378
  250    HA   HIS  31           HA       HIS  31   2.102 -14.391  -2.980
  251   1HB   HIS  31          1HB       HIS  31   3.075 -16.479  -2.759
  252   2HB   HIS  31          2HB       HIS  31   2.717 -15.961  -1.115
  253    HD2  HIS  31           HD2      HIS  31   1.384 -18.370  -3.852
  254    HE1  HIS  31           HE1      HIS  31  -0.156 -19.632  -0.099
  255    HE2  HIS  31           HE2      HIS  31  -0.011 -20.251  -2.575
  256    HA   PRO  32           HA       PRO  32   2.928 -15.773  -4.941
  257   1HB   PRO  32          1HB       PRO  32   2.898 -15.346  -7.639
  258   2HB   PRO  32          2HB       PRO  32   2.409 -16.895  -6.915
  259   1HG   PRO  32          1HG       PRO  32   0.610 -14.584  -7.694
  260   2HG   PRO  32          2HG       PRO  32   0.478 -16.286  -8.235
  261   1HD   PRO  32          1HD       PRO  32  -0.967 -15.381  -6.118
  262   2HD   PRO  32          2HD       PRO  32  -0.224 -17.002  -6.070
  263    H    SER  33           H        SER  33   4.115 -14.043  -6.673
  264    HA   SER  33           HA       SER  33   4.091 -11.618  -5.145
  265   1HB   SER  33          1HB       SER  33   6.093 -11.142  -6.425
  266   2HB   SER  33          2HB       SER  33   6.092 -12.871  -6.018
  267    HG   SER  33           HG       SER  33   6.611 -12.459  -8.219
  268    H    ASP  34           H        ASP  34   2.156 -12.508  -7.788
  269    HA   ASP  34           HA       ASP  34   2.447 -10.170  -9.441
  270   1HB   ASP  34          1HB       ASP  34   1.948 -12.388 -10.329
  271   2HB   ASP  34          2HB       ASP  34   0.427 -12.440  -9.433
  272    H    ILE  35           H        ILE  35   2.054  -8.613  -7.648
  273    HA   ILE  35           HA       ILE  35  -0.827  -7.869  -7.548
  274    HB   ILE  35           HB       ILE  35  -0.222  -8.791  -5.500
  275   1HG1  ILE  35          1HG1      ILE  35  -0.224  -5.823  -4.980
  276   2HG1  ILE  35          2HG1      ILE  35  -1.655  -6.743  -5.454
  277   1HG2  ILE  35          1HG2      ILE  35   2.059  -8.786  -5.402
  278   2HG2  ILE  35          2HG2      ILE  35   2.171  -7.018  -5.599
  279   3HG2  ILE  35          3HG2      ILE  35   1.572  -7.729  -4.083
  280   1HD1  ILE  35          1HD1      ILE  35  -1.125  -8.308  -3.476
  281   2HD1  ILE  35          2HD1      ILE  35  -0.037  -7.028  -2.906
  282   3HD1  ILE  35          3HD1      ILE  35  -1.758  -6.688  -3.111
  283    H    GLU  36           H        GLU  36  -1.253  -5.622  -7.252
  284    HA   GLU  36           HA       GLU  36   0.853  -3.712  -8.117
  285   1HB   GLU  36          1HB       GLU  36  -2.022  -3.191  -8.776
  286   2HB   GLU  36          2HB       GLU  36  -0.540  -2.657  -9.547
  287   1HG   GLU  36          1HG       GLU  36  -0.143  -5.001 -10.338
  288   2HG   GLU  36          2HG       GLU  36  -1.692  -5.469  -9.659
  289    H    VAL  37           H        VAL  37   1.133  -2.041  -6.693
  290    HA   VAL  37           HA       VAL  37  -1.123  -1.012  -5.135
  291    HB   VAL  37           HB       VAL  37   1.471  -1.835  -3.814
  292   1HG1  VAL  37          1HG1      VAL  37   0.552   0.236  -2.778
  293   2HG1  VAL  37          2HG1      VAL  37  -0.982  -0.599  -2.503
  294   3HG1  VAL  37          3HG1      VAL  37   0.485  -1.158  -1.698
  295   1HG2  VAL  37          1HG2      VAL  37  -1.354  -2.951  -3.488
  296   2HG2  VAL  37          2HG2      VAL  37   0.036  -3.792  -4.173
  297   3HG2  VAL  37          3HG2      VAL  37   0.019  -3.376  -2.461
  298    H    ASP  38           H        ASP  38  -0.907   0.470  -6.851
  299    HA   ASP  38           HA       ASP  38   1.288   2.439  -6.683
  300   1HB   ASP  38          1HB       ASP  38  -1.283   2.524  -8.328
  301   2HB   ASP  38          2HB       ASP  38   0.146   3.543  -8.483
  302    H    LEU  39           H        LEU  39   1.049   4.323  -5.447
  303    HA   LEU  39           HA       LEU  39  -1.331   4.482  -3.735
  304   1HB   LEU  39          1HB       LEU  39   1.155   6.224  -3.820
  305   2HB   LEU  39          2HB       LEU  39  -0.219   6.393  -2.717
  306    HG   LEU  39           HG       LEU  39   0.328   3.733  -2.358
  307   1HD1  LEU  39          1HD1      LEU  39   3.029   5.064  -2.797
  308   2HD1  LEU  39          2HD1      LEU  39   2.750   3.448  -2.119
  309   3HD1  LEU  39          3HD1      LEU  39   2.333   3.774  -3.803
  310   1HD2  LEU  39          1HD2      LEU  39  -0.019   5.240  -0.548
  311   2HD2  LEU  39          2HD2      LEU  39   1.588   4.522  -0.288
  312   3HD2  LEU  39          3HD2      LEU  39   1.436   6.163  -0.938
  313    H    LEU  40           H        LEU  40  -2.891   6.025  -3.830
  314    HA   LEU  40           HA       LEU  40  -3.178   7.423  -6.445
  315   1HB   LEU  40          1HB       LEU  40  -3.817   4.885  -6.244
  316   2HB   LEU  40          2HB       LEU  40  -5.172   5.464  -5.294
  317    HG   LEU  40           HG       LEU  40  -5.830   5.034  -7.554
  318   1HD1  LEU  40          1HD1      LEU  40  -5.720   8.066  -7.273
  319   2HD1  LEU  40          2HD1      LEU  40  -6.877   7.108  -8.205
  320   3HD1  LEU  40          3HD1      LEU  40  -6.880   7.004  -6.435
  321   1HD2  LEU  40          1HD2      LEU  40  -3.835   7.093  -8.547
  322   2HD2  LEU  40          2HD2      LEU  40  -3.536   5.340  -8.557
  323   3HD2  LEU  40          3HD2      LEU  40  -4.868   6.028  -9.507
  324    H    LYS  41           H        LYS  41  -3.809   9.549  -5.908
  325    HA   LYS  41           HA       LYS  41  -5.105   9.999  -3.373
  326   1HB   LYS  41          1HB       LYS  41  -4.409  11.829  -5.653
  327   2HB   LYS  41          2HB       LYS  41  -4.772  12.373  -3.993
  328   1HG   LYS  41          1HG       LYS  41  -2.830  11.793  -3.143
  329   2HG   LYS  41          2HG       LYS  41  -2.589  10.382  -4.158
  330   1HD   LYS  41          1HD       LYS  41  -0.991  12.073  -4.782
  331   2HD   LYS  41          2HD       LYS  41  -2.080  11.741  -6.102
  332   1HE   LYS  41          1HE       LYS  41  -1.684  14.147  -5.905
  333   2HE   LYS  41          2HE       LYS  41  -3.388  13.770  -5.647
  334   1HZ   LYS  41          1HZ       LYS  41  -2.971  13.914  -3.277
  335   2HZ   LYS  41          2HZ       LYS  41  -1.420  14.392  -3.552
  336   3HZ   LYS  41          3HZ       LYS  41  -2.694  15.329  -4.044
  337    H    ASN  42           H        ASN  42  -6.496  12.349  -4.666
  338    HA   ASN  42           HA       ASN  42  -9.193  11.397  -4.870
  339   1HB   ASN  42          1HB       ASN  42  -9.425  13.814  -5.922
  340   2HB   ASN  42          2HB       ASN  42  -9.016  13.627  -4.217
  341   1HD2  ASN  42          2HD2      ASN  42  -7.264  13.943  -7.386
  342   2HD2  ASN  42          1HD2      ASN  42  -5.978  14.920  -6.709
  343    H    GLY  43           H        GLY  43  -6.634  12.039  -7.263
  344   1HA   GLY  43          1HA       GLY  43  -7.709  10.196  -9.127
  345   2HA   GLY  43          2HA       GLY  43  -8.232  11.828  -9.597
  346    H    GLU  44           H        GLU  44  -5.194  10.795  -8.023
  347    HA   GLU  44           HA       GLU  44  -3.618  11.278 -10.481
  348   1HB   GLU  44          1HB       GLU  44  -3.713  13.433  -9.317
  349   2HB   GLU  44          2HB       GLU  44  -3.211  12.671  -7.809
  350   1HG   GLU  44          1HG       GLU  44  -1.040  12.001  -8.937
  351   2HG   GLU  44          2HG       GLU  44  -1.565  12.908 -10.367
  352    H    ARG  45           H        ARG  45  -2.113   9.749 -10.686
  353    HA   ARG  45           HA       ARG  45  -1.676   7.779  -8.519
  354   1HB   ARG  45          1HB       ARG  45  -2.399   6.885 -10.631
  355   2HB   ARG  45          2HB       ARG  45  -1.143   7.772 -11.512
  356   1HG   ARG  45          1HG       ARG  45   0.609   6.472 -10.555
  357   2HG   ARG  45          2HG       ARG  45  -0.470   5.738  -9.350
  358   1HD   ARG  45          1HD       ARG  45  -1.592   4.428 -10.974
  359   2HD   ARG  45          2HD       ARG  45  -0.940   5.348 -12.332
  360    HE   ARG  45           HE       ARG  45   0.408   3.253 -10.743
  361   1HH1  ARG  45          1HH2      ARG  45   0.871   5.843 -13.141
  362   2HH1  ARG  45          2HH2      ARG  45   2.497   5.331 -13.517
  363   1HH2  ARG  45          1HH1      ARG  45   2.457   2.601 -11.268
  364   2HH2  ARG  45          2HH1      ARG  45   3.394   3.436 -12.500
  365    H    ILE  46           H        ILE  46   0.227   7.591  -7.445
  366    HA   ILE  46           HA       ILE  46   2.248   9.652  -7.781
  367    HB   ILE  46           HB       ILE  46   1.472   7.548  -5.740
  368   1HG1  ILE  46          1HG1      ILE  46   1.426  10.579  -5.445
  369   2HG1  ILE  46          2HG1      ILE  46   0.059   9.729  -6.166
  370   1HG2  ILE  46          1HG2      ILE  46   3.841   7.807  -5.591
  371   2HG2  ILE  46          2HG2      ILE  46   3.701   9.586  -5.693
  372   3HG2  ILE  46          3HG2      ILE  46   3.086   8.706  -4.264
  373   1HD1  ILE  46          1HD1      ILE  46   1.071   9.330  -3.333
  374   2HD1  ILE  46          2HD1      ILE  46  -0.448  10.035  -3.918
  375   3HD1  ILE  46          3HD1      ILE  46  -0.174   8.327  -4.115
  376    H    GLU  47           H        GLU  47   3.959   9.194  -9.053
  377    HA   GLU  47           HA       GLU  47   4.991   6.389  -9.256
  378   1HB   GLU  47          1HB       GLU  47   5.284   8.735 -11.168
  379   2HB   GLU  47          2HB       GLU  47   6.069   7.154 -11.336
  380   1HG   GLU  47          1HG       GLU  47   3.824   6.062 -11.337
  381   2HG   GLU  47          2HG       GLU  47   3.070   7.667 -11.376
  382    H    LYS  48           H        LYS  48   5.471   7.911  -6.948
  383    HA   LYS  48           HA       LYS  48   8.410   7.672  -7.043
  384   1HB   LYS  48          1HB       LYS  48   7.006   9.928  -5.535
  385   2HB   LYS  48          2HB       LYS  48   8.716   9.470  -5.425
  386   1HG   LYS  48          1HG       LYS  48   8.876   9.881  -7.945
  387   2HG   LYS  48          2HG       LYS  48   7.267  10.628  -7.834
  388   1HD   LYS  48          1HD       LYS  48   8.162  12.224  -6.132
  389   2HD   LYS  48          2HD       LYS  48   9.761  11.462  -6.280
  390   1HE   LYS  48          1HE       LYS  48   9.809  12.074  -8.703
  391   2HE   LYS  48          2HE       LYS  48   8.247  12.895  -8.511
  392   1HZ   LYS  48          1HZ       LYS  48  10.740  13.578  -7.114
  393   2HZ   LYS  48          2HZ       LYS  48  10.069  14.416  -8.364
  394   3HZ   LYS  48          3HZ       LYS  48   9.294  14.341  -6.912
  395    H    VAL  49           H        VAL  49   7.143   5.596  -6.659
  396    HA   VAL  49           HA       VAL  49   6.411   5.192  -3.814
  397    HB   VAL  49           HB       VAL  49   6.275   3.230  -6.141
  398   1HG1  VAL  49          1HG1      VAL  49   6.361   2.222  -3.853
  399   2HG1  VAL  49          2HG1      VAL  49   4.999   3.247  -3.367
  400   3HG1  VAL  49          3HG1      VAL  49   4.777   2.003  -4.617
  401   1HG2  VAL  49          1HG2      VAL  49   4.159   5.102  -4.997
  402   2HG2  VAL  49          2HG2      VAL  49   4.774   5.051  -6.662
  403   3HG2  VAL  49          3HG2      VAL  49   3.805   3.708  -6.043
  404    H    GLU  50           H        GLU  50   8.241   5.076  -2.640
  405    HA   GLU  50           HA       GLU  50  10.741   3.907  -3.648
  406   1HB   GLU  50          1HB       GLU  50  10.590   6.011  -2.244
  407   2HB   GLU  50          2HB       GLU  50  10.053   4.991  -0.895
  408   1HG   GLU  50          1HG       GLU  50  12.172   3.711  -1.026
  409   2HG   GLU  50          2HG       GLU  50  12.696   4.742  -2.370
  410    H    HIS  51           H        HIS  51   9.363   1.807  -3.983
  411    HA   HIS  51           HA       HIS  51   8.376   0.513  -1.649
  412   1HB   HIS  51          1HB       HIS  51   7.558  -1.073  -3.029
  413   2HB   HIS  51          2HB       HIS  51   7.856   0.155  -4.249
  414    HD2  HIS  51           HD2      HIS  51  10.663  -0.344  -5.424
  415    HE1  HIS  51           HE1      HIS  51  10.015  -4.510  -5.038
  416    HE2  HIS  51           HE2      HIS  51  11.474  -2.729  -6.145
  417    H    SER  52           H        SER  52   9.125  -1.792  -1.046
  418    HA   SER  52           HA       SER  52  11.902  -1.735  -0.212
  419   1HB   SER  52          1HB       SER  52  11.385  -3.881   0.835
  420   2HB   SER  52          2HB       SER  52  10.129  -2.687   1.173
  421    HG   SER  52           HG       SER  52   9.346  -4.788   0.541
  422    H    ASP  53           H        ASP  53  11.812  -4.877  -0.897
  423    HA   ASP  53           HA       ASP  53  12.194  -4.890  -3.763
  424   1HB   ASP  53          1HB       ASP  53  14.404  -3.984  -2.945
  425   2HB   ASP  53          2HB       ASP  53  14.626  -5.468  -2.009
  426    H    LEU  54           H        LEU  54  10.363  -6.045  -2.093
  427    HA   LEU  54           HA       LEU  54   9.323  -7.910  -1.569
  428   1HB   LEU  54          1HB       LEU  54  10.346  -8.693  -3.862
  429   2HB   LEU  54          2HB       LEU  54  11.400  -9.694  -2.863
  430    HG   LEU  54           HG       LEU  54   9.520 -11.034  -3.538
  431   1HD1  LEU  54          1HD1      LEU  54  10.268 -11.307  -1.200
  432   2HD1  LEU  54          2HD1      LEU  54   8.857 -10.359  -0.699
  433   3HD1  LEU  54          3HD1      LEU  54   8.615 -11.844  -1.586
  434   1HD2  LEU  54          1HD2      LEU  54   7.975  -8.576  -3.182
  435   2HD2  LEU  54          2HD2      LEU  54   7.699  -9.973  -4.197
  436   3HD2  LEU  54          3HD2      LEU  54   7.185 -10.001  -2.489
  437    H    SER  55           H        SER  55   9.228  -8.528   0.462
  438    HA   SER  55           HA       SER  55  11.636  -9.647   1.829
  439   1HB   SER  55          1HB       SER  55  11.339  -7.288   2.552
  440   2HB   SER  55          2HB       SER  55   9.671  -7.644   3.023
  441    HG   SER  55           HG       SER  55  12.055  -8.776   4.075
  442    H    PHE  56           H        PHE  56  10.528 -11.638   0.995
  443    HA   PHE  56           HA       PHE  56   7.901 -12.250   1.951
  444   1HB   PHE  56          1HB       PHE  56   8.594 -14.638   1.195
  445   2HB   PHE  56          2HB       PHE  56   8.462 -13.348   0.017
  446    HD1  PHE  56           HD1      PHE  56   9.971 -13.733  -1.748
  447    HD2  PHE  56           HD2      PHE  56  11.194 -14.405   2.316
  448    HE1  PHE  56           HE1      PHE  56  12.264 -14.205  -2.520
  449    HE2  PHE  56           HE2      PHE  56  13.532 -14.821   1.549
  450    HZ   PHE  56           HZ       PHE  56  14.064 -14.708  -0.881
  451    H    SER  57           H        SER  57  10.442 -11.824   3.898
  452    HA   SER  57           HA       SER  57  11.001 -12.370   5.969
  453   1HB   SER  57          1HB       SER  57   9.215 -12.373   7.551
  454   2HB   SER  57          2HB       SER  57   8.924 -11.228   6.239
  455    HG   SER  57           HG       SER  57   7.849 -13.852   6.481
  456    H    LYS  58           H        LYS  58  11.679 -14.565   4.585
  457    HA   LYS  58           HA       LYS  58  10.045 -16.419   3.867
  458   1HB   LYS  58          1HB       LYS  58  12.598 -16.047   3.438
  459   2HB   LYS  58          2HB       LYS  58  12.828 -17.315   4.637
  460   1HG   LYS  58          1HG       LYS  58  10.975 -18.529   3.060
  461   2HG   LYS  58          2HG       LYS  58  11.627 -17.412   1.863
  462   1HD   LYS  58          1HD       LYS  58  13.246 -19.436   3.503
  463   2HD   LYS  58          2HD       LYS  58  12.645 -19.681   1.863
  464   1HE   LYS  58          1HE       LYS  58  14.907 -19.105   1.593
  465   2HE   LYS  58          2HE       LYS  58  13.990 -17.669   1.113
  466   1HZ   LYS  58          1HZ       LYS  58  15.339 -18.109   3.696
  467   2HZ   LYS  58          2HZ       LYS  58  15.861 -17.133   2.477
  468   3HZ   LYS  58          3HZ       LYS  58  14.485 -16.760   3.297
  469    H    ASP  59           H        ASP  59   8.784 -16.463   6.176
  470    HA   ASP  59           HA       ASP  59   9.217 -19.142   7.353
  471   1HB   ASP  59          1HB       ASP  59   7.550 -16.788   8.246
  472   2HB   ASP  59          2HB       ASP  59   7.798 -18.305   9.124
  473    H    TRP  60           H        TRP  60   8.220 -19.238   4.750
  474    HA   TRP  60           HA       TRP  60   6.550 -19.790   3.365
  475   1HB   TRP  60          1HB       TRP  60   4.984 -20.697   5.802
  476   2HB   TRP  60          2HB       TRP  60   4.712 -21.145   4.126
  477    HD1  TRP  60           HD1      TRP  60   7.169 -21.701   7.003
  478    HE1  TRP  60           HE1      TRP  60   8.423 -23.934   6.651
  479    HE3  TRP  60           HE3      TRP  60   5.465 -22.880   2.323
  480    HZ2  TRP  60           HZ2      TRP  60   8.616 -25.956   4.648
  481    HZ3  TRP  60           HZ3      TRP  60   6.191 -24.977   1.227
  482    HH2  TRP  60           HH2      TRP  60   7.755 -26.526   2.380
  483    H    SER  61           H        SER  61   6.708 -17.226   3.613
  484    HA   SER  61           HA       SER  61   3.934 -16.212   3.516
  485   1HB   SER  61          1HB       SER  61   4.869 -15.727   5.828
  486   2HB   SER  61          2HB       SER  61   6.175 -14.818   5.047
  487    HG   SER  61           HG       SER  61   4.492 -13.449   5.663
  488    H    PHE  62           H        PHE  62   4.194 -13.760   2.627
  489    HA   PHE  62           HA       PHE  62   6.433 -13.337   0.879
  490   1HB   PHE  62          1HB       PHE  62   4.959 -15.208  -0.207
  491   2HB   PHE  62          2HB       PHE  62   3.850 -13.911  -0.546
  492    HD1  PHE  62           HD1      PHE  62   4.645 -11.970  -2.160
  493    HD2  PHE  62           HD2      PHE  62   7.104 -15.442  -1.263
  494    HE1  PHE  62           HE1      PHE  62   6.107 -11.446  -3.969
  495    HE2  PHE  62           HE2      PHE  62   8.538 -14.915  -3.127
  496    HZ   PHE  62           HZ       PHE  62   8.165 -12.830  -4.424
  497    H    TYR  63           H        TYR  63   6.511 -11.051   0.467
  498    HA   TYR  63           HA       TYR  63   4.076  -9.480   0.368
  499   1HB   TYR  63          1HB       TYR  63   4.437  -8.218   2.427
  500   2HB   TYR  63          2HB       TYR  63   4.046  -9.919   2.682
  501    HD1  TYR  63           HD1      TYR  63   5.215 -11.288   4.109
  502    HD2  TYR  63           HD2      TYR  63   6.753  -7.450   2.877
  503    HE1  TYR  63           HE1      TYR  63   6.298 -11.008   6.288
  504    HE2  TYR  63           HE2      TYR  63   8.099  -7.324   4.929
  505    HH   TYR  63           HH       TYR  63   8.386  -8.172   7.053
  506    H    LEU  64           H        LEU  64   4.715  -7.013   0.793
  507    HA   LEU  64           HA       LEU  64   7.392  -6.220   0.449
  508   1HB   LEU  64          1HB       LEU  64   7.447  -5.345  -1.774
  509   2HB   LEU  64          2HB       LEU  64   7.115  -7.066  -1.847
  510    HG   LEU  64           HG       LEU  64   5.235  -4.775  -2.386
  511   1HD1  LEU  64          1HD1      LEU  64   5.973  -7.207  -4.090
  512   2HD1  LEU  64          2HD1      LEU  64   4.961  -5.857  -4.590
  513   3HD1  LEU  64          3HD1      LEU  64   6.687  -5.586  -4.286
  514   1HD2  LEU  64          1HD2      LEU  64   4.645  -7.727  -2.038
  515   2HD2  LEU  64          2HD2      LEU  64   3.798  -6.362  -1.241
  516   3HD2  LEU  64          3HD2      LEU  64   3.567  -6.686  -2.956
  517    H    LEU  65           H        LEU  65   7.599  -3.936   0.606
  518    HA   LEU  65           HA       LEU  65   5.200  -2.631   1.748
  519   1HB   LEU  65          1HB       LEU  65   7.642  -3.185   2.819
  520   2HB   LEU  65          2HB       LEU  65   8.004  -1.611   2.123
  521    HG   LEU  65           HG       LEU  65   5.729  -2.280   4.034
  522   1HD1  LEU  65          1HD1      LEU  65   8.439  -0.933   4.450
  523   2HD1  LEU  65          2HD1      LEU  65   7.168  -1.029   5.686
  524   3HD1  LEU  65          3HD1      LEU  65   7.937  -2.514   5.084
  525   1HD2  LEU  65          1HD2      LEU  65   5.294  -0.229   2.596
  526   2HD2  LEU  65          2HD2      LEU  65   5.411   0.091   4.332
  527   3HD2  LEU  65          3HD2      LEU  65   6.783   0.462   3.285
  528    H    TYR  66           H        TYR  66   4.375  -0.878   0.618
  529    HA   TYR  66           HA       TYR  66   6.022   0.270  -1.603
  530   1HB   TYR  66          1HB       TYR  66   3.008  -0.068  -1.620
  531   2HB   TYR  66          2HB       TYR  66   4.066   0.329  -2.957
  532    HD1  TYR  66           HD1      TYR  66   3.079  -2.460  -0.584
  533    HD2  TYR  66           HD2      TYR  66   4.954  -1.484  -4.351
  534    HE1  TYR  66           HE1      TYR  66   2.168  -4.508  -1.564
  535    HE2  TYR  66           HE2      TYR  66   4.013  -3.552  -5.327
  536    HH   TYR  66           HH       TYR  66   1.602  -5.525  -3.579
  537    H    TYR  67           H        TYR  67   6.644   2.121  -0.650
  538    HA   TYR  67           HA       TYR  67   4.592   3.834   0.662
  539   1HB   TYR  67          1HB       TYR  67   6.321   4.386   2.210
  540   2HB   TYR  67          2HB       TYR  67   5.725   2.745   2.167
  541    HD1  TYR  67           HD1      TYR  67   8.633   4.828   2.049
  542    HD2  TYR  67           HD2      TYR  67   7.191   0.904   1.060
  543    HE1  TYR  67           HE1      TYR  67  10.923   3.920   2.318
  544    HE2  TYR  67           HE2      TYR  67   9.463  -0.012   1.312
  545    HH   TYR  67           HH       TYR  67  12.268   2.056   2.182
  546    H    THR  68           H        THR  68   4.686   5.908   0.542
  547    HA   THR  68           HA       THR  68   6.685   7.340  -1.200
  548    HB   THR  68           HB       THR  68   4.542   6.792  -2.265
  549    HG1  THR  68           HG1      THR  68   5.882   8.417  -3.003
  550   1HG2  THR  68          1HG2      THR  68   2.572   8.074  -1.772
  551   2HG2  THR  68          2HG2      THR  68   3.109   7.380  -0.222
  552   3HG2  THR  68          3HG2      THR  68   3.410   9.086  -0.590
  553    H    GLU  69           H        GLU  69   6.294   9.838  -0.943
  554    HA   GLU  69           HA       GLU  69   6.234  10.603   1.944
  555   1HB   GLU  69          1HB       GLU  69   7.643  11.887  -0.380
  556   2HB   GLU  69          2HB       GLU  69   7.678  12.432   1.314
  557   1HG   GLU  69          1HG       GLU  69   8.666  10.303   1.967
  558   2HG   GLU  69          2HG       GLU  69   8.744   9.768   0.277
  559    H    PHE  70           H        PHE  70   3.811  10.617   1.672
  560    HA   PHE  70           HA       PHE  70   2.650  12.315  -0.308
  561   1HB   PHE  70          1HB       PHE  70   0.591  11.701   0.488
  562   2HB   PHE  70          2HB       PHE  70   1.557  10.259   0.772
  563    HD1  PHE  70           HD1      PHE  70  -0.891  12.469   2.106
  564    HD2  PHE  70           HD2      PHE  70   2.608  10.262   3.253
  565    HE1  PHE  70           HE1      PHE  70  -1.352  12.913   4.495
  566    HE2  PHE  70           HE2      PHE  70   1.730  10.139   5.581
  567    HZ   PHE  70           HZ       PHE  70  -0.076  11.709   6.252
  568    H    THR  71           H        THR  71   1.881  14.277  -0.229
  569    HA   THR  71           HA       THR  71   2.149  15.971   2.204
  570    HB   THR  71           HB       THR  71   2.012  16.904  -0.638
  571    HG1  THR  71           HG1      THR  71   4.237  16.933  -0.506
  572   1HG2  THR  71          1HG2      THR  71   3.089  18.889   0.351
  573   2HG2  THR  71          2HG2      THR  71   1.569  18.571   1.211
  574   3HG2  THR  71          3HG2      THR  71   3.116  18.117   1.946
  575    HA   PRO  72           HA       PRO  72  -2.438  15.598   1.462
  576   1HB   PRO  72          1HB       PRO  72  -3.380  15.899   3.978
  577   2HB   PRO  72          2HB       PRO  72  -2.525  14.440   3.432
  578   1HG   PRO  72          1HG       PRO  72  -1.374  16.815   4.934
  579   2HG   PRO  72          2HG       PRO  72  -1.184  15.098   5.360
  580   1HD   PRO  72          1HD       PRO  72   0.694  16.512   3.919
  581   2HD   PRO  72          2HD       PRO  72   0.417  14.776   3.631
  582    H    THR  73           H        THR  73  -1.862  17.640   0.244
  583    HA   THR  73           HA       THR  73  -2.082  20.231   1.400
  584    HB   THR  73           HB       THR  73  -2.502  20.914  -1.007
  585    HG1  THR  73           HG1      THR  73  -3.483  18.935  -1.648
  586   1HG2  THR  73          1HG2      THR  73  -0.256  20.299  -1.776
  587   2HG2  THR  73          2HG2      THR  73  -0.209  20.771  -0.066
  588   3HG2  THR  73          3HG2      THR  73  -0.133  19.052  -0.522
  589    H    GLU  74           H        GLU  74  -3.808  20.734   2.586
  590    HA   GLU  74           HA       GLU  74  -5.850  21.285   3.230
  591   1HB   GLU  74          1HB       GLU  74  -6.421  21.523   0.245
  592   2HB   GLU  74          2HB       GLU  74  -7.449  22.131   1.552
  593   1HG   GLU  74          1HG       GLU  74  -5.563  23.563   2.343
  594   2HG   GLU  74          2HG       GLU  74  -4.587  23.000   0.974
  595    H    LYS  75           H        LYS  75  -6.994  19.513   0.362
  596    HA   LYS  75           HA       LYS  75  -8.445  17.594   2.138
  597   1HB   LYS  75          1HB       LYS  75  -9.525  19.076  -0.292
  598   2HB   LYS  75          2HB       LYS  75 -10.369  17.799   0.606
  599   1HG   LYS  75          1HG       LYS  75 -10.271  19.188   2.667
  600   2HG   LYS  75          2HG       LYS  75  -9.521  20.503   1.738
  601   1HD   LYS  75          1HD       LYS  75 -11.491  20.641   0.275
  602   2HD   LYS  75          2HD       LYS  75 -12.254  19.293   1.150
  603   1HE   LYS  75          1HE       LYS  75 -12.218  20.628   3.244
  604   2HE   LYS  75          2HE       LYS  75 -11.455  21.976   2.379
  605   1HZ   LYS  75          1HZ       LYS  75 -13.395  22.129   1.014
  606   2HZ   LYS  75          2HZ       LYS  75 -14.103  20.856   1.786
  607   3HZ   LYS  75          3HZ       LYS  75 -13.810  22.255   2.603
  608    H    ASP  76           H        ASP  76  -5.887  17.627   0.238
  609    HA   ASP  76           HA       ASP  76  -6.558  15.641  -1.763
  610   1HB   ASP  76          1HB       ASP  76  -3.971  16.723  -0.643
  611   2HB   ASP  76          2HB       ASP  76  -3.994  15.274  -1.650
  612    H    GLU  77           H        GLU  77  -7.540  13.855  -1.027
  613    HA   GLU  77           HA       GLU  77  -6.646  12.333   1.310
  614   1HB   GLU  77          1HB       GLU  77  -9.019  12.375   0.712
  615   2HB   GLU  77          2HB       GLU  77  -8.651  11.781  -0.912
  616   1HG   GLU  77          1HG       GLU  77  -9.581  10.016   0.422
  617   2HG   GLU  77          2HG       GLU  77  -7.919   9.602   0.043
  618    H    TYR  78           H        TYR  78  -5.703  10.207   1.126
  619    HA   TYR  78           HA       TYR  78  -4.495   9.460  -1.490
  620   1HB   TYR  78          1HB       TYR  78  -3.059   9.554   1.156
  621   2HB   TYR  78          2HB       TYR  78  -2.568   8.546  -0.199
  622    HD1  TYR  78           HD1      TYR  78  -3.472  12.148   0.482
  623    HD2  TYR  78           HD2      TYR  78  -0.855   9.376  -1.517
  624    HE1  TYR  78           HE1      TYR  78  -2.322  14.031  -0.639
  625    HE2  TYR  78           HE2      TYR  78   0.473  11.292  -2.400
  626    HH   TYR  78           HH       TYR  78   0.666  13.578  -2.560
  627    H    ALA  79           H        ALA  79  -4.334   7.274  -1.878
  628    HA   ALA  79           HA       ALA  79  -5.482   5.389   0.077
  629   1HB   ALA  79          1HB       ALA  79  -7.329   6.246  -1.445
  630   2HB   ALA  79          2HB       ALA  79  -6.421   5.594  -2.824
  631   3HB   ALA  79          3HB       ALA  79  -7.037   4.503  -1.579
  632    H    CYS  80           H        CYS  80  -5.248   3.169  -0.690
  633    HA   CYS  80           HA       CYS  80  -2.698   2.694  -2.180
  634   1HB   CYS  80          1HB       CYS  80  -4.058   1.035  -0.018
  635   2HB   CYS  80          2HB       CYS  80  -2.564   0.620  -0.861
  636    H    ARG  81           H        ARG  81  -3.140   1.886  -4.168
  637    HA   ARG  81           HA       ARG  81  -5.544   0.466  -4.951
  638   1HB   ARG  81          1HB       ARG  81  -4.068   1.629  -6.509
  639   2HB   ARG  81          2HB       ARG  81  -2.727   0.577  -6.026
  640   1HG   ARG  81          1HG       ARG  81  -3.884  -1.383  -6.908
  641   2HG   ARG  81          2HG       ARG  81  -5.251  -0.380  -7.430
  642   1HD   ARG  81          1HD       ARG  81  -2.366  -0.025  -8.331
  643   2HD   ARG  81          2HD       ARG  81  -3.601  -0.873  -9.268
  644    HE   ARG  81           HE       ARG  81  -4.628   1.676  -8.642
  645   1HH1  ARG  81          1HH2      ARG  81  -1.886   0.396 -10.499
  646   2HH1  ARG  81          2HH2      ARG  81  -2.082   1.528 -11.811
  647   1HH2  ARG  81          1HH1      ARG  81  -4.738   3.287 -10.258
  648   2HH2  ARG  81          2HH1      ARG  81  -3.651   3.244 -11.622
  649    H    VAL  82           H        VAL  82  -5.934  -1.841  -4.720
  650    HA   VAL  82           HA       VAL  82  -3.652  -3.511  -3.858
  651    HB   VAL  82           HB       VAL  82  -6.393  -3.724  -2.566
  652   1HG1  VAL  82          1HG1      VAL  82  -4.869  -5.703  -2.668
  653   2HG1  VAL  82          2HG1      VAL  82  -3.636  -4.751  -1.811
  654   3HG1  VAL  82          3HG1      VAL  82  -5.182  -5.139  -1.012
  655   1HG2  VAL  82          1HG2      VAL  82  -5.536  -1.558  -1.820
  656   2HG2  VAL  82          2HG2      VAL  82  -5.402  -2.741  -0.528
  657   3HG2  VAL  82          3HG2      VAL  82  -3.954  -2.281  -1.443
  658    H    ASN  83           H        ASN  83  -3.451  -4.506  -5.798
  659    HA   ASN  83           HA       ASN  83  -5.846  -5.940  -6.925
  660   1HB   ASN  83          1HB       ASN  83  -3.540  -4.672  -8.426
  661   2HB   ASN  83          2HB       ASN  83  -4.920  -5.515  -9.129
  662   1HD2  ASN  83          2HD2      ASN  83  -4.640  -3.385 -10.370
  663   2HD2  ASN  83          1HD2      ASN  83  -5.661  -2.062  -9.827
  664    H    HIS  84           H        HIS  84  -4.843  -7.735  -5.377
  665    HA   HIS  84           HA       HIS  84  -2.326  -8.951  -6.280
  666   1HB   HIS  84          1HB       HIS  84  -3.208  -9.217  -3.961
  667   2HB   HIS  84          2HB       HIS  84  -4.608 -10.062  -4.628
  668    HD2  HIS  84           HD2      HIS  84  -0.719 -10.731  -5.260
  669    HE1  HIS  84           HE1      HIS  84  -2.628 -14.302  -4.079
  670    HE2  HIS  84           HE2      HIS  84  -0.407 -13.272  -4.854
  671    H    VAL  85           H        VAL  85  -2.339 -10.967  -7.596
  672    HA   VAL  85           HA       VAL  85  -4.209 -11.177  -9.642
  673    HB   VAL  85           HB       VAL  85  -1.943 -12.170  -9.590
  674   1HG1  VAL  85          1HG1      VAL  85  -3.203 -14.514  -8.097
  675   2HG1  VAL  85          2HG1      VAL  85  -1.552 -14.388  -8.713
  676   3HG1  VAL  85          3HG1      VAL  85  -2.073 -13.336  -7.387
  677   1HG2  VAL  85          1HG2      VAL  85  -4.169 -14.067 -10.430
  678   2HG2  VAL  85          2HG2      VAL  85  -3.533 -12.700 -11.373
  679   3HG2  VAL  85          3HG2      VAL  85  -2.493 -14.085 -11.012
  680    H    THR  86           H        THR  86  -4.282 -12.788  -6.440
  681    HA   THR  86           HA       THR  86  -6.613 -14.342  -7.167
  682    HB   THR  86           HB       THR  86  -4.646 -14.724  -5.323
  683    HG1  THR  86           HG1      THR  86  -5.935 -16.253  -6.328
  684   1HG2  THR  86          1HG2      THR  86  -7.204 -14.321  -3.725
  685   2HG2  THR  86          2HG2      THR  86  -5.609 -14.807  -3.130
  686   3HG2  THR  86          3HG2      THR  86  -5.863 -13.148  -3.694
  687    H    LEU  87           H        LEU  87  -6.195 -11.085  -5.830
  688    HA   LEU  87           HA       LEU  87  -8.974 -10.847  -4.982
  689   1HB   LEU  87          1HB       LEU  87  -6.736  -8.950  -5.658
  690   2HB   LEU  87          2HB       LEU  87  -8.374  -8.383  -5.900
  691    HG   LEU  87           HG       LEU  87  -9.010  -8.796  -3.634
  692   1HD1  LEU  87          1HD1      LEU  87  -7.535 -10.720  -3.061
  693   2HD1  LEU  87          2HD1      LEU  87  -6.127  -9.639  -3.123
  694   3HD1  LEU  87          3HD1      LEU  87  -7.386  -9.389  -1.901
  695   1HD2  LEU  87          1HD2      LEU  87  -8.034  -6.629  -4.271
  696   2HD2  LEU  87          2HD2      LEU  87  -7.583  -7.026  -2.602
  697   3HD2  LEU  87          3HD2      LEU  87  -6.402  -7.232  -3.911
  698    H    SER  88           H        SER  88  -7.158  -9.906  -7.919
  699    HA   SER  88           HA       SER  88  -7.704  -9.649 -10.064
  700   1HB   SER  88          1HB       SER  88  -8.834 -11.869  -9.946
  701   2HB   SER  88          2HB       SER  88 -10.375 -11.044  -9.617
  702    HG   SER  88           HG       SER  88  -9.992 -11.488 -11.846
  703    H    GLN  89           H        GLN  89 -10.327  -8.896  -7.761
  704    HA   GLN  89           HA       GLN  89 -11.402  -6.711  -9.324
  705   1HB   GLN  89          1HB       GLN  89 -11.788  -7.415  -6.401
  706   2HB   GLN  89          2HB       GLN  89 -12.756  -6.275  -7.344
  707   1HG   GLN  89          1HG       GLN  89 -12.580  -9.298  -7.769
  708   2HG   GLN  89          2HG       GLN  89 -13.923  -8.396  -7.078
  709   1HE2  GLN  89          2HE2      GLN  89 -12.270  -9.285 -10.060
  710   2HE2  GLN  89          1HE2      GLN  89 -13.478  -8.633 -11.148
  711    HA   PRO  90           HA       PRO  90  -8.009  -4.215  -7.839
  712   1HB   PRO  90          1HB       PRO  90  -8.460  -1.857  -9.165
  713   2HB   PRO  90          2HB       PRO  90  -7.980  -3.359 -10.003
  714   1HG   PRO  90          1HG       PRO  90 -10.791  -2.275  -9.680
  715   2HG   PRO  90          2HG       PRO  90  -9.992  -2.837 -11.175
  716   1HD   PRO  90          1HD       PRO  90 -11.632  -4.447  -9.687
  717   2HD   PRO  90          2HD       PRO  90 -10.199  -5.095 -10.543
  718    H    LYS  91           H        LYS  91  -8.347  -3.966  -5.625
  719    HA   LYS  91           HA       LYS  91 -10.654  -2.398  -4.665
  720   1HB   LYS  91          1HB       LYS  91 -10.111  -4.709  -3.866
  721   2HB   LYS  91          2HB       LYS  91  -8.646  -4.064  -3.116
  722   1HG   LYS  91          1HG       LYS  91 -10.248  -2.379  -1.928
  723   2HG   LYS  91          2HG       LYS  91 -11.554  -3.438  -2.463
  724   1HD   LYS  91          1HD       LYS  91  -9.170  -4.212  -0.715
  725   2HD   LYS  91          2HD       LYS  91 -10.826  -3.926  -0.156
  726   1HE   LYS  91          1HE       LYS  91 -11.608  -5.853  -1.552
  727   2HE   LYS  91          2HE       LYS  91  -9.927  -6.170  -2.024
  728   1HZ   LYS  91          1HZ       LYS  91  -9.406  -6.517   0.275
  729   2HZ   LYS  91          2HZ       LYS  91 -10.971  -6.244   0.714
  730   3HZ   LYS  91          3HZ       LYS  91 -10.593  -7.546  -0.222
  731    H    ILE  92           H        ILE  92 -10.160  -0.192  -4.798
  732    HA   ILE  92           HA       ILE  92  -7.528   0.763  -3.943
  733    HB   ILE  92           HB       ILE  92  -9.888   2.460  -4.769
  734   1HG1  ILE  92          1HG1      ILE  92  -9.698   0.937  -6.603
  735   2HG1  ILE  92          2HG1      ILE  92  -9.006   2.491  -7.047
  736   1HG2  ILE  92          1HG2      ILE  92  -6.861   2.830  -4.840
  737   2HG2  ILE  92          2HG2      ILE  92  -8.065   4.004  -5.415
  738   3HG2  ILE  92          3HG2      ILE  92  -7.988   3.575  -3.696
  739   1HD1  ILE  92          1HD1      ILE  92  -6.725   1.591  -6.750
  740   2HD1  ILE  92          2HD1      ILE  92  -7.409   0.016  -6.262
  741   3HD1  ILE  92          3HD1      ILE  92  -7.665   0.628  -7.899
  742    H    VAL  93           H        VAL  93  -7.389   0.419  -1.704
  743    HA   VAL  93           HA       VAL  93  -9.649   1.193   0.034
  744    HB   VAL  93           HB       VAL  93  -6.982  -0.100   0.727
  745   1HG1  VAL  93          1HG1      VAL  93  -7.963   1.059   2.659
  746   2HG1  VAL  93          2HG1      VAL  93  -9.551   0.336   2.324
  747   3HG1  VAL  93          3HG1      VAL  93  -8.197  -0.679   2.847
  748   1HG2  VAL  93          1HG2      VAL  93  -8.281  -1.608  -0.684
  749   2HG2  VAL  93          2HG2      VAL  93  -8.391  -2.159   0.991
  750   3HG2  VAL  93          3HG2      VAL  93  -9.754  -1.284   0.264
  751    H    LYS  94           H        LYS  94  -9.772   3.204   0.874
  752    HA   LYS  94           HA       LYS  94  -7.714   5.173   0.663
  753   1HB   LYS  94          1HB       LYS  94 -10.239   5.046   2.342
  754   2HB   LYS  94          2HB       LYS  94  -9.139   6.435   2.300
  755   1HG   LYS  94          1HG       LYS  94  -9.441   6.613  -0.158
  756   2HG   LYS  94          2HG       LYS  94 -10.642   5.304  -0.097
  757   1HD   LYS  94          1HD       LYS  94 -12.048   6.653   1.424
  758   2HD   LYS  94          2HD       LYS  94 -10.809   7.925   1.468
  759   1HE   LYS  94          1HE       LYS  94 -11.067   8.255  -0.989
  760   2HE   LYS  94          2HE       LYS  94 -12.348   7.027  -1.010
  761   1HZ   LYS  94          1HZ       LYS  94 -12.403   9.559   0.481
  762   2HZ   LYS  94          2HZ       LYS  94 -13.223   9.233  -0.911
  763   3HZ   LYS  94          3HZ       LYS  94 -13.603   8.427   0.476
  764    H    TRP  95           H        TRP  95  -6.215   5.913   2.067
  765    HA   TRP  95           HA       TRP  95  -5.392   4.322   4.381
  766   1HB   TRP  95          1HB       TRP  95  -3.614   5.346   3.204
  767   2HB   TRP  95          2HB       TRP  95  -4.516   6.818   2.961
  768    HD1  TRP  95           HD1      TRP  95  -3.133   5.148   6.216
  769    HE1  TRP  95           HE1      TRP  95  -2.058   7.035   7.629
  770    HE3  TRP  95           HE3      TRP  95  -3.842   9.079   3.050
  771    HZ2  TRP  95           HZ2      TRP  95  -2.046   9.924   7.609
  772    HZ3  TRP  95           HZ3      TRP  95  -3.209  11.374   3.739
  773    HH2  TRP  95           HH2      TRP  95  -2.557  11.819   6.094
  774    H    ASP  96           H        ASP  96  -5.520   5.009   6.535
  775    HA   ASP  96           HA       ASP  96  -6.974   7.490   7.139
  776   1HB   ASP  96          1HB       ASP  96  -8.662   5.697   7.288
  777   2HB   ASP  96          2HB       ASP  96  -7.618   4.798   8.404
  778    H    ARG  97           H        ARG  97  -6.409   8.386   9.056
  779    HA   ARG  97           HA       ARG  97  -3.645   7.818   9.950
  780   1HB   ARG  97          1HB       ARG  97  -4.341  10.131  11.205
  781   2HB   ARG  97          2HB       ARG  97  -3.553  10.037   9.649
  782   1HG   ARG  97          1HG       ARG  97  -6.584  10.121   9.891
  783   2HG   ARG  97          2HG       ARG  97  -5.611  11.580   9.900
  784   1HD   ARG  97          1HD       ARG  97  -5.127  11.522   7.690
  785   2HD   ARG  97          2HD       ARG  97  -4.936   9.769   7.652
  786    HE   ARG  97           HE       ARG  97  -7.697  10.579   7.994
  787   1HH1  ARG  97          1HH2      ARG  97  -5.201   9.958   5.532
  788   2HH1  ARG  97          2HH2      ARG  97  -6.370   9.757   4.243
  789   1HH2  ARG  97          1HH1      ARG  97  -9.190  10.173   6.274
  790   2HH2  ARG  97          2HH1      ARG  97  -8.590   9.871   4.659
  791    H    ASP  98           H        ASP  98  -4.312   5.869  11.002
  792    HA   ASP  98           HA       ASP  98  -4.811   6.258  13.829
  793   1HB   ASP  98          1HB       ASP  98  -7.119   6.141  12.908
  794   2HB   ASP  98          2HB       ASP  98  -6.752   4.582  12.165
  795    H    MET  99           H        MET  99  -2.795   5.417  14.137
  796    HA   MET  99           HA       MET  99  -2.307   2.580  13.659
  797   1HB   MET  99          1HB       MET  99  -0.241   2.970  12.369
  798   2HB   MET  99          2HB       MET  99  -1.684   3.488  11.510
  799   1HG   MET  99          1HG       MET  99  -0.079   5.149  11.090
  800   2HG   MET  99          2HG       MET  99  -1.211   5.865  12.214
  801   1HE   MET  99          1HE       MET  99   2.365   4.562  11.504
  802   2HE   MET  99          2HE       MET  99   3.195   4.736  13.064
  803   3HE   MET  99          3HE       MET  99   1.988   3.454  12.847
  Start of MODEL    6
    1   1H    MET   0          1H        MET   0  -9.150 -24.280  -3.452
    2   2H    MET   0          2H        MET   0  -8.117 -24.598  -2.207
    3   3H    MET   0          3H        MET   0  -8.917 -23.161  -2.258
    4    HA   MET   0           HA       MET   0  -6.914 -24.070  -4.173
    5   1HB   MET   0          1HB       MET   0  -8.226 -21.334  -3.937
    6   2HB   MET   0          2HB       MET   0  -7.018 -21.843  -5.131
    7   1HG   MET   0          1HG       MET   0  -8.629 -23.522  -6.018
    8   2HG   MET   0          2HG       MET   0  -9.851 -22.923  -4.883
    9   1HE   MET   0          1HE       MET   0 -11.621 -22.537  -6.717
   10   2HE   MET   0          2HE       MET   0 -11.313 -21.642  -8.221
   11   3HE   MET   0          3HE       MET   0 -10.490 -23.190  -7.928
   12    H    ILE   1           H        ILE   1  -4.817 -23.119  -3.946
   13    HA   ILE   1           HA       ILE   1  -4.149 -22.542  -1.133
   14    HB   ILE   1           HB       ILE   1  -2.294 -23.138  -3.448
   15   1HG1  ILE   1          1HG1      ILE   1  -2.198 -25.407  -2.040
   16   2HG1  ILE   1          2HG1      ILE   1  -3.852 -24.977  -1.610
   17   1HG2  ILE   1          1HG2      ILE   1  -1.247 -22.069  -1.429
   18   2HG2  ILE   1          2HG2      ILE   1  -1.901 -23.376  -0.431
   19   3HG2  ILE   1          3HG2      ILE   1  -0.696 -23.715  -1.693
   20   1HD1  ILE   1          1HD1      ILE   1  -2.738 -25.285  -4.447
   21   2HD1  ILE   1          2HD1      ILE   1  -3.635 -26.528  -3.557
   22   3HD1  ILE   1          3HD1      ILE   1  -4.451 -25.044  -4.042
   23    H    GLN   2           H        GLN   2  -5.461 -20.477  -1.835
   24    HA   GLN   2           HA       GLN   2  -3.765 -18.391  -3.116
   25   1HB   GLN   2          1HB       GLN   2  -6.734 -18.692  -2.670
   26   2HB   GLN   2          2HB       GLN   2  -5.958 -17.255  -3.352
   27   1HG   GLN   2          1HG       GLN   2  -5.000 -18.520  -5.179
   28   2HG   GLN   2          2HG       GLN   2  -5.588 -20.053  -4.523
   29   1HE2  GLN   2          2HE2      GLN   2  -6.112 -19.082  -7.162
   30   2HE2  GLN   2          1HE2      GLN   2  -7.845 -18.860  -7.293
   31    H    ARG   3           H        ARG   3  -2.466 -17.881  -1.160
   32    HA   ARG   3           HA       ARG   3  -3.837 -17.153   1.290
   33   1HB   ARG   3          1HB       ARG   3  -0.965 -16.939   0.396
   34   2HB   ARG   3          2HB       ARG   3  -1.548 -16.341   1.963
   35   1HG   ARG   3          1HG       ARG   3  -2.411 -18.543   2.576
   36   2HG   ARG   3          2HG       ARG   3  -2.008 -19.192   0.980
   37   1HD   ARG   3          1HD       ARG   3  -0.391 -19.936   2.614
   38   2HD   ARG   3          2HD       ARG   3   0.370 -18.888   1.407
   39    HE   ARG   3           HE       ARG   3  -0.450 -17.392   3.737
   40   1HH1  ARG   3          1HH2      ARG   3   2.045 -19.582   2.467
   41   2HH1  ARG   3          2HH2      ARG   3   3.278 -19.000   3.562
   42   1HH2  ARG   3          1HH1      ARG   3   1.214 -16.647   5.184
   43   2HH2  ARG   3          2HH1      ARG   3   2.811 -17.347   5.074
   44    H    THR   4           H        THR   4  -4.837 -15.352   1.694
   45    HA   THR   4           HA       THR   4  -5.122 -13.316  -0.237
   46    HB   THR   4           HB       THR   4  -6.018 -13.514   2.673
   47    HG1  THR   4           HG1      THR   4  -7.247 -14.306   0.247
   48   1HG2  THR   4          1HG2      THR   4  -7.285 -11.878   0.437
   49   2HG2  THR   4          2HG2      THR   4  -7.873 -12.054   2.095
   50   3HG2  THR   4          3HG2      THR   4  -6.354 -11.201   1.800
   51    HA   PRO   5           HA       PRO   5  -1.927 -10.468   1.236
   52   1HB   PRO   5          1HB       PRO   5  -2.954  -8.068   0.334
   53   2HB   PRO   5          2HB       PRO   5  -2.150  -9.278  -0.712
   54   1HG   PRO   5          1HG       PRO   5  -5.116  -8.900  -0.227
   55   2HG   PRO   5          2HG       PRO   5  -4.267  -9.050  -1.792
   56   1HD   PRO   5          1HD       PRO   5  -5.465 -11.178  -0.656
   57   2HD   PRO   5          2HD       PRO   5  -3.873 -11.393  -1.422
   58    H    LYS   6           H        LYS   6  -1.845 -10.301   3.399
   59    HA   LYS   6           HA       LYS   6  -3.900  -8.979   5.010
   60   1HB   LYS   6          1HB       LYS   6  -2.447 -10.852   5.876
   61   2HB   LYS   6          2HB       LYS   6  -1.052  -9.773   5.715
   62   1HG   LYS   6          1HG       LYS   6  -2.515  -8.098   7.120
   63   2HG   LYS   6          2HG       LYS   6  -3.461  -9.535   7.538
   64   1HD   LYS   6          1HD       LYS   6  -1.375 -10.624   8.383
   65   2HD   LYS   6          2HD       LYS   6  -0.447  -9.178   7.948
   66   1HE   LYS   6          1HE       LYS   6  -2.685  -9.321  10.022
   67   2HE   LYS   6          2HE       LYS   6  -0.946  -9.207  10.344
   68   1HZ   LYS   6          1HZ       LYS   6  -1.002  -7.082   9.128
   69   2HZ   LYS   6          2HZ       LYS   6  -2.641  -7.170   9.091
   70   3HZ   LYS   6          3HZ       LYS   6  -1.861  -7.079  10.538
   71    H    ILE   7           H        ILE   7  -4.093  -6.828   4.663
   72    HA   ILE   7           HA       ILE   7  -1.791  -5.194   3.830
   73    HB   ILE   7           HB       ILE   7  -4.621  -4.229   4.189
   74   1HG1  ILE   7          1HG1      ILE   7  -4.491  -4.624   1.527
   75   2HG1  ILE   7          2HG1      ILE   7  -3.588  -6.050   2.030
   76   1HG2  ILE   7          1HG2      ILE   7  -2.669  -2.664   3.806
   77   2HG2  ILE   7          2HG2      ILE   7  -2.438  -3.427   2.234
   78   3HG2  ILE   7          3HG2      ILE   7  -3.951  -2.569   2.580
   79   1HD1  ILE   7          1HD1      ILE   7  -6.413  -5.224   2.867
   80   2HD1  ILE   7          2HD1      ILE   7  -5.978  -6.537   1.755
   81   3HD1  ILE   7          3HD1      ILE   7  -5.594  -6.673   3.479
   82    H    GLN   8           H        GLN   8  -0.744  -3.742   5.271
   83    HA   GLN   8           HA       GLN   8  -2.284  -2.701   7.559
   84   1HB   GLN   8          1HB       GLN   8  -0.022  -2.705   8.695
   85   2HB   GLN   8          2HB       GLN   8  -0.957  -4.206   8.709
   86   1HG   GLN   8          1HG       GLN   8   1.326  -3.642   6.783
   87   2HG   GLN   8          2HG       GLN   8   1.550  -4.388   8.363
   88   1HE2  GLN   8          2HE2      GLN   8   2.023  -5.411   5.556
   89   2HE2  GLN   8          1HE2      GLN   8   1.205  -6.962   5.544
   90    H    VAL   9           H        VAL   9  -2.731  -0.790   6.491
   91    HA   VAL   9           HA       VAL   9  -0.507   0.691   5.215
   92    HB   VAL   9           HB       VAL   9  -3.451   1.417   5.277
   93   1HG1  VAL   9          1HG1      VAL   9  -1.968   3.302   4.825
   94   2HG1  VAL   9          2HG1      VAL   9  -1.059   2.364   3.631
   95   3HG1  VAL   9          3HG1      VAL   9  -2.749   2.785   3.323
   96   1HG2  VAL   9          1HG2      VAL   9  -1.890  -0.229   3.256
   97   2HG2  VAL   9          2HG2      VAL   9  -3.386  -0.645   4.145
   98   3HG2  VAL   9          3HG2      VAL   9  -3.428   0.590   2.891
   99    H    TYR  10           H        TYR  10   0.631   1.954   6.560
  100    HA   TYR  10           HA       TYR  10  -0.804   3.547   8.670
  101   1HB   TYR  10          1HB       TYR  10   1.315   3.434   9.914
  102   2HB   TYR  10          2HB       TYR  10   0.380   1.958   9.764
  103    HD1  TYR  10           HD1      TYR  10   3.588   3.564   8.971
  104    HD2  TYR  10           HD2      TYR  10   1.114   0.088   8.382
  105    HE1  TYR  10           HE1      TYR  10   5.571   2.270   8.200
  106    HE2  TYR  10           HE2      TYR  10   3.084  -1.196   7.612
  107    HH   TYR  10           HH       TYR  10   5.335  -1.135   7.130
  108    H    SER  11           H        SER  11   0.109   5.583   9.206
  109    HA   SER  11           HA       SER  11   1.848   6.910   7.196
  110   1HB   SER  11          1HB       SER  11   1.178   8.973   8.650
  111   2HB   SER  11          2HB       SER  11   0.118   8.359   7.388
  112    HG   SER  11           HG       SER  11  -0.914   8.760   9.463
  113    H    ARG  12           H        ARG  12   3.985   7.130   7.857
  114    HA   ARG  12           HA       ARG  12   4.773   6.046  10.419
  115   1HB   ARG  12          1HB       ARG  12   6.069   6.111   8.097
  116   2HB   ARG  12          2HB       ARG  12   6.643   7.664   8.705
  117   1HG   ARG  12          1HG       ARG  12   8.280   6.137   9.387
  118   2HG   ARG  12          2HG       ARG  12   7.309   6.373  10.848
  119   1HD   ARG  12          1HD       ARG  12   6.033   4.224  10.189
  120   2HD   ARG  12          2HD       ARG  12   7.148   4.074   8.833
  121    HE   ARG  12           HE       ARG  12   8.754   3.251  10.212
  122   1HH1  ARG  12          1HH2      ARG  12   6.318   4.859  12.237
  123   2HH1  ARG  12          2HH2      ARG  12   7.011   4.300  13.735
  124   1HH2  ARG  12          1HH1      ARG  12   9.653   2.526  12.181
  125   2HH2  ARG  12          2HH1      ARG  12   8.925   2.970  13.703
  126    H    HIS  13           H        HIS  13   4.824   9.290   8.936
  127    HA   HIS  13           HA       HIS  13   5.524  10.601  11.475
  128   1HB   HIS  13          1HB       HIS  13   5.080  11.581   8.634
  129   2HB   HIS  13          2HB       HIS  13   5.538  12.629   9.978
  130    HD2  HIS  13           HD2      HIS  13   7.666  12.986   7.940
  131    HE1  HIS  13           HE1      HIS  13   9.783   9.653   9.460
  132    HE2  HIS  13           HE2      HIS  13   9.965  11.736   7.991
  133    HA   PRO  14           HA       PRO  14   1.287  11.759  12.264
  134   1HB   PRO  14          1HB       PRO  14   1.486  14.095  13.643
  135   2HB   PRO  14          2HB       PRO  14   2.071  12.532  14.279
  136   1HG   PRO  14          1HG       PRO  14   3.706  14.694  12.931
  137   2HG   PRO  14          2HG       PRO  14   4.068  13.827  14.451
  138   1HD   PRO  14          1HD       PRO  14   5.146  13.115  12.051
  139   2HD   PRO  14          2HD       PRO  14   4.750  11.890  13.276
  140    H    ALA  15           H        ALA  15  -0.049  12.282  10.645
  141    HA   ALA  15           HA       ALA  15   0.622  13.862   8.440
  142   1HB   ALA  15          1HB       ALA  15  -2.158  13.045   9.365
  143   2HB   ALA  15          2HB       ALA  15  -1.691  13.558   7.734
  144   3HB   ALA  15          3HB       ALA  15  -1.038  12.050   8.407
  145    H    GLU  16           H        GLU  16   0.689  15.958   8.098
  146    HA   GLU  16           HA       GLU  16  -1.095  17.839   9.562
  147   1HB   GLU  16          1HB       GLU  16   1.175  17.833  10.559
  148   2HB   GLU  16          2HB       GLU  16   1.871  18.159   8.961
  149   1HG   GLU  16          1HG       GLU  16   0.653  20.334   8.886
  150   2HG   GLU  16          2HG       GLU  16  -0.048  19.989  10.478
  151    H    ASN  17           H        ASN  17  -2.165  19.140   8.160
  152    HA   ASN  17           HA       ASN  17  -2.241  18.601   5.468
  153   1HB   ASN  17          1HB       ASN  17  -3.665  20.564   5.281
  154   2HB   ASN  17          2HB       ASN  17  -4.081  19.526   6.642
  155   1HD2  ASN  17          2HD2      ASN  17  -2.367  22.573   5.785
  156   2HD2  ASN  17          1HD2      ASN  17  -2.623  23.346   7.334
  157    H    GLY  18           H        GLY  18  -1.267  19.299   3.656
  158   1HA   GLY  18          1HA       GLY  18   0.153  20.354   2.238
  159   2HA   GLY  18          2HA       GLY  18  -0.159  21.817   3.176
  160    H    LYS  19           H        LYS  19   1.381  18.983   4.684
  161    HA   LYS  19           HA       LYS  19   4.073  20.172   4.304
  162   1HB   LYS  19          1HB       LYS  19   3.076  20.921   6.447
  163   2HB   LYS  19          2HB       LYS  19   3.016  19.218   6.951
  164   1HG   LYS  19          1HG       LYS  19   5.586  20.566   6.070
  165   2HG   LYS  19          2HG       LYS  19   4.983  20.770   7.710
  166   1HD   LYS  19          1HD       LYS  19   5.015  17.922   6.981
  167   2HD   LYS  19          2HD       LYS  19   6.593  18.679   6.740
  168   1HE   LYS  19          1HE       LYS  19   6.464  17.758   8.971
  169   2HE   LYS  19          2HE       LYS  19   6.496  19.526   9.099
  170   1HZ   LYS  19          1HZ       LYS  19   4.085  17.841   9.221
  171   2HZ   LYS  19          2HZ       LYS  19   4.847  18.499  10.523
  172   3HZ   LYS  19          3HZ       LYS  19   4.125  19.477   9.414
  173    H    SER  20           H        SER  20   5.221  18.763   3.556
  174    HA   SER  20           HA       SER  20   4.721  16.273   2.784
  175   1HB   SER  20          1HB       SER  20   7.182  15.806   2.586
  176   2HB   SER  20          2HB       SER  20   6.480  17.216   1.796
  177    HG   SER  20           HG       SER  20   8.470  17.645   2.944
  178    H    ASN  21           H        ASN  21   4.449  14.375   3.755
  179    HA   ASN  21           HA       ASN  21   5.400  13.853   6.541
  180   1HB   ASN  21          1HB       ASN  21   2.955  14.447   5.896
  181   2HB   ASN  21          2HB       ASN  21   2.858  12.796   5.334
  182   1HD2  ASN  21          2HD2      ASN  21   2.148  11.370   6.979
  183   2HD2  ASN  21          1HD2      ASN  21   2.322  11.666   8.692
  184    H    PHE  22           H        PHE  22   4.089  11.032   6.206
  185    HA   PHE  22           HA       PHE  22   5.631   9.824   4.082
  186   1HB   PHE  22          1HB       PHE  22   6.887  10.010   6.610
  187   2HB   PHE  22          2HB       PHE  22   6.322   8.351   6.508
  188    HD1  PHE  22           HD1      PHE  22   9.092  10.325   5.899
  189    HD2  PHE  22           HD2      PHE  22   6.679   7.322   3.955
  190    HE1  PHE  22           HE1      PHE  22  10.941   9.857   4.319
  191    HE2  PHE  22           HE2      PHE  22   8.491   6.955   2.299
  192    HZ   PHE  22           HZ       PHE  22  10.581   8.291   2.431
  193    H    LEU  23           H        LEU  23   4.303   8.497   3.206
  194    HA   LEU  23           HA       LEU  23   2.150   7.088   4.679
  195   1HB   LEU  23          1HB       LEU  23   1.487   8.528   2.814
  196   2HB   LEU  23          2HB       LEU  23   2.637   7.719   1.756
  197    HG   LEU  23           HG       LEU  23   1.217   5.656   1.946
  198   1HD1  LEU  23          1HD1      LEU  23  -0.506   7.543   3.620
  199   2HD1  LEU  23          2HD1      LEU  23  -1.042   5.979   2.968
  200   3HD1  LEU  23          3HD1      LEU  23   0.237   6.031   4.189
  201   1HD2  LEU  23          1HD2      LEU  23   0.850   7.326   0.137
  202   2HD2  LEU  23          2HD2      LEU  23  -0.700   6.634   0.652
  203   3HD2  LEU  23          3HD2      LEU  23  -0.216   8.254   1.201
  204    H    ASN  24           H        ASN  24   2.120   4.845   4.723
  205    HA   ASN  24           HA       ASN  24   4.170   3.314   3.178
  206   1HB   ASN  24          1HB       ASN  24   3.606   3.218   6.139
  207   2HB   ASN  24          2HB       ASN  24   4.537   2.008   5.239
  208   1HD2  ASN  24          2HD2      ASN  24   4.465   5.572   5.907
  209   2HD2  ASN  24          1HD2      ASN  24   6.208   5.750   5.946
  210    H    CYS  25           H        CYS  25   2.648   2.393   1.807
  211    HA   CYS  25           HA       CYS  25   0.443   0.795   2.966
  212   1HB   CYS  25          1HB       CYS  25   1.497   0.602   0.135
  213   2HB   CYS  25          2HB       CYS  25  -0.047   0.087   0.764
  214    H    TYR  26           H        TYR  26   0.986  -1.232   3.822
  215    HA   TYR  26           HA       TYR  26   3.344  -2.647   2.677
  216   1HB   TYR  26          1HB       TYR  26   4.002  -1.693   4.833
  217   2HB   TYR  26          2HB       TYR  26   2.574  -2.327   5.588
  218    HD1  TYR  26           HD1      TYR  26   4.709  -4.291   3.205
  219    HD2  TYR  26           HD2      TYR  26   3.762  -3.529   7.335
  220    HE1  TYR  26           HE1      TYR  26   5.828  -6.377   3.832
  221    HE2  TYR  26           HE2      TYR  26   4.782  -5.699   7.956
  222    HH   TYR  26           HH       TYR  26   6.409  -7.797   5.551
  223    H    VAL  27           H        VAL  27   2.832  -4.648   1.979
  224    HA   VAL  27           HA       VAL  27   0.284  -5.865   2.930
  225    HB   VAL  27           HB       VAL  27   1.332  -6.103   0.071
  226   1HG1  VAL  27          1HG1      VAL  27  -0.309  -7.800   0.892
  227   2HG1  VAL  27          2HG1      VAL  27  -1.402  -6.502   1.382
  228   3HG1  VAL  27          3HG1      VAL  27  -1.030  -6.749  -0.335
  229   1HG2  VAL  27          1HG2      VAL  27  -0.675  -4.112   1.099
  230   2HG2  VAL  27          2HG2      VAL  27   0.907  -3.732   0.388
  231   3HG2  VAL  27          3HG2      VAL  27  -0.338  -4.502  -0.611
  232    H    SER  28           H        SER  28   0.459  -8.083   3.348
  233    HA   SER  28           HA       SER  28   2.734  -9.544   2.379
  234   1HB   SER  28          1HB       SER  28   3.749  -9.973   4.599
  235   2HB   SER  28          2HB       SER  28   3.743  -8.253   4.334
  236    HG   SER  28           HG       SER  28   1.967  -9.746   5.950
  237    H    GLY  29           H        GLY  29   2.863 -11.773   3.737
  238   1HA   GLY  29          1HA       GLY  29   1.706 -13.583   4.647
  239   2HA   GLY  29          2HA       GLY  29   0.176 -12.732   4.478
  240    H    PHE  30           H        PHE  30   0.747 -12.015   1.624
  241    HA   PHE  30           HA       PHE  30  -0.633 -14.247   0.506
  242   1HB   PHE  30          1HB       PHE  30  -0.823 -12.827  -1.456
  243   2HB   PHE  30          2HB       PHE  30  -1.168 -11.949  -0.010
  244    HD1  PHE  30           HD1      PHE  30   1.291 -12.444  -2.725
  245    HD2  PHE  30           HD2      PHE  30   0.210  -9.952   0.633
  246    HE1  PHE  30           HE1      PHE  30   3.117 -10.896  -3.289
  247    HE2  PHE  30           HE2      PHE  30   2.004  -8.382   0.004
  248    HZ   PHE  30           HZ       PHE  30   3.485  -8.881  -1.914
  249    H    HIS  31           H        HIS  31  -0.064 -15.044  -1.728
  250    HA   HIS  31           HA       HIS  31   2.565 -14.800  -2.862
  251   1HB   HIS  31          1HB       HIS  31   3.412 -16.948  -2.703
  252   2HB   HIS  31          2HB       HIS  31   2.898 -16.622  -1.059
  253    HD2  HIS  31           HD2      HIS  31   1.822 -18.666  -4.181
  254    HE1  HIS  31           HE1      HIS  31  -0.380 -20.084  -0.843
  255    HE2  HIS  31           HE2      HIS  31   0.138 -20.526  -3.316
  256    HA   PRO  32           HA       PRO  32   3.421 -16.082  -4.768
  257   1HB   PRO  32          1HB       PRO  32   3.590 -16.383  -7.428
  258   2HB   PRO  32          2HB       PRO  32   2.740 -17.593  -6.458
  259   1HG   PRO  32          1HG       PRO  32   1.455 -15.235  -7.882
  260   2HG   PRO  32          2HG       PRO  32   1.085 -16.970  -8.111
  261   1HD   PRO  32          1HD       PRO  32  -0.290 -15.393  -6.327
  262   2HD   PRO  32          2HD       PRO  32   0.037 -17.119  -6.007
  263    H    SER  33           H        SER  33   4.341 -14.696  -7.242
  264    HA   SER  33           HA       SER  33   4.826 -12.232  -5.845
  265   1HB   SER  33          1HB       SER  33   6.772 -12.199  -7.350
  266   2HB   SER  33          2HB       SER  33   6.541 -13.841  -6.720
  267    HG   SER  33           HG       SER  33   5.688 -12.912  -9.247
  268    H    ASP  34           H        ASP  34   2.204 -12.396  -7.387
  269    HA   ASP  34           HA       ASP  34   2.676 -10.192  -9.371
  270   1HB   ASP  34          1HB       ASP  34   2.132 -12.339 -10.385
  271   2HB   ASP  34          2HB       ASP  34   0.682 -12.475  -9.391
  272    H    ILE  35           H        ILE  35   2.396  -8.684  -7.531
  273    HA   ILE  35           HA       ILE  35  -0.501  -8.135  -7.133
  274    HB   ILE  35           HB       ILE  35   0.355  -9.028  -5.154
  275   1HG1  ILE  35          1HG1      ILE  35   0.130  -6.037  -4.712
  276   2HG1  ILE  35          2HG1      ILE  35  -1.246  -7.093  -4.982
  277   1HG2  ILE  35          1HG2      ILE  35   2.451  -6.867  -5.202
  278   2HG2  ILE  35          2HG2      ILE  35   2.134  -7.976  -3.850
  279   3HG2  ILE  35          3HG2      ILE  35   2.709  -8.632  -5.382
  280   1HD1  ILE  35          1HD1      ILE  35  -0.360  -8.487  -2.982
  281   2HD1  ILE  35          2HD1      ILE  35   0.625  -7.063  -2.606
  282   3HD1  ILE  35          3HD1      ILE  35  -1.137  -6.917  -2.665
  283    H    GLU  36           H        GLU  36  -1.158  -6.079  -7.055
  284    HA   GLU  36           HA       GLU  36   0.555  -3.992  -8.306
  285   1HB   GLU  36          1HB       GLU  36  -2.460  -4.074  -8.377
  286   2HB   GLU  36          2HB       GLU  36  -1.326  -3.180  -9.400
  287   1HG   GLU  36          1HG       GLU  36  -0.537  -5.442 -10.261
  288   2HG   GLU  36          2HG       GLU  36  -1.867  -6.169  -9.368
  289    H    VAL  37           H        VAL  37   1.016  -2.318  -6.915
  290    HA   VAL  37           HA       VAL  37  -1.103  -1.282  -5.157
  291    HB   VAL  37           HB       VAL  37   1.672  -1.891  -4.106
  292   1HG1  VAL  37          1HG1      VAL  37  -0.748  -0.917  -2.532
  293   2HG1  VAL  37          2HG1      VAL  37   0.869  -1.244  -1.923
  294   3HG1  VAL  37          3HG1      VAL  37   0.603   0.126  -3.011
  295   1HG2  VAL  37          1HG2      VAL  37  -1.037  -3.207  -3.607
  296   2HG2  VAL  37          2HG2      VAL  37   0.430  -3.949  -4.283
  297   3HG2  VAL  37          3HG2      VAL  37   0.376  -3.467  -2.581
  298    H    ASP  38           H        ASP  38  -1.073  -0.018  -7.146
  299    HA   ASP  38           HA       ASP  38   0.883   2.141  -7.363
  300   1HB   ASP  38          1HB       ASP  38  -1.990   1.914  -8.389
  301   2HB   ASP  38          2HB       ASP  38  -0.822   3.159  -8.803
  302    H    LEU  39           H        LEU  39   0.936   3.803  -5.839
  303    HA   LEU  39           HA       LEU  39  -1.234   3.995  -3.862
  304   1HB   LEU  39          1HB       LEU  39   1.355   5.546  -4.198
  305   2HB   LEU  39          2HB       LEU  39   0.118   5.800  -2.942
  306    HG   LEU  39           HG       LEU  39   0.487   3.263  -2.413
  307   1HD1  LEU  39          1HD1      LEU  39   3.151   3.982  -3.700
  308   2HD1  LEU  39          2HD1      LEU  39   2.844   2.546  -2.714
  309   3HD1  LEU  39          3HD1      LEU  39   2.049   2.722  -4.281
  310   1HD2  LEU  39          1HD2      LEU  39   2.532   5.425  -1.764
  311   2HD2  LEU  39          2HD2      LEU  39   1.005   5.147  -0.897
  312   3HD2  LEU  39          3HD2      LEU  39   2.304   3.944  -0.818
  313    H    LEU  40           H        LEU  40  -2.795   5.585  -3.915
  314    HA   LEU  40           HA       LEU  40  -3.000   7.150  -6.444
  315   1HB   LEU  40          1HB       LEU  40  -3.859   4.645  -6.381
  316   2HB   LEU  40          2HB       LEU  40  -5.175   5.325  -5.442
  317    HG   LEU  40           HG       LEU  40  -5.838   5.101  -7.715
  318   1HD1  LEU  40          1HD1      LEU  40  -5.291   8.075  -7.356
  319   2HD1  LEU  40          2HD1      LEU  40  -6.532   7.322  -8.360
  320   3HD1  LEU  40          3HD1      LEU  40  -6.631   7.179  -6.595
  321   1HD2  LEU  40          1HD2      LEU  40  -3.524   5.085  -8.690
  322   2HD2  LEU  40          2HD2      LEU  40  -4.710   6.024  -9.621
  323   3HD2  LEU  40          3HD2      LEU  40  -3.532   6.858  -8.607
  324    H    LYS  41           H        LYS  41  -3.538   9.251  -5.831
  325    HA   LYS  41           HA       LYS  41  -4.685   9.734  -3.297
  326   1HB   LYS  41          1HB       LYS  41  -4.189  11.542  -5.673
  327   2HB   LYS  41          2HB       LYS  41  -4.380  12.041  -3.970
  328   1HG   LYS  41          1HG       LYS  41  -2.400  11.064  -3.299
  329   2HG   LYS  41          2HG       LYS  41  -2.142  10.118  -4.763
  330   1HD   LYS  41          1HD       LYS  41  -0.740  12.030  -4.668
  331   2HD   LYS  41          2HD       LYS  41  -1.734  12.036  -6.119
  332   1HE   LYS  41          1HE       LYS  41  -3.216  13.682  -5.285
  333   2HE   LYS  41          2HE       LYS  41  -2.608  13.490  -3.625
  334   1HZ   LYS  41          1HZ       LYS  41  -0.573  14.493  -4.299
  335   2HZ   LYS  41          2HZ       LYS  41  -1.104  14.651  -5.862
  336   3HZ   LYS  41          3HZ       LYS  41  -1.850  15.485  -4.633
  337    H    ASN  42           H        ASN  42  -6.174  12.088  -4.687
  338    HA   ASN  42           HA       ASN  42  -8.859  11.078  -4.484
  339   1HB   ASN  42          1HB       ASN  42  -9.497  13.312  -5.196
  340   2HB   ASN  42          2HB       ASN  42  -8.208  13.456  -3.996
  341   1HD2  ASN  42          2HD2      ASN  42  -5.932  13.907  -4.853
  342   2HD2  ASN  42          1HD2      ASN  42  -5.773  14.692  -6.408
  343    H    GLY  43           H        GLY  43  -6.673  11.874  -7.182
  344   1HA   GLY  43          1HA       GLY  43  -7.707   9.757  -8.816
  345   2HA   GLY  43          2HA       GLY  43  -8.277  11.337  -9.395
  346    H    GLU  44           H        GLU  44  -5.164  10.891  -7.751
  347    HA   GLU  44           HA       GLU  44  -3.645  11.192 -10.309
  348   1HB   GLU  44          1HB       GLU  44  -3.940  13.376  -9.208
  349   2HB   GLU  44          2HB       GLU  44  -3.345  12.711  -7.686
  350   1HG   GLU  44          1HG       GLU  44  -1.137  12.232  -8.843
  351   2HG   GLU  44          2HG       GLU  44  -1.771  13.075 -10.269
  352    H    ARG  45           H        ARG  45  -2.106   9.603 -10.461
  353    HA   ARG  45           HA       ARG  45  -1.592   7.816  -8.224
  354   1HB   ARG  45          1HB       ARG  45  -1.577   7.268 -10.791
  355   2HB   ARG  45          2HB       ARG  45   0.056   7.955 -10.748
  356   1HG   ARG  45          1HG       ARG  45   0.419   6.267  -8.727
  357   2HG   ARG  45          2HG       ARG  45  -1.072   5.528  -9.312
  358   1HD   ARG  45          1HD       ARG  45   0.706   4.323 -10.284
  359   2HD   ARG  45          2HD       ARG  45   0.088   5.319 -11.596
  360    HE   ARG  45           HE       ARG  45   2.597   5.643  -9.983
  361   1HH1  ARG  45          1HH2      ARG  45   0.757   6.763 -12.825
  362   2HH1  ARG  45          2HH2      ARG  45   2.121   7.620 -13.494
  363   1HH2  ARG  45          1HH1      ARG  45   4.337   6.742 -10.890
  364   2HH2  ARG  45          2HH1      ARG  45   4.155   7.625 -12.385
  365    H    ILE  46           H        ILE  46   0.348   7.642  -6.964
  366    HA   ILE  46           HA       ILE  46   1.904  10.012  -6.607
  367    HB   ILE  46           HB       ILE  46   2.177   7.118  -5.705
  368   1HG1  ILE  46          1HG1      ILE  46  -0.023   8.101  -4.981
  369   2HG1  ILE  46          2HG1      ILE  46   1.060   7.686  -3.656
  370   1HG2  ILE  46          1HG2      ILE  46   4.237   8.381  -5.450
  371   2HG2  ILE  46          2HG2      ILE  46   3.362   9.673  -4.597
  372   3HG2  ILE  46          3HG2      ILE  46   3.481   8.033  -3.883
  373   1HD1  ILE  46          1HD1      ILE  46   0.863  10.522  -4.652
  374   2HD1  ILE  46          2HD1      ILE  46  -0.233   9.796  -3.467
  375   3HD1  ILE  46          3HD1      ILE  46   1.502   9.888  -3.112
  376    H    GLU  47           H        GLU  47   3.674  10.504  -7.755
  377    HA   GLU  47           HA       GLU  47   4.785   8.621  -9.733
  378   1HB   GLU  47          1HB       GLU  47   5.461  11.524  -9.137
  379   2HB   GLU  47          2HB       GLU  47   6.199  10.512 -10.395
  380   1HG   GLU  47          1HG       GLU  47   3.885  10.098 -11.331
  381   2HG   GLU  47          2HG       GLU  47   3.267  11.321 -10.207
  382    H    LYS  48           H        LYS  48   5.939  10.401  -6.808
  383    HA   LYS  48           HA       LYS  48   8.480   8.966  -6.921
  384   1HB   LYS  48          1HB       LYS  48   7.834  11.487  -6.192
  385   2HB   LYS  48          2HB       LYS  48   7.840  10.759  -4.595
  386   1HG   LYS  48          1HG       LYS  48  10.086  10.745  -6.664
  387   2HG   LYS  48          2HG       LYS  48   9.991  11.742  -5.209
  388   1HD   LYS  48          1HD       LYS  48  10.182   9.746  -3.774
  389   2HD   LYS  48          2HD       LYS  48  10.170   8.694  -5.196
  390   1HE   LYS  48          1HE       LYS  48  12.451   8.937  -4.448
  391   2HE   LYS  48          2HE       LYS  48  12.266   9.734  -6.018
  392   1HZ   LYS  48          1HZ       LYS  48  12.118  11.824  -4.855
  393   2HZ   LYS  48          2HZ       LYS  48  12.318  11.071  -3.401
  394   3HZ   LYS  48          3HZ       LYS  48  13.531  11.055  -4.515
  395    H    VAL  49           H        VAL  49   6.934   6.988  -6.795
  396    HA   VAL  49           HA       VAL  49   6.465   6.055  -4.026
  397    HB   VAL  49           HB       VAL  49   6.245   4.605  -6.702
  398   1HG1  VAL  49          1HG1      VAL  49   5.539   3.733  -3.864
  399   2HG1  VAL  49          2HG1      VAL  49   4.991   2.895  -5.330
  400   3HG1  VAL  49          3HG1      VAL  49   6.715   2.972  -4.960
  401   1HG2  VAL  49          1HG2      VAL  49   4.542   6.323  -6.476
  402   2HG2  VAL  49          2HG2      VAL  49   3.805   4.731  -6.288
  403   3HG2  VAL  49          3HG2      VAL  49   4.108   5.737  -4.854
  404    H    GLU  50           H        GLU  50   7.940   4.829  -2.898
  405    HA   GLU  50           HA       GLU  50  10.187   3.583  -4.367
  406   1HB   GLU  50          1HB       GLU  50  10.761   5.684  -2.934
  407   2HB   GLU  50          2HB       GLU  50  10.447   4.633  -1.540
  408   1HG   GLU  50          1HG       GLU  50  12.185   3.084  -2.284
  409   2HG   GLU  50          2HG       GLU  50  12.417   4.036  -3.766
  410    H    HIS  51           H        HIS  51  10.935   1.604  -3.100
  411    HA   HIS  51           HA       HIS  51   9.061   0.550  -1.145
  412   1HB   HIS  51          1HB       HIS  51   8.610  -1.522  -2.599
  413   2HB   HIS  51          2HB       HIS  51   7.758  -0.049  -3.054
  414    HD2  HIS  51           HD2      HIS  51  11.243  -1.575  -4.259
  415    HE1  HIS  51           HE1      HIS  51   9.024  -0.146  -7.565
  416    HE2  HIS  51           HE2      HIS  51  11.196  -1.294  -6.857
  417    H    SER  52           H        SER  52   9.696  -1.614  -0.430
  418    HA   SER  52           HA       SER  52  12.609  -1.860  -0.212
  419   1HB   SER  52          1HB       SER  52  12.108  -3.680   1.326
  420   2HB   SER  52          2HB       SER  52  11.086  -2.287   1.713
  421    HG   SER  52           HG       SER  52  10.361  -4.619   0.253
  422    H    ASP  53           H        ASP  53  13.491  -4.190  -0.521
  423    HA   ASP  53           HA       ASP  53  13.023  -5.283  -3.139
  424   1HB   ASP  53          1HB       ASP  53  15.139  -5.564  -1.899
  425   2HB   ASP  53          2HB       ASP  53  14.291  -6.437  -0.613
  426    H    LEU  54           H        LEU  54  12.173  -7.539  -3.472
  427    HA   LEU  54           HA       LEU  54   9.679  -8.042  -2.045
  428   1HB   LEU  54          1HB       LEU  54  10.021  -8.651  -4.463
  429   2HB   LEU  54          2HB       LEU  54  11.137  -9.912  -3.936
  430    HG   LEU  54           HG       LEU  54   9.062 -10.913  -4.332
  431   1HD1  LEU  54          1HD1      LEU  54  10.132 -11.725  -2.262
  432   2HD1  LEU  54          2HD1      LEU  54   9.010 -10.690  -1.324
  433   3HD1  LEU  54          3HD1      LEU  54   8.385 -11.974  -2.313
  434   1HD2  LEU  54          1HD2      LEU  54   7.677  -8.864  -2.581
  435   2HD2  LEU  54          2HD2      LEU  54   7.554  -9.024  -4.347
  436   3HD2  LEU  54          3HD2      LEU  54   6.904 -10.271  -3.276
  437    H    SER  55           H        SER  55   9.834  -8.657  -0.048
  438    HA   SER  55           HA       SER  55  12.234 -10.120   0.974
  439   1HB   SER  55          1HB       SER  55  11.867  -7.840   1.856
  440   2HB   SER  55          2HB       SER  55  10.255  -8.314   2.417
  441    HG   SER  55           HG       SER  55  11.848  -8.489   4.056
  442    H    PHE  56           H        PHE  56  10.855 -11.966  -0.172
  443    HA   PHE  56           HA       PHE  56   8.524 -12.867   1.236
  444   1HB   PHE  56          1HB       PHE  56   8.682 -14.871   0.040
  445   2HB   PHE  56          2HB       PHE  56   9.161 -13.622  -1.081
  446    HD1  PHE  56           HD1      PHE  56  11.660 -13.356  -1.608
  447    HD2  PHE  56           HD2      PHE  56  10.033 -16.696   0.567
  448    HE1  PHE  56           HE1      PHE  56  13.803 -14.592  -1.909
  449    HE2  PHE  56           HE2      PHE  56  12.175 -17.937   0.267
  450    HZ   PHE  56           HZ       PHE  56  14.057 -16.882  -0.973
  451    H    SER  57           H        SER  57   8.450 -13.644   3.319
  452    HA   SER  57           HA       SER  57  10.899 -14.043   4.751
  453   1HB   SER  57          1HB       SER  57   8.943 -13.339   5.955
  454   2HB   SER  57          2HB       SER  57   8.091 -14.861   5.565
  455    HG   SER  57           HG       SER  57   9.143 -14.880   7.627
  456    H    LYS  58           H        LYS  58  11.865 -15.943   5.395
  457    HA   LYS  58           HA       LYS  58  11.468 -18.416   3.896
  458   1HB   LYS  58          1HB       LYS  58  13.189 -17.588   6.262
  459   2HB   LYS  58          2HB       LYS  58  13.218 -19.222   5.571
  460   1HG   LYS  58          1HG       LYS  58  14.013 -18.448   3.455
  461   2HG   LYS  58          2HG       LYS  58  13.654 -16.759   3.836
  462   1HD   LYS  58          1HD       LYS  58  15.396 -16.793   5.625
  463   2HD   LYS  58          2HD       LYS  58  15.780 -18.467   5.190
  464   1HE   LYS  58          1HE       LYS  58  17.396 -17.000   4.134
  465   2HE   LYS  58          2HE       LYS  58  16.367 -17.694   2.871
  466   1HZ   LYS  58          1HZ       LYS  58  16.101 -15.010   4.044
  467   2HZ   LYS  58          2HZ       LYS  58  16.714 -15.360   2.557
  468   3HZ   LYS  58          3HZ       LYS  58  15.124 -15.634   2.874
  469    H    ASP  59           H        ASP  59   9.997 -16.952   6.672
  470    HA   ASP  59           HA       ASP  59   8.895 -19.466   7.623
  471   1HB   ASP  59          1HB       ASP  59   8.080 -16.589   8.242
  472   2HB   ASP  59          2HB       ASP  59   7.626 -18.024   9.161
  473    H    TRP  60           H        TRP  60   8.476 -19.342   4.933
  474    HA   TRP  60           HA       TRP  60   6.998 -19.340   3.232
  475   1HB   TRP  60          1HB       TRP  60   5.222 -20.374   5.465
  476   2HB   TRP  60          2HB       TRP  60   4.940 -20.577   3.735
  477    HD1  TRP  60           HD1      TRP  60   7.174 -21.793   6.548
  478    HE1  TRP  60           HE1      TRP  60   8.529 -23.859   5.777
  479    HE3  TRP  60           HE3      TRP  60   5.945 -21.785   1.576
  480    HZ2  TRP  60           HZ2      TRP  60   9.040 -25.260   3.344
  481    HZ3  TRP  60           HZ3      TRP  60   6.890 -23.495   0.058
  482    HH2  TRP  60           HH2      TRP  60   8.448 -25.224   0.924
  483    H    SER  61           H        SER  61   6.988 -17.030   2.890
  484    HA   SER  61           HA       SER  61   4.245 -16.085   2.802
  485   1HB   SER  61          1HB       SER  61   5.139 -15.293   5.083
  486   2HB   SER  61          2HB       SER  61   6.293 -14.298   4.177
  487    HG   SER  61           HG       SER  61   3.470 -14.248   3.853
  488    H    PHE  62           H        PHE  62   4.651 -13.559   1.930
  489    HA   PHE  62           HA       PHE  62   6.809 -13.278   0.024
  490   1HB   PHE  62          1HB       PHE  62   4.728 -14.836  -0.922
  491   2HB   PHE  62          2HB       PHE  62   4.183 -13.225  -1.389
  492    HD1  PHE  62           HD1      PHE  62   5.291 -12.022  -3.192
  493    HD2  PHE  62           HD2      PHE  62   6.929 -15.702  -1.647
  494    HE1  PHE  62           HE1      PHE  62   7.001 -12.009  -4.938
  495    HE2  PHE  62           HE2      PHE  62   8.556 -15.764  -3.475
  496    HZ   PHE  62           HZ       PHE  62   8.669 -13.869  -5.108
  497    H    TYR  63           H        TYR  63   7.115 -10.967   0.192
  498    HA   TYR  63           HA       TYR  63   4.773  -9.223   0.279
  499   1HB   TYR  63          1HB       TYR  63   5.193  -8.332   2.555
  500   2HB   TYR  63          2HB       TYR  63   4.688 -10.018   2.514
  501    HD1  TYR  63           HD1      TYR  63   5.702 -11.647   3.727
  502    HD2  TYR  63           HD2      TYR  63   7.643  -7.881   2.973
  503    HE1  TYR  63           HE1      TYR  63   7.221 -12.069   5.574
  504    HE2  TYR  63           HE2      TYR  63   9.291  -8.354   4.713
  505    HH   TYR  63           HH       TYR  63   9.208 -11.395   6.667
  506    H    LEU  64           H        LEU  64   5.440  -6.976   0.988
  507    HA   LEU  64           HA       LEU  64   8.089  -6.037   0.583
  508   1HB   LEU  64          1HB       LEU  64   7.934  -5.069  -1.622
  509   2HB   LEU  64          2HB       LEU  64   7.739  -6.804  -1.741
  510    HG   LEU  64           HG       LEU  64   5.638  -4.664  -2.006
  511   1HD1  LEU  64          1HD1      LEU  64   6.503  -6.876  -3.931
  512   2HD1  LEU  64          2HD1      LEU  64   5.267  -5.672  -4.259
  513   3HD1  LEU  64          3HD1      LEU  64   6.950  -5.156  -4.072
  514   1HD2  LEU  64          1HD2      LEU  64   5.297  -7.670  -1.808
  515   2HD2  LEU  64          2HD2      LEU  64   4.367  -6.420  -0.923
  516   3HD2  LEU  64          3HD2      LEU  64   4.108  -6.699  -2.643
  517    H    LEU  65           H        LEU  65   8.193  -3.824   0.985
  518    HA   LEU  65           HA       LEU  65   5.728  -2.576   2.069
  519   1HB   LEU  65          1HB       LEU  65   8.010  -3.134   3.311
  520   2HB   LEU  65          2HB       LEU  65   8.582  -1.674   2.507
  521    HG   LEU  65           HG       LEU  65   6.261  -1.984   4.470
  522   1HD1  LEU  65          1HD1      LEU  65   8.930  -0.555   4.658
  523   2HD1  LEU  65          2HD1      LEU  65   7.678  -0.584   5.913
  524   3HD1  LEU  65          3HD1      LEU  65   8.498  -2.086   5.445
  525   1HD2  LEU  65          1HD2      LEU  65   7.095   0.366   2.765
  526   2HD2  LEU  65          2HD2      LEU  65   5.467  -0.234   3.109
  527   3HD2  LEU  65          3HD2      LEU  65   6.358   0.635   4.360
  528    H    TYR  66           H        TYR  66   4.987  -0.650   1.108
  529    HA   TYR  66           HA       TYR  66   6.541   0.408  -1.193
  530   1HB   TYR  66          1HB       TYR  66   3.519   0.082  -1.204
  531   2HB   TYR  66          2HB       TYR  66   4.597   0.336  -2.556
  532    HD1  TYR  66           HD1      TYR  66   4.931  -1.575  -3.977
  533    HD2  TYR  66           HD2      TYR  66   3.778  -2.258   0.142
  534    HE1  TYR  66           HE1      TYR  66   3.832  -3.695  -4.598
  535    HE2  TYR  66           HE2      TYR  66   2.827  -4.412  -0.500
  536    HH   TYR  66           HH       TYR  66   2.298  -5.272  -3.947
  537    H    TYR  67           H        TYR  67   7.184   2.238  -0.123
  538    HA   TYR  67           HA       TYR  67   5.120   3.944   1.143
  539   1HB   TYR  67          1HB       TYR  67   7.200   4.938   2.259
  540   2HB   TYR  67          2HB       TYR  67   6.468   3.434   2.738
  541    HD1  TYR  67           HD1      TYR  67   8.178   2.177   3.702
  542    HD2  TYR  67           HD2      TYR  67   8.911   4.104  -0.063
  543    HE1  TYR  67           HE1      TYR  67  10.236   0.826   3.407
  544    HE2  TYR  67           HE2      TYR  67  10.961   2.754  -0.359
  545    HH   TYR  67           HH       TYR  67  12.287   1.063   0.491
  546    H    THR  68           H        THR  68   5.106   6.097   0.922
  547    HA   THR  68           HA       THR  68   6.956   7.470  -1.001
  548    HB   THR  68           HB       THR  68   4.965   6.860  -2.113
  549    HG1  THR  68           HG1      THR  68   6.132   8.693  -2.684
  550   1HG2  THR  68          1HG2      THR  68   2.849   8.023  -1.670
  551   2HG2  THR  68          2HG2      THR  68   3.309   7.015  -0.286
  552   3HG2  THR  68          3HG2      THR  68   3.531   8.781  -0.228
  553    H    GLU  69           H        GLU  69   7.019   9.868  -0.675
  554    HA   GLU  69           HA       GLU  69   6.648  10.796   2.116
  555   1HB   GLU  69          1HB       GLU  69   8.078  11.921  -0.288
  556   2HB   GLU  69          2HB       GLU  69   7.998  12.717   1.300
  557   1HG   GLU  69          1HG       GLU  69   9.073  10.806   2.330
  558   2HG   GLU  69          2HG       GLU  69   9.232   9.984   0.760
  559    H    PHE  70           H        PHE  70   4.205  10.686   1.728
  560    HA   PHE  70           HA       PHE  70   3.071  12.368  -0.291
  561   1HB   PHE  70          1HB       PHE  70   1.017  11.682   0.401
  562   2HB   PHE  70          2HB       PHE  70   2.001  10.265   0.738
  563    HD1  PHE  70           HD1      PHE  70   2.946  10.346   3.272
  564    HD2  PHE  70           HD2      PHE  70  -0.580  12.432   1.955
  565    HE1  PHE  70           HE1      PHE  70   1.940  10.122   5.536
  566    HE2  PHE  70           HE2      PHE  70  -1.218  12.759   4.313
  567    HZ   PHE  70           HZ       PHE  70   0.008  11.562   6.119
  568    H    THR  71           H        THR  71   2.199  14.308  -0.207
  569    HA   THR  71           HA       THR  71   2.204  15.920   2.296
  570    HB   THR  71           HB       THR  71   2.140  16.860  -0.550
  571    HG1  THR  71           HG1      THR  71   4.318  17.339  -0.065
  572   1HG2  THR  71          1HG2      THR  71   2.687  18.244   2.114
  573   2HG2  THR  71          2HG2      THR  71   2.782  18.998   0.514
  574   3HG2  THR  71          3HG2      THR  71   1.216  18.457   1.145
  575    HA   PRO  72           HA       PRO  72  -2.355  15.393   1.418
  576   1HB   PRO  72          1HB       PRO  72  -3.345  15.866   3.902
  577   2HB   PRO  72          2HB       PRO  72  -2.555  14.342   3.446
  578   1HG   PRO  72          1HG       PRO  72  -1.369  16.684   4.938
  579   2HG   PRO  72          2HG       PRO  72  -1.181  14.958   5.314
  580   1HD   PRO  72          1HD       PRO  72   0.648  16.528   3.911
  581   2HD   PRO  72          2HD       PRO  72   0.539  14.755   3.721
  582    H    THR  73           H        THR  73  -1.847  17.301   0.070
  583    HA   THR  73           HA       THR  73  -1.863  19.965   1.056
  584    HB   THR  73           HB       THR  73  -2.367  20.584  -1.310
  585    HG1  THR  73           HG1      THR  73  -2.389  17.766  -1.663
  586   1HG2  THR  73          1HG2      THR  73  -0.255  19.775  -2.229
  587   2HG2  THR  73          2HG2      THR  73  -0.031  20.220  -0.526
  588   3HG2  THR  73          3HG2      THR  73  -0.154  18.508  -0.995
  589    H    GLU  74           H        GLU  74  -3.459  20.697   2.306
  590    HA   GLU  74           HA       GLU  74  -5.431  21.222   3.154
  591   1HB   GLU  74          1HB       GLU  74  -5.685  22.434   1.023
  592   2HB   GLU  74          2HB       GLU  74  -6.531  21.061   0.314
  593   1HG   GLU  74          1HG       GLU  74  -8.282  21.268   2.122
  594   2HG   GLU  74          2HG       GLU  74  -7.405  22.666   2.760
  595    H    LYS  75           H        LYS  75  -7.234  19.307   0.820
  596    HA   LYS  75           HA       LYS  75  -7.512  17.050   2.735
  597   1HB   LYS  75          1HB       LYS  75  -9.400  18.546   3.057
  598   2HB   LYS  75          2HB       LYS  75  -9.749  18.567   1.333
  599   1HG   LYS  75          1HG       LYS  75  -9.692  15.823   2.454
  600   2HG   LYS  75          2HG       LYS  75 -10.831  16.855   3.303
  601   1HD   LYS  75          1HD       LYS  75 -12.119  17.339   1.418
  602   2HD   LYS  75          2HD       LYS  75 -10.872  16.859   0.271
  603   1HE   LYS  75          1HE       LYS  75 -12.403  14.926   2.069
  604   2HE   LYS  75          2HE       LYS  75 -12.723  15.252   0.356
  605   1HZ   LYS  75          1HZ       LYS  75 -10.353  13.958   1.495
  606   2HZ   LYS  75          2HZ       LYS  75 -11.432  13.358   0.425
  607   3HZ   LYS  75          3HZ       LYS  75 -10.391  14.553  -0.041
  608    H    ASP  76           H        ASP  76  -5.785  17.463   0.372
  609    HA   ASP  76           HA       ASP  76  -6.824  15.756  -1.715
  610   1HB   ASP  76          1HB       ASP  76  -4.932  17.336  -1.974
  611   2HB   ASP  76          2HB       ASP  76  -3.946  16.249  -0.982
  612    H    GLU  77           H        GLU  77  -7.448  13.724  -1.275
  613    HA   GLU  77           HA       GLU  77  -6.627  12.334   1.143
  614   1HB   GLU  77          1HB       GLU  77  -8.973  12.487  -0.099
  615   2HB   GLU  77          2HB       GLU  77  -8.333  11.158  -1.061
  616   1HG   GLU  77          1HG       GLU  77  -9.593  10.183   0.712
  617   2HG   GLU  77          2HG       GLU  77  -7.901   9.929   1.149
  618    H    TYR  78           H        TYR  78  -5.548  10.268   1.183
  619    HA   TYR  78           HA       TYR  78  -4.158   9.409  -1.315
  620   1HB   TYR  78          1HB       TYR  78  -2.987   9.934   1.397
  621   2HB   TYR  78          2HB       TYR  78  -2.258   8.798   0.260
  622    HD1  TYR  78           HD1      TYR  78  -0.589   9.658  -1.209
  623    HD2  TYR  78           HD2      TYR  78  -3.510  12.312   0.486
  624    HE1  TYR  78           HE1      TYR  78   0.589  11.632  -2.179
  625    HE2  TYR  78           HE2      TYR  78  -2.495  14.225  -0.725
  626    HH   TYR  78           HH       TYR  78   0.581  13.858  -2.549
  627    H    ALA  79           H        ALA  79  -4.006   7.256  -1.659
  628    HA   ALA  79           HA       ALA  79  -5.042   5.337   0.320
  629   1HB   ALA  79          1HB       ALA  79  -7.042   6.208  -0.931
  630   2HB   ALA  79          2HB       ALA  79  -6.275   5.737  -2.455
  631   3HB   ALA  79          3HB       ALA  79  -6.727   4.498  -1.290
  632    H    CYS  80           H        CYS  80  -5.009   3.084  -0.718
  633    HA   CYS  80           HA       CYS  80  -2.565   2.731  -2.416
  634   1HB   CYS  80          1HB       CYS  80  -3.602   0.826  -0.307
  635   2HB   CYS  80          2HB       CYS  80  -2.064   0.750  -1.162
  636    H    ARG  81           H        ARG  81  -3.003   1.592  -4.327
  637    HA   ARG  81           HA       ARG  81  -5.523   0.194  -4.789
  638   1HB   ARG  81          1HB       ARG  81  -4.116   0.971  -6.670
  639   2HB   ARG  81          2HB       ARG  81  -2.796  -0.048  -6.084
  640   1HG   ARG  81          1HG       ARG  81  -4.305  -2.081  -6.417
  641   2HG   ARG  81          2HG       ARG  81  -5.456  -1.006  -7.207
  642   1HD   ARG  81          1HD       ARG  81  -2.603  -1.605  -8.064
  643   2HD   ARG  81          2HD       ARG  81  -4.095  -2.244  -8.787
  644    HE   ARG  81           HE       ARG  81  -3.810   0.683  -8.723
  645   1HH1  ARG  81          1HH2      ARG  81  -3.371  -2.275 -10.720
  646   2HH1  ARG  81          2HH2      ARG  81  -3.103  -1.350 -12.166
  647   1HH2  ARG  81          1HH1      ARG  81  -3.362   1.812 -10.650
  648   2HH2  ARG  81          2HH1      ARG  81  -3.117   0.942 -12.142
  649    H    VAL  82           H        VAL  82  -5.911  -2.059  -4.154
  650    HA   VAL  82           HA       VAL  82  -3.491  -3.637  -3.498
  651    HB   VAL  82           HB       VAL  82  -6.066  -3.736  -1.884
  652   1HG1  VAL  82          1HG1      VAL  82  -4.738  -5.862  -2.217
  653   2HG1  VAL  82          2HG1      VAL  82  -3.339  -5.036  -1.496
  654   3HG1  VAL  82          3HG1      VAL  82  -4.820  -5.317  -0.542
  655   1HG2  VAL  82          1HG2      VAL  82  -4.883  -1.666  -1.281
  656   2HG2  VAL  82          2HG2      VAL  82  -4.695  -2.867  -0.006
  657   3HG2  VAL  82          3HG2      VAL  82  -3.354  -2.561  -1.126
  658    H    ASN  83           H        ASN  83  -3.474  -4.706  -5.404
  659    HA   ASN  83           HA       ASN  83  -5.724  -6.611  -5.763
  660   1HB   ASN  83          1HB       ASN  83  -5.975  -4.829  -7.461
  661   2HB   ASN  83          2HB       ASN  83  -4.362  -5.167  -8.065
  662   1HD2  ASN  83          2HD2      ASN  83  -7.365  -7.004  -7.195
  663   2HD2  ASN  83          1HD2      ASN  83  -7.268  -8.123  -8.533
  664    H    HIS  84           H        HIS  84  -4.459  -8.176  -4.688
  665    HA   HIS  84           HA       HIS  84  -1.870  -9.090  -5.799
  666   1HB   HIS  84          1HB       HIS  84  -2.379  -9.519  -3.468
  667   2HB   HIS  84          2HB       HIS  84  -3.883 -10.327  -3.912
  668    HD2  HIS  84           HD2      HIS  84   0.001 -10.967  -4.426
  669    HE1  HIS  84           HE1      HIS  84  -2.146 -14.611  -4.698
  670    HE2  HIS  84           HE2      HIS  84   0.208 -13.553  -4.705
  671    H    VAL  85           H        VAL  85  -1.889 -11.064  -7.197
  672    HA   VAL  85           HA       VAL  85  -3.709 -10.998  -9.252
  673    HB   VAL  85           HB       VAL  85  -1.555 -12.054  -9.397
  674   1HG1  VAL  85          1HG1      VAL  85  -1.486 -13.332  -7.285
  675   2HG1  VAL  85          2HG1      VAL  85  -2.725 -14.448  -7.910
  676   3HG1  VAL  85          3HG1      VAL  85  -1.133 -14.357  -8.680
  677   1HG2  VAL  85          1HG2      VAL  85  -3.269 -12.538 -11.102
  678   2HG2  VAL  85          2HG2      VAL  85  -2.122 -13.874 -10.895
  679   3HG2  VAL  85          3HG2      VAL  85  -3.749 -13.996 -10.201
  680    H    THR  86           H        THR  86  -4.083 -12.869  -6.239
  681    HA   THR  86           HA       THR  86  -6.355 -14.311  -7.317
  682    HB   THR  86           HB       THR  86  -4.611 -15.147  -5.637
  683    HG1  THR  86           HG1      THR  86  -6.419 -16.260  -6.437
  684   1HG2  THR  86          1HG2      THR  86  -6.727 -14.251  -3.657
  685   2HG2  THR  86          2HG2      THR  86  -5.158 -15.026  -3.344
  686   3HG2  THR  86          3HG2      THR  86  -5.221 -13.337  -3.890
  687    H    LEU  87           H        LEU  87  -6.080 -11.140  -5.894
  688    HA   LEU  87           HA       LEU  87  -8.858 -11.021  -4.986
  689   1HB   LEU  87          1HB       LEU  87  -6.656  -9.028  -5.480
  690   2HB   LEU  87          2HB       LEU  87  -8.320  -8.480  -5.577
  691    HG   LEU  87           HG       LEU  87  -8.823  -9.201  -3.338
  692   1HD1  LEU  87          1HD1      LEU  87  -5.930 -10.116  -3.185
  693   2HD1  LEU  87          2HD1      LEU  87  -7.059 -10.007  -1.817
  694   3HD1  LEU  87          3HD1      LEU  87  -7.351 -11.171  -3.118
  695   1HD2  LEU  87          1HD2      LEU  87  -7.890  -6.950  -3.707
  696   2HD2  LEU  87          2HD2      LEU  87  -7.366  -7.586  -2.137
  697   3HD2  LEU  87          3HD2      LEU  87  -6.241  -7.582  -3.510
  698    H    SER  88           H        SER  88 -10.429 -11.464  -6.388
  699    HA   SER  88           HA       SER  88 -10.255 -10.871  -9.242
  700   1HB   SER  88          1HB       SER  88 -12.560 -11.867  -7.527
  701   2HB   SER  88          2HB       SER  88 -12.508 -11.835  -9.301
  702    HG   SER  88           HG       SER  88 -10.692 -13.252  -7.636
  703    H    GLN  89           H        GLN  89 -10.500  -8.756  -6.757
  704    HA   GLN  89           HA       GLN  89 -11.901  -6.790  -8.382
  705   1HB   GLN  89          1HB       GLN  89 -13.121  -5.967  -6.356
  706   2HB   GLN  89          2HB       GLN  89 -13.752  -7.439  -7.106
  707   1HG   GLN  89          1HG       GLN  89 -12.819  -8.832  -5.350
  708   2HG   GLN  89          2HG       GLN  89 -11.946  -7.460  -4.659
  709   1HE2  GLN  89          2HE2      GLN  89 -15.355  -8.285  -5.564
  710   2HE2  GLN  89          1HE2      GLN  89 -16.051  -7.563  -4.130
  711    HA   PRO  90           HA       PRO  90  -8.099  -5.044  -6.622
  712   1HB   PRO  90          1HB       PRO  90  -7.897  -2.747  -8.055
  713   2HB   PRO  90          2HB       PRO  90  -7.677  -4.349  -8.815
  714   1HG   PRO  90          1HG       PRO  90 -10.183  -2.675  -8.850
  715   2HG   PRO  90          2HG       PRO  90  -9.361  -3.473 -10.218
  716   1HD   PRO  90          1HD       PRO  90 -11.479  -4.606  -8.893
  717   2HD   PRO  90          2HD       PRO  90 -10.151  -5.600  -9.571
  718    H    LYS  91           H        LYS  91  -8.316  -4.391  -4.542
  719    HA   LYS  91           HA       LYS  91 -10.550  -2.693  -3.677
  720   1HB   LYS  91          1HB       LYS  91  -8.319  -4.201  -2.262
  721   2HB   LYS  91          2HB       LYS  91  -9.460  -3.147  -1.419
  722   1HG   LYS  91          1HG       LYS  91 -11.354  -4.508  -2.268
  723   2HG   LYS  91          2HG       LYS  91 -10.188  -5.596  -3.057
  724   1HD   LYS  91          1HD       LYS  91  -9.169  -6.102  -0.842
  725   2HD   LYS  91          2HD       LYS  91 -10.269  -4.955  -0.065
  726   1HE   LYS  91          1HE       LYS  91 -11.022  -7.278   0.252
  727   2HE   LYS  91          2HE       LYS  91 -12.212  -6.308  -0.634
  728   1HZ   LYS  91          1HZ       LYS  91 -11.522  -7.298  -2.633
  729   2HZ   LYS  91          2HZ       LYS  91 -10.282  -8.117  -1.911
  730   3HZ   LYS  91          3HZ       LYS  91 -11.849  -8.502  -1.561
  731    H    ILE  92           H        ILE  92 -10.117  -0.565  -4.443
  732    HA   ILE  92           HA       ILE  92  -7.522   0.643  -3.871
  733    HB   ILE  92           HB       ILE  92  -9.973   2.095  -4.890
  734   1HG1  ILE  92          1HG1      ILE  92  -9.842   0.254  -6.406
  735   2HG1  ILE  92          2HG1      ILE  92  -9.209   1.702  -7.176
  736   1HG2  ILE  92          1HG2      ILE  92  -6.953   2.483  -5.139
  737   2HG2  ILE  92          2HG2      ILE  92  -8.171   3.461  -5.982
  738   3HG2  ILE  92          3HG2      ILE  92  -8.081   3.481  -4.212
  739   1HD1  ILE  92          1HD1      ILE  92  -6.891   0.920  -6.797
  740   2HD1  ILE  92          2HD1      ILE  92  -7.519  -0.556  -6.019
  741   3HD1  ILE  92          3HD1      ILE  92  -7.848  -0.242  -7.730
  742    H    VAL  93           H        VAL  93  -7.931  -0.012  -1.511
  743    HA   VAL  93           HA       VAL  93  -9.914   1.589  -0.058
  744    HB   VAL  93           HB       VAL  93  -8.009  -0.640   0.698
  745   1HG1  VAL  93          1HG1      VAL  93  -9.899   0.916   2.519
  746   2HG1  VAL  93          2HG1      VAL  93  -9.188  -0.663   2.910
  747   3HG1  VAL  93          3HG1      VAL  93  -8.137   0.735   2.695
  748   1HG2  VAL  93          1HG2      VAL  93 -11.058  -0.440   0.715
  749   2HG2  VAL  93          2HG2      VAL  93 -10.126  -1.136  -0.618
  750   3HG2  VAL  93          3HG2      VAL  93 -10.082  -1.897   0.984
  751    H    LYS  94           H        LYS  94  -9.528   3.186   1.394
  752    HA   LYS  94           HA       LYS  94  -7.277   4.854   0.945
  753   1HB   LYS  94          1HB       LYS  94  -8.225   6.326   2.560
  754   2HB   LYS  94          2HB       LYS  94  -9.525   5.679   1.553
  755   1HG   LYS  94          1HG       LYS  94 -10.106   4.060   3.365
  756   2HG   LYS  94          2HG       LYS  94  -8.782   4.704   4.357
  757   1HD   LYS  94          1HD       LYS  94  -9.828   6.960   4.277
  758   2HD   LYS  94          2HD       LYS  94 -11.206   6.269   3.391
  759   1HE   LYS  94          1HE       LYS  94 -11.693   4.763   5.284
  760   2HE   LYS  94          2HE       LYS  94 -10.262   5.353   6.153
  761   1HZ   LYS  94          1HZ       LYS  94 -11.248   7.504   6.243
  762   2HZ   LYS  94          2HZ       LYS  94 -12.577   6.996   5.408
  763   3HZ   LYS  94          3HZ       LYS  94 -12.263   6.392   6.910
  764    H    TRP  95           H        TRP  95  -5.858   5.727   2.608
  765    HA   TRP  95           HA       TRP  95  -4.579   3.664   4.247
  766   1HB   TRP  95          1HB       TRP  95  -2.925   4.970   3.423
  767   2HB   TRP  95          2HB       TRP  95  -3.976   6.317   3.148
  768    HD1  TRP  95           HD1      TRP  95  -2.638   4.928   6.528
  769    HE1  TRP  95           HE1      TRP  95  -1.806   6.984   7.895
  770    HE3  TRP  95           HE3      TRP  95  -3.316   8.619   3.046
  771    HZ2  TRP  95           HZ2      TRP  95  -1.895   9.820   7.654
  772    HZ3  TRP  95           HZ3      TRP  95  -2.894  10.976   3.642
  773    HH2  TRP  95           HH2      TRP  95  -2.377  11.601   5.977
  774    H    ASP  96           H        ASP  96  -5.279   6.932   5.341
  775    HA   ASP  96           HA       ASP  96  -7.324   6.616   7.203
  776   1HB   ASP  96          1HB       ASP  96  -5.490   4.949   8.215
  777   2HB   ASP  96          2HB       ASP  96  -4.613   6.420   8.592
  778    H    ARG  97           H        ARG  97  -6.292   8.375   9.189
  779    HA   ARG  97           HA       ARG  97  -4.315  10.084   8.233
  780   1HB   ARG  97          1HB       ARG  97  -5.630  12.202   8.347
  781   2HB   ARG  97          2HB       ARG  97  -5.818  11.237   6.880
  782   1HG   ARG  97          1HG       ARG  97  -8.012  10.446   7.595
  783   2HG   ARG  97          2HG       ARG  97  -7.849  11.288   9.154
  784   1HD   ARG  97          1HD       ARG  97  -7.712  13.447   8.020
  785   2HD   ARG  97          2HD       ARG  97  -7.767  12.674   6.436
  786    HE   ARG  97           HE       ARG  97  -9.946  12.909   8.463
  787   1HH1  ARG  97          1HH2      ARG  97  -9.094  11.952   5.102
  788   2HH1  ARG  97          2HH2      ARG  97 -10.719  12.144   4.540
  789   1HH2  ARG  97          1HH1      ARG  97 -12.061  13.077   7.676
  790   2HH2  ARG  97          2HH1      ARG  97 -12.422  12.709   6.009
  791    H    ASP  98           H        ASP  98  -3.197  10.469   9.989
  792    HA   ASP  98           HA       ASP  98  -3.861   9.918  12.631
  793   1HB   ASP  98          1HB       ASP  98  -1.575  10.232  11.780
  794   2HB   ASP  98          2HB       ASP  98  -1.912  11.944  11.474
  795    H    MET  99           H        MET  99  -4.363  12.919  10.758
  796    HA   MET  99           HA       MET  99  -6.291  13.849  12.753
  797   1HB   MET  99          1HB       MET  99  -4.073  14.834  13.417
  798   2HB   MET  99          2HB       MET  99  -3.931  15.542  11.806
  799   1HG   MET  99          1HG       MET  99  -4.703  17.199  13.416
  800   2HG   MET  99          2HG       MET  99  -5.935  16.905  12.194
  801   1HE   MET  99          1HE       MET  99  -4.824  16.518  15.892
  802   2HE   MET  99          2HE       MET  99  -6.181  15.647  16.643
  803   3HE   MET  99          3HE       MET  99  -5.084  14.790  15.543
  Start of MODEL    7
    1   1H    MET   0          1H        MET   0  -5.933 -21.734  -7.224
    2   2H    MET   0          2H        MET   0  -5.306 -20.637  -6.173
    3   3H    MET   0          3H        MET   0  -4.322 -21.786  -6.838
    4    HA   MET   0           HA       MET   0  -6.504 -22.176  -4.943
    5   1HB   MET   0          1HB       MET   0  -4.743 -24.290  -6.237
    6   2HB   MET   0          2HB       MET   0  -5.870 -24.552  -4.892
    7   1HG   MET   0          1HG       MET   0  -7.727 -23.663  -6.339
    8   2HG   MET   0          2HG       MET   0  -6.597 -23.639  -7.702
    9   1HE   MET   0          1HE       MET   0  -9.409 -24.989  -7.792
   10   2HE   MET   0          2HE       MET   0  -8.279 -25.061  -9.165
   11   3HE   MET   0          3HE       MET   0  -9.053 -26.547  -8.570
   12    H    ILE   1           H        ILE   1  -5.863 -22.818  -2.855
   13    HA   ILE   1           HA       ILE   1  -4.922 -22.142  -0.972
   14    HB   ILE   1           HB       ILE   1  -2.241 -23.009  -2.055
   15   1HG1  ILE   1          1HG1      ILE   1  -3.187 -25.175  -0.663
   16   2HG1  ILE   1          2HG1      ILE   1  -4.698 -24.601  -1.358
   17   1HG2  ILE   1          1HG2      ILE   1  -3.441 -23.080   0.752
   18   2HG2  ILE   1          2HG2      ILE   1  -1.815 -23.614   0.289
   19   3HG2  ILE   1          3HG2      ILE   1  -2.228 -21.907   0.215
   20   1HD1  ILE   1          1HD1      ILE   1  -2.128 -25.344  -2.831
   21   2HD1  ILE   1          2HD1      ILE   1  -3.635 -26.281  -2.779
   22   3HD1  ILE   1          3HD1      ILE   1  -3.585 -24.734  -3.640
   23    H    GLN   2           H        GLN   2  -5.550 -20.084  -2.502
   24    HA   GLN   2           HA       GLN   2  -3.286 -18.224  -2.765
   25   1HB   GLN   2          1HB       GLN   2  -4.957 -16.606  -3.508
   26   2HB   GLN   2          2HB       GLN   2  -4.782 -18.010  -4.546
   27   1HG   GLN   2          1HG       GLN   2  -7.066 -17.704  -2.526
   28   2HG   GLN   2          2HG       GLN   2  -7.143 -17.134  -4.181
   29   1HE2  GLN   2          2HE2      GLN   2  -8.071 -19.679  -2.316
   30   2HE2  GLN   2          1HE2      GLN   2  -8.129 -20.924  -3.545
   31    H    ARG   3           H        ARG   3  -2.613 -17.021  -1.144
   32    HA   ARG   3           HA       ARG   3  -4.189 -16.751   1.334
   33   1HB   ARG   3          1HB       ARG   3  -1.397 -15.971   0.502
   34   2HB   ARG   3          2HB       ARG   3  -2.083 -15.663   2.113
   35   1HG   ARG   3          1HG       ARG   3  -2.418 -18.123   2.399
   36   2HG   ARG   3          2HG       ARG   3  -1.688 -18.408   0.798
   37   1HD   ARG   3          1HD       ARG   3   0.373 -17.205   1.571
   38   2HD   ARG   3          2HD       ARG   3  -0.391 -17.035   3.174
   39    HE   ARG   3           HE       ARG   3  -0.294 -19.791   2.417
   40   1HH1  ARG   3          1HH2      ARG   3   1.731 -17.067   3.407
   41   2HH1  ARG   3          2HH2      ARG   3   2.834 -18.029   4.351
   42   1HH2  ARG   3          1HH1      ARG   3   1.261 -21.108   3.551
   43   2HH2  ARG   3          2HH1      ARG   3   2.623 -20.357   4.346
   44    H    THR   4           H        THR   4  -5.051 -14.823   2.050
   45    HA   THR   4           HA       THR   4  -5.617 -12.826   0.041
   46    HB   THR   4           HB       THR   4  -6.341 -12.949   2.999
   47    HG1  THR   4           HG1      THR   4  -7.111 -14.722   1.830
   48   1HG2  THR   4          1HG2      THR   4  -8.209 -11.484   2.418
   49   2HG2  THR   4          2HG2      THR   4  -6.685 -10.673   2.027
   50   3HG2  THR   4          3HG2      THR   4  -7.673 -11.400   0.733
   51    HA   PRO   5           HA       PRO   5  -2.179 -10.170   1.323
   52   1HB   PRO   5          1HB       PRO   5  -2.952  -7.774   0.217
   53   2HB   PRO   5          2HB       PRO   5  -2.321  -9.146  -0.737
   54   1HG   PRO   5          1HG       PRO   5  -5.208  -8.382  -0.250
   55   2HG   PRO   5          2HG       PRO   5  -4.419  -8.777  -1.803
   56   1HD   PRO   5          1HD       PRO   5  -5.851 -10.610  -0.407
   57   2HD   PRO   5          2HD       PRO   5  -4.365 -11.096  -1.272
   58    H    LYS   6           H        LYS   6  -2.180  -9.959   3.513
   59    HA   LYS   6           HA       LYS   6  -4.261  -8.523   4.965
   60   1HB   LYS   6          1HB       LYS   6  -3.002 -10.455   5.945
   61   2HB   LYS   6          2HB       LYS   6  -1.531  -9.465   5.906
   62   1HG   LYS   6          1HG       LYS   6  -2.983  -7.695   7.179
   63   2HG   LYS   6          2HG       LYS   6  -4.087  -9.038   7.494
   64   1HD   LYS   6          1HD       LYS   6  -2.230 -10.286   8.592
   65   2HD   LYS   6          2HD       LYS   6  -1.120  -8.951   8.240
   66   1HE   LYS   6          1HE       LYS   6  -3.589  -8.800  10.033
   67   2HE   LYS   6          2HE       LYS   6  -1.901  -8.853  10.566
   68   1HZ   LYS   6          1HZ       LYS   6  -1.579  -6.779   9.315
   69   2HZ   LYS   6          2HZ       LYS   6  -3.196  -6.698   9.053
   70   3HZ   LYS   6          3HZ       LYS   6  -2.617  -6.634  10.594
   71    H    ILE   7           H        ILE   7  -4.364  -6.407   4.700
   72    HA   ILE   7           HA       ILE   7  -2.066  -4.748   4.016
   73    HB   ILE   7           HB       ILE   7  -3.607  -3.019   3.686
   74   1HG1  ILE   7          1HG1      ILE   7  -5.132  -3.099   5.534
   75   2HG1  ILE   7          2HG1      ILE   7  -6.004  -3.131   4.014
   76   1HG2  ILE   7          1HG2      ILE   7  -4.864  -5.564   2.600
   77   2HG2  ILE   7          2HG2      ILE   7  -5.006  -3.925   1.947
   78   3HG2  ILE   7          3HG2      ILE   7  -3.433  -4.740   1.954
   79   1HD1  ILE   7          1HD1      ILE   7  -6.393  -5.594   4.286
   80   2HD1  ILE   7          2HD1      ILE   7  -5.655  -5.483   5.903
   81   3HD1  ILE   7          3HD1      ILE   7  -7.118  -4.574   5.534
   82    H    GLN   8           H        GLN   8  -0.920  -3.379   5.479
   83    HA   GLN   8           HA       GLN   8  -2.344  -2.433   7.857
   84   1HB   GLN   8          1HB       GLN   8  -0.117  -2.736   9.005
   85   2HB   GLN   8          2HB       GLN   8  -1.178  -4.139   8.910
   86   1HG   GLN   8          1HG       GLN   8   1.114  -3.678   6.971
   87   2HG   GLN   8          2HG       GLN   8   1.345  -4.460   8.541
   88   1HE2  GLN   8          2HE2      GLN   8   1.910  -5.632   5.973
   89   2HE2  GLN   8          1HE2      GLN   8   0.914  -7.070   5.881
   90    H    VAL   9           H        VAL   9  -2.633  -0.626   6.456
   91    HA   VAL   9           HA       VAL   9  -0.311   0.744   5.353
   92    HB   VAL   9           HB       VAL   9  -3.259   1.481   5.387
   93   1HG1  VAL   9          1HG1      VAL   9  -0.912   2.625   3.807
   94   2HG1  VAL   9          2HG1      VAL   9  -2.620   2.954   3.469
   95   3HG1  VAL   9          3HG1      VAL   9  -1.905   3.480   5.001
   96   1HG2  VAL   9          1HG2      VAL   9  -1.552   0.139   3.243
   97   2HG2  VAL   9          2HG2      VAL   9  -2.885  -0.613   4.144
   98   3HG2  VAL   9          3HG2      VAL   9  -3.218   0.709   3.021
   99    H    TYR  10           H        TYR  10   0.759   2.402   6.236
  100    HA   TYR  10           HA       TYR  10  -0.098   3.388   8.917
  101   1HB   TYR  10          1HB       TYR  10   2.677   3.165   7.776
  102   2HB   TYR  10          2HB       TYR  10   2.233   3.447   9.452
  103    HD1  TYR  10           HD1      TYR  10   0.362   1.414  10.198
  104    HD2  TYR  10           HD2      TYR  10   3.711   1.117   7.501
  105    HE1  TYR  10           HE1      TYR  10   0.621  -0.986  10.772
  106    HE2  TYR  10           HE2      TYR  10   3.987  -1.271   8.094
  107    HH   TYR  10           HH       TYR  10   1.928  -2.858  10.573
  108    H    SER  11           H        SER  11   0.521   5.414   9.560
  109    HA   SER  11           HA       SER  11   1.292   7.487   7.550
  110   1HB   SER  11          1HB       SER  11   0.751   9.047   9.489
  111   2HB   SER  11          2HB       SER  11  -0.614   8.234   8.720
  112    HG   SER  11           HG       SER  11  -0.727   8.155  10.999
  113    H    ARG  12           H        ARG  12   3.517   7.266   7.390
  114    HA   ARG  12           HA       ARG  12   5.115   6.212   9.555
  115   1HB   ARG  12          1HB       ARG  12   5.521   5.987   7.048
  116   2HB   ARG  12          2HB       ARG  12   6.046   7.668   7.094
  117   1HG   ARG  12          1HG       ARG  12   7.721   6.872   8.955
  118   2HG   ARG  12          2HG       ARG  12   7.333   5.250   8.342
  119   1HD   ARG  12          1HD       ARG  12   7.802   6.415   5.981
  120   2HD   ARG  12          2HD       ARG  12   8.688   7.586   6.966
  121    HE   ARG  12           HE       ARG  12   9.595   5.068   7.767
  122   1HH1  ARG  12          1HH2      ARG  12   9.545   6.978   4.765
  123   2HH1  ARG  12          2HH2      ARG  12  10.934   6.179   4.084
  124   1HH2  ARG  12          1HH1      ARG  12  11.427   4.022   6.845
  125   2HH2  ARG  12          2HH1      ARG  12  12.009   4.499   5.271
  126    H    HIS  13           H        HIS  13   4.807   9.392   7.944
  127    HA   HIS  13           HA       HIS  13   5.940  10.836  10.298
  128   1HB   HIS  13          1HB       HIS  13   5.375  11.629   7.440
  129   2HB   HIS  13          2HB       HIS  13   5.804  12.777   8.710
  130    HD2  HIS  13           HD2      HIS  13   8.135  13.401   7.294
  131    HE1  HIS  13           HE1      HIS  13  10.027   9.690   8.049
  132    HE2  HIS  13           HE2      HIS  13  10.389  12.070   7.188
  133    HA   PRO  14           HA       PRO  14   1.722  12.014  11.260
  134   1HB   PRO  14          1HB       PRO  14   2.045  14.319  12.664
  135   2HB   PRO  14          2HB       PRO  14   2.645  12.748  13.269
  136   1HG   PRO  14          1HG       PRO  14   4.222  14.910  11.854
  137   2HG   PRO  14          2HG       PRO  14   4.664  14.020  13.336
  138   1HD   PRO  14          1HD       PRO  14   5.561  13.353  10.825
  139   2HD   PRO  14          2HD       PRO  14   5.325  12.128  12.093
  140    H    ALA  15           H        ALA  15   0.183  12.900   9.925
  141    HA   ALA  15           HA       ALA  15   0.860  14.190   7.566
  142   1HB   ALA  15          1HB       ALA  15  -1.215  12.931   7.930
  143   2HB   ALA  15          2HB       ALA  15  -1.839  14.251   8.954
  144   3HB   ALA  15          3HB       ALA  15  -1.534  14.528   7.231
  145    H    GLU  16           H        GLU  16   0.796  16.228   6.782
  146    HA   GLU  16           HA       GLU  16   0.585  18.546   8.613
  147   1HB   GLU  16          1HB       GLU  16   2.781  17.334   8.941
  148   2HB   GLU  16          2HB       GLU  16   3.182  17.706   7.255
  149   1HG   GLU  16          1HG       GLU  16   2.993  20.140   7.802
  150   2HG   GLU  16          2HG       GLU  16   2.612  19.713   9.479
  151    H    ASN  17           H        ASN  17  -0.617  19.894   7.384
  152    HA   ASN  17           HA       ASN  17  -1.224  19.486   4.758
  153   1HB   ASN  17          1HB       ASN  17  -1.449  22.015   6.420
  154   2HB   ASN  17          2HB       ASN  17  -2.173  21.797   4.825
  155   1HD2  ASN  17          2HD2      ASN  17  -2.406  20.923   8.221
  156   2HD2  ASN  17          1HD2      ASN  17  -3.918  20.050   8.086
  157    H    GLY  18           H        GLY  18  -0.126  19.732   2.903
  158   1HA   GLY  18          1HA       GLY  18   0.957  20.838   1.217
  159   2HA   GLY  18          2HA       GLY  18   1.269  22.204   2.291
  160    H    LYS  19           H        LYS  19   2.588  20.265   4.294
  161    HA   LYS  19           HA       LYS  19   5.278  20.571   3.145
  162   1HB   LYS  19          1HB       LYS  19   4.697  21.561   5.254
  163   2HB   LYS  19          2HB       LYS  19   4.279  19.952   5.876
  164   1HG   LYS  19          1HG       LYS  19   7.103  20.705   4.994
  165   2HG   LYS  19          2HG       LYS  19   6.471  20.980   6.624
  166   1HD   LYS  19          1HD       LYS  19   5.787  18.420   6.486
  167   2HD   LYS  19          2HD       LYS  19   7.067  18.368   5.266
  168   1HE   LYS  19          1HE       LYS  19   8.752  18.870   6.826
  169   2HE   LYS  19          2HE       LYS  19   7.609  19.562   7.999
  170   1HZ   LYS  19          1HZ       LYS  19   6.728  17.468   8.413
  171   2HZ   LYS  19          2HZ       LYS  19   7.708  16.730   7.300
  172   3HZ   LYS  19          3HZ       LYS  19   8.358  17.420   8.656
  173    H    SER  20           H        SER  20   6.029  18.993   2.239
  174    HA   SER  20           HA       SER  20   5.259  16.526   1.697
  175   1HB   SER  20          1HB       SER  20   7.624  15.825   1.223
  176   2HB   SER  20          2HB       SER  20   6.965  17.268   0.457
  177    HG   SER  20           HG       SER  20   8.070  18.502   2.081
  178    H    ASN  21           H        ASN  21   4.888  14.702   2.727
  179    HA   ASN  21           HA       ASN  21   5.954  14.265   5.485
  180   1HB   ASN  21          1HB       ASN  21   3.418  14.824   4.648
  181   2HB   ASN  21          2HB       ASN  21   3.377  13.076   4.590
  182   1HD2  ASN  21          2HD2      ASN  21   4.301  15.861   6.645
  183   2HD2  ASN  21          1HD2      ASN  21   3.772  15.146   8.157
  184    H    PHE  22           H        PHE  22   4.682  11.489   5.488
  185    HA   PHE  22           HA       PHE  22   5.905  10.091   3.295
  186   1HB   PHE  22          1HB       PHE  22   7.581  10.593   5.491
  187   2HB   PHE  22          2HB       PHE  22   7.085   8.931   5.706
  188    HD1  PHE  22           HD1      PHE  22   7.047   7.633   3.197
  189    HD2  PHE  22           HD2      PHE  22   9.629  10.844   4.472
  190    HE1  PHE  22           HE1      PHE  22   8.609   7.140   1.322
  191    HE2  PHE  22           HE2      PHE  22  11.244  10.252   2.689
  192    HZ   PHE  22           HZ       PHE  22  10.661   8.508   1.028
  193    H    LEU  23           H        LEU  23   4.602   8.488   2.840
  194    HA   LEU  23           HA       LEU  23   2.942   7.191   4.955
  195   1HB   LEU  23          1HB       LEU  23   1.992   8.534   2.768
  196   2HB   LEU  23          2HB       LEU  23   2.250   6.964   2.042
  197    HG   LEU  23           HG       LEU  23   0.842   6.019   3.974
  198   1HD1  LEU  23          1HD1      LEU  23   1.122   8.258   5.349
  199   2HD1  LEU  23          2HD1      LEU  23  -0.128   8.887   4.271
  200   3HD1  LEU  23          3HD1      LEU  23  -0.446   7.462   5.292
  201   1HD2  LEU  23          1HD2      LEU  23  -0.099   6.259   1.761
  202   2HD2  LEU  23          2HD2      LEU  23  -1.308   6.774   2.944
  203   3HD2  LEU  23          3HD2      LEU  23  -0.407   7.991   2.012
  204    H    ASN  24           H        ASN  24   2.784   4.981   5.021
  205    HA   ASN  24           HA       ASN  24   4.551   3.356   3.229
  206   1HB   ASN  24          1HB       ASN  24   4.278   3.297   6.244
  207   2HB   ASN  24          2HB       ASN  24   4.915   1.962   5.290
  208   1HD2  ASN  24          2HD2      ASN  24   6.891   2.177   6.578
  209   2HD2  ASN  24          1HD2      ASN  24   8.047   3.432   6.183
  210    H    CYS  25           H        CYS  25   2.898   2.451   1.977
  211    HA   CYS  25           HA       CYS  25   0.713   0.998   3.347
  212   1HB   CYS  25          1HB       CYS  25   1.592   0.641   0.479
  213   2HB   CYS  25          2HB       CYS  25   0.126   0.080   1.263
  214    H    TYR  26           H        TYR  26   1.105  -1.036   4.195
  215    HA   TYR  26           HA       TYR  26   3.427  -2.577   3.169
  216   1HB   TYR  26          1HB       TYR  26   4.001  -1.621   5.391
  217   2HB   TYR  26          2HB       TYR  26   2.531  -2.273   6.056
  218    HD1  TYR  26           HD1      TYR  26   5.063  -3.937   3.783
  219    HD2  TYR  26           HD2      TYR  26   3.472  -3.681   7.747
  220    HE1  TYR  26           HE1      TYR  26   5.940  -6.189   4.257
  221    HE2  TYR  26           HE2      TYR  26   4.295  -5.975   8.236
  222    HH   TYR  26           HH       TYR  26   6.123  -7.891   5.819
  223    H    VAL  27           H        VAL  27   2.869  -4.607   2.578
  224    HA   VAL  27           HA       VAL  27   0.224  -5.664   3.410
  225    HB   VAL  27           HB       VAL  27   1.301  -5.880   0.558
  226   1HG1  VAL  27          1HG1      VAL  27  -1.506  -6.287   1.683
  227   2HG1  VAL  27          2HG1      VAL  27  -0.909  -6.680   0.054
  228   3HG1  VAL  27          3HG1      VAL  27  -0.355  -7.605   1.457
  229   1HG2  VAL  27          1HG2      VAL  27  -0.792  -3.968   1.586
  230   2HG2  VAL  27          2HG2      VAL  27   0.795  -3.522   0.910
  231   3HG2  VAL  27          3HG2      VAL  27  -0.405  -4.312  -0.125
  232    H    SER  28           H        SER  28   0.334  -7.899   3.840
  233    HA   SER  28           HA       SER  28   2.519  -9.432   2.766
  234   1HB   SER  28          1HB       SER  28   3.377 -10.222   4.980
  235   2HB   SER  28          2HB       SER  28   3.666  -8.510   4.814
  236    HG   SER  28           HG       SER  28   1.514  -9.766   6.202
  237    H    GLY  29           H        GLY  29   2.453 -11.761   3.912
  238   1HA   GLY  29          1HA       GLY  29   1.192 -13.537   4.672
  239   2HA   GLY  29          2HA       GLY  29  -0.307 -12.625   4.484
  240    H    PHE  30           H        PHE  30   0.215 -11.767   1.753
  241    HA   PHE  30           HA       PHE  30  -1.157 -13.798   0.420
  242   1HB   PHE  30          1HB       PHE  30  -1.017 -12.360  -1.526
  243   2HB   PHE  30          2HB       PHE  30  -1.447 -11.506  -0.097
  244    HD1  PHE  30           HD1      PHE  30   1.237 -12.118  -2.539
  245    HD2  PHE  30           HD2      PHE  30   0.000  -9.658   0.776
  246    HE1  PHE  30           HE1      PHE  30   3.127 -10.595  -2.974
  247    HE2  PHE  30           HE2      PHE  30   1.884  -8.133   0.315
  248    HZ   PHE  30           HZ       PHE  30   3.450  -8.628  -1.543
  249    H    HIS  31           H        HIS  31  -0.309 -14.274  -2.101
  250    HA   HIS  31           HA       HIS  31   2.286 -15.294  -2.510
  251   1HB   HIS  31          1HB       HIS  31   2.192 -16.844  -0.775
  252   2HB   HIS  31          2HB       HIS  31   0.427 -16.818  -0.729
  253    HD2  HIS  31           HD2      HIS  31   2.607 -18.098  -3.713
  254    HE1  HIS  31           HE1      HIS  31  -0.019 -21.147  -2.408
  255    HE2  HIS  31           HE2      HIS  31   1.751 -20.550  -4.152
  256    HA   PRO  32           HA       PRO  32   3.135 -16.127  -4.380
  257   1HB   PRO  32          1HB       PRO  32   3.572 -16.165  -7.006
  258   2HB   PRO  32          2HB       PRO  32   2.641 -17.471  -6.260
  259   1HG   PRO  32          1HG       PRO  32   1.455 -14.987  -7.538
  260   2HG   PRO  32          2HG       PRO  32   1.163 -16.687  -8.014
  261   1HD   PRO  32          1HD       PRO  32  -0.454 -15.400  -6.228
  262   2HD   PRO  32          2HD       PRO  32  -0.052 -17.126  -6.026
  263    H    SER  33           H        SER  33   4.036 -14.380  -6.787
  264    HA   SER  33           HA       SER  33   4.701 -12.338  -4.896
  265   1HB   SER  33          1HB       SER  33   6.407 -11.759  -6.534
  266   2HB   SER  33          2HB       SER  33   6.347 -13.523  -6.337
  267    HG   SER  33           HG       SER  33   5.078 -13.601  -8.249
  268    H    ASP  34           H        ASP  34   2.708 -12.329  -7.833
  269    HA   ASP  34           HA       ASP  34   3.400  -9.605  -8.407
  270   1HB   ASP  34          1HB       ASP  34   3.099 -11.240 -10.159
  271   2HB   ASP  34          2HB       ASP  34   1.429 -11.549  -9.662
  272    H    ILE  35           H        ILE  35   2.658  -8.059  -7.091
  273    HA   ILE  35           HA       ILE  35  -0.276  -7.643  -6.965
  274    HB   ILE  35           HB       ILE  35   0.456  -8.580  -4.959
  275   1HG1  ILE  35          1HG1      ILE  35   0.054  -5.649  -4.291
  276   2HG1  ILE  35          2HG1      ILE  35  -1.247  -6.687  -4.845
  277   1HG2  ILE  35          1HG2      ILE  35   2.374  -6.290  -4.656
  278   2HG2  ILE  35          2HG2      ILE  35   2.055  -7.587  -3.468
  279   3HG2  ILE  35          3HG2      ILE  35   2.805  -7.992  -5.007
  280   1HD1  ILE  35          1HD1      ILE  35  -0.601  -8.292  -2.935
  281   2HD1  ILE  35          2HD1      ILE  35   0.368  -6.974  -2.286
  282   3HD1  ILE  35          3HD1      ILE  35  -1.369  -6.752  -2.486
  283    H    GLU  36           H        GLU  36  -0.996  -5.623  -6.970
  284    HA   GLU  36           HA       GLU  36   0.723  -3.563  -8.254
  285   1HB   GLU  36          1HB       GLU  36  -2.254  -3.981  -8.635
  286   2HB   GLU  36          2HB       GLU  36  -1.123  -3.052  -9.621
  287   1HG   GLU  36          1HG       GLU  36   0.066  -5.228 -10.122
  288   2HG   GLU  36          2HG       GLU  36  -1.227  -6.087  -9.297
  289    H    VAL  37           H        VAL  37   0.989  -1.752  -7.029
  290    HA   VAL  37           HA       VAL  37  -1.108  -0.910  -5.095
  291    HB   VAL  37           HB       VAL  37   1.814  -1.489  -4.455
  292   1HG1  VAL  37          1HG1      VAL  37   0.776   0.295  -2.968
  293   2HG1  VAL  37          2HG1      VAL  37  -0.411  -0.928  -2.458
  294   3HG1  VAL  37          3HG1      VAL  37   1.305  -1.174  -2.140
  295   1HG2  VAL  37          1HG2      VAL  37   0.794  -3.601  -4.713
  296   2HG2  VAL  37          2HG2      VAL  37   0.709  -3.295  -2.973
  297   3HG2  VAL  37          3HG2      VAL  37  -0.731  -3.072  -3.948
  298    H    ASP  38           H        ASP  38  -1.467   0.810  -6.640
  299    HA   ASP  38           HA       ASP  38   0.506   2.993  -6.723
  300   1HB   ASP  38          1HB       ASP  38  -2.500   3.066  -7.324
  301   2HB   ASP  38          2HB       ASP  38  -1.330   4.343  -7.607
  302    H    LEU  39           H        LEU  39   0.082   4.996  -5.590
  303    HA   LEU  39           HA       LEU  39  -1.903   4.887  -3.360
  304   1HB   LEU  39          1HB       LEU  39   0.589   6.621  -3.534
  305   2HB   LEU  39          2HB       LEU  39  -0.695   6.699  -2.317
  306    HG   LEU  39           HG       LEU  39  -0.030   4.024  -2.217
  307   1HD1  LEU  39          1HD1      LEU  39   2.571   5.520  -2.706
  308   2HD1  LEU  39          2HD1      LEU  39   2.413   3.840  -2.156
  309   3HD1  LEU  39          3HD1      LEU  39   1.863   4.294  -3.776
  310   1HD2  LEU  39          1HD2      LEU  39   1.001   6.406  -0.644
  311   2HD2  LEU  39          2HD2      LEU  39  -0.333   5.305  -0.268
  312   3HD2  LEU  39          3HD2      LEU  39   1.351   4.734  -0.175
  313    H    LEU  40           H        LEU  40  -3.525   6.310  -3.527
  314    HA   LEU  40           HA       LEU  40  -3.754   7.854  -6.060
  315   1HB   LEU  40          1HB       LEU  40  -4.535   5.379  -5.976
  316   2HB   LEU  40          2HB       LEU  40  -5.810   5.958  -4.921
  317    HG   LEU  40           HG       LEU  40  -6.627   5.717  -7.149
  318   1HD1  LEU  40          1HD1      LEU  40  -7.475   7.701  -5.871
  319   2HD1  LEU  40          2HD1      LEU  40  -6.303   8.720  -6.742
  320   3HD1  LEU  40          3HD1      LEU  40  -7.574   7.876  -7.633
  321   1HD2  LEU  40          1HD2      LEU  40  -4.575   7.710  -8.149
  322   2HD2  LEU  40          2HD2      LEU  40  -4.367   5.946  -8.252
  323   3HD2  LEU  40          3HD2      LEU  40  -5.709   6.739  -9.101
  324    H    LYS  41           H        LYS  41  -4.153   9.963  -5.406
  325    HA   LYS  41           HA       LYS  41  -5.244  10.537  -2.838
  326   1HB   LYS  41          1HB       LYS  41  -4.596  12.282  -5.216
  327   2HB   LYS  41          2HB       LYS  41  -4.736  12.806  -3.511
  328   1HG   LYS  41          1HG       LYS  41  -2.818  11.724  -2.855
  329   2HG   LYS  41          2HG       LYS  41  -2.706  10.656  -4.245
  330   1HD   LYS  41          1HD       LYS  41  -1.081  12.361  -4.389
  331   2HD   LYS  41          2HD       LYS  41  -2.179  12.440  -5.755
  332   1HE   LYS  41          1HE       LYS  41  -3.341  14.320  -4.925
  333   2HE   LYS  41          2HE       LYS  41  -2.675  14.109  -3.288
  334   1HZ   LYS  41          1HZ       LYS  41  -1.147  14.947  -5.647
  335   2HZ   LYS  41          2HZ       LYS  41  -1.665  15.934  -4.427
  336   3HZ   LYS  41          3HZ       LYS  41  -0.547  14.761  -4.119
  337    H    ASN  42           H        ASN  42  -6.505  12.977  -4.239
  338    HA   ASN  42           HA       ASN  42  -9.286  12.258  -4.113
  339   1HB   ASN  42          1HB       ASN  42  -9.710  14.463  -4.970
  340   2HB   ASN  42          2HB       ASN  42  -8.358  14.621  -3.850
  341   1HD2  ASN  42          2HD2      ASN  42  -6.106  14.821  -4.838
  342   2HD2  ASN  42          1HD2      ASN  42  -5.965  15.391  -6.486
  343    H    GLY  43           H        GLY  43  -6.940  12.524  -6.780
  344   1HA   GLY  43          1HA       GLY  43  -8.032  10.329  -8.174
  345   2HA   GLY  43          2HA       GLY  43  -8.656  11.809  -8.930
  346    H    GLU  44           H        GLU  44  -5.481  11.493  -7.352
  347    HA   GLU  44           HA       GLU  44  -4.069  11.583  -9.984
  348   1HB   GLU  44          1HB       GLU  44  -4.025  13.782  -8.965
  349   2HB   GLU  44          2HB       GLU  44  -3.528  13.109  -7.411
  350   1HG   GLU  44          1HG       GLU  44  -1.377  12.347  -8.445
  351   2HG   GLU  44          2HG       GLU  44  -1.900  13.037  -9.992
  352    H    ARG  45           H        ARG  45  -2.744   9.880 -10.218
  353    HA   ARG  45           HA       ARG  45  -2.222   8.126  -7.911
  354   1HB   ARG  45          1HB       ARG  45  -1.698   6.424  -9.426
  355   2HB   ARG  45          2HB       ARG  45  -3.168   7.214 -10.016
  356   1HG   ARG  45          1HG       ARG  45  -1.770   8.495 -11.664
  357   2HG   ARG  45          2HG       ARG  45  -0.362   7.568 -11.106
  358   1HD   ARG  45          1HD       ARG  45  -1.643   5.438 -11.691
  359   2HD   ARG  45          2HD       ARG  45  -2.895   6.469 -12.392
  360    HE   ARG  45           HE       ARG  45  -1.576   6.868 -14.226
  361   1HH1  ARG  45          1HH2      ARG  45   0.480   5.415 -11.695
  362   2HH1  ARG  45          2HH2      ARG  45   1.944   5.629 -12.633
  363   1HH2  ARG  45          1HH1      ARG  45   0.392   7.101 -15.411
  364   2HH2  ARG  45          2HH1      ARG  45   1.899   6.588 -14.674
  365    H    ILE  46           H        ILE  46  -0.266   7.886  -6.951
  366    HA   ILE  46           HA       ILE  46   1.818   9.807  -7.547
  367    HB   ILE  46           HB       ILE  46   1.164   7.844  -5.324
  368   1HG1  ILE  46          1HG1      ILE  46   1.045  10.874  -5.153
  369   2HG1  ILE  46          2HG1      ILE  46  -0.344   9.969  -5.755
  370   1HG2  ILE  46          1HG2      ILE  46   3.536   8.184  -5.374
  371   2HG2  ILE  46          2HG2      ILE  46   3.324   9.944  -5.584
  372   3HG2  ILE  46          3HG2      ILE  46   2.856   9.155  -4.052
  373   1HD1  ILE  46          1HD1      ILE  46  -0.487   8.664  -3.686
  374   2HD1  ILE  46          2HD1      ILE  46   0.879   9.575  -3.001
  375   3HD1  ILE  46          3HD1      ILE  46  -0.638  10.378  -3.435
  376    H    GLU  47           H        GLU  47   3.391   9.148  -8.928
  377    HA   GLU  47           HA       GLU  47   3.845   6.317  -9.466
  378   1HB   GLU  47          1HB       GLU  47   5.178   8.766 -10.668
  379   2HB   GLU  47          2HB       GLU  47   5.325   7.081 -11.203
  380   1HG   GLU  47          1HG       GLU  47   2.695   7.148 -11.280
  381   2HG   GLU  47          2HG       GLU  47   2.904   8.893 -11.332
  382    H    LYS  48           H        LYS  48   5.505   8.901  -7.667
  383    HA   LYS  48           HA       LYS  48   8.016   7.457  -7.513
  384   1HB   LYS  48          1HB       LYS  48   7.829   9.937  -7.471
  385   2HB   LYS  48          2HB       LYS  48   7.098   9.845  -5.861
  386   1HG   LYS  48          1HG       LYS  48   9.144   8.681  -5.021
  387   2HG   LYS  48          2HG       LYS  48   9.844   8.760  -6.649
  388   1HD   LYS  48          1HD       LYS  48   9.666  11.277  -6.521
  389   2HD   LYS  48          2HD       LYS  48   9.140  11.120  -4.838
  390   1HE   LYS  48          1HE       LYS  48  11.787  10.092  -5.979
  391   2HE   LYS  48          2HE       LYS  48  11.585  11.591  -5.057
  392   1HZ   LYS  48          1HZ       LYS  48  11.031   8.913  -3.998
  393   2HZ   LYS  48          2HZ       LYS  48  12.360   9.830  -3.679
  394   3HZ   LYS  48          3HZ       LYS  48  10.872  10.353  -3.196
  395    H    VAL  49           H        VAL  49   6.874   5.446  -6.873
  396    HA   VAL  49           HA       VAL  49   6.440   5.205  -3.932
  397    HB   VAL  49           HB       VAL  49   5.783   3.238  -6.162
  398   1HG1  VAL  49          1HG1      VAL  49   6.159   2.136  -4.003
  399   2HG1  VAL  49          2HG1      VAL  49   5.128   3.323  -3.178
  400   3HG1  VAL  49          3HG1      VAL  49   4.423   2.177  -4.337
  401   1HG2  VAL  49          1HG2      VAL  49   4.018   5.230  -4.692
  402   2HG2  VAL  49          2HG2      VAL  49   4.370   5.174  -6.432
  403   3HG2  VAL  49          3HG2      VAL  49   3.419   3.883  -5.692
  404    H    GLU  50           H        GLU  50   8.454   4.907  -3.022
  405    HA   GLU  50           HA       GLU  50  10.487   3.238  -4.376
  406   1HB   GLU  50          1HB       GLU  50  10.992   5.345  -2.947
  407   2HB   GLU  50          2HB       GLU  50  10.648   4.303  -1.558
  408   1HG   GLU  50          1HG       GLU  50  12.378   2.694  -2.395
  409   2HG   GLU  50          2HG       GLU  50  12.771   3.873  -3.662
  410    H    HIS  51           H        HIS  51  11.101   1.169  -3.297
  411    HA   HIS  51           HA       HIS  51   9.217   0.165  -1.293
  412   1HB   HIS  51          1HB       HIS  51   8.597  -1.825  -2.583
  413   2HB   HIS  51          2HB       HIS  51   8.033  -0.357  -3.382
  414    HD2  HIS  51           HD2      HIS  51   9.456   0.358  -5.745
  415    HE1  HIS  51           HE1      HIS  51  11.363  -3.402  -6.122
  416    HE2  HIS  51           HE2      HIS  51  10.890  -1.186  -7.302
  417    H    SER  52           H        SER  52   9.873  -1.651  -0.249
  418    HA   SER  52           HA       SER  52  12.755  -2.157  -0.155
  419   1HB   SER  52          1HB       SER  52  12.075  -3.842   1.584
  420   2HB   SER  52          2HB       SER  52  11.556  -2.178   1.928
  421    HG   SER  52           HG       SER  52   9.514  -2.718   1.095
  422    H    ASP  53           H        ASP  53  13.786  -3.983  -0.942
  423    HA   ASP  53           HA       ASP  53  12.745  -5.346  -3.195
  424   1HB   ASP  53          1HB       ASP  53  15.139  -5.011  -2.808
  425   2HB   ASP  53          2HB       ASP  53  15.070  -5.985  -1.329
  426    H    LEU  54           H        LEU  54  12.412  -7.722  -3.388
  427    HA   LEU  54           HA       LEU  54  10.216  -8.330  -1.779
  428   1HB   LEU  54          1HB       LEU  54  10.552  -9.077  -4.116
  429   2HB   LEU  54          2HB       LEU  54  11.740 -10.265  -3.585
  430    HG   LEU  54           HG       LEU  54   9.346 -11.108  -4.066
  431   1HD1  LEU  54          1HD1      LEU  54  10.231 -11.788  -1.264
  432   2HD1  LEU  54          2HD1      LEU  54   9.265 -12.724  -2.396
  433   3HD1  LEU  54          3HD1      LEU  54  10.969 -12.439  -2.750
  434   1HD2  LEU  54          1HD2      LEU  54   8.263  -9.110  -2.914
  435   2HD2  LEU  54          2HD2      LEU  54   7.581 -10.706  -2.596
  436   3HD2  LEU  54          3HD2      LEU  54   8.640  -9.982  -1.399
  437    H    SER  55           H        SER  55  10.031  -9.169   0.161
  438    HA   SER  55           HA       SER  55  12.064 -11.052   1.260
  439   1HB   SER  55          1HB       SER  55  12.397  -8.803   2.267
  440   2HB   SER  55          2HB       SER  55  10.688  -8.759   2.737
  441    HG   SER  55           HG       SER  55  12.674 -10.602   3.589
  442    H    PHE  56           H        PHE  56  10.872 -12.918   1.087
  443    HA   PHE  56           HA       PHE  56   7.972 -12.803   1.567
  444   1HB   PHE  56          1HB       PHE  56   7.898 -14.950   0.479
  445   2HB   PHE  56          2HB       PHE  56   8.750 -13.779  -0.495
  446    HD1  PHE  56           HD1      PHE  56   9.025 -16.811   1.570
  447    HD2  PHE  56           HD2      PHE  56  11.119 -14.102  -1.021
  448    HE1  PHE  56           HE1      PHE  56  11.099 -18.189   1.815
  449    HE2  PHE  56           HE2      PHE  56  13.148 -15.556  -0.907
  450    HZ   PHE  56           HZ       PHE  56  13.134 -17.591   0.508
  451    H    SER  57           H        SER  57  10.542 -13.296   3.556
  452    HA   SER  57           HA       SER  57  11.073 -14.348   5.350
  453   1HB   SER  57          1HB       SER  57   9.578 -14.995   7.050
  454   2HB   SER  57          2HB       SER  57   9.012 -13.500   6.347
  455    HG   SER  57           HG       SER  57   7.325 -15.019   6.689
  456    H    LYS  58           H        LYS  58  12.103 -16.206   5.668
  457    HA   LYS  58           HA       LYS  58  11.631 -18.734   4.383
  458   1HB   LYS  58          1HB       LYS  58  12.854 -18.120   7.097
  459   2HB   LYS  58          2HB       LYS  58  13.076 -19.612   6.155
  460   1HG   LYS  58          1HG       LYS  58  14.121 -18.199   4.321
  461   2HG   LYS  58          2HG       LYS  58  14.089 -16.821   5.425
  462   1HD   LYS  58          1HD       LYS  58  15.604 -19.434   5.809
  463   2HD   LYS  58          2HD       LYS  58  16.275 -17.820   5.517
  464   1HE   LYS  58          1HE       LYS  58  15.185 -17.117   7.751
  465   2HE   LYS  58          2HE       LYS  58  14.890 -18.847   8.031
  466   1HZ   LYS  58          1HZ       LYS  58  17.496 -17.573   7.621
  467   2HZ   LYS  58          2HZ       LYS  58  16.900 -18.160   9.039
  468   3HZ   LYS  58          3HZ       LYS  58  17.255 -19.193   7.806
  469    H    ASP  59           H        ASP  59  10.184 -17.100   7.096
  470    HA   ASP  59           HA       ASP  59   8.843 -19.366   8.136
  471   1HB   ASP  59          1HB       ASP  59   8.332 -16.366   8.469
  472   2HB   ASP  59          2HB       ASP  59   7.676 -17.622   9.518
  473    H    TRP  60           H        TRP  60   8.334 -18.689   5.187
  474    HA   TRP  60           HA       TRP  60   6.692 -19.087   3.754
  475   1HB   TRP  60          1HB       TRP  60   5.082 -20.063   6.139
  476   2HB   TRP  60          2HB       TRP  60   4.765 -20.380   4.442
  477    HD1  TRP  60           HD1      TRP  60   7.142 -21.313   7.253
  478    HE1  TRP  60           HE1      TRP  60   8.356 -23.524   6.669
  479    HE3  TRP  60           HE3      TRP  60   5.583 -21.855   2.407
  480    HZ2  TRP  60           HZ2      TRP  60   8.563 -25.290   4.437
  481    HZ3  TRP  60           HZ3      TRP  60   6.312 -23.810   1.079
  482    HH2  TRP  60           HH2      TRP  60   7.773 -25.547   2.087
  483    H    SER  61           H        SER  61   6.499 -16.818   3.267
  484    HA   SER  61           HA       SER  61   3.732 -15.949   3.450
  485   1HB   SER  61          1HB       SER  61   4.806 -15.014   5.558
  486   2HB   SER  61          2HB       SER  61   5.894 -14.096   4.520
  487    HG   SER  61           HG       SER  61   4.070 -12.880   5.101
  488    H    PHE  62           H        PHE  62   4.135 -13.376   2.385
  489    HA   PHE  62           HA       PHE  62   6.265 -13.231   0.495
  490   1HB   PHE  62          1HB       PHE  62   4.129 -14.669  -0.551
  491   2HB   PHE  62          2HB       PHE  62   3.837 -13.038  -1.142
  492    HD1  PHE  62           HD1      PHE  62   6.129 -15.955  -1.176
  493    HD2  PHE  62           HD2      PHE  62   5.672 -11.890  -2.573
  494    HE1  PHE  62           HE1      PHE  62   7.695 -16.411  -2.963
  495    HE2  PHE  62           HE2      PHE  62   7.270 -12.346  -4.336
  496    HZ   PHE  62           HZ       PHE  62   8.300 -14.613  -4.587
  497    H    TYR  63           H        TYR  63   6.687 -10.970   0.536
  498    HA   TYR  63           HA       TYR  63   4.481  -9.051   0.725
  499   1HB   TYR  63          1HB       TYR  63   5.075  -8.216   2.991
  500   2HB   TYR  63          2HB       TYR  63   4.471  -9.873   2.982
  501    HD1  TYR  63           HD1      TYR  63   5.643 -11.738   3.715
  502    HD2  TYR  63           HD2      TYR  63   7.422  -7.826   3.544
  503    HE1  TYR  63           HE1      TYR  63   7.448 -12.505   5.176
  504    HE2  TYR  63           HE2      TYR  63   9.241  -8.560   5.019
  505    HH   TYR  63           HH       TYR  63  10.325 -10.436   5.912
  506    H    LEU  64           H        LEU  64   5.320  -6.900   1.384
  507    HA   LEU  64           HA       LEU  64   8.023  -6.135   1.023
  508   1HB   LEU  64          1HB       LEU  64   7.969  -5.090  -1.153
  509   2HB   LEU  64          2HB       LEU  64   7.697  -6.815  -1.327
  510    HG   LEU  64           HG       LEU  64   5.642  -4.593  -1.557
  511   1HD1  LEU  64          1HD1      LEU  64   6.542  -6.660  -3.614
  512   2HD1  LEU  64          2HD1      LEU  64   5.425  -5.322  -3.883
  513   3HD1  LEU  64          3HD1      LEU  64   7.132  -4.978  -3.560
  514   1HD2  LEU  64          1HD2      LEU  64   5.339  -7.605  -1.632
  515   2HD2  LEU  64          2HD2      LEU  64   4.363  -6.450  -0.669
  516   3HD2  LEU  64          3HD2      LEU  64   4.168  -6.551  -2.421
  517    H    LEU  65           H        LEU  65   8.224  -3.840   1.263
  518    HA   LEU  65           HA       LEU  65   5.828  -2.462   2.349
  519   1HB   LEU  65          1HB       LEU  65   8.073  -3.106   3.639
  520   2HB   LEU  65          2HB       LEU  65   8.703  -1.666   2.831
  521    HG   LEU  65           HG       LEU  65   6.332  -1.861   4.749
  522   1HD1  LEU  65          1HD1      LEU  65   9.036  -0.493   4.916
  523   2HD1  LEU  65          2HD1      LEU  65   7.785  -0.517   6.184
  524   3HD1  LEU  65          3HD1      LEU  65   8.597  -2.025   5.708
  525   1HD2  LEU  65          1HD2      LEU  65   7.312   0.405   3.003
  526   2HD2  LEU  65          2HD2      LEU  65   5.647  -0.114   3.340
  527   3HD2  LEU  65          3HD2      LEU  65   6.574   0.731   4.583
  528    H    TYR  66           H        TYR  66   5.185  -0.589   1.357
  529    HA   TYR  66           HA       TYR  66   6.684   0.285  -1.057
  530   1HB   TYR  66          1HB       TYR  66   3.656   0.122  -0.902
  531   2HB   TYR  66          2HB       TYR  66   4.686   0.190  -2.313
  532    HD1  TYR  66           HD1      TYR  66   4.571  -1.804  -3.610
  533    HD2  TYR  66           HD2      TYR  66   4.004  -2.133   0.668
  534    HE1  TYR  66           HE1      TYR  66   3.316  -3.915  -3.893
  535    HE2  TYR  66           HE2      TYR  66   2.893  -4.255   0.361
  536    HH   TYR  66           HH       TYR  66   1.911  -5.440  -2.861
  537    H    TYR  67           H        TYR  67   7.388   2.245  -0.293
  538    HA   TYR  67           HA       TYR  67   5.445   4.009   1.092
  539   1HB   TYR  67          1HB       TYR  67   7.606   5.004   2.038
  540   2HB   TYR  67          2HB       TYR  67   6.772   3.594   2.643
  541    HD1  TYR  67           HD1      TYR  67   8.419   2.383   3.767
  542    HD2  TYR  67           HD2      TYR  67   9.100   3.723  -0.237
  543    HE1  TYR  67           HE1      TYR  67  10.464   0.974   3.648
  544    HE2  TYR  67           HE2      TYR  67  11.136   2.296  -0.389
  545    HH   TYR  67           HH       TYR  67  12.462   0.744   0.688
  546    H    THR  68           H        THR  68   5.305   6.065   0.720
  547    HA   THR  68           HA       THR  68   6.801   7.375  -1.536
  548    HB   THR  68           HB       THR  68   4.672   6.487  -2.228
  549    HG1  THR  68           HG1      THR  68   5.591   8.198  -3.280
  550   1HG2  THR  68          1HG2      THR  68   2.607   7.656  -1.639
  551   2HG2  THR  68          2HG2      THR  68   3.308   6.921  -0.174
  552   3HG2  THR  68          3HG2      THR  68   3.449   8.670  -0.472
  553    H    GLU  69           H        GLU  69   6.921   9.731  -1.410
  554    HA   GLU  69           HA       GLU  69   6.829  10.921   1.268
  555   1HB   GLU  69          1HB       GLU  69   7.690  11.893  -1.449
  556   2HB   GLU  69          2HB       GLU  69   7.816  12.871   0.029
  557   1HG   GLU  69          1HG       GLU  69   9.408  11.376   0.981
  558   2HG   GLU  69          2HG       GLU  69   9.183  10.173  -0.307
  559    H    PHE  70           H        PHE  70   4.422  10.666   1.434
  560    HA   PHE  70           HA       PHE  70   2.750  11.918  -0.541
  561   1HB   PHE  70          1HB       PHE  70   1.016  10.918   0.467
  562   2HB   PHE  70          2HB       PHE  70   2.272   9.903   1.078
  563    HD1  PHE  70           HD1      PHE  70   3.149  10.525   3.406
  564    HD2  PHE  70           HD2      PHE  70  -0.532  12.097   1.889
  565    HE1  PHE  70           HE1      PHE  70   2.335  10.842   5.758
  566    HE2  PHE  70           HE2      PHE  70  -1.146  12.805   4.180
  567    HZ   PHE  70           HZ       PHE  70   0.236  12.101   6.126
  568    H    THR  71           H        THR  71   1.941  13.897  -0.582
  569    HA   THR  71           HA       THR  71   2.518  15.818   1.630
  570    HB   THR  71           HB       THR  71   2.264  16.364  -1.302
  571    HG1  THR  71           HG1      THR  71   4.495  16.436  -1.163
  572   1HG2  THR  71          1HG2      THR  71   3.376  18.493  -0.585
  573   2HG2  THR  71          2HG2      THR  71   1.770  18.329   0.143
  574   3HG2  THR  71          3HG2      THR  71   3.220  17.987   1.107
  575    HA   PRO  72           HA       PRO  72  -2.129  15.553   1.321
  576   1HB   PRO  72          1HB       PRO  72  -2.799  16.324   3.856
  577   2HB   PRO  72          2HB       PRO  72  -2.229  14.688   3.439
  578   1HG   PRO  72          1HG       PRO  72  -0.632  16.969   4.605
  579   2HG   PRO  72          2HG       PRO  72  -0.622  15.257   5.106
  580   1HD   PRO  72          1HD       PRO  72   1.270  16.348   3.458
  581   2HD   PRO  72          2HD       PRO  72   0.758  14.646   3.300
  582    H    THR  73           H        THR  73  -2.723  17.272  -0.068
  583    HA   THR  73           HA       THR  73  -2.359  20.051   0.823
  584    HB   THR  73           HB       THR  73  -3.584  20.718  -1.082
  585    HG1  THR  73           HG1      THR  73  -4.232  18.038  -1.636
  586   1HG2  THR  73          1HG2      THR  73  -1.879  18.342  -1.937
  587   2HG2  THR  73          2HG2      THR  73  -2.376  19.718  -2.936
  588   3HG2  THR  73          3HG2      THR  73  -1.283  19.970  -1.560
  589    H    GLU  74           H        GLU  74  -4.459  21.413   1.025
  590    HA   GLU  74           HA       GLU  74  -6.084  20.335   3.121
  591   1HB   GLU  74          1HB       GLU  74  -6.408  22.843   1.428
  592   2HB   GLU  74          2HB       GLU  74  -7.310  22.476   2.910
  593   1HG   GLU  74          1HG       GLU  74  -5.199  22.356   4.192
  594   2HG   GLU  74          2HG       GLU  74  -4.273  22.769   2.742
  595    H    LYS  75           H        LYS  75  -6.250  19.686  -0.221
  596    HA   LYS  75           HA       LYS  75  -8.929  18.518   0.175
  597   1HB   LYS  75          1HB       LYS  75  -9.192  20.767  -0.888
  598   2HB   LYS  75          2HB       LYS  75  -8.217  20.211  -2.256
  599   1HG   LYS  75          1HG       LYS  75  -9.915  18.434  -2.711
  600   2HG   LYS  75          2HG       LYS  75 -10.828  18.953  -1.279
  601   1HD   LYS  75          1HD       LYS  75 -11.095  21.219  -2.308
  602   2HD   LYS  75          2HD       LYS  75 -10.248  20.635  -3.757
  603   1HE   LYS  75          1HE       LYS  75 -12.017  18.904  -4.074
  604   2HE   LYS  75          2HE       LYS  75 -12.856  19.507  -2.630
  605   1HZ   LYS  75          1HZ       LYS  75 -13.117  21.608  -3.740
  606   2HZ   LYS  75          2HZ       LYS  75 -12.356  21.035  -5.086
  607   3HZ   LYS  75          3HZ       LYS  75 -13.796  20.389  -4.614
  608    H    ASP  76           H        ASP  76  -7.359  16.754   0.535
  609    HA   ASP  76           HA       ASP  76  -7.262  15.179  -1.945
  610   1HB   ASP  76          1HB       ASP  76  -4.903  15.598  -0.062
  611   2HB   ASP  76          2HB       ASP  76  -5.097  14.102  -0.983
  612    H    GLU  77           H        GLU  77  -7.266  12.897  -1.515
  613    HA   GLU  77           HA       GLU  77  -7.577  12.057   1.284
  614   1HB   GLU  77          1HB       GLU  77  -9.884  12.375   0.015
  615   2HB   GLU  77          2HB       GLU  77  -9.482  10.830  -0.729
  616   1HG   GLU  77          1HG       GLU  77  -9.767  11.485   2.235
  617   2HG   GLU  77          2HG       GLU  77 -10.857  10.500   1.254
  618    H    TYR  78           H        TYR  78  -5.489  11.243   1.135
  619    HA   TYR  78           HA       TYR  78  -4.574   9.657  -1.075
  620   1HB   TYR  78          1HB       TYR  78  -3.563  10.277   1.680
  621   2HB   TYR  78          2HB       TYR  78  -2.789   9.018   0.713
  622    HD1  TYR  78           HD1      TYR  78  -3.874  12.615   0.502
  623    HD2  TYR  78           HD2      TYR  78  -1.078   9.607  -0.808
  624    HE1  TYR  78           HE1      TYR  78  -2.507  14.359  -0.608
  625    HE2  TYR  78           HE2      TYR  78   0.378  11.389  -1.728
  626    HH   TYR  78           HH       TYR  78  -0.392  14.841  -1.509
  627    H    ALA  79           H        ALA  79  -5.039   7.637  -1.523
  628    HA   ALA  79           HA       ALA  79  -5.834   5.696   0.571
  629   1HB   ALA  79          1HB       ALA  79  -7.387   6.282  -1.993
  630   2HB   ALA  79          2HB       ALA  79  -7.750   4.991  -0.831
  631   3HB   ALA  79          3HB       ALA  79  -7.919   6.693  -0.348
  632    H    CYS  80           H        CYS  80  -5.192   3.603   0.166
  633    HA   CYS  80           HA       CYS  80  -3.119   3.438  -1.936
  634   1HB   CYS  80          1HB       CYS  80  -2.725   3.145   0.569
  635   2HB   CYS  80          2HB       CYS  80  -3.441   1.540   0.392
  636    H    ARG  81           H        ARG  81  -3.489   2.286  -3.759
  637    HA   ARG  81           HA       ARG  81  -5.684   0.449  -4.112
  638   1HB   ARG  81          1HB       ARG  81  -4.646   1.645  -5.991
  639   2HB   ARG  81          2HB       ARG  81  -3.105   0.859  -5.629
  640   1HG   ARG  81          1HG       ARG  81  -4.191  -1.387  -6.074
  641   2HG   ARG  81          2HG       ARG  81  -5.642  -0.523  -6.585
  642   1HD   ARG  81          1HD       ARG  81  -2.847  -0.396  -7.804
  643   2HD   ARG  81          2HD       ARG  81  -4.233  -1.228  -8.503
  644    HE   ARG  81           HE       ARG  81  -3.512   1.513  -8.762
  645   1HH1  ARG  81          1HH2      ARG  81  -6.342  -0.609  -8.715
  646   2HH1  ARG  81          2HH2      ARG  81  -7.385   0.549  -9.503
  647   1HH2  ARG  81          1HH1      ARG  81  -4.897   3.069  -9.670
  648   2HH2  ARG  81          2HH1      ARG  81  -6.551   2.665 -10.057
  649    H    VAL  82           H        VAL  82  -5.685  -1.797  -3.624
  650    HA   VAL  82           HA       VAL  82  -3.075  -3.169  -3.405
  651    HB   VAL  82           HB       VAL  82  -5.412  -3.457  -1.461
  652   1HG1  VAL  82          1HG1      VAL  82  -2.761  -4.937  -1.654
  653   2HG1  VAL  82          2HG1      VAL  82  -3.981  -5.133  -0.372
  654   3HG1  VAL  82          3HG1      VAL  82  -4.359  -5.626  -2.026
  655   1HG2  VAL  82          1HG2      VAL  82  -4.074  -1.497  -0.872
  656   2HG2  VAL  82          2HG2      VAL  82  -3.689  -2.804   0.245
  657   3HG2  VAL  82          3HG2      VAL  82  -2.566  -2.419  -1.071
  658    H    ASN  83           H        ASN  83  -3.194  -4.292  -5.284
  659    HA   ASN  83           HA       ASN  83  -5.531  -6.111  -5.627
  660   1HB   ASN  83          1HB       ASN  83  -5.727  -4.171  -7.159
  661   2HB   ASN  83          2HB       ASN  83  -4.206  -4.618  -7.905
  662   1HD2  ASN  83          2HD2      ASN  83  -4.276  -6.119  -9.603
  663   2HD2  ASN  83          1HD2      ASN  83  -5.646  -7.161  -9.918
  664    H    HIS  84           H        HIS  84  -4.339  -7.866  -4.786
  665    HA   HIS  84           HA       HIS  84  -1.703  -8.668  -5.789
  666   1HB   HIS  84          1HB       HIS  84  -2.499  -9.277  -3.550
  667   2HB   HIS  84          2HB       HIS  84  -3.869 -10.113  -4.268
  668    HD2  HIS  84           HD2      HIS  84   0.109 -10.590  -4.432
  669    HE1  HIS  84           HE1      HIS  84  -1.921 -14.300  -4.672
  670    HE2  HIS  84           HE2      HIS  84   0.403 -13.178  -4.552
  671    H    VAL  85           H        VAL  85  -1.524 -10.591  -7.248
  672    HA   VAL  85           HA       VAL  85  -3.191 -10.583  -9.475
  673    HB   VAL  85           HB       VAL  85  -0.943 -11.423  -9.501
  674   1HG1  VAL  85          1HG1      VAL  85  -0.833 -12.670  -7.369
  675   2HG1  VAL  85          2HG1      VAL  85  -1.948 -13.895  -8.018
  676   3HG1  VAL  85          3HG1      VAL  85  -0.343 -13.677  -8.735
  677   1HG2  VAL  85          1HG2      VAL  85  -2.542 -12.116 -11.273
  678   2HG2  VAL  85          2HG2      VAL  85  -1.226 -13.273 -11.014
  679   3HG2  VAL  85          3HG2      VAL  85  -2.843 -13.625 -10.381
  680    H    THR  86           H        THR  86  -3.659 -12.415  -6.462
  681    HA   THR  86           HA       THR  86  -5.746 -14.059  -7.635
  682    HB   THR  86           HB       THR  86  -4.121 -14.600  -5.678
  683    HG1  THR  86           HG1      THR  86  -5.637 -15.973  -6.579
  684   1HG2  THR  86          1HG2      THR  86  -6.560 -13.760  -4.081
  685   2HG2  THR  86          2HG2      THR  86  -4.973 -14.298  -3.492
  686   3HG2  THR  86          3HG2      THR  86  -5.150 -12.694  -4.229
  687    H    LEU  87           H        LEU  87  -5.695 -10.817  -6.269
  688    HA   LEU  87           HA       LEU  87  -8.517 -10.770  -5.555
  689   1HB   LEU  87          1HB       LEU  87  -6.303  -8.757  -5.827
  690   2HB   LEU  87          2HB       LEU  87  -7.942  -8.194  -6.059
  691    HG   LEU  87           HG       LEU  87  -8.668  -8.914  -3.951
  692   1HD1  LEU  87          1HD1      LEU  87  -5.891 -10.039  -3.406
  693   2HD1  LEU  87          2HD1      LEU  87  -7.205  -9.882  -2.226
  694   3HD1  LEU  87          3HD1      LEU  87  -7.375 -10.991  -3.589
  695   1HD2  LEU  87          1HD2      LEU  87  -7.493  -6.727  -4.138
  696   2HD2  LEU  87          2HD2      LEU  87  -7.284  -7.425  -2.519
  697   3HD2  LEU  87          3HD2      LEU  87  -5.966  -7.510  -3.688
  698    H    SER  88           H        SER  88 -10.138 -10.872  -6.909
  699    HA   SER  88           HA       SER  88  -9.929 -10.499  -9.768
  700   1HB   SER  88          1HB       SER  88 -12.386 -10.851  -9.661
  701   2HB   SER  88          2HB       SER  88 -11.485 -12.097  -8.778
  702    HG   SER  88           HG       SER  88 -12.853  -9.860  -7.695
  703    H    GLN  89           H        GLN  89 -10.184  -8.264  -7.131
  704    HA   GLN  89           HA       GLN  89 -11.008  -6.109  -8.917
  705   1HB   GLN  89          1HB       GLN  89 -12.763  -5.372  -7.375
  706   2HB   GLN  89          2HB       GLN  89 -13.130  -6.919  -8.148
  707   1HG   GLN  89          1HG       GLN  89 -12.330  -8.081  -6.043
  708   2HG   GLN  89          2HG       GLN  89 -12.193  -6.486  -5.282
  709   1HE2  GLN  89          2HE2      GLN  89 -14.328  -5.075  -5.706
  710   2HE2  GLN  89          1HE2      GLN  89 -15.815  -5.926  -5.342
  711    HA   PRO  90           HA       PRO  90  -7.816  -4.394  -6.371
  712   1HB   PRO  90          1HB       PRO  90  -7.842  -1.778  -7.123
  713   2HB   PRO  90          2HB       PRO  90  -7.383  -3.074  -8.261
  714   1HG   PRO  90          1HG       PRO  90 -10.087  -1.743  -8.030
  715   2HG   PRO  90          2HG       PRO  90  -9.120  -2.041  -9.501
  716   1HD   PRO  90          1HD       PRO  90 -11.116  -3.732  -8.699
  717   2HD   PRO  90          2HD       PRO  90  -9.628  -4.341  -9.486
  718    H    LYS  91           H        LYS  91  -7.991  -4.162  -4.220
  719    HA   LYS  91           HA       LYS  91 -10.343  -2.851  -3.000
  720   1HB   LYS  91          1HB       LYS  91  -7.951  -4.286  -1.781
  721   2HB   LYS  91          2HB       LYS  91  -9.348  -3.642  -0.900
  722   1HG   LYS  91          1HG       LYS  91 -10.843  -5.159  -2.213
  723   2HG   LYS  91          2HG       LYS  91  -9.414  -5.840  -3.013
  724   1HD   LYS  91          1HD       LYS  91  -8.512  -6.382  -0.680
  725   2HD   LYS  91          2HD       LYS  91 -10.107  -5.961  -0.043
  726   1HE   LYS  91          1HE       LYS  91  -9.500  -8.146  -2.085
  727   2HE   LYS  91          2HE       LYS  91  -9.825  -8.407  -0.372
  728   1HZ   LYS  91          1HZ       LYS  91 -11.699  -7.282  -2.336
  729   2HZ   LYS  91          2HZ       LYS  91 -11.740  -8.804  -1.709
  730   3HZ   LYS  91          3HZ       LYS  91 -12.016  -7.506  -0.731
  731    H    ILE  92           H        ILE  92 -10.108  -0.622  -3.362
  732    HA   ILE  92           HA       ILE  92  -7.521   0.657  -2.953
  733    HB   ILE  92           HB       ILE  92 -10.166   2.058  -3.368
  734   1HG1  ILE  92          1HG1      ILE  92 -10.074   0.521  -5.211
  735   2HG1  ILE  92          2HG1      ILE  92  -9.679   2.145  -5.758
  736   1HG2  ILE  92          1HG2      ILE  92  -7.238   2.759  -3.894
  737   2HG2  ILE  92          2HG2      ILE  92  -8.629   3.772  -4.337
  738   3HG2  ILE  92          3HG2      ILE  92  -8.277   3.430  -2.633
  739   1HD1  ILE  92          1HD1      ILE  92  -7.266   1.558  -5.815
  740   2HD1  ILE  92          2HD1      ILE  92  -7.669  -0.089  -5.257
  741   3HD1  ILE  92          3HD1      ILE  92  -8.252   0.495  -6.826
  742    H    VAL  93           H        VAL  93  -7.216  -0.130  -0.789
  743    HA   VAL  93           HA       VAL  93  -9.006   0.522   1.365
  744    HB   VAL  93           HB       VAL  93  -6.075  -0.304   1.327
  745   1HG1  VAL  93          1HG1      VAL  93  -6.554   0.846   3.453
  746   2HG1  VAL  93          2HG1      VAL  93  -8.034  -0.113   3.665
  747   3HG1  VAL  93          3HG1      VAL  93  -6.439  -0.889   3.722
  748   1HG2  VAL  93          1HG2      VAL  93  -8.644  -1.871   1.863
  749   2HG2  VAL  93          2HG2      VAL  93  -7.632  -2.007   0.410
  750   3HG2  VAL  93          3HG2      VAL  93  -6.994  -2.511   1.975
  751    H    LYS  94           H        LYS  94  -9.469   2.612   1.753
  752    HA   LYS  94           HA       LYS  94  -7.698   4.809   1.470
  753   1HB   LYS  94          1HB       LYS  94  -9.232   6.031   2.875
  754   2HB   LYS  94          2HB       LYS  94 -10.064   5.179   1.564
  755   1HG   LYS  94          1HG       LYS  94 -10.766   3.400   3.150
  756   2HG   LYS  94          2HG       LYS  94  -9.945   4.240   4.472
  757   1HD   LYS  94          1HD       LYS  94 -12.337   5.262   2.890
  758   2HD   LYS  94          2HD       LYS  94 -12.309   4.639   4.541
  759   1HE   LYS  94          1HE       LYS  94 -12.266   6.860   5.035
  760   2HE   LYS  94          2HE       LYS  94 -10.521   6.589   4.936
  761   1HZ   LYS  94          1HZ       LYS  94 -12.234   7.587   2.752
  762   2HZ   LYS  94          2HZ       LYS  94 -11.315   8.535   3.733
  763   3HZ   LYS  94          3HZ       LYS  94 -10.593   7.488   2.701
  764    H    TRP  95           H        TRP  95  -6.119   5.611   2.724
  765    HA   TRP  95           HA       TRP  95  -5.033   4.030   4.891
  766   1HB   TRP  95          1HB       TRP  95  -3.389   5.106   3.664
  767   2HB   TRP  95          2HB       TRP  95  -4.375   6.533   3.408
  768    HD1  TRP  95           HD1      TRP  95  -3.042   5.057   6.734
  769    HE1  TRP  95           HE1      TRP  95  -2.175   7.030   8.144
  770    HE3  TRP  95           HE3      TRP  95  -3.358   8.761   3.241
  771    HZ2  TRP  95           HZ2      TRP  95  -1.915   9.906   7.857
  772    HZ3  TRP  95           HZ3      TRP  95  -2.724  11.071   3.802
  773    HH2  TRP  95           HH2      TRP  95  -2.105  11.676   6.115
  774    H    ASP  96           H        ASP  96  -6.099   3.963   6.820
  775    HA   ASP  96           HA       ASP  96  -7.494   6.292   7.905
  776   1HB   ASP  96          1HB       ASP  96  -8.268   3.989   8.388
  777   2HB   ASP  96          2HB       ASP  96  -6.719   3.661   9.193
  778    H    ARG  97           H        ARG  97  -6.684   7.648   9.395
  779    HA   ARG  97           HA       ARG  97  -3.733   7.675   9.864
  780   1HB   ARG  97          1HB       ARG  97  -3.996  10.106  10.139
  781   2HB   ARG  97          2HB       ARG  97  -4.479   9.505   8.569
  782   1HG   ARG  97          1HG       ARG  97  -6.920   9.495   9.995
  783   2HG   ARG  97          2HG       ARG  97  -6.082  10.915  10.599
  784   1HD   ARG  97          1HD       ARG  97  -7.478  11.465   8.678
  785   2HD   ARG  97          2HD       ARG  97  -5.764  11.751   8.317
  786    HE   ARG  97           HE       ARG  97  -6.505   9.110   7.479
  787   1HH1  ARG  97          1HH2      ARG  97  -7.053  12.489   6.551
  788   2HH1  ARG  97          2HH2      ARG  97  -7.222  12.126   4.850
  789   1HH2  ARG  97          1HH1      ARG  97  -6.676   8.658   5.239
  790   2HH2  ARG  97          2HH1      ARG  97  -7.106   9.912   4.108
  791    H    ASP  98           H        ASP  98  -4.919   9.847  11.987
  792    HA   ASP  98           HA       ASP  98  -4.723   8.121  14.288
  793   1HB   ASP  98          1HB       ASP  98  -4.100  10.488  14.366
  794   2HB   ASP  98          2HB       ASP  98  -5.745  10.972  13.929
  795    H    MET  99           H        MET  99  -7.424   9.900  12.707
  796    HA   MET  99           HA       MET  99  -9.260   7.740  12.840
  797   1HB   MET  99          1HB       MET  99 -10.932   8.827  14.332
  798   2HB   MET  99          2HB       MET  99  -9.491   8.294  15.197
  799   1HG   MET  99          1HG       MET  99  -8.610  10.620  15.143
  800   2HG   MET  99          2HG       MET  99 -10.082  11.150  14.321
  801   1HE   MET  99          1HE       MET  99  -8.701  12.270  17.106
  802   2HE   MET  99          2HE       MET  99 -10.041  13.025  16.212
  803   3HE   MET  99          3HE       MET  99 -10.208  12.688  17.951
  Start of MODEL    8
    1   1H    MET   0          1H        MET   0  -8.825 -23.795  -1.757
    2   2H    MET   0          2H        MET   0  -7.462 -23.865  -0.829
    3   3H    MET   0          3H        MET   0  -8.281 -22.446  -0.967
    4    HA   MET   0           HA       MET   0  -6.872 -23.835  -3.113
    5   1HB   MET   0          1HB       MET   0  -8.180 -21.080  -3.158
    6   2HB   MET   0          2HB       MET   0  -7.333 -21.890  -4.491
    7   1HG   MET   0          1HG       MET   0  -9.065 -23.701  -4.430
    8   2HG   MET   0          2HG       MET   0  -9.954 -22.754  -3.222
    9   1HE   MET   0          1HE       MET   0 -11.454 -23.757  -5.579
   10   2HE   MET   0          2HE       MET   0 -12.203 -22.548  -4.509
   11   3HE   MET   0          3HE       MET   0 -12.260 -22.331  -6.273
   12    H    ILE   1           H        ILE   1  -4.984 -22.518  -3.924
   13    HA   ILE   1           HA       ILE   1  -3.453 -21.509  -1.613
   14    HB   ILE   1           HB       ILE   1  -2.456 -21.962  -4.418
   15   1HG1  ILE   1          1HG1      ILE   1  -3.477 -24.076  -3.837
   16   2HG1  ILE   1          2HG1      ILE   1  -1.731 -24.209  -3.763
   17   1HG2  ILE   1          1HG2      ILE   1  -1.070 -21.994  -1.697
   18   2HG2  ILE   1          2HG2      ILE   1  -0.301 -22.370  -3.253
   19   3HG2  ILE   1          3HG2      ILE   1  -0.926 -20.752  -2.940
   20   1HD1  ILE   1          1HD1      ILE   1  -1.785 -24.099  -1.293
   21   2HD1  ILE   1          2HD1      ILE   1  -3.551 -23.892  -1.330
   22   3HD1  ILE   1          3HD1      ILE   1  -2.818 -25.395  -1.907
   23    H    GLN   2           H        GLN   2  -5.548 -19.849  -2.277
   24    HA   GLN   2           HA       GLN   2  -4.481 -17.568  -3.859
   25   1HB   GLN   2          1HB       GLN   2  -7.250 -18.255  -2.861
   26   2HB   GLN   2          2HB       GLN   2  -6.807 -16.829  -3.805
   27   1HG   GLN   2          1HG       GLN   2  -5.997 -18.311  -5.645
   28   2HG   GLN   2          2HG       GLN   2  -6.493 -19.729  -4.725
   29   1HE2  GLN   2          2HE2      GLN   2  -7.484 -19.182  -7.323
   30   2HE2  GLN   2          1HE2      GLN   2  -9.195 -18.839  -7.185
   31    H    ARG   3           H        ARG   3  -2.952 -17.158  -1.843
   32    HA   ARG   3           HA       ARG   3  -4.133 -16.714   0.706
   33   1HB   ARG   3          1HB       ARG   3  -1.489 -15.790  -0.416
   34   2HB   ARG   3          2HB       ARG   3  -2.035 -15.600   1.267
   35   1HG   ARG   3          1HG       ARG   3  -2.343 -18.195   1.235
   36   2HG   ARG   3          2HG       ARG   3  -1.269 -18.133  -0.188
   37   1HD   ARG   3          1HD       ARG   3   0.309 -16.700   1.200
   38   2HD   ARG   3          2HD       ARG   3  -0.771 -16.971   2.593
   39    HE   ARG   3           HE       ARG   3   0.067 -19.473   1.492
   40   1HH1  ARG   3          1HH2      ARG   3   1.225 -16.687   3.374
   41   2HH1  ARG   3          2HH2      ARG   3   2.521 -17.584   4.134
   42   1HH2  ARG   3          1HH1      ARG   3   1.815 -20.635   2.528
   43   2HH2  ARG   3          2HH1      ARG   3   2.854 -19.790   3.657
   44    H    THR   4           H        THR   4  -5.474 -15.141   1.282
   45    HA   THR   4           HA       THR   4  -5.918 -12.776  -0.163
   46    HB   THR   4           HB       THR   4  -6.596 -13.316   2.761
   47    HG1  THR   4           HG1      THR   4  -7.914 -14.185   0.409
   48   1HG2  THR   4          1HG2      THR   4  -8.620 -12.002   2.257
   49   2HG2  THR   4          2HG2      THR   4  -7.167 -11.034   1.953
   50   3HG2  THR   4          3HG2      THR   4  -8.065 -11.747   0.591
   51    HA   PRO   5           HA       PRO   5  -2.432 -10.493   1.609
   52   1HB   PRO   5          1HB       PRO   5  -2.952  -7.977   0.668
   53   2HB   PRO   5          2HB       PRO   5  -2.417  -9.315  -0.386
   54   1HG   PRO   5          1HG       PRO   5  -5.250  -8.356   0.102
   55   2HG   PRO   5          2HG       PRO   5  -4.449  -8.660  -1.467
   56   1HD   PRO   5          1HD       PRO   5  -6.054 -10.504  -0.272
   57   2HD   PRO   5          2HD       PRO   5  -4.582 -11.013  -1.159
   58    H    LYS   6           H        LYS   6  -2.102  -9.726   3.629
   59    HA   LYS   6           HA       LYS   6  -4.277  -8.439   5.173
   60   1HB   LYS   6          1HB       LYS   6  -2.911 -10.350   6.122
   61   2HB   LYS   6          2HB       LYS   6  -1.504  -9.268   6.086
   62   1HG   LYS   6          1HG       LYS   6  -2.943  -7.599   7.400
   63   2HG   LYS   6          2HG       LYS   6  -4.138  -8.892   7.572
   64   1HD   LYS   6          1HD       LYS   6  -2.441 -10.300   8.728
   65   2HD   LYS   6          2HD       LYS   6  -1.249  -8.990   8.560
   66   1HE   LYS   6          1HE       LYS   6  -2.729  -7.478   9.873
   67   2HE   LYS   6          2HE       LYS   6  -3.909  -8.791  10.053
   68   1HZ   LYS   6          1HZ       LYS   6  -2.251 -10.034  11.240
   69   2HZ   LYS   6          2HZ       LYS   6  -1.160  -8.806  11.083
   70   3HZ   LYS   6          3HZ       LYS   6  -2.533  -8.583  11.966
   71    H    ILE   7           H        ILE   7  -4.384  -6.291   5.012
   72    HA   ILE   7           HA       ILE   7  -2.098  -4.713   4.027
   73    HB   ILE   7           HB       ILE   7  -4.785  -3.536   4.587
   74   1HG1  ILE   7          1HG1      ILE   7  -5.599  -5.517   3.542
   75   2HG1  ILE   7          2HG1      ILE   7  -5.705  -4.164   2.435
   76   1HG2  ILE   7          1HG2      ILE   7  -2.814  -3.169   2.305
   77   2HG2  ILE   7          2HG2      ILE   7  -4.256  -2.196   2.629
   78   3HG2  ILE   7          3HG2      ILE   7  -2.897  -2.181   3.764
   79   1HD1  ILE   7          1HD1      ILE   7  -3.671  -6.409   2.312
   80   2HD1  ILE   7          2HD1      ILE   7  -5.006  -6.080   1.206
   81   3HD1  ILE   7          3HD1      ILE   7  -3.628  -4.965   1.281
   82    H    GLN   8           H        GLN   8  -0.940  -3.264   5.466
   83    HA   GLN   8           HA       GLN   8  -2.437  -2.159   7.749
   84   1HB   GLN   8          1HB       GLN   8  -0.314  -2.494   9.037
   85   2HB   GLN   8          2HB       GLN   8  -1.367  -3.901   8.848
   86   1HG   GLN   8          1HG       GLN   8   1.090  -3.386   7.152
   87   2HG   GLN   8          2HG       GLN   8   1.126  -4.323   8.654
   88   1HE2  GLN   8          2HE2      GLN   8   1.510  -4.958   5.607
   89   2HE2  GLN   8          1HE2      GLN   8   0.504  -6.380   5.393
   90    H    VAL   9           H        VAL   9  -2.638  -0.320   6.420
   91    HA   VAL   9           HA       VAL   9  -0.312   1.005   5.329
   92    HB   VAL   9           HB       VAL   9  -3.101   2.129   5.746
   93   1HG1  VAL   9          1HG1      VAL   9  -1.352   3.820   5.187
   94   2HG1  VAL   9          2HG1      VAL   9  -0.889   2.862   3.774
   95   3HG1  VAL   9          3HG1      VAL   9  -2.503   3.593   3.869
   96   1HG2  VAL   9          1HG2      VAL   9  -1.982   0.523   3.410
   97   2HG2  VAL   9          2HG2      VAL   9  -3.357   0.084   4.451
   98   3HG2  VAL   9          3HG2      VAL   9  -3.491   1.465   3.363
   99    H    TYR  10           H        TYR  10   0.954   2.533   6.300
  100    HA   TYR  10           HA       TYR  10   0.143   3.600   8.981
  101   1HB   TYR  10          1HB       TYR  10   2.944   3.433   7.934
  102   2HB   TYR  10          2HB       TYR  10   2.384   3.652   9.581
  103    HD1  TYR  10           HD1      TYR  10   3.739   1.322   7.333
  104    HD2  TYR  10           HD2      TYR  10   0.789   1.653  10.453
  105    HE1  TYR  10           HE1      TYR  10   4.009  -1.089   7.826
  106    HE2  TYR  10           HE2      TYR  10   0.993  -0.786  10.893
  107    HH   TYR  10           HH       TYR  10   2.124  -2.705  10.436
  108    H    SER  11           H        SER  11   0.796   5.683   9.504
  109    HA   SER  11           HA       SER  11   2.021   7.403   7.436
  110   1HB   SER  11          1HB       SER  11   0.927   9.390   8.523
  111   2HB   SER  11          2HB       SER  11  -0.034   8.389   7.455
  112    HG   SER  11           HG       SER  11  -0.824   7.334   9.420
  113    H    ARG  12           H        ARG  12   3.993   8.107   8.219
  114    HA   ARG  12           HA       ARG  12   4.839   7.083  10.797
  115   1HB   ARG  12          1HB       ARG  12   6.175   8.525   8.512
  116   2HB   ARG  12          2HB       ARG  12   6.963   8.480  10.093
  117   1HG   ARG  12          1HG       ARG  12   7.740   6.623   8.737
  118   2HG   ARG  12          2HG       ARG  12   6.887   6.055  10.177
  119   1HD   ARG  12          1HD       ARG  12   4.841   5.642   8.732
  120   2HD   ARG  12          2HD       ARG  12   5.782   6.174   7.342
  121    HE   ARG  12           HE       ARG  12   7.017   4.214   7.375
  122   1HH1  ARG  12          1HH2      ARG  12   4.886   4.236  10.232
  123   2HH1  ARG  12          2HH2      ARG  12   4.912   2.501  10.394
  124   1HH2  ARG  12          1HH1      ARG  12   7.022   1.979   7.606
  125   2HH2  ARG  12          2HH1      ARG  12   6.188   1.212   8.939
  126    H    HIS  13           H        HIS  13   4.935  10.468   9.534
  127    HA   HIS  13           HA       HIS  13   4.424  11.495  12.259
  128   1HB   HIS  13          1HB       HIS  13   4.456  13.020   9.650
  129   2HB   HIS  13          2HB       HIS  13   4.524  13.675  11.284
  130    HD2  HIS  13           HD2      HIS  13   6.826  13.182   8.477
  131    HE1  HIS  13           HE1      HIS  13   9.242  12.448  11.875
  132    HE2  HIS  13           HE2      HIS  13   9.280  12.917   9.363
  133    HA   PRO  14           HA       PRO  14   0.052  11.137  11.426
  134   1HB   PRO  14          1HB       PRO  14  -1.067  12.643  13.369
  135   2HB   PRO  14          2HB       PRO  14   0.020  11.291  13.766
  136   1HG   PRO  14          1HG       PRO  14   0.785  14.219  13.537
  137   2HG   PRO  14          2HG       PRO  14   1.073  13.128  14.925
  138   1HD   PRO  14          1HD       PRO  14   2.955  13.571  12.986
  139   2HD   PRO  14          2HD       PRO  14   2.784  11.971  13.755
  140    H    ALA  15           H        ALA  15   1.036  12.504   9.387
  141    HA   ALA  15           HA       ALA  15   0.632  13.907   7.712
  142   1HB   ALA  15          1HB       ALA  15  -1.691  13.185   7.990
  143   2HB   ALA  15          2HB       ALA  15  -2.008  14.543   9.084
  144   3HB   ALA  15          3HB       ALA  15  -1.590  14.854   7.399
  145    H    GLU  16           H        GLU  16   0.514  16.181   7.019
  146    HA   GLU  16           HA       GLU  16   0.295  18.243   8.987
  147   1HB   GLU  16          1HB       GLU  16   2.698  17.682   9.352
  148   2HB   GLU  16          2HB       GLU  16   3.000  17.890   7.622
  149   1HG   GLU  16          1HG       GLU  16   3.681  19.902   8.871
  150   2HG   GLU  16          2HG       GLU  16   2.332  20.298   7.806
  151    H    ASN  17           H        ASN  17  -0.864  19.740   7.951
  152    HA   ASN  17           HA       ASN  17  -1.697  19.501   5.335
  153   1HB   ASN  17          1HB       ASN  17  -2.505  21.924   5.697
  154   2HB   ASN  17          2HB       ASN  17  -3.142  20.608   6.676
  155   1HD2  ASN  17          2HD2      ASN  17  -0.317  22.900   6.862
  156   2HD2  ASN  17          1HD2      ASN  17  -0.551  23.251   8.565
  157    H    GLY  18           H        GLY  18  -0.432  19.528   3.587
  158   1HA   GLY  18          1HA       GLY  18   0.817  20.374   1.890
  159   2HA   GLY  18          2HA       GLY  18   0.608  21.981   2.598
  160    H    LYS  19           H        LYS  19   2.174  19.211   4.269
  161    HA   LYS  19           HA       LYS  19   4.847  20.243   3.557
  162   1HB   LYS  19          1HB       LYS  19   4.118  21.279   5.706
  163   2HB   LYS  19          2HB       LYS  19   4.115  19.650   6.398
  164   1HG   LYS  19          1HG       LYS  19   6.539  20.907   5.064
  165   2HG   LYS  19          2HG       LYS  19   6.139  21.266   6.742
  166   1HD   LYS  19          1HD       LYS  19   6.708  18.465   5.720
  167   2HD   LYS  19          2HD       LYS  19   7.876  19.553   6.460
  168   1HE   LYS  19          1HE       LYS  19   6.627  19.548   8.569
  169   2HE   LYS  19          2HE       LYS  19   5.343  18.561   7.845
  170   1HZ   LYS  19          1HZ       LYS  19   6.924  16.830   7.487
  171   2HZ   LYS  19          2HZ       LYS  19   8.102  17.704   8.245
  172   3HZ   LYS  19          3HZ       LYS  19   6.770  17.212   9.084
  173    H    SER  20           H        SER  20   6.032  18.747   3.042
  174    HA   SER  20           HA       SER  20   5.495  16.381   2.208
  175   1HB   SER  20          1HB       SER  20   8.208  17.075   3.283
  176   2HB   SER  20          2HB       SER  20   7.794  16.097   1.867
  177    HG   SER  20           HG       SER  20   6.826  17.949   0.958
  178    H    ASN  21           H        ASN  21   4.642  14.586   3.302
  179    HA   ASN  21           HA       ASN  21   5.661  13.748   5.961
  180   1HB   ASN  21          1HB       ASN  21   3.290  14.812   5.419
  181   2HB   ASN  21          2HB       ASN  21   2.893  13.167   4.981
  182   1HD2  ASN  21          2HD2      ASN  21   3.174  11.503   6.739
  183   2HD2  ASN  21          1HD2      ASN  21   3.063  12.004   8.409
  184    H    PHE  22           H        PHE  22   4.758  11.187   6.136
  185    HA   PHE  22           HA       PHE  22   5.726   9.772   3.681
  186   1HB   PHE  22          1HB       PHE  22   7.047   9.970   6.245
  187   2HB   PHE  22          2HB       PHE  22   6.601   8.299   5.937
  188    HD1  PHE  22           HD1      PHE  22   9.157  10.649   5.411
  189    HD2  PHE  22           HD2      PHE  22   7.046   7.453   3.424
  190    HE1  PHE  22           HE1      PHE  22  11.098  10.290   3.915
  191    HE2  PHE  22           HE2      PHE  22   8.972   7.138   1.894
  192    HZ   PHE  22           HZ       PHE  22  11.024   8.513   2.177
  193    H    LEU  23           H        LEU  23   4.318   8.468   2.939
  194    HA   LEU  23           HA       LEU  23   2.278   7.132   4.647
  195   1HB   LEU  23          1HB       LEU  23   1.365   8.628   2.986
  196   2HB   LEU  23          2HB       LEU  23   2.370   7.908   1.725
  197    HG   LEU  23           HG       LEU  23   0.995   5.788   2.038
  198   1HD1  LEU  23          1HD1      LEU  23  -0.607   7.674   3.841
  199   2HD1  LEU  23          2HD1      LEU  23  -1.179   6.097   3.250
  200   3HD1  LEU  23          3HD1      LEU  23   0.199   6.182   4.355
  201   1HD2  LEU  23          1HD2      LEU  23   0.502   7.505   0.291
  202   2HD2  LEU  23          2HD2      LEU  23  -0.992   6.769   0.911
  203   3HD2  LEU  23          3HD2      LEU  23  -0.494   8.388   1.460
  204    H    ASN  24           H        ASN  24   2.497   4.989   4.884
  205    HA   ASN  24           HA       ASN  24   4.293   3.433   3.041
  206   1HB   ASN  24          1HB       ASN  24   3.964   3.447   6.036
  207   2HB   ASN  24          2HB       ASN  24   4.554   2.030   5.167
  208   1HD2  ASN  24          2HD2      ASN  24   5.359   5.508   4.489
  209   2HD2  ASN  24          1HD2      ASN  24   7.057   5.317   4.849
  210    H    CYS  25           H        CYS  25   2.724   2.528   1.714
  211    HA   CYS  25           HA       CYS  25   0.439   1.088   2.923
  212   1HB   CYS  25          1HB       CYS  25   1.434   0.874   0.068
  213   2HB   CYS  25          2HB       CYS  25  -0.096   0.355   0.731
  214    H    TYR  26           H        TYR  26   1.169  -0.647   4.144
  215    HA   TYR  26           HA       TYR  26   3.306  -2.366   2.982
  216   1HB   TYR  26          1HB       TYR  26   3.820  -1.387   5.208
  217   2HB   TYR  26          2HB       TYR  26   2.341  -2.053   5.838
  218    HD1  TYR  26           HD1      TYR  26   4.765  -3.858   3.555
  219    HD2  TYR  26           HD2      TYR  26   3.298  -3.393   7.564
  220    HE1  TYR  26           HE1      TYR  26   5.525  -6.115   4.083
  221    HE2  TYR  26           HE2      TYR  26   4.061  -5.674   8.117
  222    HH   TYR  26           HH       TYR  26   5.903  -7.676   5.774
  223    H    VAL  27           H        VAL  27   2.733  -4.394   2.339
  224    HA   VAL  27           HA       VAL  27   0.100  -5.477   3.195
  225    HB   VAL  27           HB       VAL  27   1.228  -5.786   0.365
  226   1HG1  VAL  27          1HG1      VAL  27  -0.440  -7.476   1.241
  227   2HG1  VAL  27          2HG1      VAL  27  -1.553  -6.140   1.537
  228   3HG1  VAL  27          3HG1      VAL  27  -1.050  -6.525  -0.124
  229   1HG2  VAL  27          1HG2      VAL  27  -0.817  -3.809   1.352
  230   2HG2  VAL  27          2HG2      VAL  27   0.775  -3.414   0.658
  231   3HG2  VAL  27          3HG2      VAL  27  -0.454  -4.188  -0.357
  232    H    SER  28           H        SER  28   0.224  -7.765   3.600
  233    HA   SER  28           HA       SER  28   2.530  -9.246   2.742
  234   1HB   SER  28          1HB       SER  28   3.414  -9.776   4.998
  235   2HB   SER  28          2HB       SER  28   3.515  -8.046   4.738
  236    HG   SER  28           HG       SER  28   1.621  -7.817   5.974
  237    H    GLY  29           H        GLY  29   2.567 -11.483   3.864
  238   1HA   GLY  29          1HA       GLY  29   1.458 -13.314   4.749
  239   2HA   GLY  29          2HA       GLY  29  -0.075 -12.437   4.737
  240    H    PHE  30           H        PHE  30   0.787 -11.732   1.748
  241    HA   PHE  30           HA       PHE  30  -0.863 -13.850   0.613
  242   1HB   PHE  30          1HB       PHE  30  -1.007 -12.416  -1.312
  243   2HB   PHE  30          2HB       PHE  30  -1.356 -11.541   0.139
  244    HD1  PHE  30           HD1      PHE  30   1.109 -12.033  -2.558
  245    HD2  PHE  30           HD2      PHE  30   0.047  -9.614   0.856
  246    HE1  PHE  30           HE1      PHE  30   3.049 -10.580  -2.991
  247    HE2  PHE  30           HE2      PHE  30   1.975  -8.139   0.377
  248    HZ   PHE  30           HZ       PHE  30   3.534  -8.708  -1.462
  249    H    HIS  31           H        HIS  31  -0.158 -14.664  -1.649
  250    HA   HIS  31           HA       HIS  31   2.462 -14.421  -2.658
  251   1HB   HIS  31          1HB       HIS  31   3.555 -16.337  -2.250
  252   2HB   HIS  31          2HB       HIS  31   2.787 -16.154  -0.690
  253    HD2  HIS  31           HD2      HIS  31   2.187 -18.184  -4.012
  254    HE1  HIS  31           HE1      HIS  31   0.903 -20.476  -0.693
  255    HE2  HIS  31           HE2      HIS  31   1.244 -20.506  -3.231
  256    HA   PRO  32           HA       PRO  32   3.437 -15.939  -4.526
  257   1HB   PRO  32          1HB       PRO  32   3.605 -16.056  -7.230
  258   2HB   PRO  32          2HB       PRO  32   2.882 -17.379  -6.297
  259   1HG   PRO  32          1HG       PRO  32   1.407 -15.072  -7.603
  260   2HG   PRO  32          2HG       PRO  32   1.150 -16.821  -7.884
  261   1HD   PRO  32          1HD       PRO  32  -0.323 -15.437  -6.063
  262   2HD   PRO  32          2HD       PRO  32   0.188 -17.113  -5.742
  263    H    SER  33           H        SER  33   4.599 -14.538  -6.705
  264    HA   SER  33           HA       SER  33   4.949 -12.100  -5.247
  265   1HB   SER  33          1HB       SER  33   7.026 -12.045  -6.576
  266   2HB   SER  33          2HB       SER  33   6.731 -13.705  -6.017
  267    HG   SER  33           HG       SER  33   6.161 -12.666  -8.579
  268    H    ASP  34           H        ASP  34   2.505 -12.237  -7.157
  269    HA   ASP  34           HA       ASP  34   3.270 -10.020  -9.027
  270   1HB   ASP  34          1HB       ASP  34   2.897 -12.184 -10.110
  271   2HB   ASP  34          2HB       ASP  34   1.292 -12.290  -9.385
  272    H    ILE  35           H        ILE  35   2.729  -8.525  -7.290
  273    HA   ILE  35           HA       ILE  35  -0.191  -7.973  -7.190
  274    HB   ILE  35           HB       ILE  35   0.543  -8.898  -5.140
  275   1HG1  ILE  35          1HG1      ILE  35   0.202  -5.917  -4.621
  276   2HG1  ILE  35          2HG1      ILE  35  -1.116  -6.959  -5.138
  277   1HG2  ILE  35          1HG2      ILE  35   2.499  -6.622  -4.921
  278   2HG2  ILE  35          2HG2      ILE  35   2.162  -7.869  -3.693
  279   3HG2  ILE  35          3HG2      ILE  35   2.909  -8.343  -5.218
  280   1HD1  ILE  35          1HD1      ILE  35  -0.581  -8.463  -3.140
  281   2HD1  ILE  35          2HD1      ILE  35   0.454  -7.167  -2.550
  282   3HD1  ILE  35          3HD1      ILE  35  -1.268  -6.860  -2.786
  283    H    GLU  36           H        GLU  36  -0.849  -5.905  -7.146
  284    HA   GLU  36           HA       GLU  36   1.006  -3.770  -8.089
  285   1HB   GLU  36          1HB       GLU  36  -1.966  -3.960  -8.583
  286   2HB   GLU  36          2HB       GLU  36  -0.777  -2.882  -9.312
  287   1HG   GLU  36          1HG       GLU  36   0.356  -5.030 -10.178
  288   2HG   GLU  36          2HG       GLU  36  -1.105  -5.879  -9.696
  289    H    VAL  37           H        VAL  37   1.060  -1.909  -6.916
  290    HA   VAL  37           HA       VAL  37  -1.146  -1.115  -5.143
  291    HB   VAL  37           HB       VAL  37   1.730  -1.492  -4.187
  292   1HG1  VAL  37          1HG1      VAL  37   0.609   0.473  -3.052
  293   2HG1  VAL  37          2HG1      VAL  37  -0.639  -0.650  -2.469
  294   3HG1  VAL  37          3HG1      VAL  37   1.038  -0.865  -1.979
  295   1HG2  VAL  37          1HG2      VAL  37  -0.858  -2.974  -3.586
  296   2HG2  VAL  37          2HG2      VAL  37   0.661  -3.638  -4.238
  297   3HG2  VAL  37          3HG2      VAL  37   0.567  -3.096  -2.556
  298    H    ASP  38           H        ASP  38  -1.429   0.372  -6.902
  299    HA   ASP  38           HA       ASP  38   0.499   2.561  -7.239
  300   1HB   ASP  38          1HB       ASP  38  -2.436   2.339  -8.076
  301   2HB   ASP  38          2HB       ASP  38  -1.325   3.637  -8.485
  302    H    LEU  39           H        LEU  39   0.622   4.234  -5.783
  303    HA   LEU  39           HA       LEU  39  -1.434   4.517  -3.697
  304   1HB   LEU  39          1HB       LEU  39   1.249   5.893  -4.103
  305   2HB   LEU  39          2HB       LEU  39   0.090   6.207  -2.800
  306    HG   LEU  39           HG       LEU  39   0.200   3.688  -2.289
  307   1HD1  LEU  39          1HD1      LEU  39   2.801   3.978  -3.795
  308   2HD1  LEU  39          2HD1      LEU  39   2.390   2.610  -2.747
  309   3HD1  LEU  39          3HD1      LEU  39   1.497   2.864  -4.239
  310   1HD2  LEU  39          1HD2      LEU  39   1.214   5.482  -0.860
  311   2HD2  LEU  39          2HD2      LEU  39   2.242   4.037  -0.877
  312   3HD2  LEU  39          3HD2      LEU  39   2.671   5.421  -1.886
  313    H    LEU  40           H        LEU  40  -2.997   6.021  -3.758
  314    HA   LEU  40           HA       LEU  40  -3.262   7.674  -6.229
  315   1HB   LEU  40          1HB       LEU  40  -4.266   5.220  -5.967
  316   2HB   LEU  40          2HB       LEU  40  -5.467   6.036  -4.989
  317    HG   LEU  40           HG       LEU  40  -6.268   5.682  -7.215
  318   1HD1  LEU  40          1HD1      LEU  40  -6.998   7.763  -6.138
  319   2HD1  LEU  40          2HD1      LEU  40  -5.669   8.651  -6.925
  320   3HD1  LEU  40          3HD1      LEU  40  -6.947   7.911  -7.901
  321   1HD2  LEU  40          1HD2      LEU  40  -3.986   7.340  -8.308
  322   2HD2  LEU  40          2HD2      LEU  40  -4.011   5.564  -8.297
  323   3HD2  LEU  40          3HD2      LEU  40  -5.224   6.471  -9.221
  324    H    LYS  41           H        LYS  41  -3.783   9.848  -5.695
  325    HA   LYS  41           HA       LYS  41  -4.745  10.419  -2.995
  326   1HB   LYS  41          1HB       LYS  41  -4.277  12.282  -5.321
  327   2HB   LYS  41          2HB       LYS  41  -4.581  12.731  -3.626
  328   1HG   LYS  41          1HG       LYS  41  -2.489  12.714  -3.177
  329   2HG   LYS  41          2HG       LYS  41  -2.459  10.977  -3.442
  330   1HD   LYS  41          1HD       LYS  41  -0.738  11.947  -4.773
  331   2HD   LYS  41          2HD       LYS  41  -1.982  11.386  -5.870
  332   1HE   LYS  41          1HE       LYS  41  -1.054  13.587  -6.525
  333   2HE   LYS  41          2HE       LYS  41  -2.786  13.697  -6.200
  334   1HZ   LYS  41          1HZ       LYS  41  -0.770  14.410  -4.194
  335   2HZ   LYS  41          2HZ       LYS  41  -1.449  15.487  -5.248
  336   3HZ   LYS  41          3HZ       LYS  41  -2.403  14.704  -4.177
  337    H    ASN  42           H        ASN  42  -6.295  12.697  -4.384
  338    HA   ASN  42           HA       ASN  42  -8.948  11.623  -4.088
  339   1HB   ASN  42          1HB       ASN  42  -9.655  13.846  -4.779
  340   2HB   ASN  42          2HB       ASN  42  -8.313  14.019  -3.646
  341   1HD2  ASN  42          2HD2      ASN  42  -6.169  14.673  -4.509
  342   2HD2  ASN  42          1HD2      ASN  42  -6.057  15.412  -6.084
  343    H    GLY  43           H        GLY  43  -6.673  11.749  -6.732
  344   1HA   GLY  43          1HA       GLY  43  -8.424  10.257  -8.478
  345   2HA   GLY  43          2HA       GLY  43  -8.267  11.950  -8.980
  346    H    GLU  44           H        GLU  44  -5.525  12.372  -8.189
  347    HA   GLU  44           HA       GLU  44  -4.257  11.212 -10.544
  348   1HB   GLU  44          1HB       GLU  44  -4.013  13.591  -9.968
  349   2HB   GLU  44          2HB       GLU  44  -3.273  13.162  -8.421
  350   1HG   GLU  44          1HG       GLU  44  -1.607  13.869 -10.060
  351   2HG   GLU  44          2HG       GLU  44  -1.328  12.197  -9.588
  352    H    ARG  45           H        ARG  45  -2.333   9.950 -10.517
  353    HA   ARG  45           HA       ARG  45  -1.986   8.333  -8.043
  354   1HB   ARG  45          1HB       ARG  45  -1.477   6.509  -9.245
  355   2HB   ARG  45          2HB       ARG  45  -2.640   7.264 -10.339
  356   1HG   ARG  45          1HG       ARG  45  -0.757   8.142 -11.714
  357   2HG   ARG  45          2HG       ARG  45   0.410   7.411 -10.586
  358   1HD   ARG  45          1HD       ARG  45  -0.584   5.183 -10.994
  359   2HD   ARG  45          2HD       ARG  45  -1.588   5.894 -12.278
  360    HE   ARG  45           HE       ARG  45   0.941   6.706 -12.952
  361   1HH1  ARG  45          1HH2      ARG  45  -0.292   3.463 -12.108
  362   2HH1  ARG  45          2HH2      ARG  45   0.630   2.673 -13.353
  363   1HH2  ARG  45          1HH1      ARG  45   2.339   5.604 -14.364
  364   2HH2  ARG  45          2HH1      ARG  45   2.154   3.886 -14.628
  365    H    ILE  46           H        ILE  46   0.059   7.750  -7.311
  366    HA   ILE  46           HA       ILE  46   2.150   9.766  -7.666
  367    HB   ILE  46           HB       ILE  46   1.429   7.621  -5.639
  368   1HG1  ILE  46          1HG1      ILE  46   1.265  10.640  -5.294
  369   2HG1  ILE  46          2HG1      ILE  46  -0.109   9.724  -5.913
  370   1HG2  ILE  46          1HG2      ILE  46   3.819   8.018  -5.644
  371   2HG2  ILE  46          2HG2      ILE  46   3.541   9.784  -5.590
  372   3HG2  ILE  46          3HG2      ILE  46   3.044   8.747  -4.220
  373   1HD1  ILE  46          1HD1      ILE  46  -0.017   8.252  -3.869
  374   2HD1  ILE  46          2HD1      ILE  46   1.114   9.434  -3.177
  375   3HD1  ILE  46          3HD1      ILE  46  -0.528   9.909  -3.679
  376    H    GLU  47           H        GLU  47   3.469   9.048  -9.414
  377    HA   GLU  47           HA       GLU  47   3.635   6.249 -10.038
  378   1HB   GLU  47          1HB       GLU  47   3.382   8.119 -11.658
  379   2HB   GLU  47          2HB       GLU  47   5.045   8.632 -11.302
  380   1HG   GLU  47          1HG       GLU  47   5.927   6.567 -12.143
  381   2HG   GLU  47          2HG       GLU  47   4.318   5.815 -12.189
  382    H    LYS  48           H        LYS  48   5.874   8.719  -8.694
  383    HA   LYS  48           HA       LYS  48   8.043   6.783  -8.432
  384   1HB   LYS  48          1HB       LYS  48   8.638   9.022  -8.885
  385   2HB   LYS  48          2HB       LYS  48   7.722   9.641  -7.510
  386   1HG   LYS  48          1HG       LYS  48  10.133   9.681  -7.184
  387   2HG   LYS  48          2HG       LYS  48   9.342   8.746  -5.938
  388   1HD   LYS  48          1HD       LYS  48  10.609   7.397  -8.368
  389   2HD   LYS  48          2HD       LYS  48  11.568   7.917  -6.978
  390   1HE   LYS  48          1HE       LYS  48   9.857   6.540  -5.534
  391   2HE   LYS  48          2HE       LYS  48   9.459   5.765  -7.082
  392   1HZ   LYS  48          1HZ       LYS  48  11.792   5.232  -7.303
  393   2HZ   LYS  48          2HZ       LYS  48  12.078   5.829  -5.784
  394   3HZ   LYS  48          3HZ       LYS  48  11.079   4.544  -5.984
  395    H    VAL  49           H        VAL  49   6.609   5.241  -7.419
  396    HA   VAL  49           HA       VAL  49   6.312   5.490  -4.464
  397    HB   VAL  49           HB       VAL  49   5.778   3.128  -6.331
  398   1HG1  VAL  49          1HG1      VAL  49   6.176   2.415  -4.052
  399   2HG1  VAL  49          2HG1      VAL  49   5.058   3.636  -3.415
  400   3HG1  VAL  49          3HG1      VAL  49   4.456   2.280  -4.401
  401   1HG2  VAL  49          1HG2      VAL  49   3.904   5.314  -5.389
  402   2HG2  VAL  49          2HG2      VAL  49   4.270   4.764  -7.042
  403   3HG2  VAL  49          3HG2      VAL  49   3.344   3.723  -5.971
  404    H    GLU  50           H        GLU  50   8.024   4.700  -3.188
  405    HA   GLU  50           HA       GLU  50  10.162   3.143  -4.553
  406   1HB   GLU  50          1HB       GLU  50  10.584   5.463  -3.400
  407   2HB   GLU  50          2HB       GLU  50  10.523   4.531  -1.891
  408   1HG   GLU  50          1HG       GLU  50  12.461   3.339  -2.418
  409   2HG   GLU  50          2HG       GLU  50  12.249   3.541  -4.162
  410    H    HIS  51           H        HIS  51  11.181   1.520  -2.884
  411    HA   HIS  51           HA       HIS  51   9.110   0.406  -1.127
  412   1HB   HIS  51          1HB       HIS  51   9.122  -1.788  -2.257
  413   2HB   HIS  51          2HB       HIS  51   8.475  -0.508  -3.268
  414    HD2  HIS  51           HD2      HIS  51  12.315  -1.642  -3.045
  415    HE1  HIS  51           HE1      HIS  51  10.851  -2.216  -6.961
  416    HE2  HIS  51           HE2      HIS  51  12.897  -2.441  -5.442
  417    H    SER  52           H        SER  52   9.747  -1.443   0.036
  418    HA   SER  52           HA       SER  52  12.599  -1.433   0.836
  419   1HB   SER  52          1HB       SER  52  10.805  -1.427   2.543
  420   2HB   SER  52          2HB       SER  52  10.257  -3.015   1.951
  421    HG   SER  52           HG       SER  52  12.835  -2.402   2.978
  422    H    ASP  53           H        ASP  53  10.780  -2.864  -1.578
  423    HA   ASP  53           HA       ASP  53  11.139  -4.447  -3.060
  424   1HB   ASP  53          1HB       ASP  53  13.662  -3.848  -2.485
  425   2HB   ASP  53          2HB       ASP  53  13.675  -5.474  -1.792
  426    H    LEU  54           H        LEU  54  11.705  -7.056  -3.110
  427    HA   LEU  54           HA       LEU  54   9.534  -8.014  -1.479
  428   1HB   LEU  54          1HB       LEU  54  10.074  -8.645  -3.919
  429   2HB   LEU  54          2HB       LEU  54  11.259  -9.758  -3.241
  430    HG   LEU  54           HG       LEU  54   9.254 -10.964  -3.681
  431   1HD1  LEU  54          1HD1      LEU  54  10.352 -11.449  -1.468
  432   2HD1  LEU  54          2HD1      LEU  54   9.005 -10.559  -0.707
  433   3HD1  LEU  54          3HD1      LEU  54   8.681 -11.986  -1.661
  434   1HD2  LEU  54          1HD2      LEU  54   7.701  -8.817  -2.193
  435   2HD2  LEU  54          2HD2      LEU  54   7.619  -9.223  -3.915
  436   3HD2  LEU  54          3HD2      LEU  54   7.028 -10.337  -2.675
  437    H    SER  55           H        SER  55   9.681  -8.721   0.473
  438    HA   SER  55           HA       SER  55  12.094 -10.164   1.469
  439   1HB   SER  55          1HB       SER  55  12.117  -7.879   2.395
  440   2HB   SER  55          2HB       SER  55  10.440  -8.063   2.939
  441    HG   SER  55           HG       SER  55  11.927  -8.527   4.603
  442    H    PHE  56           H        PHE  56  11.110 -12.186   1.155
  443    HA   PHE  56           HA       PHE  56   8.363 -12.607   2.131
  444   1HB   PHE  56          1HB       PHE  56   8.494 -14.751   1.173
  445   2HB   PHE  56          2HB       PHE  56   8.959 -13.529   0.015
  446    HD1  PHE  56           HD1      PHE  56   9.779 -16.665   1.470
  447    HD2  PHE  56           HD2      PHE  56  11.440 -13.247  -0.554
  448    HE1  PHE  56           HE1      PHE  56  11.760 -18.011   0.812
  449    HE2  PHE  56           HE2      PHE  56  13.468 -14.556  -1.114
  450    HZ   PHE  56           HZ       PHE  56  13.634 -16.941  -0.432
  451    H    SER  57           H        SER  57  10.703 -11.950   3.968
  452    HA   SER  57           HA       SER  57  11.675 -12.509   5.873
  453   1HB   SER  57          1HB       SER  57  10.167 -13.232   7.639
  454   2HB   SER  57          2HB       SER  57   9.408 -12.062   6.559
  455    HG   SER  57           HG       SER  57   8.615 -14.128   5.470
  456    H    LYS  58           H        LYS  58  12.797 -14.300   4.178
  457    HA   LYS  58           HA       LYS  58  12.194 -16.507   3.172
  458   1HB   LYS  58          1HB       LYS  58  14.570 -15.662   3.881
  459   2HB   LYS  58          2HB       LYS  58  14.422 -16.769   5.254
  460   1HG   LYS  58          1HG       LYS  58  14.214 -18.680   3.678
  461   2HG   LYS  58          2HG       LYS  58  14.186 -17.554   2.307
  462   1HD   LYS  58          1HD       LYS  58  16.472 -16.797   2.877
  463   2HD   LYS  58          2HD       LYS  58  16.508 -17.920   4.253
  464   1HE   LYS  58          1HE       LYS  58  16.293 -19.843   2.732
  465   2HE   LYS  58          2HE       LYS  58  16.107 -18.758   1.340
  466   1HZ   LYS  58          1HZ       LYS  58  18.504 -18.955   3.020
  467   2HZ   LYS  58          2HZ       LYS  58  18.321 -19.593   1.512
  468   3HZ   LYS  58          3HZ       LYS  58  18.307 -17.960   1.720
  469    H    ASP  59           H        ASP  59  10.107 -16.373   4.818
  470    HA   ASP  59           HA       ASP  59  10.002 -19.058   6.049
  471   1HB   ASP  59          1HB       ASP  59   9.483 -16.884   7.236
  472   2HB   ASP  59          2HB       ASP  59   8.002 -16.823   6.280
  473    H    TRP  60           H        TRP  60   7.261 -19.479   5.923
  474    HA   TRP  60           HA       TRP  60   6.527 -19.859   3.084
  475   1HB   TRP  60          1HB       TRP  60   5.144 -20.668   5.668
  476   2HB   TRP  60          2HB       TRP  60   4.661 -21.120   4.032
  477    HD1  TRP  60           HD1      TRP  60   7.428 -21.744   6.611
  478    HE1  TRP  60           HE1      TRP  60   8.600 -23.992   6.097
  479    HE3  TRP  60           HE3      TRP  60   5.132 -22.889   2.177
  480    HZ2  TRP  60           HZ2      TRP  60   8.574 -25.969   4.038
  481    HZ3  TRP  60           HZ3      TRP  60   5.735 -24.958   0.962
  482    HH2  TRP  60           HH2      TRP  60   7.460 -26.496   1.871
  483    H    SER  61           H        SER  61   6.732 -17.352   3.145
  484    HA   SER  61           HA       SER  61   4.064 -16.120   3.375
  485   1HB   SER  61          1HB       SER  61   6.502 -15.247   4.983
  486   2HB   SER  61          2HB       SER  61   5.132 -14.169   4.664
  487    HG   SER  61           HG       SER  61   4.972 -16.735   5.866
  488    H    PHE  62           H        PHE  62   4.535 -13.615   2.660
  489    HA   PHE  62           HA       PHE  62   6.705 -13.184   0.837
  490   1HB   PHE  62          1HB       PHE  62   4.578 -14.643  -0.282
  491   2HB   PHE  62          2HB       PHE  62   4.223 -12.970  -0.727
  492    HD1  PHE  62           HD1      PHE  62   6.838 -15.638  -0.887
  493    HD2  PHE  62           HD2      PHE  62   5.344 -11.947  -2.559
  494    HE1  PHE  62           HE1      PHE  62   8.601 -15.702  -2.550
  495    HE2  PHE  62           HE2      PHE  62   7.104 -12.024  -4.240
  496    HZ   PHE  62           HZ       PHE  62   8.743 -13.908  -4.301
  497    H    TYR  63           H        TYR  63   6.935 -10.866   0.758
  498    HA   TYR  63           HA       TYR  63   4.583  -9.209   0.721
  499   1HB   TYR  63          1HB       TYR  63   4.971  -8.004   2.857
  500   2HB   TYR  63          2HB       TYR  63   4.506  -9.681   3.062
  501    HD1  TYR  63           HD1      TYR  63   7.382  -7.401   3.219
  502    HD2  TYR  63           HD2      TYR  63   5.657 -11.169   4.400
  503    HE1  TYR  63           HE1      TYR  63   9.010  -7.548   5.047
  504    HE2  TYR  63           HE2      TYR  63   7.264 -11.328   6.247
  505    HH   TYR  63           HH       TYR  63   8.960 -10.229   7.445
  506    H    LEU  64           H        LEU  64   5.219  -6.847   1.142
  507    HA   LEU  64           HA       LEU  64   7.910  -6.042   0.871
  508   1HB   LEU  64          1HB       LEU  64   7.910  -5.033  -1.331
  509   2HB   LEU  64          2HB       LEU  64   7.717  -6.768  -1.460
  510    HG   LEU  64           HG       LEU  64   5.598  -4.655  -1.866
  511   1HD1  LEU  64          1HD1      LEU  64   6.760  -6.726  -3.785
  512   2HD1  LEU  64          2HD1      LEU  64   5.486  -5.573  -4.177
  513   3HD1  LEU  64          3HD1      LEU  64   7.111  -4.976  -3.815
  514   1HD2  LEU  64          1HD2      LEU  64   5.410  -7.681  -1.842
  515   2HD2  LEU  64          2HD2      LEU  64   4.353  -6.521  -0.973
  516   3HD2  LEU  64          3HD2      LEU  64   4.238  -6.710  -2.723
  517    H    LEU  65           H        LEU  65   8.082  -3.768   1.081
  518    HA   LEU  65           HA       LEU  65   5.614  -2.440   2.061
  519   1HB   LEU  65          1HB       LEU  65   7.902  -2.932   3.374
  520   2HB   LEU  65          2HB       LEU  65   8.430  -1.482   2.513
  521    HG   LEU  65           HG       LEU  65   6.059  -1.761   4.416
  522   1HD1  LEU  65          1HD1      LEU  65   8.302  -1.757   5.441
  523   2HD1  LEU  65          2HD1      LEU  65   8.685  -0.242   4.594
  524   3HD1  LEU  65          3HD1      LEU  65   7.406  -0.272   5.832
  525   1HD2  LEU  65          1HD2      LEU  65   6.937   0.479   2.585
  526   2HD2  LEU  65          2HD2      LEU  65   5.296  -0.121   2.915
  527   3HD2  LEU  65          3HD2      LEU  65   6.145   0.844   4.127
  528    H    TYR  66           H        TYR  66   4.907  -0.599   0.955
  529    HA   TYR  66           HA       TYR  66   6.543   0.298  -1.353
  530   1HB   TYR  66          1HB       TYR  66   3.517   0.031  -1.496
  531   2HB   TYR  66          2HB       TYR  66   4.686   0.084  -2.793
  532    HD1  TYR  66           HD1      TYR  66   3.834  -2.211   0.186
  533    HD2  TYR  66           HD2      TYR  66   4.718  -1.946  -4.042
  534    HE1  TYR  66           HE1      TYR  66   2.777  -4.338  -0.160
  535    HE2  TYR  66           HE2      TYR  66   3.525  -4.088  -4.374
  536    HH   TYR  66           HH       TYR  66   1.782  -5.718  -1.705
  537    H    TYR  67           H        TYR  67   7.159   2.194  -0.335
  538    HA   TYR  67           HA       TYR  67   5.048   3.918   0.824
  539   1HB   TYR  67          1HB       TYR  67   7.154   5.087   1.786
  540   2HB   TYR  67          2HB       TYR  67   6.416   3.657   2.452
  541    HD1  TYR  67           HD1      TYR  67   8.889   4.088  -0.366
  542    HD2  TYR  67           HD2      TYR  67   7.993   2.346   3.456
  543    HE1  TYR  67           HE1      TYR  67  11.056   2.892  -0.404
  544    HE2  TYR  67           HE2      TYR  67  10.150   1.138   3.417
  545    HH   TYR  67           HH       TYR  67  12.411   1.323   0.667
  546    H    THR  68           H        THR  68   4.916   6.027   0.460
  547    HA   THR  68           HA       THR  68   6.633   7.353  -1.609
  548    HB   THR  68           HB       THR  68   4.520   6.826  -2.512
  549    HG1  THR  68           HG1      THR  68   4.844   9.603  -2.067
  550   1HG2  THR  68          1HG2      THR  68   3.302   8.849  -0.559
  551   2HG2  THR  68          2HG2      THR  68   2.467   7.898  -1.796
  552   3HG2  THR  68          3HG2      THR  68   3.132   7.095  -0.362
  553    H    GLU  69           H        GLU  69   6.750   9.746  -1.255
  554    HA   GLU  69           HA       GLU  69   6.573  10.619   1.556
  555   1HB   GLU  69          1HB       GLU  69   8.558  10.878  -0.239
  556   2HB   GLU  69          2HB       GLU  69   7.705  12.378  -0.569
  557   1HG   GLU  69          1HG       GLU  69   8.649  11.416   2.175
  558   2HG   GLU  69          2HG       GLU  69   9.571  12.487   1.117
  559    H    PHE  70           H        PHE  70   4.250  10.670   1.635
  560    HA   PHE  70           HA       PHE  70   2.751  12.106  -0.393
  561   1HB   PHE  70          1HB       PHE  70   0.833  11.467   0.599
  562   2HB   PHE  70          2HB       PHE  70   1.873  10.114   0.981
  563    HD1  PHE  70           HD1      PHE  70  -0.517  12.535   2.208
  564    HD2  PHE  70           HD2      PHE  70   3.007  10.393   3.368
  565    HE1  PHE  70           HE1      PHE  70  -0.943  13.036   4.586
  566    HE2  PHE  70           HE2      PHE  70   2.120  10.250   5.717
  567    HZ   PHE  70           HZ       PHE  70   0.242  11.732   6.349
  568    H    THR  71           H        THR  71   2.205  14.154  -0.396
  569    HA   THR  71           HA       THR  71   2.552  15.877   2.018
  570    HB   THR  71           HB       THR  71   2.466  16.652  -0.871
  571    HG1  THR  71           HG1      THR  71   4.309  15.442  -0.188
  572   1HG2  THR  71          1HG2      THR  71   3.268  18.809   0.044
  573   2HG2  THR  71          2HG2      THR  71   1.676  18.419   0.724
  574   3HG2  THR  71          3HG2      THR  71   3.141  18.169   1.693
  575    HA   PRO  72           HA       PRO  72  -2.059  15.625   1.459
  576   1HB   PRO  72          1HB       PRO  72  -2.877  16.159   3.972
  577   2HB   PRO  72          2HB       PRO  72  -2.108  14.614   3.527
  578   1HG   PRO  72          1HG       PRO  72  -0.823  17.036   4.800
  579   2HG   PRO  72          2HG       PRO  72  -0.659  15.343   5.322
  580   1HD   PRO  72          1HD       PRO  72   1.185  16.621   3.732
  581   2HD   PRO  72          2HD       PRO  72   0.877  14.868   3.605
  582    H    THR  73           H        THR  73  -1.915  17.458   0.015
  583    HA   THR  73           HA       THR  73  -1.787  20.171   1.075
  584    HB   THR  73           HB       THR  73  -2.482  19.314  -1.640
  585    HG1  THR  73           HG1      THR  73   0.121  19.604  -0.558
  586   1HG2  THR  73          1HG2      THR  73  -0.920  21.723  -0.573
  587   2HG2  THR  73          2HG2      THR  73  -1.239  21.403  -2.289
  588   3HG2  THR  73          3HG2      THR  73  -2.582  21.783  -1.196
  589    H    GLU  74           H        GLU  74  -3.690  19.177   2.392
  590    HA   GLU  74           HA       GLU  74  -5.740  19.482   3.204
  591   1HB   GLU  74          1HB       GLU  74  -5.396  21.790   2.512
  592   2HB   GLU  74          2HB       GLU  74  -6.168  21.506   0.951
  593   1HG   GLU  74          1HG       GLU  74  -7.648  20.792   3.502
  594   2HG   GLU  74          2HG       GLU  74  -7.511  22.486   3.016
  595    H    LYS  75           H        LYS  75  -6.438  19.676  -0.321
  596    HA   LYS  75           HA       LYS  75  -8.651  17.760   0.100
  597   1HB   LYS  75          1HB       LYS  75  -8.736  20.145  -0.949
  598   2HB   LYS  75          2HB       LYS  75  -8.175  19.370  -2.423
  599   1HG   LYS  75          1HG       LYS  75 -10.114  17.881  -2.426
  600   2HG   LYS  75          2HG       LYS  75 -10.609  18.421  -0.820
  601   1HD   LYS  75          1HD       LYS  75 -10.642  20.046  -3.390
  602   2HD   LYS  75          2HD       LYS  75 -12.030  19.444  -2.479
  603   1HE   LYS  75          1HE       LYS  75 -10.132  21.698  -1.732
  604   2HE   LYS  75          2HE       LYS  75 -11.870  21.772  -2.008
  605   1HZ   LYS  75          1HZ       LYS  75 -12.207  20.523  -0.004
  606   2HZ   LYS  75          2HZ       LYS  75 -10.577  20.400   0.255
  607   3HZ   LYS  75          3HZ       LYS  75 -11.291  21.862   0.305
  608    H    ASP  76           H        ASP  76  -6.289  16.478   0.273
  609    HA   ASP  76           HA       ASP  76  -6.265  14.750  -2.150
  610   1HB   ASP  76          1HB       ASP  76  -3.819  15.933  -0.783
  611   2HB   ASP  76          2HB       ASP  76  -3.789  14.487  -1.804
  612    H    GLU  77           H        GLU  77  -7.498  13.265  -1.108
  613    HA   GLU  77           HA       GLU  77  -6.630  12.112   1.476
  614   1HB   GLU  77          1HB       GLU  77  -8.981  12.467   1.210
  615   2HB   GLU  77          2HB       GLU  77  -9.022  11.623  -0.346
  616   1HG   GLU  77          1HG       GLU  77  -8.675   9.504   0.635
  617   2HG   GLU  77          2HG       GLU  77  -8.017  10.182   2.124
  618    H    TYR  78           H        TYR  78  -4.719  11.055   1.085
  619    HA   TYR  78           HA       TYR  78  -4.230   9.514  -1.282
  620   1HB   TYR  78          1HB       TYR  78  -2.742   9.626   1.338
  621   2HB   TYR  78          2HB       TYR  78  -2.295   8.635  -0.037
  622    HD1  TYR  78           HD1      TYR  78  -0.603   9.485  -1.374
  623    HD2  TYR  78           HD2      TYR  78  -3.089  12.239   0.791
  624    HE1  TYR  78           HE1      TYR  78   0.635  11.407  -2.373
  625    HE2  TYR  78           HE2      TYR  78  -1.961  14.132  -0.326
  626    HH   TYR  78           HH       TYR  78  -0.083  14.793  -1.520
  627    H    ALA  79           H        ALA  79  -4.071   7.347  -1.545
  628    HA   ALA  79           HA       ALA  79  -5.284   5.481   0.385
  629   1HB   ALA  79          1HB       ALA  79  -6.350   5.916  -2.451
  630   2HB   ALA  79          2HB       ALA  79  -6.914   4.702  -1.287
  631   3HB   ALA  79          3HB       ALA  79  -7.175   6.429  -0.967
  632    H    CYS  80           H        CYS  80  -5.009   3.263  -0.317
  633    HA   CYS  80           HA       CYS  80  -2.560   2.806  -1.983
  634   1HB   CYS  80          1HB       CYS  80  -3.737   1.222   0.334
  635   2HB   CYS  80          2HB       CYS  80  -2.250   0.844  -0.535
  636    H    ARG  81           H        ARG  81  -3.252   1.952  -3.999
  637    HA   ARG  81           HA       ARG  81  -5.673   0.375  -4.309
  638   1HB   ARG  81          1HB       ARG  81  -4.543   1.465  -6.243
  639   2HB   ARG  81          2HB       ARG  81  -3.107   0.483  -5.907
  640   1HG   ARG  81          1HG       ARG  81  -4.531  -1.591  -6.354
  641   2HG   ARG  81          2HG       ARG  81  -5.792  -0.480  -6.913
  642   1HD   ARG  81          1HD       ARG  81  -4.212   0.345  -8.664
  643   2HD   ARG  81          2HD       ARG  81  -2.949  -0.707  -7.983
  644    HE   ARG  81           HE       ARG  81  -5.309  -2.198  -8.667
  645   1HH1  ARG  81          1HH2      ARG  81  -2.396  -0.744 -10.108
  646   2HH1  ARG  81          2HH2      ARG  81  -2.165  -2.063 -11.232
  647   1HH2  ARG  81          1HH1      ARG  81  -5.101  -3.796 -10.261
  648   2HH2  ARG  81          2HH1      ARG  81  -3.760  -3.756 -11.377
  649    H    VAL  82           H        VAL  82  -5.809  -2.003  -4.107
  650    HA   VAL  82           HA       VAL  82  -3.232  -3.395  -3.729
  651    HB   VAL  82           HB       VAL  82  -5.696  -3.939  -2.024
  652   1HG1  VAL  82          1HG1      VAL  82  -4.241  -5.867  -2.587
  653   2HG1  VAL  82          2HG1      VAL  82  -2.835  -4.967  -1.968
  654   3HG1  VAL  82          3HG1      VAL  82  -4.155  -5.447  -0.876
  655   1HG2  VAL  82          1HG2      VAL  82  -4.717  -1.806  -1.256
  656   2HG2  VAL  82          2HG2      VAL  82  -4.352  -3.094  -0.115
  657   3HG2  VAL  82          3HG2      VAL  82  -3.097  -2.538  -1.238
  658    H    ASN  83           H        ASN  83  -3.122  -4.579  -5.536
  659    HA   ASN  83           HA       ASN  83  -5.436  -6.340  -6.163
  660   1HB   ASN  83          1HB       ASN  83  -5.445  -4.424  -7.775
  661   2HB   ASN  83          2HB       ASN  83  -3.830  -4.880  -8.270
  662   1HD2  ASN  83          2HD2      ASN  83  -7.104  -6.345  -7.827
  663   2HD2  ASN  83          1HD2      ASN  83  -6.965  -7.445  -9.183
  664    H    HIS  84           H        HIS  84  -4.277  -8.027  -5.079
  665    HA   HIS  84           HA       HIS  84  -1.642  -8.983  -5.985
  666   1HB   HIS  84          1HB       HIS  84  -2.513  -9.450  -3.728
  667   2HB   HIS  84          2HB       HIS  84  -3.901 -10.269  -4.438
  668    HD2  HIS  84           HD2      HIS  84   0.061 -10.849  -4.534
  669    HE1  HIS  84           HE1      HIS  84  -2.043 -14.529  -4.704
  670    HE2  HIS  84           HE2      HIS  84   0.308 -13.434  -4.628
  671    H    VAL  85           H        VAL  85  -1.536 -10.972  -7.403
  672    HA   VAL  85           HA       VAL  85  -3.173 -10.941  -9.620
  673    HB   VAL  85           HB       VAL  85  -0.977 -12.002  -9.496
  674   1HG1  VAL  85          1HG1      VAL  85  -2.364 -14.408  -8.239
  675   2HG1  VAL  85          2HG1      VAL  85  -0.690 -14.320  -8.801
  676   3HG1  VAL  85          3HG1      VAL  85  -1.202 -13.333  -7.426
  677   1HG2  VAL  85          1HG2      VAL  85  -3.111 -13.845 -10.631
  678   2HG2  VAL  85          2HG2      VAL  85  -2.470 -12.385 -11.416
  679   3HG2  VAL  85          3HG2      VAL  85  -1.407 -13.766 -11.109
  680    H    THR  86           H        THR  86  -3.772 -12.757  -6.604
  681    HA   THR  86           HA       THR  86  -5.953 -14.235  -7.819
  682    HB   THR  86           HB       THR  86  -4.365 -14.950  -5.892
  683    HG1  THR  86           HG1      THR  86  -5.972 -16.174  -6.871
  684   1HG2  THR  86          1HG2      THR  86  -6.749 -14.015  -4.260
  685   2HG2  THR  86          2HG2      THR  86  -5.246 -14.772  -3.698
  686   3HG2  THR  86          3HG2      THR  86  -5.224 -13.106  -4.311
  687    H    LEU  87           H        LEU  87  -5.684 -11.086  -6.268
  688    HA   LEU  87           HA       LEU  87  -8.509 -10.828  -5.630
  689   1HB   LEU  87          1HB       LEU  87  -6.108  -9.038  -5.723
  690   2HB   LEU  87          2HB       LEU  87  -7.653  -8.290  -6.063
  691    HG   LEU  87           HG       LEU  87  -8.598  -9.108  -3.963
  692   1HD1  LEU  87          1HD1      LEU  87  -7.123 -11.128  -3.644
  693   2HD1  LEU  87          2HD1      LEU  87  -5.775 -10.030  -3.275
  694   3HD1  LEU  87          3HD1      LEU  87  -7.207 -10.069  -2.230
  695   1HD2  LEU  87          1HD2      LEU  87  -7.575  -6.876  -4.099
  696   2HD2  LEU  87          2HD2      LEU  87  -7.289  -7.583  -2.498
  697   3HD2  LEU  87          3HD2      LEU  87  -5.983  -7.553  -3.700
  698    H    SER  88           H        SER  88 -10.028 -10.955  -7.151
  699    HA   SER  88           HA       SER  88  -9.537 -10.396  -9.960
  700   1HB   SER  88          1HB       SER  88 -12.136 -10.954  -8.475
  701   2HB   SER  88          2HB       SER  88 -11.884 -11.016 -10.230
  702    HG   SER  88           HG       SER  88 -10.566 -12.638  -8.306
  703    H    GLN  89           H        GLN  89  -9.653  -8.168  -7.564
  704    HA   GLN  89           HA       GLN  89 -10.684  -6.109  -9.316
  705   1HB   GLN  89          1HB       GLN  89 -12.173  -5.195  -7.563
  706   2HB   GLN  89          2HB       GLN  89 -12.746  -6.737  -8.213
  707   1HG   GLN  89          1HG       GLN  89 -11.896  -7.916  -6.222
  708   2HG   GLN  89          2HG       GLN  89 -11.204  -6.411  -5.595
  709   1HE2  GLN  89          2HE2      GLN  89 -14.386  -7.689  -6.748
  710   2HE2  GLN  89          1HE2      GLN  89 -15.320  -6.888  -5.501
  711    HA   PRO  90           HA       PRO  90  -7.411  -4.167  -6.890
  712   1HB   PRO  90          1HB       PRO  90  -7.601  -1.579  -7.706
  713   2HB   PRO  90          2HB       PRO  90  -7.124  -2.888  -8.832
  714   1HG   PRO  90          1HG       PRO  90  -9.867  -1.651  -8.535
  715   2HG   PRO  90          2HG       PRO  90  -8.938  -1.946 -10.029
  716   1HD   PRO  90          1HD       PRO  90 -10.847  -3.692  -9.068
  717   2HD   PRO  90          2HD       PRO  90  -9.411  -4.241  -9.985
  718    H    LYS  91           H        LYS  91  -8.082  -4.434  -4.764
  719    HA   LYS  91           HA       LYS  91 -10.458  -3.059  -3.743
  720   1HB   LYS  91          1HB       LYS  91  -9.692  -5.430  -3.151
  721   2HB   LYS  91          2HB       LYS  91  -8.454  -4.687  -2.139
  722   1HG   LYS  91          1HG       LYS  91 -11.490  -4.421  -1.907
  723   2HG   LYS  91          2HG       LYS  91 -10.402  -5.290  -0.815
  724   1HD   LYS  91          1HD       LYS  91  -9.299  -3.077  -0.261
  725   2HD   LYS  91          2HD       LYS  91 -10.571  -2.284  -1.230
  726   1HE   LYS  91          1HE       LYS  91 -12.309  -3.195   0.225
  727   2HE   LYS  91          2HE       LYS  91 -11.073  -3.956   1.249
  728   1HZ   LYS  91          1HZ       LYS  91 -10.234  -1.831   1.783
  729   2HZ   LYS  91          2HZ       LYS  91 -11.205  -1.071   0.696
  730   3HZ   LYS  91          3HZ       LYS  91 -11.859  -1.787   2.035
  731    H    ILE  92           H        ILE  92 -10.072  -0.848  -3.697
  732    HA   ILE  92           HA       ILE  92  -7.524   0.232  -2.927
  733    HB   ILE  92           HB       ILE  92 -10.135   1.757  -3.019
  734   1HG1  ILE  92          1HG1      ILE  92 -10.131   0.625  -5.137
  735   2HG1  ILE  92          2HG1      ILE  92  -9.660   2.301  -5.373
  736   1HG2  ILE  92          1HG2      ILE  92  -7.205   2.492  -3.440
  737   2HG2  ILE  92          2HG2      ILE  92  -8.573   3.593  -3.706
  738   3HG2  ILE  92          3HG2      ILE  92  -8.253   2.951  -2.085
  739   1HD1  ILE  92          1HD1      ILE  92  -7.278   1.623  -5.568
  740   2HD1  ILE  92          2HD1      ILE  92  -7.756  -0.080  -5.340
  741   3HD1  ILE  92          3HD1      ILE  92  -8.311   0.819  -6.758
  742    H    VAL  93           H        VAL  93  -6.836   0.841  -0.935
  743    HA   VAL  93           HA       VAL  93  -8.713   0.767   1.391
  744    HB   VAL  93           HB       VAL  93  -5.745   0.089   1.281
  745   1HG1  VAL  93          1HG1      VAL  93  -7.719   0.163   3.612
  746   2HG1  VAL  93          2HG1      VAL  93  -6.060  -0.463   3.687
  747   3HG1  VAL  93          3HG1      VAL  93  -6.337   1.257   3.394
  748   1HG2  VAL  93          1HG2      VAL  93  -7.140  -1.746   0.417
  749   2HG2  VAL  93          2HG2      VAL  93  -6.577  -2.141   2.046
  750   3HG2  VAL  93          3HG2      VAL  93  -8.237  -1.590   1.807
  751    H    LYS  94           H        LYS  94  -9.307   2.846   1.542
  752    HA   LYS  94           HA       LYS  94  -7.607   5.095   0.980
  753   1HB   LYS  94          1HB       LYS  94 -10.233   4.882   2.498
  754   2HB   LYS  94          2HB       LYS  94  -9.431   6.391   2.016
  755   1HG   LYS  94          1HG       LYS  94  -9.641   5.801  -0.359
  756   2HG   LYS  94          2HG       LYS  94 -10.290   4.214   0.048
  757   1HD   LYS  94          1HD       LYS  94 -12.110   5.630  -0.637
  758   2HD   LYS  94          2HD       LYS  94 -12.282   5.209   1.067
  759   1HE   LYS  94          1HE       LYS  94 -12.854   7.553   0.720
  760   2HE   LYS  94          2HE       LYS  94 -11.391   7.459   1.703
  761   1HZ   LYS  94          1HZ       LYS  94 -11.510   7.986  -1.189
  762   2HZ   LYS  94          2HZ       LYS  94 -11.198   9.089   0.004
  763   3HZ   LYS  94          3HZ       LYS  94 -10.123   7.881  -0.297
  764    H    TRP  95           H        TRP  95  -6.213   6.158   2.306
  765    HA   TRP  95           HA       TRP  95  -5.413   4.803   4.752
  766   1HB   TRP  95          1HB       TRP  95  -3.652   5.522   3.348
  767   2HB   TRP  95          2HB       TRP  95  -4.400   7.075   3.083
  768    HD1  TRP  95           HD1      TRP  95  -2.908   5.349   6.230
  769    HE1  TRP  95           HE1      TRP  95  -1.746   7.210   7.625
  770    HE3  TRP  95           HE3      TRP  95  -3.711   9.317   3.161
  771    HZ2  TRP  95           HZ2      TRP  95  -1.750  10.127   7.651
  772    HZ3  TRP  95           HZ3      TRP  95  -2.914  11.581   3.795
  773    HH2  TRP  95           HH2      TRP  95  -2.232  12.022   6.132
  774    H    ASP  96           H        ASP  96  -6.354   5.188   6.667
  775    HA   ASP  96           HA       ASP  96  -7.788   7.648   7.306
  776   1HB   ASP  96          1HB       ASP  96  -8.082   6.610   9.486
  777   2HB   ASP  96          2HB       ASP  96  -8.490   5.463   8.213
  778    H    ARG  97           H        ARG  97  -7.109   9.098   8.984
  779    HA   ARG  97           HA       ARG  97  -4.189   9.608   8.912
  780   1HB   ARG  97          1HB       ARG  97  -6.562  11.251   9.856
  781   2HB   ARG  97          2HB       ARG  97  -4.881  11.735  10.088
  782   1HG   ARG  97          1HG       ARG  97  -5.863  12.823   8.147
  783   2HG   ARG  97          2HG       ARG  97  -4.454  11.843   7.720
  784   1HD   ARG  97          1HD       ARG  97  -5.783  10.166   6.687
  785   2HD   ARG  97          2HD       ARG  97  -7.276  10.772   7.462
  786    HE   ARG  97           HE       ARG  97  -6.209  12.799   5.786
  787   1HH1  ARG  97          1HH2      ARG  97  -7.610   9.550   5.496
  788   2HH1  ARG  97          2HH2      ARG  97  -8.721   9.999   4.224
  789   1HH2  ARG  97          1HH1      ARG  97  -7.529  13.311   3.927
  790   2HH2  ARG  97          2HH1      ARG  97  -8.596  12.088   3.278
  791    H    ASP  98           H        ASP  98  -4.071   7.474  10.145
  792    HA   ASP  98           HA       ASP  98  -3.737   6.234  11.985
  793   1HB   ASP  98          1HB       ASP  98  -1.834   7.776  11.994
  794   2HB   ASP  98          2HB       ASP  98  -2.747   8.925  12.975
  795    H    MET  99           H        MET  99  -6.184   6.161  12.014
  796    HA   MET  99           HA       MET  99  -7.432   7.504  14.364
  797   1HB   MET  99          1HB       MET  99  -8.643   6.069  11.970
  798   2HB   MET  99          2HB       MET  99  -9.546   6.869  13.260
  799   1HG   MET  99          1HG       MET  99  -7.640   8.202  11.292
  800   2HG   MET  99          2HG       MET  99  -9.396   8.266  11.240
  801   1HE   MET  99          1HE       MET  99 -10.907   9.631  12.861
  802   2HE   MET  99          2HE       MET  99 -10.231   8.847  14.311
  803   3HE   MET  99          3HE       MET  99 -10.300  10.617  14.209
  Start of MODEL    9
    1   1H    MET   0          1H        MET   0  -7.554 -26.987  -2.177
    2   2H    MET   0          2H        MET   0  -7.540 -25.761  -1.075
    3   3H    MET   0          3H        MET   0  -8.886 -26.031  -1.986
    4    HA   MET   0           HA       MET   0  -6.286 -25.207  -3.036
    5   1HB   MET   0          1HB       MET   0  -8.996 -25.480  -4.401
    6   2HB   MET   0          2HB       MET   0  -7.549 -24.758  -5.123
    7   1HG   MET   0          1HG       MET   0  -6.339 -26.908  -4.831
    8   2HG   MET   0          2HG       MET   0  -7.815 -27.642  -4.184
    9   1HE   MET   0          1HE       MET   0  -6.115 -28.881  -6.591
   10   2HE   MET   0          2HE       MET   0  -7.569 -29.606  -5.863
   11   3HE   MET   0          3HE       MET   0  -7.460 -29.409  -7.628
   12    H    ILE   1           H        ILE   1  -5.829 -23.305  -2.054
   13    HA   ILE   1           HA       ILE   1  -7.548 -21.022  -2.402
   14    HB   ILE   1           HB       ILE   1  -8.699 -21.863  -0.502
   15   1HG1  ILE   1          1HG1      ILE   1  -8.328 -20.157   1.211
   16   2HG1  ILE   1          2HG1      ILE   1  -6.794 -19.692   0.478
   17   1HG2  ILE   1          1HG2      ILE   1  -7.029 -23.457   0.344
   18   2HG2  ILE   1          2HG2      ILE   1  -6.041 -22.105   0.948
   19   3HG2  ILE   1          3HG2      ILE   1  -7.654 -22.404   1.618
   20   1HD1  ILE   1          1HD1      ILE   1  -9.517 -19.541  -0.904
   21   2HD1  ILE   1          2HD1      ILE   1  -8.714 -18.184  -0.090
   22   3HD1  ILE   1          3HD1      ILE   1  -7.985 -18.895  -1.536
   23    H    GLN   2           H        GLN   2  -6.197 -19.287  -2.770
   24    HA   GLN   2           HA       GLN   2  -3.361 -19.523  -2.236
   25   1HB   GLN   2          1HB       GLN   2  -4.521 -18.612  -4.349
   26   2HB   GLN   2          2HB       GLN   2  -5.000 -17.224  -3.374
   27   1HG   GLN   2          1HG       GLN   2  -2.993 -16.300  -3.544
   28   2HG   GLN   2          2HG       GLN   2  -2.160 -17.766  -3.008
   29   1HE2  GLN   2          2HE2      GLN   2  -1.941 -19.573  -4.629
   30   2HE2  GLN   2          1HE2      GLN   2  -1.537 -19.109  -6.269
   31    H    ARG   3           H        ARG   3  -2.196 -17.907  -0.924
   32    HA   ARG   3           HA       ARG   3  -3.594 -17.163   1.475
   33   1HB   ARG   3          1HB       ARG   3  -0.804 -16.897   0.421
   34   2HB   ARG   3          2HB       ARG   3  -1.288 -15.805   1.711
   35   1HG   ARG   3          1HG       ARG   3  -1.787 -18.773   2.020
   36   2HG   ARG   3          2HG       ARG   3  -0.210 -18.048   2.390
   37   1HD   ARG   3          1HD       ARG   3  -1.268 -16.427   3.919
   38   2HD   ARG   3          2HD       ARG   3  -2.860 -17.148   3.605
   39    HE   ARG   3           HE       ARG   3  -1.044 -19.162   4.494
   40   1HH1  ARG   3          1HH2      ARG   3  -2.833 -16.341   5.696
   41   2HH1  ARG   3          2HH2      ARG   3  -2.885 -16.909   7.344
   42   1HH2  ARG   3          1HH1      ARG   3  -1.097 -19.889   6.678
   43   2HH2  ARG   3          2HH1      ARG   3  -1.889 -18.935   7.904
   44    H    THR   4           H        THR   4  -4.504 -15.339   2.056
   45    HA   THR   4           HA       THR   4  -5.157 -13.354   0.098
   46    HB   THR   4           HB       THR   4  -5.777 -13.571   3.073
   47    HG1  THR   4           HG1      THR   4  -7.137 -14.550   0.791
   48   1HG2  THR   4          1HG2      THR   4  -7.282 -12.070   0.886
   49   2HG2  THR   4          2HG2      THR   4  -7.785 -12.259   2.576
   50   3HG2  THR   4          3HG2      THR   4  -6.332 -11.322   2.195
   51    HA   PRO   5           HA       PRO   5  -1.898 -10.477   1.474
   52   1HB   PRO   5          1HB       PRO   5  -2.791  -8.150   0.317
   53   2HB   PRO   5          2HB       PRO   5  -2.062  -9.482  -0.621
   54   1HG   PRO   5          1HG       PRO   5  -5.002  -8.919  -0.191
   55   2HG   PRO   5          2HG       PRO   5  -4.157  -9.259  -1.729
   56   1HD   PRO   5          1HD       PRO   5  -5.481 -11.191  -0.360
   57   2HD   PRO   5          2HD       PRO   5  -3.941 -11.563  -1.188
   58    H    LYS   6           H        LYS   6  -1.827  -9.977   3.595
   59    HA   LYS   6           HA       LYS   6  -4.049  -8.617   4.957
   60   1HB   LYS   6          1HB       LYS   6  -2.610 -10.434   6.026
   61   2HB   LYS   6          2HB       LYS   6  -1.280  -9.259   6.029
   62   1HG   LYS   6          1HG       LYS   6  -2.982  -7.662   7.190
   63   2HG   LYS   6          2HG       LYS   6  -3.968  -9.104   7.447
   64   1HD   LYS   6          1HD       LYS   6  -1.100  -8.677   8.421
   65   2HD   LYS   6          2HD       LYS   6  -2.564  -8.501   9.402
   66   1HE   LYS   6          1HE       LYS   6  -3.101 -10.913   9.008
   67   2HE   LYS   6          2HE       LYS   6  -1.578 -11.085   8.111
   68   1HZ   LYS   6          1HZ       LYS   6  -0.410 -10.450  10.090
   69   2HZ   LYS   6          2HZ       LYS   6  -1.821 -10.286  10.925
   70   3HZ   LYS   6          3HZ       LYS   6  -1.356 -11.768  10.377
   71    H    ILE   7           H        ILE   7  -4.213  -6.474   4.591
   72    HA   ILE   7           HA       ILE   7  -1.898  -4.827   3.774
   73    HB   ILE   7           HB       ILE   7  -4.853  -4.223   3.949
   74   1HG1  ILE   7          1HG1      ILE   7  -3.295  -4.764   1.398
   75   2HG1  ILE   7          2HG1      ILE   7  -4.128  -6.064   2.246
   76   1HG2  ILE   7          1HG2      ILE   7  -3.395  -2.225   4.035
   77   2HG2  ILE   7          2HG2      ILE   7  -2.570  -2.742   2.556
   78   3HG2  ILE   7          3HG2      ILE   7  -4.283  -2.276   2.512
   79   1HD1  ILE   7          1HD1      ILE   7  -6.272  -4.830   2.116
   80   2HD1  ILE   7          2HD1      ILE   7  -5.477  -3.609   1.097
   81   3HD1  ILE   7          3HD1      ILE   7  -5.598  -5.285   0.543
   82    H    GLN   8           H        GLN   8  -0.851  -3.459   5.359
   83    HA   GLN   8           HA       GLN   8  -2.481  -2.570   7.672
   84   1HB   GLN   8          1HB       GLN   8  -0.293  -2.794   8.895
   85   2HB   GLN   8          2HB       GLN   8  -1.259  -4.251   8.683
   86   1HG   GLN   8          1HG       GLN   8   1.069  -3.537   6.870
   87   2HG   GLN   8          2HG       GLN   8   1.286  -4.410   8.391
   88   1HE2  GLN   8          2HE2      GLN   8   1.993  -5.371   5.762
   89   2HE2  GLN   8          1HE2      GLN   8   1.080  -6.849   5.542
   90    H    VAL   9           H        VAL   9  -2.857  -0.672   6.494
   91    HA   VAL   9           HA       VAL   9  -0.693   0.911   5.445
   92    HB   VAL   9           HB       VAL   9  -3.558   1.710   6.072
   93   1HG1  VAL   9          1HG1      VAL   9  -1.437   3.018   4.313
   94   2HG1  VAL   9          2HG1      VAL   9  -3.131   3.536   4.462
   95   3HG1  VAL   9          3HG1      VAL   9  -2.038   3.663   5.846
   96   1HG2  VAL   9          1HG2      VAL   9  -3.600  -0.072   4.453
   97   2HG2  VAL   9          2HG2      VAL   9  -3.848   1.438   3.576
   98   3HG2  VAL   9          3HG2      VAL   9  -2.262   0.643   3.526
   99    H    TYR  10           H        TYR  10   0.694   2.098   6.574
  100    HA   TYR  10           HA       TYR  10  -0.001   3.006   9.330
  101   1HB   TYR  10          1HB       TYR  10   2.735   2.878   8.093
  102   2HB   TYR  10          2HB       TYR  10   2.308   2.999   9.792
  103    HD1  TYR  10           HD1      TYR  10   0.488   0.851  10.364
  104    HD2  TYR  10           HD2      TYR  10   3.813   0.906   7.623
  105    HE1  TYR  10           HE1      TYR  10   0.902  -1.565  10.801
  106    HE2  TYR  10           HE2      TYR  10   4.250  -1.487   8.087
  107    HH   TYR  10           HH       TYR  10   3.762  -3.266   9.498
  108    H    SER  11           H        SER  11   0.638   5.038   9.964
  109    HA   SER  11           HA       SER  11   1.301   7.100   7.897
  110   1HB   SER  11          1HB       SER  11   0.586   8.735   9.663
  111   2HB   SER  11          2HB       SER  11  -0.707   7.785   8.927
  112    HG   SER  11           HG       SER  11  -0.861   7.910  11.210
  113    H    ARG  12           H        ARG  12   3.512   7.463   7.940
  114    HA   ARG  12           HA       ARG  12   5.148   6.464  10.104
  115   1HB   ARG  12          1HB       ARG  12   5.653   6.746   7.582
  116   2HB   ARG  12          2HB       ARG  12   6.136   8.388   7.984
  117   1HG   ARG  12          1HG       ARG  12   7.288   5.858   9.267
  118   2HG   ARG  12          2HG       ARG  12   7.926   6.628   7.817
  119   1HD   ARG  12          1HD       ARG  12   9.299   7.286   9.627
  120   2HD   ARG  12          2HD       ARG  12   8.395   8.706   9.065
  121    HE   ARG  12           HE       ARG  12   6.983   7.452  11.210
  122   1HH1  ARG  12          1HH2      ARG  12   9.997   9.252  10.705
  123   2HH1  ARG  12          2HH2      ARG  12   9.897  10.085  12.236
  124   1HH2  ARG  12          1HH1      ARG  12   6.824   8.589  13.160
  125   2HH2  ARG  12          2HH1      ARG  12   8.098   9.672  13.668
  126    H    HIS  13           H        HIS  13   4.798   9.768   8.756
  127    HA   HIS  13           HA       HIS  13   4.902  10.979  11.457
  128   1HB   HIS  13          1HB       HIS  13   4.766  12.231   8.701
  129   2HB   HIS  13          2HB       HIS  13   4.831  13.092  10.248
  130    HD2  HIS  13           HD2      HIS  13   7.167  11.649   7.646
  131    HE1  HIS  13           HE1      HIS  13   9.522  12.449  11.071
  132    HE2  HIS  13           HE2      HIS  13   9.615  11.823   8.594
  133    HA   PRO  14           HA       PRO  14   0.448  10.693  11.247
  134   1HB   PRO  14          1HB       PRO  14  -0.299  12.073  13.436
  135   2HB   PRO  14          2HB       PRO  14   0.822  10.695  13.567
  136   1HG   PRO  14          1HG       PRO  14   1.546  13.638  13.411
  137   2HG   PRO  14          2HG       PRO  14   2.076  12.451  14.638
  138   1HD   PRO  14          1HD       PRO  14   3.560  13.079  12.394
  139   2HD   PRO  14          2HD       PRO  14   3.595  11.459  13.132
  140    H    ALA  15           H        ALA  15   1.267  12.274   9.216
  141    HA   ALA  15           HA       ALA  15   0.785  13.868   7.775
  142   1HB   ALA  15          1HB       ALA  15  -1.510  13.106   8.073
  143   2HB   ALA  15          2HB       ALA  15  -1.774  14.288   9.357
  144   3HB   ALA  15          3HB       ALA  15  -1.455  14.842   7.706
  145    H    GLU  16           H        GLU  16   0.848  16.121   7.300
  146    HA   GLU  16           HA       GLU  16   0.567  18.084   9.378
  147   1HB   GLU  16          1HB       GLU  16   3.054  17.149   9.460
  148   2HB   GLU  16          2HB       GLU  16   3.281  18.162   8.030
  149   1HG   GLU  16          1HG       GLU  16   2.337  18.970  10.822
  150   2HG   GLU  16          2HG       GLU  16   3.928  19.300  10.129
  151    H    ASN  17           H        ASN  17  -0.248  19.911   8.400
  152    HA   ASN  17           HA       ASN  17  -1.384  19.450   5.912
  153   1HB   ASN  17          1HB       ASN  17  -2.595  21.367   6.233
  154   2HB   ASN  17          2HB       ASN  17  -2.265  20.801   7.863
  155   1HD2  ASN  17          2HD2      ASN  17   0.136  21.886   8.635
  156   2HD2  ASN  17          1HD2      ASN  17   0.116  23.619   8.425
  157    H    GLY  18           H        GLY  18  -0.544  19.538   3.910
  158   1HA   GLY  18          1HA       GLY  18   0.685  20.132   2.135
  159   2HA   GLY  18          2HA       GLY  18   0.598  21.790   2.728
  160    H    LYS  19           H        LYS  19   2.190  19.231   4.633
  161    HA   LYS  19           HA       LYS  19   4.881  20.138   3.752
  162   1HB   LYS  19          1HB       LYS  19   4.245  21.376   5.758
  163   2HB   LYS  19          2HB       LYS  19   3.975  19.825   6.580
  164   1HG   LYS  19          1HG       LYS  19   6.678  20.645   5.465
  165   2HG   LYS  19          2HG       LYS  19   6.123  21.086   7.088
  166   1HD   LYS  19          1HD       LYS  19   5.730  18.583   7.518
  167   2HD   LYS  19          2HD       LYS  19   6.699  18.288   6.065
  168   1HE   LYS  19          1HE       LYS  19   7.625  19.759   8.555
  169   2HE   LYS  19          2HE       LYS  19   8.050  18.112   8.068
  170   1HZ   LYS  19          1HZ       LYS  19   9.060  19.021   6.096
  171   2HZ   LYS  19          2HZ       LYS  19   8.712  20.555   6.586
  172   3HZ   LYS  19          3HZ       LYS  19   9.757  19.628   7.460
  173    H    SER  20           H        SER  20   5.801  18.535   3.142
  174    HA   SER  20           HA       SER  20   4.998  16.089   2.707
  175   1HB   SER  20          1HB       SER  20   7.356  15.316   2.360
  176   2HB   SER  20          2HB       SER  20   6.837  16.801   1.562
  177    HG   SER  20           HG       SER  20   8.241  16.677   4.037
  178    H    ASN  21           H        ASN  21   4.638  14.285   3.738
  179    HA   ASN  21           HA       ASN  21   5.774  13.609   6.433
  180   1HB   ASN  21          1HB       ASN  21   3.147  13.035   5.079
  181   2HB   ASN  21          2HB       ASN  21   3.551  12.471   6.719
  182   1HD2  ASN  21          2HD2      ASN  21   4.653  14.586   7.979
  183   2HD2  ASN  21          1HD2      ASN  21   3.539  15.937   7.986
  184    H    PHE  22           H        PHE  22   4.458  10.864   6.116
  185    HA   PHE  22           HA       PHE  22   5.511   9.741   3.724
  186   1HB   PHE  22          1HB       PHE  22   7.245   9.648   6.031
  187   2HB   PHE  22          2HB       PHE  22   6.694   8.019   5.676
  188    HD1  PHE  22           HD1      PHE  22   6.663   7.395   3.058
  189    HD2  PHE  22           HD2      PHE  22   9.246  10.290   4.943
  190    HE1  PHE  22           HE1      PHE  22   8.269   7.205   1.170
  191    HE2  PHE  22           HE2      PHE  22  10.914   9.966   3.133
  192    HZ   PHE  22           HZ       PHE  22  10.419   8.438   1.242
  193    H    LEU  23           H        LEU  23   4.153   8.316   3.053
  194    HA   LEU  23           HA       LEU  23   2.184   7.052   4.869
  195   1HB   LEU  23          1HB       LEU  23   1.354   8.585   3.105
  196   2HB   LEU  23          2HB       LEU  23   2.189   7.636   1.880
  197    HG   LEU  23           HG       LEU  23   0.627   5.715   2.505
  198   1HD1  LEU  23          1HD1      LEU  23   0.073   6.431   4.824
  199   2HD1  LEU  23          2HD1      LEU  23  -0.594   7.951   4.202
  200   3HD1  LEU  23          3HD1      LEU  23  -1.381   6.400   3.826
  201   1HD2  LEU  23          1HD2      LEU  23  -0.608   8.393   1.712
  202   2HD2  LEU  23          2HD2      LEU  23   0.181   7.253   0.606
  203   3HD2  LEU  23          3HD2      LEU  23  -1.335   6.798   1.409
  204    H    ASN  24           H        ASN  24   2.103   4.812   4.953
  205    HA   ASN  24           HA       ASN  24   3.972   3.276   3.193
  206   1HB   ASN  24          1HB       ASN  24   3.810   3.339   6.213
  207   2HB   ASN  24          2HB       ASN  24   4.558   2.030   5.295
  208   1HD2  ASN  24          2HD2      ASN  24   4.695   5.616   5.731
  209   2HD2  ASN  24          1HD2      ASN  24   6.412   5.747   5.406
  210    H    CYS  25           H        CYS  25   2.329   2.335   2.031
  211    HA   CYS  25           HA       CYS  25   0.200   0.840   3.441
  212   1HB   CYS  25          1HB       CYS  25   0.708   1.138   0.480
  213   2HB   CYS  25          2HB       CYS  25  -0.665   0.364   1.252
  214    H    TYR  26           H        TYR  26   1.711  -0.581   4.560
  215    HA   TYR  26           HA       TYR  26   3.429  -2.334   3.008
  216   1HB   TYR  26          1HB       TYR  26   4.012  -1.606   5.287
  217   2HB   TYR  26          2HB       TYR  26   2.547  -2.289   5.919
  218    HD1  TYR  26           HD1      TYR  26   3.483  -3.798   7.505
  219    HD2  TYR  26           HD2      TYR  26   4.942  -3.891   3.464
  220    HE1  TYR  26           HE1      TYR  26   4.529  -5.999   7.939
  221    HE2  TYR  26           HE2      TYR  26   5.993  -6.063   3.887
  222    HH   TYR  26           HH       TYR  26   5.879  -7.673   7.095
  223    H    VAL  27           H        VAL  27   2.904  -4.389   2.273
  224    HA   VAL  27           HA       VAL  27   0.307  -5.574   3.123
  225    HB   VAL  27           HB       VAL  27   1.409  -5.794   0.282
  226   1HG1  VAL  27          1HG1      VAL  27  -1.366  -6.285   1.463
  227   2HG1  VAL  27          2HG1      VAL  27  -0.844  -6.612  -0.204
  228   3HG1  VAL  27          3HG1      VAL  27  -0.186  -7.556   1.143
  229   1HG2  VAL  27          1HG2      VAL  27  -0.762  -3.923   1.223
  230   2HG2  VAL  27          2HG2      VAL  27   0.848  -3.432   0.640
  231   3HG2  VAL  27          3HG2      VAL  27  -0.266  -4.254  -0.463
  232    H    SER  28           H        SER  28   0.530  -7.762   3.659
  233    HA   SER  28           HA       SER  28   2.757  -9.241   2.601
  234   1HB   SER  28          1HB       SER  28   3.782  -9.801   4.803
  235   2HB   SER  28          2HB       SER  28   3.882  -8.073   4.533
  236    HG   SER  28           HG       SER  28   3.113  -8.607   6.626
  237    H    GLY  29           H        GLY  29   2.919 -11.490   3.641
  238   1HA   GLY  29          1HA       GLY  29   1.896 -13.346   4.617
  239   2HA   GLY  29          2HA       GLY  29   0.316 -12.565   4.557
  240    H    PHE  30           H        PHE  30   0.718 -11.757   1.699
  241    HA   PHE  30           HA       PHE  30  -0.673 -13.966   0.555
  242   1HB   PHE  30          1HB       PHE  30  -0.748 -12.584  -1.448
  243   2HB   PHE  30          2HB       PHE  30  -1.179 -11.708  -0.033
  244    HD1  PHE  30           HD1      PHE  30   0.178  -9.730   0.736
  245    HD2  PHE  30           HD2      PHE  30   1.400 -12.158  -2.624
  246    HE1  PHE  30           HE1      PHE  30   1.967  -8.129   0.195
  247    HE2  PHE  30           HE2      PHE  30   3.191 -10.551  -3.134
  248    HZ   PHE  30           HZ       PHE  30   3.459  -8.535  -1.733
  249    H    HIS  31           H        HIS  31  -0.090 -14.871  -1.644
  250    HA   HIS  31           HA       HIS  31   2.640 -14.825  -2.595
  251   1HB   HIS  31          1HB       HIS  31   3.315 -16.978  -2.242
  252   2HB   HIS  31          2HB       HIS  31   2.510 -16.678  -0.709
  253    HD2  HIS  31           HD2      HIS  31   1.886 -18.508  -4.112
  254    HE1  HIS  31           HE1      HIS  31  -0.707 -20.184  -1.215
  255    HE2  HIS  31           HE2      HIS  31   0.114 -20.395  -3.631
  256    HA   PRO  32           HA       PRO  32   3.567 -15.963  -4.422
  257   1HB   PRO  32          1HB       PRO  32   3.953 -16.251  -7.058
  258   2HB   PRO  32          2HB       PRO  32   3.047 -17.479  -6.168
  259   1HG   PRO  32          1HG       PRO  32   1.825 -15.135  -7.672
  260   2HG   PRO  32          2HG       PRO  32   1.518 -16.877  -7.945
  261   1HD   PRO  32          1HD       PRO  32  -0.036 -15.368  -6.255
  262   2HD   PRO  32          2HD       PRO  32   0.336 -17.084  -5.926
  263    H    SER  33           H        SER  33   4.471 -14.487  -6.958
  264    HA   SER  33           HA       SER  33   4.916 -12.066  -5.465
  265   1HB   SER  33          1HB       SER  33   6.849 -11.923  -6.955
  266   2HB   SER  33          2HB       SER  33   6.658 -13.597  -6.397
  267    HG   SER  33           HG       SER  33   5.828 -12.575  -8.895
  268    H    ASP  34           H        ASP  34   2.373 -12.462  -7.399
  269    HA   ASP  34           HA       ASP  34   2.921 -10.192  -9.256
  270   1HB   ASP  34          1HB       ASP  34   2.477 -12.331 -10.291
  271   2HB   ASP  34          2HB       ASP  34   0.967 -12.504  -9.390
  272    H    ILE  35           H        ILE  35   2.535  -8.677  -7.485
  273    HA   ILE  35           HA       ILE  35  -0.361  -8.079  -7.237
  274    HB   ILE  35           HB       ILE  35   0.501  -8.956  -5.218
  275   1HG1  ILE  35          1HG1      ILE  35   0.077  -5.978  -4.771
  276   2HG1  ILE  35          2HG1      ILE  35  -1.222  -7.108  -5.117
  277   1HG2  ILE  35          1HG2      ILE  35   2.396  -6.617  -5.066
  278   2HG2  ILE  35          2HG2      ILE  35   2.185  -7.915  -3.871
  279   3HG2  ILE  35          3HG2      ILE  35   2.864  -8.306  -5.447
  280   1HD1  ILE  35          1HD1      ILE  35  -0.338  -8.489  -3.106
  281   2HD1  ILE  35          2HD1      ILE  35   0.575  -7.037  -2.683
  282   3HD1  ILE  35          3HD1      ILE  35  -1.188  -6.966  -2.766
  283    H    GLU  36           H        GLU  36  -1.000  -5.998  -7.191
  284    HA   GLU  36           HA       GLU  36   0.834  -3.963  -8.364
  285   1HB   GLU  36          1HB       GLU  36  -2.151  -4.010  -8.767
  286   2HB   GLU  36          2HB       GLU  36  -0.878  -3.204  -9.685
  287   1HG   GLU  36          1HG       GLU  36  -0.050  -5.484 -10.382
  288   2HG   GLU  36          2HG       GLU  36  -1.435  -6.196  -9.574
  289    H    VAL  37           H        VAL  37   1.084  -2.144  -7.140
  290    HA   VAL  37           HA       VAL  37  -1.067  -1.259  -5.320
  291    HB   VAL  37           HB       VAL  37   1.824  -1.681  -4.473
  292   1HG1  VAL  37          1HG1      VAL  37  -0.538  -0.781  -2.767
  293   2HG1  VAL  37          2HG1      VAL  37   1.104  -1.108  -2.208
  294   3HG1  VAL  37          3HG1      VAL  37   0.806   0.262  -3.278
  295   1HG2  VAL  37          1HG2      VAL  37   0.805  -3.828  -4.503
  296   2HG2  VAL  37          2HG2      VAL  37   0.640  -3.291  -2.821
  297   3HG2  VAL  37          3HG2      VAL  37  -0.747  -3.204  -3.890
  298    H    ASP  38           H        ASP  38  -1.395   0.186  -7.096
  299    HA   ASP  38           HA       ASP  38   0.520   2.367  -7.489
  300   1HB   ASP  38          1HB       ASP  38  -2.433   2.227  -8.265
  301   2HB   ASP  38          2HB       ASP  38  -1.240   3.408  -8.777
  302    H    LEU  39           H        LEU  39   0.768   3.919  -5.957
  303    HA   LEU  39           HA       LEU  39  -1.318   4.416  -3.933
  304   1HB   LEU  39          1HB       LEU  39   1.427   5.669  -4.327
  305   2HB   LEU  39          2HB       LEU  39   0.262   6.059  -3.053
  306    HG   LEU  39           HG       LEU  39   0.328   3.389  -2.686
  307   1HD1  LEU  39          1HD1      LEU  39   3.102   4.036  -3.742
  308   2HD1  LEU  39          2HD1      LEU  39   2.644   2.546  -2.899
  309   3HD1  LEU  39          3HD1      LEU  39   1.962   2.904  -4.487
  310   1HD2  LEU  39          1HD2      LEU  39   0.896   5.194  -1.005
  311   2HD2  LEU  39          2HD2      LEU  39   1.874   3.726  -0.872
  312   3HD2  LEU  39          3HD2      LEU  39   2.556   5.169  -1.647
  313    H    LEU  40           H        LEU  40  -2.645   6.177  -3.936
  314    HA   LEU  40           HA       LEU  40  -2.937   7.675  -6.488
  315   1HB   LEU  40          1HB       LEU  40  -3.655   5.148  -6.441
  316   2HB   LEU  40          2HB       LEU  40  -4.953   5.696  -5.405
  317    HG   LEU  40           HG       LEU  40  -5.737   5.411  -7.621
  318   1HD1  LEU  40          1HD1      LEU  40  -6.611   7.401  -6.379
  319   2HD1  LEU  40          2HD1      LEU  40  -5.481   8.426  -7.301
  320   3HD1  LEU  40          3HD1      LEU  40  -6.747   7.516  -8.144
  321   1HD2  LEU  40          1HD2      LEU  40  -3.480   5.666  -8.730
  322   2HD2  LEU  40          2HD2      LEU  40  -4.842   6.414  -9.591
  323   3HD2  LEU  40          3HD2      LEU  40  -3.737   7.424  -8.653
  324    H    LYS  41           H        LYS  41  -3.676   9.794  -5.836
  325    HA   LYS  41           HA       LYS  41  -4.977  10.003  -3.204
  326   1HB   LYS  41          1HB       LYS  41  -4.374  12.173  -5.190
  327   2HB   LYS  41          2HB       LYS  41  -4.804  12.356  -3.474
  328   1HG   LYS  41          1HG       LYS  41  -2.730  12.224  -2.852
  329   2HG   LYS  41          2HG       LYS  41  -2.541  10.643  -3.588
  330   1HD   LYS  41          1HD       LYS  41  -0.924  12.074  -4.656
  331   2HD   LYS  41          2HD       LYS  41  -2.196  11.791  -5.828
  332   1HE   LYS  41          1HE       LYS  41  -1.479  14.133  -5.813
  333   2HE   LYS  41          2HE       LYS  41  -3.184  13.994  -5.386
  334   1HZ   LYS  41          1HZ       LYS  41  -1.002  14.359  -3.441
  335   2HZ   LYS  41          2HZ       LYS  41  -2.018  15.539  -3.974
  336   3HZ   LYS  41          3HZ       LYS  41  -2.614  14.297  -3.094
  337    H    ASN  42           H        ASN  42  -6.312  12.398  -4.786
  338    HA   ASN  42           HA       ASN  42  -9.021  11.438  -4.901
  339   1HB   ASN  42          1HB       ASN  42  -9.244  13.723  -6.209
  340   2HB   ASN  42          2HB       ASN  42  -8.822  13.737  -4.496
  341   1HD2  ASN  42          2HD2      ASN  42  -7.220  13.836  -7.749
  342   2HD2  ASN  42          1HD2      ASN  42  -5.859  14.785  -7.189
  343    H    GLY  43           H        GLY  43  -6.495  11.945  -7.378
  344   1HA   GLY  43          1HA       GLY  43  -7.472   9.918  -9.102
  345   2HA   GLY  43          2HA       GLY  43  -8.119  11.481  -9.652
  346    H    GLU  44           H        GLU  44  -5.003  10.678  -8.097
  347    HA   GLU  44           HA       GLU  44  -3.484  11.161 -10.587
  348   1HB   GLU  44          1HB       GLU  44  -3.628  13.343  -9.463
  349   2HB   GLU  44          2HB       GLU  44  -3.067  12.631  -7.943
  350   1HG   GLU  44          1HG       GLU  44  -0.897  12.038  -9.009
  351   2HG   GLU  44          2HG       GLU  44  -1.465  12.731 -10.539
  352    H    ARG  45           H        ARG  45  -2.107   9.476 -10.780
  353    HA   ARG  45           HA       ARG  45  -1.566   7.779  -8.446
  354   1HB   ARG  45          1HB       ARG  45  -0.657   6.196  -9.879
  355   2HB   ARG  45          2HB       ARG  45  -2.153   6.754 -10.635
  356   1HG   ARG  45          1HG       ARG  45  -0.865   8.140 -12.214
  357   2HG   ARG  45          2HG       ARG  45   0.653   7.691 -11.410
  358   1HD   ARG  45          1HD       ARG  45   0.193   5.295 -11.863
  359   2HD   ARG  45          2HD       ARG  45  -1.200   5.761 -12.845
  360    HE   ARG  45           HE       ARG  45   1.650   5.927 -13.504
  361   1HH1  ARG  45          1HH2      ARG  45  -1.489   7.400 -14.236
  362   2HH1  ARG  45          2HH2      ARG  45  -0.951   8.090 -15.748
  363   1HH2  ARG  45          1HH1      ARG  45   2.354   6.855 -15.410
  364   2HH2  ARG  45          2HH1      ARG  45   1.264   7.751 -16.451
  365    H    ILE  46           H        ILE  46   0.354   7.455  -7.478
  366    HA   ILE  46           HA       ILE  46   2.396   9.524  -7.743
  367    HB   ILE  46           HB       ILE  46   1.554   7.451  -5.690
  368   1HG1  ILE  46          1HG1      ILE  46   1.366  10.481  -5.484
  369   2HG1  ILE  46          2HG1      ILE  46   0.044   9.534  -6.160
  370   1HG2  ILE  46          1HG2      ILE  46   3.928   7.825  -5.512
  371   2HG2  ILE  46          2HG2      ILE  46   3.693   9.590  -5.628
  372   3HG2  ILE  46          3HG2      ILE  46   3.095   8.682  -4.208
  373   1HD1  ILE  46          1HD1      ILE  46   1.085   9.282  -3.325
  374   2HD1  ILE  46          2HD1      ILE  46  -0.461   9.929  -3.908
  375   3HD1  ILE  46          3HD1      ILE  46  -0.133   8.218  -4.056
  376    H    GLU  47           H        GLU  47   3.683   8.791  -9.464
  377    HA   GLU  47           HA       GLU  47   4.549   5.997  -9.640
  378   1HB   GLU  47          1HB       GLU  47   5.421   8.435 -11.238
  379   2HB   GLU  47          2HB       GLU  47   5.818   6.737 -11.573
  380   1HG   GLU  47          1HG       GLU  47   3.334   6.253 -11.711
  381   2HG   GLU  47          2HG       GLU  47   3.041   7.999 -11.637
  382    H    LYS  48           H        LYS  48   5.666   8.942  -8.096
  383    HA   LYS  48           HA       LYS  48   8.364   7.952  -7.569
  384   1HB   LYS  48          1HB       LYS  48   7.637  10.366  -7.805
  385   2HB   LYS  48          2HB       LYS  48   6.870  10.245  -6.230
  386   1HG   LYS  48          1HG       LYS  48   9.854   9.828  -6.838
  387   2HG   LYS  48          2HG       LYS  48   9.097  11.312  -6.272
  388   1HD   LYS  48          1HD       LYS  48   9.798  10.611  -4.252
  389   2HD   LYS  48          2HD       LYS  48   8.247   9.809  -4.274
  390   1HE   LYS  48          1HE       LYS  48   9.738   8.153  -3.536
  391   2HE   LYS  48          2HE       LYS  48   9.589   7.743  -5.251
  392   1HZ   LYS  48          1HZ       LYS  48  11.619   8.938  -5.640
  393   2HZ   LYS  48          2HZ       LYS  48  11.758   9.285  -4.032
  394   3HZ   LYS  48          3HZ       LYS  48  11.836   7.723  -4.547
  395    H    VAL  49           H        VAL  49   7.518   5.814  -6.874
  396    HA   VAL  49           HA       VAL  49   6.658   5.782  -4.010
  397    HB   VAL  49           HB       VAL  49   6.925   3.408  -5.883
  398   1HG1  VAL  49          1HG1      VAL  49   5.447   3.807  -3.236
  399   2HG1  VAL  49          2HG1      VAL  49   5.531   2.307  -4.183
  400   3HG1  VAL  49          3HG1      VAL  49   6.988   2.958  -3.417
  401   1HG2  VAL  49          1HG2      VAL  49   4.466   5.094  -5.267
  402   2HG2  VAL  49          2HG2      VAL  49   5.214   4.820  -6.857
  403   3HG2  VAL  49          3HG2      VAL  49   4.431   3.479  -6.015
  404    H    GLU  50           H        GLU  50   8.250   5.457  -2.538
  405    HA   GLU  50           HA       GLU  50  11.000   4.755  -3.370
  406   1HB   GLU  50          1HB       GLU  50  10.323   6.742  -1.859
  407   2HB   GLU  50          2HB       GLU  50  10.022   5.536  -0.607
  408   1HG   GLU  50          1HG       GLU  50  12.347   4.791  -0.721
  409   2HG   GLU  50          2HG       GLU  50  12.657   5.888  -2.082
  410    H    HIS  51           H        HIS  51   9.656   2.580  -3.900
  411    HA   HIS  51           HA       HIS  51   8.765   1.072  -1.626
  412   1HB   HIS  51          1HB       HIS  51   8.260  -0.681  -3.172
  413   2HB   HIS  51          2HB       HIS  51   7.831   0.842  -3.944
  414    HD2  HIS  51           HD2      HIS  51   9.167   1.375  -6.327
  415    HE1  HIS  51           HE1      HIS  51  11.622  -2.073  -6.254
  416    HE2  HIS  51           HE2      HIS  51  10.897  -0.066  -7.661
  417    H    SER  52           H        SER  52   9.540  -1.063  -0.986
  418    HA   SER  52           HA       SER  52  12.490  -1.360  -1.034
  419   1HB   SER  52          1HB       SER  52  12.082  -3.117   0.640
  420   2HB   SER  52          2HB       SER  52  11.407  -1.561   1.159
  421    HG   SER  52           HG       SER  52   9.945  -3.628  -0.131
  422    H    ASP  53           H        ASP  53  13.437  -3.224  -1.922
  423    HA   ASP  53           HA       ASP  53  12.239  -4.610  -4.077
  424   1HB   ASP  53          1HB       ASP  53  14.518  -5.469  -2.243
  425   2HB   ASP  53          2HB       ASP  53  14.174  -6.126  -3.849
  426    H    LEU  54           H        LEU  54  11.841  -7.012  -4.127
  427    HA   LEU  54           HA       LEU  54   9.752  -7.585  -2.346
  428   1HB   LEU  54          1HB       LEU  54   9.956  -8.448  -4.666
  429   2HB   LEU  54          2HB       LEU  54  11.260  -9.518  -4.153
  430    HG   LEU  54           HG       LEU  54   9.173 -10.737  -4.384
  431   1HD1  LEU  54          1HD1      LEU  54   9.361 -10.715  -1.430
  432   2HD1  LEU  54          2HD1      LEU  54   9.328 -12.057  -2.563
  433   3HD1  LEU  54          3HD1      LEU  54  10.822 -11.159  -2.369
  434   1HD2  LEU  54          1HD2      LEU  54   7.493  -9.065  -4.092
  435   2HD2  LEU  54          2HD2      LEU  54   7.237 -10.294  -2.843
  436   3HD2  LEU  54          3HD2      LEU  54   7.965  -8.772  -2.411
  437    H    SER  55           H        SER  55   9.714  -8.430  -0.361
  438    HA   SER  55           HA       SER  55  12.116  -9.819   0.752
  439   1HB   SER  55          1HB       SER  55  11.833  -7.483   1.607
  440   2HB   SER  55          2HB       SER  55  10.212  -7.911   2.180
  441    HG   SER  55           HG       SER  55  12.670  -9.110   2.951
  442    H    PHE  56           H        PHE  56  11.113 -11.902   0.154
  443    HA   PHE  56           HA       PHE  56   8.591 -12.547   1.557
  444   1HB   PHE  56          1HB       PHE  56   8.663 -14.629   0.606
  445   2HB   PHE  56          2HB       PHE  56   9.046 -13.481  -0.664
  446    HD1  PHE  56           HD1      PHE  56  10.112 -16.362   1.290
  447    HD2  PHE  56           HD2      PHE  56  11.356 -13.439  -1.612
  448    HE1  PHE  56           HE1      PHE  56  12.114 -17.743   0.767
  449    HE2  PHE  56           HE2      PHE  56  13.368 -14.817  -2.136
  450    HZ   PHE  56           HZ       PHE  56  13.724 -16.984  -0.973
  451    H    SER  57           H        SER  57   8.622 -13.269   3.702
  452    HA   SER  57           HA       SER  57  11.166 -13.790   5.025
  453   1HB   SER  57          1HB       SER  57   9.335 -12.921   6.347
  454   2HB   SER  57          2HB       SER  57   8.342 -14.359   6.003
  455    HG   SER  57           HG       SER  57   9.775 -15.569   7.178
  456    H    LYS  58           H        LYS  58  12.122 -15.803   5.233
  457    HA   LYS  58           HA       LYS  58  11.595 -17.957   3.490
  458   1HB   LYS  58          1HB       LYS  58  13.017 -17.866   6.181
  459   2HB   LYS  58          2HB       LYS  58  13.033 -19.256   5.071
  460   1HG   LYS  58          1HG       LYS  58  14.190 -18.032   3.368
  461   2HG   LYS  58          2HG       LYS  58  13.972 -16.498   4.211
  462   1HD   LYS  58          1HD       LYS  58  16.247 -17.280   4.429
  463   2HD   LYS  58          2HD       LYS  58  15.475 -17.170   6.010
  464   1HE   LYS  58          1HE       LYS  58  15.648 -19.809   4.481
  465   2HE   LYS  58          2HE       LYS  58  16.985 -19.208   5.474
  466   1HZ   LYS  58          1HZ       LYS  58  15.524 -19.143   7.353
  467   2HZ   LYS  58          2HZ       LYS  58  14.293 -19.788   6.472
  468   3HZ   LYS  58          3HZ       LYS  58  15.661 -20.662   6.733
  469    H    ASP  59           H        ASP  59  10.181 -17.241   6.614
  470    HA   ASP  59           HA       ASP  59   9.063 -19.854   6.937
  471   1HB   ASP  59          1HB       ASP  59   8.454 -17.199   8.319
  472   2HB   ASP  59          2HB       ASP  59   7.922 -18.788   8.888
  473    H    TRP  60           H        TRP  60   8.299 -19.434   4.515
  474    HA   TRP  60           HA       TRP  60   6.605 -19.377   3.046
  475   1HB   TRP  60          1HB       TRP  60   5.093 -20.367   5.477
  476   2HB   TRP  60          2HB       TRP  60   4.657 -20.632   3.786
  477    HD1  TRP  60           HD1      TRP  60   7.079 -21.740   6.462
  478    HE1  TRP  60           HE1      TRP  60   8.480 -23.767   5.666
  479    HE3  TRP  60           HE3      TRP  60   5.608 -21.881   1.564
  480    HZ2  TRP  60           HZ2      TRP  60   8.943 -25.183   3.231
  481    HZ3  TRP  60           HZ3      TRP  60   6.565 -23.569   0.026
  482    HH2  TRP  60           HH2      TRP  60   8.230 -25.220   0.844
  483    H    SER  61           H        SER  61   6.869 -16.960   3.115
  484    HA   SER  61           HA       SER  61   4.191 -15.762   3.202
  485   1HB   SER  61          1HB       SER  61   5.286 -15.283   5.445
  486   2HB   SER  61          2HB       SER  61   6.571 -14.436   4.567
  487    HG   SER  61           HG       SER  61   4.876 -13.049   5.294
  488    H    PHE  62           H        PHE  62   4.701 -13.298   2.325
  489    HA   PHE  62           HA       PHE  62   6.836 -13.023   0.429
  490   1HB   PHE  62          1HB       PHE  62   4.808 -14.647  -0.556
  491   2HB   PHE  62          2HB       PHE  62   4.287 -13.051  -1.087
  492    HD1  PHE  62           HD1      PHE  62   5.497 -11.848  -2.833
  493    HD2  PHE  62           HD2      PHE  62   7.007 -15.580  -1.257
  494    HE1  PHE  62           HE1      PHE  62   7.152 -11.944  -4.603
  495    HE2  PHE  62           HE2      PHE  62   8.603 -15.722  -3.090
  496    HZ   PHE  62           HZ       PHE  62   8.706 -13.898  -4.810
  497    H    TYR  63           H        TYR  63   7.089 -10.720   0.415
  498    HA   TYR  63           HA       TYR  63   4.728  -8.995   0.454
  499   1HB   TYR  63          1HB       TYR  63   5.207  -8.006   2.686
  500   2HB   TYR  63          2HB       TYR  63   4.712  -9.697   2.733
  501    HD1  TYR  63           HD1      TYR  63   5.938 -11.430   3.650
  502    HD2  TYR  63           HD2      TYR  63   7.595  -7.484   3.189
  503    HE1  TYR  63           HE1      TYR  63   7.613 -11.944   5.345
  504    HE2  TYR  63           HE2      TYR  63   9.338  -7.994   4.825
  505    HH   TYR  63           HH       TYR  63  10.174  -9.578   6.311
  506    H    LEU  64           H        LEU  64   5.426  -6.712   1.066
  507    HA   LEU  64           HA       LEU  64   8.068  -5.804   0.662
  508   1HB   LEU  64          1HB       LEU  64   7.977  -4.865  -1.562
  509   2HB   LEU  64          2HB       LEU  64   7.819  -6.606  -1.647
  510    HG   LEU  64           HG       LEU  64   5.667  -4.536  -2.037
  511   1HD1  LEU  64          1HD1      LEU  64   6.674  -6.675  -3.969
  512   2HD1  LEU  64          2HD1      LEU  64   5.445  -5.466  -4.309
  513   3HD1  LEU  64          3HD1      LEU  64   7.113  -4.948  -4.037
  514   1HD2  LEU  64          1HD2      LEU  64   5.452  -7.557  -1.884
  515   2HD2  LEU  64          2HD2      LEU  64   4.429  -6.346  -1.045
  516   3HD2  LEU  64          3HD2      LEU  64   4.277  -6.613  -2.786
  517    H    LEU  65           H        LEU  65   8.166  -3.467   0.773
  518    HA   LEU  65           HA       LEU  65   5.743  -2.234   1.941
  519   1HB   LEU  65          1HB       LEU  65   8.304  -2.641   2.916
  520   2HB   LEU  65          2HB       LEU  65   8.450  -1.020   2.256
  521    HG   LEU  65           HG       LEU  65   6.330  -1.954   4.249
  522   1HD1  LEU  65          1HD1      LEU  65   8.558  -2.082   5.228
  523   2HD1  LEU  65          2HD1      LEU  65   8.946  -0.446   4.647
  524   3HD1  LEU  65          3HD1      LEU  65   7.703  -0.679   5.899
  525   1HD2  LEU  65          1HD2      LEU  65   5.645   0.064   2.937
  526   2HD2  LEU  65          2HD2      LEU  65   5.948   0.416   4.645
  527   3HD2  LEU  65          3HD2      LEU  65   7.158   0.861   3.437
  528    H    TYR  66           H        TYR  66   4.981  -0.281   0.996
  529    HA   TYR  66           HA       TYR  66   6.357   0.672  -1.467
  530   1HB   TYR  66          1HB       TYR  66   3.366   0.214  -1.400
  531   2HB   TYR  66          2HB       TYR  66   4.432   0.372  -2.779
  532    HD1  TYR  66           HD1      TYR  66   4.719  -1.670  -4.035
  533    HD2  TYR  66           HD2      TYR  66   3.817  -1.967   0.186
  534    HE1  TYR  66           HE1      TYR  66   3.650  -3.871  -4.378
  535    HE2  TYR  66           HE2      TYR  66   2.890  -4.176  -0.170
  536    HH   TYR  66           HH       TYR  66   1.910  -5.556  -1.740
  537    H    TYR  67           H        TYR  67   6.956   2.501  -0.442
  538    HA   TYR  67           HA       TYR  67   4.850   4.125   0.853
  539   1HB   TYR  67          1HB       TYR  67   6.623   4.835   2.351
  540   2HB   TYR  67          2HB       TYR  67   6.052   3.190   2.407
  541    HD1  TYR  67           HD1      TYR  67   8.909   5.239   2.389
  542    HD2  TYR  67           HD2      TYR  67   7.537   1.359   1.158
  543    HE1  TYR  67           HE1      TYR  67  11.217   4.367   2.579
  544    HE2  TYR  67           HE2      TYR  67   9.828   0.489   1.297
  545    HH   TYR  67           HH       TYR  67  12.011   0.932   1.888
  546    H    THR  68           H        THR  68   4.787   6.170   0.700
  547    HA   THR  68           HA       THR  68   6.566   7.668  -1.225
  548    HB   THR  68           HB       THR  68   4.591   7.000  -2.314
  549    HG1  THR  68           HG1      THR  68   5.589   9.070  -2.680
  550   1HG2  THR  68          1HG2      THR  68   2.383   7.780  -1.729
  551   2HG2  THR  68          2HG2      THR  68   3.031   6.977  -0.285
  552   3HG2  THR  68          3HG2      THR  68   3.003   8.748  -0.384
  553    H    GLU  69           H        GLU  69   6.905   9.909  -0.808
  554    HA   GLU  69           HA       GLU  69   6.469  10.797   1.958
  555   1HB   GLU  69          1HB       GLU  69   7.798  12.846   0.954
  556   2HB   GLU  69          2HB       GLU  69   8.569  11.376   1.521
  557   1HG   GLU  69          1HG       GLU  69   9.528  12.185  -0.589
  558   2HG   GLU  69          2HG       GLU  69   8.927  10.537  -0.699
  559    H    PHE  70           H        PHE  70   4.148  10.689   1.612
  560    HA   PHE  70           HA       PHE  70   2.844  12.345  -0.306
  561   1HB   PHE  70          1HB       PHE  70   0.833  11.676   0.651
  562   2HB   PHE  70          2HB       PHE  70   1.868  10.288   0.935
  563    HD1  PHE  70           HD1      PHE  70   3.033  10.294   3.273
  564    HD2  PHE  70           HD2      PHE  70  -0.340  12.770   2.370
  565    HE1  PHE  70           HE1      PHE  70   2.386  10.307   5.712
  566    HE2  PHE  70           HE2      PHE  70  -0.683  13.157   4.799
  567    HZ   PHE  70           HZ       PHE  70   0.617  11.830   6.467
  568    H    THR  71           H        THR  71   2.130  14.325  -0.219
  569    HA   THR  71           HA       THR  71   2.506  15.996   2.222
  570    HB   THR  71           HB       THR  71   2.466  16.806  -0.661
  571    HG1  THR  71           HG1      THR  71   4.680  17.057  -0.248
  572   1HG2  THR  71          1HG2      THR  71   3.066  18.233   1.970
  573   2HG2  THR  71          2HG2      THR  71   3.356  18.927   0.361
  574   3HG2  THR  71          3HG2      THR  71   1.702  18.566   0.886
  575    HA   PRO  72           HA       PRO  72  -2.037  15.756   1.572
  576   1HB   PRO  72          1HB       PRO  72  -2.953  16.251   4.079
  577   2HB   PRO  72          2HB       PRO  72  -2.148  14.727   3.616
  578   1HG   PRO  72          1HG       PRO  72  -0.926  17.117   4.997
  579   2HG   PRO  72          2HG       PRO  72  -0.751  15.398   5.440
  580   1HD   PRO  72          1HD       PRO  72   1.099  16.790   3.939
  581   2HD   PRO  72          2HD       PRO  72   0.830  15.037   3.743
  582    H    THR  73           H        THR  73  -1.791  17.593   0.134
  583    HA   THR  73           HA       THR  73  -1.811  20.311   1.112
  584    HB   THR  73           HB       THR  73  -2.115  20.923  -1.238
  585    HG1  THR  73           HG1      THR  73  -2.398  18.125  -1.611
  586   1HG2  THR  73          1HG2      THR  73   0.018  20.103  -2.056
  587   2HG2  THR  73          2HG2      THR  73   0.148  20.463  -0.324
  588   3HG2  THR  73          3HG2      THR  73   0.016  18.778  -0.881
  589    H    GLU  74           H        GLU  74  -3.513  20.944   2.287
  590    HA   GLU  74           HA       GLU  74  -5.584  21.389   3.008
  591   1HB   GLU  74          1HB       GLU  74  -6.238  21.529   0.034
  592   2HB   GLU  74          2HB       GLU  74  -7.269  22.118   1.354
  593   1HG   GLU  74          1HG       GLU  74  -5.509  23.669   2.079
  594   2HG   GLU  74          2HG       GLU  74  -4.462  23.122   0.756
  595    H    LYS  75           H        LYS  75  -7.721  20.153   0.710
  596    HA   LYS  75           HA       LYS  75  -8.430  17.972   2.527
  597   1HB   LYS  75          1HB       LYS  75 -10.038  19.697   1.539
  598   2HB   LYS  75          2HB       LYS  75  -9.888  18.836   0.002
  599   1HG   LYS  75          1HG       LYS  75 -10.784  16.782   1.034
  600   2HG   LYS  75          2HG       LYS  75 -10.711  17.535   2.639
  601   1HD   LYS  75          1HD       LYS  75 -12.358  19.254   1.885
  602   2HD   LYS  75          2HD       LYS  75 -12.413  18.484   0.291
  603   1HE   LYS  75          1HE       LYS  75 -14.348  17.830   1.634
  604   2HE   LYS  75          2HE       LYS  75 -13.332  16.418   1.297
  605   1HZ   LYS  75          1HZ       LYS  75 -12.437  16.609   3.495
  606   2HZ   LYS  75          2HZ       LYS  75 -13.323  17.965   3.799
  607   3HZ   LYS  75          3HZ       LYS  75 -14.077  16.518   3.574
  608    H    ASP  76           H        ASP  76  -6.027  17.368   1.452
  609    HA   ASP  76           HA       ASP  76  -6.289  15.666  -0.905
  610   1HB   ASP  76          1HB       ASP  76  -4.153  16.808   0.473
  611   2HB   ASP  76          2HB       ASP  76  -4.065  15.102   0.927
  612    H    GLU  77           H        GLU  77  -6.359  13.386  -0.872
  613    HA   GLU  77           HA       GLU  77  -6.738  11.967   1.690
  614   1HB   GLU  77          1HB       GLU  77  -8.970  12.851   1.019
  615   2HB   GLU  77          2HB       GLU  77  -8.852  11.969  -0.509
  616   1HG   GLU  77          1HG       GLU  77  -8.724   9.828   0.751
  617   2HG   GLU  77          2HG       GLU  77  -8.744  10.721   2.281
  618    H    TYR  78           H        TYR  78  -4.733  11.039   1.179
  619    HA   TYR  78           HA       TYR  78  -4.194   9.763  -1.333
  620   1HB   TYR  78          1HB       TYR  78  -2.819   9.714   1.341
  621   2HB   TYR  78          2HB       TYR  78  -2.341   8.672   0.012
  622    HD1  TYR  78           HD1      TYR  78  -3.034  12.312   0.702
  623    HD2  TYR  78           HD2      TYR  78  -0.731   9.412  -1.494
  624    HE1  TYR  78           HE1      TYR  78  -1.689  14.129  -0.302
  625    HE2  TYR  78           HE2      TYR  78   0.604  11.261  -2.505
  626    HH   TYR  78           HH       TYR  78   1.063  13.503  -2.504
  627    H    ALA  79           H        ALA  79  -4.192   7.599  -1.839
  628    HA   ALA  79           HA       ALA  79  -5.296   5.624   0.030
  629   1HB   ALA  79          1HB       ALA  79  -6.456   6.161  -2.762
  630   2HB   ALA  79          2HB       ALA  79  -6.986   4.901  -1.650
  631   3HB   ALA  79          3HB       ALA  79  -7.244   6.611  -1.242
  632    H    CYS  80           H        CYS  80  -5.218   3.402  -0.968
  633    HA   CYS  80           HA       CYS  80  -2.857   3.058  -2.762
  634   1HB   CYS  80          1HB       CYS  80  -3.313   1.944   0.017
  635   2HB   CYS  80          2HB       CYS  80  -2.245   1.157  -1.155
  636    H    ARG  81           H        ARG  81  -3.409   1.876  -4.423
  637    HA   ARG  81           HA       ARG  81  -5.749   0.175  -4.571
  638   1HB   ARG  81          1HB       ARG  81  -4.655   1.264  -6.551
  639   2HB   ARG  81          2HB       ARG  81  -3.207   0.303  -6.227
  640   1HG   ARG  81          1HG       ARG  81  -4.610  -1.797  -6.596
  641   2HG   ARG  81          2HG       ARG  81  -5.924  -0.724  -7.118
  642   1HD   ARG  81          1HD       ARG  81  -4.377   0.193  -8.882
  643   2HD   ARG  81          2HD       ARG  81  -3.140  -0.946  -8.299
  644    HE   ARG  81           HE       ARG  81  -5.671  -2.194  -9.031
  645   1HH1  ARG  81          1HH2      ARG  81  -2.543  -1.076 -10.343
  646   2HH1  ARG  81          2HH2      ARG  81  -2.446  -2.401 -11.487
  647   1HH2  ARG  81          1HH1      ARG  81  -5.571  -3.806 -10.659
  648   2HH2  ARG  81          2HH1      ARG  81  -4.150  -3.936 -11.664
  649    H    VAL  82           H        VAL  82  -5.768  -2.142  -4.095
  650    HA   VAL  82           HA       VAL  82  -3.124  -3.450  -3.938
  651    HB   VAL  82           HB       VAL  82  -5.360  -3.909  -1.915
  652   1HG1  VAL  82          1HG1      VAL  82  -4.114  -5.945  -2.520
  653   2HG1  VAL  82          2HG1      VAL  82  -2.575  -5.077  -2.299
  654   3HG1  VAL  82          3HG1      VAL  82  -3.627  -5.403  -0.905
  655   1HG2  VAL  82          1HG2      VAL  82  -4.204  -1.815  -1.358
  656   2HG2  VAL  82          2HG2      VAL  82  -3.639  -3.081  -0.271
  657   3HG2  VAL  82          3HG2      VAL  82  -2.620  -2.583  -1.624
  658    H    ASN  83           H        ASN  83  -3.154  -4.701  -5.682
  659    HA   ASN  83           HA       ASN  83  -5.517  -6.464  -6.139
  660   1HB   ASN  83          1HB       ASN  83  -5.508  -4.504  -7.732
  661   2HB   ASN  83          2HB       ASN  83  -3.990  -5.089  -8.382
  662   1HD2  ASN  83          2HD2      ASN  83  -3.990  -6.845  -9.845
  663   2HD2  ASN  83          1HD2      ASN  83  -5.451  -7.701 -10.290
  664    H    HIS  84           H        HIS  84  -4.333  -8.099  -5.026
  665    HA   HIS  84           HA       HIS  84  -1.739  -9.090  -6.029
  666   1HB   HIS  84          1HB       HIS  84  -2.352  -9.354  -3.685
  667   2HB   HIS  84          2HB       HIS  84  -3.819 -10.208  -4.153
  668    HD2  HIS  84           HD2      HIS  84   0.102 -10.841  -4.434
  669    HE1  HIS  84           HE1      HIS  84  -2.004 -14.495  -4.724
  670    HE2  HIS  84           HE2      HIS  84   0.338 -13.430  -4.602
  671    H    VAL  85           H        VAL  85  -1.720 -11.135  -7.291
  672    HA   VAL  85           HA       VAL  85  -3.561 -11.265  -9.354
  673    HB   VAL  85           HB       VAL  85  -1.377 -12.175  -9.537
  674   1HG1  VAL  85          1HG1      VAL  85  -1.027 -13.224  -7.352
  675   2HG1  VAL  85          2HG1      VAL  85  -2.260 -14.457  -7.715
  676   3HG1  VAL  85          3HG1      VAL  85  -0.754 -14.394  -8.647
  677   1HG2  VAL  85          1HG2      VAL  85  -3.363 -14.429  -9.998
  678   2HG2  VAL  85          2HG2      VAL  85  -3.212 -12.997 -11.042
  679   3HG2  VAL  85          3HG2      VAL  85  -1.850 -14.116 -10.868
  680    H    THR  86           H        THR  86  -3.822 -13.004  -6.240
  681    HA   THR  86           HA       THR  86  -6.068 -14.565  -7.202
  682    HB   THR  86           HB       THR  86  -4.345 -15.199  -5.407
  683    HG1  THR  86           HG1      THR  86  -6.089 -16.442  -6.150
  684   1HG2  THR  86          1HG2      THR  86  -6.545 -14.175  -3.592
  685   2HG2  THR  86          2HG2      THR  86  -4.985 -14.895  -3.143
  686   3HG2  THR  86          3HG2      THR  86  -5.039 -13.266  -3.849
  687    H    LEU  87           H        LEU  87  -5.796 -11.309  -5.868
  688    HA   LEU  87           HA       LEU  87  -8.660 -11.130  -5.209
  689   1HB   LEU  87          1HB       LEU  87  -6.402  -9.146  -5.556
  690   2HB   LEU  87          2HB       LEU  87  -8.071  -8.627  -5.626
  691    HG   LEU  87           HG       LEU  87  -8.569  -9.286  -3.423
  692   1HD1  LEU  87          1HD1      LEU  87  -5.768 -10.461  -3.223
  693   2HD1  LEU  87          2HD1      LEU  87  -6.900 -10.225  -1.879
  694   3HD1  LEU  87          3HD1      LEU  87  -7.291 -11.366  -3.173
  695   1HD2  LEU  87          1HD2      LEU  87  -7.419  -7.115  -3.806
  696   2HD2  LEU  87          2HD2      LEU  87  -7.033  -7.777  -2.206
  697   3HD2  LEU  87          3HD2      LEU  87  -5.850  -7.893  -3.524
  698    H    SER  88           H        SER  88 -10.093 -11.424  -6.831
  699    HA   SER  88           HA       SER  88  -9.622 -10.944  -9.597
  700   1HB   SER  88          1HB       SER  88 -12.276 -10.854  -8.111
  701   2HB   SER  88          2HB       SER  88 -12.006 -11.202  -9.830
  702    HG   SER  88           HG       SER  88 -10.756 -13.043  -9.079
  703    H    GLN  89           H        GLN  89 -10.301  -8.750  -6.920
  704    HA   GLN  89           HA       GLN  89 -11.125  -6.589  -8.797
  705   1HB   GLN  89          1HB       GLN  89 -11.924  -6.861  -5.893
  706   2HB   GLN  89          2HB       GLN  89 -12.552  -5.729  -7.091
  707   1HG   GLN  89          1HG       GLN  89 -12.974  -8.751  -6.987
  708   2HG   GLN  89          2HG       GLN  89 -14.164  -7.499  -6.649
  709   1HE2  GLN  89          2HE2      GLN  89 -14.353  -5.802  -8.599
  710   2HE2  GLN  89          1HE2      GLN  89 -14.549  -6.562 -10.165
  711    HA   PRO  90           HA       PRO  90  -7.573  -4.535  -6.864
  712   1HB   PRO  90          1HB       PRO  90  -7.800  -2.035  -7.930
  713   2HB   PRO  90          2HB       PRO  90  -7.291  -3.453  -8.891
  714   1HG   PRO  90          1HG       PRO  90 -10.057  -2.250  -8.744
  715   2HG   PRO  90          2HG       PRO  90  -9.126  -2.708 -10.197
  716   1HD   PRO  90          1HD       PRO  90 -11.008  -4.350  -9.077
  717   2HD   PRO  90          2HD       PRO  90  -9.528  -5.009  -9.837
  718    H    LYS  91           H        LYS  91  -8.018  -4.516  -4.750
  719    HA   LYS  91           HA       LYS  91 -10.330  -3.199  -3.575
  720   1HB   LYS  91          1HB       LYS  91  -9.536  -5.387  -2.836
  721   2HB   LYS  91          2HB       LYS  91  -7.950  -4.714  -2.429
  722   1HG   LYS  91          1HG       LYS  91  -9.021  -3.252  -0.720
  723   2HG   LYS  91          2HG       LYS  91 -10.602  -3.946  -1.141
  724   1HD   LYS  91          1HD       LYS  91  -9.862  -6.164  -0.396
  725   2HD   LYS  91          2HD       LYS  91  -8.202  -5.581  -0.190
  726   1HE   LYS  91          1HE       LYS  91  -9.319  -5.750   1.983
  727   2HE   LYS  91          2HE       LYS  91  -8.896  -4.071   1.616
  728   1HZ   LYS  91          1HZ       LYS  91 -11.555  -5.266   1.258
  729   2HZ   LYS  91          2HZ       LYS  91 -11.103  -4.289   2.506
  730   3HZ   LYS  91          3HZ       LYS  91 -11.154  -3.693   0.972
  731    H    ILE  92           H        ILE  92 -10.160  -0.954  -3.686
  732    HA   ILE  92           HA       ILE  92  -7.592   0.323  -3.229
  733    HB   ILE  92           HB       ILE  92 -10.239   1.738  -3.628
  734   1HG1  ILE  92          1HG1      ILE  92 -10.209   0.201  -5.458
  735   2HG1  ILE  92          2HG1      ILE  92  -9.794   1.812  -6.021
  736   1HG2  ILE  92          1HG2      ILE  92  -7.309   2.401  -4.161
  737   2HG2  ILE  92          2HG2      ILE  92  -8.679   3.416  -4.652
  738   3HG2  ILE  92          3HG2      ILE  92  -8.363   3.113  -2.931
  739   1HD1  ILE  92          1HD1      ILE  92  -7.392   1.190  -6.103
  740   2HD1  ILE  92          2HD1      ILE  92  -7.808  -0.450  -5.540
  741   3HD1  ILE  92          3HD1      ILE  92  -8.401   0.135  -7.102
  742    H    VAL  93           H        VAL  93  -7.068  -0.037  -1.050
  743    HA   VAL  93           HA       VAL  93  -8.904   0.772   1.106
  744    HB   VAL  93           HB       VAL  93  -5.967  -0.043   1.098
  745   1HG1  VAL  93          1HG1      VAL  93  -7.864   0.514   3.424
  746   2HG1  VAL  93          2HG1      VAL  93  -6.258  -0.233   3.565
  747   3HG1  VAL  93          3HG1      VAL  93  -6.402   1.438   3.017
  748   1HG2  VAL  93          1HG2      VAL  93  -7.430  -1.913   0.538
  749   2HG2  VAL  93          2HG2      VAL  93  -6.889  -2.093   2.214
  750   3HG2  VAL  93          3HG2      VAL  93  -8.527  -1.510   1.877
  751    H    LYS  94           H        LYS  94  -9.338   2.970   1.188
  752    HA   LYS  94           HA       LYS  94  -7.228   4.880   0.605
  753   1HB   LYS  94          1HB       LYS  94  -8.651   6.593   0.939
  754   2HB   LYS  94          2HB       LYS  94  -9.671   5.353   0.206
  755   1HG   LYS  94          1HG       LYS  94 -10.670   4.873   2.428
  756   2HG   LYS  94          2HG       LYS  94  -9.563   6.037   3.197
  757   1HD   LYS  94          1HD       LYS  94 -10.415   7.862   1.827
  758   2HD   LYS  94          2HD       LYS  94 -11.543   6.764   1.009
  759   1HE   LYS  94          1HE       LYS  94 -12.681   6.346   3.179
  760   2HE   LYS  94          2HE       LYS  94 -11.534   7.437   3.988
  761   1HZ   LYS  94          1HZ       LYS  94 -13.332   8.234   1.808
  762   2HZ   LYS  94          2HZ       LYS  94 -13.608   8.516   3.411
  763   3HZ   LYS  94          3HZ       LYS  94 -12.319   9.218   2.654
  764    H    TRP  95           H        TRP  95  -6.039   6.106   2.078
  765    HA   TRP  95           HA       TRP  95  -5.519   4.794   4.628
  766   1HB   TRP  95          1HB       TRP  95  -3.651   5.639   3.440
  767   2HB   TRP  95          2HB       TRP  95  -4.430   7.187   3.168
  768    HD1  TRP  95           HD1      TRP  95  -3.559   5.332   6.478
  769    HE1  TRP  95           HE1      TRP  95  -2.348   7.020   8.016
  770    HE3  TRP  95           HE3      TRP  95  -3.441   9.356   3.339
  771    HZ2  TRP  95           HZ2      TRP  95  -1.688   9.862   7.973
  772    HZ3  TRP  95           HZ3      TRP  95  -2.508  11.503   4.092
  773    HH2  TRP  95           HH2      TRP  95  -1.745  11.782   6.423
  774    H    ASP  96           H        ASP  96  -6.717   5.151   6.375
  775    HA   ASP  96           HA       ASP  96  -8.422   7.484   6.766
  776   1HB   ASP  96          1HB       ASP  96  -9.030   5.255   7.659
  777   2HB   ASP  96          2HB       ASP  96  -7.541   5.244   8.624
  778    H    ARG  97           H        ARG  97  -8.022   9.144   8.288
  779    HA   ARG  97           HA       ARG  97  -5.155   9.520   9.082
  780   1HB   ARG  97          1HB       ARG  97  -6.001  10.730   7.007
  781   2HB   ARG  97          2HB       ARG  97  -7.015  11.696   8.086
  782   1HG   ARG  97          1HG       ARG  97  -4.914  12.447   9.298
  783   2HG   ARG  97          2HG       ARG  97  -3.961  11.464   8.187
  784   1HD   ARG  97          1HD       ARG  97  -5.805  13.762   7.417
  785   2HD   ARG  97          2HD       ARG  97  -4.038  13.870   7.546
  786    HE   ARG  97           HE       ARG  97  -4.531  11.747   5.817
  787   1HH1  ARG  97          1HH2      ARG  97  -5.169  15.242   5.804
  788   2HH1  ARG  97          2HH2      ARG  97  -5.374  15.314   4.070
  789   1HH2  ARG  97          1HH1      ARG  97  -4.752  11.873   3.558
  790   2HH2  ARG  97          2HH1      ARG  97  -5.144  13.402   2.800
  791    H    ASP  98           H        ASP  98  -7.200   8.390  10.797
  792    HA   ASP  98           HA       ASP  98  -7.698  10.561  12.751
  793   1HB   ASP  98          1HB       ASP  98  -9.380   8.764  12.252
  794   2HB   ASP  98          2HB       ASP  98  -8.266   7.580  12.946
  795    H    MET  99           H        MET  99  -5.163  10.696  12.329
  796    HA   MET  99           HA       MET  99  -3.692   9.203  14.440
  797   1HB   MET  99          1HB       MET  99  -2.921   9.477  11.495
  798   2HB   MET  99          2HB       MET  99  -1.864   8.862  12.767
  799   1HG   MET  99          1HG       MET  99  -4.488   7.606  11.845
  800   2HG   MET  99          2HG       MET  99  -2.882   7.057  11.413
  801   1HE   MET  99          1HE       MET  99  -1.203   5.858  12.979
  802   2HE   MET  99          2HE       MET  99  -1.236   7.148  14.210
  803   3HE   MET  99          3HE       MET  99  -1.517   5.460  14.679
  Start of MODEL   10
    1   1H    MET   0          1H        MET   0  -6.276 -23.749  -0.086
    2   2H    MET   0          2H        MET   0  -4.656 -23.430  -0.042
    3   3H    MET   0          3H        MET   0  -5.734 -22.194   0.061
    4    HA   MET   0           HA       MET   0  -5.363 -23.937  -2.253
    5   1HB   MET   0          1HB       MET   0  -7.087 -21.454  -1.854
    6   2HB   MET   0          2HB       MET   0  -6.776 -22.206  -3.424
    7   1HG   MET   0          1HG       MET   0  -7.780 -24.315  -2.653
    8   2HG   MET   0          2HG       MET   0  -8.183 -23.556  -1.100
    9   1HE   MET   0          1HE       MET   0 -10.593 -24.550  -1.607
   10   2HE   MET   0          2HE       MET   0 -11.648 -23.981  -2.921
   11   3HE   MET   0          3HE       MET   0 -10.261 -25.029  -3.291
   12    H    ILE   1           H        ILE   1  -4.770 -22.486  -4.204
   13    HA   ILE   1           HA       ILE   1  -2.196 -21.485  -3.811
   14    HB   ILE   1           HB       ILE   1  -3.333 -22.525  -5.832
   15   1HG1  ILE   1          1HG1      ILE   1  -0.992 -21.835  -5.857
   16   2HG1  ILE   1          2HG1      ILE   1  -1.815 -21.796  -7.409
   17   1HG2  ILE   1          1HG2      ILE   1  -5.184 -20.960  -6.028
   18   2HG2  ILE   1          2HG2      ILE   1  -4.061 -19.651  -6.466
   19   3HG2  ILE   1          3HG2      ILE   1  -4.236 -21.065  -7.526
   20   1HD1  ILE   1          1HD1      ILE   1  -1.964 -19.354  -7.360
   21   2HD1  ILE   1          2HD1      ILE   1  -1.195 -19.323  -5.759
   22   3HD1  ILE   1          3HD1      ILE   1  -0.294 -19.902  -7.160
   23    H    GLN   2           H        GLN   2  -5.221 -19.931  -3.859
   24    HA   GLN   2           HA       GLN   2  -4.241 -17.174  -4.040
   25   1HB   GLN   2          1HB       GLN   2  -7.007 -18.330  -3.501
   26   2HB   GLN   2          2HB       GLN   2  -6.643 -16.610  -3.674
   27   1HG   GLN   2          1HG       GLN   2  -5.692 -17.121  -5.974
   28   2HG   GLN   2          2HG       GLN   2  -6.350 -18.754  -5.818
   29   1HE2  GLN   2          2HE2      GLN   2  -8.810 -18.587  -4.832
   30   2HE2  GLN   2          1HE2      GLN   2  -9.827 -17.536  -5.793
   31    H    ARG   3           H        ARG   3  -2.746 -17.382  -2.144
   32    HA   ARG   3           HA       ARG   3  -3.915 -17.296   0.538
   33   1HB   ARG   3          1HB       ARG   3  -1.254 -16.423  -0.563
   34   2HB   ARG   3          2HB       ARG   3  -1.723 -16.295   1.143
   35   1HG   ARG   3          1HG       ARG   3  -2.012 -18.757   1.255
   36   2HG   ARG   3          2HG       ARG   3  -1.542 -18.882  -0.453
   37   1HD   ARG   3          1HD       ARG   3   0.414 -19.386   0.911
   38   2HD   ARG   3          2HD       ARG   3   0.653 -17.842   0.092
   39    HE   ARG   3           HE       ARG   3   0.592 -16.673   2.037
   40   1HH1  ARG   3          1HH2      ARG   3  -0.324 -20.026   2.770
   41   2HH1  ARG   3          2HH2      ARG   3  -0.018 -19.856   4.479
   42   1HH2  ARG   3          1HH1      ARG   3   1.020 -16.481   4.237
   43   2HH2  ARG   3          2HH1      ARG   3   0.745 -17.819   5.325
   44    H    THR   4           H        THR   4  -5.247 -15.665   1.115
   45    HA   THR   4           HA       THR   4  -5.586 -13.312  -0.372
   46    HB   THR   4           HB       THR   4  -6.432 -13.870   2.500
   47    HG1  THR   4           HG1      THR   4  -7.573 -14.610   0.016
   48   1HG2  THR   4          1HG2      THR   4  -8.365 -12.449   1.950
   49   2HG2  THR   4          2HG2      THR   4  -6.861 -11.529   1.766
   50   3HG2  THR   4          3HG2      THR   4  -7.712 -12.146   0.328
   51    HA   PRO   5           HA       PRO   5  -2.191 -10.985   1.492
   52   1HB   PRO   5          1HB       PRO   5  -2.687  -8.491   0.486
   53   2HB   PRO   5          2HB       PRO   5  -2.098  -9.835  -0.535
   54   1HG   PRO   5          1HG       PRO   5  -4.947  -8.888  -0.173
   55   2HG   PRO   5          2HG       PRO   5  -4.076  -9.208  -1.698
   56   1HD   PRO   5          1HD       PRO   5  -5.723 -11.059  -0.553
   57   2HD   PRO   5          2HD       PRO   5  -4.214 -11.563  -1.373
   58    H    LYS   6           H        LYS   6  -2.007 -10.209   3.540
   59    HA   LYS   6           HA       LYS   6  -4.287  -8.954   4.920
   60   1HB   LYS   6          1HB       LYS   6  -2.779 -10.703   5.989
   61   2HB   LYS   6          2HB       LYS   6  -1.480  -9.495   5.934
   62   1HG   LYS   6          1HG       LYS   6  -3.152  -7.916   7.128
   63   2HG   LYS   6          2HG       LYS   6  -4.121  -9.367   7.425
   64   1HD   LYS   6          1HD       LYS   6  -2.193 -10.409   8.597
   65   2HD   LYS   6          2HD       LYS   6  -1.200  -8.979   8.240
   66   1HE   LYS   6          1HE       LYS   6  -2.790  -7.556   9.528
   67   2HE   LYS   6          2HE       LYS   6  -3.737  -9.002   9.935
   68   1HZ   LYS   6          1HZ       LYS   6  -1.808  -9.865  11.050
   69   2HZ   LYS   6          2HZ       LYS   6  -0.930  -8.526  10.657
   70   3HZ   LYS   6          3HZ       LYS   6  -2.222  -8.395  11.670
   71    H    ILE   7           H        ILE   7  -4.533  -6.816   4.703
   72    HA   ILE   7           HA       ILE   7  -2.337  -5.046   3.878
   73    HB   ILE   7           HB       ILE   7  -3.972  -3.446   3.429
   74   1HG1  ILE   7          1HG1      ILE   7  -5.564  -3.551   5.226
   75   2HG1  ILE   7          2HG1      ILE   7  -6.357  -3.666   3.670
   76   1HG2  ILE   7          1HG2      ILE   7  -4.931  -6.155   2.430
   77   2HG2  ILE   7          2HG2      ILE   7  -5.279  -4.580   1.704
   78   3HG2  ILE   7          3HG2      ILE   7  -3.611  -5.174   1.770
   79   1HD1  ILE   7          1HD1      ILE   7  -5.978  -5.934   5.654
   80   2HD1  ILE   7          2HD1      ILE   7  -7.470  -5.138   5.163
   81   3HD1  ILE   7          3HD1      ILE   7  -6.608  -6.151   3.999
   82    H    GLN   8           H        GLN   8  -1.256  -3.624   5.351
   83    HA   GLN   8           HA       GLN   8  -2.706  -2.779   7.767
   84   1HB   GLN   8          1HB       GLN   8  -0.524  -3.118   8.931
   85   2HB   GLN   8          2HB       GLN   8  -1.491  -4.566   8.666
   86   1HG   GLN   8          1HG       GLN   8   0.572  -3.968   6.578
   87   2HG   GLN   8          2HG       GLN   8   1.196  -4.329   8.177
   88   1HE2  GLN   8          2HE2      GLN   8   2.193  -6.216   7.510
   89   2HE2  GLN   8          1HE2      GLN   8   1.323  -7.661   7.059
   90    H    VAL   9           H        VAL   9  -2.982  -0.973   6.235
   91    HA   VAL   9           HA       VAL   9  -0.712   0.535   5.325
   92    HB   VAL   9           HB       VAL   9  -3.637   1.321   5.588
   93   1HG1  VAL   9          1HG1      VAL   9  -2.199   3.310   5.363
   94   2HG1  VAL   9          2HG1      VAL   9  -1.374   2.575   3.975
   95   3HG1  VAL   9          3HG1      VAL   9  -3.091   3.018   3.868
   96   1HG2  VAL   9          1HG2      VAL   9  -2.063   0.182   3.230
   97   2HG2  VAL   9          2HG2      VAL   9  -3.368  -0.640   4.108
   98   3HG2  VAL   9          3HG2      VAL   9  -3.723   0.802   3.151
   99    H    TYR  10           H        TYR  10   0.521   1.906   6.479
  100    HA   TYR  10           HA       TYR  10  -0.492   3.059   9.054
  101   1HB   TYR  10          1HB       TYR  10   2.397   2.817   8.300
  102   2HB   TYR  10          2HB       TYR  10   1.666   2.996   9.878
  103    HD1  TYR  10           HD1      TYR  10   0.002   0.965  10.541
  104    HD2  TYR  10           HD2      TYR  10   3.227   0.734   7.693
  105    HE1  TYR  10           HE1      TYR  10   0.266  -1.460  11.024
  106    HE2  TYR  10           HE2      TYR  10   3.523  -1.671   8.214
  107    HH   TYR  10           HH       TYR  10   1.577  -3.325  10.733
  108    H    SER  11           H        SER  11   0.577   5.152   9.595
  109    HA   SER  11           HA       SER  11   1.575   6.740   7.274
  110   1HB   SER  11          1HB       SER  11   1.124   8.773   8.495
  111   2HB   SER  11          2HB       SER  11  -0.343   7.838   8.178
  112    HG   SER  11           HG       SER  11  -0.153   8.726  10.309
  113    H    ARG  12           H        ARG  12   3.738   7.304   7.444
  114    HA   ARG  12           HA       ARG  12   5.355   6.066   9.489
  115   1HB   ARG  12          1HB       ARG  12   5.929   6.548   6.997
  116   2HB   ARG  12          2HB       ARG  12   6.281   8.183   7.545
  117   1HG   ARG  12          1HG       ARG  12   7.929   7.256   9.184
  118   2HG   ARG  12          2HG       ARG  12   7.557   5.626   8.588
  119   1HD   ARG  12          1HD       ARG  12   8.257   6.421   6.260
  120   2HD   ARG  12          2HD       ARG  12   8.765   7.936   7.005
  121    HE   ARG  12           HE       ARG  12  10.642   6.941   7.841
  122   1HH1  ARG  12          1HH2      ARG  12   8.404   4.374   6.819
  123   2HH1  ARG  12          2HH2      ARG  12   9.607   3.116   6.915
  124   1HH2  ARG  12          1HH1      ARG  12  12.196   5.274   7.995
  125   2HH2  ARG  12          2HH1      ARG  12  11.767   3.627   7.614
  126    H    HIS  13           H        HIS  13   4.622   9.419   8.528
  127    HA   HIS  13           HA       HIS  13   5.546  10.493  11.156
  128   1HB   HIS  13          1HB       HIS  13   5.367  11.839   8.444
  129   2HB   HIS  13          2HB       HIS  13   6.028  12.539   9.926
  130    HD2  HIS  13           HD2      HIS  13   7.643  11.832   6.956
  131    HE1  HIS  13           HE1      HIS  13   9.981   9.491   9.589
  132    HE2  HIS  13           HE2      HIS  13   9.906  10.561   7.269
  133    HA   PRO  14           HA       PRO  14   1.338  11.810  11.706
  134   1HB   PRO  14          1HB       PRO  14   1.543  14.127  13.141
  135   2HB   PRO  14          2HB       PRO  14   1.953  12.522  13.814
  136   1HG   PRO  14          1HG       PRO  14   3.843  14.576  12.649
  137   2HG   PRO  14          2HG       PRO  14   4.011  13.683  14.188
  138   1HD   PRO  14          1HD       PRO  14   5.265  12.923  11.901
  139   2HD   PRO  14          2HD       PRO  14   4.669  11.699  13.040
  140    H    ALA  15           H        ALA  15  -0.144  12.880  10.425
  141    HA   ALA  15           HA       ALA  15   0.850  14.217   8.115
  142   1HB   ALA  15          1HB       ALA  15  -1.109  12.778   8.103
  143   2HB   ALA  15          2HB       ALA  15  -1.990  13.945   9.113
  144   3HB   ALA  15          3HB       ALA  15  -1.501  14.388   7.467
  145    H    GLU  16           H        GLU  16   0.669  16.286   7.442
  146    HA   GLU  16           HA       GLU  16  -0.199  18.482   9.251
  147   1HB   GLU  16          1HB       GLU  16   2.532  18.110   7.973
  148   2HB   GLU  16          2HB       GLU  16   1.966  19.643   8.655
  149   1HG   GLU  16          1HG       GLU  16   1.929  18.714  10.884
  150   2HG   GLU  16          2HG       GLU  16   2.221  17.077  10.286
  151    H    ASN  17           H        ASN  17  -1.650  19.555   7.951
  152    HA   ASN  17           HA       ASN  17  -2.006  18.917   5.266
  153   1HB   ASN  17          1HB       ASN  17  -3.051  21.196   6.957
  154   2HB   ASN  17          2HB       ASN  17  -3.516  20.934   5.274
  155   1HD2  ASN  17          2HD2      ASN  17  -5.713  20.778   6.285
  156   2HD2  ASN  17          1HD2      ASN  17  -6.237  19.198   6.827
  157    H    GLY  18           H        GLY  18  -0.712  19.352   3.596
  158   1HA   GLY  18          1HA       GLY  18   0.401  20.579   2.028
  159   2HA   GLY  18          2HA       GLY  18   0.144  22.054   2.964
  160    H    LYS  19           H        LYS  19   1.696  19.085   4.243
  161    HA   LYS  19           HA       LYS  19   4.405  20.133   3.773
  162   1HB   LYS  19          1HB       LYS  19   3.745  21.126   5.855
  163   2HB   LYS  19          2HB       LYS  19   3.295  19.530   6.467
  164   1HG   LYS  19          1HG       LYS  19   6.163  20.159   5.654
  165   2HG   LYS  19          2HG       LYS  19   5.515  20.594   7.244
  166   1HD   LYS  19          1HD       LYS  19   4.777  18.182   7.522
  167   2HD   LYS  19          2HD       LYS  19   5.780  17.780   6.131
  168   1HE   LYS  19          1HE       LYS  19   7.785  18.481   7.252
  169   2HE   LYS  19          2HE       LYS  19   6.850  19.104   8.633
  170   1HZ   LYS  19          1HZ       LYS  19   6.919  16.294   7.791
  171   2HZ   LYS  19          2HZ       LYS  19   7.740  16.943   9.071
  172   3HZ   LYS  19          3HZ       LYS  19   6.093  16.920   9.076
  173    H    SER  20           H        SER  20   5.328  18.605   2.989
  174    HA   SER  20           HA       SER  20   4.535  16.119   2.514
  175   1HB   SER  20          1HB       SER  20   6.381  17.347   1.366
  176   2HB   SER  20          2HB       SER  20   7.453  16.515   2.525
  177    HG   SER  20           HG       SER  20   6.519  14.540   1.804
  178    H    ASN  21           H        ASN  21   4.293  14.364   3.763
  179    HA   ASN  21           HA       ASN  21   6.090  13.650   6.044
  180   1HB   ASN  21          1HB       ASN  21   3.139  13.409   5.526
  181   2HB   ASN  21          2HB       ASN  21   3.916  12.388   6.737
  182   1HD2  ASN  21          2HD2      ASN  21   2.485  15.433   6.268
  183   2HD2  ASN  21          1HD2      ASN  21   3.035  16.142   7.775
  184    H    PHE  22           H        PHE  22   4.809  10.889   6.031
  185    HA   PHE  22           HA       PHE  22   5.551   9.777   3.440
  186   1HB   PHE  22          1HB       PHE  22   7.205   9.436   5.874
  187   2HB   PHE  22          2HB       PHE  22   6.723   7.934   5.100
  188    HD1  PHE  22           HD1      PHE  22   7.364   7.358   2.809
  189    HD2  PHE  22           HD2      PHE  22   8.863  10.896   4.771
  190    HE1  PHE  22           HE1      PHE  22   9.271   7.433   1.223
  191    HE2  PHE  22           HE2      PHE  22  10.790  10.936   3.208
  192    HZ   PHE  22           HZ       PHE  22  11.005   9.191   1.446
  193    H    LEU  23           H        LEU  23   4.136   8.336   2.858
  194    HA   LEU  23           HA       LEU  23   2.189   7.229   4.804
  195   1HB   LEU  23          1HB       LEU  23   1.294   8.712   3.096
  196   2HB   LEU  23          2HB       LEU  23   2.092   7.780   1.822
  197    HG   LEU  23           HG       LEU  23   0.595   5.873   2.331
  198   1HD1  LEU  23          1HD1      LEU  23  -0.572   7.796   4.394
  199   2HD1  LEU  23          2HD1      LEU  23  -1.314   6.254   3.878
  200   3HD1  LEU  23          3HD1      LEU  23   0.219   6.253   4.746
  201   1HD2  LEU  23          1HD2      LEU  23  -0.075   7.700   0.724
  202   2HD2  LEU  23          2HD2      LEU  23  -1.477   6.951   1.520
  203   3HD2  LEU  23          3HD2      LEU  23  -0.883   8.539   2.058
  204    H    ASN  24           H        ASN  24   2.033   4.998   4.995
  205    HA   ASN  24           HA       ASN  24   3.901   3.368   3.319
  206   1HB   ASN  24          1HB       ASN  24   3.085   2.974   6.205
  207   2HB   ASN  24          2HB       ASN  24   4.239   2.008   5.293
  208   1HD2  ASN  24          2HD2      ASN  24   5.824   4.026   4.102
  209   2HD2  ASN  24          1HD2      ASN  24   6.627   4.935   5.361
  210    H    CYS  25           H        CYS  25   2.492   2.400   1.829
  211    HA   CYS  25           HA       CYS  25   0.244   0.814   2.912
  212   1HB   CYS  25          1HB       CYS  25   1.525   0.370   0.222
  213   2HB   CYS  25          2HB       CYS  25  -0.076  -0.061   0.781
  214    H    TYR  26           H        TYR  26   0.791  -1.035   4.044
  215    HA   TYR  26           HA       TYR  26   3.246  -2.546   3.254
  216   1HB   TYR  26          1HB       TYR  26   3.406  -1.433   5.511
  217   2HB   TYR  26          2HB       TYR  26   2.030  -2.362   6.046
  218    HD1  TYR  26           HD1      TYR  26   2.411  -5.098   5.414
  219    HD2  TYR  26           HD2      TYR  26   5.374  -2.162   6.494
  220    HE1  TYR  26           HE1      TYR  26   3.863  -6.881   6.254
  221    HE2  TYR  26           HE2      TYR  26   6.865  -3.981   7.262
  222    HH   TYR  26           HH       TYR  26   5.976  -7.437   7.019
  223    H    VAL  27           H        VAL  27   2.743  -4.615   2.612
  224    HA   VAL  27           HA       VAL  27   0.153  -5.783   3.437
  225    HB   VAL  27           HB       VAL  27   1.212  -6.004   0.581
  226   1HG1  VAL  27          1HG1      VAL  27  -1.542  -6.578   1.759
  227   2HG1  VAL  27          2HG1      VAL  27  -0.989  -6.906   0.104
  228   3HG1  VAL  27          3HG1      VAL  27  -0.330  -7.828   1.464
  229   1HG2  VAL  27          1HG2      VAL  27  -0.997  -4.203   1.585
  230   2HG2  VAL  27          2HG2      VAL  27   0.560  -3.661   0.917
  231   3HG2  VAL  27          3HG2      VAL  27  -0.576  -4.532  -0.120
  232    H    SER  28           H        SER  28   0.349  -8.024   3.846
  233    HA   SER  28           HA       SER  28   2.675  -9.424   2.812
  234   1HB   SER  28          1HB       SER  28   3.376 -10.343   4.978
  235   2HB   SER  28          2HB       SER  28   3.657  -8.619   4.946
  236    HG   SER  28           HG       SER  28   1.402  -9.962   6.088
  237    H    GLY  29           H        GLY  29   2.549 -11.678   2.903
  238   1HA   GLY  29          1HA       GLY  29   1.651 -13.581   4.036
  239   2HA   GLY  29          2HA       GLY  29   0.037 -12.898   3.953
  240    H    PHE  30           H        PHE  30   1.614 -12.414   0.972
  241    HA   PHE  30           HA       PHE  30  -0.449 -14.269  -0.085
  242   1HB   PHE  30          1HB       PHE  30  -0.911 -12.515  -1.645
  243   2HB   PHE  30          2HB       PHE  30  -1.103 -12.106   0.022
  244    HD1  PHE  30           HD1      PHE  30   0.939 -11.462  -3.016
  245    HD2  PHE  30           HD2      PHE  30   0.130 -10.250   1.044
  246    HE1  PHE  30           HE1      PHE  30   2.782  -9.860  -3.139
  247    HE2  PHE  30           HE2      PHE  30   1.833  -8.468   0.801
  248    HZ   PHE  30           HZ       PHE  30   3.147  -8.281  -1.259
  249    H    HIS  31           H        HIS  31   0.493 -16.055  -1.141
  250    HA   HIS  31           HA       HIS  31   2.526 -15.485  -3.240
  251   1HB   HIS  31          1HB       HIS  31   3.257 -17.562  -3.221
  252   2HB   HIS  31          2HB       HIS  31   2.769 -17.463  -1.538
  253    HD2  HIS  31           HD2      HIS  31   1.300 -18.841  -4.957
  254    HE1  HIS  31           HE1      HIS  31   0.009 -21.324  -1.779
  255    HE2  HIS  31           HE2      HIS  31  -0.030 -21.010  -4.313
  256    HA   PRO  32           HA       PRO  32   2.910 -16.494  -5.376
  257   1HB   PRO  32          1HB       PRO  32   2.693 -15.811  -7.984
  258   2HB   PRO  32          2HB       PRO  32   1.983 -17.319  -7.355
  259   1HG   PRO  32          1HG       PRO  32   0.586 -14.658  -7.694
  260   2HG   PRO  32          2HG       PRO  32   0.093 -16.224  -8.413
  261   1HD   PRO  32          1HD       PRO  32  -0.968 -15.355  -6.059
  262   2HD   PRO  32          2HD       PRO  32  -0.554 -17.076  -6.284
  263    H    SER  33           H        SER  33   4.153 -14.718  -7.051
  264    HA   SER  33           HA       SER  33   4.636 -12.671  -5.097
  265   1HB   SER  33          1HB       SER  33   6.580 -12.192  -6.571
  266   2HB   SER  33          2HB       SER  33   6.430 -13.913  -6.156
  267    HG   SER  33           HG       SER  33   5.582 -12.696  -8.578
  268    H    ASP  34           H        ASP  34   3.050 -12.658  -8.266
  269    HA   ASP  34           HA       ASP  34   3.648  -9.895  -8.801
  270   1HB   ASP  34          1HB       ASP  34   3.464 -11.470 -10.602
  271   2HB   ASP  34          2HB       ASP  34   1.822 -11.913 -10.133
  272    H    ILE  35           H        ILE  35   2.838  -8.497  -7.332
  273    HA   ILE  35           HA       ILE  35  -0.112  -8.089  -7.340
  274    HB   ILE  35           HB       ILE  35   0.603  -8.942  -5.240
  275   1HG1  ILE  35          1HG1      ILE  35   0.203  -6.001  -4.674
  276   2HG1  ILE  35          2HG1      ILE  35  -1.096  -6.970  -5.337
  277   1HG2  ILE  35          1HG2      ILE  35   2.515  -6.646  -5.090
  278   2HG2  ILE  35          2HG2      ILE  35   2.105  -7.754  -3.768
  279   3HG2  ILE  35          3HG2      ILE  35   2.895  -8.403  -5.203
  280   1HD1  ILE  35          1HD1      ILE  35  -0.675  -8.637  -3.425
  281   2HD1  ILE  35          2HD1      ILE  35   0.308  -7.380  -2.676
  282   3HD1  ILE  35          3HD1      ILE  35  -1.400  -7.070  -2.996
  283    H    GLU  36           H        GLU  36  -0.797  -5.938  -7.263
  284    HA   GLU  36           HA       GLU  36   1.125  -3.825  -8.104
  285   1HB   GLU  36          1HB       GLU  36  -1.833  -3.820  -8.692
  286   2HB   GLU  36          2HB       GLU  36  -0.521  -2.885  -9.413
  287   1HG   GLU  36          1HG       GLU  36   0.373  -5.072 -10.330
  288   2HG   GLU  36          2HG       GLU  36  -1.079  -5.859  -9.733
  289    H    VAL  37           H        VAL  37   1.237  -2.069  -6.756
  290    HA   VAL  37           HA       VAL  37  -1.054  -1.298  -5.077
  291    HB   VAL  37           HB       VAL  37   1.735  -1.823  -3.996
  292   1HG1  VAL  37          1HG1      VAL  37   0.711   0.130  -2.805
  293   2HG1  VAL  37          2HG1      VAL  37  -0.671  -0.897  -2.377
  294   3HG1  VAL  37          3HG1      VAL  37   0.934  -1.288  -1.779
  295   1HG2  VAL  37          1HG2      VAL  37  -0.930  -3.231  -3.614
  296   2HG2  VAL  37          2HG2      VAL  37   0.617  -3.909  -4.179
  297   3HG2  VAL  37          3HG2      VAL  37   0.402  -3.440  -2.485
  298    H    ASP  38           H        ASP  38  -1.228   0.292  -6.713
  299    HA   ASP  38           HA       ASP  38   0.817   2.417  -6.804
  300   1HB   ASP  38          1HB       ASP  38  -1.992   2.526  -7.990
  301   2HB   ASP  38          2HB       ASP  38  -0.570   3.483  -8.379
  302    H    LEU  39           H        LEU  39   0.683   4.234  -5.458
  303    HA   LEU  39           HA       LEU  39  -1.636   4.449  -3.642
  304   1HB   LEU  39          1HB       LEU  39   0.846   6.178  -3.871
  305   2HB   LEU  39          2HB       LEU  39  -0.524   6.448  -2.788
  306    HG   LEU  39           HG       LEU  39   0.065   3.793  -2.274
  307   1HD1  LEU  39          1HD1      LEU  39   2.712   5.237  -2.694
  308   2HD1  LEU  39          2HD1      LEU  39   2.497   3.644  -1.943
  309   3HD1  LEU  39          3HD1      LEU  39   2.109   3.870  -3.656
  310   1HD2  LEU  39          1HD2      LEU  39   0.959   6.367  -0.951
  311   2HD2  LEU  39          2HD2      LEU  39  -0.430   5.354  -0.548
  312   3HD2  LEU  39          3HD2      LEU  39   1.219   4.785  -0.200
  313    H    LEU  40           H        LEU  40  -3.205   5.947  -3.811
  314    HA   LEU  40           HA       LEU  40  -3.437   7.453  -6.375
  315   1HB   LEU  40          1HB       LEU  40  -4.285   4.956  -6.258
  316   2HB   LEU  40          2HB       LEU  40  -5.576   5.624  -5.279
  317    HG   LEU  40           HG       LEU  40  -6.275   5.341  -7.551
  318   1HD1  LEU  40          1HD1      LEU  40  -5.911   8.332  -7.109
  319   2HD1  LEU  40          2HD1      LEU  40  -7.147   7.527  -8.087
  320   3HD1  LEU  40          3HD1      LEU  40  -7.153   7.328  -6.325
  321   1HD2  LEU  40          1HD2      LEU  40  -3.927   5.537  -8.519
  322   2HD2  LEU  40          2HD2      LEU  40  -5.234   6.274  -9.467
  323   3HD2  LEU  40          3HD2      LEU  40  -4.167   7.298  -8.498
  324    H    LYS  41           H        LYS  41  -3.939   9.617  -5.731
  325    HA   LYS  41           HA       LYS  41  -5.063  10.050  -3.139
  326   1HB   LYS  41          1HB       LYS  41  -4.518  11.931  -5.419
  327   2HB   LYS  41          2HB       LYS  41  -4.695  12.342  -3.680
  328   1HG   LYS  41          1HG       LYS  41  -2.691  11.346  -3.100
  329   2HG   LYS  41          2HG       LYS  41  -2.516  10.414  -4.588
  330   1HD   LYS  41          1HD       LYS  41  -1.042  12.298  -4.511
  331   2HD   LYS  41          2HD       LYS  41  -2.063  12.292  -5.926
  332   1HE   LYS  41          1HE       LYS  41  -3.571  13.932  -5.024
  333   2HE   LYS  41          2HE       LYS  41  -2.785  13.844  -3.428
  334   1HZ   LYS  41          1HZ       LYS  41  -1.640  14.923  -5.913
  335   2HZ   LYS  41          2HZ       LYS  41  -2.209  15.787  -4.629
  336   3HZ   LYS  41          3HZ       LYS  41  -0.855  14.852  -4.449
  337    H    ASN  42           H        ASN  42  -6.457  12.437  -4.610
  338    HA   ASN  42           HA       ASN  42  -9.200  11.541  -4.628
  339   1HB   ASN  42          1HB       ASN  42  -9.631  13.742  -5.627
  340   2HB   ASN  42          2HB       ASN  42  -8.524  13.919  -4.261
  341   1HD2  ASN  42          2HD2      ASN  42  -6.300  14.532  -4.668
  342   2HD2  ASN  42          1HD2      ASN  42  -5.783  15.088  -6.242
  343    H    GLY  43           H        GLY  43  -6.563  11.345  -6.900
  344   1HA   GLY  43          1HA       GLY  43  -8.012   9.746  -8.776
  345   2HA   GLY  43          2HA       GLY  43  -7.887  11.419  -9.362
  346    H    GLU  44           H        GLU  44  -5.374  12.148  -8.313
  347    HA   GLU  44           HA       GLU  44  -3.693  11.402 -10.405
  348   1HB   GLU  44          1HB       GLU  44  -3.212  12.593  -7.664
  349   2HB   GLU  44          2HB       GLU  44  -1.992  12.552  -8.949
  350   1HG   GLU  44          1HG       GLU  44  -3.449  13.982 -10.348
  351   2HG   GLU  44          2HG       GLU  44  -4.676  14.004  -9.069
  352    H    ARG  45           H        ARG  45  -2.334   9.705 -10.691
  353    HA   ARG  45           HA       ARG  45  -1.966   7.715  -8.551
  354   1HB   ARG  45          1HB       ARG  45  -2.541   6.978 -10.841
  355   2HB   ARG  45          2HB       ARG  45  -1.020   7.668 -11.445
  356   1HG   ARG  45          1HG       ARG  45   0.257   6.147  -9.910
  357   2HG   ARG  45          2HG       ARG  45  -1.280   5.548  -9.266
  358   1HD   ARG  45          1HD       ARG  45  -0.485   3.933 -10.781
  359   2HD   ARG  45          2HD       ARG  45  -1.845   4.728 -11.596
  360    HE   ARG  45           HE       ARG  45   0.445   6.114 -12.415
  361   1HH1  ARG  45          1HH2      ARG  45  -0.591   2.712 -12.517
  362   2HH1  ARG  45          2HH2      ARG  45   0.243   2.377 -14.012
  363   1HH2  ARG  45          1HH1      ARG  45   1.576   5.640 -14.330
  364   2HH2  ARG  45          2HH1      ARG  45   1.500   4.043 -15.043
  365    H    ILE  46           H        ILE  46  -0.178   7.572  -7.305
  366    HA   ILE  46           HA       ILE  46   2.092   9.363  -7.724
  367    HB   ILE  46           HB       ILE  46   1.073   7.510  -5.566
  368   1HG1  ILE  46          1HG1      ILE  46   1.400  10.510  -5.336
  369   2HG1  ILE  46          2HG1      ILE  46  -0.047   9.862  -6.109
  370   1HG2  ILE  46          1HG2      ILE  46   3.522   9.279  -5.694
  371   2HG2  ILE  46          2HG2      ILE  46   2.854   8.585  -4.188
  372   3HG2  ILE  46          3HG2      ILE  46   3.475   7.510  -5.453
  373   1HD1  ILE  46          1HD1      ILE  46  -0.580   8.510  -4.123
  374   2HD1  ILE  46          2HD1      ILE  46   0.848   9.170  -3.286
  375   3HD1  ILE  46          3HD1      ILE  46  -0.473  10.231  -3.792
  376    H    GLU  47           H        GLU  47   3.452   8.496  -9.227
  377    HA   GLU  47           HA       GLU  47   4.002   5.595  -9.331
  378   1HB   GLU  47          1HB       GLU  47   4.913   7.925 -11.053
  379   2HB   GLU  47          2HB       GLU  47   5.344   6.220 -11.310
  380   1HG   GLU  47          1HG       GLU  47   2.975   5.607 -11.550
  381   2HG   GLU  47          2HG       GLU  47   2.470   7.273 -11.228
  382    H    LYS  48           H        LYS  48   5.335   8.475  -7.859
  383    HA   LYS  48           HA       LYS  48   8.010   7.400  -7.470
  384   1HB   LYS  48          1HB       LYS  48   7.536   9.821  -7.588
  385   2HB   LYS  48          2HB       LYS  48   6.566   9.710  -6.111
  386   1HG   LYS  48          1HG       LYS  48   8.575   8.954  -4.853
  387   2HG   LYS  48          2HG       LYS  48   9.522   8.981  -6.355
  388   1HD   LYS  48          1HD       LYS  48   9.217  11.420  -6.525
  389   2HD   LYS  48          2HD       LYS  48   8.109  11.400  -5.146
  390   1HE   LYS  48          1HE       LYS  48  10.287  12.177  -4.399
  391   2HE   LYS  48          2HE       LYS  48   9.938  10.604  -3.663
  392   1HZ   LYS  48          1HZ       LYS  48  11.655  11.057  -6.002
  393   2HZ   LYS  48          2HZ       LYS  48  12.167  10.730  -4.470
  394   3HZ   LYS  48          3HZ       LYS  48  11.333   9.593  -5.316
  395    H    VAL  49           H        VAL  49   7.186   5.278  -6.767
  396    HA   VAL  49           HA       VAL  49   6.399   5.173  -3.891
  397    HB   VAL  49           HB       VAL  49   6.399   2.942  -5.953
  398   1HG1  VAL  49          1HG1      VAL  49   6.591   2.235  -3.553
  399   2HG1  VAL  49          2HG1      VAL  49   5.138   3.184  -3.181
  400   3HG1  VAL  49          3HG1      VAL  49   5.035   1.785  -4.270
  401   1HG2  VAL  49          1HG2      VAL  49   4.131   4.729  -4.966
  402   2HG2  VAL  49          2HG2      VAL  49   4.716   4.575  -6.635
  403   3HG2  VAL  49          3HG2      VAL  49   3.904   3.212  -5.860
  404    H    GLU  50           H        GLU  50   8.123   5.137  -2.613
  405    HA   GLU  50           HA       GLU  50  10.805   4.354  -3.473
  406   1HB   GLU  50          1HB       GLU  50  10.172   6.393  -2.086
  407   2HB   GLU  50          2HB       GLU  50   9.796   5.279  -0.762
  408   1HG   GLU  50          1HG       GLU  50  12.122   4.496  -0.728
  409   2HG   GLU  50          2HG       GLU  50  12.501   5.532  -2.118
  410    H    HIS  51           H        HIS  51   9.545   2.110  -3.837
  411    HA   HIS  51           HA       HIS  51   8.654   0.725  -1.549
  412   1HB   HIS  51          1HB       HIS  51   8.270  -1.135  -2.988
  413   2HB   HIS  51          2HB       HIS  51   7.958   0.306  -3.954
  414    HD2  HIS  51           HD2      HIS  51   9.733   0.697  -6.119
  415    HE1  HIS  51           HE1      HIS  51  11.910  -2.883  -5.516
  416    HE2  HIS  51           HE2      HIS  51  11.552  -0.909  -7.097
  417    H    SER  52           H        SER  52   9.393  -1.218  -0.606
  418    HA   SER  52           HA       SER  52  12.330  -1.659  -0.533
  419   1HB   SER  52          1HB       SER  52  11.212  -1.504   1.652
  420   2HB   SER  52          2HB       SER  52  10.071  -2.782   1.178
  421    HG   SER  52           HG       SER  52  12.895  -3.052   1.333
  422    H    ASP  53           H        ASP  53  13.162  -3.544  -1.429
  423    HA   ASP  53           HA       ASP  53  11.738  -4.873  -3.480
  424   1HB   ASP  53          1HB       ASP  53  14.268  -5.708  -2.002
  425   2HB   ASP  53          2HB       ASP  53  13.725  -6.348  -3.559
  426    H    LEU  54           H        LEU  54  11.471  -7.283  -3.626
  427    HA   LEU  54           HA       LEU  54   9.589  -8.101  -1.718
  428   1HB   LEU  54          1HB       LEU  54   9.877  -8.834  -4.168
  429   2HB   LEU  54          2HB       LEU  54  11.059  -9.995  -3.573
  430    HG   LEU  54           HG       LEU  54   9.039 -11.164  -3.794
  431   1HD1  LEU  54          1HD1      LEU  54  10.149 -11.594  -1.590
  432   2HD1  LEU  54          2HD1      LEU  54   8.904 -10.542  -0.855
  433   3HD1  LEU  54          3HD1      LEU  54   8.433 -12.001  -1.690
  434   1HD2  LEU  54          1HD2      LEU  54   7.615  -8.849  -2.447
  435   2HD2  LEU  54          2HD2      LEU  54   7.434  -9.435  -4.112
  436   3HD2  LEU  54          3HD2      LEU  54   6.867 -10.405  -2.747
  437    H    SER  55           H        SER  55   9.853  -8.806   0.250
  438    HA   SER  55           HA       SER  55  12.064 -10.647   0.992
  439   1HB   SER  55          1HB       SER  55  12.550  -8.412   1.991
  440   2HB   SER  55          2HB       SER  55  10.935  -8.392   2.722
  441    HG   SER  55           HG       SER  55  13.001 -10.280   3.202
  442    H    PHE  56           H        PHE  56  10.944 -12.545   1.241
  443    HA   PHE  56           HA       PHE  56   8.056 -12.399   1.753
  444   1HB   PHE  56          1HB       PHE  56   7.923 -14.597   0.880
  445   2HB   PHE  56          2HB       PHE  56   8.887 -13.616  -0.213
  446    HD1  PHE  56           HD1      PHE  56  11.447 -13.899  -0.160
  447    HD2  PHE  56           HD2      PHE  56   8.664 -16.675   1.587
  448    HE1  PHE  56           HE1      PHE  56  13.285 -15.555   0.132
  449    HE2  PHE  56           HE2      PHE  56  10.481 -18.361   1.811
  450    HZ   PHE  56           HZ       PHE  56  12.797 -17.790   1.106
  451    H    SER  57           H        SER  57  10.763 -12.948   3.633
  452    HA   SER  57           HA       SER  57  11.320 -13.861   5.495
  453   1HB   SER  57          1HB       SER  57   9.900 -14.318   7.337
  454   2HB   SER  57          2HB       SER  57   9.426 -12.807   6.595
  455    HG   SER  57           HG       SER  57   7.781 -14.152   5.486
  456    H    LYS  58           H        LYS  58  11.849 -15.960   6.371
  457    HA   LYS  58           HA       LYS  58  11.352 -18.271   4.721
  458   1HB   LYS  58          1HB       LYS  58  12.443 -17.960   7.546
  459   2HB   LYS  58          2HB       LYS  58  12.412 -19.491   6.646
  460   1HG   LYS  58          1HG       LYS  58  13.797 -18.526   4.861
  461   2HG   LYS  58          2HG       LYS  58  13.838 -16.962   5.697
  462   1HD   LYS  58          1HD       LYS  58  14.962 -18.007   7.636
  463   2HD   LYS  58          2HD       LYS  58  14.916 -19.584   6.822
  464   1HE   LYS  58          1HE       LYS  58  16.323 -18.708   4.993
  465   2HE   LYS  58          2HE       LYS  58  16.331 -17.099   5.746
  466   1HZ   LYS  58          1HZ       LYS  58  17.458 -18.043   7.621
  467   2HZ   LYS  58          2HZ       LYS  58  17.444 -19.542   6.934
  468   3HZ   LYS  58          3HZ       LYS  58  18.308 -18.324   6.239
  469    H    ASP  59           H        ASP  59   9.292 -16.712   6.959
  470    HA   ASP  59           HA       ASP  59   7.847 -19.121   7.643
  471   1HB   ASP  59          1HB       ASP  59   7.074 -16.204   8.055
  472   2HB   ASP  59          2HB       ASP  59   6.394 -17.607   8.886
  473    H    TRP  60           H        TRP  60   8.089 -17.813   4.701
  474    HA   TRP  60           HA       TRP  60   6.835 -17.844   2.829
  475   1HB   TRP  60          1HB       TRP  60   5.072 -19.765   4.402
  476   2HB   TRP  60          2HB       TRP  60   5.096 -19.551   2.659
  477    HD1  TRP  60           HD1      TRP  60   7.268 -20.942   5.489
  478    HE1  TRP  60           HE1      TRP  60   8.873 -22.717   4.514
  479    HE3  TRP  60           HE3      TRP  60   6.237 -20.342   0.511
  480    HZ2  TRP  60           HZ2      TRP  60   9.569 -23.754   1.944
  481    HZ3  TRP  60           HZ3      TRP  60   7.364 -21.763  -1.174
  482    HH2  TRP  60           HH2      TRP  60   9.020 -23.476  -0.471
  483    H    SER  61           H        SER  61   6.396 -15.527   4.009
  484    HA   SER  61           HA       SER  61   3.427 -15.143   4.177
  485   1HB   SER  61          1HB       SER  61   4.791 -15.067   6.332
  486   2HB   SER  61          2HB       SER  61   5.565 -13.608   5.688
  487    HG   SER  61           HG       SER  61   2.798 -14.034   6.173
  488    H    PHE  62           H        PHE  62   5.057 -14.911   1.756
  489    HA   PHE  62           HA       PHE  62   6.331 -13.071   0.705
  490   1HB   PHE  62          1HB       PHE  62   4.105 -14.513  -0.298
  491   2HB   PHE  62          2HB       PHE  62   3.953 -12.852  -0.865
  492    HD1  PHE  62           HD1      PHE  62   5.251 -12.016  -2.682
  493    HD2  PHE  62           HD2      PHE  62   6.383 -15.692  -0.713
  494    HE1  PHE  62           HE1      PHE  62   7.061 -12.346  -4.297
  495    HE2  PHE  62           HE2      PHE  62   8.159 -16.042  -2.384
  496    HZ   PHE  62           HZ       PHE  62   8.505 -14.366  -4.194
  497    H    TYR  63           H        TYR  63   6.745 -10.871   0.813
  498    HA   TYR  63           HA       TYR  63   4.483  -8.994   0.886
  499   1HB   TYR  63          1HB       TYR  63   5.152  -7.951   3.028
  500   2HB   TYR  63          2HB       TYR  63   4.671  -9.638   3.197
  501    HD1  TYR  63           HD1      TYR  63   6.255 -11.450   3.649
  502    HD2  TYR  63           HD2      TYR  63   7.280  -7.286   3.779
  503    HE1  TYR  63           HE1      TYR  63   7.921 -11.949   5.322
  504    HE2  TYR  63           HE2      TYR  63   9.201  -7.814   5.244
  505    HH   TYR  63           HH       TYR  63  10.356  -9.477   6.376
  506    H    LEU  64           H        LEU  64   5.303  -6.789   1.306
  507    HA   LEU  64           HA       LEU  64   7.932  -5.947   0.870
  508   1HB   LEU  64          1HB       LEU  64   7.912  -5.049  -1.362
  509   2HB   LEU  64          2HB       LEU  64   7.733  -6.784  -1.437
  510    HG   LEU  64           HG       LEU  64   5.618  -4.679  -1.903
  511   1HD1  LEU  64          1HD1      LEU  64   6.704  -6.828  -3.781
  512   2HD1  LEU  64          2HD1      LEU  64   5.490  -5.617  -4.185
  513   3HD1  LEU  64          3HD1      LEU  64   7.146  -5.101  -3.839
  514   1HD2  LEU  64          1HD2      LEU  64   5.359  -7.707  -1.786
  515   2HD2  LEU  64          2HD2      LEU  64   4.387  -6.475  -0.921
  516   3HD2  LEU  64          3HD2      LEU  64   4.212  -6.707  -2.667
  517    H    LEU  65           H        LEU  65   8.025  -3.606   0.945
  518    HA   LEU  65           HA       LEU  65   5.539  -2.388   1.998
  519   1HB   LEU  65          1HB       LEU  65   8.056  -2.691   3.078
  520   2HB   LEU  65          2HB       LEU  65   8.215  -1.099   2.348
  521    HG   LEU  65           HG       LEU  65   5.962  -1.954   4.202
  522   1HD1  LEU  65          1HD1      LEU  65   8.555  -0.469   4.794
  523   2HD1  LEU  65          2HD1      LEU  65   7.211  -0.659   5.943
  524   3HD1  LEU  65          3HD1      LEU  65   8.106  -2.090   5.376
  525   1HD2  LEU  65          1HD2      LEU  65   5.599   0.114   2.714
  526   2HD2  LEU  65          2HD2      LEU  65   5.429   0.326   4.461
  527   3HD2  LEU  65          3HD2      LEU  65   6.907   0.871   3.648
  528    H    TYR  66           H        TYR  66   4.692  -0.618   0.912
  529    HA   TYR  66           HA       TYR  66   6.152   0.371  -1.493
  530   1HB   TYR  66          1HB       TYR  66   3.167   0.022  -1.628
  531   2HB   TYR  66          2HB       TYR  66   4.366  -0.061  -2.893
  532    HD1  TYR  66           HD1      TYR  66   3.287  -1.969   0.221
  533    HD2  TYR  66           HD2      TYR  66   4.537  -2.225  -3.914
  534    HE1  TYR  66           HE1      TYR  66   2.572  -4.293   0.134
  535    HE2  TYR  66           HE2      TYR  66   3.422  -4.427  -4.066
  536    HH   TYR  66           HH       TYR  66   1.955  -5.881  -3.017
  537    H    TYR  67           H        TYR  67   6.738   2.194  -0.438
  538    HA   TYR  67           HA       TYR  67   4.610   3.882   0.766
  539   1HB   TYR  67          1HB       TYR  67   6.341   4.593   2.268
  540   2HB   TYR  67          2HB       TYR  67   5.811   2.928   2.343
  541    HD1  TYR  67           HD1      TYR  67   7.368   1.105   1.261
  542    HD2  TYR  67           HD2      TYR  67   8.610   5.138   2.068
  543    HE1  TYR  67           HE1      TYR  67   9.687   0.327   1.518
  544    HE2  TYR  67           HE2      TYR  67  10.931   4.353   2.433
  545    HH   TYR  67           HH       TYR  67  11.866   0.913   2.036
  546    H    THR  68           H        THR  68   4.683   5.983   0.577
  547    HA   THR  68           HA       THR  68   6.595   7.307  -1.353
  548    HB   THR  68           HB       THR  68   4.482   6.703  -2.353
  549    HG1  THR  68           HG1      THR  68   5.600   8.452  -3.148
  550   1HG2  THR  68          1HG2      THR  68   3.250   8.805  -0.502
  551   2HG2  THR  68          2HG2      THR  68   2.445   7.919  -1.805
  552   3HG2  THR  68          3HG2      THR  68   3.000   7.052  -0.353
  553    H    GLU  69           H        GLU  69   6.633   9.717  -1.175
  554    HA   GLU  69           HA       GLU  69   6.518  10.665   1.619
  555   1HB   GLU  69          1HB       GLU  69   7.657  12.722   0.351
  556   2HB   GLU  69          2HB       GLU  69   8.524  11.343   0.996
  557   1HG   GLU  69          1HG       GLU  69   9.361  11.930  -1.193
  558   2HG   GLU  69          2HG       GLU  69   8.718  10.293  -1.175
  559    H    PHE  70           H        PHE  70   4.163  10.648   1.645
  560    HA   PHE  70           HA       PHE  70   2.699  12.110  -0.332
  561   1HB   PHE  70          1HB       PHE  70   0.777  11.467   0.712
  562   2HB   PHE  70          2HB       PHE  70   1.856  10.131   1.082
  563    HD1  PHE  70           HD1      PHE  70   3.114  10.535   3.411
  564    HD2  PHE  70           HD2      PHE  70  -0.586  12.418   2.342
  565    HE1  PHE  70           HE1      PHE  70   2.490  10.686   5.843
  566    HE2  PHE  70           HE2      PHE  70  -0.940  13.010   4.725
  567    HZ   PHE  70           HZ       PHE  70   0.517  12.021   6.485
  568    H    THR  71           H        THR  71   2.036  14.120  -0.374
  569    HA   THR  71           HA       THR  71   2.313  15.935   1.972
  570    HB   THR  71           HB       THR  71   2.016  16.716  -0.902
  571    HG1  THR  71           HG1      THR  71   4.296  16.092   0.620
  572   1HG2  THR  71          1HG2      THR  71   3.065  18.173   1.567
  573   2HG2  THR  71          2HG2      THR  71   2.906  18.838  -0.068
  574   3HG2  THR  71          3HG2      THR  71   1.459  18.423   0.868
  575    HA   PRO  72           HA       PRO  72  -2.288  15.469   1.502
  576   1HB   PRO  72          1HB       PRO  72  -3.077  16.044   4.020
  577   2HB   PRO  72          2HB       PRO  72  -2.277  14.509   3.599
  578   1HG   PRO  72          1HG       PRO  72  -1.014  16.983   4.793
  579   2HG   PRO  72          2HG       PRO  72  -0.818  15.308   5.353
  580   1HD   PRO  72          1HD       PRO  72   0.958  16.607   3.705
  581   2HD   PRO  72          2HD       PRO  72   0.708  14.844   3.610
  582    H    THR  73           H        THR  73  -1.938  17.335   0.013
  583    HA   THR  73           HA       THR  73  -2.010  20.044   1.028
  584    HB   THR  73           HB       THR  73  -2.483  20.635  -1.328
  585    HG1  THR  73           HG1      THR  73  -3.535  18.707  -1.948
  586   1HG2  THR  73          1HG2      THR  73  -0.139  18.721  -0.932
  587   2HG2  THR  73          2HG2      THR  73  -0.277  19.967  -2.186
  588   3HG2  THR  73          3HG2      THR  73  -0.155  20.444  -0.482
  589    H    GLU  74           H        GLU  74  -3.659  20.191   2.422
  590    HA   GLU  74           HA       GLU  74  -5.701  20.432   3.295
  591   1HB   GLU  74          1HB       GLU  74  -6.381  21.440   0.498
  592   2HB   GLU  74          2HB       GLU  74  -7.367  21.621   1.965
  593   1HG   GLU  74          1HG       GLU  74  -5.521  22.898   3.027
  594   2HG   GLU  74          2HG       GLU  74  -4.613  22.794   1.506
  595    H    LYS  75           H        LYS  75  -7.231  19.672   0.205
  596    HA   LYS  75           HA       LYS  75  -8.919  17.699   1.574
  597   1HB   LYS  75          1HB       LYS  75  -9.030  19.173  -1.077
  598   2HB   LYS  75          2HB       LYS  75 -10.117  17.835  -0.706
  599   1HG   LYS  75          1HG       LYS  75 -11.189  19.966  -0.277
  600   2HG   LYS  75          2HG       LYS  75 -11.068  18.994   1.197
  601   1HD   LYS  75          1HD       LYS  75  -9.256  20.341   2.032
  602   2HD   LYS  75          2HD       LYS  75  -9.098  21.195   0.466
  603   1HE   LYS  75          1HE       LYS  75 -11.315  22.218   0.823
  604   2HE   LYS  75          2HE       LYS  75 -11.475  21.350   2.364
  605   1HZ   LYS  75          1HZ       LYS  75  -9.350  23.309   1.748
  606   2HZ   LYS  75          2HZ       LYS  75 -10.700  23.603   2.650
  607   3HZ   LYS  75          3HZ       LYS  75  -9.571  22.525   3.170
  608    H    ASP  76           H        ASP  76  -6.058  17.587  -0.365
  609    HA   ASP  76           HA       ASP  76  -6.606  15.290  -1.953
  610   1HB   ASP  76          1HB       ASP  76  -4.034  16.493  -0.897
  611   2HB   ASP  76          2HB       ASP  76  -4.080  15.030  -1.885
  612    H    GLU  77           H        GLU  77  -7.468  13.552  -1.038
  613    HA   GLU  77           HA       GLU  77  -6.431  12.423   1.500
  614   1HB   GLU  77          1HB       GLU  77  -8.819  12.968   1.308
  615   2HB   GLU  77          2HB       GLU  77  -8.966  11.914  -0.108
  616   1HG   GLU  77          1HG       GLU  77  -8.399   9.949   1.274
  617   2HG   GLU  77          2HG       GLU  77  -8.104  10.997   2.672
  618    H    TYR  78           H        TYR  78  -5.031  10.769   1.335
  619    HA   TYR  78           HA       TYR  78  -4.520   9.526  -1.263
  620   1HB   TYR  78          1HB       TYR  78  -3.007   9.582   1.335
  621   2HB   TYR  78          2HB       TYR  78  -2.576   8.546  -0.015
  622    HD1  TYR  78           HD1      TYR  78  -3.489  12.216   0.434
  623    HD2  TYR  78           HD2      TYR  78  -0.688   9.322  -1.118
  624    HE1  TYR  78           HE1      TYR  78  -2.266  14.012  -0.709
  625    HE2  TYR  78           HE2      TYR  78   0.661  11.159  -2.058
  626    HH   TYR  78           HH       TYR  78   0.798  13.412  -2.488
  627    H    ALA  79           H        ALA  79  -4.229   7.278  -1.534
  628    HA   ALA  79           HA       ALA  79  -5.386   5.410   0.413
  629   1HB   ALA  79          1HB       ALA  79  -7.328   6.178  -0.969
  630   2HB   ALA  79          2HB       ALA  79  -6.458   5.660  -2.431
  631   3HB   ALA  79          3HB       ALA  79  -6.943   4.464  -1.222
  632    H    CYS  80           H        CYS  80  -5.110   3.187  -0.337
  633    HA   CYS  80           HA       CYS  80  -2.633   2.747  -1.967
  634   1HB   CYS  80          1HB       CYS  80  -3.772   1.241   0.428
  635   2HB   CYS  80          2HB       CYS  80  -2.399   0.701  -0.538
  636    H    ARG  81           H        ARG  81  -3.280   1.883  -3.950
  637    HA   ARG  81           HA       ARG  81  -5.653   0.267  -4.320
  638   1HB   ARG  81          1HB       ARG  81  -4.422   1.416  -6.177
  639   2HB   ARG  81          2HB       ARG  81  -3.046   0.351  -5.857
  640   1HG   ARG  81          1HG       ARG  81  -4.572  -1.632  -6.366
  641   2HG   ARG  81          2HG       ARG  81  -5.778  -0.452  -6.910
  642   1HD   ARG  81          1HD       ARG  81  -4.124   0.411  -8.574
  643   2HD   ARG  81          2HD       ARG  81  -2.951  -0.778  -7.958
  644    HE   ARG  81           HE       ARG  81  -5.466  -1.953  -8.832
  645   1HH1  ARG  81          1HH2      ARG  81  -2.290  -0.834 -10.010
  646   2HH1  ARG  81          2HH2      ARG  81  -2.164  -2.108 -11.202
  647   1HH2  ARG  81          1HH1      ARG  81  -5.296  -3.564 -10.459
  648   2HH2  ARG  81          2HH1      ARG  81  -3.841  -3.682 -11.419
  649    H    VAL  82           H        VAL  82  -5.784  -2.057  -3.879
  650    HA   VAL  82           HA       VAL  82  -3.206  -3.499  -3.529
  651    HB   VAL  82           HB       VAL  82  -5.713  -3.867  -1.840
  652   1HG1  VAL  82          1HG1      VAL  82  -4.540  -5.981  -2.354
  653   2HG1  VAL  82          2HG1      VAL  82  -3.006  -5.259  -1.819
  654   3HG1  VAL  82          3HG1      VAL  82  -4.328  -5.527  -0.657
  655   1HG2  VAL  82          1HG2      VAL  82  -4.464  -1.875  -1.096
  656   2HG2  VAL  82          2HG2      VAL  82  -4.227  -3.199   0.045
  657   3HG2  VAL  82          3HG2      VAL  82  -2.945  -2.799  -1.113
  658    H    ASN  83           H        ASN  83  -3.075  -4.657  -5.343
  659    HA   ASN  83           HA       ASN  83  -5.425  -6.281  -6.187
  660   1HB   ASN  83          1HB       ASN  83  -5.379  -4.144  -7.459
  661   2HB   ASN  83          2HB       ASN  83  -3.780  -4.547  -8.057
  662   1HD2  ASN  83          2HD2      ASN  83  -3.544  -6.306  -9.582
  663   2HD2  ASN  83          1HD2      ASN  83  -4.928  -6.942 -10.445
  664    H    HIS  84           H        HIS  84  -4.227  -7.945  -5.116
  665    HA   HIS  84           HA       HIS  84  -1.661  -8.966  -6.064
  666   1HB   HIS  84          1HB       HIS  84  -2.772  -9.362  -3.812
  667   2HB   HIS  84          2HB       HIS  84  -3.998 -10.297  -4.662
  668    HD2  HIS  84           HD2      HIS  84  -0.147 -10.835  -5.412
  669    HE1  HIS  84           HE1      HIS  84  -1.800 -14.258  -3.526
  670    HE2  HIS  84           HE2      HIS  84   0.253 -13.344  -4.779
  671    H    VAL  85           H        VAL  85  -1.564 -10.871  -7.587
  672    HA   VAL  85           HA       VAL  85  -3.642 -10.934  -9.612
  673    HB   VAL  85           HB       VAL  85  -1.206 -11.136 -10.031
  674   1HG1  VAL  85          1HG1      VAL  85  -0.894 -12.924  -8.141
  675   2HG1  VAL  85          2HG1      VAL  85  -1.362 -14.097  -9.391
  676   3HG1  VAL  85          3HG1      VAL  85   0.032 -13.079  -9.649
  677   1HG2  VAL  85          1HG2      VAL  85  -2.850 -11.693 -11.749
  678   2HG2  VAL  85          2HG2      VAL  85  -1.419 -12.730 -11.865
  679   3HG2  VAL  85          3HG2      VAL  85  -2.922 -13.372 -11.175
  680    H    THR  86           H        THR  86  -5.201 -11.434  -7.729
  681    HA   THR  86           HA       THR  86  -5.969 -14.193  -7.524
  682    HB   THR  86           HB       THR  86  -3.970 -13.033  -5.731
  683    HG1  THR  86           HG1      THR  86  -3.718 -14.891  -7.035
  684   1HG2  THR  86          1HG2      THR  86  -6.280 -14.567  -4.522
  685   2HG2  THR  86          2HG2      THR  86  -4.681 -14.415  -3.756
  686   3HG2  THR  86          3HG2      THR  86  -5.662 -12.968  -4.035
  687    H    LEU  87           H        LEU  87  -5.880 -10.890  -6.081
  688    HA   LEU  87           HA       LEU  87  -8.589 -10.859  -5.079
  689   1HB   LEU  87          1HB       LEU  87  -6.436  -8.859  -5.721
  690   2HB   LEU  87          2HB       LEU  87  -8.093  -8.294  -5.826
  691    HG   LEU  87           HG       LEU  87  -8.592  -8.921  -3.550
  692   1HD1  LEU  87          1HD1      LEU  87  -5.683  -9.796  -3.345
  693   2HD1  LEU  87          2HD1      LEU  87  -6.832  -9.646  -2.003
  694   3HD1  LEU  87          3HD1      LEU  87  -7.089 -10.877  -3.250
  695   1HD2  LEU  87          1HD2      LEU  87  -7.667  -6.695  -4.021
  696   2HD2  LEU  87          2HD2      LEU  87  -7.105  -7.261  -2.439
  697   3HD2  LEU  87          3HD2      LEU  87  -6.014  -7.320  -3.837
  698    H    SER  88           H        SER  88 -10.431 -10.792  -6.201
  699    HA   SER  88           HA       SER  88 -10.454 -10.878  -9.090
  700   1HB   SER  88          1HB       SER  88 -12.015 -12.149  -7.609
  701   2HB   SER  88          2HB       SER  88 -12.770 -10.612  -7.133
  702    HG   SER  88           HG       SER  88 -13.082 -10.302  -9.470
  703    H    GLN  89           H        GLN  89 -10.286  -8.227  -6.889
  704    HA   GLN  89           HA       GLN  89 -10.912  -6.348  -9.007
  705   1HB   GLN  89          1HB       GLN  89 -12.452  -5.063  -7.529
  706   2HB   GLN  89          2HB       GLN  89 -13.116  -6.606  -8.086
  707   1HG   GLN  89          1HG       GLN  89 -12.581  -7.627  -5.886
  708   2HG   GLN  89          2HG       GLN  89 -11.871  -6.096  -5.345
  709   1HE2  GLN  89          2HE2      GLN  89 -14.948  -7.409  -6.719
  710   2HE2  GLN  89          1HE2      GLN  89 -15.991  -6.389  -5.750
  711    HA   PRO  90           HA       PRO  90  -7.563  -4.402  -6.775
  712   1HB   PRO  90          1HB       PRO  90  -7.646  -1.846  -7.730
  713   2HB   PRO  90          2HB       PRO  90  -7.183  -3.233  -8.752
  714   1HG   PRO  90          1HG       PRO  90  -9.906  -1.932  -8.584
  715   2HG   PRO  90          2HG       PRO  90  -8.963  -2.329 -10.048
  716   1HD   PRO  90          1HD       PRO  90 -10.913  -3.977  -9.090
  717   2HD   PRO  90          2HD       PRO  90  -9.421  -4.639  -9.822
  718    H    LYS  91           H        LYS  91  -8.041  -4.384  -4.635
  719    HA   LYS  91           HA       LYS  91 -10.323  -2.969  -3.505
  720   1HB   LYS  91          1HB       LYS  91  -9.543  -5.166  -2.713
  721   2HB   LYS  91          2HB       LYS  91  -8.001  -4.456  -2.214
  722   1HG   LYS  91          1HG       LYS  91  -9.349  -2.881  -0.703
  723   2HG   LYS  91          2HG       LYS  91 -10.775  -3.850  -1.095
  724   1HD   LYS  91          1HD       LYS  91  -8.199  -4.848   0.220
  725   2HD   LYS  91          2HD       LYS  91  -9.720  -4.486   1.053
  726   1HE   LYS  91          1HE       LYS  91 -10.854  -6.261  -0.327
  727   2HE   LYS  91          2HE       LYS  91  -9.274  -6.690  -1.015
  728   1HZ   LYS  91          1HZ       LYS  91  -8.512  -7.197   1.179
  729   2HZ   LYS  91          2HZ       LYS  91  -9.976  -6.800   1.827
  730   3HZ   LYS  91          3HZ       LYS  91  -9.848  -8.087   0.806
  731    H    ILE  92           H        ILE  92 -10.091  -0.730  -3.656
  732    HA   ILE  92           HA       ILE  92  -7.507   0.508  -3.185
  733    HB   ILE  92           HB       ILE  92 -10.140   1.950  -3.533
  734   1HG1  ILE  92          1HG1      ILE  92 -10.098   0.455  -5.415
  735   2HG1  ILE  92          2HG1      ILE  92  -9.686   2.082  -5.930
  736   1HG2  ILE  92          1HG2      ILE  92  -8.244   3.284  -2.800
  737   2HG2  ILE  92          2HG2      ILE  92  -7.203   2.610  -4.064
  738   3HG2  ILE  92          3HG2      ILE  92  -8.574   3.651  -4.506
  739   1HD1  ILE  92          1HD1      ILE  92  -7.277   1.461  -6.012
  740   2HD1  ILE  92          2HD1      ILE  92  -7.705  -0.193  -5.507
  741   3HD1  ILE  92          3HD1      ILE  92  -8.281   0.446  -7.055
  742    H    VAL  93           H        VAL  93  -7.006  -0.072  -1.063
  743    HA   VAL  93           HA       VAL  93  -8.772   0.398   1.183
  744    HB   VAL  93           HB       VAL  93  -5.775  -0.145   1.070
  745   1HG1  VAL  93          1HG1      VAL  93  -7.762  -0.337   3.383
  746   2HG1  VAL  93          2HG1      VAL  93  -6.067  -0.863   3.427
  747   3HG1  VAL  93          3HG1      VAL  93  -6.451   0.852   3.242
  748   1HG2  VAL  93          1HG2      VAL  93  -8.126  -2.038   1.507
  749   2HG2  VAL  93          2HG2      VAL  93  -7.079  -1.993   0.070
  750   3HG2  VAL  93          3HG2      VAL  93  -6.404  -2.456   1.630
  751    H    LYS  94           H        LYS  94  -9.379   2.502   1.461
  752    HA   LYS  94           HA       LYS  94  -7.710   4.767   0.959
  753   1HB   LYS  94          1HB       LYS  94 -10.162   4.791   0.906
  754   2HB   LYS  94          2HB       LYS  94 -10.221   4.505   2.653
  755   1HG   LYS  94          1HG       LYS  94  -9.153   6.608   3.133
  756   2HG   LYS  94          2HG       LYS  94  -8.817   6.933   1.428
  757   1HD   LYS  94          1HD       LYS  94 -11.685   6.522   2.348
  758   2HD   LYS  94          2HD       LYS  94 -10.856   8.032   2.718
  759   1HE   LYS  94          1HE       LYS  94 -12.098   8.346   0.691
  760   2HE   LYS  94          2HE       LYS  94 -10.368   8.409   0.319
  761   1HZ   LYS  94          1HZ       LYS  94 -12.090   6.073  -0.092
  762   2HZ   LYS  94          2HZ       LYS  94 -11.640   7.146  -1.261
  763   3HZ   LYS  94          3HZ       LYS  94 -10.502   6.214  -0.522
  764    H    TRP  95           H        TRP  95  -6.431   5.960   2.270
  765    HA   TRP  95           HA       TRP  95  -5.698   4.890   4.940
  766   1HB   TRP  95          1HB       TRP  95  -3.847   5.421   3.463
  767   2HB   TRP  95          2HB       TRP  95  -4.524   6.999   3.116
  768    HD1  TRP  95           HD1      TRP  95  -3.450   5.169   6.368
  769    HE1  TRP  95           HE1      TRP  95  -2.104   6.828   7.816
  770    HE3  TRP  95           HE3      TRP  95  -3.626   9.229   3.309
  771    HZ2  TRP  95           HZ2      TRP  95  -1.572   9.702   7.802
  772    HZ3  TRP  95           HZ3      TRP  95  -2.752  11.423   4.051
  773    HH2  TRP  95           HH2      TRP  95  -1.933  11.695   6.375
  774    H    ASP  96           H        ASP  96  -6.925   5.627   6.575
  775    HA   ASP  96           HA       ASP  96  -8.510   8.105   6.239
  776   1HB   ASP  96          1HB       ASP  96  -9.539   5.841   6.743
  777   2HB   ASP  96          2HB       ASP  96  -8.673   5.891   8.291
  778    H    ARG  97           H        ARG  97  -5.725   8.280   6.832
  779    HA   ARG  97           HA       ARG  97  -4.204   9.293   8.172
  780   1HB   ARG  97          1HB       ARG  97  -5.707  11.166   7.673
  781   2HB   ARG  97          2HB       ARG  97  -6.537  10.909   9.218
  782   1HG   ARG  97          1HG       ARG  97  -4.425  11.292  10.439
  783   2HG   ARG  97          2HG       ARG  97  -3.535  11.449   8.919
  784   1HD   ARG  97          1HD       ARG  97  -5.821  13.283   9.755
  785   2HD   ARG  97          2HD       ARG  97  -4.108  13.591  10.086
  786    HE   ARG  97           HE       ARG  97  -4.731  13.050   7.275
  787   1HH1  ARG  97          1HH2      ARG  97  -4.370  15.633   9.715
  788   2HH1  ARG  97          2HH2      ARG  97  -4.132  16.873   8.502
  789   1HH2  ARG  97          1HH1      ARG  97  -4.432  14.729   5.742
  790   2HH2  ARG  97          2HH1      ARG  97  -4.164  16.370   6.292
  791    H    ASP  98           H        ASP  98  -3.680   7.327   9.250
  792    HA   ASP  98           HA       ASP  98  -4.674   6.500  11.741
  793   1HB   ASP  98          1HB       ASP  98  -1.793   6.413  10.729
  794   2HB   ASP  98          2HB       ASP  98  -2.537   5.380  11.947
  795    H    MET  99           H        MET  99  -1.949   8.657  10.905
  796    HA   MET  99           HA       MET  99  -2.686  10.552  12.953
  797   1HB   MET  99          1HB       MET  99  -0.392  10.768  13.875
  798   2HB   MET  99          2HB       MET  99  -1.182   9.253  14.331
  799   1HG   MET  99          1HG       MET  99   0.112   8.024  12.669
  800   2HG   MET  99          2HG       MET  99   0.856   9.529  12.089
  801   1HE   MET  99          1HE       MET  99   2.521   6.962  12.781
  802   2HE   MET  99          2HE       MET  99   3.199   8.504  12.201
  803   3HE   MET  99          3HE       MET  99   3.886   7.712  13.640
  Start of MODEL   11
    1   1H    MET   0          1H        MET   0 -10.081 -18.452  -2.661
    2   2H    MET   0          2H        MET   0  -8.518 -18.174  -2.215
    3   3H    MET   0          3H        MET   0  -8.850 -18.736  -3.725
    4    HA   MET   0           HA       MET   0  -9.305 -20.185  -1.232
    5   1HB   MET   0          1HB       MET   0  -9.565 -21.172  -4.102
    6   2HB   MET   0          2HB       MET   0  -9.873 -22.099  -2.626
    7   1HG   MET   0          1HG       MET   0 -11.756 -20.553  -2.083
    8   2HG   MET   0          2HG       MET   0 -11.467 -19.700  -3.609
    9   1HE   MET   0          1HE       MET   0 -14.298 -20.546  -3.045
   10   2HE   MET   0          2HE       MET   0 -13.805 -19.918  -4.636
   11   3HE   MET   0          3HE       MET   0 -14.778 -21.402  -4.528
   12    H    ILE   1           H        ILE   1  -7.567 -21.358  -0.532
   13    HA   ILE   1           HA       ILE   1  -5.564 -22.270  -0.319
   14    HB   ILE   1           HB       ILE   1  -5.515 -22.419  -3.337
   15   1HG1  ILE   1          1HG1      ILE   1  -5.714 -24.841  -2.938
   16   2HG1  ILE   1          2HG1      ILE   1  -5.848 -24.576  -1.198
   17   1HG2  ILE   1          1HG2      ILE   1  -3.526 -23.529  -1.329
   18   2HG2  ILE   1          2HG2      ILE   1  -3.597 -23.952  -3.051
   19   3HG2  ILE   1          3HG2      ILE   1  -3.194 -22.306  -2.576
   20   1HD1  ILE   1          1HD1      ILE   1  -7.832 -23.534  -3.269
   21   2HD1  ILE   1          2HD1      ILE   1  -7.994 -25.071  -2.402
   22   3HD1  ILE   1          3HD1      ILE   1  -8.046 -23.560  -1.496
   23    H    GLN   2           H        GLN   2  -5.248 -20.040  -2.897
   24    HA   GLN   2           HA       GLN   2  -2.746 -18.818  -2.387
   25   1HB   GLN   2          1HB       GLN   2  -5.347 -17.715  -3.521
   26   2HB   GLN   2          2HB       GLN   2  -3.833 -16.807  -3.553
   27   1HG   GLN   2          1HG       GLN   2  -4.037 -19.568  -4.842
   28   2HG   GLN   2          2HG       GLN   2  -4.547 -18.096  -5.663
   29   1HE2  GLN   2          2HE2      GLN   2  -3.045 -17.142  -6.916
   30   2HE2  GLN   2          1HE2      GLN   2  -1.313 -17.251  -6.688
   31    H    ARG   3           H        ARG   3  -2.043 -17.429  -0.798
   32    HA   ARG   3           HA       ARG   3  -3.903 -16.777   1.350
   33   1HB   ARG   3          1HB       ARG   3  -0.951 -16.247   1.025
   34   2HB   ARG   3          2HB       ARG   3  -1.908 -15.854   2.472
   35   1HG   ARG   3          1HG       ARG   3  -2.568 -18.233   2.713
   36   2HG   ARG   3          2HG       ARG   3  -1.645 -18.638   1.269
   37   1HD   ARG   3          1HD       ARG   3   0.047 -19.098   2.641
   38   2HD   ARG   3          2HD       ARG   3   0.294 -17.364   2.731
   39    HE   ARG   3           HE       ARG   3  -1.368 -19.017   4.634
   40   1HH1  ARG   3          1HH2      ARG   3   0.814 -16.226   4.240
   41   2HH1  ARG   3          2HH2      ARG   3   1.229 -16.178   5.930
   42   1HH2  ARG   3          1HH1      ARG   3  -0.909 -18.830   6.852
   43   2HH2  ARG   3          2HH1      ARG   3   0.160 -17.576   7.425
   44    H    THR   4           H        THR   4  -4.862 -14.880   1.766
   45    HA   THR   4           HA       THR   4  -4.998 -12.936  -0.313
   46    HB   THR   4           HB       THR   4  -6.636 -11.932   1.436
   47    HG1  THR   4           HG1      THR   4  -7.161 -13.395   3.097
   48   1HG2  THR   4          1HG2      THR   4  -7.029 -14.807   0.483
   49   2HG2  THR   4          2HG2      THR   4  -8.312 -13.699   1.010
   50   3HG2  THR   4          3HG2      THR   4  -7.377 -13.337  -0.452
   51    HA   PRO   5           HA       PRO   5  -2.152  -9.941   1.355
   52   1HB   PRO   5          1HB       PRO   5  -3.166  -7.596   0.376
   53   2HB   PRO   5          2HB       PRO   5  -2.415  -8.848  -0.661
   54   1HG   PRO   5          1HG       PRO   5  -5.360  -8.398  -0.111
   55   2HG   PRO   5          2HG       PRO   5  -4.557  -8.617  -1.693
   56   1HD   PRO   5          1HD       PRO   5  -5.777 -10.679  -0.390
   57   2HD   PRO   5          2HD       PRO   5  -4.268 -10.938  -1.313
   58    H    LYS   6           H        LYS   6  -2.011  -9.582   3.476
   59    HA   LYS   6           HA       LYS   6  -4.231  -8.403   5.012
   60   1HB   LYS   6          1HB       LYS   6  -2.745 -10.288   5.876
   61   2HB   LYS   6          2HB       LYS   6  -1.413  -9.119   5.893
   62   1HG   LYS   6          1HG       LYS   6  -3.092  -7.628   7.268
   63   2HG   LYS   6          2HG       LYS   6  -3.963  -9.147   7.521
   64   1HD   LYS   6          1HD       LYS   6  -1.924 -10.152   8.517
   65   2HD   LYS   6          2HD       LYS   6  -1.011  -8.672   8.157
   66   1HE   LYS   6          1HE       LYS   6  -2.562  -7.368   9.616
   67   2HE   LYS   6          2HE       LYS   6  -3.390  -8.875  10.058
   68   1HZ   LYS   6          1HZ       LYS   6  -0.542  -8.310  10.507
   69   2HZ   LYS   6          2HZ       LYS   6  -1.722  -8.178  11.647
   70   3HZ   LYS   6          3HZ       LYS   6  -1.360  -9.652  11.006
   71    H    ILE   7           H        ILE   7  -4.432  -6.225   4.697
   72    HA   ILE   7           HA       ILE   7  -2.128  -4.546   3.939
   73    HB   ILE   7           HB       ILE   7  -5.058  -3.835   4.216
   74   1HG1  ILE   7          1HG1      ILE   7  -4.513  -3.963   1.486
   75   2HG1  ILE   7          2HG1      ILE   7  -3.714  -5.404   2.093
   76   1HG2  ILE   7          1HG2      ILE   7  -3.536  -1.911   4.194
   77   2HG2  ILE   7          2HG2      ILE   7  -2.788  -2.500   2.694
   78   3HG2  ILE   7          3HG2      ILE   7  -4.485  -1.983   2.705
   79   1HD1  ILE   7          1HD1      ILE   7  -5.879  -6.063   3.212
   80   2HD1  ILE   7          2HD1      ILE   7  -6.630  -4.608   2.528
   81   3HD1  ILE   7          3HD1      ILE   7  -6.032  -5.885   1.454
   82    H    GLN   8           H        GLN   8  -1.057  -3.193   5.524
   83    HA   GLN   8           HA       GLN   8  -2.709  -2.170   7.734
   84   1HB   GLN   8          1HB       GLN   8  -0.673  -2.547   9.136
   85   2HB   GLN   8          2HB       GLN   8  -1.717  -3.946   8.866
   86   1HG   GLN   8          1HG       GLN   8   0.836  -3.430   7.295
   87   2HG   GLN   8          2HG       GLN   8   0.816  -4.304   8.829
   88   1HE2  GLN   8          2HE2      GLN   8   1.622  -5.221   6.117
   89   2HE2  GLN   8          1HE2      GLN   8   0.652  -6.652   5.835
   90    H    VAL   9           H        VAL   9  -2.801  -0.182   6.714
   91    HA   VAL   9           HA       VAL   9  -0.370   1.001   5.633
   92    HB   VAL   9           HB       VAL   9  -3.077   2.309   6.056
   93   1HG1  VAL   9          1HG1      VAL   9  -1.260   3.919   5.755
   94   2HG1  VAL   9          2HG1      VAL   9  -0.643   3.034   4.360
   95   3HG1  VAL   9          3HG1      VAL   9  -2.215   3.838   4.271
   96   1HG2  VAL   9          1HG2      VAL   9  -2.032   0.831   3.606
   97   2HG2  VAL   9          2HG2      VAL   9  -3.439   0.409   4.601
   98   3HG2  VAL   9          3HG2      VAL   9  -3.456   1.888   3.636
   99    H    TYR  10           H        TYR  10   1.056   2.155   6.823
  100    HA   TYR  10           HA       TYR  10   0.171   3.323   9.413
  101   1HB   TYR  10          1HB       TYR  10   3.003   3.146   8.418
  102   2HB   TYR  10          2HB       TYR  10   2.421   3.384  10.062
  103    HD1  TYR  10           HD1      TYR  10   0.578   1.323  10.670
  104    HD2  TYR  10           HD2      TYR  10   3.997   1.091   8.061
  105    HE1  TYR  10           HE1      TYR  10   0.652  -1.148  10.971
  106    HE2  TYR  10           HE2      TYR  10   4.113  -1.364   8.418
  107    HH   TYR  10           HH       TYR  10   3.384  -3.111   9.782
  108    H    SER  11           H        SER  11   0.799   5.447   9.862
  109    HA   SER  11           HA       SER  11   1.853   7.099   7.609
  110   1HB   SER  11          1HB       SER  11   0.877   9.106   8.683
  111   2HB   SER  11          2HB       SER  11  -0.245   8.026   7.853
  112    HG   SER  11           HG       SER  11   0.261   7.920  10.638
  113    H    ARG  12           H        ARG  12   4.011   7.057   8.176
  114    HA   ARG  12           HA       ARG  12   5.065   6.663  10.802
  115   1HB   ARG  12          1HB       ARG  12   6.165   7.813   8.222
  116   2HB   ARG  12          2HB       ARG  12   7.125   7.818   9.704
  117   1HG   ARG  12          1HG       ARG  12   7.162   5.446   9.848
  118   2HG   ARG  12          2HG       ARG  12   5.913   5.262   8.603
  119   1HD   ARG  12          1HD       ARG  12   8.235   4.796   7.758
  120   2HD   ARG  12          2HD       ARG  12   7.369   6.075   6.885
  121    HE   ARG  12           HE       ARG  12   9.010   7.126   9.015
  122   1HH1  ARG  12          1HH2      ARG  12   9.103   6.006   5.639
  123   2HH1  ARG  12          2HH2      ARG  12  10.398   7.083   5.190
  124   1HH2  ARG  12          1HH1      ARG  12  10.731   8.512   8.405
  125   2HH2  ARG  12          2HH1      ARG  12  11.336   8.490   6.767
  126    H    HIS  13           H        HIS  13   4.948   9.648   8.800
  127    HA   HIS  13           HA       HIS  13   5.391  11.297  11.192
  128   1HB   HIS  13          1HB       HIS  13   5.040  12.085   8.290
  129   2HB   HIS  13          2HB       HIS  13   5.472  13.147   9.642
  130    HD2  HIS  13           HD2      HIS  13   7.689  13.408   7.584
  131    HE1  HIS  13           HE1      HIS  13   9.755  10.223   9.448
  132    HE2  HIS  13           HE2      HIS  13   9.992  12.202   7.847
  133    HA   PRO  14           HA       PRO  14   1.002  11.868  11.603
  134   1HB   PRO  14          1HB       PRO  14   0.834  14.087  13.167
  135   2HB   PRO  14          2HB       PRO  14   1.539  12.554  13.754
  136   1HG   PRO  14          1HG       PRO  14   3.012  14.982  12.708
  137   2HG   PRO  14          2HG       PRO  14   3.358  14.039  14.184
  138   1HD   PRO  14          1HD       PRO  14   4.661  13.663  11.778
  139   2HD   PRO  14          2HD       PRO  14   4.407  12.329  12.926
  140    H    ALA  15           H        ALA  15  -0.452  12.636  10.143
  141    HA   ALA  15           HA       ALA  15   0.270  14.103   7.944
  142   1HB   ALA  15          1HB       ALA  15  -1.730  12.649   8.194
  143   2HB   ALA  15          2HB       ALA  15  -2.543  13.966   9.077
  144   3HB   ALA  15          3HB       ALA  15  -2.086  14.185   7.381
  145    H    GLU  16           H        GLU  16   0.327  16.167   7.345
  146    HA   GLU  16           HA       GLU  16  -0.680  18.359   9.062
  147   1HB   GLU  16          1HB       GLU  16   1.583  17.684   9.909
  148   2HB   GLU  16          2HB       GLU  16   2.254  18.034   8.306
  149   1HG   GLU  16          1HG       GLU  16   1.571  20.407   8.539
  150   2HG   GLU  16          2HG       GLU  16   0.781  20.037  10.079
  151    H    ASN  17           H        ASN  17  -1.593  19.819   7.738
  152    HA   ASN  17           HA       ASN  17  -1.620  19.542   4.944
  153   1HB   ASN  17          1HB       ASN  17  -3.416  20.608   6.211
  154   2HB   ASN  17          2HB       ASN  17  -2.339  21.931   6.682
  155   1HD2  ASN  17          2HD2      ASN  17  -4.159  23.239   5.694
  156   2HD2  ASN  17          1HD2      ASN  17  -4.112  23.512   3.964
  157    H    GLY  18           H        GLY  18  -0.166  20.095   3.420
  158   1HA   GLY  18          1HA       GLY  18   1.258  21.468   2.240
  159   2HA   GLY  18          2HA       GLY  18   1.383  22.574   3.612
  160    H    LYS  19           H        LYS  19   2.219  20.624   5.597
  161    HA   LYS  19           HA       LYS  19   5.047  20.560   4.883
  162   1HB   LYS  19          1HB       LYS  19   4.107  21.394   7.011
  163   2HB   LYS  19          2HB       LYS  19   3.719  19.703   7.400
  164   1HG   LYS  19          1HG       LYS  19   6.542  20.726   6.855
  165   2HG   LYS  19          2HG       LYS  19   5.799  20.666   8.462
  166   1HD   LYS  19          1HD       LYS  19   5.369  18.162   8.025
  167   2HD   LYS  19          2HD       LYS  19   6.509  18.338   6.670
  168   1HE   LYS  19          1HE       LYS  19   8.261  19.103   8.193
  169   2HE   LYS  19          2HE       LYS  19   7.154  18.919   9.570
  170   1HZ   LYS  19          1HZ       LYS  19   6.998  16.620   9.112
  171   2HZ   LYS  19          2HZ       LYS  19   7.905  16.742   7.746
  172   3HZ   LYS  19          3HZ       LYS  19   8.598  17.008   9.224
  173    H    SER  20           H        SER  20   5.835  18.977   3.998
  174    HA   SER  20           HA       SER  20   5.119  16.666   3.027
  175   1HB   SER  20          1HB       SER  20   7.865  17.159   4.096
  176   2HB   SER  20          2HB       SER  20   7.375  16.269   2.646
  177    HG   SER  20           HG       SER  20   8.067  18.335   2.130
  178    H    ASN  21           H        ASN  21   4.304  14.726   3.990
  179    HA   ASN  21           HA       ASN  21   5.365  13.764   6.602
  180   1HB   ASN  21          1HB       ASN  21   2.684  13.382   5.281
  181   2HB   ASN  21          2HB       ASN  21   3.161  12.725   6.858
  182   1HD2  ASN  21          2HD2      ASN  21   4.191  14.611   8.331
  183   2HD2  ASN  21          1HD2      ASN  21   3.156  16.016   8.442
  184    H    PHE  22           H        PHE  22   4.356  11.123   6.447
  185    HA   PHE  22           HA       PHE  22   5.511   9.893   4.018
  186   1HB   PHE  22          1HB       PHE  22   6.840   9.874   6.644
  187   2HB   PHE  22          2HB       PHE  22   6.470   8.257   6.061
  188    HD1  PHE  22           HD1      PHE  22   8.916  10.796   5.885
  189    HD2  PHE  22           HD2      PHE  22   7.048   7.645   3.612
  190    HE1  PHE  22           HE1      PHE  22  10.955  10.586   4.492
  191    HE2  PHE  22           HE2      PHE  22   9.034   7.553   2.122
  192    HZ   PHE  22           HZ       PHE  22  11.011   8.973   2.599
  193    H    LEU  23           H        LEU  23   4.152   8.498   3.279
  194    HA   LEU  23           HA       LEU  23   2.096   7.191   4.984
  195   1HB   LEU  23          1HB       LEU  23   1.243   8.704   3.283
  196   2HB   LEU  23          2HB       LEU  23   2.274   7.963   2.054
  197    HG   LEU  23           HG       LEU  23   0.896   5.858   2.317
  198   1HD1  LEU  23          1HD1      LEU  23  -0.693   7.707   4.152
  199   2HD1  LEU  23          2HD1      LEU  23  -1.284   6.152   3.516
  200   3HD1  LEU  23          3HD1      LEU  23   0.093   6.191   4.627
  201   1HD2  LEU  23          1HD2      LEU  23   0.435   7.551   0.568
  202   2HD2  LEU  23          2HD2      LEU  23  -1.078   6.834   1.162
  203   3HD2  LEU  23          3HD2      LEU  23  -0.585   8.457   1.703
  204    H    ASN  24           H        ASN  24   2.120   4.960   5.088
  205    HA   ASN  24           HA       ASN  24   3.933   3.465   3.248
  206   1HB   ASN  24          1HB       ASN  24   3.785   3.258   6.265
  207   2HB   ASN  24          2HB       ASN  24   4.729   2.228   5.188
  208   1HD2  ASN  24          2HD2      ASN  24   6.877   2.732   5.154
  209   2HD2  ASN  24          1HD2      ASN  24   7.533   4.337   5.383
  210    H    CYS  25           H        CYS  25   2.364   2.405   2.075
  211    HA   CYS  25           HA       CYS  25   0.209   0.976   3.507
  212   1HB   CYS  25          1HB       CYS  25   0.805   1.146   0.548
  213   2HB   CYS  25          2HB       CYS  25  -0.575   0.362   1.293
  214    H    TYR  26           H        TYR  26   1.665  -0.427   4.741
  215    HA   TYR  26           HA       TYR  26   3.362  -2.290   3.311
  216   1HB   TYR  26          1HB       TYR  26   3.835  -1.569   5.637
  217   2HB   TYR  26          2HB       TYR  26   2.313  -2.226   6.163
  218    HD1  TYR  26           HD1      TYR  26   4.753  -3.923   3.820
  219    HD2  TYR  26           HD2      TYR  26   3.104  -3.761   7.799
  220    HE1  TYR  26           HE1      TYR  26   5.698  -6.124   4.301
  221    HE2  TYR  26           HE2      TYR  26   4.050  -5.994   8.279
  222    HH   TYR  26           HH       TYR  26   5.993  -7.796   5.860
  223    H    VAL  27           H        VAL  27   2.770  -4.337   2.552
  224    HA   VAL  27           HA       VAL  27   0.177  -5.445   3.465
  225    HB   VAL  27           HB       VAL  27   1.158  -5.751   0.589
  226   1HG1  VAL  27          1HG1      VAL  27  -0.407  -7.466   1.541
  227   2HG1  VAL  27          2HG1      VAL  27  -1.555  -6.178   1.909
  228   3HG1  VAL  27          3HG1      VAL  27  -1.116  -6.526   0.219
  229   1HG2  VAL  27          1HG2      VAL  27  -0.941  -3.812   1.571
  230   2HG2  VAL  27          2HG2      VAL  27   0.639  -3.360   0.895
  231   3HG2  VAL  27          3HG2      VAL  27  -0.533  -4.206  -0.124
  232    H    SER  28           H        SER  28   0.340  -7.682   3.923
  233    HA   SER  28           HA       SER  28   2.570  -9.205   2.897
  234   1HB   SER  28          1HB       SER  28   3.610  -9.713   5.090
  235   2HB   SER  28          2HB       SER  28   3.708  -8.006   4.736
  236    HG   SER  28           HG       SER  28   3.001  -8.370   6.856
  237    H    GLY  29           H        GLY  29   2.639 -11.377   4.478
  238   1HA   GLY  29          1HA       GLY  29   1.514 -13.228   5.209
  239   2HA   GLY  29          2HA       GLY  29  -0.029 -12.372   5.104
  240    H    PHE  30           H        PHE  30   0.661 -11.621   2.184
  241    HA   PHE  30           HA       PHE  30  -0.773 -13.851   1.077
  242   1HB   PHE  30          1HB       PHE  30  -0.921 -12.518  -0.916
  243   2HB   PHE  30          2HB       PHE  30  -1.303 -11.602   0.506
  244    HD1  PHE  30           HD1      PHE  30   0.084  -9.597   1.143
  245    HD2  PHE  30           HD2      PHE  30   1.157 -12.140  -2.177
  246    HE1  PHE  30           HE1      PHE  30   1.828  -8.002   0.447
  247    HE2  PHE  30           HE2      PHE  30   2.926 -10.556  -2.823
  248    HZ   PHE  30           HZ       PHE  30   3.275  -8.520  -1.490
  249    H    HIS  31           H        HIS  31  -0.037 -14.509  -1.259
  250    HA   HIS  31           HA       HIS  31   2.666 -14.520  -2.089
  251   1HB   HIS  31          1HB       HIS  31   3.454 -16.631  -1.649
  252   2HB   HIS  31          2HB       HIS  31   2.704 -16.243  -0.116
  253    HD2  HIS  31           HD2      HIS  31   1.996 -18.352  -3.294
  254    HE1  HIS  31           HE1      HIS  31  -0.212 -19.962  -0.044
  255    HE2  HIS  31           HE2      HIS  31   0.465 -20.371  -2.471
  256    HA   PRO  32           HA       PRO  32   3.698 -15.712  -3.834
  257   1HB   PRO  32          1HB       PRO  32   4.174 -16.030  -6.446
  258   2HB   PRO  32          2HB       PRO  32   3.316 -17.282  -5.545
  259   1HG   PRO  32          1HG       PRO  32   1.992 -15.060  -7.139
  260   2HG   PRO  32          2HG       PRO  32   1.795 -16.819  -7.371
  261   1HD   PRO  32          1HD       PRO  32   0.111 -15.363  -5.749
  262   2HD   PRO  32          2HD       PRO  32   0.583 -17.045  -5.355
  263    H    SER  33           H        SER  33   4.273 -14.200  -6.623
  264    HA   SER  33           HA       SER  33   4.818 -11.732  -5.208
  265   1HB   SER  33          1HB       SER  33   6.513 -11.507  -6.896
  266   2HB   SER  33          2HB       SER  33   6.505 -13.189  -6.331
  267    HG   SER  33           HG       SER  33   6.584 -13.062  -8.604
  268    H    ASP  34           H        ASP  34   2.499 -12.697  -7.580
  269    HA   ASP  34           HA       ASP  34   2.627 -10.308  -9.196
  270   1HB   ASP  34          1HB       ASP  34   2.155 -12.504 -10.139
  271   2HB   ASP  34          2HB       ASP  34   0.720 -12.675  -9.125
  272    H    ILE  35           H        ILE  35   2.327  -8.894  -7.192
  273    HA   ILE  35           HA       ILE  35  -0.556  -8.197  -7.016
  274    HB   ILE  35           HB       ILE  35   0.200  -9.128  -4.978
  275   1HG1  ILE  35          1HG1      ILE  35  -0.111  -6.117  -4.584
  276   2HG1  ILE  35          2HG1      ILE  35  -1.447  -7.189  -4.964
  277   1HG2  ILE  35          1HG2      ILE  35   2.193  -6.856  -4.852
  278   2HG2  ILE  35          2HG2      ILE  35   1.868  -8.041  -3.576
  279   3HG2  ILE  35          3HG2      ILE  35   2.568  -8.595  -5.097
  280   1HD1  ILE  35          1HD1      ILE  35  -0.802  -8.550  -2.892
  281   2HD1  ILE  35          2HD1      ILE  35   0.253  -7.204  -2.450
  282   3HD1  ILE  35          3HD1      ILE  35  -1.482  -6.928  -2.617
  283    H    GLU  36           H        GLU  36  -1.148  -6.131  -7.069
  284    HA   GLU  36           HA       GLU  36   0.775  -4.124  -8.141
  285   1HB   GLU  36          1HB       GLU  36  -2.179  -4.185  -8.733
  286   2HB   GLU  36          2HB       GLU  36  -0.865  -3.358  -9.558
  287   1HG   GLU  36          1HG       GLU  36   0.030  -5.657 -10.186
  288   2HG   GLU  36          2HG       GLU  36  -1.436  -6.348  -9.508
  289    H    VAL  37           H        VAL  37   0.951  -2.281  -6.927
  290    HA   VAL  37           HA       VAL  37  -1.331  -1.271  -5.351
  291    HB   VAL  37           HB       VAL  37   1.437  -1.789  -4.238
  292   1HG1  VAL  37          1HG1      VAL  37   0.230   0.183  -3.141
  293   2HG1  VAL  37          2HG1      VAL  37  -0.949  -1.004  -2.541
  294   3HG1  VAL  37          3HG1      VAL  37   0.743  -1.146  -2.089
  295   1HG2  VAL  37          1HG2      VAL  37  -1.194  -3.272  -3.871
  296   2HG2  VAL  37          2HG2      VAL  37   0.395  -3.920  -4.346
  297   3HG2  VAL  37          3HG2      VAL  37   0.091  -3.389  -2.683
  298    H    ASP  38           H        ASP  38  -1.308   0.074  -7.270
  299    HA   ASP  38           HA       ASP  38   0.675   2.181  -7.544
  300   1HB   ASP  38          1HB       ASP  38  -2.268   2.079  -8.371
  301   2HB   ASP  38          2HB       ASP  38  -1.086   3.297  -8.846
  302    H    LEU  39           H        LEU  39   0.918   3.816  -6.076
  303    HA   LEU  39           HA       LEU  39  -1.122   4.284  -3.995
  304   1HB   LEU  39          1HB       LEU  39   1.637   5.448  -4.540
  305   2HB   LEU  39          2HB       LEU  39   0.519   6.046  -3.299
  306    HG   LEU  39           HG       LEU  39   0.458   3.380  -2.720
  307   1HD1  LEU  39          1HD1      LEU  39   2.146   2.797  -4.465
  308   2HD1  LEU  39          2HD1      LEU  39   3.306   3.856  -3.643
  309   3HD1  LEU  39          3HD1      LEU  39   2.677   2.416  -2.821
  310   1HD2  LEU  39          1HD2      LEU  39   2.593   5.309  -1.749
  311   2HD2  LEU  39          2HD2      LEU  39   0.919   5.246  -1.151
  312   3HD2  LEU  39          3HD2      LEU  39   1.999   3.867  -0.896
  313    H    LEU  40           H        LEU  40  -2.599   5.903  -4.077
  314    HA   LEU  40           HA       LEU  40  -2.800   7.447  -6.607
  315   1HB   LEU  40          1HB       LEU  40  -3.544   4.906  -6.636
  316   2HB   LEU  40          2HB       LEU  40  -4.920   5.495  -5.725
  317    HG   LEU  40           HG       LEU  40  -5.495   5.306  -8.025
  318   1HD1  LEU  40          1HD1      LEU  40  -5.081   8.294  -7.584
  319   2HD1  LEU  40          2HD1      LEU  40  -6.282   7.507  -8.615
  320   3HD1  LEU  40          3HD1      LEU  40  -6.394   7.334  -6.853
  321   1HD2  LEU  40          1HD2      LEU  40  -3.081   5.488  -8.850
  322   2HD2  LEU  40          2HD2      LEU  40  -4.330   6.238  -9.865
  323   3HD2  LEU  40          3HD2      LEU  40  -3.328   7.250  -8.825
  324    H    LYS  41           H        LYS  41  -3.364   9.505  -5.911
  325    HA   LYS  41           HA       LYS  41  -4.642   9.876  -3.402
  326   1HB   LYS  41          1HB       LYS  41  -3.967  11.756  -5.678
  327   2HB   LYS  41          2HB       LYS  41  -4.299  12.245  -3.994
  328   1HG   LYS  41          1HG       LYS  41  -2.398  11.260  -3.163
  329   2HG   LYS  41          2HG       LYS  41  -2.055  10.285  -4.596
  330   1HD   LYS  41          1HD       LYS  41  -0.596  12.152  -4.450
  331   2HD   LYS  41          2HD       LYS  41  -1.528  12.189  -5.939
  332   1HE   LYS  41          1HE       LYS  41  -3.015  13.857  -5.164
  333   2HE   LYS  41          2HE       LYS  41  -2.459  13.691  -3.482
  334   1HZ   LYS  41          1HZ       LYS  41  -0.400  14.677  -4.116
  335   2HZ   LYS  41          2HZ       LYS  41  -0.850  14.750  -5.705
  336   3HZ   LYS  41          3HZ       LYS  41  -1.650  15.659  -4.575
  337    H    ASN  42           H        ASN  42  -6.053  12.296  -4.766
  338    HA   ASN  42           HA       ASN  42  -8.738  11.274  -4.819
  339   1HB   ASN  42          1HB       ASN  42  -9.363  13.516  -5.332
  340   2HB   ASN  42          2HB       ASN  42  -8.018  13.649  -4.198
  341   1HD2  ASN  42          2HD2      ASN  42  -5.736  13.914  -5.335
  342   2HD2  ASN  42          1HD2      ASN  42  -5.718  14.899  -6.778
  343    H    GLY  43           H        GLY  43  -6.302  12.074  -7.298
  344   1HA   GLY  43          1HA       GLY  43  -7.201  10.041  -9.054
  345   2HA   GLY  43          2HA       GLY  43  -7.827  11.602  -9.631
  346    H    GLU  44           H        GLU  44  -4.760  10.937  -7.916
  347    HA   GLU  44           HA       GLU  44  -3.156  11.463 -10.372
  348   1HB   GLU  44          1HB       GLU  44  -3.376  13.580  -9.171
  349   2HB   GLU  44          2HB       GLU  44  -2.900  12.814  -7.655
  350   1HG   GLU  44          1HG       GLU  44  -0.650  12.302  -8.651
  351   2HG   GLU  44          2HG       GLU  44  -1.163  13.096 -10.148
  352    H    ARG  45           H        ARG  45  -1.722   9.835 -10.622
  353    HA   ARG  45           HA       ARG  45  -1.315   7.903  -8.463
  354   1HB   ARG  45          1HB       ARG  45  -1.741   7.208 -10.828
  355   2HB   ARG  45          2HB       ARG  45  -0.167   7.893 -11.276
  356   1HG   ARG  45          1HG       ARG  45   0.972   6.368  -9.701
  357   2HG   ARG  45          2HG       ARG  45  -0.583   5.723  -9.154
  358   1HD   ARG  45          1HD       ARG  45   0.486   5.542 -11.999
  359   2HD   ARG  45          2HD       ARG  45   0.643   4.276 -10.761
  360    HE   ARG  45           HE       ARG  45  -2.099   4.985 -11.004
  361   1HH1  ARG  45          1HH2      ARG  45   0.450   3.220 -12.738
  362   2HH1  ARG  45          2HH2      ARG  45  -0.672   2.240 -13.647
  363   1HH2  ARG  45          1HH1      ARG  45  -3.558   3.659 -12.182
  364   2HH2  ARG  45          2HH1      ARG  45  -2.951   2.480 -13.317
  365    H    ILE  46           H        ILE  46   0.466   7.598  -7.242
  366    HA   ILE  46           HA       ILE  46   2.591   9.596  -7.291
  367    HB   ILE  46           HB       ILE  46   1.582   7.455  -5.396
  368   1HG1  ILE  46          1HG1      ILE  46   1.404  10.499  -5.375
  369   2HG1  ILE  46          2HG1      ILE  46   0.068   9.381  -5.687
  370   1HG2  ILE  46          1HG2      ILE  46   4.042   7.825  -5.213
  371   2HG2  ILE  46          2HG2      ILE  46   3.710   9.559  -4.956
  372   3HG2  ILE  46          3HG2      ILE  46   3.120   8.326  -3.796
  373   1HD1  ILE  46          1HD1      ILE  46   0.350   8.439  -3.367
  374   2HD1  ILE  46          2HD1      ILE  46   1.510   9.759  -3.046
  375   3HD1  ILE  46          3HD1      ILE  46  -0.160  10.110  -3.500
  376    H    GLU  47           H        GLU  47   3.979   8.980  -8.912
  377    HA   GLU  47           HA       GLU  47   4.739   6.188  -9.356
  378   1HB   GLU  47          1HB       GLU  47   5.721   8.800 -10.563
  379   2HB   GLU  47          2HB       GLU  47   6.213   7.174 -11.079
  380   1HG   GLU  47          1HG       GLU  47   3.837   6.616 -11.577
  381   2HG   GLU  47          2HG       GLU  47   3.361   8.273 -11.175
  382    H    LYS  48           H        LYS  48   5.989   8.990  -7.578
  383    HA   LYS  48           HA       LYS  48   8.643   7.842  -7.169
  384   1HB   LYS  48          1HB       LYS  48   7.247  10.233  -5.906
  385   2HB   LYS  48          2HB       LYS  48   8.946   9.770  -5.677
  386   1HG   LYS  48          1HG       LYS  48   9.307   9.960  -8.138
  387   2HG   LYS  48          2HG       LYS  48   7.638  10.541  -8.323
  388   1HD   LYS  48          1HD       LYS  48   8.131  12.413  -6.752
  389   2HD   LYS  48          2HD       LYS  48   9.819  11.884  -6.659
  390   1HE   LYS  48          1HE       LYS  48   8.361  12.773  -9.198
  391   2HE   LYS  48          2HE       LYS  48   9.487  13.764  -8.253
  392   1HZ   LYS  48          1HZ       LYS  48  11.198  12.159  -8.726
  393   2HZ   LYS  48          2HZ       LYS  48  10.156  11.263  -9.637
  394   3HZ   LYS  48          3HZ       LYS  48  10.568  12.783 -10.115
  395    H    VAL  49           H        VAL  49   7.799   5.776  -6.461
  396    HA   VAL  49           HA       VAL  49   6.879   5.673  -3.634
  397    HB   VAL  49           HB       VAL  49   7.102   3.420  -5.665
  398   1HG1  VAL  49          1HG1      VAL  49   5.644   3.670  -2.991
  399   2HG1  VAL  49          2HG1      VAL  49   5.604   2.259  -4.071
  400   3HG1  VAL  49          3HG1      VAL  49   7.117   2.730  -3.279
  401   1HG2  VAL  49          1HG2      VAL  49   4.741   5.206  -4.943
  402   2HG2  VAL  49          2HG2      VAL  49   5.468   4.971  -6.545
  403   3HG2  VAL  49          3HG2      VAL  49   4.588   3.646  -5.785
  404    H    GLU  50           H        GLU  50   8.370   5.280  -2.118
  405    HA   GLU  50           HA       GLU  50  11.156   4.549  -2.806
  406   1HB   GLU  50          1HB       GLU  50  10.520   6.592  -1.403
  407   2HB   GLU  50          2HB       GLU  50   9.981   5.450  -0.154
  408   1HG   GLU  50          1HG       GLU  50  12.254   4.509  -0.018
  409   2HG   GLU  50          2HG       GLU  50  12.787   5.621  -1.292
  410    H    HIS  51           H        HIS  51   9.793   2.343  -3.327
  411    HA   HIS  51           HA       HIS  51   8.759   0.994  -1.024
  412   1HB   HIS  51          1HB       HIS  51   8.524  -0.963  -2.570
  413   2HB   HIS  51          2HB       HIS  51   7.777   0.522  -3.131
  414    HD2  HIS  51           HD2      HIS  51  11.551  -0.563  -3.792
  415    HE1  HIS  51           HE1      HIS  51   9.497  -0.202  -7.462
  416    HE2  HIS  51           HE2      HIS  51  11.758  -0.719  -6.375
  417    H    SER  52           H        SER  52   9.396  -1.157  -0.298
  418    HA   SER  52           HA       SER  52  12.262  -1.309   0.332
  419   1HB   SER  52          1HB       SER  52  10.490  -1.681   2.057
  420   2HB   SER  52          2HB       SER  52   9.954  -3.111   1.149
  421    HG   SER  52           HG       SER  52  12.137  -3.887   1.429
  422    H    ASP  53           H        ASP  53  10.429  -2.291  -2.303
  423    HA   ASP  53           HA       ASP  53  10.399  -3.935  -3.807
  424   1HB   ASP  53          1HB       ASP  53  13.227  -4.585  -2.872
  425   2HB   ASP  53          2HB       ASP  53  12.463  -5.176  -4.344
  426    H    LEU  54           H        LEU  54  11.104  -6.596  -3.895
  427    HA   LEU  54           HA       LEU  54   9.166  -7.618  -2.046
  428   1HB   LEU  54          1HB       LEU  54   9.578  -8.305  -4.495
  429   2HB   LEU  54          2HB       LEU  54  10.880  -9.307  -3.860
  430    HG   LEU  54           HG       LEU  54   8.946 -10.662  -4.146
  431   1HD1  LEU  54          1HD1      LEU  54  10.257 -10.956  -1.996
  432   2HD1  LEU  54          2HD1      LEU  54   8.852 -10.214  -1.180
  433   3HD1  LEU  54          3HD1      LEU  54   8.658 -11.700  -2.077
  434   1HD2  LEU  54          1HD2      LEU  54   7.336  -8.598  -2.587
  435   2HD2  LEU  54          2HD2      LEU  54   7.167  -9.062  -4.291
  436   3HD2  LEU  54          3HD2      LEU  54   6.759 -10.186  -2.990
  437    H    SER  55           H        SER  55   9.460  -8.369  -0.094
  438    HA   SER  55           HA       SER  55  12.030  -9.620   0.725
  439   1HB   SER  55          1HB       SER  55  11.904  -7.271   1.626
  440   2HB   SER  55          2HB       SER  55  10.375  -7.686   2.417
  441    HG   SER  55           HG       SER  55  12.907  -8.903   2.842
  442    H    PHE  56           H        PHE  56  10.783 -11.629   0.148
  443    HA   PHE  56           HA       PHE  56   8.464 -12.298   1.795
  444   1HB   PHE  56          1HB       PHE  56   8.671 -14.491   1.027
  445   2HB   PHE  56          2HB       PHE  56   8.804 -13.382  -0.330
  446    HD1  PHE  56           HD1      PHE  56  10.904 -13.186  -1.595
  447    HD2  PHE  56           HD2      PHE  56  10.438 -15.996   1.636
  448    HE1  PHE  56           HE1      PHE  56  12.935 -14.401  -2.359
  449    HE2  PHE  56           HE2      PHE  56  12.440 -17.238   0.843
  450    HZ   PHE  56           HZ       PHE  56  13.701 -16.430  -1.143
  451    H    SER  57           H        SER  57   8.653 -12.779   4.027
  452    HA   SER  57           HA       SER  57  11.280 -13.094   5.234
  453   1HB   SER  57          1HB       SER  57   9.562 -12.177   6.626
  454   2HB   SER  57          2HB       SER  57   8.522 -13.605   6.400
  455    HG   SER  57           HG       SER  57  11.052 -13.479   7.667
  456    H    LYS  58           H        LYS  58  12.318 -15.035   5.608
  457    HA   LYS  58           HA       LYS  58  11.635 -17.152   3.786
  458   1HB   LYS  58          1HB       LYS  58  13.917 -16.879   5.784
  459   2HB   LYS  58          2HB       LYS  58  13.830 -18.059   4.460
  460   1HG   LYS  58          1HG       LYS  58  13.712 -16.205   2.812
  461   2HG   LYS  58          2HG       LYS  58  13.891 -15.022   4.120
  462   1HD   LYS  58          1HD       LYS  58  16.086 -15.993   4.715
  463   2HD   LYS  58          2HD       LYS  58  15.914 -17.180   3.403
  464   1HE   LYS  58          1HE       LYS  58  15.739 -15.276   1.764
  465   2HE   LYS  58          2HE       LYS  58  16.022 -14.140   3.096
  466   1HZ   LYS  58          1HZ       LYS  58  17.872 -16.240   2.204
  467   2HZ   LYS  58          2HZ       LYS  58  18.017 -14.627   1.901
  468   3HZ   LYS  58          3HZ       LYS  58  18.142 -15.190   3.446
  469    H    ASP  59           H        ASP  59   9.956 -16.780   6.374
  470    HA   ASP  59           HA       ASP  59   9.935 -19.512   7.362
  471   1HB   ASP  59          1HB       ASP  59   8.051 -17.110   7.587
  472   2HB   ASP  59          2HB       ASP  59   7.653 -18.698   8.257
  473    H    TRP  60           H        TRP  60   7.085 -17.920   6.043
  474    HA   TRP  60           HA       TRP  60   7.042 -19.152   3.453
  475   1HB   TRP  60          1HB       TRP  60   5.262 -20.659   3.676
  476   2HB   TRP  60          2HB       TRP  60   6.625 -21.189   4.633
  477    HD1  TRP  60           HD1      TRP  60   6.364 -20.634   7.372
  478    HE1  TRP  60           HE1      TRP  60   4.254 -21.037   8.847
  479    HE3  TRP  60           HE3      TRP  60   2.872 -20.506   3.736
  480    HZ2  TRP  60           HZ2      TRP  60   1.425 -21.380   8.427
  481    HZ3  TRP  60           HZ3      TRP  60   0.447 -20.967   4.248
  482    HH2  TRP  60           HH2      TRP  60  -0.261 -21.412   6.589
  483    H    SER  61           H        SER  61   6.998 -16.781   3.427
  484    HA   SER  61           HA       SER  61   4.223 -15.707   3.461
  485   1HB   SER  61          1HB       SER  61   5.000 -13.678   4.539
  486   2HB   SER  61          2HB       SER  61   5.494 -15.037   5.560
  487    HG   SER  61           HG       SER  61   7.569 -14.895   4.548
  488    H    PHE  62           H        PHE  62   4.607 -13.276   2.446
  489    HA   PHE  62           HA       PHE  62   6.684 -12.996   0.527
  490   1HB   PHE  62          1HB       PHE  62   4.640 -14.633  -0.425
  491   2HB   PHE  62          2HB       PHE  62   4.097 -13.046  -0.949
  492    HD1  PHE  62           HD1      PHE  62   5.239 -11.892  -2.790
  493    HD2  PHE  62           HD2      PHE  62   6.920 -15.487  -1.080
  494    HE1  PHE  62           HE1      PHE  62   7.000 -11.911  -4.472
  495    HE2  PHE  62           HE2      PHE  62   8.597 -15.561  -2.831
  496    HZ   PHE  62           HZ       PHE  62   8.607 -13.789  -4.631
  497    H    TYR  63           H        TYR  63   6.941 -10.696   0.626
  498    HA   TYR  63           HA       TYR  63   4.518  -9.024   0.661
  499   1HB   TYR  63          1HB       TYR  63   5.020  -7.943   2.808
  500   2HB   TYR  63          2HB       TYR  63   4.595  -9.645   2.951
  501    HD1  TYR  63           HD1      TYR  63   5.868 -11.142   4.190
  502    HD2  TYR  63           HD2      TYR  63   7.382  -7.265   3.086
  503    HE1  TYR  63           HE1      TYR  63   7.619 -11.333   5.898
  504    HE2  TYR  63           HE2      TYR  63   9.178  -7.462   4.744
  505    HH   TYR  63           HH       TYR  63  10.182  -8.828   6.330
  506    H    LEU  64           H        LEU  64   5.163  -6.705   1.147
  507    HA   LEU  64           HA       LEU  64   7.805  -5.810   0.653
  508   1HB   LEU  64          1HB       LEU  64   7.574  -4.759  -1.516
  509   2HB   LEU  64          2HB       LEU  64   7.412  -6.503  -1.652
  510    HG   LEU  64           HG       LEU  64   5.263  -4.433  -1.896
  511   1HD1  LEU  64          1HD1      LEU  64   6.285  -6.547  -3.859
  512   2HD1  LEU  64          2HD1      LEU  64   4.966  -5.426  -4.178
  513   3HD1  LEU  64          3HD1      LEU  64   6.605  -4.797  -3.961
  514   1HD2  LEU  64          1HD2      LEU  64   5.108  -7.451  -1.753
  515   2HD2  LEU  64          2HD2      LEU  64   4.100  -6.269  -0.852
  516   3HD2  LEU  64          3HD2      LEU  64   3.854  -6.539  -2.583
  517    H    LEU  65           H        LEU  65   7.942  -3.536   0.942
  518    HA   LEU  65           HA       LEU  65   5.554  -2.285   2.168
  519   1HB   LEU  65          1HB       LEU  65   8.148  -2.707   3.112
  520   2HB   LEU  65          2HB       LEU  65   8.238  -1.059   2.497
  521    HG   LEU  65           HG       LEU  65   6.141  -2.085   4.453
  522   1HD1  LEU  65          1HD1      LEU  65   8.368  -2.190   5.442
  523   2HD1  LEU  65          2HD1      LEU  65   8.722  -0.534   4.901
  524   3HD1  LEU  65          3HD1      LEU  65   7.476  -0.823   6.139
  525   1HD2  LEU  65          1HD2      LEU  65   5.475  -0.051   3.107
  526   2HD2  LEU  65          2HD2      LEU  65   5.627   0.231   4.848
  527   3HD2  LEU  65          3HD2      LEU  65   6.912   0.772   3.756
  528    H    TYR  66           H        TYR  66   4.776  -0.419   1.165
  529    HA   TYR  66           HA       TYR  66   6.215   0.574  -1.234
  530   1HB   TYR  66          1HB       TYR  66   3.208   0.230  -1.309
  531   2HB   TYR  66          2HB       TYR  66   4.356   0.268  -2.624
  532    HD1  TYR  66           HD1      TYR  66   4.223  -1.763  -3.870
  533    HD2  TYR  66           HD2      TYR  66   3.631  -1.965   0.406
  534    HE1  TYR  66           HE1      TYR  66   2.998  -3.898  -4.101
  535    HE2  TYR  66           HE2      TYR  66   2.601  -4.136   0.163
  536    HH   TYR  66           HH       TYR  66   1.697  -5.489  -3.035
  537    H    TYR  67           H        TYR  67   6.832   2.311  -0.095
  538    HA   TYR  67           HA       TYR  67   4.718   4.016   1.087
  539   1HB   TYR  67          1HB       TYR  67   6.361   4.643   2.681
  540   2HB   TYR  67          2HB       TYR  67   5.894   2.960   2.655
  541    HD1  TYR  67           HD1      TYR  67   8.605   5.219   2.736
  542    HD2  TYR  67           HD2      TYR  67   7.549   1.243   1.469
  543    HE1  TYR  67           HE1      TYR  67  10.886   4.441   3.290
  544    HE2  TYR  67           HE2      TYR  67   9.837   0.490   1.925
  545    HH   TYR  67           HH       TYR  67  12.379   2.650   3.227
  546    H    THR  68           H        THR  68   4.812   6.088   0.925
  547    HA   THR  68           HA       THR  68   6.758   7.433  -0.934
  548    HB   THR  68           HB       THR  68   4.696   6.832  -2.015
  549    HG1  THR  68           HG1      THR  68   5.837   8.620  -2.687
  550   1HG2  THR  68          1HG2      THR  68   3.378   8.804  -0.073
  551   2HG2  THR  68          2HG2      THR  68   2.607   8.056  -1.473
  552   3HG2  THR  68          3HG2      THR  68   3.100   7.049  -0.104
  553    H    GLU  69           H        GLU  69   6.871   9.783  -0.698
  554    HA   GLU  69           HA       GLU  69   6.576  10.801   2.048
  555   1HB   GLU  69          1HB       GLU  69   8.617  10.986   0.304
  556   2HB   GLU  69          2HB       GLU  69   7.748  12.446  -0.149
  557   1HG   GLU  69          1HG       GLU  69   8.681  11.707   2.658
  558   2HG   GLU  69          2HG       GLU  69   9.555  12.755   1.537
  559    H    PHE  70           H        PHE  70   4.268  10.917   2.079
  560    HA   PHE  70           HA       PHE  70   2.853  12.333  -0.069
  561   1HB   PHE  70          1HB       PHE  70   0.898  11.589   0.762
  562   2HB   PHE  70          2HB       PHE  70   1.952  10.262   1.200
  563    HD1  PHE  70           HD1      PHE  70  -0.628  12.504   2.320
  564    HD2  PHE  70           HD2      PHE  70   2.929  10.498   3.627
  565    HE1  PHE  70           HE1      PHE  70  -1.216  12.947   4.679
  566    HE2  PHE  70           HE2      PHE  70   2.105  10.574   6.000
  567    HZ   PHE  70           HZ       PHE  70   0.062  11.854   6.514
  568    H    THR  71           H        THR  71   2.189  14.367   0.004
  569    HA   THR  71           HA       THR  71   2.287  15.962   2.527
  570    HB   THR  71           HB       THR  71   2.404  16.932  -0.297
  571    HG1  THR  71           HG1      THR  71   4.579  17.291   0.360
  572   1HG2  THR  71          1HG2      THR  71   3.063  19.035   0.833
  573   2HG2  THR  71          2HG2      THR  71   1.444  18.557   1.375
  574   3HG2  THR  71          3HG2      THR  71   2.847  18.264   2.419
  575    HA   PRO  72           HA       PRO  72  -2.243  15.569   1.546
  576   1HB   PRO  72          1HB       PRO  72  -3.316  15.998   3.990
  577   2HB   PRO  72          2HB       PRO  72  -2.443  14.506   3.565
  578   1HG   PRO  72          1HG       PRO  72  -1.368  16.921   5.041
  579   2HG   PRO  72          2HG       PRO  72  -1.191  15.207   5.496
  580   1HD   PRO  72          1HD       PRO  72   0.738  16.625   4.124
  581   2HD   PRO  72          2HD       PRO  72   0.511  14.873   3.902
  582    H    THR  73           H        THR  73  -1.654  17.483   0.218
  583    HA   THR  73           HA       THR  73  -1.852  20.162   1.188
  584    HB   THR  73           HB       THR  73  -2.161  20.687  -1.262
  585    HG1  THR  73           HG1      THR  73  -3.142  18.697  -1.842
  586   1HG2  THR  73          1HG2      THR  73   0.166  18.818  -0.636
  587   2HG2  THR  73          2HG2      THR  73   0.099  20.049  -1.908
  588   3HG2  THR  73          3HG2      THR  73   0.099  20.545  -0.204
  589    H    GLU  74           H        GLU  74  -3.631  20.625   2.322
  590    HA   GLU  74           HA       GLU  74  -5.732  20.953   2.968
  591   1HB   GLU  74          1HB       GLU  74  -6.051  21.552   0.002
  592   2HB   GLU  74          2HB       GLU  74  -7.318  21.838   1.209
  593   1HG   GLU  74          1HG       GLU  74  -5.776  23.279   2.502
  594   2HG   GLU  74          2HG       GLU  74  -4.521  23.044   1.272
  595    H    LYS  75           H        LYS  75  -6.952  19.602  -0.069
  596    HA   LYS  75           HA       LYS  75  -8.288  17.449   1.533
  597   1HB   LYS  75          1HB       LYS  75  -9.365  19.113  -0.771
  598   2HB   LYS  75          2HB       LYS  75 -10.202  17.758   0.015
  599   1HG   LYS  75          1HG       LYS  75 -10.096  18.967   2.194
  600   2HG   LYS  75          2HG       LYS  75  -9.378  20.365   1.367
  601   1HD   LYS  75          1HD       LYS  75 -11.366  20.528  -0.101
  602   2HD   LYS  75          2HD       LYS  75 -12.091  19.131   0.727
  603   1HE   LYS  75          1HE       LYS  75 -12.030  20.392   2.879
  604   2HE   LYS  75          2HE       LYS  75 -11.343  21.792   2.031
  605   1HZ   LYS  75          1HZ       LYS  75 -13.332  21.898   0.721
  606   2HZ   LYS  75          2HZ       LYS  75 -13.966  20.585   1.492
  607   3HZ   LYS  75          3HZ       LYS  75 -13.698  21.981   2.326
  608    H    ASP  76           H        ASP  76  -5.701  17.493  -0.198
  609    HA   ASP  76           HA       ASP  76  -6.296  15.478  -2.239
  610   1HB   ASP  76          1HB       ASP  76  -3.762  16.490  -0.925
  611   2HB   ASP  76          2HB       ASP  76  -3.780  15.031  -1.924
  612    H    GLU  77           H        GLU  77  -7.472  13.820  -1.367
  613    HA   GLU  77           HA       GLU  77  -6.768  12.331   1.011
  614   1HB   GLU  77          1HB       GLU  77  -9.014  12.306  -0.095
  615   2HB   GLU  77          2HB       GLU  77  -8.291  11.515  -1.505
  616   1HG   GLU  77          1HG       GLU  77  -7.679   9.560  -0.052
  617   2HG   GLU  77          2HG       GLU  77  -8.456  10.369   1.321
  618    H    TYR  78           H        TYR  78  -5.620  10.290   1.048
  619    HA   TYR  78           HA       TYR  78  -4.145   9.517  -1.419
  620   1HB   TYR  78          1HB       TYR  78  -2.984   9.657   1.354
  621   2HB   TYR  78          2HB       TYR  78  -2.336   8.677   0.047
  622    HD1  TYR  78           HD1      TYR  78  -3.413  12.220   0.732
  623    HD2  TYR  78           HD2      TYR  78  -0.644   9.607  -1.268
  624    HE1  TYR  78           HE1      TYR  78  -2.298  14.172  -0.294
  625    HE2  TYR  78           HE2      TYR  78   0.618  11.591  -2.090
  626    HH   TYR  78           HH       TYR  78  -0.328  14.927  -1.242
  627    H    ALA  79           H        ALA  79  -4.135   7.389  -1.876
  628    HA   ALA  79           HA       ALA  79  -5.253   5.434   0.009
  629   1HB   ALA  79          1HB       ALA  79  -7.233   6.354  -1.205
  630   2HB   ALA  79          2HB       ALA  79  -6.469   5.946  -2.753
  631   3HB   ALA  79          3HB       ALA  79  -6.923   4.659  -1.629
  632    H    CYS  80           H        CYS  80  -5.162   3.238  -1.084
  633    HA   CYS  80           HA       CYS  80  -2.779   2.963  -2.856
  634   1HB   CYS  80          1HB       CYS  80  -3.238   1.803  -0.095
  635   2HB   CYS  80          2HB       CYS  80  -2.156   1.041  -1.271
  636    H    ARG  81           H        ARG  81  -3.258   1.759  -4.516
  637    HA   ARG  81           HA       ARG  81  -5.695   0.252  -4.812
  638   1HB   ARG  81          1HB       ARG  81  -4.429   1.218  -6.697
  639   2HB   ARG  81          2HB       ARG  81  -3.047   0.198  -6.273
  640   1HG   ARG  81          1HG       ARG  81  -4.425  -1.838  -6.750
  641   2HG   ARG  81          2HG       ARG  81  -5.761  -0.780  -7.239
  642   1HD   ARG  81          1HD       ARG  81  -4.244   0.223  -8.981
  643   2HD   ARG  81          2HD       ARG  81  -2.977  -0.912  -8.454
  644    HE   ARG  81           HE       ARG  81  -5.565  -2.061  -9.244
  645   1HH1  ARG  81          1HH2      ARG  81  -2.324  -1.187 -10.460
  646   2HH1  ARG  81          2HH2      ARG  81  -2.225  -2.604 -11.490
  647   1HH2  ARG  81          1HH1      ARG  81  -5.446  -3.802 -10.705
  648   2HH2  ARG  81          2HH1      ARG  81  -3.994  -4.078 -11.637
  649    H    VAL  82           H        VAL  82  -5.980  -2.079  -4.534
  650    HA   VAL  82           HA       VAL  82  -3.576  -3.625  -3.749
  651    HB   VAL  82           HB       VAL  82  -6.286  -3.873  -2.383
  652   1HG1  VAL  82          1HG1      VAL  82  -4.840  -5.883  -2.488
  653   2HG1  VAL  82          2HG1      VAL  82  -3.515  -4.954  -1.750
  654   3HG1  VAL  82          3HG1      VAL  82  -5.011  -5.265  -0.832
  655   1HG2  VAL  82          1HG2      VAL  82  -5.337  -1.693  -1.698
  656   2HG2  VAL  82          2HG2      VAL  82  -5.262  -2.863  -0.393
  657   3HG2  VAL  82          3HG2      VAL  82  -3.793  -2.483  -1.309
  658    H    ASN  83           H        ASN  83  -3.400  -4.717  -5.680
  659    HA   ASN  83           HA       ASN  83  -5.698  -6.511  -6.288
  660   1HB   ASN  83          1HB       ASN  83  -5.486  -4.631  -7.984
  661   2HB   ASN  83          2HB       ASN  83  -3.936  -5.309  -8.444
  662   1HD2  ASN  83          2HD2      ASN  83  -4.237  -6.378 -10.405
  663   2HD2  ASN  83          1HD2      ASN  83  -5.552  -7.493 -10.703
  664    H    HIS  84           H        HIS  84  -4.611  -8.065  -4.942
  665    HA   HIS  84           HA       HIS  84  -2.009  -9.213  -5.738
  666   1HB   HIS  84          1HB       HIS  84  -2.873  -9.373  -3.432
  667   2HB   HIS  84          2HB       HIS  84  -4.281 -10.252  -4.026
  668    HD2  HIS  84           HD2      HIS  84  -0.354 -10.861  -3.836
  669    HE1  HIS  84           HE1      HIS  84  -2.430 -14.558  -3.831
  670    HE2  HIS  84           HE2      HIS  84  -0.133 -13.463  -3.555
  671    H    VAL  85           H        VAL  85  -2.037 -11.434  -6.749
  672    HA   VAL  85           HA       VAL  85  -3.709 -11.622  -8.996
  673    HB   VAL  85           HB       VAL  85  -1.531 -12.688  -8.801
  674   1HG1  VAL  85          1HG1      VAL  85  -1.665 -13.664  -6.544
  675   2HG1  VAL  85          2HG1      VAL  85  -2.887 -14.829  -7.106
  676   3HG1  VAL  85          3HG1      VAL  85  -1.241 -14.876  -7.759
  677   1HG2  VAL  85          1HG2      VAL  85  -3.734 -14.658  -9.526
  678   2HG2  VAL  85          2HG2      VAL  85  -3.135 -13.342 -10.561
  679   3HG2  VAL  85          3HG2      VAL  85  -2.057 -14.671 -10.105
  680    H    THR  86           H        THR  86  -4.189 -13.023  -5.745
  681    HA   THR  86           HA       THR  86  -6.445 -14.607  -6.605
  682    HB   THR  86           HB       THR  86  -4.806 -15.084  -4.712
  683    HG1  THR  86           HG1      THR  86  -6.635 -16.309  -5.325
  684   1HG2  THR  86          1HG2      THR  86  -6.964 -13.835  -3.006
  685   2HG2  THR  86          2HG2      THR  86  -5.354 -14.429  -2.536
  686   3HG2  THR  86          3HG2      THR  86  -5.523 -12.901  -3.437
  687    H    LEU  87           H        LEU  87  -6.103 -11.246  -5.635
  688    HA   LEU  87           HA       LEU  87  -8.973 -10.882  -5.127
  689   1HB   LEU  87          1HB       LEU  87  -6.575  -9.088  -5.492
  690   2HB   LEU  87          2HB       LEU  87  -8.170  -8.453  -5.866
  691    HG   LEU  87           HG       LEU  87  -9.016  -8.918  -3.678
  692   1HD1  LEU  87          1HD1      LEU  87  -7.729 -10.945  -3.058
  693   2HD1  LEU  87          2HD1      LEU  87  -6.237  -9.985  -3.009
  694   3HD1  LEU  87          3HD1      LEU  87  -7.531  -9.682  -1.837
  695   1HD2  LEU  87          1HD2      LEU  87  -6.327  -7.476  -3.681
  696   2HD2  LEU  87          2HD2      LEU  87  -7.921  -6.778  -4.048
  697   3HD2  LEU  87          3HD2      LEU  87  -7.547  -7.322  -2.401
  698    H    SER  88           H        SER  88  -6.727 -10.001  -7.787
  699    HA   SER  88           HA       SER  88  -6.966  -9.770  -9.980
  700   1HB   SER  88          1HB       SER  88  -8.041 -12.039  -9.930
  701   2HB   SER  88          2HB       SER  88  -9.627 -11.237  -9.934
  702    HG   SER  88           HG       SER  88  -8.860 -10.129 -11.858
  703    H    GLN  89           H        GLN  89  -9.764  -8.834  -7.998
  704    HA   GLN  89           HA       GLN  89 -10.433  -6.620  -9.832
  705   1HB   GLN  89          1HB       GLN  89 -11.742  -7.606  -7.290
  706   2HB   GLN  89          2HB       GLN  89 -12.293  -6.238  -8.276
  707   1HG   GLN  89          1HG       GLN  89 -12.601  -7.750 -10.215
  708   2HG   GLN  89          2HG       GLN  89 -12.078  -9.131  -9.233
  709   1HE2  GLN  89          2HE2      GLN  89 -14.480  -9.397 -10.410
  710   2HE2  GLN  89          1HE2      GLN  89 -15.774  -9.219  -9.243
  711    HA   PRO  90           HA       PRO  90  -7.575  -4.382  -7.189
  712   1HB   PRO  90          1HB       PRO  90  -7.671  -1.900  -8.313
  713   2HB   PRO  90          2HB       PRO  90  -7.043  -3.330  -9.186
  714   1HG   PRO  90          1HG       PRO  90  -9.842  -2.196  -9.393
  715   2HG   PRO  90          2HG       PRO  90  -8.698  -2.542 -10.721
  716   1HD   PRO  90          1HD       PRO  90 -10.588  -4.342  -9.960
  717   2HD   PRO  90          2HD       PRO  90  -8.949  -4.882 -10.445
  718    H    LYS  91           H        LYS  91  -8.378  -4.337  -5.122
  719    HA   LYS  91           HA       LYS  91 -10.729  -2.717  -4.394
  720   1HB   LYS  91          1HB       LYS  91 -10.408  -4.944  -3.448
  721   2HB   LYS  91          2HB       LYS  91  -8.855  -4.464  -2.745
  722   1HG   LYS  91          1HG       LYS  91  -9.985  -2.841  -1.281
  723   2HG   LYS  91          2HG       LYS  91 -11.536  -3.175  -2.081
  724   1HD   LYS  91          1HD       LYS  91 -11.422  -5.539  -1.299
  725   2HD   LYS  91          2HD       LYS  91  -9.852  -5.214  -0.549
  726   1HE   LYS  91          1HE       LYS  91 -11.610  -5.191   1.145
  727   2HE   LYS  91          2HE       LYS  91 -10.895  -3.578   0.986
  728   1HZ   LYS  91          1HZ       LYS  91 -13.422  -4.465  -0.231
  729   2HZ   LYS  91          2HZ       LYS  91 -13.282  -3.516   1.109
  730   3HZ   LYS  91          3HZ       LYS  91 -12.773  -2.955  -0.353
  731    H    ILE  92           H        ILE  92 -10.316  -0.518  -4.361
  732    HA   ILE  92           HA       ILE  92  -7.648   0.450  -3.746
  733    HB   ILE  92           HB       ILE  92 -10.121   2.125  -4.230
  734   1HG1  ILE  92          1HG1      ILE  92 -10.074   0.667  -6.129
  735   2HG1  ILE  92          2HG1      ILE  92  -9.460   2.247  -6.593
  736   1HG2  ILE  92          1HG2      ILE  92  -8.174   3.293  -3.332
  737   2HG2  ILE  92          2HG2      ILE  92  -7.120   2.576  -4.559
  738   3HG2  ILE  92          3HG2      ILE  92  -8.387   3.727  -5.037
  739   1HD1  ILE  92          1HD1      ILE  92  -7.129   1.375  -6.507
  740   2HD1  ILE  92          2HD1      ILE  92  -7.764  -0.228  -6.052
  741   3HD1  ILE  92          3HD1      ILE  92  -8.155   0.472  -7.629
  742    H    VAL  93           H        VAL  93  -7.225  -0.064  -1.624
  743    HA   VAL  93           HA       VAL  93  -9.047   0.611   0.541
  744    HB   VAL  93           HB       VAL  93  -6.154  -0.332   0.496
  745   1HG1  VAL  93          1HG1      VAL  93  -8.071   0.055   2.841
  746   2HG1  VAL  93          2HG1      VAL  93  -6.533  -0.823   2.924
  747   3HG1  VAL  93          3HG1      VAL  93  -6.533   0.907   2.579
  748   1HG2  VAL  93          1HG2      VAL  93  -8.773  -1.767   1.145
  749   2HG2  VAL  93          2HG2      VAL  93  -7.802  -2.004  -0.323
  750   3HG2  VAL  93          3HG2      VAL  93  -7.148  -2.470   1.253
  751    H    LYS  94           H        LYS  94  -9.358   2.640   1.187
  752    HA   LYS  94           HA       LYS  94  -7.519   4.822   0.663
  753   1HB   LYS  94          1HB       LYS  94 -10.013   4.583   2.390
  754   2HB   LYS  94          2HB       LYS  94  -9.115   6.087   2.118
  755   1HG   LYS  94          1HG       LYS  94  -9.481   5.863  -0.327
  756   2HG   LYS  94          2HG       LYS  94 -10.456   4.402  -0.046
  757   1HD   LYS  94          1HD       LYS  94 -11.979   5.755   1.422
  758   2HD   LYS  94          2HD       LYS  94 -11.054   7.205   1.011
  759   1HE   LYS  94          1HE       LYS  94 -12.639   5.435  -0.911
  760   2HE   LYS  94          2HE       LYS  94 -13.083   7.061  -0.355
  761   1HZ   LYS  94          1HZ       LYS  94 -11.115   7.895  -1.453
  762   2HZ   LYS  94          2HZ       LYS  94 -10.745   6.391  -2.000
  763   3HZ   LYS  94          3HZ       LYS  94 -12.120   7.136  -2.516
  764    H    TRP  95           H        TRP  95  -6.257   5.936   2.119
  765    HA   TRP  95           HA       TRP  95  -5.495   4.573   4.654
  766   1HB   TRP  95          1HB       TRP  95  -3.616   5.279   3.327
  767   2HB   TRP  95          2HB       TRP  95  -4.359   6.820   2.999
  768    HD1  TRP  95           HD1      TRP  95  -3.183   5.061   6.278
  769    HE1  TRP  95           HE1      TRP  95  -1.947   6.863   7.694
  770    HE3  TRP  95           HE3      TRP  95  -3.705   9.088   3.211
  771    HZ2  TRP  95           HZ2      TRP  95  -1.895   9.744   7.788
  772    HZ3  TRP  95           HZ3      TRP  95  -2.970  11.335   3.947
  773    HH2  TRP  95           HH2      TRP  95  -2.322  11.702   6.299
  774    H    ASP  96           H        ASP  96  -6.487   5.238   6.477
  775    HA   ASP  96           HA       ASP  96  -7.631   7.997   6.657
  776   1HB   ASP  96          1HB       ASP  96  -8.922   5.440   7.534
  777   2HB   ASP  96          2HB       ASP  96  -9.459   7.096   7.883
  778    H    ARG  97           H        ARG  97  -5.442   8.150   7.503
  779    HA   ARG  97           HA       ARG  97  -3.896   8.401   9.153
  780   1HB   ARG  97          1HB       ARG  97  -5.798   9.855   9.849
  781   2HB   ARG  97          2HB       ARG  97  -6.292   8.608  11.005
  782   1HG   ARG  97          1HG       ARG  97  -4.031   8.740  12.077
  783   2HG   ARG  97          2HG       ARG  97  -3.558   9.990  10.913
  784   1HD   ARG  97          1HD       ARG  97  -5.861  10.218  12.897
  785   2HD   ARG  97          2HD       ARG  97  -4.238  10.905  13.117
  786    HE   ARG  97           HE       ARG  97  -5.275  11.787  10.621
  787   1HH1  ARG  97          1HH2      ARG  97  -5.811  12.284  14.093
  788   2HH1  ARG  97          2HH2      ARG  97  -6.425  13.906  13.896
  789   1HH2  ARG  97          1HH1      ARG  97  -6.092  13.905  10.370
  790   2HH2  ARG  97          2HH1      ARG  97  -6.586  14.833  11.763
  791    H    ASP  98           H        ASP  98  -3.023   6.353   8.910
  792    HA   ASP  98           HA       ASP  98  -2.112   4.452   9.501
  793   1HB   ASP  98          1HB       ASP  98  -1.537   6.184  11.267
  794   2HB   ASP  98          2HB       ASP  98  -2.664   5.357  12.323
  795    H    MET  99           H        MET  99  -3.600   2.991   8.635
  796    HA   MET  99           HA       MET  99  -5.303   1.486  10.558
  797   1HB   MET  99          1HB       MET  99  -6.066   2.395   7.745
  798   2HB   MET  99          2HB       MET  99  -6.969   1.220   8.708
  799   1HG   MET  99          1HG       MET  99  -6.488   4.147   9.370
  800   2HG   MET  99          2HG       MET  99  -7.995   3.434   8.807
  801   1HE   MET  99          1HE       MET  99  -9.435   1.743  10.162
  802   2HE   MET  99          2HE       MET  99  -8.097   0.701  10.711
  803   3HE   MET  99          3HE       MET  99  -9.226   1.395  11.894
  Start of MODEL   12
    1   1H    MET   0          1H        MET   0  -8.339 -20.881  -5.628
    2   2H    MET   0          2H        MET   0  -7.733 -20.132  -4.291
    3   3H    MET   0          3H        MET   0  -6.943 -19.997  -5.734
    4    HA   MET   0           HA       MET   0  -7.286 -22.414  -4.138
    5   1HB   MET   0          1HB       MET   0  -5.768 -22.039  -6.759
    6   2HB   MET   0          2HB       MET   0  -5.766 -23.497  -5.748
    7   1HG   MET   0          1HG       MET   0  -8.261 -23.626  -6.025
    8   2HG   MET   0          2HG       MET   0  -8.156 -22.296  -7.192
    9   1HE   MET   0          1HE       MET   0  -9.439 -23.707  -8.972
   10   2HE   MET   0          2HE       MET   0  -9.008 -25.382  -9.396
   11   3HE   MET   0          3HE       MET   0  -9.578 -24.998  -7.753
   12    H    ILE   1           H        ILE   1  -5.647 -22.885  -2.777
   13    HA   ILE   1           HA       ILE   1  -4.175 -22.336  -1.211
   14    HB   ILE   1           HB       ILE   1  -3.003 -23.617  -2.991
   15   1HG1  ILE   1          1HG1      ILE   1  -0.661 -23.119  -2.016
   16   2HG1  ILE   1          2HG1      ILE   1  -1.492 -21.992  -0.942
   17   1HG2  ILE   1          1HG2      ILE   1  -1.653 -20.983  -3.657
   18   2HG2  ILE   1          2HG2      ILE   1  -1.186 -22.598  -4.218
   19   3HG2  ILE   1          3HG2      ILE   1  -2.742 -21.927  -4.699
   20   1HD1  ILE   1          1HD1      ILE   1  -2.960 -23.900  -0.176
   21   2HD1  ILE   1          2HD1      ILE   1  -2.046 -24.976  -1.251
   22   3HD1  ILE   1          3HD1      ILE   1  -1.234 -24.183   0.111
   23    H    GLN   2           H        GLN   2  -5.710 -20.136  -1.796
   24    HA   GLN   2           HA       GLN   2  -4.052 -17.835  -2.300
   25   1HB   GLN   2          1HB       GLN   2  -6.027 -16.577  -2.416
   26   2HB   GLN   2          2HB       GLN   2  -6.196 -18.067  -3.350
   27   1HG   GLN   2          1HG       GLN   2  -7.575 -17.327  -0.733
   28   2HG   GLN   2          2HG       GLN   2  -8.277 -17.500  -2.329
   29   1HE2  GLN   2          2HE2      GLN   2  -7.379 -19.170   0.559
   30   2HE2  GLN   2          1HE2      GLN   2  -7.895 -20.769   0.054
   31    H    ARG   3           H        ARG   3  -2.712 -17.225  -0.711
   32    HA   ARG   3           HA       ARG   3  -3.689 -16.758   2.046
   33   1HB   ARG   3          1HB       ARG   3  -1.045 -16.509   0.636
   34   2HB   ARG   3          2HB       ARG   3  -1.350 -15.661   2.162
   35   1HG   ARG   3          1HG       ARG   3  -0.220 -17.867   2.415
   36   2HG   ARG   3          2HG       ARG   3  -1.683 -17.646   3.386
   37   1HD   ARG   3          1HD       ARG   3  -2.992 -19.012   1.914
   38   2HD   ARG   3          2HD       ARG   3  -1.682 -19.093   0.713
   39    HE   ARG   3           HE       ARG   3  -0.551 -20.134   2.992
   40   1HH1  ARG   3          1HH2      ARG   3  -3.406 -20.885   1.032
   41   2HH1  ARG   3          2HH2      ARG   3  -3.440 -22.572   1.483
   42   1HH2  ARG   3          1HH1      ARG   3  -0.569 -22.362   3.548
   43   2HH2  ARG   3          2HH1      ARG   3  -1.791 -23.425   2.899
   44    H    THR   4           H        THR   4  -4.737 -14.928   2.519
   45    HA   THR   4           HA       THR   4  -5.241 -12.977   0.511
   46    HB   THR   4           HB       THR   4  -5.961 -12.896   3.468
   47    HG1  THR   4           HG1      THR   4  -7.195 -14.247   1.304
   48   1HG2  THR   4          1HG2      THR   4  -7.988 -11.740   2.666
   49   2HG2  THR   4          2HG2      THR   4  -6.538 -10.825   2.217
   50   3HG2  THR   4          3HG2      THR   4  -7.392 -11.805   0.997
   51    HA   PRO   5           HA       PRO   5  -1.834 -10.231   1.704
   52   1HB   PRO   5          1HB       PRO   5  -2.651  -7.890   0.494
   53   2HB   PRO   5          2HB       PRO   5  -1.949  -9.270  -0.394
   54   1HG   PRO   5          1HG       PRO   5  -4.865  -8.573  -0.026
   55   2HG   PRO   5          2HG       PRO   5  -4.020  -9.047  -1.528
   56   1HD   PRO   5          1HD       PRO   5  -5.460 -10.825  -0.054
   57   2HD   PRO   5          2HD       PRO   5  -3.943 -11.328  -0.861
   58    H    LYS   6           H        LYS   6  -1.698  -9.683   3.784
   59    HA   LYS   6           HA       LYS   6  -3.809  -8.240   5.217
   60   1HB   LYS   6          1HB       LYS   6  -2.306 -10.042   6.229
   61   2HB   LYS   6          2HB       LYS   6  -0.978  -8.874   6.119
   62   1HG   LYS   6          1HG       LYS   6  -2.526  -7.241   7.372
   63   2HG   LYS   6          2HG       LYS   6  -3.603  -8.620   7.640
   64   1HD   LYS   6          1HD       LYS   6  -1.819  -9.818   8.851
   65   2HD   LYS   6          2HD       LYS   6  -0.662  -8.532   8.468
   66   1HE   LYS   6          1HE       LYS   6  -1.457  -8.332  10.780
   67   2HE   LYS   6          2HE       LYS   6  -1.910  -6.916   9.818
   68   1HZ   LYS   6          1HZ       LYS   6  -3.682  -9.173  10.454
   69   2HZ   LYS   6          2HZ       LYS   6  -3.691  -7.706  11.206
   70   3HZ   LYS   6          3HZ       LYS   6  -4.101  -7.816   9.615
   71    H    ILE   7           H        ILE   7  -4.023  -6.177   4.590
   72    HA   ILE   7           HA       ILE   7  -1.749  -4.562   3.648
   73    HB   ILE   7           HB       ILE   7  -4.626  -3.665   3.772
   74   1HG1  ILE   7          1HG1      ILE   7  -4.455  -4.485   1.198
   75   2HG1  ILE   7          2HG1      ILE   7  -3.529  -5.780   1.947
   76   1HG2  ILE   7          1HG2      ILE   7  -2.743  -2.095   3.189
   77   2HG2  ILE   7          2HG2      ILE   7  -2.429  -3.092   1.761
   78   3HG2  ILE   7          3HG2      ILE   7  -3.982  -2.261   1.934
   79   1HD1  ILE   7          1HD1      ILE   7  -6.372  -4.877   2.665
   80   2HD1  ILE   7          2HD1      ILE   7  -5.941  -6.318   1.732
   81   3HD1  ILE   7          3HD1      ILE   7  -5.537  -6.216   3.453
   82    H    GLN   8           H        GLN   8  -0.731  -3.041   5.129
   83    HA   GLN   8           HA       GLN   8  -2.472  -1.883   7.230
   84   1HB   GLN   8          1HB       GLN   8  -0.247  -1.768   8.472
   85   2HB   GLN   8          2HB       GLN   8  -1.229  -3.232   8.586
   86   1HG   GLN   8          1HG       GLN   8   1.125  -2.931   6.701
   87   2HG   GLN   8          2HG       GLN   8   1.289  -3.513   8.363
   88   1HE2  GLN   8          2HE2      GLN   8   1.885  -4.876   5.772
   89   2HE2  GLN   8          1HE2      GLN   8   0.904  -6.331   5.780
   90    H    VAL   9           H        VAL   9  -2.900  -0.036   6.213
   91    HA   VAL   9           HA       VAL   9  -0.800   1.421   4.753
   92    HB   VAL   9           HB       VAL   9  -3.768   2.013   5.033
   93   1HG1  VAL   9          1HG1      VAL   9  -2.460   4.008   4.492
   94   2HG1  VAL   9          2HG1      VAL   9  -1.562   3.134   3.252
   95   3HG1  VAL   9          3HG1      VAL   9  -3.303   3.457   3.040
   96   1HG2  VAL   9          1HG2      VAL   9  -2.218   0.520   2.879
   97   2HG2  VAL   9          2HG2      VAL   9  -3.576  -0.069   3.869
   98   3HG2  VAL   9          3HG2      VAL   9  -3.851   1.184   2.656
   99    H    TYR  10           H        TYR  10   0.509   2.380   6.263
  100    HA   TYR  10           HA       TYR  10  -0.781   4.179   8.306
  101   1HB   TYR  10          1HB       TYR  10   1.147   3.854   9.670
  102   2HB   TYR  10          2HB       TYR  10   0.316   2.352   9.308
  103    HD1  TYR  10           HD1      TYR  10   1.384   0.573   8.060
  104    HD2  TYR  10           HD2      TYR  10   3.417   4.307   8.767
  105    HE1  TYR  10           HE1      TYR  10   3.541  -0.484   7.466
  106    HE2  TYR  10           HE2      TYR  10   5.566   3.248   8.113
  107    HH   TYR  10           HH       TYR  10   5.789  -0.169   7.119
  108    H    SER  11           H        SER  11   0.485   6.093   8.913
  109    HA   SER  11           HA       SER  11   2.161   7.225   6.731
  110   1HB   SER  11          1HB       SER  11   0.250   8.631   7.232
  111   2HB   SER  11          2HB       SER  11   0.713   8.691   8.951
  112    HG   SER  11           HG       SER  11   1.605  10.472   7.986
  113    H    ARG  12           H        ARG  12   4.340   7.651   7.307
  114    HA   ARG  12           HA       ARG  12   5.302   6.819   9.984
  115   1HB   ARG  12          1HB       ARG  12   6.681   7.805   7.463
  116   2HB   ARG  12          2HB       ARG  12   7.520   7.674   9.019
  117   1HG   ARG  12          1HG       ARG  12   6.941   5.300   9.193
  118   2HG   ARG  12          2HG       ARG  12   6.077   5.392   7.645
  119   1HD   ARG  12          1HD       ARG  12   8.154   5.949   6.483
  120   2HD   ARG  12          2HD       ARG  12   9.046   5.987   8.019
  121    HE   ARG  12           HE       ARG  12   7.939   3.491   8.039
  122   1HH1  ARG  12          1HH2      ARG  12  10.031   5.190   5.724
  123   2HH1  ARG  12          2HH2      ARG  12  10.720   3.720   5.084
  124   1HH2  ARG  12          1HH1      ARG  12   8.853   1.587   7.205
  125   2HH2  ARG  12          2HH1      ARG  12  10.066   1.658   5.954
  126    H    HIS  13           H        HIS  13   5.622   9.770   7.965
  127    HA   HIS  13           HA       HIS  13   6.456  11.369  10.185
  128   1HB   HIS  13          1HB       HIS  13   5.561  12.035   7.364
  129   2HB   HIS  13          2HB       HIS  13   6.213  13.228   8.497
  130    HD2  HIS  13           HD2      HIS  13   8.239  13.605   6.557
  131    HE1  HIS  13           HE1      HIS  13  10.205   9.968   7.459
  132    HE2  HIS  13           HE2      HIS  13  10.431  12.206   6.248
  133    HA   PRO  14           HA       PRO  14   2.448  12.663  11.628
  134   1HB   PRO  14          1HB       PRO  14   2.914  15.086  12.768
  135   2HB   PRO  14          2HB       PRO  14   3.595  13.571  13.425
  136   1HG   PRO  14          1HG       PRO  14   4.973  15.609  11.675
  137   2HG   PRO  14          2HG       PRO  14   5.601  14.810  13.141
  138   1HD   PRO  14          1HD       PRO  14   6.167  13.985  10.572
  139   2HD   PRO  14          2HD       PRO  14   6.122  12.849  11.941
  140    H    ALA  15           H        ALA  15   0.816  13.238  10.250
  141    HA   ALA  15           HA       ALA  15   1.332  14.598   7.836
  142   1HB   ALA  15          1HB       ALA  15  -1.318  13.917   9.147
  143   2HB   ALA  15          2HB       ALA  15  -1.082  14.383   7.447
  144   3HB   ALA  15          3HB       ALA  15  -0.366  12.884   8.064
  145    H    GLU  16           H        GLU  16   1.629  16.664   7.491
  146    HA   GLU  16           HA       GLU  16   0.452  18.769   9.270
  147   1HB   GLU  16          1HB       GLU  16   3.211  18.377   8.081
  148   2HB   GLU  16          2HB       GLU  16   2.629  19.985   8.551
  149   1HG   GLU  16          1HG       GLU  16   2.319  19.290  10.847
  150   2HG   GLU  16          2HG       GLU  16   2.704  17.613  10.455
  151    H    ASN  17           H        ASN  17  -0.795  20.201   8.249
  152    HA   ASN  17           HA       ASN  17  -1.562  19.997   5.593
  153   1HB   ASN  17          1HB       ASN  17  -2.866  21.006   7.399
  154   2HB   ASN  17          2HB       ASN  17  -1.808  22.425   7.391
  155   1HD2  ASN  17          2HD2      ASN  17  -4.514  22.786   7.045
  156   2HD2  ASN  17          1HD2      ASN  17  -4.864  23.215   5.384
  157    H    GLY  18           H        GLY  18  -0.352  20.307   3.847
  158   1HA   GLY  18          1HA       GLY  18   0.814  21.322   2.204
  159   2HA   GLY  18          2HA       GLY  18   0.806  22.833   3.128
  160    H    LYS  19           H        LYS  19   2.160  19.543   3.815
  161    HA   LYS  19           HA       LYS  19   4.935  20.530   3.645
  162   1HB   LYS  19          1HB       LYS  19   4.171  21.295   5.775
  163   2HB   LYS  19          2HB       LYS  19   3.761  19.606   6.183
  164   1HG   LYS  19          1HG       LYS  19   6.048  18.933   6.173
  165   2HG   LYS  19          2HG       LYS  19   6.582  20.460   5.415
  166   1HD   LYS  19          1HD       LYS  19   6.109  21.734   7.357
  167   2HD   LYS  19          2HD       LYS  19   5.048  20.478   8.001
  168   1HE   LYS  19          1HE       LYS  19   7.131  20.569   9.293
  169   2HE   LYS  19          2HE       LYS  19   6.958  19.010   8.473
  170   1HZ   LYS  19          1HZ       LYS  19   8.601  21.259   7.539
  171   2HZ   LYS  19          2HZ       LYS  19   9.159  19.892   8.274
  172   3HZ   LYS  19          3HZ       LYS  19   8.452  19.796   6.789
  173    H    SER  20           H        SER  20   5.561  19.031   2.480
  174    HA   SER  20           HA       SER  20   4.808  16.580   1.823
  175   1HB   SER  20          1HB       SER  20   6.669  17.784   0.758
  176   2HB   SER  20          2HB       SER  20   7.736  17.088   2.004
  177    HG   SER  20           HG       SER  20   7.063  15.018   1.286
  178    H    ASN  21           H        ASN  21   4.855  14.537   2.612
  179    HA   ASN  21           HA       ASN  21   5.873  14.045   5.370
  180   1HB   ASN  21          1HB       ASN  21   3.442  14.774   4.703
  181   2HB   ASN  21          2HB       ASN  21   3.245  13.090   4.274
  182   1HD2  ASN  21          2HD2      ASN  21   4.504  15.272   6.827
  183   2HD2  ASN  21          1HD2      ASN  21   3.883  14.382   8.198
  184    H    PHE  22           H        PHE  22   4.413  11.333   5.236
  185    HA   PHE  22           HA       PHE  22   5.596   9.938   3.029
  186   1HB   PHE  22          1HB       PHE  22   7.128  10.027   5.498
  187   2HB   PHE  22          2HB       PHE  22   6.636   8.378   5.152
  188    HD1  PHE  22           HD1      PHE  22   7.048   7.402   2.815
  189    HD2  PHE  22           HD2      PHE  22   8.977  10.975   4.264
  190    HE1  PHE  22           HE1      PHE  22   8.757   7.218   1.019
  191    HE2  PHE  22           HE2      PHE  22  10.685  10.773   2.484
  192    HZ   PHE  22           HZ       PHE  22  10.570   8.903   0.851
  193    H    LEU  23           H        LEU  23   4.170   8.541   2.412
  194    HA   LEU  23           HA       LEU  23   2.248   7.257   4.284
  195   1HB   LEU  23          1HB       LEU  23   1.256   8.720   2.663
  196   2HB   LEU  23          2HB       LEU  23   2.143   7.951   1.337
  197    HG   LEU  23           HG       LEU  23   0.741   5.911   1.742
  198   1HD1  LEU  23          1HD1      LEU  23  -0.600   7.735   3.795
  199   2HD1  LEU  23          2HD1      LEU  23  -1.247   6.177   3.222
  200   3HD1  LEU  23          3HD1      LEU  23   0.250   6.219   4.153
  201   1HD2  LEU  23          1HD2      LEU  23  -0.858   8.516   1.476
  202   2HD2  LEU  23          2HD2      LEU  23   0.067   7.787   0.162
  203   3HD2  LEU  23          3HD2      LEU  23  -1.329   6.926   0.841
  204    H    ASN  24           H        ASN  24   2.007   5.033   4.232
  205    HA   ASN  24           HA       ASN  24   4.052   3.426   2.749
  206   1HB   ASN  24          1HB       ASN  24   3.418   3.446   5.701
  207   2HB   ASN  24          2HB       ASN  24   4.495   2.312   4.882
  208   1HD2  ASN  24          2HD2      ASN  24   6.642   2.843   4.891
  209   2HD2  ASN  24          1HD2      ASN  24   7.275   4.448   5.193
  210    H    CYS  25           H        CYS  25   2.657   2.231   1.466
  211    HA   CYS  25           HA       CYS  25   0.244   1.004   2.660
  212   1HB   CYS  25          1HB       CYS  25   1.361   0.681  -0.150
  213   2HB   CYS  25          2HB       CYS  25  -0.250   0.259   0.412
  214    H    TYR  26           H        TYR  26   1.893  -0.217   4.205
  215    HA   TYR  26           HA       TYR  26   3.654  -2.146   2.961
  216   1HB   TYR  26          1HB       TYR  26   4.164  -1.186   5.123
  217   2HB   TYR  26          2HB       TYR  26   2.652  -1.739   5.781
  218    HD1  TYR  26           HD1      TYR  26   5.032  -3.781   3.680
  219    HD2  TYR  26           HD2      TYR  26   3.560  -2.985   7.643
  220    HE1  TYR  26           HE1      TYR  26   5.866  -5.972   4.417
  221    HE2  TYR  26           HE2      TYR  26   4.339  -5.216   8.376
  222    HH   TYR  26           HH       TYR  26   5.366  -7.193   7.750
  223    H    VAL  27           H        VAL  27   3.235  -4.305   2.445
  224    HA   VAL  27           HA       VAL  27   0.684  -5.467   3.392
  225    HB   VAL  27           HB       VAL  27   1.674  -5.934   0.550
  226   1HG1  VAL  27          1HG1      VAL  27   0.080  -7.583   1.737
  227   2HG1  VAL  27          2HG1      VAL  27  -1.088  -6.264   1.804
  228   3HG1  VAL  27          3HG1      VAL  27  -0.517  -6.869   0.233
  229   1HG2  VAL  27          1HG2      VAL  27  -0.354  -3.934   1.521
  230   2HG2  VAL  27          2HG2      VAL  27   1.121  -3.601   0.594
  231   3HG2  VAL  27          3HG2      VAL  27  -0.199  -4.502  -0.169
  232    H    SER  28           H        SER  28   0.841  -7.619   3.931
  233    HA   SER  28           HA       SER  28   3.015  -9.216   2.971
  234   1HB   SER  28          1HB       SER  28   3.835  -9.930   5.221
  235   2HB   SER  28          2HB       SER  28   4.197  -8.244   4.978
  236    HG   SER  28           HG       SER  28   2.201  -7.813   6.145
  237    H    GLY  29           H        GLY  29   2.821 -11.520   4.190
  238   1HA   GLY  29          1HA       GLY  29   1.407 -13.130   5.155
  239   2HA   GLY  29          2HA       GLY  29  -0.019 -12.159   4.791
  240    H    PHE  30           H        PHE  30   0.440 -11.585   2.084
  241    HA   PHE  30           HA       PHE  30  -0.888 -13.748   0.951
  242   1HB   PHE  30          1HB       PHE  30  -0.735 -12.482  -1.144
  243   2HB   PHE  30          2HB       PHE  30  -1.188 -11.496   0.187
  244    HD1  PHE  30           HD1      PHE  30   0.314  -9.648   1.006
  245    HD2  PHE  30           HD2      PHE  30   1.516 -12.291  -2.186
  246    HE1  PHE  30           HE1      PHE  30   2.279  -8.227   0.545
  247    HE2  PHE  30           HE2      PHE  30   3.406 -10.796  -2.709
  248    HZ   PHE  30           HZ       PHE  30   3.830  -8.806  -1.302
  249    H    HIS  31           H        HIS  31  -0.381 -14.865  -1.081
  250    HA   HIS  31           HA       HIS  31   2.196 -15.038  -2.175
  251   1HB   HIS  31          1HB       HIS  31   3.093 -17.020  -1.574
  252   2HB   HIS  31          2HB       HIS  31   2.368 -16.598  -0.041
  253    HD2  HIS  31           HD2      HIS  31   1.332 -18.788  -3.192
  254    HE1  HIS  31           HE1      HIS  31   0.357 -20.852   0.357
  255    HE2  HIS  31           HE2      HIS  31   0.316 -20.980  -2.190
  256    HA   PRO  32           HA       PRO  32   2.942 -16.838  -3.871
  257   1HB   PRO  32          1HB       PRO  32   3.067 -17.134  -6.569
  258   2HB   PRO  32          2HB       PRO  32   2.199 -18.288  -5.536
  259   1HG   PRO  32          1HG       PRO  32   1.017 -15.899  -6.979
  260   2HG   PRO  32          2HG       PRO  32   0.529 -17.614  -7.159
  261   1HD   PRO  32          1HD       PRO  32  -0.754 -15.975  -5.415
  262   2HD   PRO  32          2HD       PRO  32  -0.407 -17.667  -4.975
  263    H    SER  33           H        SER  33   4.302 -15.783  -6.104
  264    HA   SER  33           HA       SER  33   5.077 -13.379  -4.785
  265   1HB   SER  33          1HB       SER  33   7.077 -13.652  -6.216
  266   2HB   SER  33          2HB       SER  33   6.594 -15.219  -5.564
  267    HG   SER  33           HG       SER  33   5.512 -15.624  -7.545
  268    H    ASP  34           H        ASP  34   2.532 -12.982  -6.288
  269    HA   ASP  34           HA       ASP  34   3.420 -11.020  -8.388
  270   1HB   ASP  34          1HB       ASP  34   2.732 -13.202  -9.234
  271   2HB   ASP  34          2HB       ASP  34   1.145 -13.001  -8.502
  272    H    ILE  35           H        ILE  35   3.095  -9.225  -6.861
  273    HA   ILE  35           HA       ILE  35   0.232  -8.438  -6.823
  274    HB   ILE  35           HB       ILE  35   0.958  -9.150  -4.665
  275   1HG1  ILE  35          1HG1      ILE  35   0.572  -6.155  -4.519
  276   2HG1  ILE  35          2HG1      ILE  35  -0.731  -7.259  -4.887
  277   1HG2  ILE  35          1HG2      ILE  35   2.880  -6.843  -4.701
  278   2HG2  ILE  35          2HG2      ILE  35   2.550  -7.951  -3.348
  279   3HG2  ILE  35          3HG2      ILE  35   3.313  -8.584  -4.810
  280   1HD1  ILE  35          1HD1      ILE  35  -0.143  -8.517  -2.734
  281   2HD1  ILE  35          2HD1      ILE  35   0.858  -7.134  -2.306
  282   3HD1  ILE  35          3HD1      ILE  35  -0.870  -6.901  -2.562
  283    H    GLU  36           H        GLU  36  -0.255  -6.283  -6.979
  284    HA   GLU  36           HA       GLU  36   1.789  -4.392  -8.009
  285   1HB   GLU  36          1HB       GLU  36  -1.058  -4.563  -9.023
  286   2HB   GLU  36          2HB       GLU  36   0.344  -3.723  -9.704
  287   1HG   GLU  36          1HG       GLU  36   1.384  -6.075  -9.942
  288   2HG   GLU  36          2HG       GLU  36  -0.223  -6.697  -9.605
  289    H    VAL  37           H        VAL  37   1.712  -2.422  -6.945
  290    HA   VAL  37           HA       VAL  37  -0.718  -1.612  -5.470
  291    HB   VAL  37           HB       VAL  37   2.035  -1.914  -4.219
  292   1HG1  VAL  37          1HG1      VAL  37   0.626  -0.030  -3.231
  293   2HG1  VAL  37          2HG1      VAL  37  -0.548  -1.280  -2.756
  294   3HG1  VAL  37          3HG1      VAL  37   1.095  -1.320  -2.113
  295   1HG2  VAL  37          1HG2      VAL  37  -0.494  -3.582  -3.982
  296   2HG2  VAL  37          2HG2      VAL  37   1.164  -4.094  -4.394
  297   3HG2  VAL  37          3HG2      VAL  37   0.755  -3.598  -2.742
  298    H    ASP  38           H        ASP  38  -1.043   0.145  -6.784
  299    HA   ASP  38           HA       ASP  38   1.067   2.246  -6.928
  300   1HB   ASP  38          1HB       ASP  38  -1.761   2.198  -8.107
  301   2HB   ASP  38          2HB       ASP  38  -0.628   3.532  -8.186
  302    H    LEU  39           H        LEU  39   0.522   4.359  -6.081
  303    HA   LEU  39           HA       LEU  39  -1.540   4.410  -3.915
  304   1HB   LEU  39          1HB       LEU  39   0.963   6.048  -4.410
  305   2HB   LEU  39          2HB       LEU  39  -0.328   6.507  -3.274
  306    HG   LEU  39           HG       LEU  39   0.225   3.835  -2.618
  307   1HD1  LEU  39          1HD1      LEU  39   2.870   5.249  -3.099
  308   2HD1  LEU  39          2HD1      LEU  39   2.635   3.674  -2.314
  309   3HD1  LEU  39          3HD1      LEU  39   2.241   3.875  -4.031
  310   1HD2  LEU  39          1HD2      LEU  39  -0.279   5.473  -0.971
  311   2HD2  LEU  39          2HD2      LEU  39   1.388   4.962  -0.603
  312   3HD2  LEU  39          3HD2      LEU  39   1.079   6.494  -1.430
  313    H    LEU  40           H        LEU  40  -3.087   6.062  -4.042
  314    HA   LEU  40           HA       LEU  40  -3.335   7.503  -6.600
  315   1HB   LEU  40          1HB       LEU  40  -4.061   4.899  -6.571
  316   2HB   LEU  40          2HB       LEU  40  -5.510   5.575  -5.849
  317    HG   LEU  40           HG       LEU  40  -5.802   5.274  -8.206
  318   1HD1  LEU  40          1HD1      LEU  40  -6.837   7.307  -7.198
  319   2HD1  LEU  40          2HD1      LEU  40  -5.444   8.263  -7.757
  320   3HD1  LEU  40          3HD1      LEU  40  -6.502   7.467  -8.933
  321   1HD2  LEU  40          1HD2      LEU  40  -3.365   5.352  -8.796
  322   2HD2  LEU  40          2HD2      LEU  40  -4.418   6.238  -9.916
  323   3HD2  LEU  40          3HD2      LEU  40  -3.449   7.125  -8.734
  324    H    LYS  41           H        LYS  41  -4.022   9.522  -5.995
  325    HA   LYS  41           HA       LYS  41  -5.408   9.920  -3.528
  326   1HB   LYS  41          1HB       LYS  41  -4.796  11.771  -5.837
  327   2HB   LYS  41          2HB       LYS  41  -5.150  12.272  -4.158
  328   1HG   LYS  41          1HG       LYS  41  -3.165  11.699  -3.369
  329   2HG   LYS  41          2HG       LYS  41  -2.794  10.433  -4.535
  330   1HD   LYS  41          1HD       LYS  41  -1.407  12.295  -4.966
  331   2HD   LYS  41          2HD       LYS  41  -2.497  12.101  -6.331
  332   1HE   LYS  41          1HE       LYS  41  -3.918  13.888  -5.640
  333   2HE   LYS  41          2HE       LYS  41  -3.115  14.000  -4.059
  334   1HZ   LYS  41          1HZ       LYS  41  -1.889  14.638  -6.662
  335   2HZ   LYS  41          2HZ       LYS  41  -2.433  15.735  -5.563
  336   3HZ   LYS  41          3HZ       LYS  41  -1.154  14.768  -5.189
  337    H    ASN  42           H        ASN  42  -6.837  12.188  -5.012
  338    HA   ASN  42           HA       ASN  42  -9.493  11.188  -5.364
  339   1HB   ASN  42          1HB       ASN  42  -9.697  13.462  -6.628
  340   2HB   ASN  42          2HB       ASN  42  -9.232  13.519  -4.927
  341   1HD2  ASN  42          2HD2      ASN  42  -7.749  13.544  -8.228
  342   2HD2  ASN  42          1HD2      ASN  42  -6.351  14.482  -7.742
  343    H    GLY  43           H        GLY  43  -6.768  11.581  -7.654
  344   1HA   GLY  43          1HA       GLY  43  -7.692   9.534  -9.364
  345   2HA   GLY  43          2HA       GLY  43  -8.303  11.070 -10.006
  346    H    GLU  44           H        GLU  44  -5.239  10.399  -8.307
  347    HA   GLU  44           HA       GLU  44  -3.573  10.693 -10.705
  348   1HB   GLU  44          1HB       GLU  44  -4.210  13.014 -10.055
  349   2HB   GLU  44          2HB       GLU  44  -3.638  12.717  -8.410
  350   1HG   GLU  44          1HG       GLU  44  -1.330  12.361  -9.305
  351   2HG   GLU  44          2HG       GLU  44  -1.935  12.681 -10.940
  352    H    ARG  45           H        ARG  45  -1.535   9.726 -10.316
  353    HA   ARG  45           HA       ARG  45  -1.202   8.487  -7.633
  354   1HB   ARG  45          1HB       ARG  45   0.201   6.875  -8.555
  355   2HB   ARG  45          2HB       ARG  45  -1.275   6.924  -9.519
  356   1HG   ARG  45          1HG       ARG  45  -0.037   8.163 -11.298
  357   2HG   ARG  45          2HG       ARG  45   1.432   8.098 -10.291
  358   1HD   ARG  45          1HD       ARG  45   1.204   5.592 -10.206
  359   2HD   ARG  45          2HD       ARG  45  -0.140   5.706 -11.360
  360    HE   ARG  45           HE       ARG  45   2.010   7.062 -12.524
  361   1HH1  ARG  45          1HH2      ARG  45   1.341   3.721 -11.411
  362   2HH1  ARG  45          2HH2      ARG  45   2.427   3.013 -12.569
  363   1HH2  ARG  45          1HH1      ARG  45   3.508   6.071 -13.956
  364   2HH2  ARG  45          2HH1      ARG  45   3.681   4.335 -13.982
  365    H    ILE  46           H        ILE  46   1.110   8.187  -6.901
  366    HA   ILE  46           HA       ILE  46   2.042  10.841  -6.457
  367    HB   ILE  46           HB       ILE  46   3.037   8.182  -5.364
  368   1HG1  ILE  46          1HG1      ILE  46   0.511   8.164  -5.129
  369   2HG1  ILE  46          2HG1      ILE  46   1.429   8.133  -3.640
  370   1HG2  ILE  46          1HG2      ILE  46   2.934  11.031  -4.356
  371   2HG2  ILE  46          2HG2      ILE  46   3.257   9.649  -3.289
  372   3HG2  ILE  46          3HG2      ILE  46   4.361   9.998  -4.638
  373   1HD1  ILE  46          1HD1      ILE  46   0.370  10.758  -4.687
  374   2HD1  ILE  46          2HD1      ILE  46  -0.601   9.639  -3.716
  375   3HD1  ILE  46          3HD1      ILE  46   0.928  10.267  -3.059
  376    H    GLU  47           H        GLU  47   4.361  11.257  -6.410
  377    HA   GLU  47           HA       GLU  47   5.674  10.532  -8.893
  378   1HB   GLU  47          1HB       GLU  47   6.555  12.252  -6.536
  379   2HB   GLU  47          2HB       GLU  47   7.511  11.983  -8.006
  380   1HG   GLU  47          1HG       GLU  47   5.646  12.887  -9.381
  381   2HG   GLU  47          2HG       GLU  47   4.729  13.235  -7.907
  382    H    LYS  48           H        LYS  48   7.202  10.409  -5.609
  383    HA   LYS  48           HA       LYS  48   8.927   8.263  -6.645
  384   1HB   LYS  48          1HB       LYS  48   8.992   9.847  -4.068
  385   2HB   LYS  48          2HB       LYS  48  10.148   8.605  -4.528
  386   1HG   LYS  48          1HG       LYS  48  10.701   9.957  -6.603
  387   2HG   LYS  48          2HG       LYS  48   9.577  11.191  -6.019
  388   1HD   LYS  48          1HD       LYS  48  11.550  12.058  -5.266
  389   2HD   LYS  48          2HD       LYS  48  11.026  11.178  -3.833
  390   1HE   LYS  48          1HE       LYS  48  13.082  10.237  -5.909
  391   2HE   LYS  48          2HE       LYS  48  13.443  10.920  -4.319
  392   1HZ   LYS  48          1HZ       LYS  48  12.216   9.035  -3.369
  393   2HZ   LYS  48          2HZ       LYS  48  12.135   8.361  -4.869
  394   3HZ   LYS  48          3HZ       LYS  48  13.597   8.610  -4.159
  395    H    VAL  49           H        VAL  49   6.939   6.829  -6.744
  396    HA   VAL  49           HA       VAL  49   6.263   5.469  -4.220
  397    HB   VAL  49           HB       VAL  49   5.761   4.618  -7.103
  398   1HG1  VAL  49          1HG1      VAL  49   4.735   3.585  -4.416
  399   2HG1  VAL  49          2HG1      VAL  49   4.082   3.101  -5.995
  400   3HG1  VAL  49          3HG1      VAL  49   5.748   2.694  -5.567
  401   1HG2  VAL  49          1HG2      VAL  49   3.978   6.018  -5.072
  402   2HG2  VAL  49          2HG2      VAL  49   4.546   6.680  -6.622
  403   3HG2  VAL  49          3HG2      VAL  49   3.414   5.320  -6.603
  404    H    GLU  50           H        GLU  50   8.145   4.727  -3.270
  405    HA   GLU  50           HA       GLU  50  10.035   3.102  -4.908
  406   1HB   GLU  50          1HB       GLU  50  10.772   5.218  -3.593
  407   2HB   GLU  50          2HB       GLU  50  10.533   4.217  -2.148
  408   1HG   GLU  50          1HG       GLU  50  12.132   2.562  -3.017
  409   2HG   GLU  50          2HG       GLU  50  12.375   3.569  -4.459
  410    H    HIS  51           H        HIS  51  10.520   0.964  -4.067
  411    HA   HIS  51           HA       HIS  51   9.107   0.134  -1.670
  412   1HB   HIS  51          1HB       HIS  51   7.822  -1.660  -2.730
  413   2HB   HIS  51          2HB       HIS  51   7.332  -0.090  -3.366
  414    HD2  HIS  51           HD2      HIS  51   8.278   0.486  -6.023
  415    HE1  HIS  51           HE1      HIS  51   8.778  -3.620  -6.921
  416    HE2  HIS  51           HE2      HIS  51   8.639  -1.276  -7.928
  417    H    SER  52           H        SER  52   9.654  -1.887  -0.885
  418    HA   SER  52           HA       SER  52  12.424  -2.622  -1.269
  419   1HB   SER  52          1HB       SER  52  11.213  -2.821   0.912
  420   2HB   SER  52          2HB       SER  52  10.171  -4.069   0.195
  421    HG   SER  52           HG       SER  52  11.971  -5.370  -0.083
  422    H    ASP  53           H        ASP  53  13.183  -4.708  -1.973
  423    HA   ASP  53           HA       ASP  53  12.063  -5.779  -4.360
  424   1HB   ASP  53          1HB       ASP  53  14.437  -6.012  -3.744
  425   2HB   ASP  53          2HB       ASP  53  13.992  -6.954  -2.311
  426    H    LEU  54           H        LEU  54  10.985  -7.828  -4.665
  427    HA   LEU  54           HA       LEU  54   8.910  -8.353  -2.750
  428   1HB   LEU  54          1HB       LEU  54   8.505  -8.605  -5.080
  429   2HB   LEU  54          2HB       LEU  54   9.706  -9.908  -5.191
  430    HG   LEU  54           HG       LEU  54   8.406 -11.300  -3.640
  431   1HD1  LEU  54          1HD1      LEU  54   6.462  -8.942  -3.502
  432   2HD1  LEU  54          2HD1      LEU  54   6.053 -10.588  -3.007
  433   3HD1  LEU  54          3HD1      LEU  54   7.298  -9.712  -2.131
  434   1HD2  LEU  54          1HD2      LEU  54   6.706 -10.045  -5.796
  435   2HD2  LEU  54          2HD2      LEU  54   7.913 -11.351  -6.008
  436   3HD2  LEU  54          3HD2      LEU  54   6.456 -11.628  -5.015
  437    H    SER  55           H        SER  55   9.367  -9.276  -0.831
  438    HA   SER  55           HA       SER  55  11.407 -11.421  -0.567
  439   1HB   SER  55          1HB       SER  55  10.911  -8.808   0.933
  440   2HB   SER  55          2HB       SER  55  11.925 -10.118   1.530
  441    HG   SER  55           HG       SER  55  13.035  -8.432   0.296
  442    H    PHE  56           H        PHE  56   9.953 -13.123  -0.191
  443    HA   PHE  56           HA       PHE  56   8.122 -12.977   2.095
  444   1HB   PHE  56          1HB       PHE  56   7.709 -15.163   1.835
  445   2HB   PHE  56          2HB       PHE  56   7.995 -14.684   0.160
  446    HD1  PHE  56           HD1      PHE  56   8.336 -17.315   2.238
  447    HD2  PHE  56           HD2      PHE  56  10.772 -14.905  -0.379
  448    HE1  PHE  56           HE1      PHE  56   9.945 -19.197   1.989
  449    HE2  PHE  56           HE2      PHE  56  12.495 -16.701  -0.412
  450    HZ   PHE  56           HZ       PHE  56  12.023 -18.885   0.668
  451    H    SER  57           H        SER  57   8.632 -14.379   4.040
  452    HA   SER  57           HA       SER  57  11.400 -14.027   5.028
  453   1HB   SER  57          1HB       SER  57   9.529 -13.653   6.562
  454   2HB   SER  57          2HB       SER  57   8.875 -15.260   6.209
  455    HG   SER  57           HG       SER  57  10.036 -15.745   7.901
  456    H    LYS  58           H        LYS  58  10.629 -16.890   6.272
  457    HA   LYS  58           HA       LYS  58  11.302 -18.630   3.939
  458   1HB   LYS  58          1HB       LYS  58  11.474 -18.990   6.912
  459   2HB   LYS  58          2HB       LYS  58  11.742 -20.276   5.715
  460   1HG   LYS  58          1HG       LYS  58  13.483 -18.976   4.608
  461   2HG   LYS  58          2HG       LYS  58  13.252 -17.624   5.731
  462   1HD   LYS  58          1HD       LYS  58  13.849 -19.103   7.645
  463   2HD   LYS  58          2HD       LYS  58  14.134 -20.442   6.522
  464   1HE   LYS  58          1HE       LYS  58  15.648 -17.785   6.589
  465   2HE   LYS  58          2HE       LYS  58  16.243 -19.342   7.188
  466   1HZ   LYS  58          1HZ       LYS  58  16.119 -20.190   4.966
  467   2HZ   LYS  58          2HZ       LYS  58  15.558 -18.747   4.397
  468   3HZ   LYS  58          3HZ       LYS  58  17.080 -18.851   5.016
  469    H    ASP  59           H        ASP  59   8.652 -17.594   5.905
  470    HA   ASP  59           HA       ASP  59   7.657 -20.234   6.318
  471   1HB   ASP  59          1HB       ASP  59   6.511 -17.576   7.254
  472   2HB   ASP  59          2HB       ASP  59   6.282 -19.165   7.999
  473    H    TRP  60           H        TRP  60   7.404 -19.771   3.649
  474    HA   TRP  60           HA       TRP  60   6.041 -19.725   1.858
  475   1HB   TRP  60          1HB       TRP  60   4.110 -21.062   3.765
  476   2HB   TRP  60          2HB       TRP  60   4.164 -21.222   2.008
  477    HD1  TRP  60           HD1      TRP  60   5.963 -22.248   5.183
  478    HE1  TRP  60           HE1      TRP  60   7.575 -24.221   4.728
  479    HE3  TRP  60           HE3      TRP  60   5.627 -22.427   0.080
  480    HZ2  TRP  60           HZ2      TRP  60   8.579 -25.645   2.471
  481    HZ3  TRP  60           HZ3      TRP  60   6.941 -24.094  -1.195
  482    HH2  TRP  60           HH2      TRP  60   8.411 -25.711  -0.014
  483    H    SER  61           H        SER  61   6.020 -17.348   2.101
  484    HA   SER  61           HA       SER  61   3.302 -16.232   2.112
  485   1HB   SER  61          1HB       SER  61   4.147 -16.180   4.504
  486   2HB   SER  61          2HB       SER  61   5.493 -15.166   3.953
  487    HG   SER  61           HG       SER  61   2.721 -14.595   3.685
  488    H    PHE  62           H        PHE  62   4.184 -13.560   2.093
  489    HA   PHE  62           HA       PHE  62   6.512 -13.028   0.584
  490   1HB   PHE  62          1HB       PHE  62   3.914 -13.159  -0.970
  491   2HB   PHE  62          2HB       PHE  62   4.990 -11.796  -1.245
  492    HD1  PHE  62           HD1      PHE  62   7.489 -12.218  -1.612
  493    HD2  PHE  62           HD2      PHE  62   4.396 -15.147  -2.221
  494    HE1  PHE  62           HE1      PHE  62   9.112 -13.683  -2.695
  495    HE2  PHE  62           HE2      PHE  62   6.020 -16.673  -3.222
  496    HZ   PHE  62           HZ       PHE  62   8.392 -15.935  -3.564
  497    H    TYR  63           H        TYR  63   6.849 -10.765   0.377
  498    HA   TYR  63           HA       TYR  63   4.818  -8.857   0.972
  499   1HB   TYR  63          1HB       TYR  63   5.698  -7.952   3.140
  500   2HB   TYR  63          2HB       TYR  63   4.992  -9.549   3.259
  501    HD1  TYR  63           HD1      TYR  63   6.053 -11.453   4.009
  502    HD2  TYR  63           HD2      TYR  63   8.114  -7.725   3.404
  503    HE1  TYR  63           HE1      TYR  63   7.872 -12.245   5.417
  504    HE2  TYR  63           HE2      TYR  63   9.989  -8.503   4.741
  505    HH   TYR  63           HH       TYR  63  10.890 -10.326   5.967
  506    H    LEU  64           H        LEU  64   5.763  -6.718   1.472
  507    HA   LEU  64           HA       LEU  64   8.403  -5.946   0.974
  508   1HB   LEU  64          1HB       LEU  64   8.289  -4.968  -1.242
  509   2HB   LEU  64          2HB       LEU  64   8.115  -6.707  -1.348
  510    HG   LEU  64           HG       LEU  64   5.962  -4.603  -1.653
  511   1HD1  LEU  64          1HD1      LEU  64   7.010  -6.644  -3.662
  512   2HD1  LEU  64          2HD1      LEU  64   5.757  -5.439  -3.961
  513   3HD1  LEU  64          3HD1      LEU  64   7.416  -4.910  -3.646
  514   1HD2  LEU  64          1HD2      LEU  64   5.741  -7.629  -1.610
  515   2HD2  LEU  64          2HD2      LEU  64   4.734  -6.445  -0.720
  516   3HD2  LEU  64          3HD2      LEU  64   4.566  -6.646  -2.468
  517    H    LEU  65           H        LEU  65   8.533  -3.586   1.166
  518    HA   LEU  65           HA       LEU  65   6.044  -2.375   2.240
  519   1HB   LEU  65          1HB       LEU  65   8.297  -2.856   3.547
  520   2HB   LEU  65          2HB       LEU  65   8.855  -1.406   2.712
  521    HG   LEU  65           HG       LEU  65   6.512  -1.718   4.648
  522   1HD1  LEU  65          1HD1      LEU  65   9.075  -0.096   4.731
  523   2HD1  LEU  65          2HD1      LEU  65   7.852  -0.210   6.016
  524   3HD1  LEU  65          3HD1      LEU  65   8.798  -1.643   5.564
  525   1HD2  LEU  65          1HD2      LEU  65   7.217   0.595   2.829
  526   2HD2  LEU  65          2HD2      LEU  65   5.624  -0.087   3.193
  527   3HD2  LEU  65          3HD2      LEU  65   6.464   0.884   4.407
  528    H    TYR  66           H        TYR  66   5.282  -0.550   1.248
  529    HA   TYR  66           HA       TYR  66   6.700   0.386  -1.189
  530   1HB   TYR  66          1HB       TYR  66   3.699   0.088  -0.863
  531   2HB   TYR  66          2HB       TYR  66   4.618   0.271  -2.346
  532    HD1  TYR  66           HD1      TYR  66   4.837  -1.752  -3.664
  533    HD2  TYR  66           HD2      TYR  66   4.180  -2.134   0.596
  534    HE1  TYR  66           HE1      TYR  66   3.766  -3.952  -3.986
  535    HE2  TYR  66           HE2      TYR  66   3.241  -4.342   0.248
  536    HH   TYR  66           HH       TYR  66   2.416  -5.557  -3.013
  537    H    TYR  67           H        TYR  67   7.492   2.246  -0.275
  538    HA   TYR  67           HA       TYR  67   5.622   4.049   1.135
  539   1HB   TYR  67          1HB       TYR  67   7.902   5.097   1.844
  540   2HB   TYR  67          2HB       TYR  67   7.105   3.750   2.611
  541    HD1  TYR  67           HD1      TYR  67   8.646   2.216   3.422
  542    HD2  TYR  67           HD2      TYR  67   9.324   4.036  -0.394
  543    HE1  TYR  67           HE1      TYR  67  10.356   0.486   2.903
  544    HE2  TYR  67           HE2      TYR  67  11.041   2.321  -0.925
  545    HH   TYR  67           HH       TYR  67  12.107   0.402  -0.218
  546    H    THR  68           H        THR  68   5.437   6.071   0.639
  547    HA   THR  68           HA       THR  68   6.992   7.342  -1.579
  548    HB   THR  68           HB       THR  68   4.956   6.171  -2.289
  549    HG1  THR  68           HG1      THR  68   4.562   7.808  -3.728
  550   1HG2  THR  68          1HG2      THR  68   2.869   7.399  -2.128
  551   2HG2  THR  68          2HG2      THR  68   3.372   6.839  -0.517
  552   3HG2  THR  68          3HG2      THR  68   3.544   8.553  -0.985
  553    H    GLU  69           H        GLU  69   6.853   9.723  -1.633
  554    HA   GLU  69           HA       GLU  69   6.452  10.949   1.032
  555   1HB   GLU  69          1HB       GLU  69   7.631  12.908  -0.272
  556   2HB   GLU  69          2HB       GLU  69   8.518  11.553   0.411
  557   1HG   GLU  69          1HG       GLU  69   9.356  12.150  -1.789
  558   2HG   GLU  69          2HG       GLU  69   8.789  10.488  -1.738
  559    H    PHE  70           H        PHE  70   4.112  10.747   0.848
  560    HA   PHE  70           HA       PHE  70   2.723  12.367  -1.127
  561   1HB   PHE  70          1HB       PHE  70   0.802  11.566  -0.275
  562   2HB   PHE  70          2HB       PHE  70   1.856  10.239   0.166
  563    HD1  PHE  70           HD1      PHE  70   2.897  10.502   2.625
  564    HD2  PHE  70           HD2      PHE  70  -0.745  12.433   1.345
  565    HE1  PHE  70           HE1      PHE  70   2.178  10.748   4.975
  566    HE2  PHE  70           HE2      PHE  70  -1.142  13.126   3.631
  567    HZ   PHE  70           HZ       PHE  70   0.302  12.265   5.500
  568    H    THR  71           H        THR  71   1.711  14.349  -0.745
  569    HA   THR  71           HA       THR  71   2.558  15.889   1.655
  570    HB   THR  71           HB       THR  71   1.654  16.834  -1.029
  571    HG1  THR  71           HG1      THR  71   3.750  15.889  -0.864
  572   1HG2  THR  71          1HG2      THR  71   2.420  19.044  -0.139
  573   2HG2  THR  71          2HG2      THR  71   0.994  18.455   0.723
  574   3HG2  THR  71          3HG2      THR  71   2.599  18.319   1.471
  575    HA   PRO  72           HA       PRO  72  -2.006  15.756   2.592
  576   1HB   PRO  72          1HB       PRO  72  -1.719  16.533   5.244
  577   2HB   PRO  72          2HB       PRO  72  -1.726  14.858   4.699
  578   1HG   PRO  72          1HG       PRO  72   0.578  16.552   5.525
  579   2HG   PRO  72          2HG       PRO  72   0.435  14.781   5.587
  580   1HD   PRO  72          1HD       PRO  72   1.832  16.334   3.684
  581   2HD   PRO  72          2HD       PRO  72   1.449  14.597   3.515
  582    H    THR  73           H        THR  73  -2.585  17.602   1.440
  583    HA   THR  73           HA       THR  73  -1.899  20.310   2.469
  584    HB   THR  73           HB       THR  73  -1.754  19.949   0.115
  585    HG1  THR  73           HG1      THR  73  -2.182  21.967   0.953
  586   1HG2  THR  73          1HG2      THR  73  -4.747  19.425   0.290
  587   2HG2  THR  73          2HG2      THR  73  -3.885  19.922  -1.182
  588   3HG2  THR  73          3HG2      THR  73  -3.465  18.389  -0.387
  589    H    GLU  74           H        GLU  74  -4.434  21.352   1.811
  590    HA   GLU  74           HA       GLU  74  -5.835  21.030   4.282
  591   1HB   GLU  74          1HB       GLU  74  -5.783  23.118   2.962
  592   2HB   GLU  74          2HB       GLU  74  -6.719  22.347   1.678
  593   1HG   GLU  74          1HG       GLU  74  -8.584  21.986   3.382
  594   2HG   GLU  74          2HG       GLU  74  -7.624  22.933   4.530
  595    H    LYS  75           H        LYS  75  -7.198  20.378   1.017
  596    HA   LYS  75           HA       LYS  75  -9.069  18.418   2.294
  597   1HB   LYS  75          1HB       LYS  75 -10.638  19.162   0.510
  598   2HB   LYS  75          2HB       LYS  75 -10.216  20.407   1.681
  599   1HG   LYS  75          1HG       LYS  75  -8.860  21.597   0.223
  600   2HG   LYS  75          2HG       LYS  75  -8.598  20.247  -0.880
  601   1HD   LYS  75          1HD       LYS  75 -11.438  21.187  -0.591
  602   2HD   LYS  75          2HD       LYS  75 -10.300  22.307  -1.348
  603   1HE   LYS  75          1HE       LYS  75 -11.329  20.976  -3.088
  604   2HE   LYS  75          2HE       LYS  75  -9.610  20.577  -2.978
  605   1HZ   LYS  75          1HZ       LYS  75 -11.823  19.009  -1.850
  606   2HZ   LYS  75          2HZ       LYS  75 -10.941  18.627  -3.188
  607   3HZ   LYS  75          3HZ       LYS  75 -10.225  18.628  -1.703
  608    H    ASP  76           H        ASP  76  -6.725  17.280   1.555
  609    HA   ASP  76           HA       ASP  76  -7.218  15.969  -1.076
  610   1HB   ASP  76          1HB       ASP  76  -5.064  14.956  -0.733
  611   2HB   ASP  76          2HB       ASP  76  -4.956  16.711  -0.620
  612    H    GLU  77           H        GLU  77  -6.896  13.609  -1.166
  613    HA   GLU  77           HA       GLU  77  -7.399  12.034   1.247
  614   1HB   GLU  77          1HB       GLU  77  -9.662  12.690   0.320
  615   2HB   GLU  77          2HB       GLU  77  -9.244  11.853  -1.182
  616   1HG   GLU  77          1HG       GLU  77  -8.962   9.736   0.107
  617   2HG   GLU  77          2HG       GLU  77  -9.375  10.599   1.599
  618    H    TYR  78           H        TYR  78  -5.841  10.500   1.102
  619    HA   TYR  78           HA       TYR  78  -4.883   9.559  -1.567
  620   1HB   TYR  78          1HB       TYR  78  -3.405   9.882   1.034
  621   2HB   TYR  78          2HB       TYR  78  -2.828   8.901  -0.298
  622    HD1  TYR  78           HD1      TYR  78  -4.144  12.406   0.258
  623    HD2  TYR  78           HD2      TYR  78  -1.181   9.903  -1.608
  624    HE1  TYR  78           HE1      TYR  78  -2.980  14.414  -0.625
  625    HE2  TYR  78           HE2      TYR  78  -0.145  11.961  -2.610
  626    HH   TYR  78           HH       TYR  78  -0.065  14.198  -2.655
  627    H    ALA  79           H        ALA  79  -4.486   7.357  -1.858
  628    HA   ALA  79           HA       ALA  79  -5.315   5.425   0.187
  629   1HB   ALA  79          1HB       ALA  79  -6.740   5.671  -2.504
  630   2HB   ALA  79          2HB       ALA  79  -7.007   4.400  -1.298
  631   3HB   ALA  79          3HB       ALA  79  -7.454   6.078  -0.931
  632    H    CYS  80           H        CYS  80  -5.099   3.176  -0.692
  633    HA   CYS  80           HA       CYS  80  -2.704   2.907  -2.467
  634   1HB   CYS  80          1HB       CYS  80  -3.649   1.153  -0.176
  635   2HB   CYS  80          2HB       CYS  80  -2.184   0.937  -1.130
  636    H    ARG  81           H        ARG  81  -3.301   2.018  -4.409
  637    HA   ARG  81           HA       ARG  81  -5.594   0.233  -4.786
  638   1HB   ARG  81          1HB       ARG  81  -4.779   1.488  -6.695
  639   2HB   ARG  81          2HB       ARG  81  -3.135   0.900  -6.422
  640   1HG   ARG  81          1HG       ARG  81  -4.052  -1.473  -6.846
  641   2HG   ARG  81          2HG       ARG  81  -5.529  -0.684  -7.416
  642   1HD   ARG  81          1HD       ARG  81  -4.211   0.452  -9.178
  643   2HD   ARG  81          2HD       ARG  81  -2.709  -0.164  -8.461
  644    HE   ARG  81           HE       ARG  81  -4.779  -2.092  -9.349
  645   1HH1  ARG  81          1HH2      ARG  81  -1.463  -0.804  -9.924
  646   2HH1  ARG  81          2HH2      ARG  81  -1.039  -2.181 -10.901
  647   1HH2  ARG  81          1HH1      ARG  81  -4.156  -3.791 -10.667
  648   2HH2  ARG  81          2HH1      ARG  81  -2.506  -3.924 -11.225
  649    H    VAL  82           H        VAL  82  -5.515  -2.026  -4.266
  650    HA   VAL  82           HA       VAL  82  -2.831  -3.282  -4.112
  651    HB   VAL  82           HB       VAL  82  -5.153  -3.775  -2.200
  652   1HG1  VAL  82          1HG1      VAL  82  -2.360  -4.959  -2.379
  653   2HG1  VAL  82          2HG1      VAL  82  -3.536  -5.265  -1.077
  654   3HG1  VAL  82          3HG1      VAL  82  -3.880  -5.819  -2.723
  655   1HG2  VAL  82          1HG2      VAL  82  -4.003  -1.668  -1.622
  656   2HG2  VAL  82          2HG2      VAL  82  -3.563  -2.935  -0.475
  657   3HG2  VAL  82          3HG2      VAL  82  -2.425  -2.478  -1.754
  658    H    ASN  83           H        ASN  83  -2.719  -4.635  -5.742
  659    HA   ASN  83           HA       ASN  83  -5.031  -6.433  -6.372
  660   1HB   ASN  83          1HB       ASN  83  -3.166  -4.936  -8.227
  661   2HB   ASN  83          2HB       ASN  83  -3.934  -6.452  -8.717
  662   1HD2  ASN  83          2HD2      ASN  83  -6.164  -6.582  -9.051
  663   2HD2  ASN  83          1HD2      ASN  83  -7.163  -5.152  -9.177
  664    H    HIS  84           H        HIS  84  -4.007  -8.081  -4.965
  665    HA   HIS  84           HA       HIS  84  -1.340  -9.196  -5.702
  666   1HB   HIS  84          1HB       HIS  84  -2.080  -9.369  -3.391
  667   2HB   HIS  84          2HB       HIS  84  -3.548 -10.178  -3.914
  668    HD2  HIS  84           HD2      HIS  84   0.363 -11.011  -4.111
  669    HE1  HIS  84           HE1      HIS  84  -1.949 -14.555  -3.979
  670    HE2  HIS  84           HE2      HIS  84   0.457 -13.608  -4.047
  671    H    VAL  85           H        VAL  85  -1.402 -11.349  -6.890
  672    HA   VAL  85           HA       VAL  85  -3.139 -11.426  -9.043
  673    HB   VAL  85           HB       VAL  85  -1.019 -12.567  -8.989
  674   1HG1  VAL  85          1HG1      VAL  85  -1.069 -13.608  -6.746
  675   2HG1  VAL  85          2HG1      VAL  85  -2.341 -14.731  -7.287
  676   3HG1  VAL  85          3HG1      VAL  85  -0.732 -14.789  -8.017
  677   1HG2  VAL  85          1HG2      VAL  85  -3.268 -14.505  -9.647
  678   2HG2  VAL  85          2HG2      VAL  85  -2.729 -13.161 -10.678
  679   3HG2  VAL  85          3HG2      VAL  85  -1.625 -14.498 -10.313
  680    H    THR  86           H        THR  86  -3.640 -12.997  -5.867
  681    HA   THR  86           HA       THR  86  -5.906 -14.502  -6.820
  682    HB   THR  86           HB       THR  86  -4.317 -15.053  -4.880
  683    HG1  THR  86           HG1      THR  86  -6.104 -16.261  -5.564
  684   1HG2  THR  86          1HG2      THR  86  -6.512 -13.729  -3.260
  685   2HG2  THR  86          2HG2      THR  86  -4.958 -14.397  -2.706
  686   3HG2  THR  86          3HG2      THR  86  -5.003 -12.872  -3.618
  687    H    LEU  87           H        LEU  87  -5.557 -11.191  -5.667
  688    HA   LEU  87           HA       LEU  87  -8.382 -10.816  -5.020
  689   1HB   LEU  87          1HB       LEU  87  -6.019  -9.004  -5.502
  690   2HB   LEU  87          2HB       LEU  87  -7.635  -8.369  -5.587
  691    HG   LEU  87           HG       LEU  87  -8.175  -8.869  -3.359
  692   1HD1  LEU  87          1HD1      LEU  87  -7.128 -11.057  -3.016
  693   2HD1  LEU  87          2HD1      LEU  87  -5.517 -10.329  -3.125
  694   3HD1  LEU  87          3HD1      LEU  87  -6.595  -9.912  -1.780
  695   1HD2  LEU  87          1HD2      LEU  87  -6.802  -6.847  -3.813
  696   2HD2  LEU  87          2HD2      LEU  87  -6.507  -7.484  -2.183
  697   3HD2  LEU  87          3HD2      LEU  87  -5.328  -7.772  -3.472
  698    H    SER  88           H        SER  88  -9.750 -11.397  -6.589
  699    HA   SER  88           HA       SER  88  -9.371 -10.953  -9.403
  700   1HB   SER  88          1HB       SER  88 -10.826 -12.707  -8.415
  701   2HB   SER  88          2HB       SER  88 -11.916 -11.448  -7.801
  702    HG   SER  88           HG       SER  88 -11.230 -11.809 -10.533
  703    H    GLN  89           H        GLN  89  -9.989  -8.725  -6.864
  704    HA   GLN  89           HA       GLN  89 -11.014  -6.718  -8.765
  705   1HB   GLN  89          1HB       GLN  89 -12.479  -5.823  -6.990
  706   2HB   GLN  89          2HB       GLN  89 -12.984  -7.403  -7.602
  707   1HG   GLN  89          1HG       GLN  89 -12.114  -8.513  -5.612
  708   2HG   GLN  89          2HG       GLN  89 -11.393  -7.003  -5.030
  709   1HE2  GLN  89          2HE2      GLN  89 -14.653  -8.069  -6.214
  710   2HE2  GLN  89          1HE2      GLN  89 -15.532  -7.302  -4.908
  711    HA   PRO  90           HA       PRO  90  -7.618  -4.535  -6.836
  712   1HB   PRO  90          1HB       PRO  90  -8.143  -1.959  -7.587
  713   2HB   PRO  90          2HB       PRO  90  -7.734  -3.186  -8.807
  714   1HG   PRO  90          1HG       PRO  90 -10.505  -2.248  -8.088
  715   2HG   PRO  90          2HG       PRO  90  -9.772  -2.428  -9.703
  716   1HD   PRO  90          1HD       PRO  90 -11.337  -4.370  -8.589
  717   2HD   PRO  90          2HD       PRO  90  -9.936  -4.777  -9.625
  718    H    LYS  91           H        LYS  91  -7.713  -4.511  -4.626
  719    HA   LYS  91           HA       LYS  91  -9.990  -3.298  -3.179
  720   1HB   LYS  91          1HB       LYS  91  -7.466  -4.748  -2.307
  721   2HB   LYS  91          2HB       LYS  91  -8.648  -4.088  -1.178
  722   1HG   LYS  91          1HG       LYS  91  -9.299  -6.151  -3.335
  723   2HG   LYS  91          2HG       LYS  91  -8.838  -6.574  -1.689
  724   1HD   LYS  91          1HD       LYS  91 -11.292  -4.883  -2.358
  725   2HD   LYS  91          2HD       LYS  91 -11.290  -6.634  -2.151
  726   1HE   LYS  91          1HE       LYS  91 -10.414  -6.377   0.164
  727   2HE   LYS  91          2HE       LYS  91 -10.506  -4.613  -0.003
  728   1HZ   LYS  91          1HZ       LYS  91 -12.850  -4.826  -0.356
  729   2HZ   LYS  91          2HZ       LYS  91 -12.769  -6.466  -0.211
  730   3HZ   LYS  91          3HZ       LYS  91 -12.417  -5.505   1.081
  731    H    ILE  92           H        ILE  92  -9.885  -1.075  -3.552
  732    HA   ILE  92           HA       ILE  92  -7.351   0.308  -3.346
  733    HB   ILE  92           HB       ILE  92 -10.073   1.604  -3.519
  734   1HG1  ILE  92          1HG1      ILE  92 -10.035   0.037  -5.368
  735   2HG1  ILE  92          2HG1      ILE  92  -9.851   1.695  -5.918
  736   1HG2  ILE  92          1HG2      ILE  92  -7.217   2.413  -4.247
  737   2HG2  ILE  92          2HG2      ILE  92  -8.665   3.356  -4.657
  738   3HG2  ILE  92          3HG2      ILE  92  -8.224   3.084  -2.961
  739   1HD1  ILE  92          1HD1      ILE  92  -7.632  -0.375  -5.707
  740   2HD1  ILE  92          2HD1      ILE  92  -8.384   0.269  -7.181
  741   3HD1  ILE  92          3HD1      ILE  92  -7.386   1.326  -6.186
  742    H    VAL  93           H        VAL  93  -6.846  -0.452  -1.149
  743    HA   VAL  93           HA       VAL  93  -8.524   0.166   1.099
  744    HB   VAL  93           HB       VAL  93  -5.557  -0.512   1.016
  745   1HG1  VAL  93          1HG1      VAL  93  -7.599  -0.585   3.290
  746   2HG1  VAL  93          2HG1      VAL  93  -5.946  -1.224   3.378
  747   3HG1  VAL  93          3HG1      VAL  93  -6.209   0.512   3.177
  748   1HG2  VAL  93          1HG2      VAL  93  -6.904  -2.311   0.006
  749   2HG2  VAL  93          2HG2      VAL  93  -6.359  -2.796   1.610
  750   3HG2  VAL  93          3HG2      VAL  93  -8.035  -2.264   1.376
  751    H    LYS  94           H        LYS  94  -8.926   2.143   1.838
  752    HA   LYS  94           HA       LYS  94  -7.352   4.424   1.035
  753   1HB   LYS  94          1HB       LYS  94  -9.829   4.298   1.167
  754   2HB   LYS  94          2HB       LYS  94  -9.727   4.250   2.927
  755   1HG   LYS  94          1HG       LYS  94  -8.761   6.435   3.039
  756   2HG   LYS  94          2HG       LYS  94  -8.483   6.522   1.296
  757   1HD   LYS  94          1HD       LYS  94 -11.306   6.183   2.376
  758   2HD   LYS  94          2HD       LYS  94 -10.512   7.759   2.404
  759   1HE   LYS  94          1HE       LYS  94 -11.852   7.648   0.430
  760   2HE   LYS  94          2HE       LYS  94 -10.140   7.678  -0.037
  761   1HZ   LYS  94          1HZ       LYS  94 -10.261   5.366  -0.471
  762   2HZ   LYS  94          2HZ       LYS  94 -11.825   5.282   0.056
  763   3HZ   LYS  94          3HZ       LYS  94 -11.451   6.144  -1.298
  764    H    TRP  95           H        TRP  95  -6.154   5.824   2.339
  765    HA   TRP  95           HA       TRP  95  -4.819   4.632   4.637
  766   1HB   TRP  95          1HB       TRP  95  -3.497   5.888   3.102
  767   2HB   TRP  95          2HB       TRP  95  -4.626   7.229   3.124
  768    HD1  TRP  95           HD1      TRP  95  -2.746   5.610   6.135
  769    HE1  TRP  95           HE1      TRP  95  -1.548   7.506   7.414
  770    HE3  TRP  95           HE3      TRP  95  -3.823   9.515   3.038
  771    HZ2  TRP  95           HZ2      TRP  95  -1.480  10.420   7.323
  772    HZ3  TRP  95           HZ3      TRP  95  -2.967  11.763   3.528
  773    HH2  TRP  95           HH2      TRP  95  -1.989  12.267   5.747
  774    H    ASP  96           H        ASP  96  -5.890   4.548   6.524
  775    HA   ASP  96           HA       ASP  96  -7.750   6.559   7.456
  776   1HB   ASP  96          1HB       ASP  96  -7.563   5.316   9.595
  777   2HB   ASP  96          2HB       ASP  96  -7.960   4.279   8.222
  778    H    ARG  97           H        ARG  97  -7.382   8.037   9.141
  779    HA   ARG  97           HA       ARG  97  -4.602   9.096   9.297
  780   1HB   ARG  97          1HB       ARG  97  -5.705  11.187  10.006
  781   2HB   ARG  97          2HB       ARG  97  -6.141  10.642   8.395
  782   1HG   ARG  97          1HG       ARG  97  -8.326   9.897   9.089
  783   2HG   ARG  97          2HG       ARG  97  -7.935  10.101  10.800
  784   1HD   ARG  97          1HD       ARG  97  -9.313  11.944  10.044
  785   2HD   ARG  97          2HD       ARG  97  -7.694  12.536  10.465
  786    HE   ARG  97           HE       ARG  97  -7.817  11.892   7.675
  787   1HH1  ARG  97          1HH2      ARG  97  -8.998  14.330   9.965
  788   2HH1  ARG  97          2HH2      ARG  97  -9.055  15.606   8.775
  789   1HH2  ARG  97          1HH1      ARG  97  -7.882  13.577   6.122
  790   2HH2  ARG  97          2HH1      ARG  97  -8.417  15.172   6.576
  791    H    ASP  98           H        ASP  98  -6.031  10.479  11.819
  792    HA   ASP  98           HA       ASP  98  -5.480   8.283  13.768
  793   1HB   ASP  98          1HB       ASP  98  -3.649   9.938  13.738
  794   2HB   ASP  98          2HB       ASP  98  -4.811  11.249  13.990
  795    H    MET  99           H        MET  99  -7.843   8.046  13.066
  796    HA   MET  99           HA       MET  99  -9.522   9.114  15.144
  797   1HB   MET  99          1HB       MET  99  -9.557  11.003  13.459
  798   2HB   MET  99          2HB       MET  99 -10.117   9.863  12.238
  799   1HG   MET  99          1HG       MET  99 -11.980  11.146  13.121
  800   2HG   MET  99          2HG       MET  99 -12.172   9.446  13.528
  801   1HE   MET  99          1HE       MET  99  -9.792  12.041  15.555
  802   2HE   MET  99          2HE       MET  99 -11.096  12.960  14.761
  803   3HE   MET  99          3HE       MET  99 -11.068  12.793  16.531
  Start of MODEL   13
    1   1H    MET   0          1H        MET   0  -0.402 -22.996  -5.796
    2   2H    MET   0          2H        MET   0  -1.439 -21.739  -5.522
    3   3H    MET   0          3H        MET   0  -0.796 -22.562  -4.252
    4    HA   MET   0           HA       MET   0  -2.576 -23.702  -6.270
    5   1HB   MET   0          1HB       MET   0  -1.599 -24.848  -3.616
    6   2HB   MET   0          2HB       MET   0  -2.826 -25.569  -4.669
    7   1HG   MET   0          1HG       MET   0  -1.119 -25.726  -6.491
    8   2HG   MET   0          2HG       MET   0   0.088 -25.046  -5.392
    9   1HE   MET   0          1HE       MET   0  -2.719 -27.850  -5.192
   10   2HE   MET   0          2HE       MET   0  -1.730 -28.193  -6.631
   11   3HE   MET   0          3HE       MET   0  -1.681 -29.291  -5.233
   12    H    ILE   1           H        ILE   1  -2.544 -23.223  -2.724
   13    HA   ILE   1           HA       ILE   1  -5.197 -21.905  -2.817
   14    HB   ILE   1           HB       ILE   1  -5.193 -23.663  -1.267
   15   1HG1  ILE   1          1HG1      ILE   1  -5.597 -22.565   0.876
   16   2HG1  ILE   1          2HG1      ILE   1  -4.790 -21.093   0.331
   17   1HG2  ILE   1          1HG2      ILE   1  -2.783 -24.019  -0.930
   18   2HG2  ILE   1          2HG2      ILE   1  -2.702 -22.536   0.055
   19   3HG2  ILE   1          3HG2      ILE   1  -3.672 -23.918   0.590
   20   1HD1  ILE   1          1HD1      ILE   1  -6.559 -20.727  -1.346
   21   2HD1  ILE   1          2HD1      ILE   1  -7.294 -22.297  -0.939
   22   3HD1  ILE   1          3HD1      ILE   1  -7.282 -20.979   0.249
   23    H    GLN   2           H        GLN   2  -5.055 -19.730  -3.072
   24    HA   GLN   2           HA       GLN   2  -2.515 -18.312  -2.547
   25   1HB   GLN   2          1HB       GLN   2  -5.102 -17.599  -3.960
   26   2HB   GLN   2          2HB       GLN   2  -3.855 -16.406  -3.576
   27   1HG   GLN   2          1HG       GLN   2  -3.605 -17.201  -5.880
   28   2HG   GLN   2          2HG       GLN   2  -2.195 -17.574  -4.886
   29   1HE2  GLN   2          2HE2      GLN   2  -5.338 -19.065  -5.892
   30   2HE2  GLN   2          1HE2      GLN   2  -4.704 -20.695  -6.025
   31    H    ARG   3           H        ARG   3  -2.186 -17.129  -0.741
   32    HA   ARG   3           HA       ARG   3  -4.381 -16.763   1.186
   33   1HB   ARG   3          1HB       ARG   3  -1.393 -16.417   1.296
   34   2HB   ARG   3          2HB       ARG   3  -2.455 -15.761   2.554
   35   1HG   ARG   3          1HG       ARG   3  -3.414 -17.895   3.044
   36   2HG   ARG   3          2HG       ARG   3  -2.581 -18.672   1.688
   37   1HD   ARG   3          1HD       ARG   3  -0.395 -18.271   2.783
   38   2HD   ARG   3          2HD       ARG   3  -1.198 -17.366   4.070
   39    HE   ARG   3           HE       ARG   3  -1.914 -19.286   5.077
   40   1HH1  ARG   3          1HH2      ARG   3  -0.581 -20.157   1.904
   41   2HH1  ARG   3          2HH2      ARG   3  -0.826 -21.869   2.134
   42   1HH2  ARG   3          1HH1      ARG   3  -2.283 -21.515   5.339
   43   2HH2  ARG   3          2HH1      ARG   3  -1.798 -22.644   4.101
   44    H    THR   4           H        THR   4  -4.841 -14.780   2.147
   45    HA   THR   4           HA       THR   4  -5.368 -12.836   0.113
   46    HB   THR   4           HB       THR   4  -7.039 -13.745   1.688
   47    HG1  THR   4           HG1      THR   4  -7.449 -11.819   0.629
   48   1HG2  THR   4          1HG2      THR   4  -5.792 -11.870   3.742
   49   2HG2  THR   4          2HG2      THR   4  -7.223 -12.895   3.935
   50   3HG2  THR   4          3HG2      THR   4  -5.619 -13.641   3.772
   51    HA   PRO   5           HA       PRO   5  -2.358  -9.758   1.514
   52   1HB   PRO   5          1HB       PRO   5  -3.381  -7.493   0.367
   53   2HB   PRO   5          2HB       PRO   5  -2.589  -8.797  -0.567
   54   1HG   PRO   5          1HG       PRO   5  -5.548  -8.370  -0.101
   55   2HG   PRO   5          2HG       PRO   5  -4.707  -8.649  -1.655
   56   1HD   PRO   5          1HD       PRO   5  -5.905 -10.670  -0.305
   57   2HD   PRO   5          2HD       PRO   5  -4.346 -10.944  -1.130
   58    H    LYS   6           H        LYS   6  -2.579  -9.758   3.706
   59    HA   LYS   6           HA       LYS   6  -4.614  -8.272   5.168
   60   1HB   LYS   6          1HB       LYS   6  -3.265 -10.163   6.146
   61   2HB   LYS   6          2HB       LYS   6  -1.821  -9.147   6.001
   62   1HG   LYS   6          1HG       LYS   6  -3.221  -7.366   7.319
   63   2HG   LYS   6          2HG       LYS   6  -4.295  -8.716   7.705
   64   1HD   LYS   6          1HD       LYS   6  -2.366  -9.930   8.721
   65   2HD   LYS   6          2HD       LYS   6  -1.295  -8.577   8.288
   66   1HE   LYS   6          1HE       LYS   6  -2.679  -7.038   9.678
   67   2HE   LYS   6          2HE       LYS   6  -3.710  -8.404  10.150
   68   1HZ   LYS   6          1HZ       LYS   6  -1.776  -9.417  11.140
   69   2HZ   LYS   6          2HZ       LYS   6  -0.838  -8.132  10.702
   70   3HZ   LYS   6          3HZ       LYS   6  -2.060  -7.927  11.788
   71    H    ILE   7           H        ILE   7  -4.731  -6.133   4.676
   72    HA   ILE   7           HA       ILE   7  -2.380  -4.542   3.986
   73    HB   ILE   7           HB       ILE   7  -3.933  -2.733   3.730
   74   1HG1  ILE   7          1HG1      ILE   7  -6.506  -3.575   3.947
   75   2HG1  ILE   7          2HG1      ILE   7  -5.833  -4.461   5.307
   76   1HG2  ILE   7          1HG2      ILE   7  -3.686  -4.413   1.937
   77   2HG2  ILE   7          2HG2      ILE   7  -5.123  -5.265   2.548
   78   3HG2  ILE   7          3HG2      ILE   7  -5.264  -3.610   1.934
   79   1HD1  ILE   7          1HD1      ILE   7  -4.980  -2.273   6.242
   80   2HD1  ILE   7          2HD1      ILE   7  -5.653  -1.445   4.830
   81   3HD1  ILE   7          3HD1      ILE   7  -6.729  -2.264   5.976
   82    H    GLN   8           H        GLN   8  -1.234  -3.102   5.395
   83    HA   GLN   8           HA       GLN   8  -2.694  -2.121   7.728
   84   1HB   GLN   8          1HB       GLN   8  -0.358  -2.110   8.788
   85   2HB   GLN   8          2HB       GLN   8  -1.382  -3.544   8.951
   86   1HG   GLN   8          1HG       GLN   8   0.829  -3.260   6.904
   87   2HG   GLN   8          2HG       GLN   8   1.080  -3.937   8.519
   88   1HE2  GLN   8          2HE2      GLN   8   1.200  -5.050   5.624
   89   2HE2  GLN   8          1HE2      GLN   8   0.248  -6.519   5.727
   90    H    VAL   9           H        VAL   9  -3.153  -0.317   6.557
   91    HA   VAL   9           HA       VAL   9  -1.017   1.096   5.089
   92    HB   VAL   9           HB       VAL   9  -4.004   1.610   5.256
   93   1HG1  VAL   9          1HG1      VAL   9  -1.824   2.770   3.465
   94   2HG1  VAL   9          2HG1      VAL   9  -3.576   3.051   3.295
   95   3HG1  VAL   9          3HG1      VAL   9  -2.712   3.636   4.720
   96   1HG2  VAL   9          1HG2      VAL   9  -3.504  -0.529   4.115
   97   2HG2  VAL   9          2HG2      VAL   9  -4.049   0.690   2.956
   98   3HG2  VAL   9          3HG2      VAL   9  -2.324   0.286   3.073
   99    H    TYR  10           H        TYR  10   0.249   2.014   6.658
  100    HA   TYR  10           HA       TYR  10  -1.062   3.773   8.713
  101   1HB   TYR  10          1HB       TYR  10   0.833   3.349  10.115
  102   2HB   TYR  10          2HB       TYR  10  -0.047   1.892   9.697
  103    HD1  TYR  10           HD1      TYR  10   0.972   0.107   8.430
  104    HD2  TYR  10           HD2      TYR  10   3.163   3.694   9.337
  105    HE1  TYR  10           HE1      TYR  10   3.087  -1.015   7.790
  106    HE2  TYR  10           HE2      TYR  10   5.280   2.542   8.799
  107    HH   TYR  10           HH       TYR  10   6.269   0.554   8.189
  108    H    SER  11           H        SER  11   0.066   5.719   9.310
  109    HA   SER  11           HA       SER  11   1.952   6.832   7.292
  110   1HB   SER  11          1HB       SER  11   1.463   8.999   8.496
  111   2HB   SER  11          2HB       SER  11   0.176   8.313   7.513
  112    HG   SER  11           HG       SER  11  -0.556   8.998   9.587
  113    H    ARG  12           H        ARG  12   3.734   8.162   8.351
  114    HA   ARG  12           HA       ARG  12   4.847   6.735  10.744
  115   1HB   ARG  12          1HB       ARG  12   6.065   8.110   8.358
  116   2HB   ARG  12          2HB       ARG  12   6.999   7.887   9.847
  117   1HG   ARG  12          1HG       ARG  12   7.125   5.613   9.651
  118   2HG   ARG  12          2HG       ARG  12   5.508   5.460   8.960
  119   1HD   ARG  12          1HD       ARG  12   7.150   4.748   7.380
  120   2HD   ARG  12          2HD       ARG  12   6.250   6.164   6.785
  121    HE   ARG  12           HE       ARG  12   8.565   7.167   7.988
  122   1HH1  ARG  12          1HH2      ARG  12   7.773   4.990   5.277
  123   2HH1  ARG  12          2HH2      ARG  12   9.230   5.384   4.395
  124   1HH2  ARG  12          1HH1      ARG  12  10.408   7.752   6.715
  125   2HH2  ARG  12          2HH1      ARG  12  10.674   6.994   5.166
  126    H    HIS  13           H        HIS  13   4.533  10.042   9.353
  127    HA   HIS  13           HA       HIS  13   4.507  11.135  12.129
  128   1HB   HIS  13          1HB       HIS  13   4.530  12.658   9.523
  129   2HB   HIS  13          2HB       HIS  13   4.853  13.286  11.133
  130    HD2  HIS  13           HD2      HIS  13   6.726  12.404   8.093
  131    HE1  HIS  13           HE1      HIS  13   9.401  11.472  11.238
  132    HE2  HIS  13           HE2      HIS  13   9.215  11.864   8.719
  133    HA   PRO  14           HA       PRO  14   0.106  11.239  11.628
  134   1HB   PRO  14          1HB       PRO  14  -0.748  12.960  13.530
  135   2HB   PRO  14          2HB       PRO  14   0.245  11.546  13.942
  136   1HG   PRO  14          1HG       PRO  14   1.229  14.381  13.478
  137   2HG   PRO  14          2HG       PRO  14   1.530  13.338  14.901
  138   1HD   PRO  14          1HD       PRO  14   3.290  13.525  12.804
  139   2HD   PRO  14          2HD       PRO  14   3.060  12.000  13.702
  140    H    ALA  15           H        ALA  15   1.144  12.553   9.442
  141    HA   ALA  15           HA       ALA  15   0.675  13.981   7.766
  142   1HB   ALA  15          1HB       ALA  15  -1.523  12.905   8.087
  143   2HB   ALA  15          2HB       ALA  15  -2.035  14.292   9.069
  144   3HB   ALA  15          3HB       ALA  15  -1.637  14.514   7.364
  145    H    GLU  16           H        GLU  16  -0.552  16.285   7.319
  146    HA   GLU  16           HA       GLU  16  -0.303  18.329   9.287
  147   1HB   GLU  16          1HB       GLU  16   2.193  17.672   8.463
  148   2HB   GLU  16          2HB       GLU  16   1.746  18.659   7.085
  149   1HG   GLU  16          1HG       GLU  16   2.877  20.063   8.667
  150   2HG   GLU  16          2HG       GLU  16   1.182  20.523   8.826
  151    H    ASN  17           H        ASN  17   0.264  20.327   7.171
  152    HA   ASN  17           HA       ASN  17  -1.579  19.664   4.990
  153   1HB   ASN  17          1HB       ASN  17  -2.977  20.966   6.571
  154   2HB   ASN  17          2HB       ASN  17  -1.807  22.293   6.493
  155   1HD2  ASN  17          2HD2      ASN  17  -3.695  23.587   5.738
  156   2HD2  ASN  17          1HD2      ASN  17  -4.172  23.498   4.057
  157    H    GLY  18           H        GLY  18  -0.319  19.857   3.223
  158   1HA   GLY  18          1HA       GLY  18   0.921  20.930   1.621
  159   2HA   GLY  18          2HA       GLY  18   1.198  22.294   2.708
  160    H    LYS  19           H        LYS  19   2.272  20.353   4.838
  161    HA   LYS  19           HA       LYS  19   5.049  20.467   3.885
  162   1HB   LYS  19          1HB       LYS  19   4.267  21.411   6.032
  163   2HB   LYS  19          2HB       LYS  19   3.992  19.739   6.580
  164   1HG   LYS  19          1HG       LYS  19   6.691  20.885   5.736
  165   2HG   LYS  19          2HG       LYS  19   6.093  20.798   7.400
  166   1HD   LYS  19          1HD       LYS  19   5.781  18.250   6.968
  167   2HD   LYS  19          2HD       LYS  19   6.873  18.506   5.589
  168   1HE   LYS  19          1HE       LYS  19   7.547  19.200   8.467
  169   2HE   LYS  19          2HE       LYS  19   8.009  17.707   7.634
  170   1HZ   LYS  19          1HZ       LYS  19   9.213  18.985   6.052
  171   2HZ   LYS  19          2HZ       LYS  19   8.779  20.402   6.774
  172   3HZ   LYS  19          3HZ       LYS  19   9.747  19.331   7.572
  173    H    SER  20           H        SER  20   5.739  18.844   2.996
  174    HA   SER  20           HA       SER  20   4.774  16.438   2.451
  175   1HB   SER  20          1HB       SER  20   6.901  17.550   1.540
  176   2HB   SER  20          2HB       SER  20   7.722  16.449   2.673
  177    HG   SER  20           HG       SER  20   7.472  15.291   0.866
  178    H    ASN  21           H        ASN  21   4.527  14.463   3.423
  179    HA   ASN  21           HA       ASN  21   5.531  14.035   6.194
  180   1HB   ASN  21          1HB       ASN  21   3.100  14.712   5.518
  181   2HB   ASN  21          2HB       ASN  21   2.913  13.016   5.121
  182   1HD2  ASN  21          2HD2      ASN  21   2.703  11.554   6.902
  183   2HD2  ASN  21          1HD2      ASN  21   2.717  12.063   8.568
  184    H    PHE  22           H        PHE  22   4.202  11.213   6.076
  185    HA   PHE  22           HA       PHE  22   5.489   9.907   3.884
  186   1HB   PHE  22          1HB       PHE  22   7.103  10.205   6.212
  187   2HB   PHE  22          2HB       PHE  22   6.609   8.524   6.161
  188    HD1  PHE  22           HD1      PHE  22   6.727   7.374   3.728
  189    HD2  PHE  22           HD2      PHE  22   9.002  10.823   4.970
  190    HE1  PHE  22           HE1      PHE  22   8.338   6.989   1.879
  191    HE2  PHE  22           HE2      PHE  22  10.622  10.406   3.142
  192    HZ   PHE  22           HZ       PHE  22  10.270   8.519   1.573
  193    H    LEU  23           H        LEU  23   4.309   8.349   3.256
  194    HA   LEU  23           HA       LEU  23   2.278   7.039   4.975
  195   1HB   LEU  23          1HB       LEU  23   1.437   8.446   3.181
  196   2HB   LEU  23          2HB       LEU  23   2.503   7.657   2.015
  197    HG   LEU  23           HG       LEU  23   1.111   5.573   2.341
  198   1HD1  LEU  23          1HD1      LEU  23  -0.543   7.507   4.035
  199   2HD1  LEU  23          2HD1      LEU  23  -1.078   5.897   3.497
  200   3HD1  LEU  23          3HD1      LEU  23   0.268   6.049   4.635
  201   1HD2  LEU  23          1HD2      LEU  23   0.681   7.263   0.534
  202   2HD2  LEU  23          2HD2      LEU  23  -0.817   6.486   1.084
  203   3HD2  LEU  23          3HD2      LEU  23  -0.410   8.129   1.628
  204    H    ASN  24           H        ASN  24   2.124   4.804   4.974
  205    HA   ASN  24           HA       ASN  24   3.936   3.173   3.256
  206   1HB   ASN  24          1HB       ASN  24   3.499   3.074   6.244
  207   2HB   ASN  24          2HB       ASN  24   4.025   1.669   5.322
  208   1HD2  ASN  24          2HD2      ASN  24   6.045   1.476   6.357
  209   2HD2  ASN  24          1HD2      ASN  24   7.334   2.636   6.112
  210    H    CYS  25           H        CYS  25   2.399   2.354   1.865
  211    HA   CYS  25           HA       CYS  25  -0.035   1.074   2.948
  212   1HB   CYS  25          1HB       CYS  25   1.094   0.998   0.124
  213   2HB   CYS  25          2HB       CYS  25  -0.467   0.404   0.646
  214    H    TYR  26           H        TYR  26   1.407  -0.349   4.422
  215    HA   TYR  26           HA       TYR  26   3.122  -2.285   3.058
  216   1HB   TYR  26          1HB       TYR  26   3.713  -1.471   5.264
  217   2HB   TYR  26          2HB       TYR  26   2.184  -1.959   5.909
  218    HD1  TYR  26           HD1      TYR  26   4.149  -4.189   3.608
  219    HD2  TYR  26           HD2      TYR  26   3.216  -3.258   7.721
  220    HE1  TYR  26           HE1      TYR  26   4.904  -6.404   4.287
  221    HE2  TYR  26           HE2      TYR  26   3.942  -5.514   8.389
  222    HH   TYR  26           HH       TYR  26   5.177  -7.909   6.032
  223    H    VAL  27           H        VAL  27   2.389  -4.204   2.195
  224    HA   VAL  27           HA       VAL  27  -0.262  -5.261   3.097
  225    HB   VAL  27           HB       VAL  27   1.032  -5.715   0.366
  226   1HG1  VAL  27          1HG1      VAL  27  -1.836  -6.039   1.346
  227   2HG1  VAL  27          2HG1      VAL  27  -1.176  -6.529  -0.234
  228   3HG1  VAL  27          3HG1      VAL  27  -0.678  -7.369   1.241
  229   1HG2  VAL  27          1HG2      VAL  27  -1.078  -3.673   1.098
  230   2HG2  VAL  27          2HG2      VAL  27   0.550  -3.349   0.443
  231   3HG2  VAL  27          3HG2      VAL  27  -0.647  -4.188  -0.559
  232    H    SER  28           H        SER  28  -0.167  -7.456   3.770
  233    HA   SER  28           HA       SER  28   2.057  -9.032   2.973
  234   1HB   SER  28          1HB       SER  28   3.430  -8.820   4.789
  235   2HB   SER  28          2HB       SER  28   2.456  -7.528   5.373
  236    HG   SER  28           HG       SER  28   2.778  -9.191   6.883
  237    H    GLY  29           H        GLY  29   1.902 -11.169   4.749
  238   1HA   GLY  29          1HA       GLY  29   0.571 -12.911   5.413
  239   2HA   GLY  29          2HA       GLY  29  -0.872 -11.944   5.105
  240    H    PHE  30           H        PHE  30   0.449 -11.572   2.205
  241    HA   PHE  30           HA       PHE  30  -1.222 -13.707   1.099
  242   1HB   PHE  30          1HB       PHE  30  -1.295 -12.394  -0.875
  243   2HB   PHE  30          2HB       PHE  30  -1.592 -11.395   0.501
  244    HD1  PHE  30           HD1      PHE  30   0.716 -12.144  -2.238
  245    HD2  PHE  30           HD2      PHE  30  -0.042  -9.500   1.090
  246    HE1  PHE  30           HE1      PHE  30   2.437 -10.602  -3.072
  247    HE2  PHE  30           HE2      PHE  30   1.692  -7.973   0.241
  248    HZ   PHE  30           HZ       PHE  30   2.874  -8.509  -1.881
  249    H    HIS  31           H        HIS  31  -0.429 -14.422  -1.161
  250    HA   HIS  31           HA       HIS  31   2.242 -14.441  -2.031
  251   1HB   HIS  31          1HB       HIS  31   3.052 -16.577  -1.629
  252   2HB   HIS  31          2HB       HIS  31   2.427 -16.139  -0.050
  253    HD2  HIS  31           HD2      HIS  31   1.470 -18.293  -3.142
  254    HE1  HIS  31           HE1      HIS  31  -1.040 -19.422   0.069
  255    HE2  HIS  31           HE2      HIS  31  -0.456 -19.928  -2.358
  256    HA   PRO  32           HA       PRO  32   3.228 -15.827  -3.809
  257   1HB   PRO  32          1HB       PRO  32   3.511 -16.064  -6.494
  258   2HB   PRO  32          2HB       PRO  32   2.807 -17.366  -5.520
  259   1HG   PRO  32          1HG       PRO  32   1.282 -15.215  -7.023
  260   2HG   PRO  32          2HG       PRO  32   1.114 -16.991  -7.188
  261   1HD   PRO  32          1HD       PRO  32  -0.488 -15.545  -5.513
  262   2HD   PRO  32          2HD       PRO  32   0.079 -17.185  -5.085
  263    H    SER  33           H        SER  33   4.310 -14.402  -6.128
  264    HA   SER  33           HA       SER  33   4.569 -11.926  -4.732
  265   1HB   SER  33          1HB       SER  33   6.428 -11.588  -6.201
  266   2HB   SER  33          2HB       SER  33   6.385 -13.334  -5.879
  267    HG   SER  33           HG       SER  33   5.258 -13.573  -7.875
  268    H    ASP  34           H        ASP  34   2.495 -12.815  -7.357
  269    HA   ASP  34           HA       ASP  34   2.847 -10.371  -8.825
  270   1HB   ASP  34          1HB       ASP  34   2.456 -12.497  -9.915
  271   2HB   ASP  34          2HB       ASP  34   0.871 -12.654  -9.143
  272    H    ILE  35           H        ILE  35   2.303  -8.752  -7.281
  273    HA   ILE  35           HA       ILE  35  -0.620  -8.191  -7.225
  274    HB   ILE  35           HB       ILE  35   0.006  -8.918  -5.109
  275   1HG1  ILE  35          1HG1      ILE  35  -0.146  -5.917  -4.935
  276   2HG1  ILE  35          2HG1      ILE  35  -1.525  -6.978  -5.163
  277   1HG2  ILE  35          1HG2      ILE  35   2.339  -7.071  -5.381
  278   2HG2  ILE  35          2HG2      ILE  35   1.759  -7.580  -3.784
  279   3HG2  ILE  35          3HG2      ILE  35   2.268  -8.806  -4.936
  280   1HD1  ILE  35          1HD1      ILE  35  -0.668  -8.168  -2.978
  281   2HD1  ILE  35          2HD1      ILE  35   0.182  -6.628  -2.704
  282   3HD1  ILE  35          3HD1      ILE  35  -1.574  -6.642  -2.873
  283    H    GLU  36           H        GLU  36  -1.244  -6.050  -7.257
  284    HA   GLU  36           HA       GLU  36   0.684  -4.063  -8.360
  285   1HB   GLU  36          1HB       GLU  36  -2.192  -4.252  -9.253
  286   2HB   GLU  36          2HB       GLU  36  -0.822  -3.350  -9.923
  287   1HG   GLU  36          1HG       GLU  36   0.267  -5.667 -10.271
  288   2HG   GLU  36          2HG       GLU  36  -1.334  -6.327  -9.985
  289    H    VAL  37           H        VAL  37   0.728  -2.166  -7.293
  290    HA   VAL  37           HA       VAL  37  -1.505  -1.280  -5.572
  291    HB   VAL  37           HB       VAL  37   1.330  -1.843  -4.617
  292   1HG1  VAL  37          1HG1      VAL  37  -0.978  -0.988  -2.829
  293   2HG1  VAL  37          2HG1      VAL  37   0.711  -1.247  -2.400
  294   3HG1  VAL  37          3HG1      VAL  37   0.268   0.141  -3.400
  295   1HG2  VAL  37          1HG2      VAL  37  -1.341  -3.205  -4.102
  296   2HG2  VAL  37          2HG2      VAL  37   0.171  -3.881  -4.756
  297   3HG2  VAL  37          3HG2      VAL  37   0.060  -3.446  -3.046
  298    H    ASP  38           H        ASP  38  -1.679   0.255  -7.297
  299    HA   ASP  38           HA       ASP  38   0.301   2.384  -7.529
  300   1HB   ASP  38          1HB       ASP  38  -2.650   2.334  -8.313
  301   2HB   ASP  38          2HB       ASP  38  -1.459   3.557  -8.744
  302    H    LEU  39           H        LEU  39   0.678   3.640  -5.727
  303    HA   LEU  39           HA       LEU  39  -1.319   4.280  -3.725
  304   1HB   LEU  39          1HB       LEU  39   1.448   5.358  -4.417
  305   2HB   LEU  39          2HB       LEU  39   0.417   6.035  -3.145
  306    HG   LEU  39           HG       LEU  39   0.286   3.714  -2.154
  307   1HD1  LEU  39          1HD1      LEU  39   2.601   3.183  -4.051
  308   2HD1  LEU  39          2HD1      LEU  39   2.260   2.227  -2.595
  309   3HD1  LEU  39          3HD1      LEU  39   1.084   2.267  -3.898
  310   1HD2  LEU  39          1HD2      LEU  39   1.659   5.541  -1.216
  311   2HD2  LEU  39          2HD2      LEU  39   2.461   3.977  -0.998
  312   3HD2  LEU  39          3HD2      LEU  39   3.009   5.077  -2.282
  313    H    LEU  40           H        LEU  40  -2.808   5.910  -3.829
  314    HA   LEU  40           HA       LEU  40  -2.930   7.556  -6.312
  315   1HB   LEU  40          1HB       LEU  40  -3.918   5.138  -6.282
  316   2HB   LEU  40          2HB       LEU  40  -5.152   5.814  -5.240
  317    HG   LEU  40           HG       LEU  40  -5.916   5.617  -7.502
  318   1HD1  LEU  40          1HD1      LEU  40  -5.467   8.587  -7.009
  319   2HD1  LEU  40          2HD1      LEU  40  -6.706   7.836  -8.023
  320   3HD1  LEU  40          3HD1      LEU  40  -6.750   7.590  -6.270
  321   1HD2  LEU  40          1HD2      LEU  40  -3.712   7.485  -8.408
  322   2HD2  LEU  40          2HD2      LEU  40  -3.653   5.715  -8.569
  323   3HD2  LEU  40          3HD2      LEU  40  -4.900   6.652  -9.416
  324    H    LYS  41           H        LYS  41  -3.330   9.725  -5.687
  325    HA   LYS  41           HA       LYS  41  -4.604  10.335  -3.189
  326   1HB   LYS  41          1HB       LYS  41  -3.852  11.999  -5.587
  327   2HB   LYS  41          2HB       LYS  41  -4.280  12.628  -3.969
  328   1HG   LYS  41          1HG       LYS  41  -2.411  11.988  -2.995
  329   2HG   LYS  41          2HG       LYS  41  -2.115  10.577  -3.995
  330   1HD   LYS  41          1HD       LYS  41  -0.457  12.192  -4.494
  331   2HD   LYS  41          2HD       LYS  41  -1.471  12.022  -5.914
  332   1HE   LYS  41          1HE       LYS  41  -2.624  14.042  -5.537
  333   2HE   LYS  41          2HE       LYS  41  -2.109  14.126  -3.837
  334   1HZ   LYS  41          1HZ       LYS  41   0.103  14.579  -4.571
  335   2HZ   LYS  41          2HZ       LYS  41  -0.352  14.509  -6.154
  336   3HZ   LYS  41          3HZ       LYS  41  -0.943  15.700  -5.178
  337    H    ASN  42           H        ASN  42  -5.973  12.605  -4.888
  338    HA   ASN  42           HA       ASN  42  -8.653  11.542  -4.872
  339   1HB   ASN  42          1HB       ASN  42  -9.347  13.638  -5.705
  340   2HB   ASN  42          2HB       ASN  42  -8.017  14.009  -4.605
  341   1HD2  ASN  42          2HD2      ASN  42  -5.819  14.475  -5.666
  342   2HD2  ASN  42          1HD2      ASN  42  -5.816  15.099  -7.298
  343    H    GLY  43           H        GLY  43  -6.260  12.147  -7.469
  344   1HA   GLY  43          1HA       GLY  43  -7.284   9.950  -9.065
  345   2HA   GLY  43          2HA       GLY  43  -7.715  11.538  -9.724
  346    H    GLU  44           H        GLU  44  -4.734  11.158  -7.902
  347    HA   GLU  44           HA       GLU  44  -3.076  11.178 -10.395
  348   1HB   GLU  44          1HB       GLU  44  -3.170  13.388  -9.326
  349   2HB   GLU  44          2HB       GLU  44  -2.713  12.677  -7.774
  350   1HG   GLU  44          1HG       GLU  44  -0.535  11.926  -8.822
  351   2HG   GLU  44          2HG       GLU  44  -1.018  12.758 -10.309
  352    H    ARG  45           H        ARG  45  -1.883   9.344 -10.504
  353    HA   ARG  45           HA       ARG  45  -1.443   7.743  -8.094
  354   1HB   ARG  45          1HB       ARG  45  -0.821   5.986  -9.415
  355   2HB   ARG  45          2HB       ARG  45  -2.153   6.736 -10.305
  356   1HG   ARG  45          1HG       ARG  45  -0.546   7.751 -11.880
  357   2HG   ARG  45          2HG       ARG  45   0.813   7.106 -10.931
  358   1HD   ARG  45          1HD       ARG  45  -0.075   4.801 -11.251
  359   2HD   ARG  45          2HD       ARG  45  -1.273   5.456 -12.390
  360    HE   ARG  45           HE       ARG  45   1.287   6.351 -13.212
  361   1HH1  ARG  45          1HH2      ARG  45  -0.303   3.201 -12.745
  362   2HH1  ARG  45          2HH2      ARG  45   0.528   2.456 -14.085
  363   1HH2  ARG  45          1HH1      ARG  45   2.450   5.353 -14.817
  364   2HH2  ARG  45          2HH1      ARG  45   2.149   3.688 -15.284
  365    H    ILE  46           H        ILE  46   0.551   7.261  -7.154
  366    HA   ILE  46           HA       ILE  46   2.630   9.262  -7.572
  367    HB   ILE  46           HB       ILE  46   1.865   7.330  -5.349
  368   1HG1  ILE  46          1HG1      ILE  46   1.484  10.347  -5.604
  369   2HG1  ILE  46          2HG1      ILE  46   0.192   9.162  -5.815
  370   1HG2  ILE  46          1HG2      ILE  46   4.271   7.881  -5.371
  371   2HG2  ILE  46          2HG2      ILE  46   3.855   9.615  -5.440
  372   3HG2  ILE  46          3HG2      ILE  46   3.419   8.628  -4.013
  373   1HD1  ILE  46          1HD1      ILE  46   0.513   8.382  -3.461
  374   2HD1  ILE  46          2HD1      ILE  46   1.653   9.731  -3.226
  375   3HD1  ILE  46          3HD1      ILE  46  -0.028  10.036  -3.690
  376    H    GLU  47           H        GLU  47   3.905   8.446  -9.232
  377    HA   GLU  47           HA       GLU  47   4.537   5.620  -9.456
  378   1HB   GLU  47          1HB       GLU  47   5.593   8.040 -10.972
  379   2HB   GLU  47          2HB       GLU  47   5.903   6.337 -11.364
  380   1HG   GLU  47          1HG       GLU  47   3.424   5.973 -11.575
  381   2HG   GLU  47          2HG       GLU  47   3.171   7.715 -11.364
  382    H    LYS  48           H        LYS  48   6.161   8.484  -8.095
  383    HA   LYS  48           HA       LYS  48   8.709   7.101  -7.706
  384   1HB   LYS  48          1HB       LYS  48   7.709   9.724  -6.550
  385   2HB   LYS  48          2HB       LYS  48   9.380   9.107  -6.538
  386   1HG   LYS  48          1HG       LYS  48   9.200   9.051  -9.107
  387   2HG   LYS  48          2HG       LYS  48   7.730  10.017  -8.926
  388   1HD   LYS  48          1HD       LYS  48  10.545  10.790  -8.009
  389   2HD   LYS  48          2HD       LYS  48   9.682  11.379  -9.430
  390   1HE   LYS  48          1HE       LYS  48   9.387  13.125  -7.947
  391   2HE   LYS  48          2HE       LYS  48   7.866  12.240  -7.777
  392   1HZ   LYS  48          1HZ       LYS  48  10.200  12.062  -5.986
  393   2HZ   LYS  48          2HZ       LYS  48   8.816  12.892  -5.682
  394   3HZ   LYS  48          3HZ       LYS  48   8.784  11.250  -5.779
  395    H    VAL  49           H        VAL  49   7.628   5.218  -6.668
  396    HA   VAL  49           HA       VAL  49   6.907   5.622  -3.815
  397    HB   VAL  49           HB       VAL  49   6.910   3.047  -5.430
  398   1HG1  VAL  49          1HG1      VAL  49   5.504   3.824  -2.829
  399   2HG1  VAL  49          2HG1      VAL  49   5.425   2.251  -3.648
  400   3HG1  VAL  49          3HG1      VAL  49   6.946   2.789  -2.926
  401   1HG2  VAL  49          1HG2      VAL  49   5.333   4.529  -6.500
  402   2HG2  VAL  49          2HG2      VAL  49   4.420   3.386  -5.514
  403   3HG2  VAL  49          3HG2      VAL  49   4.670   5.047  -4.934
  404    H    GLU  50           H        GLU  50   8.337   5.151  -2.229
  405    HA   GLU  50           HA       GLU  50  11.110   4.387  -2.860
  406   1HB   GLU  50          1HB       GLU  50  10.424   6.327  -1.375
  407   2HB   GLU  50          2HB       GLU  50   9.808   5.129  -0.219
  408   1HG   GLU  50          1HG       GLU  50  12.032   4.194   0.077
  409   2HG   GLU  50          2HG       GLU  50  12.682   5.274  -1.169
  410    H    HIS  51           H        HIS  51   9.805   2.239  -3.591
  411    HA   HIS  51           HA       HIS  51   8.636   0.692  -1.452
  412   1HB   HIS  51          1HB       HIS  51   8.510  -1.078  -3.328
  413   2HB   HIS  51          2HB       HIS  51   7.636   0.435  -3.565
  414    HD2  HIS  51           HD2      HIS  51  11.300  -0.744  -4.603
  415    HE1  HIS  51           HE1      HIS  51   9.615   1.635  -7.664
  416    HE2  HIS  51           HE2      HIS  51  11.682   0.300  -6.969
  417    H    SER  52           H        SER  52   9.254  -1.412  -0.760
  418    HA   SER  52           HA       SER  52  12.149  -2.066  -0.945
  419   1HB   SER  52          1HB       SER  52  11.702  -3.682   0.837
  420   2HB   SER  52          2HB       SER  52  11.281  -2.033   1.332
  421    HG   SER  52           HG       SER  52   9.681  -3.540   1.906
  422    H    ASP  53           H        ASP  53  12.725  -4.153  -1.784
  423    HA   ASP  53           HA       ASP  53  11.270  -4.808  -4.105
  424   1HB   ASP  53          1HB       ASP  53  13.528  -6.288  -2.692
  425   2HB   ASP  53          2HB       ASP  53  12.899  -6.697  -4.296
  426    H    LEU  54           H        LEU  54  12.065  -7.314  -1.659
  427    HA   LEU  54           HA       LEU  54   9.309  -8.085  -1.291
  428   1HB   LEU  54          1HB       LEU  54   9.744  -8.938  -3.560
  429   2HB   LEU  54          2HB       LEU  54  11.134  -9.850  -2.983
  430    HG   LEU  54           HG       LEU  54   8.793 -10.947  -3.414
  431   1HD1  LEU  54          1HD1      LEU  54  10.383 -11.601  -0.922
  432   2HD1  LEU  54          2HD1      LEU  54   9.229 -12.672  -1.726
  433   3HD1  LEU  54          3HD1      LEU  54  10.708 -12.196  -2.573
  434   1HD2  LEU  54          1HD2      LEU  54   7.537  -9.414  -1.827
  435   2HD2  LEU  54          2HD2      LEU  54   7.304 -11.133  -1.521
  436   3HD2  LEU  54          3HD2      LEU  54   8.408 -10.282  -0.510
  437    H    SER  55           H        SER  55   9.233  -8.719   0.734
  438    HA   SER  55           HA       SER  55  11.546 -10.107   2.023
  439   1HB   SER  55          1HB       SER  55  11.268  -7.760   2.844
  440   2HB   SER  55          2HB       SER  55   9.595  -8.126   3.288
  441    HG   SER  55           HG       SER  55  11.952  -9.350   4.293
  442    H    PHE  56           H        PHE  56  10.508 -12.141   1.322
  443    HA   PHE  56           HA       PHE  56   7.795 -12.633   2.262
  444   1HB   PHE  56          1HB       PHE  56   7.881 -14.725   1.271
  445   2HB   PHE  56          2HB       PHE  56   8.545 -13.544   0.159
  446    HD1  PHE  56           HD1      PHE  56  11.202 -13.436   0.017
  447    HD2  PHE  56           HD2      PHE  56   8.904 -16.776   1.476
  448    HE1  PHE  56           HE1      PHE  56  13.167 -14.904  -0.263
  449    HE2  PHE  56           HE2      PHE  56  10.887 -18.247   1.211
  450    HZ   PHE  56           HZ       PHE  56  13.028 -17.308   0.358
  451    H    SER  57           H        SER  57   9.667 -11.914   4.368
  452    HA   SER  57           HA       SER  57  10.597 -12.505   6.323
  453   1HB   SER  57          1HB       SER  57   9.050 -13.670   7.833
  454   2HB   SER  57          2HB       SER  57   8.208 -12.492   6.820
  455    HG   SER  57           HG       SER  57   7.655 -14.296   5.437
  456    H    LYS  58           H        LYS  58  12.276 -13.781   4.763
  457    HA   LYS  58           HA       LYS  58  11.522 -15.534   3.127
  458   1HB   LYS  58          1HB       LYS  58  14.183 -15.965   4.552
  459   2HB   LYS  58          2HB       LYS  58  13.796 -16.509   2.928
  460   1HG   LYS  58          1HG       LYS  58  14.383 -14.596   2.016
  461   2HG   LYS  58          2HG       LYS  58  13.264 -13.665   2.998
  462   1HD   LYS  58          1HD       LYS  58  16.076 -14.536   3.825
  463   2HD   LYS  58          2HD       LYS  58  15.633 -12.940   3.196
  464   1HE   LYS  58          1HE       LYS  58  14.112 -12.589   5.141
  465   2HE   LYS  58          2HE       LYS  58  14.619 -14.152   5.813
  466   1HZ   LYS  58          1HZ       LYS  58  16.854 -13.316   5.893
  467   2HZ   LYS  58          2HZ       LYS  58  16.367 -11.854   5.306
  468   3HZ   LYS  58          3HZ       LYS  58  15.828 -12.375   6.773
  469    H    ASP  59           H        ASP  59   9.828 -16.429   4.967
  470    HA   ASP  59           HA       ASP  59  10.319 -19.343   5.078
  471   1HB   ASP  59          1HB       ASP  59   8.436 -17.448   6.506
  472   2HB   ASP  59          2HB       ASP  59   8.317 -19.208   6.599
  473    H    TRP  60           H        TRP  60   7.444 -17.249   4.749
  474    HA   TRP  60           HA       TRP  60   6.477 -18.482   2.295
  475   1HB   TRP  60          1HB       TRP  60   5.631 -19.448   4.989
  476   2HB   TRP  60          2HB       TRP  60   4.313 -19.022   3.908
  477    HD1  TRP  60           HD1      TRP  60   6.810 -21.738   4.477
  478    HE1  TRP  60           HE1      TRP  60   6.556 -23.575   2.675
  479    HE3  TRP  60           HE3      TRP  60   3.624 -19.328   1.273
  480    HZ2  TRP  60           HZ2      TRP  60   5.218 -23.913   0.170
  481    HZ3  TRP  60           HZ3      TRP  60   2.894 -20.426  -0.822
  482    HH2  TRP  60           HH2      TRP  60   3.703 -22.703  -1.395
  483    H    SER  61           H        SER  61   5.621 -16.504   5.185
  484    HA   SER  61           HA       SER  61   3.457 -15.117   3.996
  485   1HB   SER  61          1HB       SER  61   3.908 -15.157   6.414
  486   2HB   SER  61          2HB       SER  61   5.367 -14.187   6.182
  487    HG   SER  61           HG       SER  61   2.729 -13.415   5.470
  488    H    PHE  62           H        PHE  62   3.767 -14.298   2.017
  489    HA   PHE  62           HA       PHE  62   6.238 -13.152   1.031
  490   1HB   PHE  62          1HB       PHE  62   4.471 -14.915   0.039
  491   2HB   PHE  62          2HB       PHE  62   3.771 -13.437  -0.613
  492    HD1  PHE  62           HD1      PHE  62   5.049 -12.072  -2.274
  493    HD2  PHE  62           HD2      PHE  62   6.651 -15.761  -0.678
  494    HE1  PHE  62           HE1      PHE  62   6.815 -12.044  -3.925
  495    HE2  PHE  62           HE2      PHE  62   8.285 -15.836  -2.484
  496    HZ   PHE  62           HZ       PHE  62   8.397 -13.961  -4.147
  497    H    TYR  63           H        TYR  63   6.520 -10.845   0.932
  498    HA   TYR  63           HA       TYR  63   4.144  -9.122   0.632
  499   1HB   TYR  63          1HB       TYR  63   4.406  -8.069   2.816
  500   2HB   TYR  63          2HB       TYR  63   3.908  -9.769   2.853
  501    HD1  TYR  63           HD1      TYR  63   6.840  -7.574   3.361
  502    HD2  TYR  63           HD2      TYR  63   4.774 -11.217   4.343
  503    HE1  TYR  63           HE1      TYR  63   8.112  -7.713   5.420
  504    HE2  TYR  63           HE2      TYR  63   6.094 -11.437   6.370
  505    HH   TYR  63           HH       TYR  63   7.716 -10.465   7.741
  506    H    LEU  64           H        LEU  64   4.788  -6.786   1.115
  507    HA   LEU  64           HA       LEU  64   7.521  -6.012   0.777
  508   1HB   LEU  64          1HB       LEU  64   7.570  -5.242  -1.477
  509   2HB   LEU  64          2HB       LEU  64   7.170  -6.955  -1.500
  510    HG   LEU  64           HG       LEU  64   5.325  -4.605  -1.997
  511   1HD1  LEU  64          1HD1      LEU  64   5.922  -6.978  -3.820
  512   2HD1  LEU  64          2HD1      LEU  64   5.022  -5.518  -4.219
  513   3HD1  LEU  64          3HD1      LEU  64   6.767  -5.414  -3.943
  514   1HD2  LEU  64          1HD2      LEU  64   4.772  -7.557  -1.626
  515   2HD2  LEU  64          2HD2      LEU  64   3.880  -6.189  -0.889
  516   3HD2  LEU  64          3HD2      LEU  64   3.690  -6.569  -2.602
  517    H    LEU  65           H        LEU  65   7.763  -3.782   1.040
  518    HA   LEU  65           HA       LEU  65   5.366  -2.465   2.152
  519   1HB   LEU  65          1HB       LEU  65   7.819  -3.025   3.209
  520   2HB   LEU  65          2HB       LEU  65   8.147  -1.422   2.562
  521    HG   LEU  65           HG       LEU  65   5.900  -2.182   4.473
  522   1HD1  LEU  65          1HD1      LEU  65   8.131  -2.415   5.491
  523   2HD1  LEU  65          2HD1      LEU  65   8.572  -0.784   4.944
  524   3HD1  LEU  65          3HD1      LEU  65   7.300  -1.000   6.166
  525   1HD2  LEU  65          1HD2      LEU  65   5.457  -0.110   3.050
  526   2HD2  LEU  65          2HD2      LEU  65   5.531   0.144   4.796
  527   3HD2  LEU  65          3HD2      LEU  65   6.912   0.603   3.791
  528    H    TYR  66           H        TYR  66   4.547  -0.696   1.078
  529    HA   TYR  66           HA       TYR  66   6.098   0.445  -1.217
  530   1HB   TYR  66          1HB       TYR  66   3.083   0.110  -1.102
  531   2HB   TYR  66          2HB       TYR  66   4.076   0.542  -2.482
  532    HD1  TYR  66           HD1      TYR  66   4.696  -1.238  -4.039
  533    HD2  TYR  66           HD2      TYR  66   3.343  -2.303  -0.073
  534    HE1  TYR  66           HE1      TYR  66   3.748  -3.342  -4.899
  535    HE2  TYR  66           HE2      TYR  66   2.310  -4.329  -0.969
  536    HH   TYR  66           HH       TYR  66   2.288  -5.065  -4.487
  537    H    TYR  67           H        TYR  67   6.817   2.196  -0.157
  538    HA   TYR  67           HA       TYR  67   4.845   3.940   1.203
  539   1HB   TYR  67          1HB       TYR  67   6.718   4.540   2.634
  540   2HB   TYR  67          2HB       TYR  67   6.039   2.937   2.725
  541    HD1  TYR  67           HD1      TYR  67   7.340   0.999   1.500
  542    HD2  TYR  67           HD2      TYR  67   9.030   4.824   2.462
  543    HE1  TYR  67           HE1      TYR  67   9.583  -0.023   1.589
  544    HE2  TYR  67           HE2      TYR  67  11.243   3.763   2.807
  545    HH   TYR  67           HH       TYR  67  12.483   1.834   2.617
  546    H    THR  68           H        THR  68   4.940   6.005   0.980
  547    HA   THR  68           HA       THR  68   6.883   7.330  -0.906
  548    HB   THR  68           HB       THR  68   4.874   6.596  -2.013
  549    HG1  THR  68           HG1      THR  68   6.083   8.309  -2.770
  550   1HG2  THR  68          1HG2      THR  68   2.780   7.774  -1.726
  551   2HG2  THR  68          2HG2      THR  68   3.214   7.065  -0.158
  552   3HG2  THR  68          3HG2      THR  68   3.454   8.802  -0.456
  553    H    GLU  69           H        GLU  69   7.163   9.629  -0.638
  554    HA   GLU  69           HA       GLU  69   6.763  10.654   2.056
  555   1HB   GLU  69          1HB       GLU  69   8.867  10.892   0.674
  556   2HB   GLU  69          2HB       GLU  69   7.965  12.030  -0.331
  557   1HG   GLU  69          1HG       GLU  69   7.467  13.324   1.824
  558   2HG   GLU  69          2HG       GLU  69   8.587  12.240   2.643
  559    H    PHE  70           H        PHE  70   4.318  10.527   1.823
  560    HA   PHE  70           HA       PHE  70   3.043  12.004  -0.264
  561   1HB   PHE  70          1HB       PHE  70   1.028  11.294   0.543
  562   2HB   PHE  70          2HB       PHE  70   2.076   9.979   1.042
  563    HD1  PHE  70           HD1      PHE  70   2.994  10.256   3.452
  564    HD2  PHE  70           HD2      PHE  70  -0.502  12.323   2.078
  565    HE1  PHE  70           HE1      PHE  70   2.021  10.196   5.764
  566    HE2  PHE  70           HE2      PHE  70  -1.049  12.864   4.419
  567    HZ   PHE  70           HZ       PHE  70   0.149  11.726   6.280
  568    H    THR  71           H        THR  71   2.263  13.984  -0.335
  569    HA   THR  71           HA       THR  71   2.625  15.819   1.974
  570    HB   THR  71           HB       THR  71   2.199  16.561  -0.905
  571    HG1  THR  71           HG1      THR  71   4.584  16.063   0.530
  572   1HG2  THR  71          1HG2      THR  71   3.329  18.046   1.513
  573   2HG2  THR  71          2HG2      THR  71   3.207  18.683  -0.136
  574   3HG2  THR  71          3HG2      THR  71   1.738  18.331   0.792
  575    HA   PRO  72           HA       PRO  72  -1.995  15.336   1.829
  576   1HB   PRO  72          1HB       PRO  72  -2.555  16.345   4.335
  577   2HB   PRO  72          2HB       PRO  72  -2.108  14.666   4.005
  578   1HG   PRO  72          1HG       PRO  72  -0.369  16.926   5.000
  579   2HG   PRO  72          2HG       PRO  72  -0.349  15.218   5.526
  580   1HD   PRO  72          1HD       PRO  72   1.446  16.333   3.783
  581   2HD   PRO  72          2HD       PRO  72   1.005  14.605   3.728
  582    H    THR  73           H        THR  73  -2.671  16.915   0.406
  583    HA   THR  73           HA       THR  73  -2.579  19.770   1.193
  584    HB   THR  73           HB       THR  73  -3.666  20.243  -0.836
  585    HG1  THR  73           HG1      THR  73  -4.279  18.164  -2.093
  586   1HG2  THR  73          1HG2      THR  73  -1.856  17.881  -1.517
  587   2HG2  THR  73          2HG2      THR  73  -2.316  19.230  -2.568
  588   3HG2  THR  73          3HG2      THR  73  -1.299  19.530  -1.145
  589    H    GLU  74           H        GLU  74  -4.919  20.796   1.177
  590    HA   GLU  74           HA       GLU  74  -6.429  19.575   3.257
  591   1HB   GLU  74          1HB       GLU  74  -6.215  22.008   2.803
  592   2HB   GLU  74          2HB       GLU  74  -7.206  21.821   1.352
  593   1HG   GLU  74          1HG       GLU  74  -9.102  21.041   2.809
  594   2HG   GLU  74          2HG       GLU  74  -8.064  21.252   4.229
  595    H    LYS  75           H        LYS  75  -6.552  19.190  -0.227
  596    HA   LYS  75           HA       LYS  75  -9.257  17.948  -0.120
  597   1HB   LYS  75          1HB       LYS  75  -7.611  19.193  -2.340
  598   2HB   LYS  75          2HB       LYS  75  -9.035  18.195  -2.639
  599   1HG   LYS  75          1HG       LYS  75  -9.675  20.485  -2.721
  600   2HG   LYS  75          2HG       LYS  75 -10.462  19.711  -1.340
  601   1HD   LYS  75          1HD       LYS  75  -9.130  20.880   0.226
  602   2HD   LYS  75          2HD       LYS  75  -7.892  21.290  -0.993
  603   1HE   LYS  75          1HE       LYS  75  -9.493  22.789  -2.121
  604   2HE   LYS  75          2HE       LYS  75 -10.748  22.371  -0.936
  605   1HZ   LYS  75          1HZ       LYS  75  -8.190  23.673  -0.303
  606   2HZ   LYS  75          2HZ       LYS  75  -9.644  24.433  -0.446
  607   3HZ   LYS  75          3HZ       LYS  75  -9.401  23.346   0.764
  608    H    ASP  76           H        ASP  76  -5.870  17.181  -0.774
  609    HA   ASP  76           HA       ASP  76  -6.496  14.742  -2.281
  610   1HB   ASP  76          1HB       ASP  76  -3.906  15.950  -1.268
  611   2HB   ASP  76          2HB       ASP  76  -3.993  14.343  -1.979
  612    H    GLU  77           H        GLU  77  -7.547  13.223  -1.138
  613    HA   GLU  77           HA       GLU  77  -6.446  12.281   1.465
  614   1HB   GLU  77          1HB       GLU  77  -8.911  12.485   1.256
  615   2HB   GLU  77          2HB       GLU  77  -8.883  11.323  -0.086
  616   1HG   GLU  77          1HG       GLU  77  -7.876   9.617   1.450
  617   2HG   GLU  77          2HG       GLU  77  -7.922  10.800   2.767
  618    H    TYR  78           H        TYR  78  -4.722  10.932   1.221
  619    HA   TYR  78           HA       TYR  78  -4.202   9.624  -1.318
  620   1HB   TYR  78          1HB       TYR  78  -2.687   9.664   1.304
  621   2HB   TYR  78          2HB       TYR  78  -2.227   8.684  -0.076
  622    HD1  TYR  78           HD1      TYR  78  -3.147  12.283   0.660
  623    HD2  TYR  78           HD2      TYR  78  -0.518   9.549  -1.374
  624    HE1  TYR  78           HE1      TYR  78  -2.009  14.184  -0.433
  625    HE2  TYR  78           HE2      TYR  78   0.786  11.490  -2.251
  626    HH   TYR  78           HH       TYR  78  -0.061  14.860  -1.487
  627    H    ALA  79           H        ALA  79  -4.099   7.433  -1.703
  628    HA   ALA  79           HA       ALA  79  -5.168   5.517   0.249
  629   1HB   ALA  79          1HB       ALA  79  -7.186   6.397  -0.875
  630   2HB   ALA  79          2HB       ALA  79  -6.446   6.129  -2.467
  631   3HB   ALA  79          3HB       ALA  79  -6.883   4.750  -1.461
  632    H    CYS  80           H        CYS  80  -5.278   3.279  -0.804
  633    HA   CYS  80           HA       CYS  80  -2.851   2.799  -2.485
  634   1HB   CYS  80          1HB       CYS  80  -3.919   0.951  -0.344
  635   2HB   CYS  80          2HB       CYS  80  -2.344   0.917  -1.121
  636    H    ARG  81           H        ARG  81  -3.456   1.829  -4.410
  637    HA   ARG  81           HA       ARG  81  -5.967   0.363  -4.739
  638   1HB   ARG  81          1HB       ARG  81  -4.835   1.365  -6.669
  639   2HB   ARG  81          2HB       ARG  81  -3.386   0.420  -6.304
  640   1HG   ARG  81          1HG       ARG  81  -4.762  -1.694  -6.680
  641   2HG   ARG  81          2HG       ARG  81  -6.077  -0.647  -7.248
  642   1HD   ARG  81          1HD       ARG  81  -4.548   0.224  -9.025
  643   2HD   ARG  81          2HD       ARG  81  -3.250  -0.791  -8.353
  644    HE   ARG  81           HE       ARG  81  -5.638  -2.284  -9.058
  645   1HH1  ARG  81          1HH2      ARG  81  -2.561  -0.989 -10.374
  646   2HH1  ARG  81          2HH2      ARG  81  -2.402  -2.327 -11.495
  647   1HH2  ARG  81          1HH1      ARG  81  -5.389  -3.937 -10.646
  648   2HH2  ARG  81          2HH1      ARG  81  -3.929  -3.968 -11.609
  649    H    VAL  82           H        VAL  82  -6.223  -1.910  -4.219
  650    HA   VAL  82           HA       VAL  82  -3.746  -3.444  -3.600
  651    HB   VAL  82           HB       VAL  82  -6.396  -3.657  -2.110
  652   1HG1  VAL  82          1HG1      VAL  82  -3.635  -4.861  -1.676
  653   2HG1  VAL  82          2HG1      VAL  82  -5.046  -5.074  -0.611
  654   3HG1  VAL  82          3HG1      VAL  82  -5.072  -5.729  -2.260
  655   1HG2  VAL  82          1HG2      VAL  82  -5.354  -1.524  -1.481
  656   2HG2  VAL  82          2HG2      VAL  82  -5.136  -2.700  -0.187
  657   3HG2  VAL  82          3HG2      VAL  82  -3.781  -2.325  -1.268
  658    H    ASN  83           H        ASN  83  -3.574  -4.617  -5.428
  659    HA   ASN  83           HA       ASN  83  -5.906  -6.284  -6.230
  660   1HB   ASN  83          1HB       ASN  83  -5.711  -4.258  -7.697
  661   2HB   ASN  83          2HB       ASN  83  -4.103  -4.777  -8.149
  662   1HD2  ASN  83          2HD2      ASN  83  -7.365  -6.375  -7.779
  663   2HD2  ASN  83          1HD2      ASN  83  -7.276  -7.232  -9.299
  664    H    HIS  84           H        HIS  84  -4.715  -7.961  -4.991
  665    HA   HIS  84           HA       HIS  84  -2.120  -8.977  -5.944
  666   1HB   HIS  84          1HB       HIS  84  -2.832  -9.298  -3.642
  667   2HB   HIS  84          2HB       HIS  84  -4.282 -10.146  -4.190
  668    HD2  HIS  84           HD2      HIS  84  -0.361 -10.765  -4.209
  669    HE1  HIS  84           HE1      HIS  84  -2.423 -14.453  -4.284
  670    HE2  HIS  84           HE2      HIS  84  -0.098 -13.351  -4.155
  671    H    VAL  85           H        VAL  85  -2.054 -11.105  -7.108
  672    HA   VAL  85           HA       VAL  85  -3.697 -11.247  -9.342
  673    HB   VAL  85           HB       VAL  85  -1.531 -12.291  -9.222
  674   1HG1  VAL  85          1HG1      VAL  85  -2.776 -14.444  -7.455
  675   2HG1  VAL  85          2HG1      VAL  85  -1.178 -14.513  -8.214
  676   3HG1  VAL  85          3HG1      VAL  85  -1.510 -13.278  -6.997
  677   1HG2  VAL  85          1HG2      VAL  85  -3.683 -14.324  -9.917
  678   2HG2  VAL  85          2HG2      VAL  85  -3.143 -12.982 -10.951
  679   3HG2  VAL  85          3HG2      VAL  85  -2.018 -14.282 -10.524
  680    H    THR  86           H        THR  86  -4.240 -12.821  -6.185
  681    HA   THR  86           HA       THR  86  -6.480 -14.368  -7.187
  682    HB   THR  86           HB       THR  86  -4.803 -14.920  -5.297
  683    HG1  THR  86           HG1      THR  86  -6.525 -16.206  -6.033
  684   1HG2  THR  86          1HG2      THR  86  -7.065 -13.804  -3.611
  685   2HG2  THR  86          2HG2      THR  86  -5.504 -14.477  -3.080
  686   3HG2  THR  86          3HG2      THR  86  -5.569 -12.890  -3.886
  687    H    LEU  87           H        LEU  87  -6.138 -11.090  -5.971
  688    HA   LEU  87           HA       LEU  87  -8.953 -10.782  -5.231
  689   1HB   LEU  87          1HB       LEU  87  -6.533  -9.026  -5.465
  690   2HB   LEU  87          2HB       LEU  87  -8.096  -8.275  -5.753
  691    HG   LEU  87           HG       LEU  87  -8.955  -9.006  -3.616
  692   1HD1  LEU  87          1HD1      LEU  87  -7.575 -11.071  -3.285
  693   2HD1  LEU  87          2HD1      LEU  87  -6.145 -10.049  -3.051
  694   3HD1  LEU  87          3HD1      LEU  87  -7.492  -9.967  -1.904
  695   1HD2  LEU  87          1HD2      LEU  87  -6.278  -7.546  -3.467
  696   2HD2  LEU  87          2HD2      LEU  87  -7.855  -6.819  -3.839
  697   3HD2  LEU  87          3HD2      LEU  87  -7.550  -7.493  -2.227
  698    H    SER  88           H        SER  88 -10.373 -11.243  -6.833
  699    HA   SER  88           HA       SER  88  -9.948 -10.402  -9.599
  700   1HB   SER  88          1HB       SER  88 -12.444 -11.505  -8.251
  701   2HB   SER  88          2HB       SER  88 -12.108 -11.413  -9.993
  702    HG   SER  88           HG       SER  88 -10.277 -12.788  -9.561
  703    H    GLN  89           H        GLN  89  -9.715  -8.186  -7.810
  704    HA   GLN  89           HA       GLN  89 -11.439  -6.322  -9.049
  705   1HB   GLN  89          1HB       GLN  89 -12.409  -5.483  -6.865
  706   2HB   GLN  89          2HB       GLN  89 -13.170  -6.915  -7.563
  707   1HG   GLN  89          1HG       GLN  89 -11.979  -8.364  -5.964
  708   2HG   GLN  89          2HG       GLN  89 -11.101  -6.969  -5.317
  709   1HE2  GLN  89          2HE2      GLN  89 -14.487  -8.068  -5.932
  710   2HE2  GLN  89          1HE2      GLN  89 -15.139  -7.393  -4.453
  711    HA   PRO  90           HA       PRO  90  -7.824  -4.144  -7.319
  712   1HB   PRO  90          1HB       PRO  90  -8.079  -1.726  -8.549
  713   2HB   PRO  90          2HB       PRO  90  -7.659  -3.198  -9.471
  714   1HG   PRO  90          1HG       PRO  90 -10.379  -1.893  -9.226
  715   2HG   PRO  90          2HG       PRO  90  -9.574  -2.510 -10.690
  716   1HD   PRO  90          1HD       PRO  90 -11.440  -3.938  -9.192
  717   2HD   PRO  90          2HD       PRO  90 -10.176  -4.706 -10.201
  718    H    LYS  91           H        LYS  91  -8.509  -4.171  -5.164
  719    HA   LYS  91           HA       LYS  91 -10.841  -2.629  -4.314
  720   1HB   LYS  91          1HB       LYS  91 -10.273  -4.939  -3.538
  721   2HB   LYS  91          2HB       LYS  91  -8.881  -4.277  -2.668
  722   1HG   LYS  91          1HG       LYS  91 -10.453  -2.810  -1.367
  723   2HG   LYS  91          2HG       LYS  91 -11.813  -3.529  -2.259
  724   1HD   LYS  91          1HD       LYS  91 -11.073  -5.797  -1.442
  725   2HD   LYS  91          2HD       LYS  91  -9.871  -5.000  -0.414
  726   1HE   LYS  91          1HE       LYS  91 -12.902  -4.589  -0.292
  727   2HE   LYS  91          2HE       LYS  91 -11.960  -5.619   0.799
  728   1HZ   LYS  91          1HZ       LYS  91 -11.656  -2.712   0.527
  729   2HZ   LYS  91          2HZ       LYS  91 -12.405  -3.500   1.762
  730   3HZ   LYS  91          3HZ       LYS  91 -10.784  -3.682   1.537
  731    H    ILE  92           H        ILE  92 -10.520  -0.425  -4.155
  732    HA   ILE  92           HA       ILE  92  -7.870   0.610  -3.610
  733    HB   ILE  92           HB       ILE  92 -10.387   2.247  -3.943
  734   1HG1  ILE  92          1HG1      ILE  92 -10.452   0.794  -5.847
  735   2HG1  ILE  92          2HG1      ILE  92  -9.873   2.374  -6.347
  736   1HG2  ILE  92          1HG2      ILE  92  -7.414   2.714  -4.476
  737   2HG2  ILE  92          2HG2      ILE  92  -8.715   3.858  -4.868
  738   3HG2  ILE  92          3HG2      ILE  92  -8.382   3.429  -3.180
  739   1HD1  ILE  92          1HD1      ILE  92  -7.536   1.516  -6.403
  740   2HD1  ILE  92          2HD1      ILE  92  -8.120  -0.088  -5.905
  741   3HD1  ILE  92          3HD1      ILE  92  -8.621   0.597  -7.456
  742    H    VAL  93           H        VAL  93  -7.633  -0.338  -1.506
  743    HA   VAL  93           HA       VAL  93  -9.257   0.528   0.733
  744    HB   VAL  93           HB       VAL  93  -6.493  -0.760   0.684
  745   1HG1  VAL  93          1HG1      VAL  93  -6.981   0.266   2.858
  746   2HG1  VAL  93          2HG1      VAL  93  -8.596  -0.477   2.877
  747   3HG1  VAL  93          3HG1      VAL  93  -7.145  -1.490   2.980
  748   1HG2  VAL  93          1HG2      VAL  93  -8.087  -2.228  -0.459
  749   2HG2  VAL  93          2HG2      VAL  93  -7.748  -2.872   1.147
  750   3HG2  VAL  93          3HG2      VAL  93  -9.269  -2.004   0.847
  751    H    LYS  94           H        LYS  94  -9.244   2.673   1.303
  752    HA   LYS  94           HA       LYS  94  -6.930   4.301   0.718
  753   1HB   LYS  94          1HB       LYS  94  -8.161   6.159   1.454
  754   2HB   LYS  94          2HB       LYS  94  -9.176   5.177   0.397
  755   1HG   LYS  94          1HG       LYS  94 -10.504   4.390   2.254
  756   2HG   LYS  94          2HG       LYS  94  -9.347   5.033   3.444
  757   1HD   LYS  94          1HD       LYS  94  -9.740   7.322   2.611
  758   2HD   LYS  94          2HD       LYS  94 -10.963   6.710   1.478
  759   1HE   LYS  94          1HE       LYS  94 -12.337   5.946   3.392
  760   2HE   LYS  94          2HE       LYS  94 -11.075   6.488   4.523
  761   1HZ   LYS  94          1HZ       LYS  94 -12.599   8.203   2.695
  762   2HZ   LYS  94          2HZ       LYS  94 -12.764   8.131   4.338
  763   3HZ   LYS  94          3HZ       LYS  94 -11.377   8.718   3.661
  764    H    TRP  95           H        TRP  95  -5.982   5.786   2.257
  765    HA   TRP  95           HA       TRP  95  -5.122   4.471   4.757
  766   1HB   TRP  95          1HB       TRP  95  -3.383   5.419   3.339
  767   2HB   TRP  95          2HB       TRP  95  -4.305   6.882   3.138
  768    HD1  TRP  95           HD1      TRP  95  -2.774   5.200   6.313
  769    HE1  TRP  95           HE1      TRP  95  -1.695   7.083   7.715
  770    HE3  TRP  95           HE3      TRP  95  -3.589   9.147   3.179
  771    HZ2  TRP  95           HZ2      TRP  95  -1.677   9.970   7.696
  772    HZ3  TRP  95           HZ3      TRP  95  -2.912  11.422   3.851
  773    HH2  TRP  95           HH2      TRP  95  -2.214  11.874   6.176
  774    H    ASP  96           H        ASP  96  -5.324   5.552   6.771
  775    HA   ASP  96           HA       ASP  96  -7.040   7.945   6.941
  776   1HB   ASP  96          1HB       ASP  96  -8.510   6.000   7.443
  777   2HB   ASP  96          2HB       ASP  96  -7.359   5.452   8.673
  778    H    ARG  97           H        ARG  97  -6.670   9.053   8.985
  779    HA   ARG  97           HA       ARG  97  -3.836   9.377   9.384
  780   1HB   ARG  97          1HB       ARG  97  -5.583  11.173   9.206
  781   2HB   ARG  97          2HB       ARG  97  -6.150  10.739  10.824
  782   1HG   ARG  97          1HG       ARG  97  -3.863  11.297  11.716
  783   2HG   ARG  97          2HG       ARG  97  -3.344  11.680  10.060
  784   1HD   ARG  97          1HD       ARG  97  -5.218  13.381   9.954
  785   2HD   ARG  97          2HD       ARG  97  -5.494  13.101  11.687
  786    HE   ARG  97           HE       ARG  97  -2.756  13.670  11.378
  787   1HH1  ARG  97          1HH2      ARG  97  -5.823  15.377  10.839
  788   2HH1  ARG  97          2HH2      ARG  97  -5.097  16.961  10.947
  789   1HH2  ARG  97          1HH1      ARG  97  -1.823  15.722  11.474
  790   2HH2  ARG  97          2HH1      ARG  97  -2.800  17.166  11.333
  791    H    ASP  98           H        ASP  98  -3.509   7.179  10.162
  792    HA   ASP  98           HA       ASP  98  -3.710   6.828  13.098
  793   1HB   ASP  98          1HB       ASP  98  -5.757   5.856  12.117
  794   2HB   ASP  98          2HB       ASP  98  -4.792   4.925  10.967
  795    H    MET  99           H        MET  99  -1.455   7.250  12.972
  796    HA   MET  99           HA       MET  99   0.309   5.530  11.426
  797   1HB   MET  99          1HB       MET  99   2.119   6.712  12.546
  798   2HB   MET  99          2HB       MET  99   0.945   7.832  11.847
  799   1HG   MET  99          1HG       MET  99  -0.012   8.160  14.148
  800   2HG   MET  99          2HG       MET  99   1.271   7.108  14.775
  801   1HE   MET  99          1HE       MET  99   2.445   8.765  16.414
  802   2HE   MET  99          2HE       MET  99   2.595  10.500  16.056
  803   3HE   MET  99          3HE       MET  99   0.985   9.747  16.135
  Start of MODEL   14
    1   1H    MET   0          1H        MET   0  -2.766 -24.127  -7.132
    2   2H    MET   0          2H        MET   0  -4.099 -23.839  -6.199
    3   3H    MET   0          3H        MET   0  -3.288 -22.580  -6.870
    4    HA   MET   0           HA       MET   0  -2.244 -24.421  -4.867
    5   1HB   MET   0          1HB       MET   0  -0.321 -22.907  -4.685
    6   2HB   MET   0          2HB       MET   0  -0.471 -23.602  -6.301
    7   1HG   MET   0          1HG       MET   0  -1.462 -21.505  -7.137
    8   2HG   MET   0          2HG       MET   0  -1.352 -20.789  -5.522
    9   1HE   MET   0          1HE       MET   0  -0.066 -19.968  -8.622
   10   2HE   MET   0          2HE       MET   0  -0.302 -18.880  -7.234
   11   3HE   MET   0          3HE       MET   0   1.309 -19.045  -7.979
   12    H    ILE   1           H        ILE   1  -1.694 -23.259  -2.792
   13    HA   ILE   1           HA       ILE   1  -4.097 -22.351  -1.700
   14    HB   ILE   1           HB       ILE   1  -2.452 -23.652  -0.570
   15   1HG1  ILE   1          1HG1      ILE   1  -4.214 -22.321   0.652
   16   2HG1  ILE   1          2HG1      ILE   1  -2.853 -22.965   1.567
   17   1HG2  ILE   1          1HG2      ILE   1  -0.755 -21.152  -0.400
   18   2HG2  ILE   1          2HG2      ILE   1  -0.490 -22.659   0.503
   19   3HG2  ILE   1          3HG2      ILE   1  -0.380 -22.654  -1.267
   20   1HD1  ILE   1          1HD1      ILE   1  -1.790 -20.759   1.656
   21   2HD1  ILE   1          2HD1      ILE   1  -3.131 -20.056   0.721
   22   3HD1  ILE   1          3HD1      ILE   1  -3.423 -20.729   2.329
   23    H    GLN   2           H        GLN   2  -5.062 -20.444  -1.641
   24    HA   GLN   2           HA       GLN   2  -3.709 -18.058  -2.743
   25   1HB   GLN   2          1HB       GLN   2  -6.630 -18.671  -2.146
   26   2HB   GLN   2          2HB       GLN   2  -6.004 -17.187  -2.876
   27   1HG   GLN   2          1HG       GLN   2  -5.072 -18.543  -4.763
   28   2HG   GLN   2          2HG       GLN   2  -5.818 -19.993  -4.071
   29   1HE2  GLN   2          2HE2      GLN   2  -6.524 -19.436  -6.607
   30   2HE2  GLN   2          1HE2      GLN   2  -8.143 -18.772  -6.680
   31    H    ARG   3           H        ARG   3  -2.416 -17.479  -0.853
   32    HA   ARG   3           HA       ARG   3  -3.734 -16.849   1.661
   33   1HB   ARG   3          1HB       ARG   3  -1.023 -16.014   0.622
   34   2HB   ARG   3          2HB       ARG   3  -1.632 -15.778   2.269
   35   1HG   ARG   3          1HG       ARG   3  -1.921 -18.257   2.473
   36   2HG   ARG   3          2HG       ARG   3  -1.178 -18.449   0.870
   37   1HD   ARG   3          1HD       ARG   3   0.912 -17.373   1.739
   38   2HD   ARG   3          2HD       ARG   3   0.138 -17.188   3.311
   39    HE   ARG   3           HE       ARG   3   0.437 -19.395   3.793
   40   1HH1  ARG   3          1HH2      ARG   3   1.173 -18.924   0.343
   41   2HH1  ARG   3          2HH2      ARG   3   1.716 -20.562   0.113
   42   1HH2  ARG   3          1HH1      ARG   3   1.103 -21.551   3.455
   43   2HH2  ARG   3          2HH1      ARG   3   1.671 -22.066   1.888
   44    H    THR   4           H        THR   4  -4.416 -14.884   2.409
   45    HA   THR   4           HA       THR   4  -5.318 -13.025   0.327
   46    HB   THR   4           HB       THR   4  -6.108 -13.411   3.243
   47    HG1  THR   4           HG1      THR   4  -6.567 -15.161   1.804
   48   1HG2  THR   4          1HG2      THR   4  -7.589 -11.885   1.060
   49   2HG2  THR   4          2HG2      THR   4  -8.135 -12.162   2.719
   50   3HG2  THR   4          3HG2      THR   4  -6.726 -11.129   2.427
   51    HA   PRO   5           HA       PRO   5  -2.300 -10.018   1.726
   52   1HB   PRO   5          1HB       PRO   5  -3.385  -7.658   0.797
   53   2HB   PRO   5          2HB       PRO   5  -2.601  -8.874  -0.245
   54   1HG   PRO   5          1HG       PRO   5  -5.553  -8.539   0.304
   55   2HG   PRO   5          2HG       PRO   5  -4.736  -8.731  -1.275
   56   1HD   PRO   5          1HD       PRO   5  -5.884 -10.838  -0.024
   57   2HD   PRO   5          2HD       PRO   5  -4.322 -11.047  -0.861
   58    H    LYS   6           H        LYS   6  -2.182  -9.860   3.880
   59    HA   LYS   6           HA       LYS   6  -4.190  -8.528   5.530
   60   1HB   LYS   6          1HB       LYS   6  -2.597 -10.388   6.274
   61   2HB   LYS   6          2HB       LYS   6  -1.298  -9.178   6.206
   62   1HG   LYS   6          1HG       LYS   6  -2.913  -7.748   7.701
   63   2HG   LYS   6          2HG       LYS   6  -3.755  -9.270   7.986
   64   1HD   LYS   6          1HD       LYS   6  -0.824  -8.646   8.623
   65   2HD   LYS   6          2HD       LYS   6  -2.163  -8.727   9.766
   66   1HE   LYS   6          1HE       LYS   6  -1.105 -10.773  10.069
   67   2HE   LYS   6          2HE       LYS   6  -2.470 -11.188   9.022
   68   1HZ   LYS   6          1HZ       LYS   6   0.313 -10.721   8.177
   69   2HZ   LYS   6          2HZ       LYS   6  -0.412 -12.192   8.327
   70   3HZ   LYS   6          3HZ       LYS   6  -0.923 -11.137   7.170
   71    H    ILE   7           H        ILE   7  -4.419  -6.383   5.205
   72    HA   ILE   7           HA       ILE   7  -2.229  -4.687   4.149
   73    HB   ILE   7           HB       ILE   7  -5.204  -4.298   4.470
   74   1HG1  ILE   7          1HG1      ILE   7  -3.850  -4.432   1.788
   75   2HG1  ILE   7          2HG1      ILE   7  -4.085  -5.957   2.636
   76   1HG2  ILE   7          1HG2      ILE   7  -3.067  -2.543   3.195
   77   2HG2  ILE   7          2HG2      ILE   7  -4.812  -2.318   2.959
   78   3HG2  ILE   7          3HG2      ILE   7  -4.120  -2.143   4.573
   79   1HD1  ILE   7          1HD1      ILE   7  -6.315  -3.996   2.019
   80   2HD1  ILE   7          2HD1      ILE   7  -5.983  -5.514   1.168
   81   3HD1  ILE   7          3HD1      ILE   7  -6.487  -5.546   2.866
   82    H    GLN   8           H        GLN   8  -1.045  -3.373   5.676
   83    HA   GLN   8           HA       GLN   8  -2.588  -2.228   7.916
   84   1HB   GLN   8          1HB       GLN   8  -0.553  -2.624   9.261
   85   2HB   GLN   8          2HB       GLN   8  -1.573  -4.037   8.979
   86   1HG   GLN   8          1HG       GLN   8   0.985  -3.443   7.450
   87   2HG   GLN   8          2HG       GLN   8   0.922  -4.416   8.920
   88   1HE2  GLN   8          2HE2      GLN   8   1.626  -5.046   5.986
   89   2HE2  GLN   8          1HE2      GLN   8   0.711  -6.511   5.693
   90    H    VAL   9           H        VAL   9  -2.727  -0.474   6.409
   91    HA   VAL   9           HA       VAL   9  -0.355   0.890   5.523
   92    HB   VAL   9           HB       VAL   9  -3.213   1.910   5.744
   93   1HG1  VAL   9          1HG1      VAL   9  -1.701   3.774   5.505
   94   2HG1  VAL   9          2HG1      VAL   9  -0.757   2.938   4.265
   95   3HG1  VAL   9          3HG1      VAL   9  -2.413   3.476   3.917
   96   1HG2  VAL   9          1HG2      VAL   9  -3.243  -0.032   4.324
   97   2HG2  VAL   9          2HG2      VAL   9  -3.317   1.391   3.285
   98   3HG2  VAL   9          3HG2      VAL   9  -1.795   0.490   3.449
   99    H    TYR  10           H        TYR  10   0.886   2.312   6.617
  100    HA   TYR  10           HA       TYR  10  -0.089   3.388   9.220
  101   1HB   TYR  10          1HB       TYR  10   2.769   3.239   8.317
  102   2HB   TYR  10          2HB       TYR  10   2.133   3.464   9.938
  103    HD1  TYR  10           HD1      TYR  10   3.592   1.157   7.758
  104    HD2  TYR  10           HD2      TYR  10   0.445   1.440  10.679
  105    HE1  TYR  10           HE1      TYR  10   3.823  -1.274   8.225
  106    HE2  TYR  10           HE2      TYR  10   0.620  -1.007  11.100
  107    HH   TYR  10           HH       TYR  10   1.797  -2.920  10.696
  108    H    SER  11           H        SER  11   0.215   5.473   9.701
  109    HA   SER  11           HA       SER  11   1.200   7.421   7.647
  110   1HB   SER  11          1HB       SER  11   0.247   9.105   9.371
  111   2HB   SER  11          2HB       SER  11  -0.826   8.258   8.268
  112    HG   SER  11           HG       SER  11  -0.429   7.811  11.015
  113    H    ARG  12           H        ARG  12   3.395   7.123   7.905
  114    HA   ARG  12           HA       ARG  12   4.764   6.487  10.302
  115   1HB   ARG  12          1HB       ARG  12   5.667   6.212   8.003
  116   2HB   ARG  12          2HB       ARG  12   5.721   7.975   7.852
  117   1HG   ARG  12          1HG       ARG  12   7.361   8.048   9.765
  118   2HG   ARG  12          2HG       ARG  12   7.355   6.271   9.784
  119   1HD   ARG  12          1HD       ARG  12   8.172   6.254   7.438
  120   2HD   ARG  12          2HD       ARG  12   8.069   8.028   7.405
  121    HE   ARG  12           HE       ARG  12   9.771   7.111   9.533
  122   1HH1  ARG  12          1HH2      ARG  12   9.679   7.729   6.023
  123   2HH1  ARG  12          2HH2      ARG  12  11.372   8.127   5.926
  124   1HH2  ARG  12          1HH1      ARG  12  12.004   7.641   9.371
  125   2HH2  ARG  12          2HH1      ARG  12  12.697   8.061   7.826
  126    H    HIS  13           H        HIS  13   3.963   9.605   8.779
  127    HA   HIS  13           HA       HIS  13   4.418  10.932  11.399
  128   1HB   HIS  13          1HB       HIS  13   4.549  12.280   8.699
  129   2HB   HIS  13          2HB       HIS  13   4.898  12.987  10.288
  130    HD2  HIS  13           HD2      HIS  13   6.797  11.778   7.378
  131    HE1  HIS  13           HE1      HIS  13   9.215  10.620  10.646
  132    HE2  HIS  13           HE2      HIS  13   9.156  10.902   8.107
  133    HA   PRO  14           HA       PRO  14   0.097  11.002  11.101
  134   1HB   PRO  14          1HB       PRO  14  -0.632  12.459  13.253
  135   2HB   PRO  14          2HB       PRO  14   0.490  11.089  13.420
  136   1HG   PRO  14          1HG       PRO  14   1.254  14.013  13.084
  137   2HG   PRO  14          2HG       PRO  14   1.738  12.916  14.412
  138   1HD   PRO  14          1HD       PRO  14   3.311  13.286  12.202
  139   2HD   PRO  14          2HD       PRO  14   3.173  11.693  12.996
  140    H    ALA  15           H        ALA  15   0.982  12.658   9.044
  141    HA   ALA  15           HA       ALA  15   0.259  14.098   7.534
  142   1HB   ALA  15          1HB       ALA  15  -1.917  13.057   7.924
  143   2HB   ALA  15          2HB       ALA  15  -2.312  14.282   9.149
  144   3HB   ALA  15          3HB       ALA  15  -2.097  14.760   7.469
  145    H    GLU  16           H        GLU  16   0.430  16.171   6.957
  146    HA   GLU  16           HA       GLU  16   0.077  18.456   8.702
  147   1HB   GLU  16          1HB       GLU  16   2.229  17.459   9.567
  148   2HB   GLU  16          2HB       GLU  16   2.914  17.630   7.941
  149   1HG   GLU  16          1HG       GLU  16   2.587  20.093   8.085
  150   2HG   GLU  16          2HG       GLU  16   1.904  19.899   9.704
  151    H    ASN  17           H        ASN  17  -0.918  19.695   7.110
  152    HA   ASN  17           HA       ASN  17  -0.579  19.231   4.381
  153   1HB   ASN  17          1HB       ASN  17  -1.991  21.084   4.020
  154   2HB   ASN  17          2HB       ASN  17  -2.565  20.272   5.471
  155   1HD2  ASN  17          2HD2      ASN  17  -2.031  21.309   7.606
  156   2HD2  ASN  17          1HD2      ASN  17  -1.824  23.046   7.646
  157    H    GLY  18           H        GLY  18   0.623  20.099   2.758
  158   1HA   GLY  18          1HA       GLY  18   2.179  21.404   1.685
  159   2HA   GLY  18          2HA       GLY  18   2.360  22.419   3.122
  160    H    LYS  19           H        LYS  19   3.175  20.696   5.069
  161    HA   LYS  19           HA       LYS  19   5.950  20.200   4.304
  162   1HB   LYS  19          1HB       LYS  19   5.224  21.331   6.339
  163   2HB   LYS  19          2HB       LYS  19   4.528  19.783   6.870
  164   1HG   LYS  19          1HG       LYS  19   7.495  20.335   6.382
  165   2HG   LYS  19          2HG       LYS  19   6.692  20.334   7.960
  166   1HD   LYS  19          1HD       LYS  19   5.967  17.928   7.452
  167   2HD   LYS  19          2HD       LYS  19   7.146  17.976   6.112
  168   1HE   LYS  19          1HE       LYS  19   8.952  18.424   7.717
  169   2HE   LYS  19          2HE       LYS  19   7.776  18.398   9.052
  170   1HZ   LYS  19          1HZ       LYS  19   8.352  16.167   7.233
  171   2HZ   LYS  19          2HZ       LYS  19   8.839  16.286   8.809
  172   3HZ   LYS  19          3HZ       LYS  19   7.236  16.152   8.442
  173    H    SER  20           H        SER  20   5.886  18.596   3.088
  174    HA   SER  20           HA       SER  20   4.633  16.292   2.719
  175   1HB   SER  20          1HB       SER  20   6.688  15.158   1.898
  176   2HB   SER  20          2HB       SER  20   6.329  16.757   1.251
  177    HG   SER  20           HG       SER  20   7.874  17.589   2.779
  178    H    ASN  21           H        ASN  21   4.226  14.432   3.679
  179    HA   ASN  21           HA       ASN  21   5.545  13.625   6.239
  180   1HB   ASN  21          1HB       ASN  21   2.804  13.064   5.114
  181   2HB   ASN  21          2HB       ASN  21   3.387  12.470   6.677
  182   1HD2  ASN  21          2HD2      ASN  21   4.159  14.231   8.237
  183   2HD2  ASN  21          1HD2      ASN  21   3.183  15.678   8.290
  184    H    PHE  22           H        PHE  22   4.428  10.916   6.103
  185    HA   PHE  22           HA       PHE  22   5.562   9.686   3.670
  186   1HB   PHE  22          1HB       PHE  22   6.692   9.502   6.421
  187   2HB   PHE  22          2HB       PHE  22   6.520   7.983   5.544
  188    HD1  PHE  22           HD1      PHE  22   7.839   7.405   3.632
  189    HD2  PHE  22           HD2      PHE  22   8.199  11.296   5.455
  190    HE1  PHE  22           HE1      PHE  22   9.966   7.786   2.411
  191    HE2  PHE  22           HE2      PHE  22  10.292  11.696   4.186
  192    HZ   PHE  22           HZ       PHE  22  11.131   9.977   2.608
  193    H    LEU  23           H        LEU  23   4.060   8.433   2.929
  194    HA   LEU  23           HA       LEU  23   2.089   7.125   4.727
  195   1HB   LEU  23          1HB       LEU  23   1.171   8.586   3.016
  196   2HB   LEU  23          2HB       LEU  23   2.047   7.719   1.755
  197    HG   LEU  23           HG       LEU  23   0.633   5.740   2.195
  198   1HD1  LEU  23          1HD1      LEU  23   0.230   5.951   4.602
  199   2HD1  LEU  23          2HD1      LEU  23  -0.578   7.515   4.369
  200   3HD1  LEU  23          3HD1      LEU  23  -1.316   6.011   3.761
  201   1HD2  LEU  23          1HD2      LEU  23  -1.004   8.320   2.039
  202   2HD2  LEU  23          2HD2      LEU  23  -0.143   7.602   0.667
  203   3HD2  LEU  23          3HD2      LEU  23  -1.494   6.728   1.421
  204    H    ASN  24           H        ASN  24   2.319   5.001   5.074
  205    HA   ASN  24           HA       ASN  24   4.193   3.416   3.353
  206   1HB   ASN  24          1HB       ASN  24   3.838   3.533   6.354
  207   2HB   ASN  24          2HB       ASN  24   4.739   2.287   5.484
  208   1HD2  ASN  24          2HD2      ASN  24   6.858   2.665   6.017
  209   2HD2  ASN  24          1HD2      ASN  24   7.670   4.206   5.843
  210    H    CYS  25           H        CYS  25   2.580   2.445   2.122
  211    HA   CYS  25           HA       CYS  25   0.414   0.965   3.482
  212   1HB   CYS  25          1HB       CYS  25   1.081   1.210   0.547
  213   2HB   CYS  25          2HB       CYS  25  -0.237   0.261   1.227
  214    H    TYR  26           H        TYR  26   1.492  -0.581   4.714
  215    HA   TYR  26           HA       TYR  26   3.355  -2.401   3.354
  216   1HB   TYR  26          1HB       TYR  26   3.805  -1.610   5.677
  217   2HB   TYR  26          2HB       TYR  26   2.297  -2.291   6.194
  218    HD1  TYR  26           HD1      TYR  26   3.314  -3.691   7.898
  219    HD2  TYR  26           HD2      TYR  26   4.629  -4.067   3.811
  220    HE1  TYR  26           HE1      TYR  26   4.227  -5.935   8.392
  221    HE2  TYR  26           HE2      TYR  26   5.505  -6.289   4.293
  222    HH   TYR  26           HH       TYR  26   5.382  -7.765   7.556
  223    H    VAL  27           H        VAL  27   2.690  -4.403   2.585
  224    HA   VAL  27           HA       VAL  27   0.044  -5.449   3.425
  225    HB   VAL  27           HB       VAL  27   1.004  -5.668   0.548
  226   1HG1  VAL  27          1HG1      VAL  27  -1.790  -5.761   1.735
  227   2HG1  VAL  27          2HG1      VAL  27  -1.291  -6.224   0.094
  228   3HG1  VAL  27          3HG1      VAL  27  -0.798  -7.201   1.489
  229   1HG2  VAL  27          1HG2      VAL  27   0.787  -3.260   0.923
  230   2HG2  VAL  27          2HG2      VAL  27  -0.553  -3.879  -0.051
  231   3HG2  VAL  27          3HG2      VAL  27  -0.804  -3.522   1.680
  232    H    SER  28           H        SER  28   0.122  -7.731   3.691
  233    HA   SER  28           HA       SER  28   2.447  -9.171   2.755
  234   1HB   SER  28          1HB       SER  28   3.252  -9.755   5.062
  235   2HB   SER  28          2HB       SER  28   3.389  -8.034   4.800
  236    HG   SER  28           HG       SER  28   1.238  -9.380   6.100
  237    H    GLY  29           H        GLY  29   2.588 -11.414   3.561
  238   1HA   GLY  29          1HA       GLY  29   1.623 -13.414   4.257
  239   2HA   GLY  29          2HA       GLY  29   0.033 -12.654   4.375
  240    H    PHE  30           H        PHE  30   0.125 -11.438   1.719
  241    HA   PHE  30           HA       PHE  30  -1.281 -13.482   0.411
  242   1HB   PHE  30          1HB       PHE  30  -1.505 -11.937  -1.448
  243   2HB   PHE  30          2HB       PHE  30  -1.795 -11.158   0.058
  244    HD1  PHE  30           HD1      PHE  30  -0.289  -9.293   0.857
  245    HD2  PHE  30           HD2      PHE  30   0.571 -11.513  -2.742
  246    HE1  PHE  30           HE1      PHE  30   1.786  -7.994   0.505
  247    HE2  PHE  30           HE2      PHE  30   2.641 -10.236  -3.052
  248    HZ   PHE  30           HZ       PHE  30   3.311  -8.591  -1.344
  249    H    HIS  31           H        HIS  31  -0.800 -14.934  -1.195
  250    HA   HIS  31           HA       HIS  31   1.868 -14.910  -2.522
  251   1HB   HIS  31          1HB       HIS  31   2.410 -16.363  -0.800
  252   2HB   HIS  31          2HB       HIS  31   0.769 -16.985  -0.670
  253    HD2  HIS  31           HD2      HIS  31   0.286 -18.376  -3.590
  254    HE1  HIS  31           HE1      HIS  31   3.850 -20.438  -2.677
  255    HE2  HIS  31           HE2      HIS  31   1.759 -20.441  -4.135
  256    HA   PRO  32           HA       PRO  32   2.504 -16.203  -4.411
  257   1HB   PRO  32          1HB       PRO  32   2.597 -15.961  -7.114
  258   2HB   PRO  32          2HB       PRO  32   1.847 -17.364  -6.321
  259   1HG   PRO  32          1HG       PRO  32   0.460 -14.830  -7.222
  260   2HG   PRO  32          2HG       PRO  32   0.081 -16.492  -7.779
  261   1HD   PRO  32          1HD       PRO  32  -1.281 -15.373  -5.706
  262   2HD   PRO  32          2HD       PRO  32  -0.788 -17.085  -5.623
  263    H    SER  33           H        SER  33   3.719 -14.538  -6.427
  264    HA   SER  33           HA       SER  33   4.062 -12.287  -4.679
  265   1HB   SER  33          1HB       SER  33   6.066 -11.940  -6.029
  266   2HB   SER  33          2HB       SER  33   5.875 -13.673  -5.681
  267    HG   SER  33           HG       SER  33   6.364 -13.221  -7.896
  268    H    ASP  34           H        ASP  34   2.238 -12.665  -7.616
  269    HA   ASP  34           HA       ASP  34   2.839 -10.071  -8.710
  270   1HB   ASP  34          1HB       ASP  34   2.374 -11.962 -10.137
  271   2HB   ASP  34          2HB       ASP  34   0.780 -12.193  -9.406
  272    H    ILE  35           H        ILE  35   2.272  -8.510  -7.160
  273    HA   ILE  35           HA       ILE  35  -0.645  -7.941  -7.002
  274    HB   ILE  35           HB       ILE  35   0.176  -8.792  -4.938
  275   1HG1  ILE  35          1HG1      ILE  35  -0.226  -5.831  -4.454
  276   2HG1  ILE  35          2HG1      ILE  35  -1.542  -6.884  -4.957
  277   1HG2  ILE  35          1HG2      ILE  35   2.097  -6.493  -4.869
  278   2HG2  ILE  35          2HG2      ILE  35   1.793  -7.667  -3.569
  279   3HG2  ILE  35          3HG2      ILE  35   2.496  -8.232  -5.079
  280   1HD1  ILE  35          1HD1      ILE  35  -0.927  -8.406  -2.990
  281   2HD1  ILE  35          2HD1      ILE  35   0.089  -7.086  -2.403
  282   3HD1  ILE  35          3HD1      ILE  35  -1.647  -6.828  -2.596
  283    H    GLU  36           H        GLU  36  -1.276  -5.791  -6.878
  284    HA   GLU  36           HA       GLU  36   0.617  -3.739  -7.927
  285   1HB   GLU  36          1HB       GLU  36  -2.373  -3.671  -8.260
  286   2HB   GLU  36          2HB       GLU  36  -1.116  -2.793  -9.130
  287   1HG   GLU  36          1HG       GLU  36  -0.333  -5.045 -10.017
  288   2HG   GLU  36          2HG       GLU  36  -1.780  -5.751  -9.320
  289    H    VAL  37           H        VAL  37   0.919  -2.000  -6.573
  290    HA   VAL  37           HA       VAL  37  -1.300  -1.034  -4.919
  291    HB   VAL  37           HB       VAL  37   1.452  -1.573  -3.754
  292   1HG1  VAL  37          1HG1      VAL  37  -1.041  -0.621  -2.291
  293   2HG1  VAL  37          2HG1      VAL  37   0.543  -0.956  -1.590
  294   3HG1  VAL  37          3HG1      VAL  37   0.344   0.416  -2.680
  295   1HG2  VAL  37          1HG2      VAL  37  -1.228  -2.968  -3.338
  296   2HG2  VAL  37          2HG2      VAL  37   0.282  -3.679  -3.950
  297   3HG2  VAL  37          3HG2      VAL  37   0.151  -3.177  -2.260
  298    H    ASP  38           H        ASP  38  -1.199   0.240  -6.931
  299    HA   ASP  38           HA       ASP  38   0.788   2.366  -7.048
  300   1HB   ASP  38          1HB       ASP  38  -1.964   2.223  -8.362
  301   2HB   ASP  38          2HB       ASP  38  -0.629   3.302  -8.760
  302    H    LEU  39           H        LEU  39   0.694   4.269  -5.929
  303    HA   LEU  39           HA       LEU  39  -1.478   4.657  -3.987
  304   1HB   LEU  39          1HB       LEU  39   1.216   5.941  -4.469
  305   2HB   LEU  39          2HB       LEU  39  -0.016   6.743  -3.487
  306    HG   LEU  39           HG       LEU  39   0.081   3.971  -2.681
  307   1HD1  LEU  39          1HD1      LEU  39   2.291   3.802  -3.552
  308   2HD1  LEU  39          2HD1      LEU  39   2.802   5.261  -2.659
  309   3HD1  LEU  39          3HD1      LEU  39   2.324   3.789  -1.783
  310   1HD2  LEU  39          1HD2      LEU  39   0.883   6.579  -1.329
  311   2HD2  LEU  39          2HD2      LEU  39  -0.707   5.807  -1.274
  312   3HD2  LEU  39          3HD2      LEU  39   0.688   5.037  -0.484
  313    H    LEU  40           H        LEU  40  -3.031   6.093  -4.062
  314    HA   LEU  40           HA       LEU  40  -3.526   7.456  -6.656
  315   1HB   LEU  40          1HB       LEU  40  -4.200   4.924  -6.321
  316   2HB   LEU  40          2HB       LEU  40  -5.468   5.577  -5.304
  317    HG   LEU  40           HG       LEU  40  -6.354   5.177  -7.464
  318   1HD1  LEU  40          1HD1      LEU  40  -5.891   8.185  -7.360
  319   2HD1  LEU  40          2HD1      LEU  40  -7.197   7.323  -8.182
  320   3HD1  LEU  40          3HD1      LEU  40  -7.104   7.304  -6.411
  321   1HD2  LEU  40          1HD2      LEU  40  -4.252   5.039  -8.694
  322   2HD2  LEU  40          2HD2      LEU  40  -5.411   6.093  -9.536
  323   3HD2  LEU  40          3HD2      LEU  40  -4.055   6.787  -8.643
  324    H    LYS  41           H        LYS  41  -4.081   9.605  -6.053
  325    HA   LYS  41           HA       LYS  41  -5.072   9.997  -3.329
  326   1HB   LYS  41          1HB       LYS  41  -4.400  12.166  -5.298
  327   2HB   LYS  41          2HB       LYS  41  -4.548  12.234  -3.539
  328   1HG   LYS  41          1HG       LYS  41  -2.415  11.929  -3.389
  329   2HG   LYS  41          2HG       LYS  41  -2.548  10.287  -3.992
  330   1HD   LYS  41          1HD       LYS  41  -2.270  12.850  -5.656
  331   2HD   LYS  41          2HD       LYS  41  -0.958  11.740  -5.285
  332   1HE   LYS  41          1HE       LYS  41  -3.336  11.107  -6.988
  333   2HE   LYS  41          2HE       LYS  41  -1.700  11.449  -7.563
  334   1HZ   LYS  41          1HZ       LYS  41  -2.237   9.226  -5.735
  335   2HZ   LYS  41          2HZ       LYS  41  -2.306   9.082  -7.370
  336   3HZ   LYS  41          3HZ       LYS  41  -0.895   9.499  -6.638
  337    H    ASN  42           H        ASN  42  -6.227  12.494  -5.031
  338    HA   ASN  42           HA       ASN  42  -9.011  11.881  -4.736
  339   1HB   ASN  42          1HB       ASN  42  -9.349  14.010  -5.866
  340   2HB   ASN  42          2HB       ASN  42  -8.015  14.208  -4.726
  341   1HD2  ASN  42          2HD2      ASN  42  -5.851  14.579  -5.575
  342   2HD2  ASN  42          1HD2      ASN  42  -5.583  14.908  -7.277
  343    H    GLY  43           H        GLY  43  -6.702  11.327  -7.341
  344   1HA   GLY  43          1HA       GLY  43  -8.446   9.574  -8.762
  345   2HA   GLY  43          2HA       GLY  43  -8.482  11.180  -9.516
  346    H    GLU  44           H        GLU  44  -5.680  11.837  -8.831
  347    HA   GLU  44           HA       GLU  44  -4.409  10.809 -11.179
  348   1HB   GLU  44          1HB       GLU  44  -3.506  12.496  -8.804
  349   2HB   GLU  44          2HB       GLU  44  -2.556  12.258 -10.270
  350   1HG   GLU  44          1HG       GLU  44  -4.116  13.463 -11.608
  351   2HG   GLU  44          2HG       GLU  44  -5.377  13.412 -10.372
  352    H    ARG  45           H        ARG  45  -2.061   9.959 -10.955
  353    HA   ARG  45           HA       ARG  45  -1.915   7.801  -8.876
  354   1HB   ARG  45          1HB       ARG  45  -2.477   6.914 -11.026
  355   2HB   ARG  45          2HB       ARG  45  -1.162   7.809 -11.812
  356   1HG   ARG  45          1HG       ARG  45   0.522   6.505 -10.680
  357   2HG   ARG  45          2HG       ARG  45  -0.683   5.746  -9.617
  358   1HD   ARG  45          1HD       ARG  45  -1.697   4.579 -11.474
  359   2HD   ARG  45          2HD       ARG  45  -0.719   5.453 -12.656
  360    HE   ARG  45           HE       ARG  45   0.090   3.208 -10.919
  361   1HH1  ARG  45          1HH2      ARG  45   1.246   5.755 -13.114
  362   2HH1  ARG  45          2HH2      ARG  45   2.839   5.070 -13.262
  363   1HH2  ARG  45          1HH1      ARG  45   2.102   2.320 -11.124
  364   2HH2  ARG  45          2HH1      ARG  45   3.339   3.059 -12.131
  365    H    ILE  46           H        ILE  46  -0.023   7.703  -7.667
  366    HA   ILE  46           HA       ILE  46   2.173   9.589  -8.113
  367    HB   ILE  46           HB       ILE  46   1.224   7.679  -5.987
  368   1HG1  ILE  46          1HG1      ILE  46   2.199  10.467  -5.441
  369   2HG1  ILE  46          2HG1      ILE  46   0.725  10.362  -6.375
  370   1HG2  ILE  46          1HG2      ILE  46   3.928   8.999  -6.247
  371   2HG2  ILE  46          2HG2      ILE  46   3.266   8.323  -4.728
  372   3HG2  ILE  46          3HG2      ILE  46   3.580   7.254  -6.104
  373   1HD1  ILE  46          1HD1      ILE  46  -0.280   8.881  -4.563
  374   2HD1  ILE  46          2HD1      ILE  46   1.208   9.109  -3.622
  375   3HD1  ILE  46          3HD1      ILE  46   0.183  10.490  -4.025
  376    H    GLU  47           H        GLU  47   3.872   8.967  -9.276
  377    HA   GLU  47           HA       GLU  47   4.356   6.102  -9.862
  378   1HB   GLU  47          1HB       GLU  47   5.697   8.543 -11.047
  379   2HB   GLU  47          2HB       GLU  47   5.948   6.838 -11.475
  380   1HG   GLU  47          1HG       GLU  47   3.267   6.879 -11.705
  381   2HG   GLU  47          2HG       GLU  47   3.555   8.590 -11.970
  382    H    LYS  48           H        LYS  48   5.628   8.719  -7.825
  383    HA   LYS  48           HA       LYS  48   8.126   7.288  -7.303
  384   1HB   LYS  48          1HB       LYS  48   7.961   9.779  -7.306
  385   2HB   LYS  48          2HB       LYS  48   6.989   9.688  -5.827
  386   1HG   LYS  48          1HG       LYS  48   8.888   8.499  -4.695
  387   2HG   LYS  48          2HG       LYS  48   9.814   8.574  -6.202
  388   1HD   LYS  48          1HD       LYS  48   9.662  11.087  -6.098
  389   2HD   LYS  48          2HD       LYS  48   8.909  10.940  -4.501
  390   1HE   LYS  48          1HE       LYS  48  11.667   9.873  -5.297
  391   2HE   LYS  48          2HE       LYS  48  11.370  11.372  -4.401
  392   1HZ   LYS  48          1HZ       LYS  48  10.478  10.151  -2.625
  393   2HZ   LYS  48          2HZ       LYS  48  10.629   8.703  -3.420
  394   3HZ   LYS  48          3HZ       LYS  48  11.964   9.558  -2.977
  395    H    VAL  49           H        VAL  49   6.674   5.337  -6.903
  396    HA   VAL  49           HA       VAL  49   6.049   5.074  -3.992
  397    HB   VAL  49           HB       VAL  49   5.565   3.106  -6.271
  398   1HG1  VAL  49          1HG1      VAL  49   4.669   3.139  -3.351
  399   2HG1  VAL  49          2HG1      VAL  49   4.162   1.961  -4.579
  400   3HG1  VAL  49          3HG1      VAL  49   5.852   2.029  -4.065
  401   1HG2  VAL  49          1HG2      VAL  49   3.710   5.097  -4.923
  402   2HG2  VAL  49          2HG2      VAL  49   4.120   4.986  -6.646
  403   3HG2  VAL  49          3HG2      VAL  49   3.149   3.716  -5.897
  404    H    GLU  50           H        GLU  50   7.964   4.731  -2.940
  405    HA   GLU  50           HA       GLU  50  10.164   3.211  -4.235
  406   1HB   GLU  50          1HB       GLU  50  10.446   5.468  -2.968
  407   2HB   GLU  50          2HB       GLU  50  10.207   4.495  -1.508
  408   1HG   GLU  50          1HG       GLU  50  12.114   3.060  -2.159
  409   2HG   GLU  50          2HG       GLU  50  12.370   4.091  -3.582
  410    H    HIS  51           H        HIS  51  10.904   1.245  -3.096
  411    HA   HIS  51           HA       HIS  51   8.906   0.139  -1.195
  412   1HB   HIS  51          1HB       HIS  51   8.932  -1.987  -2.484
  413   2HB   HIS  51          2HB       HIS  51   8.214  -0.637  -3.354
  414    HD2  HIS  51           HD2      HIS  51  11.987  -1.987  -3.302
  415    HE1  HIS  51           HE1      HIS  51  10.756  -1.239  -7.271
  416    HE2  HIS  51           HE2      HIS  51  12.690  -2.048  -5.807
  417    H    SER  52           H        SER  52   9.539  -1.726  -0.081
  418    HA   SER  52           HA       SER  52  12.398  -1.782   0.654
  419   1HB   SER  52          1HB       SER  52  11.691  -3.301   2.412
  420   2HB   SER  52          2HB       SER  52  10.678  -1.846   2.406
  421    HG   SER  52           HG       SER  52   9.517  -3.858   2.580
  422    H    ASP  53           H        ASP  53  10.535  -3.174  -1.767
  423    HA   ASP  53           HA       ASP  53  10.774  -4.791  -3.224
  424   1HB   ASP  53          1HB       ASP  53  13.228  -4.213  -3.136
  425   2HB   ASP  53          2HB       ASP  53  13.456  -5.519  -1.966
  426    H    LEU  54           H        LEU  54  10.967  -7.321  -3.402
  427    HA   LEU  54           HA       LEU  54   9.103  -8.261  -1.476
  428   1HB   LEU  54          1HB       LEU  54   9.343  -8.954  -3.942
  429   2HB   LEU  54          2HB       LEU  54  10.600 -10.059  -3.388
  430    HG   LEU  54           HG       LEU  54   8.590 -11.302  -3.544
  431   1HD1  LEU  54          1HD1      LEU  54   9.917 -11.641  -1.418
  432   2HD1  LEU  54          2HD1      LEU  54   8.581 -10.788  -0.591
  433   3HD1  LEU  54          3HD1      LEU  54   8.265 -12.260  -1.479
  434   1HD2  LEU  54          1HD2      LEU  54   7.201  -8.966  -2.228
  435   2HD2  LEU  54          2HD2      LEU  54   6.808  -9.836  -3.714
  436   3HD2  LEU  54          3HD2      LEU  54   6.517 -10.575  -2.127
  437    H    SER  55           H        SER  55   9.437  -8.978   0.469
  438    HA   SER  55           HA       SER  55  11.831 -10.612   1.138
  439   1HB   SER  55          1HB       SER  55  12.171  -8.349   2.091
  440   2HB   SER  55          2HB       SER  55  10.591  -8.440   2.889
  441    HG   SER  55           HG       SER  55  12.802 -10.181   3.297
  442    H    PHE  56           H        PHE  56  10.764 -12.563   1.102
  443    HA   PHE  56           HA       PHE  56   8.076 -12.797   2.297
  444   1HB   PHE  56          1HB       PHE  56   8.033 -14.967   1.270
  445   2HB   PHE  56          2HB       PHE  56   8.493 -13.736   0.132
  446    HD1  PHE  56           HD1      PHE  56  10.824 -13.624  -0.748
  447    HD2  PHE  56           HD2      PHE  56   9.333 -16.880   1.636
  448    HE1  PHE  56           HE1      PHE  56  12.687 -15.053  -1.546
  449    HE2  PHE  56           HE2      PHE  56  11.167 -18.332   0.797
  450    HZ   PHE  56           HZ       PHE  56  12.873 -17.406  -0.761
  451    H    SER  57           H        SER  57  10.390 -12.189   4.021
  452    HA   SER  57           HA       SER  57  11.557 -12.850   5.821
  453   1HB   SER  57          1HB       SER  57  10.048 -13.371   7.708
  454   2HB   SER  57          2HB       SER  57   9.486 -12.057   6.679
  455    HG   SER  57           HG       SER  57   8.522 -14.687   6.890
  456    H    LYS  58           H        LYS  58  12.462 -14.871   4.295
  457    HA   LYS  58           HA       LYS  58  11.415 -16.938   3.301
  458   1HB   LYS  58          1HB       LYS  58  13.719 -17.369   5.273
  459   2HB   LYS  58          2HB       LYS  58  13.313 -18.430   3.911
  460   1HG   LYS  58          1HG       LYS  58  13.773 -16.576   2.317
  461   2HG   LYS  58          2HG       LYS  58  14.216 -15.531   3.674
  462   1HD   LYS  58          1HD       LYS  58  16.235 -16.301   2.757
  463   2HD   LYS  58          2HD       LYS  58  16.029 -17.130   4.308
  464   1HE   LYS  58          1HE       LYS  58  15.325 -19.187   3.138
  465   2HE   LYS  58          2HE       LYS  58  15.337 -18.333   1.582
  466   1HZ   LYS  58          1HZ       LYS  58  17.674 -18.835   3.284
  467   2HZ   LYS  58          2HZ       LYS  58  17.299 -19.618   1.883
  468   3HZ   LYS  58          3HZ       LYS  58  17.689 -18.019   1.852
  469    H    ASP  59           H        ASP  59   9.412 -16.501   5.010
  470    HA   ASP  59           HA       ASP  59   8.871 -19.171   6.167
  471   1HB   ASP  59          1HB       ASP  59   7.370 -16.542   6.202
  472   2HB   ASP  59          2HB       ASP  59   6.862 -18.006   7.055
  473    H    TRP  60           H        TRP  60   6.137 -19.256   5.795
  474    HA   TRP  60           HA       TRP  60   5.511 -19.019   2.887
  475   1HB   TRP  60          1HB       TRP  60   4.051 -20.416   5.147
  476   2HB   TRP  60          2HB       TRP  60   3.464 -20.246   3.493
  477    HD1  TRP  60           HD1      TRP  60   6.046 -22.140   5.518
  478    HE1  TRP  60           HE1      TRP  60   6.877 -24.179   4.145
  479    HE3  TRP  60           HE3      TRP  60   3.895 -21.041   1.007
  480    HZ2  TRP  60           HZ2      TRP  60   6.628 -25.174   1.479
  481    HZ3  TRP  60           HZ3      TRP  60   4.182 -22.566  -0.920
  482    HH2  TRP  60           HH2      TRP  60   5.567 -24.616  -0.706
  483    H    SER  61           H        SER  61   6.020 -16.756   4.615
  484    HA   SER  61           HA       SER  61   3.458 -15.321   4.137
  485   1HB   SER  61          1HB       SER  61   4.267 -15.165   6.547
  486   2HB   SER  61          2HB       SER  61   5.758 -14.417   5.935
  487    HG   SER  61           HG       SER  61   3.091 -13.483   5.703
  488    H    PHE  62           H        PHE  62   3.943 -13.199   2.963
  489    HA   PHE  62           HA       PHE  62   6.359 -13.222   1.292
  490   1HB   PHE  62          1HB       PHE  62   4.827 -15.181   0.670
  491   2HB   PHE  62          2HB       PHE  62   3.726 -13.981   0.070
  492    HD1  PHE  62           HD1      PHE  62   4.726 -12.295  -1.801
  493    HD2  PHE  62           HD2      PHE  62   6.649 -15.969  -0.542
  494    HE1  PHE  62           HE1      PHE  62   6.189 -12.230  -3.732
  495    HE2  PHE  62           HE2      PHE  62   8.098 -15.891  -2.495
  496    HZ   PHE  62           HZ       PHE  62   7.896 -14.013  -4.128
  497    H    TYR  63           H        TYR  63   6.698 -10.979   1.126
  498    HA   TYR  63           HA       TYR  63   4.337  -9.204   0.768
  499   1HB   TYR  63          1HB       TYR  63   4.797  -8.060   2.917
  500   2HB   TYR  63          2HB       TYR  63   4.362  -9.762   3.104
  501    HD1  TYR  63           HD1      TYR  63   5.567 -11.243   4.387
  502    HD2  TYR  63           HD2      TYR  63   7.244  -7.468   3.161
  503    HE1  TYR  63           HE1      TYR  63   7.273 -11.429   6.146
  504    HE2  TYR  63           HE2      TYR  63   8.964  -7.643   4.896
  505    HH   TYR  63           HH       TYR  63   9.742  -8.847   6.698
  506    H    LEU  64           H        LEU  64   5.041  -6.878   1.194
  507    HA   LEU  64           HA       LEU  64   7.741  -6.105   0.889
  508   1HB   LEU  64          1HB       LEU  64   7.722  -5.059  -1.285
  509   2HB   LEU  64          2HB       LEU  64   7.467  -6.786  -1.460
  510    HG   LEU  64           HG       LEU  64   5.423  -4.579  -1.785
  511   1HD1  LEU  64          1HD1      LEU  64   6.363  -6.708  -3.761
  512   2HD1  LEU  64          2HD1      LEU  64   5.209  -5.417  -4.088
  513   3HD1  LEU  64          3HD1      LEU  64   6.902  -5.009  -3.774
  514   1HD2  LEU  64          1HD2      LEU  64   5.129  -7.590  -1.755
  515   2HD2  LEU  64          2HD2      LEU  64   4.116  -6.399  -0.870
  516   3HD2  LEU  64          3HD2      LEU  64   3.965  -6.594  -2.620
  517    H    LEU  65           H        LEU  65   7.909  -3.805   1.208
  518    HA   LEU  65           HA       LEU  65   5.427  -2.530   2.217
  519   1HB   LEU  65          1HB       LEU  65   7.684  -3.057   3.556
  520   2HB   LEU  65          2HB       LEU  65   8.235  -1.578   2.755
  521    HG   LEU  65           HG       LEU  65   5.848  -1.946   4.617
  522   1HD1  LEU  65          1HD1      LEU  65   8.440  -0.381   4.864
  523   2HD1  LEU  65          2HD1      LEU  65   7.151  -0.465   6.083
  524   3HD1  LEU  65          3HD1      LEU  65   8.075  -1.925   5.659
  525   1HD2  LEU  65          1HD2      LEU  65   6.649   0.366   2.857
  526   2HD2  LEU  65          2HD2      LEU  65   5.031  -0.276   3.192
  527   3HD2  LEU  65          3HD2      LEU  65   5.873   0.673   4.422
  528    H    TYR  66           H        TYR  66   4.768  -0.613   1.212
  529    HA   TYR  66           HA       TYR  66   6.382   0.320  -1.101
  530   1HB   TYR  66          1HB       TYR  66   3.348   0.086  -1.143
  531   2HB   TYR  66          2HB       TYR  66   4.460   0.220  -2.485
  532    HD1  TYR  66           HD1      TYR  66   3.750  -2.253   0.383
  533    HD2  TYR  66           HD2      TYR  66   4.414  -1.715  -3.855
  534    HE1  TYR  66           HE1      TYR  66   2.651  -4.352  -0.045
  535    HE2  TYR  66           HE2      TYR  66   3.208  -3.839  -4.265
  536    HH   TYR  66           HH       TYR  66   1.551  -5.615  -1.630
  537    H    TYR  67           H        TYR  67   7.047   2.210  -0.073
  538    HA   TYR  67           HA       TYR  67   4.956   3.953   1.088
  539   1HB   TYR  67          1HB       TYR  67   7.072   5.094   2.066
  540   2HB   TYR  67          2HB       TYR  67   6.279   3.705   2.755
  541    HD1  TYR  67           HD1      TYR  67   8.824   4.207   0.070
  542    HD2  TYR  67           HD2      TYR  67   7.733   2.136   3.649
  543    HE1  TYR  67           HE1      TYR  67  10.871   2.804  -0.136
  544    HE2  TYR  67           HE2      TYR  67   9.746   0.697   3.434
  545    HH   TYR  67           HH       TYR  67  12.033   0.991   0.705
  546    H    THR  68           H        THR  68   4.822   6.044   0.653
  547    HA   THR  68           HA       THR  68   6.604   7.328  -1.399
  548    HB   THR  68           HB       THR  68   4.467   6.735  -2.286
  549    HG1  THR  68           HG1      THR  68   5.607   8.385  -3.173
  550   1HG2  THR  68          1HG2      THR  68   2.498   8.095  -1.743
  551   2HG2  THR  68          2HG2      THR  68   2.994   7.132  -0.331
  552   3HG2  THR  68          3HG2      THR  68   3.342   8.876  -0.404
  553    H    GLU  69           H        GLU  69   5.901   9.912  -1.176
  554    HA   GLU  69           HA       GLU  69   6.332  10.721   1.673
  555   1HB   GLU  69          1HB       GLU  69   7.274  12.074  -0.841
  556   2HB   GLU  69          2HB       GLU  69   7.598  12.576   0.833
  557   1HG   GLU  69          1HG       GLU  69   8.744  10.401   1.205
  558   2HG   GLU  69          2HG       GLU  69   8.515   9.976  -0.497
  559    H    PHE  70           H        PHE  70   3.860  10.641   1.771
  560    HA   PHE  70           HA       PHE  70   2.407  12.163  -0.160
  561   1HB   PHE  70          1HB       PHE  70   0.465  11.465   0.846
  562   2HB   PHE  70          2HB       PHE  70   1.557  10.129   1.170
  563    HD1  PHE  70           HD1      PHE  70  -0.813  12.505   2.459
  564    HD2  PHE  70           HD2      PHE  70   2.710  10.335   3.517
  565    HE1  PHE  70           HE1      PHE  70  -1.178  13.027   4.869
  566    HE2  PHE  70           HE2      PHE  70   2.032  10.385   5.948
  567    HZ   PHE  70           HZ       PHE  70   0.074  11.756   6.606
  568    H    THR  71           H        THR  71   1.735  14.161  -0.150
  569    HA   THR  71           HA       THR  71   2.125  15.920   2.226
  570    HB   THR  71           HB       THR  71   1.978  16.753  -0.636
  571    HG1  THR  71           HG1      THR  71   4.190  16.743  -0.499
  572   1HG2  THR  71          1HG2      THR  71   3.033  18.065   1.915
  573   2HG2  THR  71          2HG2      THR  71   3.019  18.790   0.295
  574   3HG2  THR  71          3HG2      THR  71   1.495  18.487   1.151
  575    HA   PRO  72           HA       PRO  72  -2.463  15.612   1.732
  576   1HB   PRO  72          1HB       PRO  72  -3.252  16.012   4.280
  577   2HB   PRO  72          2HB       PRO  72  -2.388  14.548   3.755
  578   1HG   PRO  72          1HG       PRO  72  -1.206  17.004   5.085
  579   2HG   PRO  72          2HG       PRO  72  -0.952  15.300   5.543
  580   1HD   PRO  72          1HD       PRO  72   0.791  16.697   3.935
  581   2HD   PRO  72          2HD       PRO  72   0.535  14.938   3.766
  582    H    THR  73           H        THR  73  -2.047  17.575   0.359
  583    HA   THR  73           HA       THR  73  -2.426  20.217   1.513
  584    HB   THR  73           HB       THR  73  -2.700  20.867  -0.889
  585    HG1  THR  73           HG1      THR  73  -3.354  18.723  -1.606
  586   1HG2  THR  73          1HG2      THR  73  -0.195  19.266  -0.217
  587   2HG2  THR  73          2HG2      THR  73  -0.322  20.564  -1.417
  588   3HG2  THR  73          3HG2      THR  73  -0.506  20.938   0.308
  589    H    GLU  74           H        GLU  74  -4.243  20.164   2.685
  590    HA   GLU  74           HA       GLU  74  -6.392  20.365   3.255
  591   1HB   GLU  74          1HB       GLU  74  -6.764  21.173   0.342
  592   2HB   GLU  74          2HB       GLU  74  -7.958  21.373   1.638
  593   1HG   GLU  74          1HG       GLU  74  -6.340  22.777   2.898
  594   2HG   GLU  74          2HG       GLU  74  -5.177  22.619   1.570
  595    H    LYS  75           H        LYS  75  -7.553  19.289   0.086
  596    HA   LYS  75           HA       LYS  75  -8.847  16.987   1.480
  597   1HB   LYS  75          1HB       LYS  75  -9.652  18.401  -1.079
  598   2HB   LYS  75          2HB       LYS  75 -10.592  17.209  -0.171
  599   1HG   LYS  75          1HG       LYS  75  -9.875  20.026   0.755
  600   2HG   LYS  75          2HG       LYS  75 -11.437  19.453   0.168
  601   1HD   LYS  75          1HD       LYS  75 -11.576  17.868   2.105
  602   2HD   LYS  75          2HD       LYS  75 -10.023  18.479   2.698
  603   1HE   LYS  75          1HE       LYS  75 -11.780  19.560   3.933
  604   2HE   LYS  75          2HE       LYS  75 -10.970  20.757   2.909
  605   1HZ   LYS  75          1HZ       LYS  75 -13.521  19.423   2.304
  606   2HZ   LYS  75          2HZ       LYS  75 -13.347  20.966   2.858
  607   3HZ   LYS  75          3HZ       LYS  75 -12.785  20.562   1.364
  608    H    ASP  76           H        ASP  76  -6.089  16.814   0.445
  609    HA   ASP  76           HA       ASP  76  -6.258  15.045  -1.887
  610   1HB   ASP  76          1HB       ASP  76  -4.075  16.037  -0.062
  611   2HB   ASP  76          2HB       ASP  76  -3.860  14.529  -0.957
  612    H    GLU  77           H        GLU  77  -7.608  13.390  -1.448
  613    HA   GLU  77           HA       GLU  77  -7.426  11.799   1.009
  614   1HB   GLU  77          1HB       GLU  77  -9.574  12.388  -0.078
  615   2HB   GLU  77          2HB       GLU  77  -9.103  11.471  -1.516
  616   1HG   GLU  77          1HG       GLU  77  -8.959   9.401  -0.067
  617   2HG   GLU  77          2HG       GLU  77  -9.512  10.368   1.305
  618    H    TYR  78           H        TYR  78  -5.132  11.189   0.694
  619    HA   TYR  78           HA       TYR  78  -4.260   9.615  -1.523
  620   1HB   TYR  78          1HB       TYR  78  -3.199  10.130   1.219
  621   2HB   TYR  78          2HB       TYR  78  -2.564   8.786   0.270
  622    HD1  TYR  78           HD1      TYR  78  -0.752   9.186  -1.204
  623    HD2  TYR  78           HD2      TYR  78  -3.291  12.445   0.015
  624    HE1  TYR  78           HE1      TYR  78   0.928  10.810  -1.988
  625    HE2  TYR  78           HE2      TYR  78  -1.714  14.060  -1.028
  626    HH   TYR  78           HH       TYR  78   0.346  14.350  -1.984
  627    H    ALA  79           H        ALA  79  -4.439   7.522  -1.973
  628    HA   ALA  79           HA       ALA  79  -5.403   5.572   0.032
  629   1HB   ALA  79          1HB       ALA  79  -7.312   6.453  -1.443
  630   2HB   ALA  79          2HB       ALA  79  -6.467   5.734  -2.826
  631   3HB   ALA  79          3HB       ALA  79  -7.030   4.699  -1.512
  632    H    CYS  80           H        CYS  80  -5.190   3.340  -0.896
  633    HA   CYS  80           HA       CYS  80  -2.842   3.019  -2.721
  634   1HB   CYS  80          1HB       CYS  80  -3.308   1.880   0.042
  635   2HB   CYS  80          2HB       CYS  80  -2.391   0.965  -1.163
  636    H    ARG  81           H        ARG  81  -3.412   1.892  -4.434
  637    HA   ARG  81           HA       ARG  81  -5.796   0.331  -4.709
  638   1HB   ARG  81          1HB       ARG  81  -4.408   1.204  -6.603
  639   2HB   ARG  81          2HB       ARG  81  -3.119   0.091  -6.125
  640   1HG   ARG  81          1HG       ARG  81  -4.789  -1.828  -6.503
  641   2HG   ARG  81          2HG       ARG  81  -5.859  -0.625  -7.233
  642   1HD   ARG  81          1HD       ARG  81  -3.036  -1.357  -8.123
  643   2HD   ARG  81          2HD       ARG  81  -4.545  -1.889  -8.889
  644    HE   ARG  81           HE       ARG  81  -4.349   0.992  -8.722
  645   1HH1  ARG  81          1HH2      ARG  81  -3.278  -1.823 -10.667
  646   2HH1  ARG  81          2HH2      ARG  81  -2.875  -0.836 -12.041
  647   1HH2  ARG  81          1HH1      ARG  81  -3.815   2.227 -10.553
  648   2HH2  ARG  81          2HH1      ARG  81  -3.198   1.457 -11.993
  649    H    VAL  82           H        VAL  82  -6.080  -1.989  -4.210
  650    HA   VAL  82           HA       VAL  82  -3.598  -3.494  -3.663
  651    HB   VAL  82           HB       VAL  82  -6.112  -3.815  -1.974
  652   1HG1  VAL  82          1HG1      VAL  82  -3.301  -4.979  -1.863
  653   2HG1  VAL  82          2HG1      VAL  82  -4.593  -5.292  -0.685
  654   3HG1  VAL  82          3HG1      VAL  82  -4.768  -5.853  -2.358
  655   1HG2  VAL  82          1HG2      VAL  82  -3.456  -2.510  -1.237
  656   2HG2  VAL  82          2HG2      VAL  82  -5.041  -1.703  -1.306
  657   3HG2  VAL  82          3HG2      VAL  82  -4.739  -2.952  -0.098
  658    H    ASN  83           H        ASN  83  -3.606  -4.397  -5.655
  659    HA   ASN  83           HA       ASN  83  -5.889  -6.240  -6.254
  660   1HB   ASN  83          1HB       ASN  83  -5.696  -4.302  -7.872
  661   2HB   ASN  83          2HB       ASN  83  -4.135  -4.924  -8.351
  662   1HD2  ASN  83          2HD2      ASN  83  -4.059  -7.249  -9.100
  663   2HD2  ASN  83          1HD2      ASN  83  -5.434  -7.852 -10.009
  664    H    HIS  84           H        HIS  84  -4.758  -7.833  -4.943
  665    HA   HIS  84           HA       HIS  84  -2.129  -8.882  -5.772
  666   1HB   HIS  84          1HB       HIS  84  -3.007  -9.151  -3.473
  667   2HB   HIS  84          2HB       HIS  84  -4.399 -10.014  -4.127
  668    HD2  HIS  84           HD2      HIS  84  -0.533 -10.689  -4.866
  669    HE1  HIS  84           HE1      HIS  84  -2.459 -14.231  -3.590
  670    HE2  HIS  84           HE2      HIS  84  -0.261 -13.254  -4.471
  671    H    VAL  85           H        VAL  85  -2.045 -10.894  -7.126
  672    HA   VAL  85           HA       VAL  85  -3.960 -11.042  -9.168
  673    HB   VAL  85           HB       VAL  85  -1.640 -11.809  -9.352
  674   1HG1  VAL  85          1HG1      VAL  85  -2.586 -14.313  -7.878
  675   2HG1  VAL  85          2HG1      VAL  85  -1.045 -14.099  -8.719
  676   3HG1  VAL  85          3HG1      VAL  85  -1.405 -13.125  -7.276
  677   1HG2  VAL  85          1HG2      VAL  85  -3.359 -12.405 -11.033
  678   2HG2  VAL  85          2HG2      VAL  85  -2.073 -13.615 -10.899
  679   3HG2  VAL  85          3HG2      VAL  85  -3.657 -13.933 -10.172
  680    H    THR  86           H        THR  86  -4.017 -12.664  -6.003
  681    HA   THR  86           HA       THR  86  -6.168 -14.442  -6.862
  682    HB   THR  86           HB       THR  86  -4.290 -14.662  -4.908
  683    HG1  THR  86           HG1      THR  86  -6.738 -16.010  -5.193
  684   1HG2  THR  86          1HG2      THR  86  -6.967 -14.420  -3.470
  685   2HG2  THR  86          2HG2      THR  86  -5.395 -14.854  -2.780
  686   3HG2  THR  86          3HG2      THR  86  -5.682 -13.195  -3.338
  687    H    LEU  87           H        LEU  87  -5.996 -11.168  -5.544
  688    HA   LEU  87           HA       LEU  87  -8.796 -11.058  -4.760
  689   1HB   LEU  87          1HB       LEU  87  -6.546  -9.121  -5.202
  690   2HB   LEU  87          2HB       LEU  87  -8.171  -8.519  -5.500
  691    HG   LEU  87           HG       LEU  87  -8.911  -9.076  -3.290
  692   1HD1  LEU  87          1HD1      LEU  87  -7.541 -11.080  -2.799
  693   2HD1  LEU  87          2HD1      LEU  87  -6.080 -10.079  -2.766
  694   3HD1  LEU  87          3HD1      LEU  87  -7.347  -9.842  -1.550
  695   1HD2  LEU  87          1HD2      LEU  87  -7.856  -6.895  -3.719
  696   2HD2  LEU  87          2HD2      LEU  87  -7.502  -7.427  -2.067
  697   3HD2  LEU  87          3HD2      LEU  87  -6.259  -7.564  -3.328
  698    H    SER  88           H        SER  88  -6.937 -10.138  -7.693
  699    HA   SER  88           HA       SER  88  -7.543  -9.661  -9.810
  700   1HB   SER  88          1HB       SER  88  -9.976 -11.449  -9.358
  701   2HB   SER  88          2HB       SER  88  -9.269 -10.974 -10.908
  702    HG   SER  88           HG       SER  88  -8.599 -13.049 -10.199
  703    H    GLN  89           H        GLN  89  -8.636  -8.071  -7.469
  704    HA   GLN  89           HA       GLN  89 -10.590  -6.424  -8.916
  705   1HB   GLN  89          1HB       GLN  89 -11.082  -7.637  -6.176
  706   2HB   GLN  89          2HB       GLN  89 -12.012  -6.304  -6.887
  707   1HG   GLN  89          1HG       GLN  89 -12.618  -7.798  -8.807
  708   2HG   GLN  89          2HG       GLN  89 -11.803  -9.142  -7.985
  709   1HE2  GLN  89          2HE2      GLN  89 -14.280  -9.728  -8.550
  710   2HE2  GLN  89          1HE2      GLN  89 -15.340  -9.582  -7.163
  711    HA   PRO  90           HA       PRO  90  -7.528  -3.858  -6.812
  712   1HB   PRO  90          1HB       PRO  90  -8.012  -1.456  -7.986
  713   2HB   PRO  90          2HB       PRO  90  -7.352  -2.830  -8.907
  714   1HG   PRO  90          1HG       PRO  90 -10.254  -1.965  -8.749
  715   2HG   PRO  90          2HG       PRO  90  -9.285  -2.293 -10.214
  716   1HD   PRO  90          1HD       PRO  90 -10.917  -4.173  -9.082
  717   2HD   PRO  90          2HD       PRO  90  -9.360  -4.623  -9.847
  718    H    LYS  91           H        LYS  91  -8.409  -4.197  -4.755
  719    HA   LYS  91           HA       LYS  91 -10.622  -2.649  -3.687
  720   1HB   LYS  91          1HB       LYS  91  -9.991  -4.865  -2.836
  721   2HB   LYS  91          2HB       LYS  91  -8.395  -4.263  -2.379
  722   1HG   LYS  91          1HG       LYS  91  -9.524  -2.648  -0.791
  723   2HG   LYS  91          2HG       LYS  91 -11.077  -3.397  -1.213
  724   1HD   LYS  91          1HD       LYS  91 -10.208  -5.594  -0.418
  725   2HD   LYS  91          2HD       LYS  91  -8.653  -4.829  -0.026
  726   1HE   LYS  91          1HE       LYS  91  -9.834  -3.312   1.580
  727   2HE   LYS  91          2HE       LYS  91 -11.353  -4.160   1.233
  728   1HZ   LYS  91          1HZ       LYS  91 -10.344  -6.161   2.065
  729   2HZ   LYS  91          2HZ       LYS  91  -8.930  -5.370   2.375
  730   3HZ   LYS  91          3HZ       LYS  91 -10.296  -4.972   3.205
  731    H    ILE  92           H        ILE  92 -10.205  -0.414  -4.022
  732    HA   ILE  92           HA       ILE  92  -7.601   0.685  -3.448
  733    HB   ILE  92           HB       ILE  92 -10.125   2.299  -3.876
  734   1HG1  ILE  92          1HG1      ILE  92 -10.151   0.790  -5.742
  735   2HG1  ILE  92          2HG1      ILE  92  -9.624   2.385  -6.255
  736   1HG2  ILE  92          1HG2      ILE  92  -8.188   3.530  -3.128
  737   2HG2  ILE  92          2HG2      ILE  92  -7.140   2.759  -4.325
  738   3HG2  ILE  92          3HG2      ILE  92  -8.421   3.871  -4.852
  739   1HD1  ILE  92          1HD1      ILE  92  -7.826  -0.031  -5.813
  740   2HD1  ILE  92          2HD1      ILE  92  -8.290   0.710  -7.358
  741   3HD1  ILE  92          3HD1      ILE  92  -7.244   1.596  -6.247
  742    H    VAL  93           H        VAL  93  -7.041   0.462  -1.317
  743    HA   VAL  93           HA       VAL  93  -8.900   0.990   0.874
  744    HB   VAL  93           HB       VAL  93  -5.914   0.385   0.782
  745   1HG1  VAL  93          1HG1      VAL  93  -7.825   0.524   3.159
  746   2HG1  VAL  93          2HG1      VAL  93  -6.159  -0.091   3.207
  747   3HG1  VAL  93          3HG1      VAL  93  -6.453   1.615   2.863
  748   1HG2  VAL  93          1HG2      VAL  93  -8.360  -1.320   1.432
  749   2HG2  VAL  93          2HG2      VAL  93  -7.302  -1.499   0.014
  750   3HG2  VAL  93          3HG2      VAL  93  -6.672  -1.824   1.631
  751    H    LYS  94           H        LYS  94  -9.519   3.103   1.054
  752    HA   LYS  94           HA       LYS  94  -7.738   5.351   0.612
  753   1HB   LYS  94          1HB       LYS  94 -10.530   5.004   1.721
  754   2HB   LYS  94          2HB       LYS  94  -9.629   6.485   2.049
  755   1HG   LYS  94          1HG       LYS  94 -10.994   6.859   0.150
  756   2HG   LYS  94          2HG       LYS  94  -9.293   6.925  -0.315
  757   1HD   LYS  94          1HD       LYS  94  -9.507   4.545  -1.172
  758   2HD   LYS  94          2HD       LYS  94 -11.240   4.625  -0.826
  759   1HE   LYS  94          1HE       LYS  94  -9.643   6.370  -2.766
  760   2HE   LYS  94          2HE       LYS  94 -10.757   5.061  -3.197
  761   1HZ   LYS  94          1HZ       LYS  94 -11.479   7.585  -1.874
  762   2HZ   LYS  94          2HZ       LYS  94 -11.787   7.176  -3.435
  763   3HZ   LYS  94          3HZ       LYS  94 -12.529   6.355  -2.210
  764    H    TRP  95           H        TRP  95  -6.314   6.214   1.943
  765    HA   TRP  95           HA       TRP  95  -6.062   5.217   4.732
  766   1HB   TRP  95          1HB       TRP  95  -3.987   5.151   3.539
  767   2HB   TRP  95          2HB       TRP  95  -4.264   6.713   2.818
  768    HD1  TRP  95           HD1      TRP  95  -3.489   5.259   6.315
  769    HE1  TRP  95           HE1      TRP  95  -2.388   7.124   7.732
  770    HE3  TRP  95           HE3      TRP  95  -3.761   9.048   2.971
  771    HZ2  TRP  95           HZ2      TRP  95  -2.134  10.026   7.568
  772    HZ3  TRP  95           HZ3      TRP  95  -3.189  11.400   3.650
  773    HH2  TRP  95           HH2      TRP  95  -2.673  11.881   6.033
  774    H    ASP  96           H        ASP  96  -6.771   6.483   6.366
  775    HA   ASP  96           HA       ASP  96  -6.973   9.420   6.051
  776   1HB   ASP  96          1HB       ASP  96  -9.241   7.687   6.984
  777   2HB   ASP  96          2HB       ASP  96  -9.116   9.449   7.111
  778    H    ARG  97           H        ARG  97  -5.038   9.075   7.234
  779    HA   ARG  97           HA       ARG  97  -3.666   8.889   9.029
  780   1HB   ARG  97          1HB       ARG  97  -5.042  10.928   9.483
  781   2HB   ARG  97          2HB       ARG  97  -5.995   9.981  10.626
  782   1HG   ARG  97          1HG       ARG  97  -3.144   9.555  11.166
  783   2HG   ARG  97          2HG       ARG  97  -3.440  11.280  10.968
  784   1HD   ARG  97          1HD       ARG  97  -3.652  10.798  13.262
  785   2HD   ARG  97          2HD       ARG  97  -5.299  11.100  12.671
  786    HE   ARG  97           HE       ARG  97  -4.996   8.361  12.448
  787   1HH1  ARG  97          1HH2      ARG  97  -4.714  10.659  15.135
  788   2HH1  ARG  97          2HH2      ARG  97  -5.110   9.475  16.354
  789   1HH2  ARG  97          1HH1      ARG  97  -5.346   6.789  14.061
  790   2HH2  ARG  97          2HH1      ARG  97  -5.513   7.268  15.732
  791    H    ASP  98           H        ASP  98  -3.204   6.748   9.284
  792    HA   ASP  98           HA       ASP  98  -4.826   4.845  10.702
  793   1HB   ASP  98          1HB       ASP  98  -3.136   4.102   9.169
  794   2HB   ASP  98          2HB       ASP  98  -1.876   5.026   9.996
  795    H    MET  99           H        MET  99  -1.905   6.741  11.603
  796    HA   MET  99           HA       MET  99  -2.798   6.922  14.415
  797   1HB   MET  99          1HB       MET  99  -1.444   4.892  14.244
  798   2HB   MET  99          2HB       MET  99  -0.127   5.792  13.479
  799   1HG   MET  99          1HG       MET  99   0.137   7.155  15.538
  800   2HG   MET  99          2HG       MET  99  -1.173   6.256  16.312
  801   1HE   MET  99          1HE       MET  99  -1.115   3.775  16.890
  802   2HE   MET  99          2HE       MET  99  -0.449   3.144  15.362
  803   3HE   MET  99          3HE       MET  99   0.337   2.750  16.903
  Start of MODEL   15
    1   1H    MET   0          1H        MET   0  -4.056 -25.432  -6.283
    2   2H    MET   0          2H        MET   0  -4.245 -25.658  -4.658
    3   3H    MET   0          3H        MET   0  -5.436 -24.927  -5.527
    4    HA   MET   0           HA       MET   0  -2.759 -23.882  -5.045
    5   1HB   MET   0          1HB       MET   0  -3.584 -23.245  -7.254
    6   2HB   MET   0          2HB       MET   0  -5.105 -22.660  -6.563
    7   1HG   MET   0          1HG       MET   0  -3.910 -20.895  -5.341
    8   2HG   MET   0          2HG       MET   0  -2.354 -21.552  -5.879
    9   1HE   MET   0          1HE       MET   0  -1.559 -19.234  -6.607
   10   2HE   MET   0          2HE       MET   0  -2.441 -18.150  -7.706
   11   3HE   MET   0          3HE       MET   0  -3.090 -18.489  -6.084
   12    H    ILE   1           H        ILE   1  -2.564 -22.429  -3.359
   13    HA   ILE   1           HA       ILE   1  -4.929 -21.988  -1.593
   14    HB   ILE   1           HB       ILE   1  -1.974 -21.733  -1.031
   15   1HG1  ILE   1          1HG1      ILE   1  -2.527 -24.085  -1.256
   16   2HG1  ILE   1          2HG1      ILE   1  -2.193 -23.672   0.421
   17   1HG2  ILE   1          1HG2      ILE   1  -4.396 -21.395   0.783
   18   2HG2  ILE   1          2HG2      ILE   1  -2.715 -21.500   1.349
   19   3HG2  ILE   1          3HG2      ILE   1  -3.222 -20.155   0.323
   20   1HD1  ILE   1          1HD1      ILE   1  -4.980 -24.073  -0.761
   21   2HD1  ILE   1          2HD1      ILE   1  -4.081 -25.219   0.241
   22   3HD1  ILE   1          3HD1      ILE   1  -4.615 -23.683   0.938
   23    H    GLN   2           H        GLN   2  -5.899 -20.112  -1.920
   24    HA   GLN   2           HA       GLN   2  -4.590 -17.857  -3.266
   25   1HB   GLN   2          1HB       GLN   2  -7.412 -18.205  -2.149
   26   2HB   GLN   2          2HB       GLN   2  -6.823 -16.847  -3.101
   27   1HG   GLN   2          1HG       GLN   2  -7.998 -18.249  -4.621
   28   2HG   GLN   2          2HG       GLN   2  -6.277 -18.455  -4.973
   29   1HE2  GLN   2          2HE2      GLN   2  -6.461 -20.509  -5.930
   30   2HE2  GLN   2          1HE2      GLN   2  -6.883 -21.932  -4.992
   31    H    ARG   3           H        ARG   3  -2.941 -17.709  -1.484
   32    HA   ARG   3           HA       ARG   3  -3.783 -17.181   1.191
   33   1HB   ARG   3          1HB       ARG   3  -1.690 -18.296   0.456
   34   2HB   ARG   3          2HB       ARG   3  -1.081 -16.714  -0.019
   35   1HG   ARG   3          1HG       ARG   3  -1.351 -15.948   2.355
   36   2HG   ARG   3          2HG       ARG   3  -1.961 -17.559   2.785
   37   1HD   ARG   3          1HD       ARG   3   0.166 -18.585   2.039
   38   2HD   ARG   3          2HD       ARG   3   0.781 -16.997   1.580
   39    HE   ARG   3           HE       ARG   3   1.029 -16.356   3.792
   40   1HH1  ARG   3          1HH2      ARG   3  -0.254 -19.681   3.648
   41   2HH1  ARG   3          2HH2      ARG   3   0.336 -20.097   5.235
   42   1HH2  ARG   3          1HH1      ARG   3   1.847 -16.960   5.817
   43   2HH2  ARG   3          2HH1      ARG   3   1.496 -18.532   6.498
   44    H    THR   4           H        THR   4  -4.622 -15.366   1.941
   45    HA   THR   4           HA       THR   4  -5.096 -13.212   0.220
   46    HB   THR   4           HB       THR   4  -5.713 -13.448   3.193
   47    HG1  THR   4           HG1      THR   4  -7.600 -14.518   2.407
   48   1HG2  THR   4          1HG2      THR   4  -7.278 -12.108   0.943
   49   2HG2  THR   4          2HG2      THR   4  -7.762 -12.215   2.645
   50   3HG2  THR   4          3HG2      THR   4  -6.348 -11.247   2.199
   51    HA   PRO   5           HA       PRO   5  -1.828 -10.424   1.646
   52   1HB   PRO   5          1HB       PRO   5  -2.704  -8.042   0.621
   53   2HB   PRO   5          2HB       PRO   5  -2.043  -9.352  -0.403
   54   1HG   PRO   5          1HG       PRO   5  -4.945  -8.728   0.179
   55   2HG   PRO   5          2HG       PRO   5  -4.182  -9.014  -1.409
   56   1HD   PRO   5          1HD       PRO   5  -5.494 -10.976  -0.071
   57   2HD   PRO   5          2HD       PRO   5  -4.010 -11.350  -0.991
   58    H    LYS   6           H        LYS   6  -1.532  -9.736   3.628
   59    HA   LYS   6           HA       LYS   6  -3.728  -8.619   5.265
   60   1HB   LYS   6          1HB       LYS   6  -1.070  -9.766   5.874
   61   2HB   LYS   6          2HB       LYS   6  -2.015  -8.883   7.086
   62   1HG   LYS   6          1HG       LYS   6  -3.887 -10.436   6.823
   63   2HG   LYS   6          2HG       LYS   6  -3.060 -11.256   5.488
   64   1HD   LYS   6          1HD       LYS   6  -1.251 -11.967   7.054
   65   2HD   LYS   6          2HD       LYS   6  -2.057 -11.096   8.369
   66   1HE   LYS   6          1HE       LYS   6  -2.572 -13.460   8.552
   67   2HE   LYS   6          2HE       LYS   6  -4.047 -12.573   8.137
   68   1HZ   LYS   6          1HZ       LYS   6  -2.351 -14.035   6.229
   69   2HZ   LYS   6          2HZ       LYS   6  -3.764 -14.589   6.870
   70   3HZ   LYS   6          3HZ       LYS   6  -3.770 -13.274   5.879
   71    H    ILE   7           H        ILE   7  -3.914  -6.453   4.981
   72    HA   ILE   7           HA       ILE   7  -1.624  -4.820   4.171
   73    HB   ILE   7           HB       ILE   7  -3.123  -3.134   3.660
   74   1HG1  ILE   7          1HG1      ILE   7  -4.742  -3.091   5.450
   75   2HG1  ILE   7          2HG1      ILE   7  -5.501  -3.117   3.873
   76   1HG2  ILE   7          1HG2      ILE   7  -4.211  -5.786   2.681
   77   2HG2  ILE   7          2HG2      ILE   7  -4.568  -4.196   1.986
   78   3HG2  ILE   7          3HG2      ILE   7  -2.907  -4.804   1.983
   79   1HD1  ILE   7          1HD1      ILE   7  -5.362  -5.454   5.815
   80   2HD1  ILE   7          2HD1      ILE   7  -6.768  -4.494   5.358
   81   3HD1  ILE   7          3HD1      ILE   7  -6.014  -5.553   4.157
   82    H    GLN   8           H        GLN   8  -0.508  -3.416   5.553
   83    HA   GLN   8           HA       GLN   8  -1.886  -2.423   7.969
   84   1HB   GLN   8          1HB       GLN   8   0.546  -2.377   8.827
   85   2HB   GLN   8          2HB       GLN   8  -0.438  -3.828   9.057
   86   1HG   GLN   8          1HG       GLN   8   1.585  -3.478   6.824
   87   2HG   GLN   8          2HG       GLN   8   1.974  -4.163   8.407
   88   1HE2  GLN   8          2HE2      GLN   8   2.412  -5.521   5.980
   89   2HE2  GLN   8          1HE2      GLN   8   1.391  -6.944   5.986
   90    H    VAL   9           H        VAL   9  -2.450  -0.553   7.007
   91    HA   VAL   9           HA       VAL   9  -0.493   0.898   5.307
   92    HB   VAL   9           HB       VAL   9  -3.514   1.131   5.542
   93   1HG1  VAL   9          1HG1      VAL   9  -1.507   2.385   3.622
   94   2HG1  VAL   9          2HG1      VAL   9  -3.279   2.459   3.471
   95   3HG1  VAL   9          3HG1      VAL   9  -2.473   3.229   4.844
   96   1HG2  VAL   9          1HG2      VAL   9  -2.905  -1.018   4.544
   97   2HG2  VAL   9          2HG2      VAL   9  -3.514   0.065   3.289
   98   3HG2  VAL   9          3HG2      VAL   9  -1.768  -0.223   3.432
   99    H    TYR  10           H        TYR  10   0.678   2.233   6.603
  100    HA   TYR  10           HA       TYR  10  -0.746   3.771   8.751
  101   1HB   TYR  10          1HB       TYR  10   1.329   3.616  10.010
  102   2HB   TYR  10          2HB       TYR  10   0.494   2.101   9.725
  103    HD1  TYR  10           HD1      TYR  10   1.461   0.311   8.471
  104    HD2  TYR  10           HD2      TYR  10   3.553   4.045   8.952
  105    HE1  TYR  10           HE1      TYR  10   3.548  -0.760   7.684
  106    HE2  TYR  10           HE2      TYR  10   5.652   2.954   8.175
  107    HH   TYR  10           HH       TYR  10   5.742  -0.441   7.063
  108    H    SER  11           H        SER  11   0.116   5.755   9.397
  109    HA   SER  11           HA       SER  11   1.468   7.377   7.328
  110   1HB   SER  11          1HB       SER  11  -0.652   8.154   8.527
  111   2HB   SER  11          2HB       SER  11   0.330   8.337   9.979
  112    HG   SER  11           HG       SER  11   0.827   9.551   7.456
  113    H    ARG  12           H        ARG  12   3.733   7.685   7.639
  114    HA   ARG  12           HA       ARG  12   5.002   6.618  10.051
  115   1HB   ARG  12          1HB       ARG  12   5.880   7.687   7.417
  116   2HB   ARG  12          2HB       ARG  12   7.004   7.970   8.734
  117   1HG   ARG  12          1HG       ARG  12   5.824   5.254   8.068
  118   2HG   ARG  12          2HG       ARG  12   7.358   5.843   7.415
  119   1HD   ARG  12          1HD       ARG  12   6.776   5.335  10.375
  120   2HD   ARG  12          2HD       ARG  12   7.744   4.355   9.294
  121    HE   ARG  12           HE       ARG  12   9.456   5.920   9.224
  122   1HH1  ARG  12          1HH2      ARG  12   6.852   7.103  11.373
  123   2HH1  ARG  12          2HH2      ARG  12   7.886   8.267  12.145
  124   1HH2  ARG  12          1HH1      ARG  12  10.754   7.471  10.255
  125   2HH2  ARG  12          2HH1      ARG  12  10.089   8.486  11.509
  126    H    HIS  13           H        HIS  13   5.165   9.850   8.501
  127    HA   HIS  13           HA       HIS  13   5.774  11.142  11.065
  128   1HB   HIS  13          1HB       HIS  13   5.387  12.157   8.234
  129   2HB   HIS  13          2HB       HIS  13   5.824  13.183   9.599
  130    HD2  HIS  13           HD2      HIS  13   8.062  13.638   7.787
  131    HE1  HIS  13           HE1      HIS  13   9.974  10.036   8.914
  132    HE2  HIS  13           HE2      HIS  13  10.291  12.267   7.711
  133    HA   PRO  14           HA       PRO  14   1.535  12.118  11.904
  134   1HB   PRO  14          1HB       PRO  14   1.591  14.497  13.229
  135   2HB   PRO  14          2HB       PRO  14   2.279  12.990  13.896
  136   1HG   PRO  14          1HG       PRO  14   3.760  15.214  12.476
  137   2HG   PRO  14          2HG       PRO  14   4.190  14.419  14.016
  138   1HD   PRO  14          1HD       PRO  14   5.301  13.704  11.634
  139   2HD   PRO  14          2HD       PRO  14   4.973  12.483  12.883
  140    H    ALA  15           H        ALA  15   0.212  12.478  10.218
  141    HA   ALA  15           HA       ALA  15   0.581  14.163   8.038
  142   1HB   ALA  15          1HB       ALA  15  -2.019  13.133   9.231
  143   2HB   ALA  15          2HB       ALA  15  -1.802  13.734   7.573
  144   3HB   ALA  15          3HB       ALA  15  -0.965  12.259   8.104
  145    H    GLU  16           H        GLU  16   0.184  16.281   7.589
  146    HA   GLU  16           HA       GLU  16  -1.368  18.038   9.348
  147   1HB   GLU  16          1HB       GLU  16   0.691  17.786  10.611
  148   2HB   GLU  16          2HB       GLU  16   1.666  18.062   9.174
  149   1HG   GLU  16          1HG       GLU  16   0.725  20.424   9.082
  150   2HG   GLU  16          2HG       GLU  16  -0.085  20.095  10.625
  151    H    ASN  17           H        ASN  17  -1.935  19.922   8.293
  152    HA   ASN  17           HA       ASN  17  -2.127  19.860   5.517
  153   1HB   ASN  17          1HB       ASN  17  -2.568  22.037   7.562
  154   2HB   ASN  17          2HB       ASN  17  -2.889  22.261   5.839
  155   1HD2  ASN  17          2HD2      ASN  17  -4.906  22.471   7.845
  156   2HD2  ASN  17          1HD2      ASN  17  -6.082  21.219   7.470
  157    H    GLY  18           H        GLY  18  -0.498  20.021   4.079
  158   1HA   GLY  18          1HA       GLY  18   1.161  20.963   2.838
  159   2HA   GLY  18          2HA       GLY  18   0.902  22.483   3.708
  160    H    LYS  19           H        LYS  19   1.972  19.202   4.703
  161    HA   LYS  19           HA       LYS  19   4.585  20.226   5.671
  162   1HB   LYS  19          1HB       LYS  19   2.879  20.510   7.429
  163   2HB   LYS  19          2HB       LYS  19   2.545  18.776   7.261
  164   1HG   LYS  19          1HG       LYS  19   3.878  18.935   9.188
  165   2HG   LYS  19          2HG       LYS  19   4.982  18.348   7.957
  166   1HD   LYS  19          1HD       LYS  19   6.016  20.506   7.716
  167   2HD   LYS  19          2HD       LYS  19   4.732  21.321   8.627
  168   1HE   LYS  19          1HE       LYS  19   6.540  19.186   9.842
  169   2HE   LYS  19          2HE       LYS  19   6.902  20.921   9.896
  170   1HZ   LYS  19          1HZ       LYS  19   4.856  21.280  11.053
  171   2HZ   LYS  19          2HZ       LYS  19   4.469  19.695  11.018
  172   3HZ   LYS  19          3HZ       LYS  19   5.784  20.191  11.875
  173    H    SER  20           H        SER  20   5.215  19.090   4.073
  174    HA   SER  20           HA       SER  20   4.978  16.728   2.949
  175   1HB   SER  20          1HB       SER  20   7.455  16.496   2.595
  176   2HB   SER  20          2HB       SER  20   6.661  17.997   2.121
  177    HG   SER  20           HG       SER  20   7.412  18.874   4.159
  178    H    ASN  21           H        ASN  21   4.782  14.736   3.477
  179    HA   ASN  21           HA       ASN  21   5.612  13.757   6.166
  180   1HB   ASN  21          1HB       ASN  21   3.186  14.607   5.417
  181   2HB   ASN  21          2HB       ASN  21   3.064  12.968   4.824
  182   1HD2  ASN  21          2HD2      ASN  21   3.552  15.041   7.630
  183   2HD2  ASN  21          1HD2      ASN  21   3.136  13.858   8.847
  184    H    PHE  22           H        PHE  22   4.481  11.162   5.868
  185    HA   PHE  22           HA       PHE  22   5.748   9.906   3.523
  186   1HB   PHE  22          1HB       PHE  22   6.797   9.644   6.331
  187   2HB   PHE  22          2HB       PHE  22   6.746   8.207   5.311
  188    HD1  PHE  22           HD1      PHE  22   8.204  11.613   5.554
  189    HD2  PHE  22           HD2      PHE  22   8.167   7.873   3.420
  190    HE1  PHE  22           HE1      PHE  22  10.315  12.248   4.402
  191    HE2  PHE  22           HE2      PHE  22  10.325   8.467   2.344
  192    HZ   PHE  22           HZ       PHE  22  11.380  10.668   2.805
  193    H    LEU  23           H        LEU  23   4.312   8.604   2.753
  194    HA   LEU  23           HA       LEU  23   2.254   7.316   4.484
  195   1HB   LEU  23          1HB       LEU  23   1.347   8.708   2.717
  196   2HB   LEU  23          2HB       LEU  23   2.371   7.918   1.520
  197    HG   LEU  23           HG       LEU  23   1.058   5.803   1.915
  198   1HD1  LEU  23          1HD1      LEU  23  -0.517   7.651   3.764
  199   2HD1  LEU  23          2HD1      LEU  23  -1.071   6.053   3.207
  200   3HD1  LEU  23          3HD1      LEU  23   0.342   6.181   4.262
  201   1HD2  LEU  23          1HD2      LEU  23   0.433   7.456   0.162
  202   2HD2  LEU  23          2HD2      LEU  23  -0.999   6.644   0.835
  203   3HD2  LEU  23          3HD2      LEU  23  -0.588   8.301   1.342
  204    H    ASN  24           H        ASN  24   2.212   5.104   4.657
  205    HA   ASN  24           HA       ASN  24   4.070   3.498   2.951
  206   1HB   ASN  24          1HB       ASN  24   3.754   3.522   5.949
  207   2HB   ASN  24          2HB       ASN  24   4.628   2.288   5.029
  208   1HD2  ASN  24          2HD2      ASN  24   6.808   2.638   4.684
  209   2HD2  ASN  24          1HD2      ASN  24   7.618   4.170   4.913
  210    H    CYS  25           H        CYS  25   2.498   2.529   1.742
  211    HA   CYS  25           HA       CYS  25   0.389   0.946   3.079
  212   1HB   CYS  25          1HB       CYS  25   1.281   0.715   0.190
  213   2HB   CYS  25          2HB       CYS  25  -0.191   0.128   0.928
  214    H    TYR  26           H        TYR  26   1.461  -0.683   4.345
  215    HA   TYR  26           HA       TYR  26   3.613  -2.249   2.980
  216   1HB   TYR  26          1HB       TYR  26   4.262  -1.335   5.134
  217   2HB   TYR  26          2HB       TYR  26   2.850  -1.997   5.889
  218    HD1  TYR  26           HD1      TYR  26   5.045  -3.863   3.458
  219    HD2  TYR  26           HD2      TYR  26   4.006  -3.264   7.594
  220    HE1  TYR  26           HE1      TYR  26   6.144  -5.981   4.035
  221    HE2  TYR  26           HE2      TYR  26   4.998  -5.460   8.153
  222    HH   TYR  26           HH       TYR  26   6.092  -7.331   7.351
  223    H    VAL  27           H        VAL  27   3.074  -4.235   2.236
  224    HA   VAL  27           HA       VAL  27   0.674  -5.566   3.397
  225    HB   VAL  27           HB       VAL  27   1.440  -5.860   0.460
  226   1HG1  VAL  27          1HG1      VAL  27  -1.131  -6.399   2.014
  227   2HG1  VAL  27          2HG1      VAL  27  -0.801  -6.784   0.309
  228   3HG1  VAL  27          3HG1      VAL  27   0.054  -7.634   1.604
  229   1HG2  VAL  27          1HG2      VAL  27  -0.592  -3.998   1.700
  230   2HG2  VAL  27          2HG2      VAL  27   0.826  -3.522   0.735
  231   3HG2  VAL  27          3HG2      VAL  27  -0.492  -4.429  -0.031
  232    H    SER  28           H        SER  28   0.978  -7.664   3.911
  233    HA   SER  28           HA       SER  28   3.138  -9.183   2.737
  234   1HB   SER  28          1HB       SER  28   4.108  -9.886   4.892
  235   2HB   SER  28          2HB       SER  28   4.349  -8.177   4.705
  236    HG   SER  28           HG       SER  28   2.295  -9.461   6.208
  237    H    GLY  29           H        GLY  29   2.975 -11.515   4.143
  238   1HA   GLY  29          1HA       GLY  29   1.514 -13.097   5.079
  239   2HA   GLY  29          2HA       GLY  29   0.130 -12.089   4.710
  240    H    PHE  30           H        PHE  30   1.034 -11.728   1.820
  241    HA   PHE  30           HA       PHE  30  -0.755 -13.828   0.965
  242   1HB   PHE  30          1HB       PHE  30  -0.689 -12.610  -1.202
  243   2HB   PHE  30          2HB       PHE  30  -1.151 -11.647   0.137
  244    HD1  PHE  30           HD1      PHE  30   0.239  -9.714   0.912
  245    HD2  PHE  30           HD2      PHE  30   1.469 -12.250  -2.343
  246    HE1  PHE  30           HE1      PHE  30   2.128  -8.203   0.429
  247    HE2  PHE  30           HE2      PHE  30   3.244 -10.631  -2.934
  248    HZ   PHE  30           HZ       PHE  30   3.640  -8.671  -1.478
  249    H    HIS  31           H        HIS  31  -0.408 -15.003  -1.141
  250    HA   HIS  31           HA       HIS  31   2.152 -15.037  -2.312
  251   1HB   HIS  31          1HB       HIS  31   3.043 -17.097  -1.963
  252   2HB   HIS  31          2HB       HIS  31   2.408 -16.773  -0.365
  253    HD2  HIS  31           HD2      HIS  31   1.266 -18.741  -3.610
  254    HE1  HIS  31           HE1      HIS  31   0.099 -20.898  -0.159
  255    HE2  HIS  31           HE2      HIS  31   0.076 -20.911  -2.719
  256    HA   PRO  32           HA       PRO  32   3.010 -16.483  -4.185
  257   1HB   PRO  32          1HB       PRO  32   3.196 -16.372  -6.887
  258   2HB   PRO  32          2HB       PRO  32   2.394 -17.721  -6.058
  259   1HG   PRO  32          1HG       PRO  32   1.062 -15.223  -7.133
  260   2HG   PRO  32          2HG       PRO  32   0.706 -16.914  -7.614
  261   1HD   PRO  32          1HD       PRO  32  -0.738 -15.723  -5.666
  262   2HD   PRO  32          2HD       PRO  32  -0.210 -17.413  -5.466
  263    H    SER  33           H        SER  33   4.285 -14.949  -6.290
  264    HA   SER  33           HA       SER  33   4.966 -12.747  -4.615
  265   1HB   SER  33          1HB       SER  33   6.610 -12.328  -6.491
  266   2HB   SER  33          2HB       SER  33   6.652 -13.981  -5.850
  267    HG   SER  33           HG       SER  33   5.314 -13.114  -8.199
  268    H    ASP  34           H        ASP  34   2.902 -12.996  -7.477
  269    HA   ASP  34           HA       ASP  34   3.457 -10.324  -8.374
  270   1HB   ASP  34          1HB       ASP  34   3.055 -12.116  -9.935
  271   2HB   ASP  34          2HB       ASP  34   1.461 -12.441  -9.239
  272    H    ILE  35           H        ILE  35   2.764  -8.693  -7.097
  273    HA   ILE  35           HA       ILE  35  -0.177  -8.312  -6.874
  274    HB   ILE  35           HB       ILE  35   0.631  -9.047  -4.818
  275   1HG1  ILE  35          1HG1      ILE  35   0.376  -6.069  -4.409
  276   2HG1  ILE  35          2HG1      ILE  35  -1.021  -7.037  -4.815
  277   1HG2  ILE  35          1HG2      ILE  35   2.572  -6.749  -4.839
  278   2HG2  ILE  35          2HG2      ILE  35   2.315  -7.912  -3.517
  279   3HG2  ILE  35          3HG2      ILE  35   2.992  -8.480  -5.035
  280   1HD1  ILE  35          1HD1      ILE  35  -0.437  -8.520  -2.803
  281   2HD1  ILE  35          2HD1      ILE  35   0.696  -7.271  -2.310
  282   3HD1  ILE  35          3HD1      ILE  35  -1.015  -6.871  -2.447
  283    H    GLU  36           H        GLU  36  -0.881  -6.202  -6.819
  284    HA   GLU  36           HA       GLU  36   0.844  -4.088  -8.006
  285   1HB   GLU  36          1HB       GLU  36  -2.134  -4.402  -8.455
  286   2HB   GLU  36          2HB       GLU  36  -0.948  -3.479  -9.380
  287   1HG   GLU  36          1HG       GLU  36   0.120  -5.694 -10.002
  288   2HG   GLU  36          2HG       GLU  36  -1.222  -6.511  -9.215
  289    H    VAL  37           H        VAL  37   0.996  -2.332  -6.627
  290    HA   VAL  37           HA       VAL  37  -1.368  -1.412  -5.137
  291    HB   VAL  37           HB       VAL  37   1.263  -1.845  -3.678
  292   1HG1  VAL  37          1HG1      VAL  37  -1.495  -1.075  -2.640
  293   2HG1  VAL  37          2HG1      VAL  37  -0.037  -1.336  -1.664
  294   3HG1  VAL  37          3HG1      VAL  37  -0.110   0.034  -2.775
  295   1HG2  VAL  37          1HG2      VAL  37  -1.321  -3.447  -3.525
  296   2HG2  VAL  37          2HG2      VAL  37   0.282  -4.009  -4.052
  297   3HG2  VAL  37          3HG2      VAL  37   0.010  -3.567  -2.365
  298    H    ASP  38           H        ASP  38  -1.092  -0.003  -7.080
  299    HA   ASP  38           HA       ASP  38   0.971   2.044  -6.983
  300   1HB   ASP  38          1HB       ASP  38  -1.828   2.260  -8.171
  301   2HB   ASP  38          2HB       ASP  38  -0.435   3.283  -8.515
  302    H    LEU  39           H        LEU  39   0.939   3.929  -5.750
  303    HA   LEU  39           HA       LEU  39  -1.214   4.223  -3.745
  304   1HB   LEU  39          1HB       LEU  39   1.418   5.698  -4.116
  305   2HB   LEU  39          2HB       LEU  39   0.181   6.043  -2.896
  306    HG   LEU  39           HG       LEU  39   0.405   3.460  -2.332
  307   1HD1  LEU  39          1HD1      LEU  39   2.056   2.870  -4.112
  308   2HD1  LEU  39          2HD1      LEU  39   3.161   4.094  -3.456
  309   3HD1  LEU  39          3HD1      LEU  39   2.736   2.662  -2.501
  310   1HD2  LEU  39          1HD2      LEU  39   0.878   5.309  -0.779
  311   2HD2  LEU  39          2HD2      LEU  39   2.099   4.038  -0.624
  312   3HD2  LEU  39          3HD2      LEU  39   2.484   5.518  -1.519
  313    H    LEU  40           H        LEU  40  -2.930   5.453  -4.175
  314    HA   LEU  40           HA       LEU  40  -2.960   7.102  -6.661
  315   1HB   LEU  40          1HB       LEU  40  -3.598   4.595  -6.801
  316   2HB   LEU  40          2HB       LEU  40  -5.007   5.033  -5.854
  317    HG   LEU  40           HG       LEU  40  -5.584   4.870  -8.161
  318   1HD1  LEU  40          1HD1      LEU  40  -5.476   7.861  -7.606
  319   2HD1  LEU  40          2HD1      LEU  40  -6.603   6.994  -8.653
  320   3HD1  LEU  40          3HD1      LEU  40  -6.669   6.742  -6.898
  321   1HD2  LEU  40          1HD2      LEU  40  -3.247   5.292  -9.042
  322   2HD2  LEU  40          2HD2      LEU  40  -4.559   6.045  -9.970
  323   3HD2  LEU  40          3HD2      LEU  40  -3.588   7.029  -8.872
  324    H    LYS  41           H        LYS  41  -3.661   9.166  -6.037
  325    HA   LYS  41           HA       LYS  41  -4.993   9.518  -3.548
  326   1HB   LYS  41          1HB       LYS  41  -4.390  11.446  -5.802
  327   2HB   LYS  41          2HB       LYS  41  -4.671  11.857  -4.084
  328   1HG   LYS  41          1HG       LYS  41  -2.654  10.982  -3.394
  329   2HG   LYS  41          2HG       LYS  41  -2.379  10.003  -4.831
  330   1HD   LYS  41          1HD       LYS  41  -0.979  11.905  -4.824
  331   2HD   LYS  41          2HD       LYS  41  -2.004  11.867  -6.244
  332   1HE   LYS  41          1HE       LYS  41  -3.371  13.609  -5.564
  333   2HE   LYS  41          2HE       LYS  41  -2.965  13.416  -3.848
  334   1HZ   LYS  41          1HZ       LYS  41  -0.825  14.304  -4.266
  335   2HZ   LYS  41          2HZ       LYS  41  -1.128  14.444  -5.890
  336   3HZ   LYS  41          3HZ       LYS  41  -1.966  15.368  -4.800
  337    H    ASN  42           H        ASN  42  -6.372  11.891  -4.990
  338    HA   ASN  42           HA       ASN  42  -9.087  10.954  -5.141
  339   1HB   ASN  42          1HB       ASN  42  -9.335  13.313  -6.258
  340   2HB   ASN  42          2HB       ASN  42  -8.828  13.221  -4.573
  341   1HD2  ASN  42          2HD2      ASN  42  -7.337  13.430  -7.876
  342   2HD2  ASN  42          1HD2      ASN  42  -5.970  14.381  -7.331
  343    H    GLY  43           H        GLY  43  -6.518  11.449  -7.533
  344   1HA   GLY  43          1HA       GLY  43  -7.517   9.591  -9.394
  345   2HA   GLY  43          2HA       GLY  43  -8.115  11.193  -9.880
  346    H    GLU  44           H        GLU  44  -5.066  10.282  -8.268
  347    HA   GLU  44           HA       GLU  44  -3.415  10.908 -10.635
  348   1HB   GLU  44          1HB       GLU  44  -3.733  13.059  -9.533
  349   2HB   GLU  44          2HB       GLU  44  -3.348  12.365  -7.961
  350   1HG   GLU  44          1HG       GLU  44  -1.016  11.843  -8.822
  351   2HG   GLU  44          2HG       GLU  44  -1.443  12.677 -10.324
  352    H    ARG  45           H        ARG  45  -1.973   9.274 -10.759
  353    HA   ARG  45           HA       ARG  45  -1.443   7.566  -8.430
  354   1HB   ARG  45          1HB       ARG  45  -0.359   6.095  -9.873
  355   2HB   ARG  45          2HB       ARG  45  -1.809   6.629 -10.732
  356   1HG   ARG  45          1HG       ARG  45  -0.416   8.203 -12.076
  357   2HG   ARG  45          2HG       ARG  45   1.031   7.660 -11.198
  358   1HD   ARG  45          1HD       ARG  45   0.606   5.334 -11.929
  359   2HD   ARG  45          2HD       ARG  45  -0.713   5.904 -12.953
  360    HE   ARG  45           HE       ARG  45   2.205   6.227 -13.330
  361   1HH1  ARG  45          1HH2      ARG  45  -0.977   7.403 -14.403
  362   2HH1  ARG  45          2HH2      ARG  45  -0.331   8.150 -15.843
  363   1HH2  ARG  45          1HH1      ARG  45   3.014   7.229 -15.140
  364   2HH2  ARG  45          2HH1      ARG  45   1.966   8.052 -16.280
  365    H    ILE  46           H        ILE  46   0.437   7.516  -7.237
  366    HA   ILE  46           HA       ILE  46   2.337   9.714  -7.556
  367    HB   ILE  46           HB       ILE  46   1.716   7.602  -5.459
  368   1HG1  ILE  46          1HG1      ILE  46   1.245  10.575  -5.133
  369   2HG1  ILE  46          2HG1      ILE  46   0.028   9.611  -5.971
  370   1HG2  ILE  46          1HG2      ILE  46   4.015   8.202  -5.271
  371   2HG2  ILE  46          2HG2      ILE  46   3.643   9.932  -5.518
  372   3HG2  ILE  46          3HG2      ILE  46   3.116   9.106  -4.030
  373   1HD1  ILE  46          1HD1      ILE  46  -0.125   8.050  -4.074
  374   2HD1  ILE  46          2HD1      ILE  46   1.017   9.055  -3.160
  375   3HD1  ILE  46          3HD1      ILE  46  -0.554   9.696  -3.670
  376    H    GLU  47           H        GLU  47   3.723   9.038  -9.266
  377    HA   GLU  47           HA       GLU  47   4.356   6.274  -9.619
  378   1HB   GLU  47          1HB       GLU  47   3.947   8.058 -11.370
  379   2HB   GLU  47          2HB       GLU  47   5.565   8.697 -11.023
  380   1HG   GLU  47          1HG       GLU  47   6.591   6.671 -11.749
  381   2HG   GLU  47          2HG       GLU  47   5.059   5.774 -11.696
  382    H    LYS  48           H        LYS  48   5.905   8.944  -7.910
  383    HA   LYS  48           HA       LYS  48   8.454   7.535  -7.620
  384   1HB   LYS  48          1HB       LYS  48   8.250  10.043  -7.594
  385   2HB   LYS  48          2HB       LYS  48   7.435   9.910  -6.028
  386   1HG   LYS  48          1HG       LYS  48   9.514   8.523  -5.273
  387   2HG   LYS  48          2HG       LYS  48  10.262   9.046  -6.789
  388   1HD   LYS  48          1HD       LYS  48   9.937  11.428  -6.069
  389   2HD   LYS  48          2HD       LYS  48   9.230  10.840  -4.546
  390   1HE   LYS  48          1HE       LYS  48  11.362   9.614  -4.057
  391   2HE   LYS  48          2HE       LYS  48  12.069  10.291  -5.537
  392   1HZ   LYS  48          1HZ       LYS  48  11.717  12.479  -4.586
  393   2HZ   LYS  48          2HZ       LYS  48  11.113  11.807  -3.209
  394   3HZ   LYS  48          3HZ       LYS  48  12.682  11.548  -3.625
  395    H    VAL  49           H        VAL  49   7.394   5.504  -6.972
  396    HA   VAL  49           HA       VAL  49   6.697   5.392  -4.066
  397    HB   VAL  49           HB       VAL  49   6.588   3.163  -6.137
  398   1HG1  VAL  49          1HG1      VAL  49   6.803   2.412  -3.790
  399   2HG1  VAL  49          2HG1      VAL  49   5.436   3.439  -3.323
  400   3HG1  VAL  49          3HG1      VAL  49   5.188   2.064  -4.421
  401   1HG2  VAL  49          1HG2      VAL  49   4.415   5.068  -5.200
  402   2HG2  VAL  49          2HG2      VAL  49   4.982   4.765  -6.860
  403   3HG2  VAL  49          3HG2      VAL  49   4.092   3.510  -5.996
  404    H    GLU  50           H        GLU  50   8.509   5.210  -2.824
  405    HA   GLU  50           HA       GLU  50  10.907   3.757  -3.780
  406   1HB   GLU  50          1HB       GLU  50  11.115   5.805  -2.323
  407   2HB   GLU  50          2HB       GLU  50  10.323   4.883  -1.029
  408   1HG   GLU  50          1HG       GLU  50  12.102   3.148  -1.204
  409   2HG   GLU  50          2HG       GLU  50  12.904   4.127  -2.448
  410    H    HIS  51           H        HIS  51  11.026   1.543  -3.392
  411    HA   HIS  51           HA       HIS  51   9.053   0.365  -1.516
  412   1HB   HIS  51          1HB       HIS  51   8.352  -1.266  -3.120
  413   2HB   HIS  51          2HB       HIS  51   8.111   0.337  -3.816
  414    HD2  HIS  51           HD2      HIS  51   9.871   0.990  -5.964
  415    HE1  HIS  51           HE1      HIS  51  11.356  -2.955  -6.374
  416    HE2  HIS  51           HE2      HIS  51  11.276  -0.641  -7.459
  417    H    SER  52           H        SER  52   9.570  -1.620  -0.670
  418    HA   SER  52           HA       SER  52  12.457  -1.948  -0.317
  419   1HB   SER  52          1HB       SER  52  11.903  -3.423   1.486
  420   2HB   SER  52          2HB       SER  52  10.852  -2.000   1.579
  421    HG   SER  52           HG       SER  52  10.202  -4.546   0.486
  422    H    ASP  53           H        ASP  53  10.557  -3.075  -2.755
  423    HA   ASP  53           HA       ASP  53  10.630  -4.662  -4.245
  424   1HB   ASP  53          1HB       ASP  53  13.105  -4.244  -4.148
  425   2HB   ASP  53          2HB       ASP  53  13.260  -5.627  -3.053
  426    H    LEU  54           H        LEU  54  10.436  -6.974  -4.689
  427    HA   LEU  54           HA       LEU  54   8.623  -8.089  -2.780
  428   1HB   LEU  54          1HB       LEU  54   8.253  -8.158  -5.147
  429   2HB   LEU  54          2HB       LEU  54   9.688  -9.139  -5.410
  430    HG   LEU  54           HG       LEU  54   7.419 -10.319  -5.448
  431   1HD1  LEU  54          1HD1      LEU  54   9.678 -11.416  -5.162
  432   2HD1  LEU  54          2HD1      LEU  54   9.267 -11.572  -3.441
  433   3HD1  LEU  54          3HD1      LEU  54   8.236 -12.306  -4.693
  434   1HD2  LEU  54          1HD2      LEU  54   6.417  -9.128  -3.541
  435   2HD2  LEU  54          2HD2      LEU  54   6.248 -10.886  -3.513
  436   3HD2  LEU  54          3HD2      LEU  54   7.429 -10.101  -2.450
  437    H    SER  55           H        SER  55   9.043  -9.335  -1.108
  438    HA   SER  55           HA       SER  55  11.259 -11.280  -1.039
  439   1HB   SER  55          1HB       SER  55  12.196  -9.089  -0.208
  440   2HB   SER  55          2HB       SER  55  10.938  -9.053   1.039
  441    HG   SER  55           HG       SER  55  11.768 -11.026   1.829
  442    H    PHE  56           H        PHE  56  10.381 -13.117  -0.131
  443    HA   PHE  56           HA       PHE  56   7.954 -12.892   1.525
  444   1HB   PHE  56          1HB       PHE  56   7.549 -15.067   1.156
  445   2HB   PHE  56          2HB       PHE  56   8.302 -14.605  -0.354
  446    HD1  PHE  56           HD1      PHE  56   7.834 -17.370   0.777
  447    HD2  PHE  56           HD2      PHE  56  11.261 -14.768   0.774
  448    HE1  PHE  56           HE1      PHE  56   9.321 -19.319   1.254
  449    HE2  PHE  56           HE2      PHE  56  12.734 -16.697   1.285
  450    HZ   PHE  56           HZ       PHE  56  11.763 -18.972   1.553
  451    H    SER  57           H        SER  57   7.730 -14.309   3.414
  452    HA   SER  57           HA       SER  57  10.074 -14.115   5.220
  453   1HB   SER  57          1HB       SER  57   8.616 -14.109   6.972
  454   2HB   SER  57          2HB       SER  57   7.513 -13.439   5.770
  455    HG   SER  57           HG       SER  57   6.919 -15.395   7.144
  456    H    LYS  58           H        LYS  58  10.643 -16.120   6.420
  457    HA   LYS  58           HA       LYS  58  10.705 -18.494   4.769
  458   1HB   LYS  58          1HB       LYS  58  11.400 -18.037   7.698
  459   2HB   LYS  58          2HB       LYS  58  11.664 -19.553   6.804
  460   1HG   LYS  58          1HG       LYS  58  13.156 -18.466   5.230
  461   2HG   LYS  58          2HG       LYS  58  12.825 -16.879   5.927
  462   1HD   LYS  58          1HD       LYS  58  14.990 -17.673   6.602
  463   2HD   LYS  58          2HD       LYS  58  13.950 -17.471   8.012
  464   1HE   LYS  58          1HE       LYS  58  14.282 -20.192   6.675
  465   2HE   LYS  58          2HE       LYS  58  15.503 -19.574   7.797
  466   1HZ   LYS  58          1HZ       LYS  58  12.679 -19.923   8.485
  467   2HZ   LYS  58          2HZ       LYS  58  13.910 -20.933   8.904
  468   3HZ   LYS  58          3HZ       LYS  58  13.876 -19.392   9.482
  469    H    ASP  59           H        ASP  59   8.243 -17.213   6.807
  470    HA   ASP  59           HA       ASP  59   7.012 -19.806   7.233
  471   1HB   ASP  59          1HB       ASP  59   5.691 -17.106   7.628
  472   2HB   ASP  59          2HB       ASP  59   5.339 -18.634   8.438
  473    H    TRP  60           H        TRP  60   7.554 -18.505   4.420
  474    HA   TRP  60           HA       TRP  60   6.669 -18.621   2.399
  475   1HB   TRP  60          1HB       TRP  60   4.585 -20.455   3.611
  476   2HB   TRP  60          2HB       TRP  60   5.018 -20.307   1.909
  477    HD1  TRP  60           HD1      TRP  60   6.316 -21.668   5.213
  478    HE1  TRP  60           HE1      TRP  60   8.348 -23.217   4.818
  479    HE3  TRP  60           HE3      TRP  60   6.982 -20.894   0.198
  480    HZ2  TRP  60           HZ2      TRP  60  10.043 -23.962   2.649
  481    HZ3  TRP  60           HZ3      TRP  60   8.836 -22.016  -0.997
  482    HH2  TRP  60           HH2      TRP  60  10.376 -23.542   0.216
  483    H    SER  61           H        SER  61   6.257 -16.299   3.193
  484    HA   SER  61           HA       SER  61   3.505 -15.496   2.416
  485   1HB   SER  61          1HB       SER  61   4.907 -14.723   5.016
  486   2HB   SER  61          2HB       SER  61   3.486 -13.911   4.350
  487    HG   SER  61           HG       SER  61   3.669 -16.664   5.014
  488    H    PHE  62           H        PHE  62   4.167 -14.450   0.569
  489    HA   PHE  62           HA       PHE  62   6.494 -12.914   0.196
  490   1HB   PHE  62          1HB       PHE  62   3.879 -13.076  -1.255
  491   2HB   PHE  62          2HB       PHE  62   4.997 -11.762  -1.586
  492    HD1  PHE  62           HD1      PHE  62   4.255 -15.046  -2.546
  493    HD2  PHE  62           HD2      PHE  62   7.534 -12.348  -1.876
  494    HE1  PHE  62           HE1      PHE  62   5.700 -16.495  -3.878
  495    HE2  PHE  62           HE2      PHE  62   9.054 -13.919  -2.951
  496    HZ   PHE  62           HZ       PHE  62   8.107 -15.891  -4.209
  497    H    TYR  63           H        TYR  63   6.738 -10.664   0.036
  498    HA   TYR  63           HA       TYR  63   4.597  -8.877   0.800
  499   1HB   TYR  63          1HB       TYR  63   5.594  -7.905   2.840
  500   2HB   TYR  63          2HB       TYR  63   5.144  -9.598   3.012
  501    HD1  TYR  63           HD1      TYR  63   6.484 -11.168   3.960
  502    HD2  TYR  63           HD2      TYR  63   8.018  -7.392   2.596
  503    HE1  TYR  63           HE1      TYR  63   8.552 -11.556   5.218
  504    HE2  TYR  63           HE2      TYR  63  10.097  -7.765   3.804
  505    HH   TYR  63           HH       TYR  63  11.323  -9.245   5.137
  506    H    LEU  64           H        LEU  64   5.442  -6.652   1.169
  507    HA   LEU  64           HA       LEU  64   7.979  -5.775   0.591
  508   1HB   LEU  64          1HB       LEU  64   7.842  -4.701  -1.568
  509   2HB   LEU  64          2HB       LEU  64   7.730  -6.439  -1.730
  510    HG   LEU  64           HG       LEU  64   5.532  -4.413  -2.051
  511   1HD1  LEU  64          1HD1      LEU  64   6.692  -6.459  -3.994
  512   2HD1  LEU  64          2HD1      LEU  64   5.425  -5.286  -4.365
  513   3HD1  LEU  64          3HD1      LEU  64   7.063  -4.716  -3.998
  514   1HD2  LEU  64          1HD2      LEU  64   5.400  -7.451  -2.038
  515   2HD2  LEU  64          2HD2      LEU  64   4.363  -6.317  -1.114
  516   3HD2  LEU  64          3HD2      LEU  64   4.194  -6.487  -2.866
  517    H    LEU  65           H        LEU  65   8.107  -3.522   0.840
  518    HA   LEU  65           HA       LEU  65   5.746  -2.194   2.033
  519   1HB   LEU  65          1HB       LEU  65   8.293  -2.643   2.958
  520   2HB   LEU  65          2HB       LEU  65   8.539  -1.091   2.166
  521    HG   LEU  65           HG       LEU  65   6.455  -1.738   4.298
  522   1HD1  LEU  65          1HD1      LEU  65   8.755  -1.888   5.148
  523   2HD1  LEU  65          2HD1      LEU  65   9.141  -0.301   4.448
  524   3HD1  LEU  65          3HD1      LEU  65   7.975  -0.425   5.784
  525   1HD2  LEU  65          1HD2      LEU  65   5.859   0.230   2.795
  526   2HD2  LEU  65          2HD2      LEU  65   6.094   0.629   4.503
  527   3HD2  LEU  65          3HD2      LEU  65   7.372   0.994   3.340
  528    H    TYR  66           H        TYR  66   4.943  -0.355   0.941
  529    HA   TYR  66           HA       TYR  66   6.387   0.495  -1.518
  530   1HB   TYR  66          1HB       TYR  66   3.362   0.158  -1.397
  531   2HB   TYR  66          2HB       TYR  66   4.382   0.320  -2.808
  532    HD1  TYR  66           HD1      TYR  66   4.466  -1.685  -4.130
  533    HD2  TYR  66           HD2      TYR  66   3.847  -2.078   0.132
  534    HE1  TYR  66           HE1      TYR  66   3.337  -3.880  -4.441
  535    HE2  TYR  66           HE2      TYR  66   2.811  -4.237  -0.206
  536    HH   TYR  66           HH       TYR  66   1.800  -5.613  -1.727
  537    H    TYR  67           H        TYR  67   7.005   2.394  -0.620
  538    HA   TYR  67           HA       TYR  67   4.954   4.110   0.671
  539   1HB   TYR  67          1HB       TYR  67   6.742   4.805   2.122
  540   2HB   TYR  67          2HB       TYR  67   6.180   3.158   2.223
  541    HD1  TYR  67           HD1      TYR  67   9.022   5.294   1.885
  542    HD2  TYR  67           HD2      TYR  67   7.662   1.294   1.042
  543    HE1  TYR  67           HE1      TYR  67  11.350   4.473   1.964
  544    HE2  TYR  67           HE2      TYR  67   9.981   0.484   1.070
  545    HH   TYR  67           HH       TYR  67  12.757   2.731   1.336
  546    H    THR  68           H        THR  68   5.019   6.183   0.481
  547    HA   THR  68           HA       THR  68   6.905   7.538  -1.429
  548    HB   THR  68           HB       THR  68   4.793   6.853  -2.408
  549    HG1  THR  68           HG1      THR  68   5.949   8.465  -3.316
  550   1HG2  THR  68          1HG2      THR  68   3.540   9.100  -0.764
  551   2HG2  THR  68          2HG2      THR  68   2.762   8.053  -1.965
  552   3HG2  THR  68          3HG2      THR  68   3.308   7.368  -0.430
  553    H    GLU  69           H        GLU  69   6.315  10.040  -1.337
  554    HA   GLU  69           HA       GLU  69   6.680  10.956   1.483
  555   1HB   GLU  69          1HB       GLU  69   7.635  12.210  -1.088
  556   2HB   GLU  69          2HB       GLU  69   8.070  12.690   0.561
  557   1HG   GLU  69          1HG       GLU  69   9.198  10.488   0.850
  558   2HG   GLU  69          2HG       GLU  69   8.802  10.054  -0.819
  559    H    PHE  70           H        PHE  70   4.168  10.980   1.466
  560    HA   PHE  70           HA       PHE  70   2.926  12.772  -0.440
  561   1HB   PHE  70          1HB       PHE  70   0.914  12.125   0.325
  562   2HB   PHE  70          2HB       PHE  70   1.867  10.644   0.459
  563    HD1  PHE  70           HD1      PHE  70   3.022  10.586   3.011
  564    HD2  PHE  70           HD2      PHE  70  -0.724  12.410   1.932
  565    HE1  PHE  70           HE1      PHE  70   2.215  10.361   5.357
  566    HE2  PHE  70           HE2      PHE  70  -1.288  12.588   4.315
  567    HZ   PHE  70           HZ       PHE  70   0.148  11.505   6.044
  568    H    THR  71           H        THR  71   2.149  14.728  -0.152
  569    HA   THR  71           HA       THR  71   2.620  16.222   2.397
  570    HB   THR  71           HB       THR  71   2.485  17.240  -0.418
  571    HG1  THR  71           HG1      THR  71   4.319  15.982   0.090
  572   1HG2  THR  71          1HG2      THR  71   3.380  19.305   0.679
  573   2HG2  THR  71          2HG2      THR  71   1.741  18.940   1.231
  574   3HG2  THR  71          3HG2      THR  71   3.128  18.559   2.268
  575    HA   PRO  72           HA       PRO  72  -1.987  15.913   1.740
  576   1HB   PRO  72          1HB       PRO  72  -2.848  15.756   4.318
  577   2HB   PRO  72          2HB       PRO  72  -2.110  14.392   3.447
  578   1HG   PRO  72          1HG       PRO  72  -0.791  16.315   5.384
  579   2HG   PRO  72          2HG       PRO  72  -0.654  14.549   5.394
  580   1HD   PRO  72          1HD       PRO  72   1.221  16.208   4.252
  581   2HD   PRO  72          2HD       PRO  72   0.887  14.585   3.591
  582    H    THR  73           H        THR  73  -2.925  17.843   1.154
  583    HA   THR  73           HA       THR  73  -3.011  20.117   3.078
  584    HB   THR  73           HB       THR  73  -4.042  21.336   1.302
  585    HG1  THR  73           HG1      THR  73  -3.945  18.950  -0.220
  586   1HG2  THR  73          1HG2      THR  73  -2.286  21.357  -0.368
  587   2HG2  THR  73          2HG2      THR  73  -1.572  21.155   1.245
  588   3HG2  THR  73          3HG2      THR  73  -1.701  19.766   0.145
  589    H    GLU  74           H        GLU  74  -5.437  21.049   3.076
  590    HA   GLU  74           HA       GLU  74  -7.385  19.277   4.130
  591   1HB   GLU  74          1HB       GLU  74  -7.568  21.909   2.607
  592   2HB   GLU  74          2HB       GLU  74  -8.982  21.108   3.298
  593   1HG   GLU  74          1HG       GLU  74  -6.557  21.930   4.953
  594   2HG   GLU  74          2HG       GLU  74  -7.991  22.935   4.717
  595    H    LYS  75           H        LYS  75  -6.550  20.178   0.783
  596    HA   LYS  75           HA       LYS  75  -8.790  18.588  -0.326
  597   1HB   LYS  75          1HB       LYS  75  -8.334  20.997  -0.978
  598   2HB   LYS  75          2HB       LYS  75  -6.848  20.438  -1.754
  599   1HG   LYS  75          1HG       LYS  75  -8.285  18.914  -3.200
  600   2HG   LYS  75          2HG       LYS  75  -9.717  19.607  -2.414
  601   1HD   LYS  75          1HD       LYS  75  -9.041  21.869  -3.205
  602   2HD   LYS  75          2HD       LYS  75  -7.611  21.161  -3.987
  603   1HE   LYS  75          1HE       LYS  75  -9.087  19.789  -5.442
  604   2HE   LYS  75          2HE       LYS  75 -10.515  20.503  -4.666
  605   1HZ   LYS  75          1HZ       LYS  75  -8.480  21.962  -6.199
  606   2HZ   LYS  75          2HZ       LYS  75 -10.003  21.592  -6.708
  607   3HZ   LYS  75          3HZ       LYS  75  -9.785  22.643  -5.458
  608    H    ASP  76           H        ASP  76  -7.159  16.874   0.857
  609    HA   ASP  76           HA       ASP  76  -6.081  15.395  -1.444
  610   1HB   ASP  76          1HB       ASP  76  -4.426  16.172   0.981
  611   2HB   ASP  76          2HB       ASP  76  -4.100  14.686   0.096
  612    H    GLU  77           H        GLU  77  -6.438  13.276  -1.315
  613    HA   GLU  77           HA       GLU  77  -6.721  11.932   1.266
  614   1HB   GLU  77          1HB       GLU  77  -9.051  12.559   0.555
  615   2HB   GLU  77          2HB       GLU  77  -8.820  11.600  -0.919
  616   1HG   GLU  77          1HG       GLU  77  -8.378   9.586   0.525
  617   2HG   GLU  77          2HG       GLU  77  -8.662  10.587   1.961
  618    H    TYR  78           H        TYR  78  -5.472  10.144   1.145
  619    HA   TYR  78           HA       TYR  78  -4.432   9.264  -1.516
  620   1HB   TYR  78          1HB       TYR  78  -3.149   9.698   1.164
  621   2HB   TYR  78          2HB       TYR  78  -2.512   8.495   0.042
  622    HD1  TYR  78           HD1      TYR  78  -0.604   9.255  -1.028
  623    HD2  TYR  78           HD2      TYR  78  -3.768  12.071  -0.226
  624    HE1  TYR  78           HE1      TYR  78   0.711  11.051  -2.106
  625    HE2  TYR  78           HE2      TYR  78  -2.507  13.813  -1.429
  626    HH   TYR  78           HH       TYR  78   0.773  13.255  -2.749
  627    H    ALA  79           H        ALA  79  -4.263   7.068  -1.957
  628    HA   ALA  79           HA       ALA  79  -5.264   5.139   0.039
  629   1HB   ALA  79          1HB       ALA  79  -6.401   5.384  -2.781
  630   2HB   ALA  79          2HB       ALA  79  -6.961   4.309  -1.495
  631   3HB   ALA  79          3HB       ALA  79  -7.215   6.063  -1.365
  632    H    CYS  80           H        CYS  80  -5.075   2.936  -0.646
  633    HA   CYS  80           HA       CYS  80  -2.624   2.417  -2.273
  634   1HB   CYS  80          1HB       CYS  80  -3.917   0.726  -0.117
  635   2HB   CYS  80          2HB       CYS  80  -2.341   0.466  -0.864
  636    H    ARG  81           H        ARG  81  -3.014   1.380  -4.193
  637    HA   ARG  81           HA       ARG  81  -5.689   0.501  -4.914
  638   1HB   ARG  81          1HB       ARG  81  -4.145   1.771  -6.390
  639   2HB   ARG  81          2HB       ARG  81  -3.050   0.391  -6.372
  640   1HG   ARG  81          1HG       ARG  81  -5.498  -0.711  -7.263
  641   2HG   ARG  81          2HG       ARG  81  -5.458   0.910  -7.961
  642   1HD   ARG  81          1HD       ARG  81  -2.939   0.213  -8.586
  643   2HD   ARG  81          2HD       ARG  81  -3.570  -1.414  -8.373
  644    HE   ARG  81           HE       ARG  81  -4.658  -1.215 -10.383
  645   1HH1  ARG  81          1HH2      ARG  81  -3.801   2.038  -9.255
  646   2HH1  ARG  81          2HH2      ARG  81  -4.226   2.818 -10.755
  647   1HH2  ARG  81          1HH1      ARG  81  -5.183  -0.181 -12.369
  648   2HH2  ARG  81          2HH1      ARG  81  -5.012   1.548 -12.532
  649    H    VAL  82           H        VAL  82  -5.652  -1.328  -3.107
  650    HA   VAL  82           HA       VAL  82  -3.550  -3.257  -3.225
  651    HB   VAL  82           HB       VAL  82  -6.189  -3.349  -1.726
  652   1HG1  VAL  82          1HG1      VAL  82  -3.620  -4.947  -1.361
  653   2HG1  VAL  82          2HG1      VAL  82  -5.025  -4.973  -0.273
  654   3HG1  VAL  82          3HG1      VAL  82  -5.178  -5.600  -1.914
  655   1HG2  VAL  82          1HG2      VAL  82  -3.402  -2.438  -0.883
  656   2HG2  VAL  82          2HG2      VAL  82  -4.834  -1.403  -1.066
  657   3HG2  VAL  82          3HG2      VAL  82  -4.797  -2.624   0.200
  658    H    ASN  83           H        ASN  83  -3.327  -4.652  -4.908
  659    HA   ASN  83           HA       ASN  83  -5.578  -6.473  -5.484
  660   1HB   ASN  83          1HB       ASN  83  -5.770  -4.550  -7.052
  661   2HB   ASN  83          2HB       ASN  83  -4.184  -4.931  -7.701
  662   1HD2  ASN  83          2HD2      ASN  83  -4.270  -6.214  -9.568
  663   2HD2  ASN  83          1HD2      ASN  83  -5.532  -7.382  -9.891
  664    H    HIS  84           H        HIS  84  -4.304  -8.090  -4.470
  665    HA   HIS  84           HA       HIS  84  -1.669  -8.957  -5.479
  666   1HB   HIS  84          1HB       HIS  84  -2.397  -9.432  -3.181
  667   2HB   HIS  84          2HB       HIS  84  -3.816 -10.260  -3.803
  668    HD2  HIS  84           HD2      HIS  84   0.124 -10.880  -4.030
  669    HE1  HIS  84           HE1      HIS  84  -2.011 -14.527  -4.152
  670    HE2  HIS  84           HE2      HIS  84   0.337 -13.470  -4.141
  671    H    VAL  85           H        VAL  85  -1.528 -10.959  -6.845
  672    HA   VAL  85           HA       VAL  85  -3.239 -10.971  -9.026
  673    HB   VAL  85           HB       VAL  85  -0.985 -11.928  -8.992
  674   1HG1  VAL  85          1HG1      VAL  85  -2.234 -14.383  -7.670
  675   2HG1  VAL  85          2HG1      VAL  85  -0.595 -14.236  -8.319
  676   3HG1  VAL  85          3HG1      VAL  85  -1.070 -13.269  -6.911
  677   1HG2  VAL  85          1HG2      VAL  85  -3.063 -13.873 -10.047
  678   2HG2  VAL  85          2HG2      VAL  85  -2.531 -12.376 -10.849
  679   3HG2  VAL  85          3HG2      VAL  85  -1.381 -13.697 -10.583
  680    H    THR  86           H        THR  86  -3.645 -12.776  -5.979
  681    HA   THR  86           HA       THR  86  -5.795 -14.379  -7.079
  682    HB   THR  86           HB       THR  86  -4.079 -14.913  -5.146
  683    HG1  THR  86           HG1      THR  86  -5.527 -16.296  -6.176
  684   1HG2  THR  86          1HG2      THR  86  -6.604 -14.237  -3.583
  685   2HG2  THR  86          2HG2      THR  86  -5.069 -14.882  -2.969
  686   3HG2  THR  86          3HG2      THR  86  -5.157 -13.206  -3.555
  687    H    LEU  87           H        LEU  87  -5.673 -11.158  -5.677
  688    HA   LEU  87           HA       LEU  87  -8.530 -11.073  -5.046
  689   1HB   LEU  87          1HB       LEU  87  -6.335  -9.037  -5.346
  690   2HB   LEU  87          2HB       LEU  87  -7.993  -8.534  -5.565
  691    HG   LEU  87           HG       LEU  87  -8.659  -9.252  -3.384
  692   1HD1  LEU  87          1HD1      LEU  87  -5.785 -10.144  -2.943
  693   2HD1  LEU  87          2HD1      LEU  87  -7.049 -10.065  -1.705
  694   3HD1  LEU  87          3HD1      LEU  87  -7.191 -11.219  -3.038
  695   1HD2  LEU  87          1HD2      LEU  87  -7.670  -6.993  -3.680
  696   2HD2  LEU  87          2HD2      LEU  87  -7.344  -7.635  -2.058
  697   3HD2  LEU  87          3HD2      LEU  87  -6.065  -7.645  -3.287
  698    H    SER  88           H        SER  88  -9.876 -11.631  -6.617
  699    HA   SER  88           HA       SER  88  -9.512 -11.088  -9.433
  700   1HB   SER  88          1HB       SER  88 -11.989 -11.808  -7.808
  701   2HB   SER  88          2HB       SER  88 -11.859 -11.846  -9.578
  702    HG   SER  88           HG       SER  88 -10.233 -13.345  -7.791
  703    H    GLN  89           H        GLN  89 -10.241  -9.029  -6.794
  704    HA   GLN  89           HA       GLN  89 -11.441  -6.981  -8.562
  705   1HB   GLN  89          1HB       GLN  89 -12.361  -7.820  -5.797
  706   2HB   GLN  89          2HB       GLN  89 -12.868  -6.323  -6.585
  707   1HG   GLN  89          1HG       GLN  89 -13.381  -9.104  -7.748
  708   2HG   GLN  89          2HG       GLN  89 -14.498  -8.225  -6.712
  709   1HE2  GLN  89          2HE2      GLN  89 -12.955  -8.230  -9.924
  710   2HE2  GLN  89          1HE2      GLN  89 -14.085  -7.103 -10.649
  711    HA   PRO  90           HA       PRO  90  -7.997  -4.960  -6.355
  712   1HB   PRO  90          1HB       PRO  90  -8.079  -2.507  -7.539
  713   2HB   PRO  90          2HB       PRO  90  -7.525  -3.950  -8.438
  714   1HG   PRO  90          1HG       PRO  90 -10.291  -2.730  -8.479
  715   2HG   PRO  90          2HG       PRO  90  -9.268  -3.179  -9.876
  716   1HD   PRO  90          1HD       PRO  90 -11.212  -4.815  -8.888
  717   2HD   PRO  90          2HD       PRO  90  -9.686  -5.490  -9.543
  718    H    LYS  91           H        LYS  91  -7.918  -3.380  -4.639
  719    HA   LYS  91           HA       LYS  91 -10.565  -2.343  -3.688
  720   1HB   LYS  91          1HB       LYS  91  -8.450  -3.824  -2.075
  721   2HB   LYS  91          2HB       LYS  91  -9.929  -3.070  -1.447
  722   1HG   LYS  91          1HG       LYS  91 -11.287  -4.610  -2.866
  723   2HG   LYS  91          2HG       LYS  91  -9.792  -5.387  -3.428
  724   1HD   LYS  91          1HD       LYS  91  -9.210  -6.006  -1.114
  725   2HD   LYS  91          2HD       LYS  91 -10.708  -5.248  -0.528
  726   1HE   LYS  91          1HE       LYS  91 -12.049  -6.818  -1.902
  727   2HE   LYS  91          2HE       LYS  91 -10.561  -7.559  -2.523
  728   1HZ   LYS  91          1HZ       LYS  91 -11.413  -7.533   0.287
  729   2HZ   LYS  91          2HZ       LYS  91 -11.502  -8.817  -0.741
  730   3HZ   LYS  91          3HZ       LYS  91 -10.032  -8.222  -0.294
  731    H    ILE  92           H        ILE  92 -10.219  -0.196  -4.065
  732    HA   ILE  92           HA       ILE  92  -7.587   0.958  -3.667
  733    HB   ILE  92           HB       ILE  92 -10.112   2.461  -4.367
  734   1HG1  ILE  92          1HG1      ILE  92 -10.139   0.665  -5.958
  735   2HG1  ILE  92          2HG1      ILE  92  -9.558   2.126  -6.740
  736   1HG2  ILE  92          1HG2      ILE  92  -8.149   3.802  -3.824
  737   2HG2  ILE  92          2HG2      ILE  92  -7.130   2.852  -4.913
  738   3HG2  ILE  92          3HG2      ILE  92  -8.426   3.869  -5.575
  739   1HD1  ILE  92          1HD1      ILE  92  -7.225   1.304  -6.552
  740   2HD1  ILE  92          2HD1      ILE  92  -7.818  -0.209  -5.826
  741   3HD1  ILE  92          3HD1      ILE  92  -8.262   0.214  -7.484
  742    H    VAL  93           H        VAL  93  -7.580   0.264  -1.385
  743    HA   VAL  93           HA       VAL  93  -9.425   1.342   0.537
  744    HB   VAL  93           HB       VAL  93  -6.715  -0.024   0.794
  745   1HG1  VAL  93          1HG1      VAL  93  -7.035   1.309   2.829
  746   2HG1  VAL  93          2HG1      VAL  93  -8.712   0.742   2.973
  747   3HG1  VAL  93          3HG1      VAL  93  -7.358  -0.385   3.188
  748   1HG2  VAL  93          1HG2      VAL  93  -9.558  -1.013   1.307
  749   2HG2  VAL  93          2HG2      VAL  93  -8.584  -1.413  -0.122
  750   3HG2  VAL  93          3HG2      VAL  93  -8.064  -1.958   1.478
  751    H    LYS  94           H        LYS  94  -9.531   3.505   0.881
  752    HA   LYS  94           HA       LYS  94  -7.313   5.300   0.776
  753   1HB   LYS  94          1HB       LYS  94  -8.713   6.894   1.903
  754   2HB   LYS  94          2HB       LYS  94  -9.524   6.108   0.544
  755   1HG   LYS  94          1HG       LYS  94 -10.814   4.679   2.120
  756   2HG   LYS  94          2HG       LYS  94  -9.930   5.387   3.483
  757   1HD   LYS  94          1HD       LYS  94 -12.085   6.431   3.344
  758   2HD   LYS  94          2HD       LYS  94 -10.830   7.616   2.952
  759   1HE   LYS  94          1HE       LYS  94 -11.350   7.285   0.499
  760   2HE   LYS  94          2HE       LYS  94 -12.626   6.142   0.958
  761   1HZ   LYS  94          1HZ       LYS  94 -13.657   7.973   2.153
  762   2HZ   LYS  94          2HZ       LYS  94 -12.445   8.985   1.661
  763   3HZ   LYS  94          3HZ       LYS  94 -13.461   8.326   0.549
  764    H    TRP  95           H        TRP  95  -5.824   5.848   2.219
  765    HA   TRP  95           HA       TRP  95  -5.027   3.849   3.981
  766   1HB   TRP  95          1HB       TRP  95  -3.152   4.907   3.422
  767   2HB   TRP  95          2HB       TRP  95  -4.011   6.348   2.996
  768    HD1  TRP  95           HD1      TRP  95  -2.972   4.918   6.467
  769    HE1  TRP  95           HE1      TRP  95  -2.181   6.942   7.903
  770    HE3  TRP  95           HE3      TRP  95  -3.309   8.620   2.977
  771    HZ2  TRP  95           HZ2      TRP  95  -2.057   9.783   7.646
  772    HZ3  TRP  95           HZ3      TRP  95  -2.867  10.967   3.592
  773    HH2  TRP  95           HH2      TRP  95  -2.341  11.566   5.945
  774    H    ASP  96           H        ASP  96  -5.469   7.109   5.352
  775    HA   ASP  96           HA       ASP  96  -7.385   6.688   7.306
  776   1HB   ASP  96          1HB       ASP  96  -5.357   4.967   8.021
  777   2HB   ASP  96          2HB       ASP  96  -4.717   6.435   8.709
  778    H    ARG  97           H        ARG  97  -6.329   8.215   9.369
  779    HA   ARG  97           HA       ARG  97  -4.513  10.256   8.528
  780   1HB   ARG  97          1HB       ARG  97  -6.151  12.114   9.122
  781   2HB   ARG  97          2HB       ARG  97  -6.341  11.385   7.528
  782   1HG   ARG  97          1HG       ARG  97  -8.023  10.180   9.702
  783   2HG   ARG  97          2HG       ARG  97  -8.393  11.849   9.270
  784   1HD   ARG  97          1HD       ARG  97  -8.730  11.309   6.956
  785   2HD   ARG  97          2HD       ARG  97  -8.190   9.649   7.168
  786    HE   ARG  97           HE       ARG  97 -10.796  10.755   7.747
  787   1HH1  ARG  97          1HH2      ARG  97  -8.547   8.172   8.748
  788   2HH1  ARG  97          2HH2      ARG  97  -9.817   7.069   9.173
  789   1HH2  ARG  97          1HH1      ARG  97 -12.449   9.293   8.368
  790   2HH2  ARG  97          2HH1      ARG  97 -12.036   7.714   8.987
  791    H    ASP  98           H        ASP  98  -3.454   9.152  10.201
  792    HA   ASP  98           HA       ASP  98  -4.594   9.269  12.949
  793   1HB   ASP  98          1HB       ASP  98  -4.427   7.010  12.062
  794   2HB   ASP  98          2HB       ASP  98  -2.743   7.275  11.588
  795    H    MET  99           H        MET  99  -3.783  11.418  12.999
  796    HA   MET  99           HA       MET  99  -0.858  11.644  13.591
  797   1HB   MET  99          1HB       MET  99  -1.095  14.044  13.208
  798   2HB   MET  99          2HB       MET  99  -1.412  13.095  11.755
  799   1HG   MET  99          1HG       MET  99  -3.685  14.092  13.503
  800   2HG   MET  99          2HG       MET  99  -2.926  15.113  12.291
  801   1HE   MET  99          1HE       MET  99  -6.032  14.326  12.532
  802   2HE   MET  99          2HE       MET  99  -5.432  15.479  11.313
  803   3HE   MET  99          3HE       MET  99  -6.460  14.113  10.819
  Start of MODEL   16
    1   1H    MET   0          1H        MET   0   0.193 -20.519  -6.204
    2   2H    MET   0          2H        MET   0  -1.199 -19.660  -5.993
    3   3H    MET   0          3H        MET   0  -0.186 -19.894  -4.718
    4    HA   MET   0           HA       MET   0  -1.649 -21.966  -6.160
    5   1HB   MET   0          1HB       MET   0   0.068 -22.164  -3.647
    6   2HB   MET   0          2HB       MET   0  -0.985 -23.447  -4.274
    7   1HG   MET   0          1HG       MET   0   0.285 -23.386  -6.423
    8   2HG   MET   0          2HG       MET   0   1.404 -22.217  -5.698
    9   1HE   MET   0          1HE       MET   0   3.364 -23.747  -6.455
   10   2HE   MET   0          2HE       MET   0   3.546 -25.453  -5.985
   11   3HE   MET   0          3HE       MET   0   2.248 -24.973  -7.103
   12    H    ILE   1           H        ILE   1  -1.814 -22.026  -2.694
   13    HA   ILE   1           HA       ILE   1  -4.601 -21.670  -2.850
   14    HB   ILE   1           HB       ILE   1  -3.276 -23.070  -1.206
   15   1HG1  ILE   1          1HG1      ILE   1  -4.877 -22.807   0.653
   16   2HG1  ILE   1          2HG1      ILE   1  -5.534 -21.348  -0.091
   17   1HG2  ILE   1          1HG2      ILE   1  -1.786 -21.237  -0.480
   18   2HG2  ILE   1          2HG2      ILE   1  -3.156 -20.463   0.357
   19   3HG2  ILE   1          3HG2      ILE   1  -2.583 -22.066   0.870
   20   1HD1  ILE   1          1HD1      ILE   1  -6.334 -22.669  -2.013
   21   2HD1  ILE   1          2HD1      ILE   1  -5.470 -24.104  -1.418
   22   3HD1  ILE   1          3HD1      ILE   1  -6.856 -23.453  -0.521
   23    H    GLN   2           H        GLN   2  -5.953 -20.088  -1.846
   24    HA   GLN   2           HA       GLN   2  -5.107 -17.495  -2.812
   25   1HB   GLN   2          1HB       GLN   2  -7.794 -18.391  -1.698
   26   2HB   GLN   2          2HB       GLN   2  -7.447 -16.919  -2.590
   27   1HG   GLN   2          1HG       GLN   2  -8.424 -18.368  -4.175
   28   2HG   GLN   2          2HG       GLN   2  -6.695 -18.390  -4.551
   29   1HE2  GLN   2          2HE2      GLN   2  -8.936 -20.177  -2.317
   30   2HE2  GLN   2          1HE2      GLN   2  -8.366 -21.766  -2.782
   31    H    ARG   3           H        ARG   3  -3.483 -17.073  -1.030
   32    HA   ARG   3           HA       ARG   3  -4.560 -16.448   1.621
   33   1HB   ARG   3          1HB       ARG   3  -1.871 -15.922   0.356
   34   2HB   ARG   3          2HB       ARG   3  -2.334 -15.474   2.006
   35   1HG   ARG   3          1HG       ARG   3  -2.892 -17.945   2.401
   36   2HG   ARG   3          2HG       ARG   3  -2.071 -18.270   0.852
   37   1HD   ARG   3          1HD       ARG   3  -0.073 -17.076   1.704
   38   2HD   ARG   3          2HD       ARG   3  -0.873 -16.828   3.265
   39    HE   ARG   3           HE       ARG   3  -1.057 -19.498   3.080
   40   1HH1  ARG   3          1HH2      ARG   3   1.695 -17.314   2.602
   41   2HH1  ARG   3          2HH2      ARG   3   2.891 -18.532   2.953
   42   1HH2  ARG   3          1HH1      ARG   3   0.525 -21.040   3.750
   43   2HH2  ARG   3          2HH1      ARG   3   2.216 -20.612   3.749
   44    H    THR   4           H        THR   4  -5.928 -14.778   1.795
   45    HA   THR   4           HA       THR   4  -6.011 -12.465   0.199
   46    HB   THR   4           HB       THR   4  -6.942 -12.903   3.069
   47    HG1  THR   4           HG1      THR   4  -8.856 -13.547   2.050
   48   1HG2  THR   4          1HG2      THR   4  -8.668 -11.227   2.561
   49   2HG2  THR   4          2HG2      THR   4  -7.060 -10.504   2.402
   50   3HG2  THR   4          3HG2      THR   4  -7.979 -10.967   0.949
   51    HA   PRO   5           HA       PRO   5  -2.405 -10.435   2.004
   52   1HB   PRO   5          1HB       PRO   5  -2.712  -7.893   1.009
   53   2HB   PRO   5          2HB       PRO   5  -2.255  -9.275  -0.028
   54   1HG   PRO   5          1HG       PRO   5  -5.017  -8.124   0.419
   55   2HG   PRO   5          2HG       PRO   5  -4.215  -8.469  -1.140
   56   1HD   PRO   5          1HD       PRO   5  -5.939 -10.233  -0.018
   57   2HD   PRO   5          2HD       PRO   5  -4.453 -10.832  -0.820
   58    H    LYS   6           H        LYS   6  -1.912  -9.360   3.853
   59    HA   LYS   6           HA       LYS   6  -4.040  -8.090   5.472
   60   1HB   LYS   6          1HB       LYS   6  -2.506  -9.823   6.440
   61   2HB   LYS   6          2HB       LYS   6  -1.152  -8.712   6.172
   62   1HG   LYS   6          1HG       LYS   6  -2.518  -6.975   7.485
   63   2HG   LYS   6          2HG       LYS   6  -3.627  -8.295   7.889
   64   1HD   LYS   6          1HD       LYS   6  -1.709  -9.545   8.929
   65   2HD   LYS   6          2HD       LYS   6  -0.632  -8.207   8.500
   66   1HE   LYS   6          1HE       LYS   6  -1.220  -7.970  10.825
   67   2HE   LYS   6          2HE       LYS   6  -2.008  -6.666   9.922
   68   1HZ   LYS   6          1HZ       LYS   6  -4.033  -7.936   9.989
   69   2HZ   LYS   6          2HZ       LYS   6  -3.286  -9.168  10.791
   70   3HZ   LYS   6          3HZ       LYS   6  -3.462  -7.699  11.515
   71    H    ILE   7           H        ILE   7  -4.386  -6.096   4.604
   72    HA   ILE   7           HA       ILE   7  -2.161  -4.388   3.738
   73    HB   ILE   7           HB       ILE   7  -5.043  -3.516   3.818
   74   1HG1  ILE   7          1HG1      ILE   7  -4.896  -4.262   1.271
   75   2HG1  ILE   7          2HG1      ILE   7  -3.898  -5.562   1.924
   76   1HG2  ILE   7          1HG2      ILE   7  -3.123  -1.963   3.319
   77   2HG2  ILE   7          2HG2      ILE   7  -2.773  -2.937   1.884
   78   3HG2  ILE   7          3HG2      ILE   7  -4.320  -2.081   2.022
   79   1HD1  ILE   7          1HD1      ILE   7  -5.855  -6.165   3.433
   80   2HD1  ILE   7          2HD1      ILE   7  -6.753  -4.802   2.748
   81   3HD1  ILE   7          3HD1      ILE   7  -6.294  -6.171   1.721
   82    H    GLN   8           H        GLN   8  -1.131  -3.114   5.283
   83    HA   GLN   8           HA       GLN   8  -2.832  -1.731   7.317
   84   1HB   GLN   8          1HB       GLN   8  -0.340  -1.567   8.313
   85   2HB   GLN   8          2HB       GLN   8  -1.500  -2.817   8.782
   86   1HG   GLN   8          1HG       GLN   8  -0.524  -4.436   7.308
   87   2HG   GLN   8          2HG       GLN   8   0.507  -3.226   6.550
   88   1HE2  GLN   8          2HE2      GLN   8   0.756  -5.789   8.389
   89   2HE2  GLN   8          1HE2      GLN   8   2.091  -5.330   9.434
   90    H    VAL   9           H        VAL   9  -3.247   0.166   6.304
   91    HA   VAL   9           HA       VAL   9  -1.044   1.539   4.863
   92    HB   VAL   9           HB       VAL   9  -3.961   2.341   4.875
   93   1HG1  VAL   9          1HG1      VAL   9  -2.251   4.042   4.217
   94   2HG1  VAL   9          2HG1      VAL   9  -1.563   2.907   3.062
   95   3HG1  VAL   9          3HG1      VAL   9  -3.209   3.529   2.816
   96   1HG2  VAL   9          1HG2      VAL   9  -2.516   0.466   2.972
   97   2HG2  VAL   9          2HG2      VAL   9  -3.947   0.109   3.974
   98   3HG2  VAL   9          3HG2      VAL   9  -4.076   1.255   2.638
   99    H    TYR  10           H        TYR  10   0.149   2.451   6.454
  100    HA   TYR  10           HA       TYR  10  -1.220   4.266   8.430
  101   1HB   TYR  10          1HB       TYR  10   0.504   3.762   9.969
  102   2HB   TYR  10          2HB       TYR  10  -0.321   2.308   9.435
  103    HD1  TYR  10           HD1      TYR  10   2.874   4.149   9.456
  104    HD2  TYR  10           HD2      TYR  10   0.831   0.617   8.065
  105    HE1  TYR  10           HE1      TYR  10   5.054   3.066   8.977
  106    HE2  TYR  10           HE2      TYR  10   3.007  -0.499   7.702
  107    HH   TYR  10           HH       TYR  10   5.301  -0.284   7.789
  108    H    SER  11           H        SER  11   0.256   6.019   9.275
  109    HA   SER  11           HA       SER  11   2.177   7.060   7.248
  110   1HB   SER  11          1HB       SER  11   0.393   8.588   7.266
  111   2HB   SER  11          2HB       SER  11   0.261   8.569   9.044
  112    HG   SER  11           HG       SER  11   2.505   9.487   7.561
  113    H    ARG  12           H        ARG  12   4.190   7.571   7.998
  114    HA   ARG  12           HA       ARG  12   5.009   6.702  10.685
  115   1HB   ARG  12          1HB       ARG  12   6.465   7.944   8.320
  116   2HB   ARG  12          2HB       ARG  12   7.244   7.579   9.865
  117   1HG   ARG  12          1HG       ARG  12   6.803   5.216   9.616
  118   2HG   ARG  12          2HG       ARG  12   5.863   5.488   8.129
  119   1HD   ARG  12          1HD       ARG  12   7.792   6.328   6.955
  120   2HD   ARG  12          2HD       ARG  12   8.772   6.356   8.438
  121    HE   ARG  12           HE       ARG  12   8.004   3.730   8.219
  122   1HH1  ARG  12          1HH2      ARG  12   9.701   5.985   6.051
  123   2HH1  ARG  12          2HH2      ARG  12  10.690   4.743   5.332
  124   1HH2  ARG  12          1HH1      ARG  12   9.331   2.121   7.288
  125   2HH2  ARG  12          2HH1      ARG  12  10.471   2.531   6.033
  126    H    HIS  13           H        HIS  13   5.384   9.719   8.791
  127    HA   HIS  13           HA       HIS  13   6.161  11.245  11.096
  128   1HB   HIS  13          1HB       HIS  13   5.657  11.865   8.173
  129   2HB   HIS  13          2HB       HIS  13   6.168  13.099   9.324
  130    HD2  HIS  13           HD2      HIS  13   8.608  13.469   8.142
  131    HE1  HIS  13           HE1      HIS  13  10.035   9.524   8.704
  132    HE2  HIS  13           HE2      HIS  13  10.687  11.885   7.971
  133    HA   PRO  14           HA       PRO  14   2.240  12.801  12.331
  134   1HB   PRO  14          1HB       PRO  14   2.720  15.301  13.294
  135   2HB   PRO  14          2HB       PRO  14   3.378  13.822  14.049
  136   1HG   PRO  14          1HG       PRO  14   4.793  15.680  12.124
  137   2HG   PRO  14          2HG       PRO  14   5.396  15.047  13.684
  138   1HD   PRO  14          1HD       PRO  14   6.045  13.914  11.303
  139   2HD   PRO  14          2HD       PRO  14   5.806  12.906  12.749
  140    H    ALA  15           H        ALA  15   0.753  13.038  10.739
  141    HA   ALA  15           HA       ALA  15   1.178  14.237   8.283
  142   1HB   ALA  15          1HB       ALA  15  -1.478  13.664   9.649
  143   2HB   ALA  15          2HB       ALA  15  -1.220  13.905   7.906
  144   3HB   ALA  15          3HB       ALA  15  -0.494  12.507   8.727
  145    H    GLU  16           H        GLU  16   0.946  16.233   7.403
  146    HA   GLU  16           HA       GLU  16  -0.618  18.352   8.670
  147   1HB   GLU  16          1HB       GLU  16   1.430  18.484   9.974
  148   2HB   GLU  16          2HB       GLU  16   2.420  18.420   8.510
  149   1HG   GLU  16          1HG       GLU  16   1.529  20.628   7.799
  150   2HG   GLU  16          2HG       GLU  16   0.446  20.643   9.203
  151    H    ASN  17           H        ASN  17  -1.340  19.747   7.162
  152    HA   ASN  17           HA       ASN  17  -1.155  18.944   4.430
  153   1HB   ASN  17          1HB       ASN  17  -2.589  21.253   5.800
  154   2HB   ASN  17          2HB       ASN  17  -2.802  20.758   4.119
  155   1HD2  ASN  17          2HD2      ASN  17  -5.086  20.493   4.620
  156   2HD2  ASN  17          1HD2      ASN  17  -5.631  19.032   5.412
  157    H    GLY  18           H        GLY  18   1.020  19.273   3.854
  158   1HA   GLY  18          1HA       GLY  18   1.772  20.963   2.057
  159   2HA   GLY  18          2HA       GLY  18   1.894  22.100   3.410
  160    H    LYS  19           H        LYS  19   2.763  20.259   5.398
  161    HA   LYS  19           HA       LYS  19   5.613  20.154   4.797
  162   1HB   LYS  19          1HB       LYS  19   4.755  20.919   6.907
  163   2HB   LYS  19          2HB       LYS  19   3.996  19.328   7.136
  164   1HG   LYS  19          1HG       LYS  19   6.001  19.638   8.527
  165   2HG   LYS  19          2HG       LYS  19   6.175  18.265   7.442
  166   1HD   LYS  19          1HD       LYS  19   7.260  20.926   6.511
  167   2HD   LYS  19          2HD       LYS  19   8.091  20.121   7.845
  168   1HE   LYS  19          1HE       LYS  19   8.444  18.096   6.558
  169   2HE   LYS  19          2HE       LYS  19   7.509  18.732   5.201
  170   1HZ   LYS  19          1HZ       LYS  19  10.046  19.814   6.184
  171   2HZ   LYS  19          2HZ       LYS  19   9.791  18.970   4.786
  172   3HZ   LYS  19          3HZ       LYS  19   9.137  20.465   4.970
  173    H    SER  20           H        SER  20   5.505  18.799   3.246
  174    HA   SER  20           HA       SER  20   4.811  16.340   2.575
  175   1HB   SER  20          1HB       SER  20   7.089  15.815   1.691
  176   2HB   SER  20          2HB       SER  20   6.388  17.371   1.241
  177    HG   SER  20           HG       SER  20   8.235  16.939   3.364
  178    H    ASN  21           H        ASN  21   4.793  14.381   3.351
  179    HA   ASN  21           HA       ASN  21   5.894  13.932   6.088
  180   1HB   ASN  21          1HB       ASN  21   3.443  14.612   5.517
  181   2HB   ASN  21          2HB       ASN  21   3.258  12.957   4.981
  182   1HD2  ASN  21          2HD2      ASN  21   4.216  15.078   7.685
  183   2HD2  ASN  21          1HD2      ASN  21   3.754  13.998   8.977
  184    H    PHE  22           H        PHE  22   4.438  11.177   5.951
  185    HA   PHE  22           HA       PHE  22   5.847   9.764   3.858
  186   1HB   PHE  22          1HB       PHE  22   7.043   9.879   6.540
  187   2HB   PHE  22          2HB       PHE  22   6.682   8.231   6.040
  188    HD1  PHE  22           HD1      PHE  22   7.345   7.494   3.643
  189    HD2  PHE  22           HD2      PHE  22   9.121  10.805   5.759
  190    HE1  PHE  22           HE1      PHE  22   9.302   7.424   2.120
  191    HE2  PHE  22           HE2      PHE  22  11.106  10.682   4.283
  192    HZ   PHE  22           HZ       PHE  22  11.117   9.110   2.363
  193    H    LEU  23           H        LEU  23   4.370   8.516   3.127
  194    HA   LEU  23           HA       LEU  23   2.308   7.212   4.810
  195   1HB   LEU  23          1HB       LEU  23   1.508   8.622   3.001
  196   2HB   LEU  23          2HB       LEU  23   2.595   7.834   1.859
  197    HG   LEU  23           HG       LEU  23   1.186   5.745   2.177
  198   1HD1  LEU  23          1HD1      LEU  23   0.271   6.306   4.444
  199   2HD1  LEU  23          2HD1      LEU  23  -0.546   7.716   3.751
  200   3HD1  LEU  23          3HD1      LEU  23  -1.018   6.071   3.261
  201   1HD2  LEU  23          1HD2      LEU  23  -0.240   8.325   1.378
  202   2HD2  LEU  23          2HD2      LEU  23   0.828   7.383   0.324
  203   3HD2  LEU  23          3HD2      LEU  23  -0.710   6.681   0.873
  204    H    ASN  24           H        ASN  24   2.119   4.992   4.796
  205    HA   ASN  24           HA       ASN  24   4.085   3.331   3.268
  206   1HB   ASN  24          1HB       ASN  24   3.371   3.326   6.209
  207   2HB   ASN  24          2HB       ASN  24   4.040   1.915   5.379
  208   1HD2  ASN  24          2HD2      ASN  24   5.981   1.774   6.474
  209   2HD2  ASN  24          1HD2      ASN  24   7.243   2.970   6.292
  210    H    CYS  25           H        CYS  25   2.576   2.508   1.794
  211    HA   CYS  25           HA       CYS  25   0.175   1.108   2.816
  212   1HB   CYS  25          1HB       CYS  25   1.407   1.117   0.038
  213   2HB   CYS  25          2HB       CYS  25  -0.094   0.339   0.494
  214    H    TYR  26           H        TYR  26   1.310  -0.286   4.325
  215    HA   TYR  26           HA       TYR  26   3.363  -2.154   3.336
  216   1HB   TYR  26          1HB       TYR  26   3.483  -1.083   5.504
  217   2HB   TYR  26          2HB       TYR  26   1.985  -1.785   6.021
  218    HD1  TYR  26           HD1      TYR  26   2.126  -4.660   5.529
  219    HD2  TYR  26           HD2      TYR  26   5.215  -1.918   6.771
  220    HE1  TYR  26           HE1      TYR  26   3.238  -6.452   6.758
  221    HE2  TYR  26           HE2      TYR  26   6.338  -3.746   7.984
  222    HH   TYR  26           HH       TYR  26   5.043  -7.084   8.028
  223    H    VAL  27           H        VAL  27   2.878  -4.236   2.571
  224    HA   VAL  27           HA       VAL  27   0.209  -5.340   3.226
  225    HB   VAL  27           HB       VAL  27   1.347  -5.702   0.425
  226   1HG1  VAL  27          1HG1      VAL  27  -0.423  -7.237   1.351
  227   2HG1  VAL  27          2HG1      VAL  27  -1.474  -5.828   1.587
  228   3HG1  VAL  27          3HG1      VAL  27  -0.981  -6.304  -0.048
  229   1HG2  VAL  27          1HG2      VAL  27   1.087  -3.346   0.511
  230   2HG2  VAL  27          2HG2      VAL  27  -0.298  -4.047  -0.353
  231   3HG2  VAL  27          3HG2      VAL  27  -0.498  -3.498   1.332
  232    H    SER  28           H        SER  28   0.429  -7.456   3.963
  233    HA   SER  28           HA       SER  28   2.518  -9.060   2.767
  234   1HB   SER  28          1HB       SER  28   3.821  -9.477   4.701
  235   2HB   SER  28          2HB       SER  28   3.742  -7.777   4.703
  236    HG   SER  28           HG       SER  28   1.854  -8.031   6.139
  237    H    GLY  29           H        GLY  29   2.718 -11.257   4.096
  238   1HA   GLY  29          1HA       GLY  29   1.658 -13.076   5.046
  239   2HA   GLY  29          2HA       GLY  29   0.112 -12.226   5.046
  240    H    PHE  30           H        PHE  30   0.630 -11.541   2.060
  241    HA   PHE  30           HA       PHE  30  -1.022 -13.672   1.092
  242   1HB   PHE  30          1HB       PHE  30  -1.109 -12.369  -0.938
  243   2HB   PHE  30          2HB       PHE  30  -1.359 -11.384   0.459
  244    HD1  PHE  30           HD1      PHE  30   0.075  -9.423   0.931
  245    HD2  PHE  30           HD2      PHE  30   1.040 -12.226  -2.210
  246    HE1  PHE  30           HE1      PHE  30   1.783  -7.890   0.051
  247    HE2  PHE  30           HE2      PHE  30   2.727 -10.660  -3.092
  248    HZ   PHE  30           HZ       PHE  30   3.136  -8.538  -1.964
  249    H    HIS  31           H        HIS  31  -0.588 -14.705  -1.064
  250    HA   HIS  31           HA       HIS  31   1.967 -14.829  -2.275
  251   1HB   HIS  31          1HB       HIS  31   2.813 -16.880  -1.884
  252   2HB   HIS  31          2HB       HIS  31   2.298 -16.444  -0.270
  253    HD2  HIS  31           HD2      HIS  31   0.768 -18.529  -3.279
  254    HE1  HIS  31           HE1      HIS  31   0.371 -20.675   0.346
  255    HE2  HIS  31           HE2      HIS  31  -0.091 -20.754  -2.167
  256    HA   PRO  32           HA       PRO  32   2.585 -16.474  -4.145
  257   1HB   PRO  32          1HB       PRO  32   2.557 -16.551  -6.850
  258   2HB   PRO  32          2HB       PRO  32   1.774 -17.806  -5.867
  259   1HG   PRO  32          1HG       PRO  32   0.450 -15.347  -7.043
  260   2HG   PRO  32          2HG       PRO  32  -0.009 -17.054  -7.324
  261   1HD   PRO  32          1HD       PRO  32  -1.206 -15.571  -5.376
  262   2HD   PRO  32          2HD       PRO  32  -0.821 -17.287  -5.101
  263    H    SER  33           H        SER  33   3.749 -15.143  -6.404
  264    HA   SER  33           HA       SER  33   4.550 -12.831  -4.925
  265   1HB   SER  33          1HB       SER  33   6.362 -12.818  -6.619
  266   2HB   SER  33          2HB       SER  33   6.066 -14.472  -6.081
  267    HG   SER  33           HG       SER  33   5.093 -13.266  -8.436
  268    H    ASP  34           H        ASP  34   1.807 -12.655  -6.399
  269    HA   ASP  34           HA       ASP  34   2.448 -10.560  -8.441
  270   1HB   ASP  34          1HB       ASP  34   1.902 -12.737  -9.382
  271   2HB   ASP  34          2HB       ASP  34   0.390 -12.788  -8.469
  272    H    ILE  35           H        ILE  35   2.099  -8.934  -6.716
  273    HA   ILE  35           HA       ILE  35  -0.785  -8.188  -6.756
  274    HB   ILE  35           HB       ILE  35  -0.042  -8.816  -4.566
  275   1HG1  ILE  35          1HG1      ILE  35  -0.484  -5.812  -4.588
  276   2HG1  ILE  35          2HG1      ILE  35  -1.757  -6.982  -4.786
  277   1HG2  ILE  35          1HG2      ILE  35   1.841  -6.489  -4.697
  278   2HG2  ILE  35          2HG2      ILE  35   1.526  -7.536  -3.302
  279   3HG2  ILE  35          3HG2      ILE  35   2.309  -8.225  -4.729
  280   1HD1  ILE  35          1HD1      ILE  35  -0.885  -8.050  -2.563
  281   2HD1  ILE  35          2HD1      ILE  35  -0.068  -6.489  -2.331
  282   3HD1  ILE  35          3HD1      ILE  35  -1.826  -6.548  -2.491
  283    H    GLU  36           H        GLU  36  -1.288  -6.057  -7.090
  284    HA   GLU  36           HA       GLU  36   0.816  -4.222  -8.134
  285   1HB   GLU  36          1HB       GLU  36  -2.160  -4.024  -8.660
  286   2HB   GLU  36          2HB       GLU  36  -0.820  -3.154  -9.412
  287   1HG   GLU  36          1HG       GLU  36   0.001  -5.502 -10.153
  288   2HG   GLU  36          2HG       GLU  36  -1.607  -6.055  -9.722
  289    H    VAL  37           H        VAL  37   1.137  -2.439  -6.830
  290    HA   VAL  37           HA       VAL  37  -1.117  -1.340  -5.269
  291    HB   VAL  37           HB       VAL  37   1.577  -1.812  -3.980
  292   1HG1  VAL  37          1HG1      VAL  37   0.255   0.098  -3.063
  293   2HG1  VAL  37          2HG1      VAL  37  -1.117  -1.003  -2.799
  294   3HG1  VAL  37          3HG1      VAL  37   0.398  -1.228  -1.903
  295   1HG2  VAL  37          1HG2      VAL  37   0.642  -3.990  -4.205
  296   2HG2  VAL  37          2HG2      VAL  37   0.239  -3.491  -2.559
  297   3HG2  VAL  37          3HG2      VAL  37  -1.003  -3.422  -3.796
  298    H    ASP  38           H        ASP  38  -1.054   0.067  -7.154
  299    HA   ASP  38           HA       ASP  38   1.088   2.100  -7.154
  300   1HB   ASP  38          1HB       ASP  38  -0.378   3.285  -8.773
  301   2HB   ASP  38          2HB       ASP  38   0.186   1.710  -9.330
  302    H    LEU  39           H        LEU  39   1.049   3.770  -5.782
  303    HA   LEU  39           HA       LEU  39  -1.177   4.121  -3.947
  304   1HB   LEU  39          1HB       LEU  39   1.540   5.471  -4.233
  305   2HB   LEU  39          2HB       LEU  39   0.305   5.882  -3.022
  306    HG   LEU  39           HG       LEU  39   0.274   3.582  -2.230
  307   1HD1  LEU  39          1HD1      LEU  39   2.534   3.133  -4.172
  308   2HD1  LEU  39          2HD1      LEU  39   2.387   2.182  -2.677
  309   3HD1  LEU  39          3HD1      LEU  39   1.081   2.153  -3.847
  310   1HD2  LEU  39          1HD2      LEU  39   3.007   4.927  -2.112
  311   2HD2  LEU  39          2HD2      LEU  39   1.601   5.328  -1.091
  312   3HD2  LEU  39          3HD2      LEU  39   2.379   3.746  -0.941
  313    H    LEU  40           H        LEU  40  -2.633   5.709  -3.997
  314    HA   LEU  40           HA       LEU  40  -2.861   7.252  -6.528
  315   1HB   LEU  40          1HB       LEU  40  -3.603   4.722  -6.431
  316   2HB   LEU  40          2HB       LEU  40  -4.938   5.328  -5.472
  317    HG   LEU  40           HG       LEU  40  -5.599   5.013  -7.748
  318   1HD1  LEU  40          1HD1      LEU  40  -5.323   8.013  -7.299
  319   2HD1  LEU  40          2HD1      LEU  40  -6.473   7.196  -8.367
  320   3HD1  LEU  40          3HD1      LEU  40  -6.591   6.967  -6.610
  321   1HD2  LEU  40          1HD2      LEU  40  -3.291   5.234  -8.719
  322   2HD2  LEU  40          2HD2      LEU  40  -4.572   6.023  -9.660
  323   3HD2  LEU  40          3HD2      LEU  40  -3.492   6.996  -8.657
  324    H    LYS  41           H        LYS  41  -3.482   9.324  -5.904
  325    HA   LYS  41           HA       LYS  41  -4.677   9.722  -3.283
  326   1HB   LYS  41          1HB       LYS  41  -4.057  11.692  -5.474
  327   2HB   LYS  41          2HB       LYS  41  -4.452  12.071  -3.778
  328   1HG   LYS  41          1HG       LYS  41  -2.394  11.827  -3.120
  329   2HG   LYS  41          2HG       LYS  41  -2.319  10.189  -3.731
  330   1HD   LYS  41          1HD       LYS  41  -0.564  11.477  -4.737
  331   2HD   LYS  41          2HD       LYS  41  -1.716  11.020  -5.976
  332   1HE   LYS  41          1HE       LYS  41  -0.925  13.302  -6.289
  333   2HE   LYS  41          2HE       LYS  41  -2.665  13.314  -5.970
  334   1HZ   LYS  41          1HZ       LYS  41  -0.579  13.904  -3.985
  335   2HZ   LYS  41          2HZ       LYS  41  -1.523  15.009  -4.773
  336   3HZ   LYS  41          3HZ       LYS  41  -2.205  13.934  -3.735
  337    H    ASN  42           H        ASN  42  -6.105  12.112  -4.739
  338    HA   ASN  42           HA       ASN  42  -8.789  11.110  -4.652
  339   1HB   ASN  42          1HB       ASN  42  -9.400  13.312  -5.366
  340   2HB   ASN  42          2HB       ASN  42  -7.994  13.554  -4.325
  341   1HD2  ASN  42          2HD2      ASN  42  -5.797  13.786  -5.515
  342   2HD2  ASN  42          1HD2      ASN  42  -5.816  14.454  -7.130
  343    H    GLY  43           H        GLY  43  -6.424  11.585  -7.267
  344   1HA   GLY  43          1HA       GLY  43  -7.482   9.519  -8.885
  345   2HA   GLY  43          2HA       GLY  43  -8.127  11.068  -9.464
  346    H    GLU  44           H        GLU  44  -4.926  10.498  -7.965
  347    HA   GLU  44           HA       GLU  44  -3.580  10.738 -10.600
  348   1HB   GLU  44          1HB       GLU  44  -3.691  12.989  -9.635
  349   2HB   GLU  44          2HB       GLU  44  -2.956  12.406  -8.131
  350   1HG   GLU  44          1HG       GLU  44  -0.879  11.865  -9.300
  351   2HG   GLU  44          2HG       GLU  44  -1.631  12.203 -10.870
  352    H    ARG  45           H        ARG  45  -1.890   9.413 -10.810
  353    HA   ARG  45           HA       ARG  45  -1.279   7.430  -8.738
  354   1HB   ARG  45          1HB       ARG  45  -0.091   7.916 -11.498
  355   2HB   ARG  45          2HB       ARG  45   0.184   6.487 -10.489
  356   1HG   ARG  45          1HG       ARG  45  -2.150   5.809 -10.712
  357   2HG   ARG  45          2HG       ARG  45  -2.544   7.307 -11.578
  358   1HD   ARG  45          1HD       ARG  45  -0.754   6.593 -13.303
  359   2HD   ARG  45          2HD       ARG  45  -0.734   5.034 -12.475
  360    HE   ARG  45           HE       ARG  45  -2.717   4.474 -13.469
  361   1HH1  ARG  45          1HH2      ARG  45  -2.385   8.007 -13.691
  362   2HH1  ARG  45          2HH2      ARG  45  -3.655   8.177 -14.875
  363   1HH2  ARG  45          1HH1      ARG  45  -4.352   4.714 -15.050
  364   2HH2  ARG  45          2HH1      ARG  45  -4.782   6.297 -15.645
  365    H    ILE  46           H        ILE  46   0.674   7.319  -7.541
  366    HA   ILE  46           HA       ILE  46   2.353   9.708  -7.525
  367    HB   ILE  46           HB       ILE  46   1.890   7.290  -5.750
  368   1HG1  ILE  46          1HG1      ILE  46   1.271  10.275  -5.484
  369   2HG1  ILE  46          2HG1      ILE  46   0.075   9.033  -5.870
  370   1HG2  ILE  46          1HG2      ILE  46   4.240   8.042  -5.646
  371   2HG2  ILE  46          2HG2      ILE  46   3.673   9.699  -5.315
  372   3HG2  ILE  46          3HG2      ILE  46   3.332   8.364  -4.165
  373   1HD1  ILE  46          1HD1      ILE  46   1.514   9.391  -3.228
  374   2HD1  ILE  46          2HD1      ILE  46  -0.212   9.525  -3.622
  375   3HD1  ILE  46          3HD1      ILE  46   0.553   7.955  -3.635
  376    H    GLU  47           H        GLU  47   4.174   9.699  -8.679
  377    HA   GLU  47           HA       GLU  47   5.228   7.332  -9.996
  378   1HB   GLU  47          1HB       GLU  47   6.360  10.152  -9.687
  379   2HB   GLU  47          2HB       GLU  47   7.039   8.871 -10.703
  380   1HG   GLU  47          1HG       GLU  47   4.866   8.783 -11.962
  381   2HG   GLU  47          2HG       GLU  47   4.323  10.208 -11.060
  382    H    LYS  48           H        LYS  48   6.276   9.463  -7.318
  383    HA   LYS  48           HA       LYS  48   8.725   7.965  -6.889
  384   1HB   LYS  48          1HB       LYS  48   7.522  10.330  -5.405
  385   2HB   LYS  48          2HB       LYS  48   9.166   9.684  -5.209
  386   1HG   LYS  48          1HG       LYS  48   9.595  10.114  -7.640
  387   2HG   LYS  48          2HG       LYS  48   7.990  10.857  -7.776
  388   1HD   LYS  48          1HD       LYS  48   8.618  12.547  -6.083
  389   2HD   LYS  48          2HD       LYS  48  10.240  11.825  -5.973
  390   1HE   LYS  48          1HE       LYS  48  10.613  12.290  -8.386
  391   2HE   LYS  48          2HE       LYS  48   8.991  12.998  -8.508
  392   1HZ   LYS  48          1HZ       LYS  48  11.166  14.006  -6.815
  393   2HZ   LYS  48          2HZ       LYS  48  10.667  14.660  -8.244
  394   3HZ   LYS  48          3HZ       LYS  48   9.658  14.661  -6.941
  395    H    VAL  49           H        VAL  49   7.371   5.988  -6.576
  396    HA   VAL  49           HA       VAL  49   6.681   5.492  -3.714
  397    HB   VAL  49           HB       VAL  49   6.206   3.883  -6.256
  398   1HG1  VAL  49          1HG1      VAL  49   6.580   2.364  -4.333
  399   2HG1  VAL  49          2HG1      VAL  49   5.390   3.273  -3.378
  400   3HG1  VAL  49          3HG1      VAL  49   4.885   2.368  -4.820
  401   1HG2  VAL  49          1HG2      VAL  49   4.735   5.858  -6.011
  402   2HG2  VAL  49          2HG2      VAL  49   3.839   4.349  -5.856
  403   3HG2  VAL  49          3HG2      VAL  49   4.238   5.295  -4.405
  404    H    GLU  50           H        GLU  50   8.507   4.862  -2.577
  405    HA   GLU  50           HA       GLU  50  10.626   3.292  -3.969
  406   1HB   GLU  50          1HB       GLU  50  11.204   5.270  -2.454
  407   2HB   GLU  50          2HB       GLU  50  10.681   4.249  -1.107
  408   1HG   GLU  50          1HG       GLU  50  12.331   2.522  -1.795
  409   2HG   GLU  50          2HG       GLU  50  12.862   3.598  -3.101
  410    H    HIS  51           H        HIS  51  11.141   1.150  -3.029
  411    HA   HIS  51           HA       HIS  51   8.857  -0.057  -1.552
  412   1HB   HIS  51          1HB       HIS  51   9.037  -2.004  -3.060
  413   2HB   HIS  51          2HB       HIS  51   8.507  -0.526  -3.855
  414    HD2  HIS  51           HD2      HIS  51  12.126  -2.166  -3.446
  415    HE1  HIS  51           HE1      HIS  51  11.581  -0.806  -7.409
  416    HE2  HIS  51           HE2      HIS  51  13.212  -1.952  -5.809
  417    H    SER  52           H        SER  52   9.310  -1.830  -0.290
  418    HA   SER  52           HA       SER  52  12.094  -2.186   0.607
  419   1HB   SER  52          1HB       SER  52  10.220  -2.114   2.222
  420   2HB   SER  52          2HB       SER  52   9.561  -3.604   1.503
  421    HG   SER  52           HG       SER  52  11.673  -4.528   2.002
  422    H    ASP  53           H        ASP  53  10.351  -3.304  -2.009
  423    HA   ASP  53           HA       ASP  53  10.602  -4.879  -3.511
  424   1HB   ASP  53          1HB       ASP  53  13.094  -4.505  -2.976
  425   2HB   ASP  53          2HB       ASP  53  13.019  -6.036  -2.092
  426    H    LEU  54           H        LEU  54  10.549  -7.332  -3.873
  427    HA   LEU  54           HA       LEU  54   8.492  -8.287  -2.055
  428   1HB   LEU  54          1HB       LEU  54   8.066  -8.277  -4.367
  429   2HB   LEU  54          2HB       LEU  54   9.442  -9.345  -4.690
  430    HG   LEU  54           HG       LEU  54   8.406 -11.183  -3.572
  431   1HD1  LEU  54          1HD1      LEU  54   6.406  -9.174  -2.456
  432   2HD1  LEU  54          2HD1      LEU  54   5.997 -10.874  -2.593
  433   3HD1  LEU  54          3HD1      LEU  54   7.378 -10.389  -1.604
  434   1HD2  LEU  54          1HD2      LEU  54   6.191  -9.716  -5.026
  435   2HD2  LEU  54          2HD2      LEU  54   7.533 -10.597  -5.819
  436   3HD2  LEU  54          3HD2      LEU  54   6.372 -11.471  -4.787
  437    H    SER  55           H        SER  55   9.034  -9.353  -0.299
  438    HA   SER  55           HA       SER  55  11.101 -11.497  -0.345
  439   1HB   SER  55          1HB       SER  55  11.996  -9.497   0.857
  440   2HB   SER  55          2HB       SER  55  10.557  -9.490   1.894
  441    HG   SER  55           HG       SER  55  12.454 -11.590   1.670
  442    H    PHE  56           H        PHE  56  10.235 -13.399   0.316
  443    HA   PHE  56           HA       PHE  56   7.689 -13.475   1.818
  444   1HB   PHE  56          1HB       PHE  56   7.738 -15.822   1.414
  445   2HB   PHE  56          2HB       PHE  56   7.914 -14.944  -0.095
  446    HD1  PHE  56           HD1      PHE  56   9.260 -17.440   2.082
  447    HD2  PHE  56           HD2      PHE  56  10.204 -14.839  -1.203
  448    HE1  PHE  56           HE1      PHE  56  11.389 -18.694   1.714
  449    HE2  PHE  56           HE2      PHE  56  12.367 -16.047  -1.537
  450    HZ   PHE  56           HZ       PHE  56  12.931 -17.992  -0.102
  451    H    SER  57           H        SER  57  10.406 -12.519   2.947
  452    HA   SER  57           HA       SER  57  12.025 -12.961   4.420
  453   1HB   SER  57          1HB       SER  57  10.212 -13.264   6.118
  454   2HB   SER  57          2HB       SER  57  10.141 -14.979   5.727
  455    HG   SER  57           HG       SER  57  11.546 -15.040   7.269
  456    H    LYS  58           H        LYS  58  12.841 -15.594   5.406
  457    HA   LYS  58           HA       LYS  58  13.191 -17.205   2.912
  458   1HB   LYS  58          1HB       LYS  58  14.588 -17.219   5.576
  459   2HB   LYS  58          2HB       LYS  58  14.885 -18.380   4.264
  460   1HG   LYS  58          1HG       LYS  58  15.409 -16.562   2.701
  461   2HG   LYS  58          2HG       LYS  58  15.120 -15.364   3.972
  462   1HD   LYS  58          1HD       LYS  58  16.977 -16.334   5.320
  463   2HD   LYS  58          2HD       LYS  58  17.232 -17.561   4.070
  464   1HE   LYS  58          1HE       LYS  58  18.887 -15.816   3.777
  465   2HE   LYS  58          2HE       LYS  58  17.752 -15.771   2.418
  466   1HZ   LYS  58          1HZ       LYS  58  16.637 -13.943   3.521
  467   2HZ   LYS  58          2HZ       LYS  58  17.724 -13.987   4.757
  468   3HZ   LYS  58          3HZ       LYS  58  18.219 -13.597   3.234
  469    H    ASP  59           H        ASP  59  10.669 -16.937   4.721
  470    HA   ASP  59           HA       ASP  59  10.466 -19.643   5.782
  471   1HB   ASP  59          1HB       ASP  59   8.731 -17.155   6.018
  472   2HB   ASP  59          2HB       ASP  59   8.314 -18.718   6.734
  473    H    TRP  60           H        TRP  60   7.574 -18.096   4.660
  474    HA   TRP  60           HA       TRP  60   7.232 -19.683   2.232
  475   1HB   TRP  60          1HB       TRP  60   5.333 -20.985   3.363
  476   2HB   TRP  60          2HB       TRP  60   6.997 -21.488   3.598
  477    HD1  TRP  60           HD1      TRP  60   7.828 -21.763   5.932
  478    HE1  TRP  60           HE1      TRP  60   6.970 -21.217   8.336
  479    HE3  TRP  60           HE3      TRP  60   3.818 -18.933   4.706
  480    HZ2  TRP  60           HZ2      TRP  60   4.818 -19.723   9.510
  481    HZ3  TRP  60           HZ3      TRP  60   2.376 -17.904   6.462
  482    HH2  TRP  60           HH2      TRP  60   2.868 -18.309   8.865
  483    H    SER  61           H        SER  61   6.676 -16.871   3.778
  484    HA   SER  61           HA       SER  61   3.839 -16.473   3.181
  485   1HB   SER  61          1HB       SER  61   4.227 -14.303   4.208
  486   2HB   SER  61          2HB       SER  61   4.935 -15.577   5.202
  487    HG   SER  61           HG       SER  61   6.973 -15.080   4.264
  488    H    PHE  62           H        PHE  62   4.311 -13.646   2.337
  489    HA   PHE  62           HA       PHE  62   6.226 -13.398   0.401
  490   1HB   PHE  62          1HB       PHE  62   3.986 -14.699  -0.739
  491   2HB   PHE  62          2HB       PHE  62   3.828 -13.036  -1.274
  492    HD1  PHE  62           HD1      PHE  62   4.284 -15.549  -2.910
  493    HD2  PHE  62           HD2      PHE  62   7.016 -12.578  -1.405
  494    HE1  PHE  62           HE1      PHE  62   6.012 -16.407  -4.380
  495    HE2  PHE  62           HE2      PHE  62   8.738 -13.387  -2.874
  496    HZ   PHE  62           HZ       PHE  62   8.247 -15.258  -4.492
  497    H    TYR  63           H        TYR  63   6.572 -11.076   0.336
  498    HA   TYR  63           HA       TYR  63   4.258  -9.287   0.581
  499   1HB   TYR  63          1HB       TYR  63   4.743  -8.491   2.850
  500   2HB   TYR  63          2HB       TYR  63   4.315 -10.208   2.816
  501    HD1  TYR  63           HD1      TYR  63   6.979  -7.802   3.421
  502    HD2  TYR  63           HD2      TYR  63   5.798 -11.939   3.555
  503    HE1  TYR  63           HE1      TYR  63   8.938  -8.278   4.772
  504    HE2  TYR  63           HE2      TYR  63   7.732 -12.432   4.998
  505    HH   TYR  63           HH       TYR  63  10.204  -9.955   5.837
  506    H    LEU  64           H        LEU  64   4.988  -7.036   1.480
  507    HA   LEU  64           HA       LEU  64   7.649  -6.147   1.054
  508   1HB   LEU  64          1HB       LEU  64   7.390  -5.030  -1.085
  509   2HB   LEU  64          2HB       LEU  64   7.164  -6.744  -1.262
  510    HG   LEU  64           HG       LEU  64   5.294  -4.509  -1.631
  511   1HD1  LEU  64          1HD1      LEU  64   6.265  -5.547  -3.589
  512   2HD1  LEU  64          2HD1      LEU  64   5.873  -7.171  -3.008
  513   3HD1  LEU  64          3HD1      LEU  64   4.589  -6.137  -3.559
  514   1HD2  LEU  64          1HD2      LEU  64   4.187  -7.177  -0.770
  515   2HD2  LEU  64          2HD2      LEU  64   3.802  -5.566  -0.127
  516   3HD2  LEU  64          3HD2      LEU  64   3.274  -6.033  -1.733
  517    H    LEU  65           H        LEU  65   7.581  -3.614   0.765
  518    HA   LEU  65           HA       LEU  65   5.210  -2.438   2.084
  519   1HB   LEU  65          1HB       LEU  65   7.416  -3.092   3.454
  520   2HB   LEU  65          2HB       LEU  65   8.064  -1.640   2.682
  521    HG   LEU  65           HG       LEU  65   5.609  -1.854   4.452
  522   1HD1  LEU  65          1HD1      LEU  65   7.730  -2.164   5.601
  523   2HD1  LEU  65          2HD1      LEU  65   8.410  -0.724   4.824
  524   3HD1  LEU  65          3HD1      LEU  65   7.096  -0.553   6.012
  525   1HD2  LEU  65          1HD2      LEU  65   6.731   0.485   2.907
  526   2HD2  LEU  65          2HD2      LEU  65   5.044  -0.061   3.066
  527   3HD2  LEU  65          3HD2      LEU  65   5.841   0.722   4.426
  528    H    TYR  66           H        TYR  66   4.620  -0.521   1.091
  529    HA   TYR  66           HA       TYR  66   6.434   0.555  -1.028
  530   1HB   TYR  66          1HB       TYR  66   3.398   0.374  -1.095
  531   2HB   TYR  66          2HB       TYR  66   4.472   0.824  -2.412
  532    HD1  TYR  66           HD1      TYR  66   6.188  -1.165  -3.169
  533    HD2  TYR  66           HD2      TYR  66   2.704  -1.921  -0.750
  534    HE1  TYR  66           HE1      TYR  66   5.728  -3.297  -4.377
  535    HE2  TYR  66           HE2      TYR  66   2.315  -4.007  -1.975
  536    HH   TYR  66           HH       TYR  66   3.824  -4.382  -5.288
  537    H    TYR  67           H        TYR  67   7.184   2.319   0.039
  538    HA   TYR  67           HA       TYR  67   5.224   4.144   1.276
  539   1HB   TYR  67          1HB       TYR  67   7.422   5.109   2.292
  540   2HB   TYR  67          2HB       TYR  67   6.491   3.779   2.934
  541    HD1  TYR  67           HD1      TYR  67   7.956   2.358   4.025
  542    HD2  TYR  67           HD2      TYR  67   8.980   3.828   0.136
  543    HE1  TYR  67           HE1      TYR  67   9.895   0.798   3.948
  544    HE2  TYR  67           HE2      TYR  67  10.861   2.200   0.005
  545    HH   TYR  67           HH       TYR  67  11.561  -0.113   2.644
  546    H    THR  68           H        THR  68   5.141   6.188   0.902
  547    HA   THR  68           HA       THR  68   6.876   7.531  -1.150
  548    HB   THR  68           HB       THR  68   4.875   6.747  -2.145
  549    HG1  THR  68           HG1      THR  68   5.858   8.607  -2.882
  550   1HG2  THR  68          1HG2      THR  68   2.700   7.689  -1.671
  551   2HG2  THR  68          2HG2      THR  68   3.304   6.923  -0.192
  552   3HG2  THR  68          3HG2      THR  68   3.347   8.696  -0.366
  553    H    GLU  69           H        GLU  69   7.020   9.917  -0.872
  554    HA   GLU  69           HA       GLU  69   6.552  10.921   1.857
  555   1HB   GLU  69          1HB       GLU  69   7.945  12.057  -0.555
  556   2HB   GLU  69          2HB       GLU  69   7.771  12.917   0.995
  557   1HG   GLU  69          1HG       GLU  69   8.896  11.112   2.151
  558   2HG   GLU  69          2HG       GLU  69   9.158  10.234   0.629
  559    H    PHE  70           H        PHE  70   4.153  10.666   1.558
  560    HA   PHE  70           HA       PHE  70   2.765  12.254  -0.368
  561   1HB   PHE  70          1HB       PHE  70   0.796  11.587   0.651
  562   2HB   PHE  70          2HB       PHE  70   1.845  10.210   0.936
  563    HD1  PHE  70           HD1      PHE  70  -0.486  12.599   2.363
  564    HD2  PHE  70           HD2      PHE  70   3.087  10.396   3.296
  565    HE1  PHE  70           HE1      PHE  70  -0.767  13.039   4.772
  566    HE2  PHE  70           HE2      PHE  70   2.360  10.272   5.686
  567    HZ   PHE  70           HZ       PHE  70   0.488  11.668   6.434
  568    H    THR  71           H        THR  71   1.960  14.234  -0.276
  569    HA   THR  71           HA       THR  71   2.188  15.890   2.195
  570    HB   THR  71           HB       THR  71   2.031  16.824  -0.642
  571    HG1  THR  71           HG1      THR  71   3.931  15.659  -0.202
  572   1HG2  THR  71          1HG2      THR  71   2.808  18.930   0.408
  573   2HG2  THR  71          2HG2      THR  71   1.261  18.449   1.130
  574   3HG2  THR  71          3HG2      THR  71   2.772  18.160   2.005
  575    HA   PRO  72           HA       PRO  72  -2.369  15.212   1.573
  576   1HB   PRO  72          1HB       PRO  72  -3.295  15.661   4.065
  577   2HB   PRO  72          2HB       PRO  72  -2.297  14.249   3.655
  578   1HG   PRO  72          1HG       PRO  72  -1.396  16.834   4.926
  579   2HG   PRO  72          2HG       PRO  72  -0.998  15.192   5.457
  580   1HD   PRO  72          1HD       PRO  72   0.644  16.744   3.823
  581   2HD   PRO  72          2HD       PRO  72   0.648  14.963   3.778
  582    H    THR  73           H        THR  73  -1.948  17.147   0.158
  583    HA   THR  73           HA       THR  73  -2.261  19.816   1.086
  584    HB   THR  73           HB       THR  73  -2.623  20.304  -1.376
  585    HG1  THR  73           HG1      THR  73  -2.064  17.528  -1.620
  586   1HG2  THR  73          1HG2      THR  73  -0.312  19.792  -1.978
  587   2HG2  THR  73          2HG2      THR  73  -0.386  20.339  -0.292
  588   3HG2  THR  73          3HG2      THR  73  -0.196  18.609  -0.663
  589    H    GLU  74           H        GLU  74  -4.013  20.338   2.204
  590    HA   GLU  74           HA       GLU  74  -6.066  20.976   2.730
  591   1HB   GLU  74          1HB       GLU  74  -6.494  21.034  -0.285
  592   2HB   GLU  74          2HB       GLU  74  -7.608  21.685   0.925
  593   1HG   GLU  74          1HG       GLU  74  -5.768  23.144   1.797
  594   2HG   GLU  74          2HG       GLU  74  -4.727  22.564   0.484
  595    H    LYS  75           H        LYS  75  -7.106  18.999  -0.033
  596    HA   LYS  75           HA       LYS  75  -8.643  17.227   1.821
  597   1HB   LYS  75          1HB       LYS  75  -9.638  18.434  -0.793
  598   2HB   LYS  75          2HB       LYS  75 -10.529  17.346   0.290
  599   1HG   LYS  75          1HG       LYS  75 -10.276  19.092   2.108
  600   2HG   LYS  75          2HG       LYS  75  -9.632  20.200   0.874
  601   1HD   LYS  75          1HD       LYS  75 -11.720  19.876  -0.465
  602   2HD   LYS  75          2HD       LYS  75 -12.393  18.905   0.856
  603   1HE   LYS  75          1HE       LYS  75 -11.549  21.842   0.975
  604   2HE   LYS  75          2HE       LYS  75 -13.209  21.224   0.958
  605   1HZ   LYS  75          1HZ       LYS  75 -12.791  20.191   3.067
  606   2HZ   LYS  75          2HZ       LYS  75 -11.238  20.746   3.082
  607   3HZ   LYS  75          3HZ       LYS  75 -12.491  21.809   3.148
  608    H    ASP  76           H        ASP  76  -6.044  17.212  -0.090
  609    HA   ASP  76           HA       ASP  76  -6.721  15.149  -2.003
  610   1HB   ASP  76          1HB       ASP  76  -4.868  16.823  -2.335
  611   2HB   ASP  76          2HB       ASP  76  -3.977  15.961  -1.070
  612    H    GLU  77           H        GLU  77  -7.436  13.273  -1.097
  613    HA   GLU  77           HA       GLU  77  -6.143  12.173   1.320
  614   1HB   GLU  77          1HB       GLU  77  -8.609  12.492   1.175
  615   2HB   GLU  77          2HB       GLU  77  -8.665  11.304  -0.141
  616   1HG   GLU  77          1HG       GLU  77  -7.754   9.558   1.392
  617   2HG   GLU  77          2HG       GLU  77  -7.538  10.779   2.664
  618    H    TYR  78           H        TYR  78  -4.823  10.508   1.243
  619    HA   TYR  78           HA       TYR  78  -4.072   9.331  -1.336
  620   1HB   TYR  78          1HB       TYR  78  -2.814   9.472   1.402
  621   2HB   TYR  78          2HB       TYR  78  -2.221   8.403   0.162
  622    HD1  TYR  78           HD1      TYR  78  -3.121  12.031   0.702
  623    HD2  TYR  78           HD2      TYR  78  -0.584   9.229  -1.367
  624    HE1  TYR  78           HE1      TYR  78  -1.947  13.898  -0.394
  625    HE2  TYR  78           HE2      TYR  78   0.654  11.153  -2.379
  626    HH   TYR  78           HH       TYR  78   1.002  13.378  -2.384
  627    H    ALA  79           H        ALA  79  -3.994   7.133  -1.729
  628    HA   ALA  79           HA       ALA  79  -5.028   5.190   0.193
  629   1HB   ALA  79          1HB       ALA  79  -6.432   5.703  -2.476
  630   2HB   ALA  79          2HB       ALA  79  -6.865   4.469  -1.276
  631   3HB   ALA  79          3HB       ALA  79  -7.079   6.189  -0.900
  632    H    CYS  80           H        CYS  80  -5.140   2.984  -1.059
  633    HA   CYS  80           HA       CYS  80  -2.755   2.717  -2.847
  634   1HB   CYS  80          1HB       CYS  80  -3.536   0.615  -0.853
  635   2HB   CYS  80          2HB       CYS  80  -1.968   0.913  -1.591
  636    H    ARG  81           H        ARG  81  -3.380   1.773  -4.786
  637    HA   ARG  81           HA       ARG  81  -6.008   0.466  -5.060
  638   1HB   ARG  81          1HB       ARG  81  -5.259   1.846  -6.851
  639   2HB   ARG  81          2HB       ARG  81  -3.739   0.949  -6.976
  640   1HG   ARG  81          1HG       ARG  81  -4.884  -1.047  -7.688
  641   2HG   ARG  81          2HG       ARG  81  -6.469  -0.352  -7.391
  642   1HD   ARG  81          1HD       ARG  81  -6.297   1.139  -9.230
  643   2HD   ARG  81          2HD       ARG  81  -4.564   0.907  -9.398
  644    HE   ARG  81           HE       ARG  81  -6.663  -0.746 -10.494
  645   1HH1  ARG  81          1HH2      ARG  81  -3.216  -0.835  -9.441
  646   2HH1  ARG  81          2HH2      ARG  81  -2.927  -2.320 -10.332
  647   1HH2  ARG  81          1HH1      ARG  81  -6.084  -2.631 -11.738
  648   2HH2  ARG  81          2HH1      ARG  81  -4.446  -3.248 -11.616
  649    H    VAL  82           H        VAL  82  -5.913  -1.414  -3.658
  650    HA   VAL  82           HA       VAL  82  -3.614  -3.231  -3.990
  651    HB   VAL  82           HB       VAL  82  -5.977  -3.516  -2.102
  652   1HG1  VAL  82          1HG1      VAL  82  -3.139  -4.616  -2.070
  653   2HG1  VAL  82          2HG1      VAL  82  -4.431  -4.989  -0.911
  654   3HG1  VAL  82          3HG1      VAL  82  -4.565  -5.544  -2.584
  655   1HG2  VAL  82          1HG2      VAL  82  -4.949  -1.399  -1.540
  656   2HG2  VAL  82          2HG2      VAL  82  -4.413  -2.608  -0.376
  657   3HG2  VAL  82          3HG2      VAL  82  -3.316  -2.097  -1.675
  658    H    ASN  83           H        ASN  83  -3.813  -4.449  -5.829
  659    HA   ASN  83           HA       ASN  83  -6.035  -6.421  -5.708
  660   1HB   ASN  83          1HB       ASN  83  -5.875  -6.782  -8.156
  661   2HB   ASN  83          2HB       ASN  83  -6.721  -5.343  -7.640
  662   1HD2  ASN  83          2HD2      ASN  83  -4.455  -6.467  -9.842
  663   2HD2  ASN  83          1HD2      ASN  83  -3.736  -4.927 -10.269
  664    H    HIS  84           H        HIS  84  -4.868  -7.866  -4.570
  665    HA   HIS  84           HA       HIS  84  -2.281  -8.969  -5.475
  666   1HB   HIS  84          1HB       HIS  84  -2.972  -9.155  -3.128
  667   2HB   HIS  84          2HB       HIS  84  -4.432 -10.020  -3.628
  668    HD2  HIS  84           HD2      HIS  84  -0.517 -10.665  -3.814
  669    HE1  HIS  84           HE1      HIS  84  -2.615 -14.341  -3.795
  670    HE2  HIS  84           HE2      HIS  84  -0.278 -13.268  -3.833
  671    H    VAL  85           H        VAL  85  -2.318 -11.075  -6.651
  672    HA   VAL  85           HA       VAL  85  -4.141 -11.191  -8.748
  673    HB   VAL  85           HB       VAL  85  -1.949 -12.223  -8.754
  674   1HG1  VAL  85          1HG1      VAL  85  -3.141 -14.465  -7.063
  675   2HG1  VAL  85          2HG1      VAL  85  -1.562 -14.467  -7.861
  676   3HG1  VAL  85          3HG1      VAL  85  -1.880 -13.312  -6.559
  677   1HG2  VAL  85          1HG2      VAL  85  -3.637 -12.823 -10.444
  678   2HG2  VAL  85          2HG2      VAL  85  -2.500 -14.143 -10.126
  679   3HG2  VAL  85          3HG2      VAL  85  -4.140 -14.210  -9.452
  680    H    THR  86           H        THR  86  -4.442 -12.735  -5.550
  681    HA   THR  86           HA       THR  86  -6.774 -14.244  -6.425
  682    HB   THR  86           HB       THR  86  -4.853 -14.879  -4.705
  683    HG1  THR  86           HG1      THR  86  -6.430 -16.192  -5.626
  684   1HG2  THR  86          1HG2      THR  86  -7.180 -14.209  -2.868
  685   2HG2  THR  86          2HG2      THR  86  -5.603 -14.898  -2.451
  686   3HG2  THR  86          3HG2      THR  86  -5.714 -13.202  -2.966
  687    H    LEU  87           H        LEU  87  -6.364 -11.017  -5.203
  688    HA   LEU  87           HA       LEU  87  -9.053 -10.738  -4.126
  689   1HB   LEU  87          1HB       LEU  87  -6.884  -8.899  -5.094
  690   2HB   LEU  87          2HB       LEU  87  -8.521  -8.341  -5.314
  691    HG   LEU  87           HG       LEU  87  -9.065  -8.582  -2.999
  692   1HD1  LEU  87          1HD1      LEU  87  -7.491 -10.462  -2.377
  693   2HD1  LEU  87          2HD1      LEU  87  -6.144  -9.314  -2.539
  694   3HD1  LEU  87          3HD1      LEU  87  -7.377  -9.059  -1.297
  695   1HD2  LEU  87          1HD2      LEU  87  -6.475  -7.046  -3.504
  696   2HD2  LEU  87          2HD2      LEU  87  -8.129  -6.444  -3.758
  697   3HD2  LEU  87          3HD2      LEU  87  -7.535  -6.779  -2.119
  698    H    SER  88           H        SER  88  -7.532 -10.369  -7.332
  699    HA   SER  88           HA       SER  88  -8.305 -10.500  -9.420
  700   1HB   SER  88          1HB       SER  88  -9.788 -12.381  -8.638
  701   2HB   SER  88          2HB       SER  88 -11.104 -11.198  -8.450
  702    HG   SER  88           HG       SER  88 -11.125 -12.185 -10.488
  703    H    GLN  89           H        GLN  89 -10.510  -8.797  -7.144
  704    HA   GLN  89           HA       GLN  89 -10.970  -6.655  -9.128
  705   1HB   GLN  89          1HB       GLN  89 -13.051  -7.429  -8.631
  706   2HB   GLN  89          2HB       GLN  89 -12.608  -7.983  -7.011
  707   1HG   GLN  89          1HG       GLN  89 -12.642  -5.792  -6.098
  708   2HG   GLN  89          2HG       GLN  89 -12.758  -5.054  -7.710
  709   1HE2  GLN  89          2HE2      GLN  89 -14.797  -5.357  -8.926
  710   2HE2  GLN  89          1HE2      GLN  89 -16.285  -5.629  -8.044
  711    HA   PRO  90           HA       PRO  90  -8.201  -4.572  -6.294
  712   1HB   PRO  90          1HB       PRO  90  -8.371  -1.982  -7.162
  713   2HB   PRO  90          2HB       PRO  90  -7.563  -3.249  -8.121
  714   1HG   PRO  90          1HG       PRO  90 -10.421  -2.286  -8.396
  715   2HG   PRO  90          2HG       PRO  90  -9.200  -2.455  -9.691
  716   1HD   PRO  90          1HD       PRO  90 -11.035  -4.390  -9.226
  717   2HD   PRO  90          2HD       PRO  90  -9.347  -4.841  -9.616
  718    H    LYS  91           H        LYS  91  -8.341  -3.628  -4.355
  719    HA   LYS  91           HA       LYS  91 -10.903  -2.368  -3.463
  720   1HB   LYS  91          1HB       LYS  91  -8.870  -4.007  -1.887
  721   2HB   LYS  91          2HB       LYS  91 -10.241  -3.113  -1.200
  722   1HG   LYS  91          1HG       LYS  91 -11.839  -4.526  -2.396
  723   2HG   LYS  91          2HG       LYS  91 -10.536  -5.322  -3.285
  724   1HD   LYS  91          1HD       LYS  91 -11.285  -6.804  -1.576
  725   2HD   LYS  91          2HD       LYS  91  -9.639  -6.279  -1.198
  726   1HE   LYS  91          1HE       LYS  91 -10.506  -4.704   0.497
  727   2HE   LYS  91          2HE       LYS  91 -12.173  -5.136   0.064
  728   1HZ   LYS  91          1HZ       LYS  91 -10.156  -6.956   1.181
  729   2HZ   LYS  91          2HZ       LYS  91 -11.429  -6.300   1.996
  730   3HZ   LYS  91          3HZ       LYS  91 -11.698  -7.370   0.774
  731    H    ILE  92           H        ILE  92 -10.516  -0.194  -3.456
  732    HA   ILE  92           HA       ILE  92  -7.766   0.751  -3.509
  733    HB   ILE  92           HB       ILE  92 -10.279   2.429  -3.623
  734   1HG1  ILE  92          1HG1      ILE  92 -10.628   0.794  -5.353
  735   2HG1  ILE  92          2HG1      ILE  92 -10.144   2.325  -6.068
  736   1HG2  ILE  92          1HG2      ILE  92  -8.201   3.653  -3.283
  737   2HG2  ILE  92          2HG2      ILE  92  -7.400   2.767  -4.588
  738   3HG2  ILE  92          3HG2      ILE  92  -8.727   3.887  -4.960
  739   1HD1  ILE  92          1HD1      ILE  92  -8.322  -0.087  -5.678
  740   2HD1  ILE  92          2HD1      ILE  92  -9.069   0.443  -7.194
  741   3HD1  ILE  92          3HD1      ILE  92  -7.851   1.465  -6.418
  742    H    VAL  93           H        VAL  93  -7.336  -0.075  -1.316
  743    HA   VAL  93           HA       VAL  93  -8.792   0.709   0.971
  744    HB   VAL  93           HB       VAL  93  -5.869  -0.144   0.830
  745   1HG1  VAL  93          1HG1      VAL  93  -6.557   0.797   3.043
  746   2HG1  VAL  93          2HG1      VAL  93  -7.919  -0.340   3.086
  747   3HG1  VAL  93          3HG1      VAL  93  -6.252  -0.941   3.133
  748   1HG2  VAL  93          1HG2      VAL  93  -7.226  -1.850  -0.278
  749   2HG2  VAL  93          2HG2      VAL  93  -6.775  -2.428   1.321
  750   3HG2  VAL  93          3HG2      VAL  93  -8.416  -1.814   1.039
  751    H    LYS  94           H        LYS  94  -9.035   2.742   1.753
  752    HA   LYS  94           HA       LYS  94  -7.200   4.861   1.050
  753   1HB   LYS  94          1HB       LYS  94  -9.421   4.997   3.103
  754   2HB   LYS  94          2HB       LYS  94  -8.573   6.317   2.276
  755   1HG   LYS  94          1HG       LYS  94  -9.494   5.088   0.085
  756   2HG   LYS  94          2HG       LYS  94 -10.700   4.462   1.223
  757   1HD   LYS  94          1HD       LYS  94 -10.014   7.383   0.659
  758   2HD   LYS  94          2HD       LYS  94 -11.489   6.536   0.161
  759   1HE   LYS  94          1HE       LYS  94 -12.152   6.255   2.538
  760   2HE   LYS  94          2HE       LYS  94 -10.673   7.076   3.059
  761   1HZ   LYS  94          1HZ       LYS  94 -11.416   9.017   1.865
  762   2HZ   LYS  94          2HZ       LYS  94 -12.838   8.282   1.487
  763   3HZ   LYS  94          3HZ       LYS  94 -12.449   8.591   3.059
  764    H    TRP  95           H        TRP  95  -5.958   6.130   2.434
  765    HA   TRP  95           HA       TRP  95  -4.474   4.645   4.396
  766   1HB   TRP  95          1HB       TRP  95  -3.280   6.136   3.047
  767   2HB   TRP  95          2HB       TRP  95  -4.439   7.431   3.316
  768    HD1  TRP  95           HD1      TRP  95  -2.437   5.497   6.022
  769    HE1  TRP  95           HE1      TRP  95  -1.436   7.261   7.615
  770    HE3  TRP  95           HE3      TRP  95  -3.586   9.699   3.390
  771    HZ2  TRP  95           HZ2      TRP  95  -1.550  10.117   7.913
  772    HZ3  TRP  95           HZ3      TRP  95  -2.803  11.897   4.194
  773    HH2  TRP  95           HH2      TRP  95  -1.962  12.152   6.505
  774    H    ASP  96           H        ASP  96  -5.483   4.040   6.150
  775    HA   ASP  96           HA       ASP  96  -7.107   5.681   7.847
  776   1HB   ASP  96          1HB       ASP  96  -7.110   3.175   7.840
  777   2HB   ASP  96          2HB       ASP  96  -5.452   3.203   8.470
  778    H    ARG  97           H        ARG  97  -6.507   6.795   9.685
  779    HA   ARG  97           HA       ARG  97  -3.658   7.470  10.193
  780   1HB   ARG  97          1HB       ARG  97  -4.121   9.840   9.601
  781   2HB   ARG  97          2HB       ARG  97  -4.143   8.713   8.252
  782   1HG   ARG  97          1HG       ARG  97  -6.625   8.676   8.239
  783   2HG   ARG  97          2HG       ARG  97  -6.641   9.858   9.557
  784   1HD   ARG  97          1HD       ARG  97  -5.421  11.454   8.137
  785   2HD   ARG  97          2HD       ARG  97  -5.380  10.286   6.812
  786    HE   ARG  97           HE       ARG  97  -7.674  11.846   7.823
  787   1HH1  ARG  97          1HH2      ARG  97  -6.828   9.024   5.747
  788   2HH1  ARG  97          2HH2      ARG  97  -8.213   9.297   4.712
  789   1HH2  ARG  97          1HH1      ARG  97  -9.508  12.022   6.471
  790   2HH2  ARG  97          2HH1      ARG  97  -9.715  10.899   5.143
  791    H    ASP  98           H        ASP  98  -5.307  10.080  11.219
  792    HA   ASP  98           HA       ASP  98  -5.839   9.115  13.906
  793   1HB   ASP  98          1HB       ASP  98  -5.076  11.404  13.489
  794   2HB   ASP  98          2HB       ASP  98  -6.529  11.749  12.538
  795    H    MET  99           H        MET  99  -7.997  10.577  11.384
  796    HA   MET  99           HA       MET  99  -9.742   8.369  11.272
  797   1HB   MET  99          1HB       MET  99 -11.779   9.370  12.191
  798   2HB   MET  99          2HB       MET  99 -10.568   9.125  13.444
  799   1HG   MET  99          1HG       MET  99  -9.931  11.612  13.044
  800   2HG   MET  99          2HG       MET  99 -11.466  11.732  12.190
  801   1HE   MET  99          1HE       MET  99 -13.814  11.859  13.420
  802   2HE   MET  99          2HE       MET  99 -13.557  10.126  13.752
  803   3HE   MET  99          3HE       MET  99 -14.068  11.218  15.058
  Start of MODEL   17
    1   1H    MET   0          1H        MET   0  -6.820 -25.235  -2.881
    2   2H    MET   0          2H        MET   0  -5.191 -25.329  -2.635
    3   3H    MET   0          3H        MET   0  -6.188 -24.940  -1.383
    4    HA   MET   0           HA       MET   0  -5.760 -23.322  -3.776
    5   1HB   MET   0          1HB       MET   0  -7.348 -22.769  -1.234
    6   2HB   MET   0          2HB       MET   0  -7.005 -21.573  -2.491
    7   1HG   MET   0          1HG       MET   0  -8.251 -22.911  -4.140
    8   2HG   MET   0          2HG       MET   0  -8.597 -24.135  -2.909
    9   1HE   MET   0          1HE       MET   0 -10.717 -22.625  -4.812
   10   2HE   MET   0          2HE       MET   0 -11.183 -23.921  -3.682
   11   3HE   MET   0          3HE       MET   0 -12.054 -22.372  -3.667
   12    H    ILE   1           H        ILE   1  -4.085 -21.894  -3.689
   13    HA   ILE   1           HA       ILE   1  -2.808 -21.286  -1.071
   14    HB   ILE   1           HB       ILE   1  -1.236 -21.429  -3.648
   15   1HG1  ILE   1          1HG1      ILE   1  -0.174 -23.489  -2.421
   16   2HG1  ILE   1          2HG1      ILE   1  -1.735 -23.627  -1.611
   17   1HG2  ILE   1          1HG2      ILE   1  -0.386 -21.467  -0.717
   18   2HG2  ILE   1          2HG2      ILE   1   0.678 -21.375  -2.132
   19   3HG2  ILE   1          3HG2      ILE   1  -0.369 -20.015  -1.724
   20   1HD1  ILE   1          1HD1      ILE   1  -1.224 -23.648  -4.632
   21   2HD1  ILE   1          2HD1      ILE   1  -1.489 -25.079  -3.616
   22   3HD1  ILE   1          3HD1      ILE   1  -2.804 -23.934  -3.879
   23    H    GLN   2           H        GLN   2  -4.977 -19.981  -1.908
   24    HA   GLN   2           HA       GLN   2  -4.230 -17.597  -3.495
   25   1HB   GLN   2          1HB       GLN   2  -6.879 -18.535  -2.339
   26   2HB   GLN   2          2HB       GLN   2  -6.630 -17.122  -3.372
   27   1HG   GLN   2          1HG       GLN   2  -5.744 -18.629  -5.177
   28   2HG   GLN   2          2HG       GLN   2  -6.077 -20.029  -4.162
   29   1HE2  GLN   2          2HE2      GLN   2  -7.745 -17.141  -5.543
   30   2HE2  GLN   2          1HE2      GLN   2  -9.257 -17.975  -5.853
   31    H    ARG   3           H        ARG   3  -2.630 -17.347  -1.466
   32    HA   ARG   3           HA       ARG   3  -3.733 -16.741   1.079
   33   1HB   ARG   3          1HB       ARG   3  -1.042 -16.097  -0.124
   34   2HB   ARG   3          2HB       ARG   3  -1.482 -15.773   1.565
   35   1HG   ARG   3          1HG       ARG   3  -1.896 -18.139   1.968
   36   2HG   ARG   3          2HG       ARG   3  -1.524 -18.529   0.284
   37   1HD   ARG   3          1HD       ARG   3   0.693 -18.521   0.634
   38   2HD   ARG   3          2HD       ARG   3   0.674 -16.998   1.532
   39    HE   ARG   3           HE       ARG   3   0.632 -19.730   2.548
   40   1HH1  ARG   3          1HH2      ARG   3   0.126 -16.290   3.379
   41   2HH1  ARG   3          2HH2      ARG   3   0.107 -16.603   5.093
   42   1HH2  ARG   3          1HH1      ARG   3   0.584 -20.081   4.796
   43   2HH2  ARG   3          2HH1      ARG   3   0.415 -18.748   5.906
   44    H    THR   4           H        THR   4  -4.830 -15.008   1.733
   45    HA   THR   4           HA       THR   4  -5.384 -12.876  -0.053
   46    HB   THR   4           HB       THR   4  -6.105 -13.260   2.881
   47    HG1  THR   4           HG1      THR   4  -7.391 -14.095   0.497
   48   1HG2  THR   4          1HG2      THR   4  -7.563 -11.683   0.716
   49   2HG2  THR   4          2HG2      THR   4  -8.091 -11.922   2.389
   50   3HG2  THR   4          3HG2      THR   4  -6.640 -10.962   2.061
   51    HA   PRO   5           HA       PRO   5  -2.195 -10.067   1.463
   52   1HB   PRO   5          1HB       PRO   5  -3.137  -7.667   0.508
   53   2HB   PRO   5          2HB       PRO   5  -2.411  -8.933  -0.524
   54   1HG   PRO   5          1HG       PRO   5  -5.343  -8.412  -0.012
   55   2HG   PRO   5          2HG       PRO   5  -4.523  -8.658  -1.583
   56   1HD   PRO   5          1HD       PRO   5  -5.809 -10.672  -0.312
   57   2HD   PRO   5          2HD       PRO   5  -4.282 -10.983  -1.186
   58    H    LYS   6           H        LYS   6  -2.106  -9.817   3.627
   59    HA   LYS   6           HA       LYS   6  -4.195  -8.458   5.189
   60   1HB   LYS   6          1HB       LYS   6  -2.855 -10.395   6.087
   61   2HB   LYS   6          2HB       LYS   6  -1.416  -9.357   6.009
   62   1HG   LYS   6          1HG       LYS   6  -2.781  -7.648   7.375
   63   2HG   LYS   6          2HG       LYS   6  -3.974  -8.930   7.614
   64   1HD   LYS   6          1HD       LYS   6  -2.305 -10.314   8.778
   65   2HD   LYS   6          2HD       LYS   6  -1.020  -9.170   8.349
   66   1HE   LYS   6          1HE       LYS   6  -1.636  -8.784  10.659
   67   2HE   LYS   6          2HE       LYS   6  -2.127  -7.392   9.681
   68   1HZ   LYS   6          1HZ       LYS   6  -4.355  -8.267   9.679
   69   2HZ   LYS   6          2HZ       LYS   6  -3.891  -9.563  10.588
   70   3HZ   LYS   6          3HZ       LYS   6  -3.817  -8.042  11.218
   71    H    ILE   7           H        ILE   7  -4.291  -6.310   4.954
   72    HA   ILE   7           HA       ILE   7  -1.957  -4.722   4.084
   73    HB   ILE   7           HB       ILE   7  -4.891  -4.068   4.355
   74   1HG1  ILE   7          1HG1      ILE   7  -3.772  -4.276   1.634
   75   2HG1  ILE   7          2HG1      ILE   7  -3.732  -5.818   2.463
   76   1HG2  ILE   7          1HG2      ILE   7  -3.517  -2.064   4.407
   77   2HG2  ILE   7          2HG2      ILE   7  -2.602  -2.596   2.983
   78   3HG2  ILE   7          3HG2      ILE   7  -4.318  -2.171   2.834
   79   1HD1  ILE   7          1HD1      ILE   7  -6.093  -5.763   2.947
   80   2HD1  ILE   7          2HD1      ILE   7  -6.249  -4.139   2.250
   81   3HD1  ILE   7          3HD1      ILE   7  -5.828  -5.514   1.211
   82    H    GLN   8           H        GLN   8  -0.823  -3.350   5.570
   83    HA   GLN   8           HA       GLN   8  -2.315  -2.344   7.908
   84   1HB   GLN   8          1HB       GLN   8  -0.180  -2.720   9.141
   85   2HB   GLN   8          2HB       GLN   8  -1.220  -4.129   8.913
   86   1HG   GLN   8          1HG       GLN   8   1.206  -3.529   7.182
   87   2HG   GLN   8          2HG       GLN   8   1.304  -4.451   8.684
   88   1HE2  GLN   8          2HE2      GLN   8   1.781  -5.147   5.750
   89   2HE2  GLN   8          1HE2      GLN   8   0.914  -6.660   5.578
   90    H    VAL   9           H        VAL   9  -2.535  -0.392   6.826
   91    HA   VAL   9           HA       VAL   9  -0.227   0.941   5.695
   92    HB   VAL   9           HB       VAL   9  -2.988   2.071   6.252
   93   1HG1  VAL   9          1HG1      VAL   9  -0.710   2.933   4.420
   94   2HG1  VAL   9          2HG1      VAL   9  -2.347   3.618   4.389
   95   3HG1  VAL   9          3HG1      VAL   9  -1.332   3.814   5.821
   96   1HG2  VAL   9          1HG2      VAL   9  -3.322   0.153   4.839
   97   2HG2  VAL   9          2HG2      VAL   9  -3.420   1.588   3.823
   98   3HG2  VAL   9          3HG2      VAL   9  -1.952   0.588   3.797
   99    H    TYR  10           H        TYR  10   1.148   2.296   6.746
  100    HA   TYR  10           HA       TYR  10   0.392   3.337   9.442
  101   1HB   TYR  10          1HB       TYR  10   3.190   3.219   8.379
  102   2HB   TYR  10          2HB       TYR  10   2.622   3.336  10.031
  103    HD1  TYR  10           HD1      TYR  10   3.909   1.130   7.586
  104    HD2  TYR  10           HD2      TYR  10   1.052   1.284  10.805
  105    HE1  TYR  10           HE1      TYR  10   4.141  -1.321   7.899
  106    HE2  TYR  10           HE2      TYR  10   1.226  -1.183  11.068
  107    HH   TYR  10           HH       TYR  10   2.382  -3.067  10.503
  108    H    SER  11           H        SER  11   1.141   5.413   9.985
  109    HA   SER  11           HA       SER  11   1.600   7.390   7.793
  110   1HB   SER  11          1HB       SER  11   0.192   8.440  10.178
  111   2HB   SER  11          2HB       SER  11  -0.086   8.731   8.470
  112    HG   SER  11           HG       SER  11  -1.794   7.609   9.595
  113    H    ARG  12           H        ARG  12   3.727   8.095   8.157
  114    HA   ARG  12           HA       ARG  12   5.059   7.780  10.686
  115   1HB   ARG  12          1HB       ARG  12   5.629   9.469   8.224
  116   2HB   ARG  12          2HB       ARG  12   6.682   9.493   9.641
  117   1HG   ARG  12          1HG       ARG  12   5.982   6.928   8.144
  118   2HG   ARG  12          2HG       ARG  12   7.398   7.940   7.797
  119   1HD   ARG  12          1HD       ARG  12   8.160   7.682  10.140
  120   2HD   ARG  12          2HD       ARG  12   6.852   6.514  10.430
  121    HE   ARG  12           HE       ARG  12   8.096   5.539   8.187
  122   1HH1  ARG  12          1HH2      ARG  12   9.182   6.340  11.472
  123   2HH1  ARG  12          2HH2      ARG  12  10.517   5.218  11.441
  124   1HH2  ARG  12          1HH1      ARG  12   9.851   4.071   8.158
  125   2HH2  ARG  12          2HH1      ARG  12  10.893   3.914   9.549
  126    H    HIS  13           H        HIS  13   3.398  10.519   9.137
  127    HA   HIS  13           HA       HIS  13   3.055  11.759  11.820
  128   1HB   HIS  13          1HB       HIS  13   3.204  13.174   9.144
  129   2HB   HIS  13          2HB       HIS  13   2.979  13.928  10.724
  130    HD2  HIS  13           HD2      HIS  13   5.765  12.512   8.497
  131    HE1  HIS  13           HE1      HIS  13   7.573  13.904  12.067
  132    HE2  HIS  13           HE2      HIS  13   8.052  12.994   9.727
  133    HA   PRO  14           HA       PRO  14  -1.207  11.118  10.601
  134   1HB   PRO  14          1HB       PRO  14  -2.543  12.425  12.529
  135   2HB   PRO  14          2HB       PRO  14  -1.353  11.166  12.956
  136   1HG   PRO  14          1HG       PRO  14  -0.843  14.146  12.909
  137   2HG   PRO  14          2HG       PRO  14  -0.552  12.995  14.250
  138   1HD   PRO  14          1HD       PRO  14   1.380  13.713  12.407
  139   2HD   PRO  14          2HD       PRO  14   1.342  12.107  13.183
  140    H    ALA  15           H        ALA  15  -0.055  12.669   8.780
  141    HA   ALA  15           HA       ALA  15  -0.354  14.114   7.139
  142   1HB   ALA  15          1HB       ALA  15  -2.771  13.587   7.301
  143   2HB   ALA  15          2HB       ALA  15  -2.973  14.994   8.360
  144   3HB   ALA  15          3HB       ALA  15  -2.445  15.225   6.699
  145    H    GLU  16           H        GLU  16   0.556  15.956   6.734
  146    HA   GLU  16           HA       GLU  16   0.241  18.344   8.415
  147   1HB   GLU  16          1HB       GLU  16   3.031  17.363   7.670
  148   2HB   GLU  16          2HB       GLU  16   2.594  18.811   8.578
  149   1HG   GLU  16          1HG       GLU  16   1.664  17.320  10.391
  150   2HG   GLU  16          2HG       GLU  16   2.278  15.922   9.492
  151    H    ASN  17           H        ASN  17  -0.624  19.629   6.794
  152    HA   ASN  17           HA       ASN  17  -0.227  19.157   4.052
  153   1HB   ASN  17          1HB       ASN  17  -1.486  21.174   3.716
  154   2HB   ASN  17          2HB       ASN  17  -2.211  20.263   5.038
  155   1HD2  ASN  17          2HD2      ASN  17  -1.717  21.024   7.305
  156   2HD2  ASN  17          1HD2      ASN  17  -1.406  22.727   7.548
  157    H    GLY  18           H        GLY  18   0.821  20.314   2.420
  158   1HA   GLY  18          1HA       GLY  18   2.341  21.704   1.439
  159   2HA   GLY  18          2HA       GLY  18   2.667  22.489   2.988
  160    H    LYS  19           H        LYS  19   3.686  20.615   4.607
  161    HA   LYS  19           HA       LYS  19   6.309  20.012   3.408
  162   1HB   LYS  19          1HB       LYS  19   5.984  21.030   5.643
  163   2HB   LYS  19          2HB       LYS  19   5.478  19.394   6.170
  164   1HG   LYS  19          1HG       LYS  19   7.641  18.477   5.340
  165   2HG   LYS  19          2HG       LYS  19   8.092  20.088   4.755
  166   1HD   LYS  19          1HD       LYS  19   9.222  19.692   6.728
  167   2HD   LYS  19          2HD       LYS  19   8.016  20.958   7.062
  168   1HE   LYS  19          1HE       LYS  19   6.552  19.312   8.191
  169   2HE   LYS  19          2HE       LYS  19   7.659  17.992   7.753
  170   1HZ   LYS  19          1HZ       LYS  19   8.263  20.230   9.551
  171   2HZ   LYS  19          2HZ       LYS  19   7.947  18.672   9.988
  172   3HZ   LYS  19          3HZ       LYS  19   9.312  19.026   9.134
  173    H    SER  20           H        SER  20   6.552  18.212   2.480
  174    HA   SER  20           HA       SER  20   5.206  15.908   2.166
  175   1HB   SER  20          1HB       SER  20   7.370  14.726   1.804
  176   2HB   SER  20          2HB       SER  20   7.057  16.208   0.906
  177    HG   SER  20           HG       SER  20   8.509  16.129   3.350
  178    H    ASN  21           H        ASN  21   4.714  14.113   3.412
  179    HA   ASN  21           HA       ASN  21   6.004  13.641   6.091
  180   1HB   ASN  21          1HB       ASN  21   3.301  12.856   5.023
  181   2HB   ASN  21          2HB       ASN  21   3.901  12.496   6.657
  182   1HD2  ASN  21          2HD2      ASN  21   2.520  14.905   4.565
  183   2HD2  ASN  21          1HD2      ASN  21   2.482  16.221   5.724
  184    H    PHE  22           H        PHE  22   4.632  10.843   5.931
  185    HA   PHE  22           HA       PHE  22   5.626   9.659   3.566
  186   1HB   PHE  22          1HB       PHE  22   7.472   9.605   5.760
  187   2HB   PHE  22          2HB       PHE  22   6.850   7.977   5.536
  188    HD1  PHE  22           HD1      PHE  22   6.768   7.060   3.067
  189    HD2  PHE  22           HD2      PHE  22   9.262  10.331   4.362
  190    HE1  PHE  22           HE1      PHE  22   8.286   6.692   1.129
  191    HE2  PHE  22           HE2      PHE  22  10.819   9.884   2.481
  192    HZ   PHE  22           HZ       PHE  22  10.286   8.112   0.821
  193    H    LEU  23           H        LEU  23   4.163   8.361   2.977
  194    HA   LEU  23           HA       LEU  23   2.273   7.064   4.834
  195   1HB   LEU  23          1HB       LEU  23   1.410   8.504   3.016
  196   2HB   LEU  23          2HB       LEU  23   2.310   7.557   1.833
  197    HG   LEU  23           HG       LEU  23   0.821   5.612   2.395
  198   1HD1  LEU  23          1HD1      LEU  23  -0.591   7.716   4.106
  199   2HD1  LEU  23          2HD1      LEU  23  -1.212   6.091   3.712
  200   3HD1  LEU  23          3HD1      LEU  23   0.215   6.265   4.732
  201   1HD2  LEU  23          1HD2      LEU  23   0.318   7.219   0.538
  202   2HD2  LEU  23          2HD2      LEU  23  -1.175   6.614   1.284
  203   3HD2  LEU  23          3HD2      LEU  23  -0.579   8.240   1.675
  204    H    ASN  24           H        ASN  24   2.256   4.830   4.998
  205    HA   ASN  24           HA       ASN  24   4.171   3.279   3.293
  206   1HB   ASN  24          1HB       ASN  24   3.889   3.334   6.301
  207   2HB   ASN  24          2HB       ASN  24   4.786   2.119   5.384
  208   1HD2  ASN  24          2HD2      ASN  24   4.636   5.625   6.188
  209   2HD2  ASN  24          1HD2      ASN  24   6.329   5.935   5.869
  210    H    CYS  25           H        CYS  25   2.479   2.405   2.111
  211    HA   CYS  25           HA       CYS  25   0.306   0.954   3.501
  212   1HB   CYS  25          1HB       CYS  25   0.848   1.341   0.551
  213   2HB   CYS  25          2HB       CYS  25  -0.487   0.434   1.242
  214    H    TYR  26           H        TYR  26   1.744  -0.509   4.630
  215    HA   TYR  26           HA       TYR  26   3.410  -2.304   3.071
  216   1HB   TYR  26          1HB       TYR  26   4.026  -1.624   5.366
  217   2HB   TYR  26          2HB       TYR  26   2.542  -2.278   5.985
  218    HD1  TYR  26           HD1      TYR  26   3.553  -3.778   7.584
  219    HD2  TYR  26           HD2      TYR  26   4.720  -4.004   3.447
  220    HE1  TYR  26           HE1      TYR  26   4.508  -6.024   7.975
  221    HE2  TYR  26           HE2      TYR  26   5.618  -6.246   3.816
  222    HH   TYR  26           HH       TYR  26   5.539  -7.854   7.026
  223    H    VAL  27           H        VAL  27   2.710  -4.227   2.167
  224    HA   VAL  27           HA       VAL  27   0.115  -5.360   3.109
  225    HB   VAL  27           HB       VAL  27   1.101  -5.628   0.237
  226   1HG1  VAL  27          1HG1      VAL  27  -0.600  -7.225   1.166
  227   2HG1  VAL  27          2HG1      VAL  27  -1.637  -5.840   1.538
  228   3HG1  VAL  27          3HG1      VAL  27  -1.238  -6.224  -0.151
  229   1HG2  VAL  27          1HG2      VAL  27  -0.764  -3.504   1.302
  230   2HG2  VAL  27          2HG2      VAL  27   0.802  -3.243   0.494
  231   3HG2  VAL  27          3HG2      VAL  27  -0.543  -3.947  -0.416
  232    H    SER  28           H        SER  28   0.253  -7.577   3.561
  233    HA   SER  28           HA       SER  28   2.459  -9.108   2.514
  234   1HB   SER  28          1HB       SER  28   3.487  -9.610   4.751
  235   2HB   SER  28          2HB       SER  28   3.543  -7.892   4.441
  236    HG   SER  28           HG       SER  28   1.588  -9.264   5.981
  237    H    GLY  29           H        GLY  29   2.549 -11.308   4.037
  238   1HA   GLY  29          1HA       GLY  29   1.423 -13.183   4.707
  239   2HA   GLY  29          2HA       GLY  29  -0.114 -12.318   4.647
  240    H    PHE  30           H        PHE  30   0.357 -11.476   1.771
  241    HA   PHE  30           HA       PHE  30  -1.011 -13.663   0.586
  242   1HB   PHE  30          1HB       PHE  30  -1.067 -12.294  -1.415
  243   2HB   PHE  30          2HB       PHE  30  -1.462 -11.373  -0.016
  244    HD1  PHE  30           HD1      PHE  30  -0.127  -9.404   0.657
  245    HD2  PHE  30           HD2      PHE  30   1.173 -12.003  -2.550
  246    HE1  PHE  30           HE1      PHE  30   1.692  -7.854   0.093
  247    HE2  PHE  30           HE2      PHE  30   2.963 -10.411  -3.111
  248    HZ   PHE  30           HZ       PHE  30   3.223  -8.357  -1.771
  249    H    HIS  31           H        HIS  31  -0.320 -14.444  -1.668
  250    HA   HIS  31           HA       HIS  31   2.400 -14.781  -2.501
  251   1HB   HIS  31          1HB       HIS  31   2.821 -16.262  -0.666
  252   2HB   HIS  31          2HB       HIS  31   1.166 -16.834  -0.717
  253    HD2  HIS  31           HD2      HIS  31   0.736 -18.315  -3.409
  254    HE1  HIS  31           HE1      HIS  31   4.436 -20.213  -2.693
  255    HE2  HIS  31           HE2      HIS  31   2.271 -20.323  -4.049
  256    HA   PRO  32           HA       PRO  32   3.119 -16.179  -4.195
  257   1HB   PRO  32          1HB       PRO  32   3.411 -16.549  -6.846
  258   2HB   PRO  32          2HB       PRO  32   2.560 -17.725  -5.836
  259   1HG   PRO  32          1HG       PRO  32   1.272 -15.490  -7.431
  260   2HG   PRO  32          2HG       PRO  32   0.925 -17.242  -7.544
  261   1HD   PRO  32          1HD       PRO  32  -0.507 -15.552  -5.920
  262   2HD   PRO  32          2HD       PRO  32  -0.190 -17.248  -5.465
  263    H    SER  33           H        SER  33   3.969 -14.769  -6.874
  264    HA   SER  33           HA       SER  33   4.700 -12.446  -5.382
  265   1HB   SER  33          1HB       SER  33   6.310 -12.174  -7.249
  266   2HB   SER  33          2HB       SER  33   6.299 -13.837  -6.628
  267    HG   SER  33           HG       SER  33   4.864 -12.952  -8.911
  268    H    ASP  34           H        ASP  34   2.598 -12.863  -8.222
  269    HA   ASP  34           HA       ASP  34   3.046 -10.161  -9.100
  270   1HB   ASP  34          1HB       ASP  34   2.564 -11.870 -10.710
  271   2HB   ASP  34          2HB       ASP  34   1.044 -12.290  -9.912
  272    H    ILE  35           H        ILE  35   2.510  -8.701  -7.495
  273    HA   ILE  35           HA       ILE  35  -0.416  -8.215  -7.259
  274    HB   ILE  35           HB       ILE  35   0.453  -9.008  -5.199
  275   1HG1  ILE  35          1HG1      ILE  35   0.041  -6.018  -4.847
  276   2HG1  ILE  35          2HG1      ILE  35  -1.276  -7.108  -5.231
  277   1HG2  ILE  35          1HG2      ILE  35   2.788  -8.380  -5.397
  278   2HG2  ILE  35          2HG2      ILE  35   2.338  -6.655  -5.225
  279   3HG2  ILE  35          3HG2      ILE  35   2.089  -7.799  -3.890
  280   1HD1  ILE  35          1HD1      ILE  35   0.425  -7.116  -2.717
  281   2HD1  ILE  35          2HD1      ILE  35  -1.308  -6.844  -2.880
  282   3HD1  ILE  35          3HD1      ILE  35  -0.627  -8.465  -3.163
  283    H    GLU  36           H        GLU  36  -1.093  -6.112  -7.303
  284    HA   GLU  36           HA       GLU  36   0.775  -4.030  -8.336
  285   1HB   GLU  36          1HB       GLU  36  -2.177  -4.041  -8.883
  286   2HB   GLU  36          2HB       GLU  36  -0.856  -3.218  -9.705
  287   1HG   GLU  36          1HG       GLU  36  -0.053  -5.476 -10.478
  288   2HG   GLU  36          2HG       GLU  36  -1.477  -6.196  -9.752
  289    H    VAL  37           H        VAL  37   0.846  -2.161  -7.156
  290    HA   VAL  37           HA       VAL  37  -1.397  -1.362  -5.416
  291    HB   VAL  37           HB       VAL  37   1.466  -1.738  -4.448
  292   1HG1  VAL  37          1HG1      VAL  37  -0.911  -0.730  -2.830
  293   2HG1  VAL  37          2HG1      VAL  37   0.715  -1.057  -2.236
  294   3HG1  VAL  37          3HG1      VAL  37   0.448   0.267  -3.372
  295   1HG2  VAL  37          1HG2      VAL  37  -1.148  -3.177  -3.850
  296   2HG2  VAL  37          2HG2      VAL  37   0.383  -3.859  -4.449
  297   3HG2  VAL  37          3HG2      VAL  37   0.247  -3.286  -2.779
  298    H    ASP  38           H        ASP  38  -1.782   0.204  -6.961
  299    HA   ASP  38           HA       ASP  38   0.211   2.300  -7.471
  300   1HB   ASP  38          1HB       ASP  38  -2.764   2.235  -8.137
  301   2HB   ASP  38          2HB       ASP  38  -1.552   3.377  -8.719
  302    H    LEU  39           H        LEU  39   0.528   3.953  -6.070
  303    HA   LEU  39           HA       LEU  39  -1.428   4.521  -3.938
  304   1HB   LEU  39          1HB       LEU  39   1.384   5.576  -4.462
  305   2HB   LEU  39          2HB       LEU  39   0.289   6.096  -3.170
  306    HG   LEU  39           HG       LEU  39   0.107   3.607  -2.531
  307   1HD1  LEU  39          1HD1      LEU  39   2.542   3.491  -4.297
  308   2HD1  LEU  39          2HD1      LEU  39   2.322   2.377  -2.932
  309   3HD1  LEU  39          3HD1      LEU  39   1.152   2.395  -4.247
  310   1HD2  LEU  39          1HD2      LEU  39   2.681   5.164  -2.110
  311   2HD2  LEU  39          2HD2      LEU  39   1.185   5.316  -1.156
  312   3HD2  LEU  39          3HD2      LEU  39   2.125   3.818  -1.092
  313    H    LEU  40           H        LEU  40  -2.692   6.278  -3.951
  314    HA   LEU  40           HA       LEU  40  -2.938   7.744  -6.527
  315   1HB   LEU  40          1HB       LEU  40  -3.757   5.238  -6.353
  316   2HB   LEU  40          2HB       LEU  40  -5.055   5.913  -5.394
  317    HG   LEU  40           HG       LEU  40  -5.757   5.572  -7.648
  318   1HD1  LEU  40          1HD1      LEU  40  -6.594   7.641  -6.513
  319   2HD1  LEU  40          2HD1      LEU  40  -5.344   8.581  -7.365
  320   3HD1  LEU  40          3HD1      LEU  40  -6.604   7.743  -8.284
  321   1HD2  LEU  40          1HD2      LEU  40  -3.679   7.498  -8.683
  322   2HD2  LEU  40          2HD2      LEU  40  -3.373   5.749  -8.592
  323   3HD2  LEU  40          3HD2      LEU  40  -4.697   6.381  -9.597
  324    H    LYS  41           H        LYS  41  -3.477   9.876  -5.937
  325    HA   LYS  41           HA       LYS  41  -4.707  10.351  -3.349
  326   1HB   LYS  41          1HB       LYS  41  -4.053  12.269  -5.576
  327   2HB   LYS  41          2HB       LYS  41  -4.445  12.688  -3.889
  328   1HG   LYS  41          1HG       LYS  41  -2.424  12.441  -3.208
  329   2HG   LYS  41          2HG       LYS  41  -2.323  10.799  -3.805
  330   1HD   LYS  41          1HD       LYS  41  -0.575  12.058  -4.871
  331   2HD   LYS  41          2HD       LYS  41  -1.774  11.693  -6.095
  332   1HE   LYS  41          1HE       LYS  41  -0.936  14.017  -6.237
  333   2HE   LYS  41          2HE       LYS  41  -2.683  13.976  -5.976
  334   1HZ   LYS  41          1HZ       LYS  41  -0.717  14.383  -3.836
  335   2HZ   LYS  41          2HZ       LYS  41  -1.529  15.595  -4.610
  336   3HZ   LYS  41          3HZ       LYS  41  -2.363  14.506  -3.708
  337    H    ASN  42           H        ASN  42  -6.101  12.710  -4.788
  338    HA   ASN  42           HA       ASN  42  -8.796  11.740  -4.763
  339   1HB   ASN  42          1HB       ASN  42  -9.374  13.957  -5.493
  340   2HB   ASN  42          2HB       ASN  42  -8.045  14.155  -4.348
  341   1HD2  ASN  42          2HD2      ASN  42  -5.748  14.313  -5.434
  342   2HD2  ASN  42          1HD2      ASN  42  -5.674  15.143  -6.970
  343    H    GLY  43           H        GLY  43  -6.413  12.319  -7.355
  344   1HA   GLY  43          1HA       GLY  43  -7.449  10.236  -8.989
  345   2HA   GLY  43          2HA       GLY  43  -8.050  11.797  -9.587
  346    H    GLU  44           H        GLU  44  -4.915  11.149  -7.992
  347    HA   GLU  44           HA       GLU  44  -3.470  11.386 -10.587
  348   1HB   GLU  44          1HB       GLU  44  -3.456  13.572  -9.480
  349   2HB   GLU  44          2HB       GLU  44  -2.831  12.838  -7.993
  350   1HG   GLU  44          1HG       GLU  44  -0.760  12.165  -9.171
  351   2HG   GLU  44          2HG       GLU  44  -1.396  12.829 -10.687
  352    H    ARG  45           H        ARG  45  -1.936   9.872 -10.819
  353    HA   ARG  45           HA       ARG  45  -1.523   7.915  -8.640
  354   1HB   ARG  45          1HB       ARG  45  -2.338   7.171 -10.843
  355   2HB   ARG  45          2HB       ARG  45  -0.855   7.764 -11.605
  356   1HG   ARG  45          1HG       ARG  45   0.511   6.188 -10.369
  357   2HG   ARG  45          2HG       ARG  45  -0.848   5.724  -9.329
  358   1HD   ARG  45          1HD       ARG  45  -0.757   5.266 -12.340
  359   2HD   ARG  45          2HD       ARG  45  -0.316   4.064 -11.110
  360    HE   ARG  45           HE       ARG  45  -2.929   5.159 -10.605
  361   1HH1  ARG  45          1HH2      ARG  45  -1.245   2.738 -12.582
  362   2HH1  ARG  45          2HH2      ARG  45  -2.673   1.764 -12.816
  363   1HH2  ARG  45          1HH1      ARG  45  -4.771   3.866 -10.896
  364   2HH2  ARG  45          2HH1      ARG  45  -4.681   2.399 -11.837
  365    H    ILE  46           H        ILE  46   0.395   7.546  -7.663
  366    HA   ILE  46           HA       ILE  46   2.351   9.668  -7.884
  367    HB   ILE  46           HB       ILE  46   1.659   7.469  -5.900
  368   1HG1  ILE  46          1HG1      ILE  46   1.212  10.491  -5.788
  369   2HG1  ILE  46          2HG1      ILE  46  -0.049   9.333  -6.221
  370   1HG2  ILE  46          1HG2      ILE  46   4.022   8.023  -5.778
  371   2HG2  ILE  46          2HG2      ILE  46   3.628   9.763  -5.738
  372   3HG2  ILE  46          3HG2      ILE  46   3.154   8.686  -4.392
  373   1HD1  ILE  46          1HD1      ILE  46   1.325   9.504  -3.528
  374   2HD1  ILE  46          2HD1      ILE  46  -0.350   9.884  -3.956
  375   3HD1  ILE  46          3HD1      ILE  46   0.200   8.218  -4.005
  376    H    GLU  47           H        GLU  47   4.173   9.354  -8.959
  377    HA   GLU  47           HA       GLU  47   4.998   6.710  -9.901
  378   1HB   GLU  47          1HB       GLU  47   6.255   9.449 -10.334
  379   2HB   GLU  47          2HB       GLU  47   6.711   7.932 -11.128
  380   1HG   GLU  47          1HG       GLU  47   4.340   7.764 -12.016
  381   2HG   GLU  47          2HG       GLU  47   4.058   9.402 -11.405
  382    H    LYS  48           H        LYS  48   6.273   9.256  -7.678
  383    HA   LYS  48           HA       LYS  48   8.673   7.723  -7.111
  384   1HB   LYS  48          1HB       LYS  48   8.449  10.246  -7.198
  385   2HB   LYS  48          2HB       LYS  48   7.695  10.178  -5.609
  386   1HG   LYS  48          1HG       LYS  48  10.477   9.114  -6.328
  387   2HG   LYS  48          2HG       LYS  48  10.141  10.696  -5.622
  388   1HD   LYS  48          1HD       LYS  48   9.203   9.580  -3.586
  389   2HD   LYS  48          2HD       LYS  48   9.601   8.005  -4.297
  390   1HE   LYS  48          1HE       LYS  48  11.300   8.505  -2.728
  391   2HE   LYS  48          2HE       LYS  48  12.002   8.597  -4.351
  392   1HZ   LYS  48          1HZ       LYS  48  11.104  10.903  -2.756
  393   2HZ   LYS  48          2HZ       LYS  48  12.662  10.391  -2.885
  394   3HZ   LYS  48          3HZ       LYS  48  11.870  10.966  -4.212
  395    H    VAL  49           H        VAL  49   7.399   5.785  -6.541
  396    HA   VAL  49           HA       VAL  49   6.754   5.728  -3.626
  397    HB   VAL  49           HB       VAL  49   6.194   3.532  -5.622
  398   1HG1  VAL  49          1HG1      VAL  49   6.210   3.183  -3.065
  399   2HG1  VAL  49          2HG1      VAL  49   4.817   4.263  -3.001
  400   3HG1  VAL  49          3HG1      VAL  49   4.718   2.735  -3.901
  401   1HG2  VAL  49          1HG2      VAL  49   4.304   5.796  -4.871
  402   2HG2  VAL  49          2HG2      VAL  49   5.022   5.521  -6.474
  403   3HG2  VAL  49          3HG2      VAL  49   3.903   4.345  -5.818
  404    H    GLU  50           H        GLU  50   8.555   5.132  -2.479
  405    HA   GLU  50           HA       GLU  50  10.757   3.619  -3.699
  406   1HB   GLU  50          1HB       GLU  50  11.096   5.525  -2.132
  407   2HB   GLU  50          2HB       GLU  50  10.391   4.545  -0.837
  408   1HG   GLU  50          1HG       GLU  50  12.152   2.857  -1.113
  409   2HG   GLU  50          2HG       GLU  50  12.835   3.763  -2.474
  410    H    HIS  51           H        HIS  51  10.839   1.417  -3.635
  411    HA   HIS  51           HA       HIS  51   8.759  -0.040  -2.084
  412   1HB   HIS  51          1HB       HIS  51  10.253  -0.679  -4.628
  413   2HB   HIS  51          2HB       HIS  51   9.272  -1.864  -3.759
  414    HD2  HIS  51           HD2      HIS  51   7.441   1.452  -3.769
  415    HE1  HIS  51           HE1      HIS  51   5.987  -0.776  -7.056
  416    HE2  HIS  51           HE2      HIS  51   5.603   1.314  -5.638
  417    H    SER  52           H        SER  52   9.263  -2.050  -1.175
  418    HA   SER  52           HA       SER  52  11.919  -2.348   0.003
  419   1HB   SER  52          1HB       SER  52   9.793  -2.911   1.173
  420   2HB   SER  52          2HB       SER  52   9.567  -4.256   0.019
  421    HG   SER  52           HG       SER  52  11.683  -4.973   0.755
  422    H    ASP  53           H        ASP  53  10.452  -3.336  -2.966
  423    HA   ASP  53           HA       ASP  53  10.968  -4.709  -4.638
  424   1HB   ASP  53          1HB       ASP  53  13.787  -4.546  -3.504
  425   2HB   ASP  53          2HB       ASP  53  13.350  -5.015  -5.149
  426    H    LEU  54           H        LEU  54   9.813  -5.977  -2.551
  427    HA   LEU  54           HA       LEU  54   9.116  -7.958  -1.984
  428   1HB   LEU  54          1HB       LEU  54   9.682  -8.375  -4.501
  429   2HB   LEU  54          2HB       LEU  54  10.920  -9.448  -3.850
  430    HG   LEU  54           HG       LEU  54   8.986 -10.774  -4.287
  431   1HD1  LEU  54          1HD1      LEU  54  10.078 -11.237  -2.087
  432   2HD1  LEU  54          2HD1      LEU  54   8.726 -10.358  -1.323
  433   3HD1  LEU  54          3HD1      LEU  54   8.411 -11.794  -2.264
  434   1HD2  LEU  54          1HD2      LEU  54   7.247  -8.826  -2.731
  435   2HD2  LEU  54          2HD2      LEU  54   7.346  -8.957  -4.500
  436   3HD2  LEU  54          3HD2      LEU  54   6.732 -10.290  -3.534
  437    H    SER  55           H        SER  55   9.440  -8.606  -0.058
  438    HA   SER  55           HA       SER  55  11.857 -10.198   0.616
  439   1HB   SER  55          1HB       SER  55  12.072  -8.049   1.824
  440   2HB   SER  55          2HB       SER  55  10.423  -8.220   2.451
  441    HG   SER  55           HG       SER  55  12.616  -9.957   2.940
  442    H    PHE  56           H        PHE  56  10.877 -12.188   0.410
  443    HA   PHE  56           HA       PHE  56   8.071 -12.502   1.198
  444   1HB   PHE  56          1HB       PHE  56   8.146 -14.575   0.093
  445   2HB   PHE  56          2HB       PHE  56   9.094 -13.499  -0.911
  446    HD1  PHE  56           HD1      PHE  56  11.678 -13.631  -0.682
  447    HD2  PHE  56           HD2      PHE  56   8.961 -16.623   0.801
  448    HE1  PHE  56           HE1      PHE  56  13.599 -15.180  -0.282
  449    HE2  PHE  56           HE2      PHE  56  10.877 -18.191   1.141
  450    HZ   PHE  56           HZ       PHE  56  13.177 -17.488   0.532
  451    H    SER  57           H        SER  57  10.671 -12.298   3.046
  452    HA   SER  57           HA       SER  57  11.492 -13.055   4.915
  453   1HB   SER  57          1HB       SER  57  10.161 -13.860   6.696
  454   2HB   SER  57          2HB       SER  57   9.190 -12.696   5.807
  455    HG   SER  57           HG       SER  57   8.178 -14.515   4.789
  456    H    LYS  58           H        LYS  58  11.723 -15.375   6.271
  457    HA   LYS  58           HA       LYS  58  12.097 -17.554   4.278
  458   1HB   LYS  58          1HB       LYS  58  12.965 -17.232   7.144
  459   2HB   LYS  58          2HB       LYS  58  13.264 -18.655   6.121
  460   1HG   LYS  58          1HG       LYS  58  14.532 -17.335   4.506
  461   2HG   LYS  58          2HG       LYS  58  14.099 -15.832   5.305
  462   1HD   LYS  58          1HD       LYS  58  16.353 -16.348   5.947
  463   2HD   LYS  58          2HD       LYS  58  15.296 -16.479   7.355
  464   1HE   LYS  58          1HE       LYS  58  16.960 -18.278   7.308
  465   2HE   LYS  58          2HE       LYS  58  15.322 -18.935   7.204
  466   1HZ   LYS  58          1HZ       LYS  58  15.650 -19.179   4.844
  467   2HZ   LYS  58          2HZ       LYS  58  17.164 -18.534   4.942
  468   3HZ   LYS  58          3HZ       LYS  58  16.829 -19.973   5.671
  469    H    ASP  59           H        ASP  59   9.600 -16.385   6.229
  470    HA   ASP  59           HA       ASP  59   8.765 -18.983   7.208
  471   1HB   ASP  59          1HB       ASP  59   7.586 -16.208   7.605
  472   2HB   ASP  59          2HB       ASP  59   7.180 -17.657   8.533
  473    H    TRP  60           H        TRP  60   8.650 -18.808   4.413
  474    HA   TRP  60           HA       TRP  60   7.334 -18.871   2.559
  475   1HB   TRP  60          1HB       TRP  60   5.949 -20.727   2.526
  476   2HB   TRP  60          2HB       TRP  60   7.392 -21.044   3.473
  477    HD1  TRP  60           HD1      TRP  60   7.042 -21.144   6.170
  478    HE1  TRP  60           HE1      TRP  60   5.025 -22.064   7.549
  479    HE3  TRP  60           HE3      TRP  60   3.515 -20.955   2.565
  480    HZ2  TRP  60           HZ2      TRP  60   2.244 -22.639   7.081
  481    HZ3  TRP  60           HZ3      TRP  60   1.182 -21.799   2.990
  482    HH2  TRP  60           HH2      TRP  60   0.543 -22.582   5.260
  483    H    SER  61           H        SER  61   6.789 -16.456   3.617
  484    HA   SER  61           HA       SER  61   3.894 -16.055   2.960
  485   1HB   SER  61          1HB       SER  61   4.172 -13.861   4.037
  486   2HB   SER  61          2HB       SER  61   4.611 -15.161   5.152
  487    HG   SER  61           HG       SER  61   6.573 -13.906   3.560
  488    H    PHE  62           H        PHE  62   4.212 -13.375   2.027
  489    HA   PHE  62           HA       PHE  62   6.385 -13.129   0.178
  490   1HB   PHE  62          1HB       PHE  62   4.328 -14.665  -0.834
  491   2HB   PHE  62          2HB       PHE  62   3.879 -13.066  -1.393
  492    HD1  PHE  62           HD1      PHE  62   6.447 -15.736  -1.444
  493    HD2  PHE  62           HD2      PHE  62   5.307 -11.917  -3.101
  494    HE1  PHE  62           HE1      PHE  62   8.211 -15.956  -3.106
  495    HE2  PHE  62           HE2      PHE  62   7.036 -12.181  -4.823
  496    HZ   PHE  62           HZ       PHE  62   8.580 -14.137  -4.782
  497    H    TYR  63           H        TYR  63   6.697 -10.819   0.225
  498    HA   TYR  63           HA       TYR  63   4.353  -9.068   0.312
  499   1HB   TYR  63          1HB       TYR  63   4.799  -8.113   2.539
  500   2HB   TYR  63          2HB       TYR  63   4.365  -9.821   2.589
  501    HD1  TYR  63           HD1      TYR  63   7.267  -7.546   2.867
  502    HD2  TYR  63           HD2      TYR  63   5.567 -11.416   3.717
  503    HE1  TYR  63           HE1      TYR  63   8.973  -7.893   4.586
  504    HE2  TYR  63           HE2      TYR  63   7.209 -11.743   5.500
  505    HH   TYR  63           HH       TYR  63   8.942 -10.771   6.748
  506    H    LEU  64           H        LEU  64   5.051  -6.786   0.930
  507    HA   LEU  64           HA       LEU  64   7.716  -5.969   0.623
  508   1HB   LEU  64          1HB       LEU  64   7.732  -4.880  -1.526
  509   2HB   LEU  64          2HB       LEU  64   7.504  -6.606  -1.730
  510    HG   LEU  64           HG       LEU  64   5.437  -4.452  -2.082
  511   1HD1  LEU  64          1HD1      LEU  64   6.541  -6.492  -4.068
  512   2HD1  LEU  64          2HD1      LEU  64   5.349  -5.241  -4.416
  513   3HD1  LEU  64          3HD1      LEU  64   7.008  -4.772  -4.016
  514   1HD2  LEU  64          1HD2      LEU  64   5.222  -7.483  -2.125
  515   2HD2  LEU  64          2HD2      LEU  64   4.159  -6.319  -1.274
  516   3HD2  LEU  64          3HD2      LEU  64   4.093  -6.494  -3.036
  517    H    LEU  65           H        LEU  65   7.908  -3.723   0.910
  518    HA   LEU  65           HA       LEU  65   5.544  -2.336   1.999
  519   1HB   LEU  65          1HB       LEU  65   8.075  -2.851   2.995
  520   2HB   LEU  65          2HB       LEU  65   8.317  -1.262   2.296
  521    HG   LEU  65           HG       LEU  65   6.187  -2.023   4.323
  522   1HD1  LEU  65          1HD1      LEU  65   8.820  -0.502   4.617
  523   2HD1  LEU  65          2HD1      LEU  65   7.634  -0.775   5.914
  524   3HD1  LEU  65          3HD1      LEU  65   8.513  -2.149   5.207
  525   1HD2  LEU  65          1HD2      LEU  65   5.659   0.008   2.845
  526   2HD2  LEU  65          2HD2      LEU  65   5.753   0.298   4.588
  527   3HD2  LEU  65          3HD2      LEU  65   7.108   0.765   3.555
  528    H    TYR  66           H        TYR  66   4.856  -0.424   0.959
  529    HA   TYR  66           HA       TYR  66   6.335   0.425  -1.487
  530   1HB   TYR  66          1HB       TYR  66   3.307   0.199  -1.401
  531   2HB   TYR  66          2HB       TYR  66   4.363   0.357  -2.789
  532    HD1  TYR  66           HD1      TYR  66   3.663  -2.043   0.099
  533    HD2  TYR  66           HD2      TYR  66   4.474  -1.619  -4.134
  534    HE1  TYR  66           HE1      TYR  66   2.709  -4.234  -0.310
  535    HE2  TYR  66           HE2      TYR  66   3.341  -3.772  -4.531
  536    HH   TYR  66           HH       TYR  66   1.956  -5.390  -3.613
  537    H    TYR  67           H        TYR  67   7.032   2.282  -0.517
  538    HA   TYR  67           HA       TYR  67   5.051   3.969   0.905
  539   1HB   TYR  67          1HB       TYR  67   7.027   4.678   2.233
  540   2HB   TYR  67          2HB       TYR  67   6.261   3.130   2.445
  541    HD1  TYR  67           HD1      TYR  67   7.327   1.082   1.293
  542    HD2  TYR  67           HD2      TYR  67   9.394   4.780   1.904
  543    HE1  TYR  67           HE1      TYR  67   9.474  -0.081   0.881
  544    HE2  TYR  67           HE2      TYR  67  11.562   3.562   1.827
  545    HH   TYR  67           HH       TYR  67  11.782   0.140   0.779
  546    H    THR  68           H        THR  68   4.839   5.919   0.539
  547    HA   THR  68           HA       THR  68   6.636   7.459  -1.328
  548    HB   THR  68           HB       THR  68   4.578   6.719  -2.371
  549    HG1  THR  68           HG1      THR  68   5.656   8.538  -3.096
  550   1HG2  THR  68          1HG2      THR  68   2.462   7.809  -1.882
  551   2HG2  THR  68          2HG2      THR  68   3.009   7.004  -0.397
  552   3HG2  THR  68          3HG2      THR  68   3.179   8.765  -0.580
  553    H    GLU  69           H        GLU  69   6.852   9.717  -0.969
  554    HA   GLU  69           HA       GLU  69   6.509  10.669   1.774
  555   1HB   GLU  69          1HB       GLU  69   7.771  12.629   0.885
  556   2HB   GLU  69          2HB       GLU  69   8.618  11.086   0.854
  557   1HG   GLU  69          1HG       GLU  69   8.336  10.827  -1.519
  558   2HG   GLU  69          2HG       GLU  69   7.265  12.231  -1.621
  559    H    PHE  70           H        PHE  70   4.112  10.506   1.599
  560    HA   PHE  70           HA       PHE  70   2.733  12.063  -0.341
  561   1HB   PHE  70          1HB       PHE  70   0.769  11.341   0.596
  562   2HB   PHE  70          2HB       PHE  70   1.849  10.026   1.019
  563    HD1  PHE  70           HD1      PHE  70   2.918  10.283   3.397
  564    HD2  PHE  70           HD2      PHE  70  -0.534  12.506   2.174
  565    HE1  PHE  70           HE1      PHE  70   2.163  10.403   5.789
  566    HE2  PHE  70           HE2      PHE  70  -0.939  13.111   4.527
  567    HZ   PHE  70           HZ       PHE  70   0.235  11.844   6.360
  568    H    THR  71           H        THR  71   2.076  14.014  -0.401
  569    HA   THR  71           HA       THR  71   2.454  15.877   1.888
  570    HB   THR  71           HB       THR  71   2.378  16.588  -1.013
  571    HG1  THR  71           HG1      THR  71   4.078  15.145  -0.550
  572   1HG2  THR  71          1HG2      THR  71   3.491  17.948   1.490
  573   2HG2  THR  71          2HG2      THR  71   3.493  18.602  -0.157
  574   3HG2  THR  71          3HG2      THR  71   1.963  18.412   0.723
  575    HA   PRO  72           HA       PRO  72  -2.163  15.719   1.213
  576   1HB   PRO  72          1HB       PRO  72  -3.006  16.250   3.727
  577   2HB   PRO  72          2HB       PRO  72  -2.274  14.690   3.271
  578   1HG   PRO  72          1HG       PRO  72  -0.929  17.042   4.616
  579   2HG   PRO  72          2HG       PRO  72  -0.814  15.330   5.073
  580   1HD   PRO  72          1HD       PRO  72   1.063  16.618   3.522
  581   2HD   PRO  72          2HD       PRO  72   0.719  14.871   3.372
  582    H    THR  73           H        THR  73  -1.567  17.577  -0.175
  583    HA   THR  73           HA       THR  73  -1.452  20.272   0.747
  584    HB   THR  73           HB       THR  73  -2.095  20.734  -1.695
  585    HG1  THR  73           HG1      THR  73  -3.146  18.685  -1.987
  586   1HG2  THR  73          1HG2      THR  73   0.289  18.900  -1.180
  587   2HG2  THR  73          2HG2      THR  73   0.092  20.038  -2.528
  588   3HG2  THR  73          3HG2      THR  73   0.252  20.650  -0.873
  589    H    GLU  74           H        GLU  74  -3.009  21.039   2.003
  590    HA   GLU  74           HA       GLU  74  -4.963  21.420   2.994
  591   1HB   GLU  74          1HB       GLU  74  -5.018  22.984   1.042
  592   2HB   GLU  74          2HB       GLU  74  -6.008  21.820   0.171
  593   1HG   GLU  74          1HG       GLU  74  -7.356  22.096   2.639
  594   2HG   GLU  74          2HG       GLU  74  -6.679  23.701   2.389
  595    H    LYS  75           H        LYS  75  -7.403  20.523   0.848
  596    HA   LYS  75           HA       LYS  75  -8.025  18.171   2.469
  597   1HB   LYS  75          1HB       LYS  75  -9.606  20.062   2.020
  598   2HB   LYS  75          2HB       LYS  75  -9.685  19.552   0.327
  599   1HG   LYS  75          1HG       LYS  75 -10.597  17.356   1.044
  600   2HG   LYS  75          2HG       LYS  75 -10.366  17.814   2.741
  601   1HD   LYS  75          1HD       LYS  75 -12.048  19.607   2.499
  602   2HD   LYS  75          2HD       LYS  75 -12.183  19.270   0.767
  603   1HE   LYS  75          1HE       LYS  75 -14.063  18.263   1.978
  604   2HE   LYS  75          2HE       LYS  75 -13.057  17.014   1.227
  605   1HZ   LYS  75          1HZ       LYS  75 -12.984  17.808   4.056
  606   2HZ   LYS  75          2HZ       LYS  75 -13.669  16.439   3.447
  607   3HZ   LYS  75          3HZ       LYS  75 -12.040  16.648   3.363
  608    H    ASP  76           H        ASP  76  -5.855  17.495   1.130
  609    HA   ASP  76           HA       ASP  76  -6.658  15.755  -1.150
  610   1HB   ASP  76          1HB       ASP  76  -4.127  16.839  -0.184
  611   2HB   ASP  76          2HB       ASP  76  -4.063  15.080  -0.191
  612    H    GLU  77           H        GLU  77  -6.940  13.585  -0.932
  613    HA   GLU  77           HA       GLU  77  -6.303  12.241   1.652
  614   1HB   GLU  77          1HB       GLU  77  -8.769  12.317   1.349
  615   2HB   GLU  77          2HB       GLU  77  -8.594  11.567  -0.248
  616   1HG   GLU  77          1HG       GLU  77  -7.598   9.547   0.822
  617   2HG   GLU  77          2HG       GLU  77  -7.754  10.314   2.410
  618    H    TYR  78           H        TYR  78  -5.111  10.387   1.351
  619    HA   TYR  78           HA       TYR  78  -4.314   9.644  -1.431
  620   1HB   TYR  78          1HB       TYR  78  -2.691   9.608   1.123
  621   2HB   TYR  78          2HB       TYR  78  -2.312   8.597  -0.259
  622    HD1  TYR  78           HD1      TYR  78  -0.551   9.391  -1.549
  623    HD2  TYR  78           HD2      TYR  78  -3.116  12.226   0.442
  624    HE1  TYR  78           HE1      TYR  78   0.804  11.273  -2.447
  625    HE2  TYR  78           HE2      TYR  78  -1.846  14.078  -0.577
  626    HH   TYR  78           HH       TYR  78   0.106  14.686  -1.649
  627    H    ALA  79           H        ALA  79  -4.245   7.462  -1.919
  628    HA   ALA  79           HA       ALA  79  -5.310   5.526   0.038
  629   1HB   ALA  79          1HB       ALA  79  -6.440   5.976  -2.766
  630   2HB   ALA  79          2HB       ALA  79  -6.976   4.748  -1.600
  631   3HB   ALA  79          3HB       ALA  79  -7.249   6.470  -1.266
  632    H    CYS  80           H        CYS  80  -5.256   3.315  -0.919
  633    HA   CYS  80           HA       CYS  80  -2.893   2.846  -2.676
  634   1HB   CYS  80          1HB       CYS  80  -3.375   1.853   0.150
  635   2HB   CYS  80          2HB       CYS  80  -2.259   1.067  -0.978
  636    H    ARG  81           H        ARG  81  -3.654   1.760  -4.327
  637    HA   ARG  81           HA       ARG  81  -5.965   0.057  -4.393
  638   1HB   ARG  81          1HB       ARG  81  -4.963   1.146  -6.376
  639   2HB   ARG  81          2HB       ARG  81  -3.473   0.243  -6.090
  640   1HG   ARG  81          1HG       ARG  81  -4.781  -1.904  -6.454
  641   2HG   ARG  81          2HG       ARG  81  -6.155  -0.894  -6.936
  642   1HD   ARG  81          1HD       ARG  81  -4.728   0.063  -8.768
  643   2HD   ARG  81          2HD       ARG  81  -3.376  -0.932  -8.178
  644    HE   ARG  81           HE       ARG  81  -5.766  -2.455  -8.796
  645   1HH1  ARG  81          1HH2      ARG  81  -2.787  -1.125 -10.239
  646   2HH1  ARG  81          2HH2      ARG  81  -2.613  -2.471 -11.348
  647   1HH2  ARG  81          1HH1      ARG  81  -5.638  -4.045 -10.413
  648   2HH2  ARG  81          2HH1      ARG  81  -4.250  -4.105 -11.470
  649    H    VAL  82           H        VAL  82  -6.061  -2.296  -4.062
  650    HA   VAL  82           HA       VAL  82  -3.469  -3.670  -3.656
  651    HB   VAL  82           HB       VAL  82  -5.959  -4.225  -1.998
  652   1HG1  VAL  82          1HG1      VAL  82  -4.406  -6.104  -2.391
  653   2HG1  VAL  82          2HG1      VAL  82  -3.055  -5.105  -1.804
  654   3HG1  VAL  82          3HG1      VAL  82  -4.370  -5.568  -0.699
  655   1HG2  VAL  82          1HG2      VAL  82  -5.069  -1.998  -1.321
  656   2HG2  VAL  82          2HG2      VAL  82  -4.781  -3.226  -0.097
  657   3HG2  VAL  82          3HG2      VAL  82  -3.447  -2.710  -1.152
  658    H    ASN  83           H        ASN  83  -3.358  -4.803  -5.503
  659    HA   ASN  83           HA       ASN  83  -5.683  -6.531  -6.237
  660   1HB   ASN  83          1HB       ASN  83  -5.518  -4.443  -7.638
  661   2HB   ASN  83          2HB       ASN  83  -3.964  -5.016  -8.218
  662   1HD2  ASN  83          2HD2      ASN  83  -4.002  -7.371  -9.131
  663   2HD2  ASN  83          1HD2      ASN  83  -5.406  -7.802 -10.089
  664    H    HIS  84           H        HIS  84  -4.451  -8.147  -5.005
  665    HA   HIS  84           HA       HIS  84  -1.831  -9.113  -5.933
  666   1HB   HIS  84          1HB       HIS  84  -2.628  -9.464  -3.639
  667   2HB   HIS  84          2HB       HIS  84  -4.038 -10.318  -4.256
  668    HD2  HIS  84           HD2      HIS  84  -0.093 -10.870  -4.421
  669    HE1  HIS  84           HE1      HIS  84  -2.140 -14.582  -4.431
  670    HE2  HIS  84           HE2      HIS  84   0.190 -13.461  -4.419
  671    H    VAL  85           H        VAL  85  -1.722 -11.099  -7.292
  672    HA   VAL  85           HA       VAL  85  -3.411 -11.185  -9.472
  673    HB   VAL  85           HB       VAL  85  -1.205 -12.126  -9.453
  674   1HG1  VAL  85          1HG1      VAL  85  -2.298 -14.450  -7.808
  675   2HG1  VAL  85          2HG1      VAL  85  -0.692 -14.347  -8.546
  676   3HG1  VAL  85          3HG1      VAL  85  -1.132 -13.226  -7.253
  677   1HG2  VAL  85          1HG2      VAL  85  -3.226 -14.244 -10.237
  678   2HG2  VAL  85          2HG2      VAL  85  -2.769 -12.821 -11.203
  679   3HG2  VAL  85          3HG2      VAL  85  -1.567 -14.068 -10.837
  680    H    THR  86           H        THR  86  -3.865 -12.941  -6.396
  681    HA   THR  86           HA       THR  86  -6.045 -14.508  -7.509
  682    HB   THR  86           HB       THR  86  -4.339 -15.105  -5.593
  683    HG1  THR  86           HG1      THR  86  -5.854 -16.443  -6.590
  684   1HG2  THR  86          1HG2      THR  86  -6.805 -14.352  -3.985
  685   2HG2  THR  86          2HG2      THR  86  -5.264 -15.014  -3.405
  686   3HG2  THR  86          3HG2      THR  86  -5.339 -13.347  -4.011
  687    H    LEU  87           H        LEU  87  -5.824 -11.314  -6.063
  688    HA   LEU  87           HA       LEU  87  -8.660 -11.133  -5.394
  689   1HB   LEU  87          1HB       LEU  87  -6.342  -9.232  -5.627
  690   2HB   LEU  87          2HB       LEU  87  -7.952  -8.599  -5.893
  691    HG   LEU  87           HG       LEU  87  -8.729  -9.337  -3.736
  692   1HD1  LEU  87          1HD1      LEU  87  -7.294 -11.370  -3.436
  693   2HD1  LEU  87          2HD1      LEU  87  -5.895 -10.308  -3.193
  694   3HD1  LEU  87          3HD1      LEU  87  -7.247 -10.272  -2.052
  695   1HD2  LEU  87          1HD2      LEU  87  -7.686  -7.126  -3.972
  696   2HD2  LEU  87          2HD2      LEU  87  -7.335  -7.794  -2.367
  697   3HD2  LEU  87          3HD2      LEU  87  -6.086  -7.810  -3.628
  698    H    SER  88           H        SER  88 -10.176 -11.336  -6.878
  699    HA   SER  88           HA       SER  88  -9.752 -11.032  -9.711
  700   1HB   SER  88          1HB       SER  88 -11.352 -12.623  -8.621
  701   2HB   SER  88          2HB       SER  88 -12.348 -11.235  -8.135
  702    HG   SER  88           HG       SER  88 -12.383 -10.715 -10.442
  703    H    GLN  89           H        GLN  89 -10.000  -8.615  -7.340
  704    HA   GLN  89           HA       GLN  89 -10.883  -6.633  -9.293
  705   1HB   GLN  89          1HB       GLN  89 -12.480  -5.655  -7.722
  706   2HB   GLN  89          2HB       GLN  89 -12.965  -7.286  -8.208
  707   1HG   GLN  89          1HG       GLN  89 -12.098  -8.177  -6.060
  708   2HG   GLN  89          2HG       GLN  89 -11.589  -6.544  -5.583
  709   1HE2  GLN  89          2HE2      GLN  89 -13.074  -7.463  -3.717
  710   2HE2  GLN  89          1HE2      GLN  89 -14.737  -6.921  -3.814
  711    HA   PRO  90           HA       PRO  90  -7.694  -4.459  -7.012
  712   1HB   PRO  90          1HB       PRO  90  -8.039  -1.900  -7.883
  713   2HB   PRO  90          2HB       PRO  90  -7.538  -3.214  -8.988
  714   1HG   PRO  90          1HG       PRO  90 -10.341  -2.142  -8.617
  715   2HG   PRO  90          2HG       PRO  90  -9.442  -2.380 -10.139
  716   1HD   PRO  90          1HD       PRO  90 -11.181  -4.252  -9.163
  717   2HD   PRO  90          2HD       PRO  90  -9.690  -4.719 -10.033
  718    H    LYS  91           H        LYS  91  -8.299  -4.733  -4.864
  719    HA   LYS  91           HA       LYS  91 -10.655  -3.414  -3.746
  720   1HB   LYS  91          1HB       LYS  91  -9.771  -5.745  -3.183
  721   2HB   LYS  91          2HB       LYS  91  -8.485  -4.957  -2.273
  722   1HG   LYS  91          1HG       LYS  91 -11.494  -4.817  -1.786
  723   2HG   LYS  91          2HG       LYS  91 -10.274  -5.630  -0.795
  724   1HD   LYS  91          1HD       LYS  91  -9.222  -3.364  -0.357
  725   2HD   LYS  91          2HD       LYS  91 -10.622  -2.638  -1.192
  726   1HE   LYS  91          1HE       LYS  91 -12.147  -3.712   0.431
  727   2HE   LYS  91          2HE       LYS  91 -10.740  -4.313   1.333
  728   1HZ   LYS  91          1HZ       LYS  91 -10.066  -2.070   1.685
  729   2HZ   LYS  91          2HZ       LYS  91 -11.284  -1.482   0.753
  730   3HZ   LYS  91          3HZ       LYS  91 -11.629  -2.230   2.185
  731    H    ILE  92           H        ILE  92 -10.371  -1.166  -3.667
  732    HA   ILE  92           HA       ILE  92  -7.774  -0.033  -3.103
  733    HB   ILE  92           HB       ILE  92 -10.400   1.462  -3.182
  734   1HG1  ILE  92          1HG1      ILE  92 -10.453   0.215  -5.230
  735   2HG1  ILE  92          2HG1      ILE  92 -10.002   1.876  -5.582
  736   1HG2  ILE  92          1HG2      ILE  92  -7.495   2.211  -3.743
  737   2HG2  ILE  92          2HG2      ILE  92  -8.887   3.275  -4.032
  738   3HG2  ILE  92          3HG2      ILE  92  -8.500   2.751  -2.388
  739   1HD1  ILE  92          1HD1      ILE  92  -7.616   1.194  -5.794
  740   2HD1  ILE  92          2HD1      ILE  92  -8.083  -0.492  -5.461
  741   3HD1  ILE  92          3HD1      ILE  92  -8.676   0.325  -6.913
  742    H    VAL  93           H        VAL  93  -7.061   0.963  -1.274
  743    HA   VAL  93           HA       VAL  93  -8.741   0.865   1.201
  744    HB   VAL  93           HB       VAL  93  -5.773   0.241   0.855
  745   1HG1  VAL  93          1HG1      VAL  93  -6.104   1.443   2.961
  746   2HG1  VAL  93          2HG1      VAL  93  -7.504   0.426   3.361
  747   3HG1  VAL  93          3HG1      VAL  93  -5.873  -0.273   3.306
  748   1HG2  VAL  93          1HG2      VAL  93  -7.234  -1.642   0.176
  749   2HG2  VAL  93          2HG2      VAL  93  -6.388  -1.979   1.687
  750   3HG2  VAL  93          3HG2      VAL  93  -8.100  -1.523   1.726
  751    H    LYS  94           H        LYS  94  -9.326   3.022   1.298
  752    HA   LYS  94           HA       LYS  94  -7.470   5.160   0.733
  753   1HB   LYS  94          1HB       LYS  94  -9.094   6.638   1.491
  754   2HB   LYS  94          2HB       LYS  94  -9.985   5.351   0.666
  755   1HG   LYS  94          1HG       LYS  94 -10.448   4.336   2.958
  756   2HG   LYS  94          2HG       LYS  94  -9.631   5.745   3.667
  757   1HD   LYS  94          1HD       LYS  94 -11.294   7.219   2.402
  758   2HD   LYS  94          2HD       LYS  94 -12.170   5.733   2.000
  759   1HE   LYS  94          1HE       LYS  94 -13.195   6.717   3.961
  760   2HE   LYS  94          2HE       LYS  94 -12.358   5.241   4.472
  761   1HZ   LYS  94          1HZ       LYS  94 -10.567   6.603   5.264
  762   2HZ   LYS  94          2HZ       LYS  94 -11.292   7.975   4.712
  763   3HZ   LYS  94          3HZ       LYS  94 -11.978   7.110   5.939
  764    H    TRP  95           H        TRP  95  -6.104   6.249   2.145
  765    HA   TRP  95           HA       TRP  95  -5.498   4.891   4.707
  766   1HB   TRP  95          1HB       TRP  95  -3.550   5.373   3.531
  767   2HB   TRP  95          2HB       TRP  95  -4.155   6.895   2.944
  768    HD1  TRP  95           HD1      TRP  95  -3.018   5.509   6.394
  769    HE1  TRP  95           HE1      TRP  95  -2.013   7.494   7.723
  770    HE3  TRP  95           HE3      TRP  95  -3.635   9.175   2.963
  771    HZ2  TRP  95           HZ2      TRP  95  -2.027  10.420   7.501
  772    HZ3  TRP  95           HZ3      TRP  95  -2.999  11.537   3.482
  773    HH2  TRP  95           HH2      TRP  95  -2.423  12.151   5.804
  774    H    ASP  96           H        ASP  96  -6.514   5.497   6.516
  775    HA   ASP  96           HA       ASP  96  -7.843   8.112   6.796
  776   1HB   ASP  96          1HB       ASP  96  -8.579   7.236   8.939
  777   2HB   ASP  96          2HB       ASP  96  -8.940   6.070   7.662
  778    H    ARG  97           H        ARG  97  -7.305   9.402   8.753
  779    HA   ARG  97           HA       ARG  97  -4.673  10.304   8.659
  780   1HB   ARG  97          1HB       ARG  97  -6.840  10.634  10.768
  781   2HB   ARG  97          2HB       ARG  97  -5.320  11.523  10.828
  782   1HG   ARG  97          1HG       ARG  97  -7.129  11.608   8.375
  783   2HG   ARG  97          2HG       ARG  97  -7.428  12.636   9.778
  784   1HD   ARG  97          1HD       ARG  97  -4.816  12.602   8.224
  785   2HD   ARG  97          2HD       ARG  97  -6.132  13.740   7.965
  786    HE   ARG  97           HE       ARG  97  -4.521  13.442  10.485
  787   1HH1  ARG  97          1HH2      ARG  97  -6.262  15.652   8.277
  788   2HH1  ARG  97          2HH2      ARG  97  -5.960  17.036   9.289
  789   1HH2  ARG  97          1HH1      ARG  97  -4.165  15.256  11.746
  790   2HH2  ARG  97          2HH1      ARG  97  -4.791  16.815  11.268
  791    H    ASP  98           H        ASP  98  -5.867   9.193  11.786
  792    HA   ASP  98           HA       ASP  98  -3.877   7.204  12.326
  793   1HB   ASP  98          1HB       ASP  98  -2.429   9.211  12.257
  794   2HB   ASP  98          2HB       ASP  98  -3.468  10.028  13.428
  795    H    MET  99           H        MET  99  -6.279   6.580  12.682
  796    HA   MET  99           HA       MET  99  -6.982   6.890  15.511
  797   1HB   MET  99          1HB       MET  99  -7.936   8.926  14.437
  798   2HB   MET  99          2HB       MET  99  -8.780   7.909  13.262
  799   1HG   MET  99          1HG       MET  99 -10.316   8.608  14.969
  800   2HG   MET  99          2HG       MET  99 -10.067   6.871  15.136
  801   1HE   MET  99          1HE       MET  99 -11.257   6.960  17.498
  802   2HE   MET  99          2HE       MET  99 -10.787   8.080  18.797
  803   3HE   MET  99          3HE       MET  99 -11.497   8.713  17.295
  Start of MODEL   18
    1   1H    MET   0          1H        MET   0 -10.758 -20.780   0.738
    2   2H    MET   0          2H        MET   0  -9.319 -20.952   1.519
    3   3H    MET   0          3H        MET   0  -9.377 -20.186   0.061
    4    HA   MET   0           HA       MET   0  -9.999 -23.003   0.547
    5   1HB   MET   0          1HB       MET   0  -9.858 -21.429  -2.060
    6   2HB   MET   0          2HB       MET   0  -9.961 -23.197  -1.940
    7   1HG   MET   0          1HG       MET   0 -12.106 -22.994  -0.734
    8   2HG   MET   0          2HG       MET   0 -12.020 -21.230  -0.852
    9   1HE   MET   0          1HE       MET   0 -14.486 -21.241  -1.806
   10   2HE   MET   0          2HE       MET   0 -14.981 -22.208  -3.214
   11   3HE   MET   0          3HE       MET   0 -14.500 -23.018  -1.706
   12    H    ILE   1           H        ILE   1  -7.822 -21.282  -1.725
   13    HA   ILE   1           HA       ILE   1  -5.485 -22.156  -0.187
   14    HB   ILE   1           HB       ILE   1  -5.903 -23.898  -1.872
   15   1HG1  ILE   1          1HG1      ILE   1  -3.754 -24.147  -2.805
   16   2HG1  ILE   1          2HG1      ILE   1  -3.369 -22.436  -2.697
   17   1HG2  ILE   1          1HG2      ILE   1  -5.442 -21.696  -3.919
   18   2HG2  ILE   1          2HG2      ILE   1  -5.629 -23.430  -4.252
   19   3HG2  ILE   1          3HG2      ILE   1  -6.989 -22.507  -3.590
   20   1HD1  ILE   1          1HD1      ILE   1  -3.871 -24.243  -0.288
   21   2HD1  ILE   1          2HD1      ILE   1  -2.270 -23.865  -0.959
   22   3HD1  ILE   1          3HD1      ILE   1  -3.250 -22.571  -0.256
   23    H    GLN   2           H        GLN   2  -7.018 -19.666  -0.596
   24    HA   GLN   2           HA       GLN   2  -5.250 -17.943  -2.211
   25   1HB   GLN   2          1HB       GLN   2  -7.802 -17.352  -0.655
   26   2HB   GLN   2          2HB       GLN   2  -6.889 -16.224  -1.669
   27   1HG   GLN   2          1HG       GLN   2  -7.217 -17.941  -3.577
   28   2HG   GLN   2          2HG       GLN   2  -8.434 -18.698  -2.547
   29   1HE2  GLN   2          2HE2      GLN   2  -8.882 -17.461  -5.146
   30   2HE2  GLN   2          1HE2      GLN   2  -9.963 -16.107  -4.893
   31    H    ARG   3           H        ARG   3  -3.308 -17.521  -1.129
   32    HA   ARG   3           HA       ARG   3  -3.284 -16.867   1.735
   33   1HB   ARG   3          1HB       ARG   3  -1.309 -17.007  -0.516
   34   2HB   ARG   3          2HB       ARG   3  -0.906 -16.027   0.879
   35   1HG   ARG   3          1HG       ARG   3  -1.826 -18.819   1.460
   36   2HG   ARG   3          2HG       ARG   3  -0.217 -18.582   0.767
   37   1HD   ARG   3          1HD       ARG   3  -0.002 -18.593   3.181
   38   2HD   ARG   3          2HD       ARG   3   0.428 -17.032   2.516
   39    HE   ARG   3           HE       ARG   3  -1.351 -16.022   3.551
   40   1HH1  ARG   3          1HH2      ARG   3  -1.707 -19.546   3.820
   41   2HH1  ARG   3          2HH2      ARG   3  -2.975 -19.467   5.013
   42   1HH2  ARG   3          1HH1      ARG   3  -3.070 -15.931   5.098
   43   2HH2  ARG   3          2HH1      ARG   3  -3.766 -17.405   5.722
   44    H    THR   4           H        THR   4  -4.335 -15.067   2.269
   45    HA   THR   4           HA       THR   4  -5.088 -13.122   0.345
   46    HB   THR   4           HB       THR   4  -5.423 -13.105   3.372
   47    HG1  THR   4           HG1      THR   4  -7.378 -14.171   2.865
   48   1HG2  THR   4          1HG2      THR   4  -7.116 -11.829   1.175
   49   2HG2  THR   4          2HG2      THR   4  -7.487 -11.838   2.907
   50   3HG2  THR   4          3HG2      THR   4  -6.073 -10.949   2.322
   51    HA   PRO   5           HA       PRO   5  -1.730 -10.175   1.265
   52   1HB   PRO   5          1HB       PRO   5  -2.726  -7.920   0.072
   53   2HB   PRO   5          2HB       PRO   5  -2.076  -9.307  -0.849
   54   1HG   PRO   5          1HG       PRO   5  -4.971  -8.715  -0.188
   55   2HG   PRO   5          2HG       PRO   5  -4.269  -9.123  -1.779
   56   1HD   PRO   5          1HD       PRO   5  -5.448 -10.997  -0.209
   57   2HD   PRO   5          2HD       PRO   5  -3.990 -11.402  -1.163
   58    H    LYS   6           H        LYS   6  -1.678  -9.868   3.442
   59    HA   LYS   6           HA       LYS   6  -3.759  -8.426   4.904
   60   1HB   LYS   6          1HB       LYS   6  -2.322 -10.278   5.866
   61   2HB   LYS   6          2HB       LYS   6  -0.951  -9.155   5.810
   62   1HG   LYS   6          1HG       LYS   6  -2.501  -7.504   7.080
   63   2HG   LYS   6          2HG       LYS   6  -3.543  -8.898   7.380
   64   1HD   LYS   6          1HD       LYS   6  -0.598  -8.645   8.170
   65   2HD   LYS   6          2HD       LYS   6  -1.981  -8.411   9.251
   66   1HE   LYS   6          1HE       LYS   6  -2.696 -10.781   8.794
   67   2HE   LYS   6          2HE       LYS   6  -1.219 -11.009   7.836
   68   1HZ   LYS   6          1HZ       LYS   6   0.049 -10.495   9.795
   69   2HZ   LYS   6          2HZ       LYS   6  -1.328 -10.322  10.686
   70   3HZ   LYS   6          3HZ       LYS   6  -0.939 -11.791  10.046
   71    H    ILE   7           H        ILE   7  -3.916  -6.419   3.989
   72    HA   ILE   7           HA       ILE   7  -1.604  -4.736   3.450
   73    HB   ILE   7           HB       ILE   7  -3.141  -3.149   2.617
   74   1HG1  ILE   7          1HG1      ILE   7  -5.017  -3.179   4.138
   75   2HG1  ILE   7          2HG1      ILE   7  -5.511  -3.378   2.473
   76   1HG2  ILE   7          1HG2      ILE   7  -3.668  -5.992   1.698
   77   2HG2  ILE   7          2HG2      ILE   7  -4.328  -4.573   0.891
   78   3HG2  ILE   7          3HG2      ILE   7  -2.580  -4.764   1.026
   79   1HD1  ILE   7          1HD1      ILE   7  -5.763  -5.867   2.884
   80   2HD1  ILE   7          2HD1      ILE   7  -5.513  -5.522   4.619
   81   3HD1  ILE   7          3HD1      ILE   7  -6.879  -4.811   3.763
   82    H    GLN   8           H        GLN   8  -0.753  -3.136   4.829
   83    HA   GLN   8           HA       GLN   8  -2.591  -1.894   6.765
   84   1HB   GLN   8          1HB       GLN   8  -0.508  -1.745   8.209
   85   2HB   GLN   8          2HB       GLN   8  -1.482  -3.212   8.273
   86   1HG   GLN   8          1HG       GLN   8   1.035  -2.956   6.607
   87   2HG   GLN   8          2HG       GLN   8   1.069  -3.478   8.290
   88   1HE2  GLN   8          2HE2      GLN   8   1.766  -4.872   5.673
   89   2HE2  GLN   8          1HE2      GLN   8   0.833  -6.357   5.714
   90    H    VAL   9           H        VAL   9  -2.868  -0.014   5.795
   91    HA   VAL   9           HA       VAL   9  -0.645   1.407   4.456
   92    HB   VAL   9           HB       VAL   9  -3.615   2.041   4.521
   93   1HG1  VAL   9          1HG1      VAL   9  -1.343   3.049   2.764
   94   2HG1  VAL   9          2HG1      VAL   9  -3.060   3.455   2.566
   95   3HG1  VAL   9          3HG1      VAL   9  -2.187   3.993   4.005
   96   1HG2  VAL   9          1HG2      VAL   9  -1.964   0.601   2.390
   97   2HG2  VAL   9          2HG2      VAL   9  -3.239  -0.137   3.382
   98   3HG2  VAL   9          3HG2      VAL   9  -3.652   1.124   2.215
   99    H    TYR  10           H        TYR  10   0.543   2.059   6.274
  100    HA   TYR  10           HA       TYR  10  -0.877   3.755   8.291
  101   1HB   TYR  10          1HB       TYR  10   1.055   3.279   9.740
  102   2HB   TYR  10          2HB       TYR  10   0.067   1.894   9.313
  103    HD1  TYR  10           HD1      TYR  10   0.981  -0.007   8.217
  104    HD2  TYR  10           HD2      TYR  10   3.349   3.564   8.638
  105    HE1  TYR  10           HE1      TYR  10   3.009  -1.279   7.623
  106    HE2  TYR  10           HE2      TYR  10   5.361   2.298   7.959
  107    HH   TYR  10           HH       TYR  10   5.256  -1.164   7.081
  108    H    SER  11           H        SER  11   0.186   5.556   9.162
  109    HA   SER  11           HA       SER  11   1.704   7.176   7.213
  110   1HB   SER  11          1HB       SER  11  -0.356   8.074   8.304
  111   2HB   SER  11          2HB       SER  11   0.457   7.968   9.871
  112    HG   SER  11           HG       SER  11   1.395   9.417   7.615
  113    H    ARG  12           H        ARG  12   3.323   8.679   8.481
  114    HA   ARG  12           HA       ARG  12   5.032   7.123  10.404
  115   1HB   ARG  12          1HB       ARG  12   5.641   8.483   7.840
  116   2HB   ARG  12          2HB       ARG  12   6.703   8.954   9.163
  117   1HG   ARG  12          1HG       ARG  12   7.699   7.152   7.958
  118   2HG   ARG  12          2HG       ARG  12   7.320   6.651   9.612
  119   1HD   ARG  12          1HD       ARG  12   5.380   5.360   8.814
  120   2HD   ARG  12          2HD       ARG  12   5.569   6.034   7.194
  121    HE   ARG  12           HE       ARG  12   7.247   4.558   6.733
  122   1HH1  ARG  12          1HH2      ARG  12   6.731   4.476  10.245
  123   2HH1  ARG  12          2HH2      ARG  12   7.680   3.028  10.463
  124   1HH2  ARG  12          1HH1      ARG  12   8.351   2.627   7.008
  125   2HH2  ARG  12          2HH1      ARG  12   8.658   1.990   8.605
  126    H    HIS  13           H        HIS  13   4.666  10.450   9.120
  127    HA   HIS  13           HA       HIS  13   5.207  11.564  11.797
  128   1HB   HIS  13          1HB       HIS  13   4.964  12.939   9.092
  129   2HB   HIS  13          2HB       HIS  13   5.702  13.591  10.549
  130    HD2  HIS  13           HD2      HIS  13   6.860  12.086   7.378
  131    HE1  HIS  13           HE1      HIS  13   9.762  10.886  10.202
  132    HE2  HIS  13           HE2      HIS  13   9.246  11.073   7.708
  133    HA   PRO  14           HA       PRO  14   0.934  12.723  12.331
  134   1HB   PRO  14          1HB       PRO  14   0.976  15.267  13.365
  135   2HB   PRO  14          2HB       PRO  14   1.452  13.816  14.292
  136   1HG   PRO  14          1HG       PRO  14   3.258  15.764  12.850
  137   2HG   PRO  14          2HG       PRO  14   3.442  15.110  14.502
  138   1HD   PRO  14          1HD       PRO  14   4.785  14.103  12.379
  139   2HD   PRO  14          2HD       PRO  14   4.211  13.011  13.653
  140    H    ALA  15           H        ALA  15  -0.411  13.165  10.662
  141    HA   ALA  15           HA       ALA  15   0.467  14.292   8.268
  142   1HB   ALA  15          1HB       ALA  15  -2.378  13.878   9.268
  143   2HB   ALA  15          2HB       ALA  15  -1.900  14.128   7.571
  144   3HB   ALA  15          3HB       ALA  15  -1.367  12.680   8.447
  145    H    GLU  16           H        GLU  16   0.765  16.293   7.609
  146    HA   GLU  16           HA       GLU  16  -0.276  18.581   9.200
  147   1HB   GLU  16          1HB       GLU  16   2.084  19.413   9.180
  148   2HB   GLU  16          2HB       GLU  16   1.788  17.977  10.167
  149   1HG   GLU  16          1HG       GLU  16   2.709  16.534   8.307
  150   2HG   GLU  16          2HG       GLU  16   3.108  18.008   7.431
  151    H    ASN  17           H        ASN  17  -0.880  20.280   8.087
  152    HA   ASN  17           HA       ASN  17  -1.695  20.051   5.513
  153   1HB   ASN  17          1HB       ASN  17  -2.610  21.625   7.153
  154   2HB   ASN  17          2HB       ASN  17  -1.154  22.619   7.030
  155   1HD2  ASN  17          2HD2      ASN  17  -3.855  21.258   5.053
  156   2HD2  ASN  17          1HD2      ASN  17  -3.923  22.603   3.935
  157    H    GLY  18           H        GLY  18  -0.378  19.650   3.794
  158   1HA   GLY  18          1HA       GLY  18   0.812  20.164   1.969
  159   2HA   GLY  18          2HA       GLY  18   0.787  21.856   2.483
  160    H    LYS  19           H        LYS  19   2.198  19.091   4.274
  161    HA   LYS  19           HA       LYS  19   4.926  19.777   3.426
  162   1HB   LYS  19          1HB       LYS  19   4.500  21.145   5.412
  163   2HB   LYS  19          2HB       LYS  19   4.038  19.684   6.294
  164   1HG   LYS  19          1HG       LYS  19   6.842  20.226   5.221
  165   2HG   LYS  19          2HG       LYS  19   6.279  20.568   6.864
  166   1HD   LYS  19          1HD       LYS  19   5.532  17.980   6.740
  167   2HD   LYS  19          2HD       LYS  19   6.899  17.933   5.605
  168   1HE   LYS  19          1HE       LYS  19   8.421  18.687   7.299
  169   2HE   LYS  19          2HE       LYS  19   7.093  18.967   8.448
  170   1HZ   LYS  19          1HZ       LYS  19   7.664  16.341   7.279
  171   2HZ   LYS  19          2HZ       LYS  19   8.241  16.842   8.748
  172   3HZ   LYS  19          3HZ       LYS  19   6.617  16.701   8.497
  173    H    SER  20           H        SER  20   5.889  18.063   3.067
  174    HA   SER  20           HA       SER  20   4.894  15.677   2.662
  175   1HB   SER  20          1HB       SER  20   7.187  14.658   2.701
  176   2HB   SER  20          2HB       SER  20   6.841  16.045   1.668
  177    HG   SER  20           HG       SER  20   8.835  16.228   2.829
  178    H    ASN  21           H        ASN  21   4.144  14.084   3.816
  179    HA   ASN  21           HA       ASN  21   4.944  13.380   6.589
  180   1HB   ASN  21          1HB       ASN  21   2.557  13.852   6.028
  181   2HB   ASN  21          2HB       ASN  21   2.560  12.489   4.928
  182   1HD2  ASN  21          2HD2      ASN  21   0.648  12.375   6.750
  183   2HD2  ASN  21          1HD2      ASN  21   1.048  11.308   8.088
  184    H    PHE  22           H        PHE  22   4.022  10.512   5.945
  185    HA   PHE  22           HA       PHE  22   5.545   9.681   3.647
  186   1HB   PHE  22          1HB       PHE  22   6.818   9.558   6.224
  187   2HB   PHE  22          2HB       PHE  22   6.451   7.910   5.711
  188    HD1  PHE  22           HD1      PHE  22   7.209   7.114   3.424
  189    HD2  PHE  22           HD2      PHE  22   8.606  10.782   5.204
  190    HE1  PHE  22           HE1      PHE  22   9.166   7.108   1.902
  191    HE2  PHE  22           HE2      PHE  22  10.574  10.760   3.700
  192    HZ   PHE  22           HZ       PHE  22  10.848   8.937   2.033
  193    H    LEU  23           H        LEU  23   4.244   8.386   2.657
  194    HA   LEU  23           HA       LEU  23   2.080   6.912   4.055
  195   1HB   LEU  23          1HB       LEU  23   1.493   8.256   2.106
  196   2HB   LEU  23          2HB       LEU  23   2.693   7.446   1.150
  197    HG   LEU  23           HG       LEU  23   1.430   5.366   1.248
  198   1HD1  LEU  23          1HD1      LEU  23  -0.473   6.903   3.064
  199   2HD1  LEU  23          2HD1      LEU  23  -0.896   5.402   2.234
  200   3HD1  LEU  23          3HD1      LEU  23   0.403   5.407   3.439
  201   1HD2  LEU  23          1HD2      LEU  23   0.890   7.093  -0.480
  202   2HD2  LEU  23          2HD2      LEU  23  -0.543   6.141  -0.048
  203   3HD2  LEU  23          3HD2      LEU  23  -0.338   7.781   0.596
  204    H    ASN  24           H        ASN  24   2.417   4.805   4.526
  205    HA   ASN  24           HA       ASN  24   4.370   3.210   2.897
  206   1HB   ASN  24          1HB       ASN  24   3.999   3.426   5.877
  207   2HB   ASN  24          2HB       ASN  24   4.544   1.919   5.111
  208   1HD2  ASN  24          2HD2      ASN  24   5.423   5.373   4.377
  209   2HD2  ASN  24          1HD2      ASN  24   7.137   5.106   4.579
  210    H    CYS  25           H        CYS  25   2.801   2.361   1.576
  211    HA   CYS  25           HA       CYS  25   0.611   0.772   2.767
  212   1HB   CYS  25          1HB       CYS  25   1.540   0.639  -0.106
  213   2HB   CYS  25          2HB       CYS  25   0.031   0.095   0.608
  214    H    TYR  26           H        TYR  26   1.533  -0.865   3.997
  215    HA   TYR  26           HA       TYR  26   3.701  -2.517   2.767
  216   1HB   TYR  26          1HB       TYR  26   4.208  -1.618   4.972
  217   2HB   TYR  26          2HB       TYR  26   2.681  -2.170   5.578
  218    HD1  TYR  26           HD1      TYR  26   3.491  -3.505   7.404
  219    HD2  TYR  26           HD2      TYR  26   5.012  -4.215   3.431
  220    HE1  TYR  26           HE1      TYR  26   4.231  -5.753   8.090
  221    HE2  TYR  26           HE2      TYR  26   5.722  -6.464   4.107
  222    HH   TYR  26           HH       TYR  26   5.358  -7.681   7.458
  223    H    VAL  27           H        VAL  27   3.142  -4.597   2.105
  224    HA   VAL  27           HA       VAL  27   0.475  -5.635   2.941
  225    HB   VAL  27           HB       VAL  27   1.687  -5.947   0.147
  226   1HG1  VAL  27          1HG1      VAL  27  -1.115  -6.475   1.238
  227   2HG1  VAL  27          2HG1      VAL  27  -0.527  -6.824  -0.407
  228   3HG1  VAL  27          3HG1      VAL  27   0.093  -7.725   0.984
  229   1HG2  VAL  27          1HG2      VAL  27   1.133  -3.645   0.290
  230   2HG2  VAL  27          2HG2      VAL  27  -0.191  -4.462  -0.571
  231   3HG2  VAL  27          3HG2      VAL  27  -0.392  -4.000   1.142
  232    H    SER  28           H        SER  28   0.592  -7.891   3.518
  233    HA   SER  28           HA       SER  28   2.801  -9.383   2.480
  234   1HB   SER  28          1HB       SER  28   4.305  -8.921   4.182
  235   2HB   SER  28          2HB       SER  28   3.138  -8.089   5.104
  236    HG   SER  28           HG       SER  28   3.945  -9.898   6.185
  237    H    GLY  29           H        GLY  29   2.938 -11.658   3.317
  238   1HA   GLY  29          1HA       GLY  29   2.022 -13.569   4.177
  239   2HA   GLY  29          2HA       GLY  29   0.564 -12.696   4.662
  240    H    PHE  30           H        PHE  30   1.148 -11.983   1.413
  241    HA   PHE  30           HA       PHE  30  -0.779 -13.967   0.451
  242   1HB   PHE  30          1HB       PHE  30  -0.912 -12.625  -1.513
  243   2HB   PHE  30          2HB       PHE  30  -1.167 -11.705  -0.080
  244    HD1  PHE  30           HD1      PHE  30   0.414  -9.883   0.620
  245    HD2  PHE  30           HD2      PHE  30   1.057 -12.233  -2.950
  246    HE1  PHE  30           HE1      PHE  30   2.110  -8.274  -0.165
  247    HE2  PHE  30           HE2      PHE  30   2.597 -10.518  -3.798
  248    HZ   PHE  30           HZ       PHE  30   3.071  -8.526  -2.449
  249    H    HIS  31           H        HIS  31  -0.241 -15.102  -1.707
  250    HA   HIS  31           HA       HIS  31   2.624 -15.117  -2.507
  251   1HB   HIS  31          1HB       HIS  31   2.972 -17.343  -2.404
  252   2HB   HIS  31          2HB       HIS  31   1.995 -17.167  -0.955
  253    HD2  HIS  31           HD2      HIS  31   1.683 -18.391  -4.672
  254    HE1  HIS  31           HE1      HIS  31  -1.425 -20.189  -2.427
  255    HE2  HIS  31           HE2      HIS  31  -0.304 -20.127  -4.721
  256    HA   PRO  32           HA       PRO  32   3.621 -16.073  -4.328
  257   1HB   PRO  32          1HB       PRO  32   4.326 -16.060  -6.910
  258   2HB   PRO  32          2HB       PRO  32   3.215 -17.292  -6.301
  259   1HG   PRO  32          1HG       PRO  32   2.407 -14.719  -7.699
  260   2HG   PRO  32          2HG       PRO  32   1.931 -16.387  -8.118
  261   1HD   PRO  32          1HD       PRO  32   0.428 -14.733  -6.477
  262   2HD   PRO  32          2HD       PRO  32   0.437 -16.511  -6.322
  263    H    SER  33           H        SER  33   4.426 -14.185  -6.942
  264    HA   SER  33           HA       SER  33   5.224 -11.956  -5.220
  265   1HB   SER  33          1HB       SER  33   6.911 -11.636  -6.835
  266   2HB   SER  33          2HB       SER  33   6.792 -13.373  -6.504
  267    HG   SER  33           HG       SER  33   5.721 -12.011  -8.745
  268    H    ASP  34           H        ASP  34   2.504 -12.505  -7.055
  269    HA   ASP  34           HA       ASP  34   2.815 -10.321  -9.001
  270   1HB   ASP  34          1HB       ASP  34   2.568 -12.615  -9.752
  271   2HB   ASP  34          2HB       ASP  34   1.035 -12.779  -8.886
  272    H    ILE  35           H        ILE  35   2.221  -8.605  -7.563
  273    HA   ILE  35           HA       ILE  35  -0.720  -8.168  -7.433
  274    HB   ILE  35           HB       ILE  35   0.043  -8.863  -5.337
  275   1HG1  ILE  35          1HG1      ILE  35  -0.289  -5.873  -5.088
  276   2HG1  ILE  35          2HG1      ILE  35  -1.614  -7.002  -5.319
  277   1HG2  ILE  35          1HG2      ILE  35   2.190  -6.809  -5.651
  278   2HG2  ILE  35          2HG2      ILE  35   1.770  -7.502  -4.072
  279   3HG2  ILE  35          3HG2      ILE  35   2.340  -8.564  -5.354
  280   1HD1  ILE  35          1HD1      ILE  35  -0.616  -8.241  -3.222
  281   2HD1  ILE  35          2HD1      ILE  35   0.187  -6.691  -2.908
  282   3HD1  ILE  35          3HD1      ILE  35  -1.574  -6.762  -3.000
  283    H    GLU  36           H        GLU  36  -1.357  -5.926  -7.322
  284    HA   GLU  36           HA       GLU  36   0.527  -3.929  -8.498
  285   1HB   GLU  36          1HB       GLU  36  -2.481  -3.782  -8.700
  286   2HB   GLU  36          2HB       GLU  36  -1.247  -2.917  -9.599
  287   1HG   GLU  36          1HG       GLU  36  -0.499  -5.171 -10.520
  288   2HG   GLU  36          2HG       GLU  36  -1.950  -5.864  -9.826
  289    H    VAL  37           H        VAL  37   1.006  -2.283  -7.070
  290    HA   VAL  37           HA       VAL  37  -1.103  -1.256  -5.291
  291    HB   VAL  37           HB       VAL  37   1.652  -1.925  -4.235
  292   1HG1  VAL  37          1HG1      VAL  37  -0.800  -0.944  -2.724
  293   2HG1  VAL  37          2HG1      VAL  37   0.736  -1.422  -2.010
  294   3HG1  VAL  37          3HG1      VAL  37   0.663   0.004  -3.048
  295   1HG2  VAL  37          1HG2      VAL  37  -1.031  -3.319  -3.786
  296   2HG2  VAL  37          2HG2      VAL  37   0.430  -3.980  -4.544
  297   3HG2  VAL  37          3HG2      VAL  37   0.418  -3.624  -2.817
  298    H    ASP  38           H        ASP  38  -1.016   0.104  -7.237
  299    HA   ASP  38           HA       ASP  38   1.025   2.189  -7.292
  300   1HB   ASP  38          1HB       ASP  38  -1.821   2.195  -8.415
  301   2HB   ASP  38          2HB       ASP  38  -0.571   3.398  -8.694
  302    H    LEU  39           H        LEU  39   0.667   4.335  -6.494
  303    HA   LEU  39           HA       LEU  39  -1.104   4.463  -4.089
  304   1HB   LEU  39          1HB       LEU  39   1.575   5.788  -4.633
  305   2HB   LEU  39          2HB       LEU  39   0.544   5.960  -3.188
  306    HG   LEU  39           HG       LEU  39   0.795   3.270  -3.202
  307   1HD1  LEU  39          1HD1      LEU  39   2.281   3.127  -5.182
  308   2HD1  LEU  39          2HD1      LEU  39   3.412   4.252  -4.406
  309   3HD1  LEU  39          3HD1      LEU  39   3.132   2.643  -3.714
  310   1HD2  LEU  39          1HD2      LEU  39   1.343   4.762  -1.324
  311   2HD2  LEU  39          2HD2      LEU  39   2.585   3.523  -1.546
  312   3HD2  LEU  39          3HD2      LEU  39   2.886   5.184  -2.101
  313    H    LEU  40           H        LEU  40  -2.526   6.187  -3.998
  314    HA   LEU  40           HA       LEU  40  -2.803   7.736  -6.533
  315   1HB   LEU  40          1HB       LEU  40  -3.725   5.222  -6.224
  316   2HB   LEU  40          2HB       LEU  40  -5.022   6.060  -5.399
  317    HG   LEU  40           HG       LEU  40  -5.577   5.554  -7.679
  318   1HD1  LEU  40          1HD1      LEU  40  -5.162   8.558  -7.427
  319   2HD1  LEU  40          2HD1      LEU  40  -6.295   7.723  -8.504
  320   3HD1  LEU  40          3HD1      LEU  40  -6.515   7.618  -6.750
  321   1HD2  LEU  40          1HD2      LEU  40  -3.231   5.538  -8.571
  322   2HD2  LEU  40          2HD2      LEU  40  -4.422   6.333  -9.615
  323   3HD2  LEU  40          3HD2      LEU  40  -3.305   7.312  -8.655
  324    H    LYS  41           H        LYS  41  -3.380   9.843  -6.056
  325    HA   LYS  41           HA       LYS  41  -4.558  10.547  -3.487
  326   1HB   LYS  41          1HB       LYS  41  -4.090  12.292  -5.896
  327   2HB   LYS  41          2HB       LYS  41  -4.543  12.785  -4.253
  328   1HG   LYS  41          1HG       LYS  41  -2.435  13.088  -3.831
  329   2HG   LYS  41          2HG       LYS  41  -2.417  11.337  -3.630
  330   1HD   LYS  41          1HD       LYS  41  -0.528  11.986  -4.925
  331   2HD   LYS  41          2HD       LYS  41  -1.621  11.031  -5.909
  332   1HE   LYS  41          1HE       LYS  41  -0.763  12.834  -7.255
  333   2HE   LYS  41          2HE       LYS  41  -2.448  13.218  -6.928
  334   1HZ   LYS  41          1HZ       LYS  41  -0.097  14.344  -5.594
  335   2HZ   LYS  41          2HZ       LYS  41  -1.075  15.070  -6.709
  336   3HZ   LYS  41          3HZ       LYS  41  -1.664  14.706  -5.205
  337    H    ASN  42           H        ASN  42  -6.219  12.583  -5.121
  338    HA   ASN  42           HA       ASN  42  -8.775  11.321  -4.915
  339   1HB   ASN  42          1HB       ASN  42  -9.632  13.389  -5.787
  340   2HB   ASN  42          2HB       ASN  42  -8.257  13.845  -4.777
  341   1HD2  ASN  42          2HD2      ASN  42  -6.036  13.986  -6.120
  342   2HD2  ASN  42          1HD2      ASN  42  -6.175  14.697  -7.707
  343    H    GLY  43           H        GLY  43  -6.640  11.936  -7.714
  344   1HA   GLY  43          1HA       GLY  43  -7.594   9.658  -9.170
  345   2HA   GLY  43          2HA       GLY  43  -8.352  11.144  -9.776
  346    H    GLU  44           H        GLU  44  -5.110  10.757  -8.379
  347    HA   GLU  44           HA       GLU  44  -3.665  10.999 -10.921
  348   1HB   GLU  44          1HB       GLU  44  -4.265  13.316 -10.350
  349   2HB   GLU  44          2HB       GLU  44  -3.708  13.093  -8.700
  350   1HG   GLU  44          1HG       GLU  44  -1.358  12.730  -9.626
  351   2HG   GLU  44          2HG       GLU  44  -2.003  13.131 -11.224
  352    H    ARG  45           H        ARG  45  -1.503  10.174 -10.601
  353    HA   ARG  45           HA       ARG  45  -1.276   8.415  -8.280
  354   1HB   ARG  45          1HB       ARG  45   0.687   8.923 -10.538
  355   2HB   ARG  45          2HB       ARG  45   0.735   7.605  -9.349
  356   1HG   ARG  45          1HG       ARG  45  -1.519   6.843 -10.218
  357   2HG   ARG  45          2HG       ARG  45  -1.340   8.013 -11.537
  358   1HD   ARG  45          1HD       ARG  45   0.499   5.651 -10.899
  359   2HD   ARG  45          2HD       ARG  45  -0.640   5.774 -12.230
  360    HE   ARG  45           HE       ARG  45   0.714   7.252 -13.386
  361   1HH1  ARG  45          1HH2      ARG  45   2.268   6.448 -10.274
  362   2HH1  ARG  45          2HH2      ARG  45   3.823   7.055 -10.773
  363   1HH2  ARG  45          1HH1      ARG  45   2.762   8.012 -14.002
  364   2HH2  ARG  45          2HH1      ARG  45   4.107   7.926 -12.894
  365    H    ILE  46           H        ILE  46   0.664   8.300  -6.872
  366    HA   ILE  46           HA       ILE  46   1.859  10.689  -5.916
  367    HB   ILE  46           HB       ILE  46   2.562   7.733  -5.933
  368   1HG1  ILE  46          1HG1      ILE  46   0.531   8.036  -4.678
  369   2HG1  ILE  46          2HG1      ILE  46   1.875   7.756  -3.578
  370   1HG2  ILE  46          1HG2      ILE  46   3.787   9.983  -4.342
  371   2HG2  ILE  46          2HG2      ILE  46   4.034   8.223  -4.095
  372   3HG2  ILE  46          3HG2      ILE  46   4.577   8.980  -5.590
  373   1HD1  ILE  46          1HD1      ILE  46   0.167  10.160  -3.938
  374   2HD1  ILE  46          2HD1      ILE  46   0.724   9.347  -2.472
  375   3HD1  ILE  46          3HD1      ILE  46   1.826  10.413  -3.337
  376    H    GLU  47           H        GLU  47   3.803  11.543  -6.501
  377    HA   GLU  47           HA       GLU  47   4.747  11.222  -9.231
  378   1HB   GLU  47          1HB       GLU  47   5.792  12.848  -6.873
  379   2HB   GLU  47          2HB       GLU  47   6.494  12.870  -8.502
  380   1HG   GLU  47          1HG       GLU  47   4.417  13.713  -9.451
  381   2HG   GLU  47          2HG       GLU  47   3.606  13.615  -7.879
  382    H    LYS  48           H        LYS  48   6.699  11.064  -6.212
  383    HA   LYS  48           HA       LYS  48   8.513   9.105  -7.538
  384   1HB   LYS  48          1HB       LYS  48   8.855  11.250  -5.442
  385   2HB   LYS  48          2HB       LYS  48   9.947   9.864  -5.489
  386   1HG   LYS  48          1HG       LYS  48  10.915  11.704  -6.674
  387   2HG   LYS  48          2HG       LYS  48  10.629  10.344  -7.763
  388   1HD   LYS  48          1HD       LYS  48   8.683  11.439  -8.725
  389   2HD   LYS  48          2HD       LYS  48   8.784  12.770  -7.556
  390   1HE   LYS  48          1HE       LYS  48  10.919  12.076  -9.634
  391   2HE   LYS  48          2HE       LYS  48   9.668  13.310  -9.847
  392   1HZ   LYS  48          1HZ       LYS  48  10.550  14.491  -7.993
  393   2HZ   LYS  48          2HZ       LYS  48  11.718  13.352  -7.748
  394   3HZ   LYS  48          3HZ       LYS  48  11.720  14.251  -9.127
  395    H    VAL  49           H        VAL  49   7.735   7.120  -7.136
  396    HA   VAL  49           HA       VAL  49   7.020   6.264  -4.376
  397    HB   VAL  49           HB       VAL  49   6.823   4.845  -7.072
  398   1HG1  VAL  49          1HG1      VAL  49   7.078   3.188  -5.322
  399   2HG1  VAL  49          2HG1      VAL  49   5.890   4.017  -4.293
  400   3HG1  VAL  49          3HG1      VAL  49   5.383   3.226  -5.800
  401   1HG2  VAL  49          1HG2      VAL  49   4.666   6.144  -5.362
  402   2HG2  VAL  49          2HG2      VAL  49   5.207   6.684  -6.968
  403   3HG2  VAL  49          3HG2      VAL  49   4.371   5.139  -6.795
  404    H    GLU  50           H        GLU  50   8.381   4.851  -3.236
  405    HA   GLU  50           HA       GLU  50  10.649   3.602  -4.703
  406   1HB   GLU  50          1HB       GLU  50  11.209   5.481  -2.983
  407   2HB   GLU  50          2HB       GLU  50  10.740   4.287  -1.758
  408   1HG   GLU  50          1HG       GLU  50  12.431   2.724  -2.623
  409   2HG   GLU  50          2HG       GLU  50  12.863   3.900  -3.882
  410    H    HIS  51           H        HIS  51  11.228   1.460  -3.662
  411    HA   HIS  51           HA       HIS  51   8.982   0.227  -2.176
  412   1HB   HIS  51          1HB       HIS  51   8.827  -1.633  -3.586
  413   2HB   HIS  51          2HB       HIS  51   8.791  -0.245  -4.674
  414    HD2  HIS  51           HD2      HIS  51  11.167   0.077  -6.259
  415    HE1  HIS  51           HE1      HIS  51  12.678  -3.770  -5.345
  416    HE2  HIS  51           HE2      HIS  51  12.944  -1.748  -6.877
  417    H    SER  52           H        SER  52   9.533  -1.601  -0.998
  418    HA   SER  52           HA       SER  52  12.393  -2.057  -0.363
  419   1HB   SER  52          1HB       SER  52  10.901  -2.043   1.560
  420   2HB   SER  52          2HB       SER  52   9.810  -3.202   0.765
  421    HG   SER  52           HG       SER  52  11.476  -4.731   0.823
  422    H    ASP  53           H        ASP  53  13.451  -3.730  -1.356
  423    HA   ASP  53           HA       ASP  53  12.464  -5.298  -3.475
  424   1HB   ASP  53          1HB       ASP  53  14.700  -5.769  -1.453
  425   2HB   ASP  53          2HB       ASP  53  14.405  -6.834  -2.832
  426    H    LEU  54           H        LEU  54  11.935  -7.522  -3.581
  427    HA   LEU  54           HA       LEU  54   9.868  -8.261  -1.884
  428   1HB   LEU  54          1HB       LEU  54  10.382  -9.084  -4.247
  429   2HB   LEU  54          2HB       LEU  54  11.553 -10.188  -3.530
  430    HG   LEU  54           HG       LEU  54   9.594 -11.424  -3.909
  431   1HD1  LEU  54          1HD1      LEU  54  10.554 -11.817  -1.638
  432   2HD1  LEU  54          2HD1      LEU  54   9.222 -10.818  -0.986
  433   3HD1  LEU  54          3HD1      LEU  54   8.860 -12.280  -1.868
  434   1HD2  LEU  54          1HD2      LEU  54   8.047  -9.086  -2.773
  435   2HD2  LEU  54          2HD2      LEU  54   7.903  -9.863  -4.357
  436   3HD2  LEU  54          3HD2      LEU  54   7.335 -10.684  -2.892
  437    H    SER  55           H        SER  55   9.920  -8.865   0.132
  438    HA   SER  55           HA       SER  55  12.284 -10.274   1.317
  439   1HB   SER  55          1HB       SER  55  12.060  -7.960   2.179
  440   2HB   SER  55          2HB       SER  55  10.374  -8.281   2.624
  441    HG   SER  55           HG       SER  55  12.658  -9.677   3.586
  442    H    PHE  56           H        PHE  56  11.276 -12.321   0.686
  443    HA   PHE  56           HA       PHE  56   8.525 -12.781   1.476
  444   1HB   PHE  56          1HB       PHE  56   8.719 -14.817   0.351
  445   2HB   PHE  56          2HB       PHE  56   9.758 -13.774  -0.558
  446    HD1  PHE  56           HD1      PHE  56   9.465 -16.836   1.218
  447    HD2  PHE  56           HD2      PHE  56  12.227 -13.994  -0.398
  448    HE1  PHE  56           HE1      PHE  56  11.364 -18.382   1.802
  449    HE2  PHE  56           HE2      PHE  56  14.143 -15.539   0.154
  450    HZ   PHE  56           HZ       PHE  56  13.693 -17.711   1.253
  451    H    SER  57           H        SER  57  10.781 -12.215   3.554
  452    HA   SER  57           HA       SER  57  11.659 -12.914   5.434
  453   1HB   SER  57          1HB       SER  57   9.292 -12.951   6.194
  454   2HB   SER  57          2HB       SER  57   9.221 -14.675   5.799
  455    HG   SER  57           HG       SER  57  10.937 -13.386   7.659
  456    H    LYS  58           H        LYS  58  11.562 -15.670   6.555
  457    HA   LYS  58           HA       LYS  58  12.694 -17.341   4.366
  458   1HB   LYS  58          1HB       LYS  58  13.832 -16.890   6.629
  459   2HB   LYS  58          2HB       LYS  58  12.677 -18.076   7.264
  460   1HG   LYS  58          1HG       LYS  58  13.473 -19.696   5.501
  461   2HG   LYS  58          2HG       LYS  58  14.605 -18.461   4.916
  462   1HD   LYS  58          1HD       LYS  58  15.796 -18.459   7.063
  463   2HD   LYS  58          2HD       LYS  58  14.596 -19.558   7.765
  464   1HE   LYS  58          1HE       LYS  58  16.627 -20.785   7.183
  465   2HE   LYS  58          2HE       LYS  58  15.267 -21.347   6.199
  466   1HZ   LYS  58          1HZ       LYS  58  17.322 -19.442   5.311
  467   2HZ   LYS  58          2HZ       LYS  58  17.275 -21.045   4.939
  468   3HZ   LYS  58          3HZ       LYS  58  16.090 -20.042   4.397
  469    H    ASP  59           H        ASP  59   9.882 -16.990   6.453
  470    HA   ASP  59           HA       ASP  59   9.463 -19.785   6.675
  471   1HB   ASP  59          1HB       ASP  59   7.807 -19.175   8.323
  472   2HB   ASP  59          2HB       ASP  59   9.203 -18.102   8.514
  473    H    TRP  60           H        TRP  60   9.111 -19.335   3.995
  474    HA   TRP  60           HA       TRP  60   7.765 -19.780   2.257
  475   1HB   TRP  60          1HB       TRP  60   5.657 -20.744   4.212
  476   2HB   TRP  60          2HB       TRP  60   5.773 -21.092   2.504
  477    HD1  TRP  60           HD1      TRP  60   7.465 -21.964   5.806
  478    HE1  TRP  60           HE1      TRP  60   8.682 -24.233   5.562
  479    HE3  TRP  60           HE3      TRP  60   6.899 -22.667   0.767
  480    HZ2  TRP  60           HZ2      TRP  60   9.281 -26.096   3.478
  481    HZ3  TRP  60           HZ3      TRP  60   7.780 -24.712  -0.311
  482    HH2  TRP  60           HH2      TRP  60   8.969 -26.433   1.030
  483    H    SER  61           H        SER  61   7.306 -17.154   4.080
  484    HA   SER  61           HA       SER  61   4.648 -16.323   3.209
  485   1HB   SER  61          1HB       SER  61   5.638 -15.667   5.379
  486   2HB   SER  61          2HB       SER  61   6.913 -14.772   4.540
  487    HG   SER  61           HG       SER  61   5.123 -13.464   5.155
  488    H    PHE  62           H        PHE  62   4.847 -13.834   2.211
  489    HA   PHE  62           HA       PHE  62   6.923 -13.473   0.235
  490   1HB   PHE  62          1HB       PHE  62   4.842 -15.140  -0.641
  491   2HB   PHE  62          2HB       PHE  62   4.373 -13.551  -1.235
  492    HD1  PHE  62           HD1      PHE  62   7.016 -16.142  -1.336
  493    HD2  PHE  62           HD2      PHE  62   5.683 -12.349  -2.931
  494    HE1  PHE  62           HE1      PHE  62   8.805 -16.221  -2.966
  495    HE2  PHE  62           HE2      PHE  62   7.483 -12.425  -4.550
  496    HZ   PHE  62           HZ       PHE  62   9.099 -14.298  -4.585
  497    H    TYR  63           H        TYR  63   7.129 -11.170   0.114
  498    HA   TYR  63           HA       TYR  63   4.720  -9.524   0.104
  499   1HB   TYR  63          1HB       TYR  63   5.135  -8.433   2.257
  500   2HB   TYR  63          2HB       TYR  63   4.671 -10.130   2.374
  501    HD1  TYR  63           HD1      TYR  63   7.382  -7.752   2.882
  502    HD2  TYR  63           HD2      TYR  63   5.880 -11.733   3.515
  503    HE1  TYR  63           HE1      TYR  63   8.765  -7.927   4.889
  504    HE2  TYR  63           HE2      TYR  63   7.222 -11.924   5.553
  505    HH   TYR  63           HH       TYR  63   9.508  -9.333   6.604
  506    H    LEU  64           H        LEU  64   5.316  -7.182   0.695
  507    HA   LEU  64           HA       LEU  64   7.933  -6.216   0.266
  508   1HB   LEU  64          1HB       LEU  64   7.828  -5.289  -1.917
  509   2HB   LEU  64          2HB       LEU  64   7.475  -7.000  -2.064
  510    HG   LEU  64           HG       LEU  64   5.635  -4.636  -2.384
  511   1HD1  LEU  64          1HD1      LEU  64   6.022  -7.094  -4.153
  512   2HD1  LEU  64          2HD1      LEU  64   5.198  -5.605  -4.589
  513   3HD1  LEU  64          3HD1      LEU  64   6.950  -5.587  -4.353
  514   1HD2  LEU  64          1HD2      LEU  64   4.873  -7.531  -1.936
  515   2HD2  LEU  64          2HD2      LEU  64   4.194  -6.100  -1.113
  516   3HD2  LEU  64          3HD2      LEU  64   3.800  -6.428  -2.790
  517    H    LEU  65           H        LEU  65   7.947  -3.827   0.141
  518    HA   LEU  65           HA       LEU  65   5.595  -2.609   1.484
  519   1HB   LEU  65          1HB       LEU  65   7.982  -3.230   2.595
  520   2HB   LEU  65          2HB       LEU  65   8.437  -1.686   1.862
  521    HG   LEU  65           HG       LEU  65   6.188  -2.176   3.858
  522   1HD1  LEU  65          1HD1      LEU  65   8.464  -2.460   4.744
  523   2HD1  LEU  65          2HD1      LEU  65   8.915  -0.863   4.112
  524   3HD1  LEU  65          3HD1      LEU  65   7.696  -1.002   5.404
  525   1HD2  LEU  65          1HD2      LEU  65   7.146   0.319   2.429
  526   2HD2  LEU  65          2HD2      LEU  65   5.491  -0.295   2.581
  527   3HD2  LEU  65          3HD2      LEU  65   6.302   0.395   3.995
  528    H    TYR  66           H        TYR  66   4.922  -0.650   0.571
  529    HA   TYR  66           HA       TYR  66   6.513   0.443  -1.712
  530   1HB   TYR  66          1HB       TYR  66   3.482   0.285  -1.639
  531   2HB   TYR  66          2HB       TYR  66   4.535   0.644  -2.993
  532    HD1  TYR  66           HD1      TYR  66   3.431  -2.164  -0.667
  533    HD2  TYR  66           HD2      TYR  66   5.307  -1.190  -4.446
  534    HE1  TYR  66           HE1      TYR  66   2.601  -4.247  -1.612
  535    HE2  TYR  66           HE2      TYR  66   4.439  -3.296  -5.380
  536    HH   TYR  66           HH       TYR  66   2.097  -5.333  -3.642
  537    H    TYR  67           H        TYR  67   7.324   2.147  -0.657
  538    HA   TYR  67           HA       TYR  67   5.494   3.950   0.797
  539   1HB   TYR  67          1HB       TYR  67   7.688   4.687   1.894
  540   2HB   TYR  67          2HB       TYR  67   6.774   3.266   2.348
  541    HD1  TYR  67           HD1      TYR  67   9.087   3.459  -0.585
  542    HD2  TYR  67           HD2      TYR  67   8.485   2.059   3.425
  543    HE1  TYR  67           HE1      TYR  67  11.135   2.098  -0.768
  544    HE2  TYR  67           HE2      TYR  67  10.586   0.760   3.292
  545    HH   TYR  67           HH       TYR  67  12.382   0.146   1.972
  546    H    THR  68           H        THR  68   5.581   6.045   0.646
  547    HA   THR  68           HA       THR  68   7.416   7.495  -1.246
  548    HB   THR  68           HB       THR  68   5.464   6.871  -2.406
  549    HG1  THR  68           HG1      THR  68   6.446   8.788  -2.928
  550   1HG2  THR  68          1HG2      THR  68   3.270   7.826  -1.862
  551   2HG2  THR  68          2HG2      THR  68   3.843   6.792  -0.550
  552   3HG2  THR  68          3HG2      THR  68   3.915   8.573  -0.406
  553    H    GLU  69           H        GLU  69   7.419   9.926  -0.798
  554    HA   GLU  69           HA       GLU  69   6.687  10.694   1.978
  555   1HB   GLU  69          1HB       GLU  69   7.958  12.746   1.495
  556   2HB   GLU  69          2HB       GLU  69   8.878  11.247   1.518
  557   1HG   GLU  69          1HG       GLU  69   9.055  11.219  -0.916
  558   2HG   GLU  69          2HG       GLU  69   8.052  12.676  -1.034
  559    H    PHE  70           H        PHE  70   4.361  10.472   1.437
  560    HA   PHE  70           HA       PHE  70   3.230  12.202  -0.565
  561   1HB   PHE  70          1HB       PHE  70   1.198  11.397  -0.039
  562   2HB   PHE  70          2HB       PHE  70   2.226  10.011   0.256
  563    HD1  PHE  70           HD1      PHE  70  -0.745  10.799   1.236
  564    HD2  PHE  70           HD2      PHE  70   3.072  10.982   3.200
  565    HE1  PHE  70           HE1      PHE  70  -1.446   9.070   2.838
  566    HE2  PHE  70           HE2      PHE  70   2.054   9.891   5.184
  567    HZ   PHE  70           HZ       PHE  70  -0.081   8.698   4.922
  568    H    THR  71           H        THR  71   2.088  14.046  -0.319
  569    HA   THR  71           HA       THR  71   2.664  15.614   2.147
  570    HB   THR  71           HB       THR  71   2.290  16.520  -0.670
  571    HG1  THR  71           HG1      THR  71   4.521  16.764  -0.508
  572   1HG2  THR  71          1HG2      THR  71   3.216  18.639   0.273
  573   2HG2  THR  71          2HG2      THR  71   1.660  18.233   1.028
  574   3HG2  THR  71          3HG2      THR  71   3.176  17.917   1.891
  575    HA   PRO  72           HA       PRO  72  -1.944  15.376   2.226
  576   1HB   PRO  72          1HB       PRO  72  -2.303  15.886   4.920
  577   2HB   PRO  72          2HB       PRO  72  -1.970  14.283   4.221
  578   1HG   PRO  72          1HG       PRO  72  -0.012  16.195   5.486
  579   2HG   PRO  72          2HG       PRO  72  -0.140  14.431   5.731
  580   1HD   PRO  72          1HD       PRO  72   1.686  15.568   4.072
  581   2HD   PRO  72          2HD       PRO  72   0.933  13.993   3.679
  582    H    THR  73           H        THR  73  -2.337  17.212   1.062
  583    HA   THR  73           HA       THR  73  -2.006  19.940   2.118
  584    HB   THR  73           HB       THR  73  -3.139  20.569   0.025
  585    HG1  THR  73           HG1      THR  73  -3.435  17.774  -0.335
  586   1HG2  THR  73          1HG2      THR  73  -1.517  19.798  -1.574
  587   2HG2  THR  73          2HG2      THR  73  -0.709  20.120  -0.029
  588   3HG2  THR  73          3HG2      THR  73  -1.035  18.448  -0.534
  589    H    GLU  74           H        GLU  74  -4.277  21.218   1.742
  590    HA   GLU  74           HA       GLU  74  -6.067  20.586   3.789
  591   1HB   GLU  74          1HB       GLU  74  -5.802  22.766   2.650
  592   2HB   GLU  74          2HB       GLU  74  -6.596  22.134   1.208
  593   1HG   GLU  74          1HG       GLU  74  -7.895  22.187   3.976
  594   2HG   GLU  74          2HG       GLU  74  -7.997  23.534   2.837
  595    H    LYS  75           H        LYS  75  -6.393  19.935   0.260
  596    HA   LYS  75           HA       LYS  75  -8.688  18.130   0.783
  597   1HB   LYS  75          1HB       LYS  75  -8.559  20.166  -0.885
  598   2HB   LYS  75          2HB       LYS  75  -7.798  19.015  -1.971
  599   1HG   LYS  75          1HG       LYS  75 -10.522  18.735  -0.591
  600   2HG   LYS  75          2HG       LYS  75 -10.247  19.277  -2.250
  601   1HD   LYS  75          1HD       LYS  75  -9.233  17.045  -2.787
  602   2HD   LYS  75          2HD       LYS  75  -9.705  16.480  -1.164
  603   1HE   LYS  75          1HE       LYS  75 -12.071  16.959  -1.667
  604   2HE   LYS  75          2HE       LYS  75 -11.619  17.614  -3.255
  605   1HZ   LYS  75          1HZ       LYS  75 -10.776  15.418  -3.809
  606   2HZ   LYS  75          2HZ       LYS  75 -11.322  14.829  -2.367
  607   3HZ   LYS  75          3HZ       LYS  75 -12.387  15.406  -3.468
  608    H    ASP  76           H        ASP  76  -6.451  16.958   1.723
  609    HA   ASP  76           HA       ASP  76  -5.149  15.318  -0.301
  610   1HB   ASP  76          1HB       ASP  76  -4.019  14.287   1.520
  611   2HB   ASP  76          2HB       ASP  76  -4.103  16.017   1.842
  612    H    GLU  77           H        GLU  77  -5.836  13.325  -1.055
  613    HA   GLU  77           HA       GLU  77  -7.992  11.888   0.382
  614   1HB   GLU  77          1HB       GLU  77  -8.935  13.608  -1.261
  615   2HB   GLU  77          2HB       GLU  77  -8.236  12.642  -2.564
  616   1HG   GLU  77          1HG       GLU  77  -9.670  10.725  -1.881
  617   2HG   GLU  77          2HG       GLU  77 -10.232  11.642  -0.472
  618    H    TYR  78           H        TYR  78  -5.536  11.067   0.573
  619    HA   TYR  78           HA       TYR  78  -4.623   9.553  -1.711
  620   1HB   TYR  78          1HB       TYR  78  -3.566   9.900   1.074
  621   2HB   TYR  78          2HB       TYR  78  -2.820   8.837  -0.089
  622    HD1  TYR  78           HD1      TYR  78  -1.190   9.715  -1.598
  623    HD2  TYR  78           HD2      TYR  78  -3.902  12.394   0.375
  624    HE1  TYR  78           HE1      TYR  78   0.194  11.676  -2.299
  625    HE2  TYR  78           HE2      TYR  78  -2.575  14.329  -0.427
  626    HH   TYR  78           HH       TYR  78  -0.444  14.967  -1.127
  627    H    ALA  79           H        ALA  79  -4.462   7.441  -1.990
  628    HA   ALA  79           HA       ALA  79  -5.594   5.477  -0.149
  629   1HB   ALA  79          1HB       ALA  79  -7.581   6.356  -1.411
  630   2HB   ALA  79          2HB       ALA  79  -6.760   5.971  -2.936
  631   3HB   ALA  79          3HB       ALA  79  -7.232   4.669  -1.826
  632    H    CYS  80           H        CYS  80  -5.452   3.263  -1.332
  633    HA   CYS  80           HA       CYS  80  -2.991   3.124  -2.976
  634   1HB   CYS  80          1HB       CYS  80  -2.734   3.086  -0.328
  635   2HB   CYS  80          2HB       CYS  80  -3.154   1.383  -0.522
  636    H    ARG  81           H        ARG  81  -3.117   1.659  -4.501
  637    HA   ARG  81           HA       ARG  81  -5.524   0.139  -4.970
  638   1HB   ARG  81          1HB       ARG  81  -4.141   1.223  -6.698
  639   2HB   ARG  81          2HB       ARG  81  -2.796   0.159  -6.274
  640   1HG   ARG  81          1HG       ARG  81  -4.058  -1.801  -7.000
  641   2HG   ARG  81          2HG       ARG  81  -5.461  -0.798  -7.399
  642   1HD   ARG  81          1HD       ARG  81  -2.700  -0.397  -8.620
  643   2HD   ARG  81          2HD       ARG  81  -3.948  -1.397  -9.368
  644    HE   ARG  81           HE       ARG  81  -5.186   1.043  -8.873
  645   1HH1  ARG  81          1HH2      ARG  81  -2.352   0.003 -10.759
  646   2HH1  ARG  81          2HH2      ARG  81  -2.634   1.152 -12.037
  647   1HH2  ARG  81          1HH1      ARG  81  -5.453   2.633 -10.510
  648   2HH2  ARG  81          2HH1      ARG  81  -4.343   2.694 -11.854
  649    H    VAL  82           H        VAL  82  -5.848  -2.192  -4.700
  650    HA   VAL  82           HA       VAL  82  -3.478  -3.784  -3.986
  651    HB   VAL  82           HB       VAL  82  -6.077  -4.070  -2.435
  652   1HG1  VAL  82          1HG1      VAL  82  -4.534  -6.014  -2.791
  653   2HG1  VAL  82          2HG1      VAL  82  -3.293  -5.106  -1.903
  654   3HG1  VAL  82          3HG1      VAL  82  -4.822  -5.570  -1.104
  655   1HG2  VAL  82          1HG2      VAL  82  -5.080  -1.863  -1.796
  656   2HG2  VAL  82          2HG2      VAL  82  -5.057  -3.049  -0.511
  657   3HG2  VAL  82          3HG2      VAL  82  -3.561  -2.703  -1.406
  658    H    ASN  83           H        ASN  83  -3.521  -4.682  -6.024
  659    HA   ASN  83           HA       ASN  83  -5.949  -6.336  -6.689
  660   1HB   ASN  83          1HB       ASN  83  -4.058  -5.169  -8.722
  661   2HB   ASN  83          2HB       ASN  83  -5.570  -6.014  -8.987
  662   1HD2  ASN  83          2HD2      ASN  83  -5.177  -3.765 -10.335
  663   2HD2  ASN  83          1HD2      ASN  83  -6.203  -2.478  -9.719
  664    H    HIS  84           H        HIS  84  -4.775  -7.967  -5.274
  665    HA   HIS  84           HA       HIS  84  -2.167  -9.037  -6.160
  666   1HB   HIS  84          1HB       HIS  84  -2.740  -9.104  -3.827
  667   2HB   HIS  84          2HB       HIS  84  -4.254  -9.932  -4.181
  668    HD2  HIS  84           HD2      HIS  84  -0.380 -10.783  -4.643
  669    HE1  HIS  84           HE1      HIS  84  -2.582 -14.311  -3.871
  670    HE2  HIS  84           HE2      HIS  84  -0.260 -13.387  -4.340
  671    H    VAL  85           H        VAL  85  -2.077 -11.136  -7.328
  672    HA   VAL  85           HA       VAL  85  -3.939 -11.492  -9.326
  673    HB   VAL  85           HB       VAL  85  -1.643 -12.363  -9.308
  674   1HG1  VAL  85          1HG1      VAL  85  -1.658 -13.476  -7.072
  675   2HG1  VAL  85          2HG1      VAL  85  -2.745 -14.724  -7.723
  676   3HG1  VAL  85          3HG1      VAL  85  -1.113 -14.541  -8.381
  677   1HG2  VAL  85          1HG2      VAL  85  -3.276 -13.072 -11.031
  678   2HG2  VAL  85          2HG2      VAL  85  -2.073 -14.322 -10.677
  679   3HG2  VAL  85          3HG2      VAL  85  -3.715 -14.473 -10.029
  680    H    THR  86           H        THR  86  -4.135 -12.914  -6.058
  681    HA   THR  86           HA       THR  86  -6.319 -14.671  -6.852
  682    HB   THR  86           HB       THR  86  -4.500 -14.954  -4.941
  683    HG1  THR  86           HG1      THR  86  -7.142 -15.901  -5.059
  684   1HG2  THR  86          1HG2      THR  86  -6.993 -14.188  -3.366
  685   2HG2  THR  86          2HG2      THR  86  -5.398 -14.672  -2.750
  686   3HG2  THR  86          3HG2      THR  86  -5.609 -13.092  -3.524
  687    H    LEU  87           H        LEU  87  -6.094 -11.339  -5.687
  688    HA   LEU  87           HA       LEU  87  -8.877 -11.159  -4.819
  689   1HB   LEU  87          1HB       LEU  87  -6.627  -9.236  -5.417
  690   2HB   LEU  87          2HB       LEU  87  -8.281  -8.646  -5.394
  691    HG   LEU  87           HG       LEU  87  -8.631  -9.157  -3.145
  692   1HD1  LEU  87          1HD1      LEU  87  -6.000 -10.694  -3.127
  693   2HD1  LEU  87          2HD1      LEU  87  -6.964 -10.266  -1.700
  694   3HD1  LEU  87          3HD1      LEU  87  -7.625 -11.370  -2.907
  695   1HD2  LEU  87          1HD2      LEU  87  -7.228  -7.163  -3.671
  696   2HD2  LEU  87          2HD2      LEU  87  -6.879  -7.817  -2.060
  697   3HD2  LEU  87          3HD2      LEU  87  -5.768  -8.131  -3.408
  698    H    SER  88           H        SER  88 -10.380 -11.735  -6.268
  699    HA   SER  88           HA       SER  88 -10.098 -11.280  -9.122
  700   1HB   SER  88          1HB       SER  88 -12.513 -12.204  -7.518
  701   2HB   SER  88          2HB       SER  88 -12.235 -12.414  -9.259
  702    HG   SER  88           HG       SER  88 -10.338 -13.637  -8.649
  703    H    GLN  89           H        GLN  89 -10.277  -8.876  -7.118
  704    HA   GLN  89           HA       GLN  89 -11.888  -7.233  -8.829
  705   1HB   GLN  89          1HB       GLN  89 -13.211  -6.296  -6.968
  706   2HB   GLN  89          2HB       GLN  89 -13.652  -7.966  -7.353
  707   1HG   GLN  89          1HG       GLN  89 -12.269  -8.750  -5.428
  708   2HG   GLN  89          2HG       GLN  89 -11.903  -7.062  -5.020
  709   1HE2  GLN  89          2HE2      GLN  89 -13.122  -8.850  -3.196
  710   2HE2  GLN  89          1HE2      GLN  89 -14.753  -8.285  -2.896
  711    HA   PRO  90           HA       PRO  90  -8.430  -4.801  -7.439
  712   1HB   PRO  90          1HB       PRO  90  -9.013  -2.328  -8.470
  713   2HB   PRO  90          2HB       PRO  90  -8.655  -3.739  -9.504
  714   1HG   PRO  90          1HG       PRO  90 -11.390  -2.673  -8.757
  715   2HG   PRO  90          2HG       PRO  90 -10.781  -3.106 -10.377
  716   1HD   PRO  90          1HD       PRO  90 -12.268  -4.836  -8.851
  717   2HD   PRO  90          2HD       PRO  90 -10.966  -5.405  -9.940
  718    H    LYS  91           H        LYS  91  -8.283  -4.497  -5.251
  719    HA   LYS  91           HA       LYS  91 -10.563  -3.294  -3.799
  720   1HB   LYS  91          1HB       LYS  91  -9.868  -5.525  -3.178
  721   2HB   LYS  91          2HB       LYS  91  -8.206  -4.999  -2.925
  722   1HG   LYS  91          1HG       LYS  91  -9.426  -5.329  -0.831
  723   2HG   LYS  91          2HG       LYS  91  -8.846  -3.669  -0.986
  724   1HD   LYS  91          1HD       LYS  91 -11.077  -2.883  -1.595
  725   2HD   LYS  91          2HD       LYS  91 -11.681  -4.556  -1.682
  726   1HE   LYS  91          1HE       LYS  91 -11.226  -4.815   0.760
  727   2HE   LYS  91          2HE       LYS  91 -10.663  -3.134   0.821
  728   1HZ   LYS  91          1HZ       LYS  91 -12.842  -2.453   0.108
  729   2HZ   LYS  91          2HZ       LYS  91 -13.359  -4.017   0.069
  730   3HZ   LYS  91          3HZ       LYS  91 -12.929  -3.327   1.502
  731    H    ILE  92           H        ILE  92 -10.158  -1.079  -4.296
  732    HA   ILE  92           HA       ILE  92  -7.573   0.088  -3.651
  733    HB   ILE  92           HB       ILE  92 -10.151   1.558  -4.241
  734   1HG1  ILE  92          1HG1      ILE  92  -9.978  -0.012  -6.062
  735   2HG1  ILE  92          2HG1      ILE  92  -9.525   1.592  -6.610
  736   1HG2  ILE  92          1HG2      ILE  92  -7.188   2.209  -4.568
  737   2HG2  ILE  92          2HG2      ILE  92  -8.522   3.229  -5.150
  738   3HG2  ILE  92          3HG2      ILE  92  -8.326   2.924  -3.413
  739   1HD1  ILE  92          1HD1      ILE  92  -7.131   0.972  -6.527
  740   2HD1  ILE  92          2HD1      ILE  92  -7.571  -0.655  -5.938
  741   3HD1  ILE  92          3HD1      ILE  92  -8.061  -0.130  -7.554
  742    H    VAL  93           H        VAL  93  -6.989   0.636  -1.610
  743    HA   VAL  93           HA       VAL  93  -9.064   0.840   0.532
  744    HB   VAL  93           HB       VAL  93  -6.132   0.014   0.613
  745   1HG1  VAL  93          1HG1      VAL  93  -6.696   1.138   2.703
  746   2HG1  VAL  93          2HG1      VAL  93  -8.212   0.218   2.838
  747   3HG1  VAL  93          3HG1      VAL  93  -6.642  -0.601   2.987
  748   1HG2  VAL  93          1HG2      VAL  93  -7.559  -1.717  -0.372
  749   2HG2  VAL  93          2HG2      VAL  93  -7.073  -2.200   1.252
  750   3HG2  VAL  93          3HG2      VAL  93  -8.711  -1.576   0.974
  751    H    LYS  94           H        LYS  94  -9.379   2.835   1.352
  752    HA   LYS  94           HA       LYS  94  -7.803   5.090   0.629
  753   1HB   LYS  94          1HB       LYS  94  -9.201   6.336   2.117
  754   2HB   LYS  94          2HB       LYS  94 -10.208   5.166   1.254
  755   1HG   LYS  94          1HG       LYS  94 -10.222   3.692   3.261
  756   2HG   LYS  94          2HG       LYS  94  -9.168   4.839   4.113
  757   1HD   LYS  94          1HD       LYS  94 -10.871   6.611   3.868
  758   2HD   LYS  94          2HD       LYS  94 -11.978   5.439   3.120
  759   1HE   LYS  94          1HE       LYS  94 -12.030   4.106   5.165
  760   2HE   LYS  94          2HE       LYS  94 -10.743   5.084   5.896
  761   1HZ   LYS  94          1HZ       LYS  94 -13.415   6.068   5.197
  762   2HZ   LYS  94          2HZ       LYS  94 -12.878   5.702   6.712
  763   3HZ   LYS  94          3HZ       LYS  94 -12.202   6.951   5.881
  764    H    TRP  95           H        TRP  95  -6.441   6.444   1.965
  765    HA   TRP  95           HA       TRP  95  -4.921   5.080   4.088
  766   1HB   TRP  95          1HB       TRP  95  -3.686   6.577   2.680
  767   2HB   TRP  95          2HB       TRP  95  -4.872   7.863   2.911
  768    HD1  TRP  95           HD1      TRP  95  -3.105   5.827   5.685
  769    HE1  TRP  95           HE1      TRP  95  -1.917   7.486   7.269
  770    HE3  TRP  95           HE3      TRP  95  -3.964  10.170   3.131
  771    HZ2  TRP  95           HZ2      TRP  95  -1.426  10.345   7.400
  772    HZ3  TRP  95           HZ3      TRP  95  -2.644  12.170   3.710
  773    HH2  TRP  95           HH2      TRP  95  -1.503  12.327   5.902
  774    H    ASP  96           H        ASP  96  -6.140   4.734   5.924
  775    HA   ASP  96           HA       ASP  96  -7.872   6.760   7.092
  776   1HB   ASP  96          1HB       ASP  96  -7.643   5.362   9.138
  777   2HB   ASP  96          2HB       ASP  96  -8.297   4.544   7.725
  778    H    ARG  97           H        ARG  97  -7.235   8.456   8.190
  779    HA   ARG  97           HA       ARG  97  -4.504   9.339   8.232
  780   1HB   ARG  97          1HB       ARG  97  -6.969  10.332   9.730
  781   2HB   ARG  97          2HB       ARG  97  -5.410  11.155   9.748
  782   1HG   ARG  97          1HG       ARG  97  -7.107  10.665   7.256
  783   2HG   ARG  97          2HG       ARG  97  -6.993  12.162   8.181
  784   1HD   ARG  97          1HD       ARG  97  -4.324  11.721   7.690
  785   2HD   ARG  97          2HD       ARG  97  -5.039  10.922   6.290
  786    HE   ARG  97           HE       ARG  97  -5.489  12.995   5.390
  787   1HH1  ARG  97          1HH2      ARG  97  -4.965  13.382   8.883
  788   2HH1  ARG  97          2HH2      ARG  97  -5.046  15.124   8.825
  789   1HH2  ARG  97          1HH1      ARG  97  -5.693  15.288   5.360
  790   2HH2  ARG  97          2HH1      ARG  97  -5.464  16.205   6.824
  791    H    ASP  98           H        ASP  98  -6.687   8.273  10.768
  792    HA   ASP  98           HA       ASP  98  -4.505   7.144  12.415
  793   1HB   ASP  98          1HB       ASP  98  -4.825   9.398  13.319
  794   2HB   ASP  98          2HB       ASP  98  -6.577   9.174  13.381
  795    H    MET  99           H        MET  99  -8.017   7.851  12.341
  796    HA   MET  99           HA       MET  99  -8.637   4.954  12.254
  797   1HB   MET  99          1HB       MET  99 -10.592   5.328  13.643
  798   2HB   MET  99          2HB       MET  99  -9.129   5.785  14.525
  799   1HG   MET  99          1HG       MET  99  -9.580   8.178  14.033
  800   2HG   MET  99          2HG       MET  99 -11.038   7.715  13.142
  801   1HE   MET  99          1HE       MET  99 -12.494   9.358  14.424
  802   2HE   MET  99          2HE       MET  99 -12.693   9.394  16.190
  803   3HE   MET  99          3HE       MET  99 -11.163   9.930  15.460
  Start of MODEL   19
    1   1H    MET   0          1H        MET   0  -1.106 -23.586   1.880
    2   2H    MET   0          2H        MET   0  -1.111 -22.104   1.158
    3   3H    MET   0          3H        MET   0  -2.517 -22.946   1.312
    4    HA   MET   0           HA       MET   0  -0.205 -23.749  -0.290
    5   1HB   MET   0          1HB       MET   0  -2.980 -25.007  -0.101
    6   2HB   MET   0          2HB       MET   0  -1.695 -25.473  -1.228
    7   1HG   MET   0          1HG       MET   0  -0.224 -25.972   0.770
    8   2HG   MET   0          2HG       MET   0  -1.617 -25.650   1.809
    9   1HE   MET   0          1HE       MET   0   0.332 -28.180  -0.235
   10   2HE   MET   0          2HE       MET   0  -0.868 -29.389  -0.740
   11   3HE   MET   0          3HE       MET   0  -0.857 -27.783  -1.501
   12    H    ILE   1           H        ILE   1  -3.697 -22.943  -0.582
   13    HA   ILE   1           HA       ILE   1  -3.501 -21.801  -3.175
   14    HB   ILE   1           HB       ILE   1  -5.691 -20.993  -2.873
   15   1HG1  ILE   1          1HG1      ILE   1  -5.661 -19.866  -0.774
   16   2HG1  ILE   1          2HG1      ILE   1  -6.950 -21.060  -0.779
   17   1HG2  ILE   1          1HG2      ILE   1  -5.519 -23.368  -3.234
   18   2HG2  ILE   1          2HG2      ILE   1  -5.455 -23.690  -1.490
   19   3HG2  ILE   1          3HG2      ILE   1  -6.917 -22.998  -2.213
   20   1HD1  ILE   1          1HD1      ILE   1  -5.469 -22.603   0.556
   21   2HD1  ILE   1          2HD1      ILE   1  -4.282 -21.278   0.671
   22   3HD1  ILE   1          3HD1      ILE   1  -5.889 -21.085   1.371
   23    H    GLN   2           H        GLN   2  -4.100 -19.481  -3.601
   24    HA   GLN   2           HA       GLN   2  -2.000 -17.802  -2.591
   25   1HB   GLN   2          1HB       GLN   2  -4.379 -17.357  -4.440
   26   2HB   GLN   2          2HB       GLN   2  -3.179 -16.121  -4.042
   27   1HG   GLN   2          1HG       GLN   2  -2.530 -17.129  -6.138
   28   2HG   GLN   2          2HG       GLN   2  -1.377 -17.615  -4.891
   29   1HE2  GLN   2          2HE2      GLN   2  -0.771 -19.726  -5.027
   30   2HE2  GLN   2          1HE2      GLN   2  -1.775 -21.021  -5.643
   31    H    ARG   3           H        ARG   3  -2.147 -17.185  -0.486
   32    HA   ARG   3           HA       ARG   3  -4.629 -16.857   0.857
   33   1HB   ARG   3          1HB       ARG   3  -2.583 -17.701   1.871
   34   2HB   ARG   3          2HB       ARG   3  -1.850 -16.098   1.733
   35   1HG   ARG   3          1HG       ARG   3  -3.485 -15.163   3.299
   36   2HG   ARG   3          2HG       ARG   3  -4.424 -16.674   3.264
   37   1HD   ARG   3          1HD       ARG   3  -2.472 -17.863   4.263
   38   2HD   ARG   3          2HD       ARG   3  -1.620 -16.307   4.394
   39    HE   ARG   3           HE       ARG   3  -4.102 -15.926   5.612
   40   1HH1  ARG   3          1HH2      ARG   3  -1.284 -18.011   6.165
   41   2HH1  ARG   3          2HH2      ARG   3  -1.613 -18.220   7.865
   42   1HH2  ARG   3          1HH1      ARG   3  -4.530 -16.210   7.833
   43   2HH2  ARG   3          2HH1      ARG   3  -3.471 -17.180   8.823
   44    H    THR   4           H        THR   4  -5.529 -15.015   1.836
   45    HA   THR   4           HA       THR   4  -5.926 -12.854   0.186
   46    HB   THR   4           HB       THR   4  -6.347 -13.023   3.204
   47    HG1  THR   4           HG1      THR   4  -7.930 -13.989   1.065
   48   1HG2  THR   4          1HG2      THR   4  -8.355 -11.655   2.777
   49   2HG2  THR   4          2HG2      THR   4  -6.883 -10.782   2.315
   50   3HG2  THR   4          3HG2      THR   4  -7.917 -11.517   1.064
   51    HA   PRO   5           HA       PRO   5  -2.388 -10.226   1.330
   52   1HB   PRO   5          1HB       PRO   5  -3.121  -7.901   0.073
   53   2HB   PRO   5          2HB       PRO   5  -2.522  -9.345  -0.790
   54   1HG   PRO   5          1HG       PRO   5  -5.386  -8.472  -0.381
   55   2HG   PRO   5          2HG       PRO   5  -4.601  -9.034  -1.885
   56   1HD   PRO   5          1HD       PRO   5  -6.105 -10.667  -0.283
   57   2HD   PRO   5          2HD       PRO   5  -4.686 -11.286  -1.185
   58    H    LYS   6           H        LYS   6  -2.289  -9.782   3.449
   59    HA   LYS   6           HA       LYS   6  -4.371  -8.321   4.881
   60   1HB   LYS   6          1HB       LYS   6  -3.032 -10.245   5.832
   61   2HB   LYS   6          2HB       LYS   6  -1.614  -9.183   5.832
   62   1HG   LYS   6          1HG       LYS   6  -3.175  -7.501   7.118
   63   2HG   LYS   6          2HG       LYS   6  -4.209  -8.910   7.385
   64   1HD   LYS   6          1HD       LYS   6  -1.290  -8.559   8.219
   65   2HD   LYS   6          2HD       LYS   6  -2.707  -8.511   9.281
   66   1HE   LYS   6          1HE       LYS   6  -3.205 -10.898   8.666
   67   2HE   LYS   6          2HE       LYS   6  -1.704 -10.939   7.718
   68   1HZ   LYS   6          1HZ       LYS   6  -1.872 -10.406  10.595
   69   2HZ   LYS   6          2HZ       LYS   6  -1.408 -11.827   9.902
   70   3HZ   LYS   6          3HZ       LYS   6  -0.490 -10.473   9.700
   71    H    ILE   7           H        ILE   7  -4.458  -6.215   4.290
   72    HA   ILE   7           HA       ILE   7  -2.104  -4.578   3.732
   73    HB   ILE   7           HB       ILE   7  -3.724  -2.825   3.292
   74   1HG1  ILE   7          1HG1      ILE   7  -6.256  -3.838   3.277
   75   2HG1  ILE   7          2HG1      ILE   7  -5.662  -4.622   4.734
   76   1HG2  ILE   7          1HG2      ILE   7  -3.228  -4.507   1.553
   77   2HG2  ILE   7          2HG2      ILE   7  -4.646  -5.452   2.070
   78   3HG2  ILE   7          3HG2      ILE   7  -4.846  -3.815   1.429
   79   1HD1  ILE   7          1HD1      ILE   7  -5.023  -2.329   5.615
   80   2HD1  ILE   7          2HD1      ILE   7  -5.695  -1.633   4.131
   81   3HD1  ILE   7          3HD1      ILE   7  -6.748  -2.505   5.261
   82    H    GLN   8           H        GLN   8  -1.166  -2.968   5.128
   83    HA   GLN   8           HA       GLN   8  -2.857  -1.942   7.269
   84   1HB   GLN   8          1HB       GLN   8  -0.656  -1.869   8.577
   85   2HB   GLN   8          2HB       GLN   8  -1.676  -3.312   8.668
   86   1HG   GLN   8          1HG       GLN   8   0.750  -3.061   6.872
   87   2HG   GLN   8          2HG       GLN   8   0.833  -3.669   8.528
   88   1HE2  GLN   8          2HE2      GLN   8   1.301  -4.909   5.728
   89   2HE2  GLN   8          1HE2      GLN   8   0.325  -6.366   5.751
   90    H    VAL   9           H        VAL   9  -3.193  -0.093   6.150
   91    HA   VAL   9           HA       VAL   9  -0.952   1.307   4.851
   92    HB   VAL   9           HB       VAL   9  -3.914   1.971   4.868
   93   1HG1  VAL   9          1HG1      VAL   9  -1.532   3.034   3.318
   94   2HG1  VAL   9          2HG1      VAL   9  -3.220   3.325   2.840
   95   3HG1  VAL   9          3HG1      VAL   9  -2.614   3.938   4.383
   96   1HG2  VAL   9          1HG2      VAL   9  -3.527  -0.212   3.759
   97   2HG2  VAL   9          2HG2      VAL   9  -3.893   1.034   2.561
   98   3HG2  VAL   9          3HG2      VAL   9  -2.220   0.496   2.793
   99    H    TYR  10           H        TYR  10   0.270   2.120   6.513
  100    HA   TYR  10           HA       TYR  10  -1.100   3.886   8.506
  101   1HB   TYR  10          1HB       TYR  10   0.774   3.490   9.958
  102   2HB   TYR  10          2HB       TYR  10  -0.081   2.020   9.520
  103    HD1  TYR  10           HD1      TYR  10   0.989   0.244   8.288
  104    HD2  TYR  10           HD2      TYR  10   3.098   3.899   9.163
  105    HE1  TYR  10           HE1      TYR  10   3.129  -0.848   7.698
  106    HE2  TYR  10           HE2      TYR  10   5.238   2.806   8.544
  107    HH   TYR  10           HH       TYR  10   6.246   0.906   7.720
  108    H    SER  11           H        SER  11  -0.157   5.790   9.150
  109    HA   SER  11           HA       SER  11   1.769   7.122   7.315
  110   1HB   SER  11          1HB       SER  11   0.952   9.182   8.633
  111   2HB   SER  11          2HB       SER  11  -0.077   8.459   7.396
  112    HG   SER  11           HG       SER  11  -0.293   7.982  10.180
  113    H    ARG  12           H        ARG  12   3.765   7.660   8.186
  114    HA   ARG  12           HA       ARG  12   4.416   6.767  10.915
  115   1HB   ARG  12          1HB       ARG  12   6.083   8.014   8.696
  116   2HB   ARG  12          2HB       ARG  12   6.700   7.537  10.290
  117   1HG   ARG  12          1HG       ARG  12   5.860   5.201   9.876
  118   2HG   ARG  12          2HG       ARG  12   5.338   5.704   8.266
  119   1HD   ARG  12          1HD       ARG  12   7.427   4.586   8.033
  120   2HD   ARG  12          2HD       ARG  12   7.730   6.311   7.737
  121    HE   ARG  12           HE       ARG  12   8.175   5.914  10.466
  122   1HH1  ARG  12          1HH2      ARG  12   9.574   4.628   7.464
  123   2HH1  ARG  12          2HH2      ARG  12  11.127   4.295   8.188
  124   1HH2  ARG  12          1HH1      ARG  12  10.218   5.477  11.395
  125   2HH2  ARG  12          2HH1      ARG  12  11.493   4.782  10.429
  126    H    HIS  13           H        HIS  13   4.658   9.857   9.083
  127    HA   HIS  13           HA       HIS  13   5.172  11.416  11.442
  128   1HB   HIS  13          1HB       HIS  13   4.344  12.203   8.639
  129   2HB   HIS  13          2HB       HIS  13   4.953  13.315   9.861
  130    HD2  HIS  13           HD2      HIS  13   7.553  13.832   9.562
  131    HE1  HIS  13           HE1      HIS  13   8.655  10.292   7.527
  132    HE2  HIS  13           HE2      HIS  13   9.507  12.530   8.398
  133    HA   PRO  14           HA       PRO  14   0.873  12.616  12.249
  134   1HB   PRO  14          1HB       PRO  14   1.160  15.043  13.445
  135   2HB   PRO  14          2HB       PRO  14   1.640  13.518  14.241
  136   1HG   PRO  14          1HG       PRO  14   3.413  15.506  12.822
  137   2HG   PRO  14          2HG       PRO  14   3.702  14.672  14.372
  138   1HD   PRO  14          1HD       PRO  14   4.750  13.855  11.954
  139   2HD   PRO  14          2HD       PRO  14   4.419  12.716  13.275
  140    H    ALA  15           H        ALA  15  -0.493  13.263  10.626
  141    HA   ALA  15           HA       ALA  15   0.508  14.625   8.372
  142   1HB   ALA  15          1HB       ALA  15  -1.332  13.031   8.241
  143   2HB   ALA  15          2HB       ALA  15  -2.394  14.179   9.105
  144   3HB   ALA  15          3HB       ALA  15  -1.760  14.584   7.504
  145    H    GLU  16           H        GLU  16   0.282  16.646   7.588
  146    HA   GLU  16           HA       GLU  16  -1.076  18.799   9.007
  147   1HB   GLU  16          1HB       GLU  16   1.000  18.579  10.311
  148   2HB   GLU  16          2HB       GLU  16   1.970  18.667   8.835
  149   1HG   GLU  16          1HG       GLU  16   1.138  20.982   8.434
  150   2HG   GLU  16          2HG       GLU  16   0.145  20.869   9.899
  151    H    ASN  17           H        ASN  17  -1.382  20.562   7.656
  152    HA   ASN  17           HA       ASN  17  -1.641  19.934   4.938
  153   1HB   ASN  17          1HB       ASN  17  -3.111  21.430   6.205
  154   2HB   ASN  17          2HB       ASN  17  -1.820  22.637   6.307
  155   1HD2  ASN  17          2HD2      ASN  17  -3.866  23.785   5.293
  156   2HD2  ASN  17          1HD2      ASN  17  -3.882  23.840   3.541
  157    H    GLY  18           H        GLY  18  -0.003  19.727   3.510
  158   1HA   GLY  18          1HA       GLY  18   1.651  20.376   2.079
  159   2HA   GLY  18          2HA       GLY  18   1.532  22.018   2.727
  160    H    LYS  19           H        LYS  19   2.376  18.915   4.312
  161    HA   LYS  19           HA       LYS  19   5.153  19.807   4.828
  162   1HB   LYS  19          1HB       LYS  19   3.751  20.631   6.628
  163   2HB   LYS  19          2HB       LYS  19   3.129  18.976   6.842
  164   1HG   LYS  19          1HG       LYS  19   4.702  19.594   8.599
  165   2HG   LYS  19          2HG       LYS  19   5.291  18.215   7.693
  166   1HD   LYS  19          1HD       LYS  19   6.221  20.977   6.866
  167   2HD   LYS  19          2HD       LYS  19   6.801  20.315   8.399
  168   1HE   LYS  19          1HE       LYS  19   7.627  18.276   7.265
  169   2HE   LYS  19          2HE       LYS  19   7.163  18.956   5.698
  170   1HZ   LYS  19          1HZ       LYS  19   9.071  20.168   7.567
  171   2HZ   LYS  19          2HZ       LYS  19   9.464  19.310   6.217
  172   3HZ   LYS  19          3HZ       LYS  19   8.669  20.744   6.075
  173    H    SER  20           H        SER  20   5.802  18.314   3.678
  174    HA   SER  20           HA       SER  20   5.062  15.895   2.986
  175   1HB   SER  20          1HB       SER  20   7.121  17.128   2.176
  176   2HB   SER  20          2HB       SER  20   7.994  16.143   3.378
  177    HG   SER  20           HG       SER  20   6.285  15.150   1.337
  178    H    ASN  21           H        ASN  21   4.850  13.921   3.818
  179    HA   ASN  21           HA       ASN  21   5.802  13.180   6.544
  180   1HB   ASN  21          1HB       ASN  21   3.209  12.720   5.050
  181   2HB   ASN  21          2HB       ASN  21   3.551  11.998   6.615
  182   1HD2  ASN  21          2HD2      ASN  21   1.612  14.174   5.525
  183   2HD2  ASN  21          1HD2      ASN  21   1.829  15.504   6.645
  184    H    PHE  22           H        PHE  22   4.451  10.459   5.957
  185    HA   PHE  22           HA       PHE  22   5.698   9.454   3.608
  186   1HB   PHE  22          1HB       PHE  22   7.282   9.260   5.962
  187   2HB   PHE  22          2HB       PHE  22   6.662   7.648   5.662
  188    HD1  PHE  22           HD1      PHE  22   9.308   9.850   4.903
  189    HD2  PHE  22           HD2      PHE  22   6.707   6.965   3.041
  190    HE1  PHE  22           HE1      PHE  22  10.973   9.514   3.097
  191    HE2  PHE  22           HE2      PHE  22   8.340   6.718   1.168
  192    HZ   PHE  22           HZ       PHE  22  10.480   7.963   1.218
  193    H    LEU  23           H        LEU  23   4.197   8.289   2.784
  194    HA   LEU  23           HA       LEU  23   2.119   6.955   4.401
  195   1HB   LEU  23          1HB       LEU  23   1.514   8.345   2.439
  196   2HB   LEU  23          2HB       LEU  23   2.463   7.305   1.413
  197    HG   LEU  23           HG       LEU  23   0.969   5.442   1.775
  198   1HD1  LEU  23          1HD1      LEU  23  -0.525   7.218   3.758
  199   2HD1  LEU  23          2HD1      LEU  23  -1.146   5.706   3.090
  200   3HD1  LEU  23          3HD1      LEU  23   0.286   5.693   4.122
  201   1HD2  LEU  23          1HD2      LEU  23   0.372   7.280   0.132
  202   2HD2  LEU  23          2HD2      LEU  23  -1.032   6.353   0.711
  203   3HD2  LEU  23          3HD2      LEU  23  -0.695   7.968   1.359
  204    H    ASN  24           H        ASN  24   2.043   4.736   4.585
  205    HA   ASN  24           HA       ASN  24   4.027   3.082   3.084
  206   1HB   ASN  24          1HB       ASN  24   3.398   3.125   6.051
  207   2HB   ASN  24          2HB       ASN  24   4.314   1.856   5.232
  208   1HD2  ASN  24          2HD2      ASN  24   4.314   5.456   5.765
  209   2HD2  ASN  24          1HD2      ASN  24   6.055   5.586   5.870
  210    H    CYS  25           H        CYS  25   2.439   2.165   1.753
  211    HA   CYS  25           HA       CYS  25   0.073   0.879   2.982
  212   1HB   CYS  25          1HB       CYS  25   0.953   0.901   0.092
  213   2HB   CYS  25          2HB       CYS  25  -0.556   0.267   0.735
  214    H    TYR  26           H        TYR  26   1.672  -0.380   4.345
  215    HA   TYR  26           HA       TYR  26   3.331  -2.373   3.076
  216   1HB   TYR  26          1HB       TYR  26   3.808  -1.429   5.292
  217   2HB   TYR  26          2HB       TYR  26   2.274  -1.964   5.884
  218    HD1  TYR  26           HD1      TYR  26   4.634  -4.064   3.817
  219    HD2  TYR  26           HD2      TYR  26   3.135  -3.225   7.763
  220    HE1  TYR  26           HE1      TYR  26   5.238  -6.342   4.526
  221    HE2  TYR  26           HE2      TYR  26   3.728  -5.518   8.478
  222    HH   TYR  26           HH       TYR  26   4.566  -7.573   7.825
  223    H    VAL  27           H        VAL  27   2.736  -4.482   2.487
  224    HA   VAL  27           HA       VAL  27   0.112  -5.490   3.422
  225    HB   VAL  27           HB       VAL  27   1.047  -5.908   0.553
  226   1HG1  VAL  27          1HG1      VAL  27  -0.615  -7.528   1.537
  227   2HG1  VAL  27          2HG1      VAL  27  -1.678  -6.170   1.912
  228   3HG1  VAL  27          3HG1      VAL  27  -1.287  -6.555   0.223
  229   1HG2  VAL  27          1HG2      VAL  27  -0.824  -3.778   1.588
  230   2HG2  VAL  27          2HG2      VAL  27   0.696  -3.547   0.690
  231   3HG2  VAL  27          3HG2      VAL  27  -0.685  -4.296  -0.119
  232    H    SER  28           H        SER  28   0.132  -7.763   3.734
  233    HA   SER  28           HA       SER  28   2.371  -9.297   2.800
  234   1HB   SER  28          1HB       SER  28   3.239  -9.907   5.067
  235   2HB   SER  28          2HB       SER  28   3.369  -8.177   4.850
  236    HG   SER  28           HG       SER  28   1.346  -7.985   5.953
  237    H    GLY  29           H        GLY  29   2.353 -11.564   4.045
  238   1HA   GLY  29          1HA       GLY  29   1.156 -13.383   4.804
  239   2HA   GLY  29          2HA       GLY  29  -0.351 -12.473   4.713
  240    H    PHE  30           H        PHE  30   0.499 -11.719   1.786
  241    HA   PHE  30           HA       PHE  30  -0.950 -13.935   0.568
  242   1HB   PHE  30          1HB       PHE  30  -1.092 -12.484  -1.354
  243   2HB   PHE  30          2HB       PHE  30  -1.504 -11.625   0.087
  244    HD1  PHE  30           HD1      PHE  30   1.012 -12.037  -2.565
  245    HD2  PHE  30           HD2      PHE  30  -0.127  -9.657   0.853
  246    HE1  PHE  30           HE1      PHE  30   2.922 -10.534  -2.978
  247    HE2  PHE  30           HE2      PHE  30   1.819  -8.194   0.453
  248    HZ   PHE  30           HZ       PHE  30   3.357  -8.671  -1.427
  249    H    HIS  31           H        HIS  31  -0.174 -14.595  -1.688
  250    HA   HIS  31           HA       HIS  31   2.571 -14.585  -2.467
  251   1HB   HIS  31          1HB       HIS  31   3.285 -16.743  -2.042
  252   2HB   HIS  31          2HB       HIS  31   2.651 -16.222  -0.495
  253    HD2  HIS  31           HD2      HIS  31   1.557 -18.381  -3.538
  254    HE1  HIS  31           HE1      HIS  31  -0.233 -19.940  -0.012
  255    HE2  HIS  31           HE2      HIS  31   0.031 -20.335  -2.524
  256    HA   PRO  32           HA       PRO  32   3.599 -15.911  -4.209
  257   1HB   PRO  32          1HB       PRO  32   4.095 -16.026  -6.870
  258   2HB   PRO  32          2HB       PRO  32   3.282 -17.347  -6.026
  259   1HG   PRO  32          1HG       PRO  32   1.904 -15.068  -7.495
  260   2HG   PRO  32          2HG       PRO  32   1.745 -16.822  -7.813
  261   1HD   PRO  32          1HD       PRO  32   0.016 -15.543  -6.144
  262   2HD   PRO  32          2HD       PRO  32   0.607 -17.192  -5.793
  263    H    SER  33           H        SER  33   4.625 -14.276  -6.631
  264    HA   SER  33           HA       SER  33   4.899 -11.875  -5.102
  265   1HB   SER  33          1HB       SER  33   6.661 -11.417  -6.736
  266   2HB   SER  33          2HB       SER  33   6.728 -13.136  -6.292
  267    HG   SER  33           HG       SER  33   5.558 -12.052  -8.626
  268    H    ASP  34           H        ASP  34   2.728 -12.654  -7.691
  269    HA   ASP  34           HA       ASP  34   3.015 -10.137  -9.064
  270   1HB   ASP  34          1HB       ASP  34   2.571 -12.182 -10.254
  271   2HB   ASP  34          2HB       ASP  34   1.052 -12.430  -9.382
  272    H    ILE  35           H        ILE  35   2.599  -8.709  -7.240
  273    HA   ILE  35           HA       ILE  35  -0.294  -8.045  -7.082
  274    HB   ILE  35           HB       ILE  35   0.551  -8.956  -5.045
  275   1HG1  ILE  35          1HG1      ILE  35   0.087  -6.008  -4.544
  276   2HG1  ILE  35          2HG1      ILE  35  -1.196  -7.116  -4.993
  277   1HG2  ILE  35          1HG2      ILE  35   2.405  -6.601  -4.863
  278   2HG2  ILE  35          2HG2      ILE  35   2.160  -7.882  -3.649
  279   3HG2  ILE  35          3HG2      ILE  35   2.892  -8.292  -5.199
  280   1HD1  ILE  35          1HD1      ILE  35  -0.447  -8.582  -3.000
  281   2HD1  ILE  35          2HD1      ILE  35   0.469  -7.179  -2.465
  282   3HD1  ILE  35          3HD1      ILE  35  -1.282  -7.048  -2.647
  283    H    GLU  36           H        GLU  36  -0.919  -5.977  -7.027
  284    HA   GLU  36           HA       GLU  36   0.901  -3.903  -8.132
  285   1HB   GLU  36          1HB       GLU  36  -2.081  -3.966  -8.595
  286   2HB   GLU  36          2HB       GLU  36  -0.804  -3.165  -9.505
  287   1HG   GLU  36          1HG       GLU  36   0.043  -5.448 -10.168
  288   2HG   GLU  36          2HG       GLU  36  -1.362  -6.153  -9.379
  289    H    VAL  37           H        VAL  37   1.111  -2.159  -6.779
  290    HA   VAL  37           HA       VAL  37  -1.155  -1.290  -5.109
  291    HB   VAL  37           HB       VAL  37   1.630  -1.772  -3.985
  292   1HG1  VAL  37          1HG1      VAL  37   0.340   0.144  -2.880
  293   2HG1  VAL  37          2HG1      VAL  37  -0.902  -1.049  -2.453
  294   3HG1  VAL  37          3HG1      VAL  37   0.739  -1.213  -1.819
  295   1HG2  VAL  37          1HG2      VAL  37   0.562  -3.904  -4.240
  296   2HG2  VAL  37          2HG2      VAL  37   0.358  -3.459  -2.538
  297   3HG2  VAL  37          3HG2      VAL  37  -0.999  -3.281  -3.648
  298    H    ASP  38           H        ASP  38  -1.138   0.073  -7.049
  299    HA   ASP  38           HA       ASP  38   0.870   2.197  -7.139
  300   1HB   ASP  38          1HB       ASP  38  -1.805   2.177  -8.602
  301   2HB   ASP  38          2HB       ASP  38  -0.338   3.067  -8.968
  302    H    LEU  39           H        LEU  39   0.674   4.196  -6.199
  303    HA   LEU  39           HA       LEU  39  -1.491   4.570  -4.233
  304   1HB   LEU  39          1HB       LEU  39   1.099   6.026  -4.807
  305   2HB   LEU  39          2HB       LEU  39  -0.084   6.527  -3.588
  306    HG   LEU  39           HG       LEU  39   0.383   3.708  -3.211
  307   1HD1  LEU  39          1HD1      LEU  39   2.946   5.284  -3.511
  308   2HD1  LEU  39          2HD1      LEU  39   2.803   3.719  -2.679
  309   3HD1  LEU  39          3HD1      LEU  39   2.435   3.829  -4.410
  310   1HD2  LEU  39          1HD2      LEU  39  -0.281   5.355  -1.495
  311   2HD2  LEU  39          2HD2      LEU  39   1.200   4.494  -1.003
  312   3HD2  LEU  39          3HD2      LEU  39   1.290   6.144  -1.651
  313    H    LEU  40           H        LEU  40  -3.094   6.016  -4.430
  314    HA   LEU  40           HA       LEU  40  -3.343   7.545  -6.956
  315   1HB   LEU  40          1HB       LEU  40  -4.130   4.979  -6.862
  316   2HB   LEU  40          2HB       LEU  40  -5.515   5.675  -6.043
  317    HG   LEU  40           HG       LEU  40  -6.014   5.414  -8.356
  318   1HD1  LEU  40          1HD1      LEU  40  -6.838   7.542  -7.289
  319   2HD1  LEU  40          2HD1      LEU  40  -5.443   8.390  -7.994
  320   3HD1  LEU  40          3HD1      LEU  40  -6.649   7.642  -9.051
  321   1HD2  LEU  40          1HD2      LEU  40  -3.571   5.407  -9.083
  322   2HD2  LEU  40          2HD2      LEU  40  -4.702   6.242 -10.172
  323   3HD2  LEU  40          3HD2      LEU  40  -3.669   7.178  -9.093
  324    H    LYS  41           H        LYS  41  -3.877   9.608  -6.206
  325    HA   LYS  41           HA       LYS  41  -5.109   9.883  -3.604
  326   1HB   LYS  41          1HB       LYS  41  -4.358  11.930  -5.681
  327   2HB   LYS  41          2HB       LYS  41  -4.644  12.226  -3.945
  328   1HG   LYS  41          1HG       LYS  41  -2.702  11.211  -3.292
  329   2HG   LYS  41          2HG       LYS  41  -2.531  10.188  -4.702
  330   1HD   LYS  41          1HD       LYS  41  -0.919  11.941  -4.696
  331   2HD   LYS  41          2HD       LYS  41  -1.904  11.977  -6.134
  332   1HE   LYS  41          1HE       LYS  41  -3.040  13.903  -5.546
  333   2HE   LYS  41          2HE       LYS  41  -2.807  13.654  -3.810
  334   1HZ   LYS  41          1HZ       LYS  41  -0.548  14.277  -4.020
  335   2HZ   LYS  41          2HZ       LYS  41  -0.678  14.442  -5.665
  336   3HZ   LYS  41          3HZ       LYS  41  -1.491  15.470  -4.659
  337    H    ASN  42           H        ASN  42  -6.391  12.445  -4.988
  338    HA   ASN  42           HA       ASN  42  -9.127  11.556  -4.988
  339   1HB   ASN  42          1HB       ASN  42  -9.656  13.804  -5.543
  340   2HB   ASN  42          2HB       ASN  42  -8.253  13.926  -4.480
  341   1HD2  ASN  42          2HD2      ASN  42  -6.017  13.927  -5.790
  342   2HD2  ASN  42          1HD2      ASN  42  -6.016  14.877  -7.254
  343    H    GLY  43           H        GLY  43  -6.684  12.068  -7.505
  344   1HA   GLY  43          1HA       GLY  43  -7.715  10.032  -9.160
  345   2HA   GLY  43          2HA       GLY  43  -8.264  11.592  -9.814
  346    H    GLU  44           H        GLU  44  -5.236  10.784  -8.087
  347    HA   GLU  44           HA       GLU  44  -3.602  11.474 -10.495
  348   1HB   GLU  44          1HB       GLU  44  -3.816  13.449  -9.098
  349   2HB   GLU  44          2HB       GLU  44  -3.404  12.520  -7.661
  350   1HG   GLU  44          1HG       GLU  44  -1.118  12.063  -8.711
  351   2HG   GLU  44          2HG       GLU  44  -1.574  13.172 -10.011
  352    H    ARG  45           H        ARG  45  -2.306   9.854 -10.937
  353    HA   ARG  45           HA       ARG  45  -1.586   7.731  -9.048
  354   1HB   ARG  45          1HB       ARG  45  -2.068   7.107 -11.325
  355   2HB   ARG  45          2HB       ARG  45  -0.967   8.343 -11.960
  356   1HG   ARG  45          1HG       ARG  45   0.978   7.171 -11.101
  357   2HG   ARG  45          2HG       ARG  45  -0.045   5.962 -10.293
  358   1HD   ARG  45          1HD       ARG  45  -0.760   5.056 -12.405
  359   2HD   ARG  45          2HD       ARG  45  -0.180   6.472 -13.290
  360    HE   ARG  45           HE       ARG  45   1.969   5.667 -13.334
  361   1HH1  ARG  45          1HH2      ARG  45   0.084   3.714 -11.051
  362   2HH1  ARG  45          2HH2      ARG  45   1.331   2.518 -10.848
  363   1HH2  ARG  45          1HH1      ARG  45   3.593   4.161 -13.046
  364   2HH2  ARG  45          2HH1      ARG  45   3.369   2.777 -11.987
  365    H    ILE  46           H        ILE  46   0.182   7.783  -7.738
  366    HA   ILE  46           HA       ILE  46   2.158   9.894  -8.063
  367    HB   ILE  46           HB       ILE  46   1.703   7.777  -5.930
  368   1HG1  ILE  46          1HG1      ILE  46   0.462  10.537  -6.189
  369   2HG1  ILE  46          2HG1      ILE  46  -0.375   8.980  -6.056
  370   1HG2  ILE  46          1HG2      ILE  46   3.090  10.463  -5.877
  371   2HG2  ILE  46          2HG2      ILE  46   3.028   9.259  -4.553
  372   3HG2  ILE  46          3HG2      ILE  46   3.916   8.889  -6.032
  373   1HD1  ILE  46          1HD1      ILE  46   0.858   8.725  -3.770
  374   2HD1  ILE  46          2HD1      ILE  46   1.126  10.479  -3.960
  375   3HD1  ILE  46          3HD1      ILE  46  -0.521   9.810  -3.891
  376    H    GLU  47           H        GLU  47   3.438   9.110  -9.865
  377    HA   GLU  47           HA       GLU  47   4.489   6.394  -9.770
  378   1HB   GLU  47          1HB       GLU  47   3.600   7.642 -11.769
  379   2HB   GLU  47          2HB       GLU  47   5.064   8.634 -11.746
  380   1HG   GLU  47          1HG       GLU  47   6.430   6.753 -12.204
  381   2HG   GLU  47          2HG       GLU  47   5.162   5.590 -11.780
  382    H    LYS  48           H        LYS  48   5.210   7.533  -7.481
  383    HA   LYS  48           HA       LYS  48   8.143   7.655  -7.643
  384   1HB   LYS  48          1HB       LYS  48   6.468   9.814  -6.274
  385   2HB   LYS  48          2HB       LYS  48   8.200   9.546  -6.001
  386   1HG   LYS  48          1HG       LYS  48   8.643   9.954  -8.416
  387   2HG   LYS  48          2HG       LYS  48   6.921  10.335  -8.647
  388   1HD   LYS  48          1HD       LYS  48   7.078  12.152  -6.990
  389   2HD   LYS  48          2HD       LYS  48   8.802  11.798  -6.746
  390   1HE   LYS  48          1HE       LYS  48   9.267  12.322  -9.115
  391   2HE   LYS  48          2HE       LYS  48   7.540  12.620  -9.404
  392   1HZ   LYS  48          1HZ       LYS  48   9.240  14.140  -7.554
  393   2HZ   LYS  48          2HZ       LYS  48   8.758  14.638  -9.049
  394   3HZ   LYS  48          3HZ       LYS  48   7.644  14.420  -7.855
  395    H    VAL  49           H        VAL  49   7.134   5.469  -7.087
  396    HA   VAL  49           HA       VAL  49   6.646   5.190  -4.162
  397    HB   VAL  49           HB       VAL  49   6.356   3.032  -6.284
  398   1HG1  VAL  49          1HG1      VAL  49   6.465   2.315  -3.921
  399   2HG1  VAL  49          2HG1      VAL  49   5.140   3.421  -3.515
  400   3HG1  VAL  49          3HG1      VAL  49   4.853   2.041  -4.597
  401   1HG2  VAL  49          1HG2      VAL  49   4.267   5.067  -5.441
  402   2HG2  VAL  49          2HG2      VAL  49   4.877   4.756  -7.080
  403   3HG2  VAL  49          3HG2      VAL  49   3.906   3.528  -6.267
  404    H    GLU  50           H        GLU  50   8.421   4.515  -2.952
  405    HA   GLU  50           HA       GLU  50  10.464   2.845  -4.328
  406   1HB   GLU  50          1HB       GLU  50  11.306   4.973  -3.267
  407   2HB   GLU  50          2HB       GLU  50  10.739   4.344  -1.709
  408   1HG   GLU  50          1HG       GLU  50  13.163   4.015  -2.109
  409   2HG   GLU  50          2HG       GLU  50  12.319   2.487  -1.835
  410    H    HIS  51           H        HIS  51  11.111   0.927  -3.071
  411    HA   HIS  51           HA       HIS  51   9.091   0.060  -1.087
  412   1HB   HIS  51          1HB       HIS  51   8.616  -1.995  -2.299
  413   2HB   HIS  51          2HB       HIS  51   8.229  -0.610  -3.320
  414    HD2  HIS  51           HD2      HIS  51   9.979  -0.213  -5.525
  415    HE1  HIS  51           HE1      HIS  51  11.841  -3.995  -5.141
  416    HE2  HIS  51           HE2      HIS  51  11.548  -1.972  -6.672
  417    H    SER  52           H        SER  52   9.692  -1.613   0.224
  418    HA   SER  52           HA       SER  52  12.576  -1.759   0.699
  419   1HB   SER  52          1HB       SER  52  10.860  -1.432   2.510
  420   2HB   SER  52          2HB       SER  52  10.321  -3.098   2.236
  421    HG   SER  52           HG       SER  52  11.901  -2.940   3.888
  422    H    ASP  53           H        ASP  53  12.628  -2.811  -1.577
  423    HA   ASP  53           HA       ASP  53  13.001  -4.572  -2.924
  424   1HB   ASP  53          1HB       ASP  53  14.757  -4.693  -1.051
  425   2HB   ASP  53          2HB       ASP  53  13.853  -6.068  -0.418
  426    H    LEU  54           H        LEU  54  12.819  -7.485  -1.978
  427    HA   LEU  54           HA       LEU  54   9.912  -7.761  -1.481
  428   1HB   LEU  54          1HB       LEU  54  10.593  -8.473  -3.825
  429   2HB   LEU  54          2HB       LEU  54  11.646  -9.683  -3.096
  430    HG   LEU  54           HG       LEU  54   9.587 -10.732  -3.812
  431   1HD1  LEU  54          1HD1      LEU  54  10.617 -11.396  -1.571
  432   2HD1  LEU  54          2HD1      LEU  54   9.161 -10.629  -0.858
  433   3HD1  LEU  54          3HD1      LEU  54   9.001 -11.953  -1.999
  434   1HD2  LEU  54          1HD2      LEU  54   8.068  -8.726  -2.134
  435   2HD2  LEU  54          2HD2      LEU  54   8.099  -8.829  -3.911
  436   3HD2  LEU  54          3HD2      LEU  54   7.365 -10.098  -2.926
  437    H    SER  55           H        SER  55   9.607  -8.679   0.457
  438    HA   SER  55           HA       SER  55  11.833 -10.191   1.773
  439   1HB   SER  55          1HB       SER  55  11.652  -7.907   2.711
  440   2HB   SER  55          2HB       SER  55   9.934  -8.185   3.048
  441    HG   SER  55           HG       SER  55  12.176  -9.554   4.130
  442    H    PHE  56           H        PHE  56  10.861 -12.141   1.017
  443    HA   PHE  56           HA       PHE  56   8.092 -12.729   1.832
  444   1HB   PHE  56          1HB       PHE  56   8.239 -14.670   0.602
  445   2HB   PHE  56          2HB       PHE  56   8.961 -13.414  -0.369
  446    HD1  PHE  56           HD1      PHE  56  11.624 -13.314  -0.336
  447    HD2  PHE  56           HD2      PHE  56   9.174 -16.723   0.588
  448    HE1  PHE  56           HE1      PHE  56  13.500 -14.818  -0.934
  449    HE2  PHE  56           HE2      PHE  56  11.026 -18.238  -0.076
  450    HZ   PHE  56           HZ       PHE  56  13.199 -17.284  -0.824
  451    H    SER  57           H        SER  57  10.582 -12.375   3.737
  452    HA   SER  57           HA       SER  57  11.426 -13.220   5.607
  453   1HB   SER  57          1HB       SER  57   9.163 -12.737   6.297
  454   2HB   SER  57          2HB       SER  57   8.637 -14.390   5.918
  455    HG   SER  57           HG       SER  57  10.165 -15.090   7.479
  456    H    LYS  58           H        LYS  58  12.519 -14.807   3.775
  457    HA   LYS  58           HA       LYS  58  12.036 -16.825   2.374
  458   1HB   LYS  58          1HB       LYS  58  14.265 -16.239   3.609
  459   2HB   LYS  58          2HB       LYS  58  13.791 -17.452   4.807
  460   1HG   LYS  58          1HG       LYS  58  13.867 -19.201   3.055
  461   2HG   LYS  58          2HG       LYS  58  14.165 -17.967   1.814
  462   1HD   LYS  58          1HD       LYS  58  16.301 -17.383   2.810
  463   2HD   LYS  58          2HD       LYS  58  16.005 -18.448   4.199
  464   1HE   LYS  58          1HE       LYS  58  16.045 -20.426   2.735
  465   2HE   LYS  58          2HE       LYS  58  16.246 -19.392   1.307
  466   1HZ   LYS  58          1HZ       LYS  58  18.152 -19.650   3.526
  467   2HZ   LYS  58          2HZ       LYS  58  18.319 -20.284   2.014
  468   3HZ   LYS  58          3HZ       LYS  58  18.332 -18.652   2.226
  469    H    ASP  59           H        ASP  59   9.697 -16.719   3.488
  470    HA   ASP  59           HA       ASP  59   9.179 -19.330   4.734
  471   1HB   ASP  59          1HB       ASP  59   8.573 -17.174   5.801
  472   2HB   ASP  59          2HB       ASP  59   7.470 -16.844   4.462
  473    H    TRP  60           H        TRP  60   6.648 -19.898   4.133
  474    HA   TRP  60           HA       TRP  60   6.245 -20.333   1.299
  475   1HB   TRP  60          1HB       TRP  60   4.280 -20.466   3.604
  476   2HB   TRP  60          2HB       TRP  60   4.072 -21.147   1.991
  477    HD1  TRP  60           HD1      TRP  60   6.039 -21.662   5.224
  478    HE1  TRP  60           HE1      TRP  60   6.917 -24.091   5.346
  479    HE3  TRP  60           HE3      TRP  60   4.687 -23.267   0.553
  480    HZ2  TRP  60           HZ2      TRP  60   7.054 -26.377   3.639
  481    HZ3  TRP  60           HZ3      TRP  60   5.221 -25.572  -0.173
  482    HH2  TRP  60           HH2      TRP  60   6.418 -27.127   1.350
  483    H    SER  61           H        SER  61   5.376 -17.890   3.737
  484    HA   SER  61           HA       SER  61   3.418 -16.458   2.229
  485   1HB   SER  61          1HB       SER  61   3.769 -16.387   4.721
  486   2HB   SER  61          2HB       SER  61   5.248 -15.445   4.443
  487    HG   SER  61           HG       SER  61   3.403 -14.149   4.862
  488    H    PHE  62           H        PHE  62   4.123 -13.869   2.151
  489    HA   PHE  62           HA       PHE  62   6.477 -13.308   0.592
  490   1HB   PHE  62          1HB       PHE  62   4.472 -14.629  -0.809
  491   2HB   PHE  62          2HB       PHE  62   4.084 -12.945  -1.118
  492    HD1  PHE  62           HD1      PHE  62   6.755 -15.540  -1.305
  493    HD2  PHE  62           HD2      PHE  62   5.531 -11.615  -2.646
  494    HE1  PHE  62           HE1      PHE  62   8.484 -15.600  -3.003
  495    HE2  PHE  62           HE2      PHE  62   7.218 -11.719  -4.395
  496    HZ   PHE  62           HZ       PHE  62   8.729 -13.689  -4.613
  497    H    TYR  63           H        TYR  63   6.762 -11.001   0.762
  498    HA   TYR  63           HA       TYR  63   4.421  -9.313   0.756
  499   1HB   TYR  63          1HB       TYR  63   4.738  -8.303   2.992
  500   2HB   TYR  63          2HB       TYR  63   4.267 -10.001   3.047
  501    HD1  TYR  63           HD1      TYR  63   7.018  -7.679   3.649
  502    HD2  TYR  63           HD2      TYR  63   5.499 -11.686   4.111
  503    HE1  TYR  63           HE1      TYR  63   8.638  -8.066   5.454
  504    HE2  TYR  63           HE2      TYR  63   7.051 -12.065   5.967
  505    HH   TYR  63           HH       TYR  63   8.668 -11.100   7.389
  506    H    LEU  64           H        LEU  64   5.082  -7.007   1.376
  507    HA   LEU  64           HA       LEU  64   7.764  -6.183   1.174
  508   1HB   LEU  64          1HB       LEU  64   7.854  -5.149  -1.004
  509   2HB   LEU  64          2HB       LEU  64   7.669  -6.877  -1.162
  510    HG   LEU  64           HG       LEU  64   5.605  -4.724  -1.676
  511   1HD1  LEU  64          1HD1      LEU  64   6.660  -6.920  -3.513
  512   2HD1  LEU  64          2HD1      LEU  64   5.545  -5.635  -3.958
  513   3HD1  LEU  64          3HD1      LEU  64   7.218  -5.226  -3.547
  514   1HD2  LEU  64          1HD2      LEU  64   5.288  -7.735  -1.599
  515   2HD2  LEU  64          2HD2      LEU  64   4.260  -6.518  -0.769
  516   3HD2  LEU  64          3HD2      LEU  64   4.187  -6.722  -2.525
  517    H    LEU  65           H        LEU  65   7.962  -3.938   1.405
  518    HA   LEU  65           HA       LEU  65   5.505  -2.532   2.284
  519   1HB   LEU  65          1HB       LEU  65   7.721  -3.067   3.685
  520   2HB   LEU  65          2HB       LEU  65   8.348  -1.668   2.806
  521    HG   LEU  65           HG       LEU  65   5.957  -1.813   4.689
  522   1HD1  LEU  65          1HD1      LEU  65   8.648  -0.409   4.808
  523   2HD1  LEU  65          2HD1      LEU  65   7.360  -0.243   6.013
  524   3HD1  LEU  65          3HD1      LEU  65   8.137  -1.817   5.756
  525   1HD2  LEU  65          1HD2      LEU  65   6.821   0.346   2.766
  526   2HD2  LEU  65          2HD2      LEU  65   5.185  -0.219   3.146
  527   3HD2  LEU  65          3HD2      LEU  65   6.063   0.783   4.307
  528    H    TYR  66           H        TYR  66   4.904  -0.700   1.118
  529    HA   TYR  66           HA       TYR  66   6.641   0.184  -1.130
  530   1HB   TYR  66          1HB       TYR  66   3.635   0.039  -1.452
  531   2HB   TYR  66          2HB       TYR  66   4.891   0.007  -2.664
  532    HD1  TYR  66           HD1      TYR  66   3.732  -2.156   0.280
  533    HD2  TYR  66           HD2      TYR  66   4.782  -2.001  -3.919
  534    HE1  TYR  66           HE1      TYR  66   2.674  -4.312  -0.067
  535    HE2  TYR  66           HE2      TYR  66   3.556  -4.120  -4.261
  536    HH   TYR  66           HH       TYR  66   1.710  -5.685  -1.629
  537    H    TYR  67           H        TYR  67   7.213   2.102  -0.225
  538    HA   TYR  67           HA       TYR  67   5.066   3.840   0.848
  539   1HB   TYR  67          1HB       TYR  67   7.062   4.944   1.989
  540   2HB   TYR  67          2HB       TYR  67   6.315   3.481   2.556
  541    HD1  TYR  67           HD1      TYR  67   8.999   4.205  -0.023
  542    HD2  TYR  67           HD2      TYR  67   7.891   2.113   3.566
  543    HE1  TYR  67           HE1      TYR  67  11.093   2.905  -0.113
  544    HE2  TYR  67           HE2      TYR  67   9.932   0.731   3.393
  545    HH   TYR  67           HH       TYR  67  11.915   0.353   2.238
  546    H    THR  68           H        THR  68   4.985   5.926   0.486
  547    HA   THR  68           HA       THR  68   6.835   7.252  -1.481
  548    HB   THR  68           HB       THR  68   4.797   6.610  -2.536
  549    HG1  THR  68           HG1      THR  68   5.882   8.337  -3.325
  550   1HG2  THR  68          1HG2      THR  68   2.726   7.828  -2.124
  551   2HG2  THR  68          2HG2      THR  68   3.187   6.891  -0.681
  552   3HG2  THR  68          3HG2      THR  68   3.424   8.655  -0.730
  553    H    GLU  69           H        GLU  69   7.255   9.549  -0.973
  554    HA   GLU  69           HA       GLU  69   6.865  10.368   1.809
  555   1HB   GLU  69          1HB       GLU  69   8.258  12.316   1.082
  556   2HB   GLU  69          2HB       GLU  69   9.023  10.732   0.955
  557   1HG   GLU  69          1HG       GLU  69   8.868  10.683  -1.419
  558   2HG   GLU  69          2HG       GLU  69   7.711  12.019  -1.467
  559    H    PHE  70           H        PHE  70   4.404  10.404   1.487
  560    HA   PHE  70           HA       PHE  70   3.374  12.291  -0.384
  561   1HB   PHE  70          1HB       PHE  70   1.260  11.840   0.321
  562   2HB   PHE  70          2HB       PHE  70   2.107  10.287   0.313
  563    HD1  PHE  70           HD1      PHE  70  -0.632  10.920   1.549
  564    HD2  PHE  70           HD2      PHE  70   3.298  11.153   3.312
  565    HE1  PHE  70           HE1      PHE  70  -1.253   9.329   3.301
  566    HE2  PHE  70           HE2      PHE  70   2.385  10.195   5.398
  567    HZ   PHE  70           HZ       PHE  70   0.177   9.079   5.325
  568    H    THR  71           H        THR  71   2.502  14.168  -0.217
  569    HA   THR  71           HA       THR  71   2.847  15.807   2.255
  570    HB   THR  71           HB       THR  71   2.978  16.566  -0.638
  571    HG1  THR  71           HG1      THR  71   5.165  16.686  -0.149
  572   1HG2  THR  71          1HG2      THR  71   3.549  18.106   1.940
  573   2HG2  THR  71          2HG2      THR  71   3.915  18.671   0.298
  574   3HG2  THR  71          3HG2      THR  71   2.229  18.446   0.797
  575    HA   PRO  72           HA       PRO  72  -1.712  15.476   1.379
  576   1HB   PRO  72          1HB       PRO  72  -2.704  15.745   3.919
  577   2HB   PRO  72          2HB       PRO  72  -1.967  14.245   3.299
  578   1HG   PRO  72          1HG       PRO  72  -0.625  16.394   4.951
  579   2HG   PRO  72          2HG       PRO  72  -0.622  14.630   5.232
  580   1HD   PRO  72          1HD       PRO  72   1.415  15.896   3.963
  581   2HD   PRO  72          2HD       PRO  72   0.880  14.263   3.442
  582    H    THR  73           H        THR  73  -1.828  17.421   0.173
  583    HA   THR  73           HA       THR  73  -1.835  20.012   1.547
  584    HB   THR  73           HB       THR  73  -2.171  20.984  -0.622
  585    HG1  THR  73           HG1      THR  73  -2.390  18.321  -1.555
  586   1HG2  THR  73          1HG2      THR  73  -0.103  20.315  -1.720
  587   2HG2  THR  73          2HG2      THR  73   0.141  20.371   0.038
  588   3HG2  THR  73          3HG2      THR  73  -0.042  18.810  -0.792
  589    H    GLU  74           H        GLU  74  -3.598  20.833   2.449
  590    HA   GLU  74           HA       GLU  74  -5.696  21.251   3.075
  591   1HB   GLU  74          1HB       GLU  74  -5.524  22.355   0.886
  592   2HB   GLU  74          2HB       GLU  74  -6.254  20.966   0.091
  593   1HG   GLU  74          1HG       GLU  74  -8.320  21.323   1.529
  594   2HG   GLU  74          2HG       GLU  74  -7.528  22.744   2.224
  595    H    LYS  75           H        LYS  75  -7.191  19.312   0.555
  596    HA   LYS  75           HA       LYS  75  -8.328  17.504   2.640
  597   1HB   LYS  75          1HB       LYS  75 -10.247  17.336   1.162
  598   2HB   LYS  75          2HB       LYS  75  -9.942  19.009   1.593
  599   1HG   LYS  75          1HG       LYS  75  -9.384  19.653  -0.512
  600   2HG   LYS  75          2HG       LYS  75  -8.590  18.142  -0.939
  601   1HD   LYS  75          1HD       LYS  75 -11.615  18.428  -0.756
  602   2HD   LYS  75          2HD       LYS  75 -10.663  18.653  -2.235
  603   1HE   LYS  75          1HE       LYS  75  -9.756  16.327  -1.999
  604   2HE   LYS  75          2HE       LYS  75 -10.827  16.070  -0.613
  605   1HZ   LYS  75          1HZ       LYS  75 -11.655  16.642  -3.362
  606   2HZ   LYS  75          2HZ       LYS  75 -11.765  15.208  -2.555
  607   3HZ   LYS  75          3HZ       LYS  75 -12.682  16.494  -2.074
  608    H    ASP  76           H        ASP  76  -5.726  17.161   1.011
  609    HA   ASP  76           HA       ASP  76  -6.075  15.398  -1.066
  610   1HB   ASP  76          1HB       ASP  76  -3.887  16.191   0.753
  611   2HB   ASP  76          2HB       ASP  76  -3.692  14.548   0.189
  612    H    GLU  77           H        GLU  77  -7.116  13.586  -1.211
  613    HA   GLU  77           HA       GLU  77  -7.533  11.802   1.090
  614   1HB   GLU  77          1HB       GLU  77  -9.384  11.024  -0.399
  615   2HB   GLU  77          2HB       GLU  77  -9.525  12.688   0.169
  616   1HG   GLU  77          1HG       GLU  77  -8.832  13.551  -2.019
  617   2HG   GLU  77          2HG       GLU  77  -8.536  11.906  -2.608
  618    H    TYR  78           H        TYR  78  -5.198  11.142   0.713
  619    HA   TYR  78           HA       TYR  78  -4.424   9.736  -1.632
  620   1HB   TYR  78          1HB       TYR  78  -3.335   9.972   1.142
  621   2HB   TYR  78          2HB       TYR  78  -2.751   8.685   0.104
  622    HD1  TYR  78           HD1      TYR  78  -0.736   9.159  -0.953
  623    HD2  TYR  78           HD2      TYR  78  -3.583  12.342  -0.362
  624    HE1  TYR  78           HE1      TYR  78   0.861  10.779  -1.876
  625    HE2  TYR  78           HE2      TYR  78  -2.076  13.894  -1.566
  626    HH   TYR  78           HH       TYR  78   1.171  12.908  -2.703
  627    H    ALA  79           H        ALA  79  -4.377   7.588  -2.141
  628    HA   ALA  79           HA       ALA  79  -5.487   5.614  -0.278
  629   1HB   ALA  79          1HB       ALA  79  -7.376   6.666  -1.723
  630   2HB   ALA  79          2HB       ALA  79  -6.620   5.851  -3.100
  631   3HB   ALA  79          3HB       ALA  79  -7.237   4.895  -1.752
  632    H    CYS  80           H        CYS  80  -5.362   3.429  -1.244
  633    HA   CYS  80           HA       CYS  80  -3.039   3.101  -3.090
  634   1HB   CYS  80          1HB       CYS  80  -3.345   2.202  -0.265
  635   2HB   CYS  80          2HB       CYS  80  -2.799   0.960  -1.399
  636    H    ARG  81           H        ARG  81  -3.432   1.836  -4.706
  637    HA   ARG  81           HA       ARG  81  -5.811   0.192  -4.980
  638   1HB   ARG  81          1HB       ARG  81  -4.653   1.011  -6.949
  639   2HB   ARG  81          2HB       ARG  81  -3.152   0.223  -6.437
  640   1HG   ARG  81          1HG       ARG  81  -4.200  -1.994  -6.633
  641   2HG   ARG  81          2HG       ARG  81  -5.738  -1.250  -7.080
  642   1HD   ARG  81          1HD       ARG  81  -3.130  -0.935  -8.616
  643   2HD   ARG  81          2HD       ARG  81  -4.361  -2.146  -9.009
  644    HE   ARG  81           HE       ARG  81  -5.875   0.060  -9.040
  645   1HH1  ARG  81          1HH2      ARG  81  -2.649  -0.353 -10.524
  646   2HH1  ARG  81          2HH2      ARG  81  -3.108   0.468 -11.988
  647   1HH2  ARG  81          1HH1      ARG  81  -6.374   1.256 -10.909
  648   2HH2  ARG  81          2HH1      ARG  81  -5.175   1.480 -12.158
  649    H    VAL  82           H        VAL  82  -6.058  -1.977  -4.300
  650    HA   VAL  82           HA       VAL  82  -3.605  -3.431  -3.429
  651    HB   VAL  82           HB       VAL  82  -6.364  -3.592  -2.153
  652   1HG1  VAL  82          1HG1      VAL  82  -4.973  -5.656  -2.129
  653   2HG1  VAL  82          2HG1      VAL  82  -3.667  -4.737  -1.345
  654   3HG1  VAL  82          3HG1      VAL  82  -5.227  -4.982  -0.517
  655   1HG2  VAL  82          1HG2      VAL  82  -5.393  -1.406  -1.575
  656   2HG2  VAL  82          2HG2      VAL  82  -5.373  -2.480  -0.195
  657   3HG2  VAL  82          3HG2      VAL  82  -3.870  -2.192  -1.101
  658    H    ASN  83           H        ASN  83  -3.327  -4.720  -5.203
  659    HA   ASN  83           HA       ASN  83  -5.586  -6.495  -5.942
  660   1HB   ASN  83          1HB       ASN  83  -5.510  -4.430  -7.420
  661   2HB   ASN  83          2HB       ASN  83  -3.982  -5.008  -8.042
  662   1HD2  ASN  83          2HD2      ASN  83  -4.392  -5.837 -10.087
  663   2HD2  ASN  83          1HD2      ASN  83  -5.698  -6.945 -10.456
  664    H    HIS  84           H        HIS  84  -4.399  -8.195  -4.898
  665    HA   HIS  84           HA       HIS  84  -1.750  -9.043  -5.943
  666   1HB   HIS  84          1HB       HIS  84  -2.330  -9.548  -3.640
  667   2HB   HIS  84          2HB       HIS  84  -3.780 -10.390  -4.157
  668    HD2  HIS  84           HD2      HIS  84   0.153 -10.901  -4.627
  669    HE1  HIS  84           HE1      HIS  84  -1.898 -14.583  -4.942
  670    HE2  HIS  84           HE2      HIS  84   0.438 -13.462  -4.919
  671    H    VAL  85           H        VAL  85  -1.742 -11.007  -7.387
  672    HA   VAL  85           HA       VAL  85  -3.567 -10.936  -9.463
  673    HB   VAL  85           HB       VAL  85  -1.378 -11.932  -9.624
  674   1HG1  VAL  85          1HG1      VAL  85  -2.484 -14.332  -8.095
  675   2HG1  VAL  85          2HG1      VAL  85  -0.928 -14.258  -8.937
  676   3HG1  VAL  85          3HG1      VAL  85  -1.216 -13.208  -7.545
  677   1HG2  VAL  85          1HG2      VAL  85  -3.127 -12.447 -11.309
  678   2HG2  VAL  85          2HG2      VAL  85  -1.909 -13.725 -11.155
  679   3HG2  VAL  85          3HG2      VAL  85  -3.512 -13.945 -10.431
  680    H    THR  86           H        THR  86  -3.906 -12.781  -6.445
  681    HA   THR  86           HA       THR  86  -6.034 -14.431  -7.440
  682    HB   THR  86           HB       THR  86  -4.422 -14.940  -5.595
  683    HG1  THR  86           HG1      THR  86  -6.255 -16.185  -6.128
  684   1HG2  THR  86          1HG2      THR  86  -6.503 -13.693  -3.787
  685   2HG2  THR  86          2HG2      THR  86  -4.873 -14.284  -3.382
  686   3HG2  THR  86          3HG2      THR  86  -5.082 -12.766  -4.289
  687    H    LEU  87           H        LEU  87  -6.006 -11.115  -6.204
  688    HA   LEU  87           HA       LEU  87  -8.862 -11.067  -5.586
  689   1HB   LEU  87          1HB       LEU  87  -6.732  -8.955  -6.019
  690   2HB   LEU  87          2HB       LEU  87  -8.435  -8.543  -6.032
  691    HG   LEU  87           HG       LEU  87  -8.814  -9.285  -3.810
  692   1HD1  LEU  87          1HD1      LEU  87  -7.359 -11.240  -3.620
  693   2HD1  LEU  87          2HD1      LEU  87  -5.918 -10.211  -3.778
  694   3HD1  LEU  87          3HD1      LEU  87  -6.966 -10.079  -2.352
  695   1HD2  LEU  87          1HD2      LEU  87  -6.239  -7.653  -3.943
  696   2HD2  LEU  87          2HD2      LEU  87  -7.879  -7.012  -4.184
  697   3HD2  LEU  87          3HD2      LEU  87  -7.405  -7.680  -2.611
  698    H    SER  88           H        SER  88 -10.473 -10.949  -7.000
  699    HA   SER  88           HA       SER  88 -10.070 -10.889  -9.862
  700   1HB   SER  88          1HB       SER  88 -11.913 -12.119  -8.760
  701   2HB   SER  88          2HB       SER  88 -12.598 -10.583  -8.186
  702    HG   SER  88           HG       SER  88 -12.153 -11.276 -10.905
  703    H    GLN  89           H        GLN  89 -10.608  -8.451  -7.338
  704    HA   GLN  89           HA       GLN  89 -10.983  -6.354  -9.383
  705   1HB   GLN  89          1HB       GLN  89 -13.061  -6.182  -8.656
  706   2HB   GLN  89          2HB       GLN  89 -12.790  -7.274  -7.296
  707   1HG   GLN  89          1HG       GLN  89 -11.945  -5.470  -5.909
  708   2HG   GLN  89          2HG       GLN  89 -12.065  -4.330  -7.270
  709   1HE2  GLN  89          2HE2      GLN  89 -13.275  -3.452  -5.115
  710   2HE2  GLN  89          1HE2      GLN  89 -15.011  -3.684  -5.167
  711    HA   PRO  90           HA       PRO  90  -7.664  -4.533  -6.880
  712   1HB   PRO  90          1HB       PRO  90  -7.498  -2.091  -8.119
  713   2HB   PRO  90          2HB       PRO  90  -6.949  -3.589  -8.922
  714   1HG   PRO  90          1HG       PRO  90  -9.578  -2.157  -9.295
  715   2HG   PRO  90          2HG       PRO  90  -8.471  -2.796 -10.540
  716   1HD   PRO  90          1HD       PRO  90 -10.671  -4.159  -9.637
  717   2HD   PRO  90          2HD       PRO  90  -9.181  -5.002 -10.169
  718    H    LYS  91           H        LYS  91  -8.513  -4.205  -4.810
  719    HA   LYS  91           HA       LYS  91 -10.795  -2.360  -4.449
  720   1HB   LYS  91          1HB       LYS  91 -10.926  -3.121  -2.211
  721   2HB   LYS  91          2HB       LYS  91 -10.847  -4.497  -3.316
  722   1HG   LYS  91          1HG       LYS  91  -8.383  -4.709  -2.738
  723   2HG   LYS  91          2HG       LYS  91  -8.643  -3.442  -1.511
  724   1HD   LYS  91          1HD       LYS  91 -10.390  -4.889  -0.445
  725   2HD   LYS  91          2HD       LYS  91 -10.051  -6.137  -1.655
  726   1HE   LYS  91          1HE       LYS  91  -8.868  -6.703   0.375
  727   2HE   LYS  91          2HE       LYS  91  -7.679  -6.246  -0.854
  728   1HZ   LYS  91          1HZ       LYS  91  -8.655  -4.500   1.294
  729   2HZ   LYS  91          2HZ       LYS  91  -7.209  -5.291   1.274
  730   3HZ   LYS  91          3HZ       LYS  91  -7.513  -4.108   0.170
  731    H    ILE  92           H        ILE  92 -10.455  -0.221  -4.135
  732    HA   ILE  92           HA       ILE  92  -7.707   0.676  -3.670
  733    HB   ILE  92           HB       ILE  92 -10.079   2.425  -4.318
  734   1HG1  ILE  92          1HG1      ILE  92 -10.166   0.768  -6.055
  735   2HG1  ILE  92          2HG1      ILE  92  -9.507   2.272  -6.682
  736   1HG2  ILE  92          1HG2      ILE  92  -8.017   3.500  -3.556
  737   2HG2  ILE  92          2HG2      ILE  92  -7.068   2.635  -4.773
  738   3HG2  ILE  92          3HG2      ILE  92  -8.283   3.830  -5.279
  739   1HD1  ILE  92          1HD1      ILE  92  -7.225   1.333  -6.636
  740   2HD1  ILE  92          2HD1      ILE  92  -7.854  -0.180  -5.936
  741   3HD1  ILE  92          3HD1      ILE  92  -8.325   0.306  -7.568
  742    H    VAL  93           H        VAL  93  -7.200   0.749  -1.502
  743    HA   VAL  93           HA       VAL  93  -9.265   1.447   0.492
  744    HB   VAL  93           HB       VAL  93  -6.403   0.470   0.810
  745   1HG1  VAL  93          1HG1      VAL  93  -7.108   1.769   2.776
  746   2HG1  VAL  93          2HG1      VAL  93  -8.656   0.900   2.829
  747   3HG1  VAL  93          3HG1      VAL  93  -7.137   0.048   3.169
  748   1HG2  VAL  93          1HG2      VAL  93  -9.096  -0.954   1.028
  749   2HG2  VAL  93          2HG2      VAL  93  -7.844  -1.252  -0.196
  750   3HG2  VAL  93          3HG2      VAL  93  -7.532  -1.651   1.498
  751    H    LYS  94           H        LYS  94  -9.567   3.541   0.949
  752    HA   LYS  94           HA       LYS  94  -7.601   5.615   0.499
  753   1HB   LYS  94          1HB       LYS  94 -10.269   5.561   1.934
  754   2HB   LYS  94          2HB       LYS  94  -9.275   7.014   1.766
  755   1HG   LYS  94          1HG       LYS  94  -9.308   6.876  -0.642
  756   2HG   LYS  94          2HG       LYS  94 -10.283   5.404  -0.634
  757   1HD   LYS  94          1HD       LYS  94 -11.254   7.998   0.654
  758   2HD   LYS  94          2HD       LYS  94 -11.347   7.742  -1.087
  759   1HE   LYS  94          1HE       LYS  94 -13.472   7.186  -0.140
  760   2HE   LYS  94          2HE       LYS  94 -12.721   5.720  -0.789
  761   1HZ   LYS  94          1HZ       LYS  94 -12.714   6.508   2.044
  762   2HZ   LYS  94          2HZ       LYS  94 -13.755   5.424   1.366
  763   3HZ   LYS  94          3HZ       LYS  94 -12.145   5.092   1.416
  764    H    TRP  95           H        TRP  95  -6.242   6.583   1.917
  765    HA   TRP  95           HA       TRP  95  -5.384   5.176   4.284
  766   1HB   TRP  95          1HB       TRP  95  -3.729   6.296   2.984
  767   2HB   TRP  95          2HB       TRP  95  -4.678   7.772   2.915
  768    HD1  TRP  95           HD1      TRP  95  -3.151   5.781   5.881
  769    HE1  TRP  95           HE1      TRP  95  -1.934   7.482   7.425
  770    HE3  TRP  95           HE3      TRP  95  -3.903  10.053   3.187
  771    HZ2  TRP  95           HZ2      TRP  95  -1.509  10.325   7.530
  772    HZ3  TRP  95           HZ3      TRP  95  -2.657  12.086   3.798
  773    HH2  TRP  95           HH2      TRP  95  -1.575  12.290   6.000
  774    H    ASP  96           H        ASP  96  -6.185   5.381   6.286
  775    HA   ASP  96           HA       ASP  96  -7.665   7.830   7.113
  776   1HB   ASP  96          1HB       ASP  96  -8.698   5.603   7.598
  777   2HB   ASP  96          2HB       ASP  96  -7.281   5.202   8.587
  778    H    ARG  97           H        ARG  97  -6.827   9.083   8.771
  779    HA   ARG  97           HA       ARG  97  -4.011   9.381   8.823
  780   1HB   ARG  97          1HB       ARG  97  -6.129  10.535  10.677
  781   2HB   ARG  97          2HB       ARG  97  -4.448  11.078  10.564
  782   1HG   ARG  97          1HG       ARG  97  -4.774  11.713   8.197
  783   2HG   ARG  97          2HG       ARG  97  -6.452  11.146   8.260
  784   1HD   ARG  97          1HD       ARG  97  -6.423  13.553   8.536
  785   2HD   ARG  97          2HD       ARG  97  -6.958  12.774  10.040
  786    HE   ARG  97           HE       ARG  97  -4.099  13.248   9.991
  787   1HH1  ARG  97          1HH2      ARG  97  -7.206  14.852  10.600
  788   2HH1  ARG  97          2HH2      ARG  97  -6.520  16.059  11.656
  789   1HH2  ARG  97          1HH1      ARG  97  -3.200  14.868  11.340
  790   2HH2  ARG  97          2HH1      ARG  97  -4.231  16.062  12.081
  791    H    ASP  98           H        ASP  98  -6.088   7.441  10.859
  792    HA   ASP  98           HA       ASP  98  -5.844   6.306  12.762
  793   1HB   ASP  98          1HB       ASP  98  -4.301   5.052  11.366
  794   2HB   ASP  98          2HB       ASP  98  -2.982   6.145  11.782
  795    H    MET  99           H        MET  99  -6.390   8.423  13.718
  796    HA   MET  99           HA       MET  99  -4.400   9.275  15.755
  797   1HB   MET  99          1HB       MET  99  -6.133  11.091  14.011
  798   2HB   MET  99          2HB       MET  99  -5.199  11.620  15.419
  799   1HG   MET  99          1HG       MET  99  -4.027  10.408  12.891
  800   2HG   MET  99          2HG       MET  99  -4.076  12.124  13.281
  801   1HE   MET  99          1HE       MET  99  -1.561  10.295  12.415
  802   2HE   MET  99          2HE       MET  99  -1.431  12.057  12.640
  803   3HE   MET  99          3HE       MET  99  -0.285  10.959  13.456
  Start of MODEL   20
    1   1H    MET   0          1H        MET   0  -7.083 -20.272  -6.392
    2   2H    MET   0          2H        MET   0  -6.526 -19.808  -4.912
    3   3H    MET   0          3H        MET   0  -5.485 -19.924  -6.182
    4    HA   MET   0           HA       MET   0  -6.933 -22.137  -4.928
    5   1HB   MET   0          1HB       MET   0  -4.909 -22.173  -7.199
    6   2HB   MET   0          2HB       MET   0  -5.566 -23.597  -6.370
    7   1HG   MET   0          1HG       MET   0  -7.886 -22.771  -7.040
    8   2HG   MET   0          2HG       MET   0  -7.081 -21.598  -8.091
    9   1HE   MET   0          1HE       MET   0  -5.558 -22.214 -10.090
   10   2HE   MET   0          2HE       MET   0  -4.559 -23.418  -9.237
   11   3HE   MET   0          3HE       MET   0  -5.367 -23.850 -10.758
   12    H    ILE   1           H        ILE   1  -6.138 -22.239  -2.903
   13    HA   ILE   1           HA       ILE   1  -4.783 -22.397  -1.158
   14    HB   ILE   1           HB       ILE   1  -2.602 -23.287  -3.057
   15   1HG1  ILE   1          1HG1      ILE   1  -4.615 -24.563  -3.657
   16   2HG1  ILE   1          2HG1      ILE   1  -3.396 -25.562  -2.896
   17   1HG2  ILE   1          1HG2      ILE   1  -3.106 -23.741  -0.109
   18   2HG2  ILE   1          2HG2      ILE   1  -2.165 -24.903  -1.062
   19   3HG2  ILE   1          3HG2      ILE   1  -1.611 -23.247  -0.934
   20   1HD1  ILE   1          1HD1      ILE   1  -4.642 -25.485  -0.741
   21   2HD1  ILE   1          2HD1      ILE   1  -5.896 -24.490  -1.520
   22   3HD1  ILE   1          3HD1      ILE   1  -5.606 -26.151  -2.068
   23    H    GLN   2           H        GLN   2  -4.826 -19.857  -2.757
   24    HA   GLN   2           HA       GLN   2  -2.228 -18.589  -2.117
   25   1HB   GLN   2          1HB       GLN   2  -4.666 -17.775  -3.700
   26   2HB   GLN   2          2HB       GLN   2  -3.333 -16.662  -3.342
   27   1HG   GLN   2          1HG       GLN   2  -1.742 -17.955  -4.537
   28   2HG   GLN   2          2HG       GLN   2  -2.789 -19.364  -4.617
   29   1HE2  GLN   2          2HE2      GLN   2  -1.991 -16.314  -6.104
   30   2HE2  GLN   2          1HE2      GLN   2  -3.081 -16.466  -7.466
   31    H    ARG   3           H        ARG   3  -1.979 -17.254  -0.395
   32    HA   ARG   3           HA       ARG   3  -4.138 -16.888   1.527
   33   1HB   ARG   3          1HB       ARG   3  -1.224 -16.145   1.376
   34   2HB   ARG   3          2HB       ARG   3  -2.277 -15.392   2.584
   35   1HG   ARG   3          1HG       ARG   3  -1.111 -17.277   3.532
   36   2HG   ARG   3          2HG       ARG   3  -2.856 -17.570   3.525
   37   1HD   ARG   3          1HD       ARG   3  -2.658 -19.078   1.628
   38   2HD   ARG   3          2HD       ARG   3  -0.941 -18.645   1.411
   39    HE   ARG   3           HE       ARG   3  -1.209 -19.569   4.033
   40   1HH1  ARG   3          1HH2      ARG   3  -1.634 -20.930   0.754
   41   2HH1  ARG   3          2HH2      ARG   3  -1.197 -22.538   1.261
   42   1HH2  ARG   3          1HH1      ARG   3  -0.588 -21.668   4.630
   43   2HH2  ARG   3          2HH1      ARG   3  -0.579 -22.961   3.457
   44    H    THR   4           H        THR   4  -5.173 -15.005   2.049
   45    HA   THR   4           HA       THR   4  -5.551 -13.035   0.017
   46    HB   THR   4           HB       THR   4  -7.341 -13.701   1.494
   47    HG1  THR   4           HG1      THR   4  -6.646 -10.983   1.871
   48   1HG2  THR   4          1HG2      THR   4  -5.853 -12.245   3.723
   49   2HG2  THR   4          2HG2      THR   4  -7.484 -12.933   3.801
   50   3HG2  THR   4          3HG2      THR   4  -6.085 -14.007   3.621
   51    HA   PRO   5           HA       PRO   5  -2.272 -10.234   1.341
   52   1HB   PRO   5          1HB       PRO   5  -3.111  -7.854   0.265
   53   2HB   PRO   5          2HB       PRO   5  -2.418  -9.186  -0.705
   54   1HG   PRO   5          1HG       PRO   5  -5.336  -8.532  -0.250
   55   2HG   PRO   5          2HG       PRO   5  -4.517  -8.888  -1.797
   56   1HD   PRO   5          1HD       PRO   5  -5.907 -10.788  -0.437
   57   2HD   PRO   5          2HD       PRO   5  -4.398 -11.207  -1.291
   58    H    LYS   6           H        LYS   6  -2.146  -9.825   3.449
   59    HA   LYS   6           HA       LYS   6  -4.273  -8.473   4.953
   60   1HB   LYS   6          1HB       LYS   6  -2.847 -10.412   5.809
   61   2HB   LYS   6          2HB       LYS   6  -1.490  -9.272   5.871
   62   1HG   LYS   6          1HG       LYS   6  -3.113  -7.762   7.247
   63   2HG   LYS   6          2HG       LYS   6  -4.115  -9.210   7.404
   64   1HD   LYS   6          1HD       LYS   6  -1.199  -8.918   8.276
   65   2HD   LYS   6          2HD       LYS   6  -2.611  -8.896   9.346
   66   1HE   LYS   6          1HE       LYS   6  -3.165 -11.233   8.629
   67   2HE   LYS   6          2HE       LYS   6  -1.687 -11.264   7.645
   68   1HZ   LYS   6          1HZ       LYS   6  -0.421 -10.919   9.627
   69   2HZ   LYS   6          2HZ       LYS   6  -1.787 -10.896  10.550
   70   3HZ   LYS   6          3HZ       LYS   6  -1.352 -12.273   9.757
   71    H    ILE   7           H        ILE   7  -4.379  -6.332   4.621
   72    HA   ILE   7           HA       ILE   7  -2.045  -4.744   3.738
   73    HB   ILE   7           HB       ILE   7  -5.011  -4.177   3.833
   74   1HG1  ILE   7          1HG1      ILE   7  -3.404  -4.715   1.325
   75   2HG1  ILE   7          2HG1      ILE   7  -4.116  -6.057   2.209
   76   1HG2  ILE   7          1HG2      ILE   7  -3.700  -2.100   3.853
   77   2HG2  ILE   7          2HG2      ILE   7  -2.703  -2.686   2.506
   78   3HG2  ILE   7          3HG2      ILE   7  -4.420  -2.315   2.255
   79   1HD1  ILE   7          1HD1      ILE   7  -5.670  -3.775   0.968
   80   2HD1  ILE   7          2HD1      ILE   7  -5.669  -5.486   0.512
   81   3HD1  ILE   7          3HD1      ILE   7  -6.366  -4.992   2.060
   82    H    GLN   8           H        GLN   8  -0.975  -3.366   5.302
   83    HA   GLN   8           HA       GLN   8  -2.637  -2.218   7.444
   84   1HB   GLN   8          1HB       GLN   8  -0.605  -2.572   8.862
   85   2HB   GLN   8          2HB       GLN   8  -1.664  -3.966   8.620
   86   1HG   GLN   8          1HG       GLN   8   0.913  -3.519   7.071
   87   2HG   GLN   8          2HG       GLN   8   0.854  -4.371   8.612
   88   1HE2  GLN   8          2HE2      GLN   8   1.659  -5.337   5.893
   89   2HE2  GLN   8          1HE2      GLN   8   0.652  -6.744   5.617
   90    H    VAL   9           H        VAL   9  -2.563  -0.099   7.153
   91    HA   VAL   9           HA       VAL   9  -0.292   1.077   5.663
   92    HB   VAL   9           HB       VAL   9  -3.042   2.237   6.200
   93   1HG1  VAL   9          1HG1      VAL   9  -0.710   3.052   4.411
   94   2HG1  VAL   9          2HG1      VAL   9  -2.342   3.737   4.290
   95   3HG1  VAL   9          3HG1      VAL   9  -1.391   3.964   5.763
   96   1HG2  VAL   9          1HG2      VAL   9  -1.988   0.731   3.768
   97   2HG2  VAL   9          2HG2      VAL   9  -3.343   0.266   4.813
   98   3HG2  VAL   9          3HG2      VAL   9  -3.475   1.700   3.792
   99    H    TYR  10           H        TYR  10   1.120   2.397   6.645
  100    HA   TYR  10           HA       TYR  10   0.438   3.512   9.330
  101   1HB   TYR  10          1HB       TYR  10   3.218   3.219   8.257
  102   2HB   TYR  10          2HB       TYR  10   2.663   3.391   9.912
  103    HD1  TYR  10           HD1      TYR  10   3.924   1.107   7.585
  104    HD2  TYR  10           HD2      TYR  10   0.903   1.424  10.634
  105    HE1  TYR  10           HE1      TYR  10   4.060  -1.346   7.960
  106    HE2  TYR  10           HE2      TYR  10   0.982  -1.046  10.960
  107    HH   TYR  10           HH       TYR  10   3.465  -3.078   9.398
  108    H    SER  11           H        SER  11   1.050   5.542   9.824
  109    HA   SER  11           HA       SER  11   1.794   7.493   7.682
  110   1HB   SER  11          1HB       SER  11   0.999   9.227   9.282
  111   2HB   SER  11          2HB       SER  11  -0.277   8.123   8.762
  112    HG   SER  11           HG       SER  11   1.156   8.003  11.208
  113    H    ARG  12           H        ARG  12   3.270   9.268   8.762
  114    HA   ARG  12           HA       ARG  12   5.235   8.040  10.672
  115   1HB   ARG  12          1HB       ARG  12   5.677   9.850   8.276
  116   2HB   ARG  12          2HB       ARG  12   6.895   9.602   9.539
  117   1HG   ARG  12          1HG       ARG  12   5.619   7.229   8.132
  118   2HG   ARG  12          2HG       ARG  12   6.904   8.150   7.361
  119   1HD   ARG  12          1HD       ARG  12   7.229   6.949  10.127
  120   2HD   ARG  12          2HD       ARG  12   7.636   6.077   8.652
  121    HE   ARG  12           HE       ARG  12   9.130   8.212   9.911
  122   1HH1  ARG  12          1HH2      ARG  12   8.516   6.646   6.773
  123   2HH1  ARG  12          2HH2      ARG  12   9.971   7.268   6.041
  124   1HH2  ARG  12          1HH1      ARG  12  11.031   9.011   8.932
  125   2HH2  ARG  12          2HH1      ARG  12  11.414   8.603   7.279
  126    H    HIS  13           H        HIS  13   4.996  11.395   9.495
  127    HA   HIS  13           HA       HIS  13   4.453  12.396  12.190
  128   1HB   HIS  13          1HB       HIS  13   4.320  13.868   9.545
  129   2HB   HIS  13          2HB       HIS  13   4.509  14.571  11.149
  130    HD2  HIS  13           HD2      HIS  13   6.638  14.410   8.325
  131    HE1  HIS  13           HE1      HIS  13   9.230  13.277  11.474
  132    HE2  HIS  13           HE2      HIS  13   9.135  14.095   9.054
  133    HA   PRO  14           HA       PRO  14   0.093  11.932  11.735
  134   1HB   PRO  14          1HB       PRO  14  -0.967  13.790  13.434
  135   2HB   PRO  14          2HB       PRO  14   0.152  12.524  13.993
  136   1HG   PRO  14          1HG       PRO  14   0.833  15.363  13.173
  137   2HG   PRO  14          2HG       PRO  14   1.208  14.570  14.735
  138   1HD   PRO  14          1HD       PRO  14   3.011  14.639  12.720
  139   2HD   PRO  14          2HD       PRO  14   2.839  13.167  13.719
  140    H    ALA  15           H        ALA  15   1.078  13.174   9.451
  141    HA   ALA  15           HA       ALA  15   0.438  14.156   7.580
  142   1HB   ALA  15          1HB       ALA  15  -2.331  13.953   8.782
  143   2HB   ALA  15          2HB       ALA  15  -1.936  14.124   7.061
  144   3HB   ALA  15          3HB       ALA  15  -1.470  12.651   7.944
  145    H    GLU  16           H        GLU  16   1.286  16.166   7.465
  146    HA   GLU  16           HA       GLU  16  -0.398  18.480   8.350
  147   1HB   GLU  16          1HB       GLU  16   2.628  18.548   8.425
  148   2HB   GLU  16          2HB       GLU  16   1.463  19.726   9.039
  149   1HG   GLU  16          1HG       GLU  16   1.914  18.757  11.034
  150   2HG   GLU  16          2HG       GLU  16   0.727  17.553  10.534
  151    H    ASN  17           H        ASN  17  -0.743  19.992   6.797
  152    HA   ASN  17           HA       ASN  17   0.012  19.347   4.119
  153   1HB   ASN  17          1HB       ASN  17  -1.332  21.358   3.575
  154   2HB   ASN  17          2HB       ASN  17  -2.184  20.276   4.674
  155   1HD2  ASN  17          2HD2      ASN  17  -0.554  23.411   4.426
  156   2HD2  ASN  17          1HD2      ASN  17  -1.194  24.045   5.929
  157    H    GLY  18           H        GLY  18   1.282  20.356   2.676
  158   1HA   GLY  18          1HA       GLY  18   3.004  21.633   1.846
  159   2HA   GLY  18          2HA       GLY  18   3.021  22.611   3.323
  160    H    LYS  19           H        LYS  19   3.468  20.953   5.289
  161    HA   LYS  19           HA       LYS  19   6.235  20.226   5.250
  162   1HB   LYS  19          1HB       LYS  19   4.135  20.688   7.089
  163   2HB   LYS  19          2HB       LYS  19   4.932  19.155   7.474
  164   1HG   LYS  19          1HG       LYS  19   7.082  20.152   7.627
  165   2HG   LYS  19          2HG       LYS  19   6.539  21.662   6.874
  166   1HD   LYS  19          1HD       LYS  19   6.922  21.775   9.300
  167   2HD   LYS  19          2HD       LYS  19   5.363  22.392   8.720
  168   1HE   LYS  19          1HE       LYS  19   5.060  21.111  10.828
  169   2HE   LYS  19          2HE       LYS  19   4.205  20.375   9.471
  170   1HZ   LYS  19          1HZ       LYS  19   6.087  18.849   9.261
  171   2HZ   LYS  19          2HZ       LYS  19   6.751  19.478  10.631
  172   3HZ   LYS  19          3HZ       LYS  19   5.280  18.709  10.680
  173    H    SER  20           H        SER  20   6.083  18.902   3.571
  174    HA   SER  20           HA       SER  20   4.850  16.692   2.860
  175   1HB   SER  20          1HB       SER  20   6.781  17.686   1.643
  176   2HB   SER  20          2HB       SER  20   7.831  16.652   2.638
  177    HG   SER  20           HG       SER  20   5.701  15.786   0.966
  178    H    ASN  21           H        ASN  21   4.768  14.489   3.271
  179    HA   ASN  21           HA       ASN  21   5.606  13.671   6.004
  180   1HB   ASN  21          1HB       ASN  21   3.171  14.386   5.024
  181   2HB   ASN  21          2HB       ASN  21   3.123  12.680   4.685
  182   1HD2  ASN  21          2HD2      ASN  21   2.940  11.221   6.583
  183   2HD2  ASN  21          1HD2      ASN  21   2.637  11.877   8.176
  184    H    PHE  22           H        PHE  22   4.334  10.983   5.548
  185    HA   PHE  22           HA       PHE  22   5.465   9.815   3.224
  186   1HB   PHE  22          1HB       PHE  22   7.184   9.795   5.554
  187   2HB   PHE  22          2HB       PHE  22   6.643   8.152   5.209
  188    HD1  PHE  22           HD1      PHE  22   6.716   7.346   2.734
  189    HD2  PHE  22           HD2      PHE  22   9.140  10.497   4.399
  190    HE1  PHE  22           HE1      PHE  22   8.453   6.932   1.001
  191    HE2  PHE  22           HE2      PHE  22  10.930   9.982   2.755
  192    HZ   PHE  22           HZ       PHE  22  10.574   8.221   1.037
  193    H    LEU  23           H        LEU  23   4.094   8.363   2.615
  194    HA   LEU  23           HA       LEU  23   2.134   7.108   4.459
  195   1HB   LEU  23          1HB       LEU  23   1.281   8.440   2.572
  196   2HB   LEU  23          2HB       LEU  23   2.283   7.518   1.458
  197    HG   LEU  23           HG       LEU  23   0.824   5.504   2.041
  198   1HD1  LEU  23          1HD1      LEU  23  -0.691   7.726   3.497
  199   2HD1  LEU  23          2HD1      LEU  23  -1.353   6.115   3.147
  200   3HD1  LEU  23          3HD1      LEU  23   0.021   6.288   4.257
  201   1HD2  LEU  23          1HD2      LEU  23   0.442   6.934   0.030
  202   2HD2  LEU  23          2HD2      LEU  23  -1.098   6.373   0.708
  203   3HD2  LEU  23          3HD2      LEU  23  -0.544   8.036   1.001
  204    H    ASN  24           H        ASN  24   2.084   4.846   4.642
  205    HA   ASN  24           HA       ASN  24   4.100   3.278   3.082
  206   1HB   ASN  24          1HB       ASN  24   3.800   3.241   6.096
  207   2HB   ASN  24          2HB       ASN  24   4.957   2.365   5.091
  208   1HD2  ASN  24          2HD2      ASN  24   3.977   5.545   6.353
  209   2HD2  ASN  24          1HD2      ASN  24   5.520   6.341   6.129
  210    H    CYS  25           H        CYS  25   2.425   2.237   1.969
  211    HA   CYS  25           HA       CYS  25   0.305   0.859   3.518
  212   1HB   CYS  25          1HB       CYS  25   0.697   1.069   0.531
  213   2HB   CYS  25          2HB       CYS  25  -0.636   0.280   1.362
  214    H    TYR  26           H        TYR  26   1.740  -0.611   4.629
  215    HA   TYR  26           HA       TYR  26   3.401  -2.438   3.114
  216   1HB   TYR  26          1HB       TYR  26   3.926  -1.723   5.423
  217   2HB   TYR  26          2HB       TYR  26   2.436  -2.394   5.995
  218    HD1  TYR  26           HD1      TYR  26   3.214  -3.933   7.590
  219    HD2  TYR  26           HD2      TYR  26   4.870  -4.050   3.626
  220    HE1  TYR  26           HE1      TYR  26   4.096  -6.197   8.033
  221    HE2  TYR  26           HE2      TYR  26   5.738  -6.304   4.047
  222    HH   TYR  26           HH       TYR  26   5.376  -7.939   7.227
  223    H    VAL  27           H        VAL  27   2.848  -4.526   2.433
  224    HA   VAL  27           HA       VAL  27   0.219  -5.602   3.272
  225    HB   VAL  27           HB       VAL  27   1.181  -5.873   0.396
  226   1HG1  VAL  27          1HG1      VAL  27  -0.487  -7.525   1.312
  227   2HG1  VAL  27          2HG1      VAL  27  -1.557  -6.182   1.707
  228   3HG1  VAL  27          3HG1      VAL  27  -1.142  -6.518   0.012
  229   1HG2  VAL  27          1HG2      VAL  27  -0.755  -3.822   1.453
  230   2HG2  VAL  27          2HG2      VAL  27   0.822  -3.502   0.691
  231   3HG2  VAL  27          3HG2      VAL  27  -0.471  -4.244  -0.263
  232    H    SER  28           H        SER  28   0.307  -7.803   3.686
  233    HA   SER  28           HA       SER  28   2.469  -9.406   2.683
  234   1HB   SER  28          1HB       SER  28   3.417  -9.989   4.927
  235   2HB   SER  28          2HB       SER  28   3.638  -8.287   4.590
  236    HG   SER  28           HG       SER  28   2.813  -8.491   6.641
  237    H    GLY  29           H        GLY  29   2.387 -11.624   4.225
  238   1HA   GLY  29          1HA       GLY  29   1.027 -13.342   5.021
  239   2HA   GLY  29          2HA       GLY  29  -0.425 -12.407   4.657
  240    H    PHE  30           H        PHE  30   0.386 -11.758   1.901
  241    HA   PHE  30           HA       PHE  30  -0.961 -13.982   0.696
  242   1HB   PHE  30          1HB       PHE  30  -1.007 -12.599  -1.283
  243   2HB   PHE  30          2HB       PHE  30  -1.463 -11.705   0.118
  244    HD1  PHE  30           HD1      PHE  30  -0.140  -9.705   0.857
  245    HD2  PHE  30           HD2      PHE  30   1.200 -12.221  -2.394
  246    HE1  PHE  30           HE1      PHE  30   1.669  -8.128   0.336
  247    HE2  PHE  30           HE2      PHE  30   2.987 -10.612  -2.903
  248    HZ   PHE  30           HZ       PHE  30   3.228  -8.581  -1.515
  249    H    HIS  31           H        HIS  31  -0.201 -14.692  -1.570
  250    HA   HIS  31           HA       HIS  31   2.573 -14.842  -2.301
  251   1HB   HIS  31          1HB       HIS  31   2.934 -16.444  -0.566
  252   2HB   HIS  31          2HB       HIS  31   1.314 -17.091  -0.738
  253    HD2  HIS  31           HD2      HIS  31   1.193 -18.326  -3.664
  254    HE1  HIS  31           HE1      HIS  31   4.885 -20.141  -2.715
  255    HE2  HIS  31           HE2      HIS  31   2.885 -20.205  -4.303
  256    HA   PRO  32           HA       PRO  32   3.499 -16.051  -4.048
  257   1HB   PRO  32          1HB       PRO  32   3.983 -16.297  -6.674
  258   2HB   PRO  32          2HB       PRO  32   3.041 -17.520  -5.820
  259   1HG   PRO  32          1HG       PRO  32   1.884 -15.162  -7.350
  260   2HG   PRO  32          2HG       PRO  32   1.567 -16.899  -7.634
  261   1HD   PRO  32          1HD       PRO  32  -0.020 -15.376  -5.989
  262   2HD   PRO  32          2HD       PRO  32   0.320 -17.095  -5.646
  263    H    SER  33           H        SER  33   4.375 -14.497  -6.682
  264    HA   SER  33           HA       SER  33   4.970 -12.101  -5.208
  265   1HB   SER  33          1HB       SER  33   6.578 -11.778  -7.023
  266   2HB   SER  33          2HB       SER  33   6.637 -13.456  -6.439
  267    HG   SER  33           HG       SER  33   6.602 -13.344  -8.712
  268    H    ASP  34           H        ASP  34   2.709 -12.844  -7.756
  269    HA   ASP  34           HA       ASP  34   2.966 -10.312  -9.093
  270   1HB   ASP  34          1HB       ASP  34   2.511 -12.407 -10.243
  271   2HB   ASP  34          2HB       ASP  34   1.007 -12.623  -9.347
  272    H    ILE  35           H        ILE  35   2.558  -8.878  -7.246
  273    HA   ILE  35           HA       ILE  35  -0.353  -8.283  -7.056
  274    HB   ILE  35           HB       ILE  35   0.456  -9.117  -4.998
  275   1HG1  ILE  35          1HG1      ILE  35   0.093  -6.127  -4.608
  276   2HG1  ILE  35          2HG1      ILE  35  -1.232  -7.196  -5.006
  277   1HG2  ILE  35          1HG2      ILE  35   2.388  -6.811  -4.949
  278   2HG2  ILE  35          2HG2      ILE  35   2.098  -7.985  -3.645
  279   3HG2  ILE  35          3HG2      ILE  35   2.805  -8.542  -5.162
  280   1HD1  ILE  35          1HD1      ILE  35  -0.551  -8.599  -2.956
  281   2HD1  ILE  35          2HD1      ILE  35   0.436  -7.214  -2.481
  282   3HD1  ILE  35          3HD1      ILE  35  -1.307  -7.015  -2.669
  283    H    GLU  36           H        GLU  36  -0.990  -6.209  -7.116
  284    HA   GLU  36           HA       GLU  36   0.877  -4.215  -8.301
  285   1HB   GLU  36          1HB       GLU  36  -2.084  -4.244  -8.827
  286   2HB   GLU  36          2HB       GLU  36  -0.766  -3.539  -9.751
  287   1HG   GLU  36          1HG       GLU  36   0.032  -5.883 -10.253
  288   2HG   GLU  36          2HG       GLU  36  -1.416  -6.498  -9.472
  289    H    VAL  37           H        VAL  37   1.118  -2.414  -7.029
  290    HA   VAL  37           HA       VAL  37  -1.138  -1.499  -5.336
  291    HB   VAL  37           HB       VAL  37   1.717  -1.922  -4.400
  292   1HG1  VAL  37          1HG1      VAL  37  -0.652  -0.937  -2.759
  293   2HG1  VAL  37          2HG1      VAL  37   0.984  -1.265  -2.179
  294   3HG1  VAL  37          3HG1      VAL  37   0.707   0.078  -3.293
  295   1HG2  VAL  37          1HG2      VAL  37  -0.909  -3.364  -3.885
  296   2HG2  VAL  37          2HG2      VAL  37   0.652  -4.029  -4.417
  297   3HG2  VAL  37          3HG2      VAL  37   0.424  -3.473  -2.745
  298    H    ASP  38           H        ASP  38  -1.546   0.044  -6.828
  299    HA   ASP  38           HA       ASP  38   0.498   2.112  -7.395
  300   1HB   ASP  38          1HB       ASP  38  -2.373   1.922  -8.392
  301   2HB   ASP  38          2HB       ASP  38  -1.083   2.966  -8.986
  302    H    LEU  39           H        LEU  39   0.602   3.864  -6.059
  303    HA   LEU  39           HA       LEU  39  -1.484   4.183  -4.006
  304   1HB   LEU  39          1HB       LEU  39   1.219   5.545  -4.291
  305   2HB   LEU  39          2HB       LEU  39   0.032   5.751  -2.990
  306    HG   LEU  39           HG       LEU  39   0.178   3.162  -2.717
  307   1HD1  LEU  39          1HD1      LEU  39   2.829   3.721  -4.074
  308   2HD1  LEU  39          2HD1      LEU  39   2.467   2.269  -3.129
  309   3HD1  LEU  39          3HD1      LEU  39   1.604   2.572  -4.631
  310   1HD2  LEU  39          1HD2      LEU  39   0.985   4.882  -1.064
  311   2HD2  LEU  39          2HD2      LEU  39   1.969   3.412  -1.087
  312   3HD2  LEU  39          3HD2      LEU  39   2.555   4.876  -1.899
  313    H    LEU  40           H        LEU  40  -2.664   6.136  -3.731
  314    HA   LEU  40           HA       LEU  40  -3.262   7.482  -6.324
  315   1HB   LEU  40          1HB       LEU  40  -4.148   4.980  -5.723
  316   2HB   LEU  40          2HB       LEU  40  -5.355   5.907  -4.858
  317    HG   LEU  40           HG       LEU  40  -6.077   5.136  -7.032
  318   1HD1  LEU  40          1HD1      LEU  40  -5.853   8.167  -6.976
  319   2HD1  LEU  40          2HD1      LEU  40  -6.943   7.223  -8.003
  320   3HD1  LEU  40          3HD1      LEU  40  -7.130   7.164  -6.244
  321   1HD2  LEU  40          1HD2      LEU  40  -3.743   5.278  -8.093
  322   2HD2  LEU  40          2HD2      LEU  40  -5.141   5.694  -9.104
  323   3HD2  LEU  40          3HD2      LEU  40  -4.143   6.981  -8.420
  324    H    LYS  41           H        LYS  41  -4.121   9.599  -5.943
  325    HA   LYS  41           HA       LYS  41  -4.855  10.324  -3.190
  326   1HB   LYS  41          1HB       LYS  41  -4.906  11.992  -5.691
  327   2HB   LYS  41          2HB       LYS  41  -5.170  12.502  -4.012
  328   1HG   LYS  41          1HG       LYS  41  -3.048  13.084  -4.246
  329   2HG   LYS  41          2HG       LYS  41  -2.900  11.511  -3.460
  330   1HD   LYS  41          1HD       LYS  41  -2.009  10.472  -5.247
  331   2HD   LYS  41          2HD       LYS  41  -2.845  11.458  -6.425
  332   1HE   LYS  41          1HE       LYS  41  -0.347  12.213  -4.911
  333   2HE   LYS  41          2HE       LYS  41  -0.512  11.832  -6.637
  334   1HZ   LYS  41          1HZ       LYS  41  -1.903  13.798  -6.869
  335   2HZ   LYS  41          2HZ       LYS  41  -1.636  14.181  -5.291
  336   3HZ   LYS  41          3HZ       LYS  41  -0.385  14.148  -6.355
  337    H    ASN  42           H        ASN  42  -6.946  12.110  -4.551
  338    HA   ASN  42           HA       ASN  42  -9.335  10.510  -4.274
  339   1HB   ASN  42          1HB       ASN  42 -10.457  12.512  -5.172
  340   2HB   ASN  42          2HB       ASN  42  -9.353  12.949  -3.866
  341   1HD2  ASN  42          2HD2      ASN  42  -7.275  13.985  -4.445
  342   2HD2  ASN  42          1HD2      ASN  42  -7.088  14.781  -5.994
  343    H    GLY  43           H        GLY  43  -7.189  11.392  -6.946
  344   1HA   GLY  43          1HA       GLY  43  -8.548   9.503  -8.772
  345   2HA   GLY  43          2HA       GLY  43  -8.513  11.218  -9.227
  346    H    GLU  44           H        GLU  44  -6.052  12.086  -8.388
  347    HA   GLU  44           HA       GLU  44  -4.345  11.415 -10.485
  348   1HB   GLU  44          1HB       GLU  44  -3.940  12.666  -7.750
  349   2HB   GLU  44          2HB       GLU  44  -2.683  12.625  -8.998
  350   1HG   GLU  44          1HG       GLU  44  -4.054  14.041 -10.441
  351   2HG   GLU  44          2HG       GLU  44  -5.421  13.930  -9.316
  352    H    ARG  45           H        ARG  45  -2.452  10.206 -10.593
  353    HA   ARG  45           HA       ARG  45  -2.207   7.906  -8.718
  354   1HB   ARG  45          1HB       ARG  45  -2.698   7.452 -11.095
  355   2HB   ARG  45          2HB       ARG  45  -1.244   8.349 -11.567
  356   1HG   ARG  45          1HG       ARG  45   0.169   6.692 -10.384
  357   2HG   ARG  45          2HG       ARG  45  -1.282   5.810  -9.861
  358   1HD   ARG  45          1HD       ARG  45  -1.858   5.303 -12.168
  359   2HD   ARG  45          2HD       ARG  45  -0.585   6.369 -12.771
  360    HE   ARG  45           HE       ARG  45   1.118   4.932 -11.926
  361   1HH1  ARG  45          1HH2      ARG  45  -2.087   3.370 -12.172
  362   2HH1  ARG  45          2HH2      ARG  45  -1.450   1.793 -11.780
  363   1HH2  ARG  45          1HH1      ARG  45   1.907   2.841 -11.546
  364   2HH2  ARG  45          2HH1      ARG  45   0.806   1.492 -11.432
  365    H    ILE  46           H        ILE  46  -0.220   7.387  -7.724
  366    HA   ILE  46           HA       ILE  46   1.730   9.555  -7.577
  367    HB   ILE  46           HB       ILE  46   1.095   7.073  -5.948
  368   1HG1  ILE  46          1HG1      ILE  46   0.551  10.052  -5.613
  369   2HG1  ILE  46          2HG1      ILE  46  -0.664   8.786  -5.861
  370   1HG2  ILE  46          1HG2      ILE  46   3.467   7.671  -5.850
  371   2HG2  ILE  46          2HG2      ILE  46   3.014   9.345  -5.426
  372   3HG2  ILE  46          3HG2      ILE  46   2.623   7.980  -4.329
  373   1HD1  ILE  46          1HD1      ILE  46  -0.094   7.864  -3.602
  374   2HD1  ILE  46          2HD1      ILE  46   0.977   9.264  -3.358
  375   3HD1  ILE  46          3HD1      ILE  46  -0.766   9.481  -3.613
  376    H    GLU  47           H        GLU  47   3.343   9.381  -9.042
  377    HA   GLU  47           HA       GLU  47   4.265   6.826 -10.124
  378   1HB   GLU  47          1HB       GLU  47   5.090   9.686 -10.600
  379   2HB   GLU  47          2HB       GLU  47   5.900   8.272 -11.295
  380   1HG   GLU  47          1HG       GLU  47   4.312   8.993 -12.889
  381   2HG   GLU  47          2HG       GLU  47   3.741   7.467 -12.245
  382    H    LYS  48           H        LYS  48   5.367   9.262  -7.741
  383    HA   LYS  48           HA       LYS  48   7.999   8.118  -7.348
  384   1HB   LYS  48          1HB       LYS  48   6.336  10.118  -5.770
  385   2HB   LYS  48          2HB       LYS  48   8.000   9.629  -5.375
  386   1HG   LYS  48          1HG       LYS  48   8.853  10.535  -7.443
  387   2HG   LYS  48          2HG       LYS  48   7.218  10.884  -8.033
  388   1HD   LYS  48          1HD       LYS  48   8.363  12.903  -7.167
  389   2HD   LYS  48          2HD       LYS  48   6.853  12.542  -6.311
  390   1HE   LYS  48          1HE       LYS  48   8.103  11.613  -4.407
  391   2HE   LYS  48          2HE       LYS  48   9.635  11.802  -5.288
  392   1HZ   LYS  48          1HZ       LYS  48   9.248  14.168  -5.246
  393   2HZ   LYS  48          2HZ       LYS  48   7.835  13.952  -4.418
  394   3HZ   LYS  48          3HZ       LYS  48   9.264  13.538  -3.721
  395    H    VAL  49           H        VAL  49   7.059   5.866  -7.119
  396    HA   VAL  49           HA       VAL  49   6.293   5.255  -4.293
  397    HB   VAL  49           HB       VAL  49   6.031   3.537  -6.786
  398   1HG1  VAL  49          1HG1      VAL  49   6.275   2.182  -4.770
  399   2HG1  VAL  49          2HG1      VAL  49   5.115   3.196  -3.893
  400   3HG1  VAL  49          3HG1      VAL  49   4.574   2.182  -5.249
  401   1HG2  VAL  49          1HG2      VAL  49   4.516   5.390  -6.992
  402   2HG2  VAL  49          2HG2      VAL  49   3.584   3.977  -6.488
  403   3HG2  VAL  49          3HG2      VAL  49   3.994   5.243  -5.304
  404    H    GLU  50           H        GLU  50   8.161   4.853  -3.130
  405    HA   GLU  50           HA       GLU  50  10.385   3.327  -4.392
  406   1HB   GLU  50          1HB       GLU  50  10.773   5.404  -2.879
  407   2HB   GLU  50          2HB       GLU  50  10.308   4.335  -1.548
  408   1HG   GLU  50          1HG       GLU  50  12.108   2.747  -2.246
  409   2HG   GLU  50          2HG       GLU  50  12.591   3.922  -3.484
  410    H    HIS  51           H        HIS  51  10.905   1.231  -3.283
  411    HA   HIS  51           HA       HIS  51   8.969   0.312  -1.326
  412   1HB   HIS  51          1HB       HIS  51   8.193  -1.633  -2.529
  413   2HB   HIS  51          2HB       HIS  51   7.806  -0.201  -3.480
  414    HD2  HIS  51           HD2      HIS  51   9.617   0.180  -5.752
  415    HE1  HIS  51           HE1      HIS  51  10.687  -3.916  -5.814
  416    HE2  HIS  51           HE2      HIS  51  10.758  -1.732  -7.136
  417    H    SER  52           H        SER  52   9.661  -1.411  -0.127
  418    HA   SER  52           HA       SER  52  12.516  -1.966  -0.081
  419   1HB   SER  52          1HB       SER  52  11.915  -3.616   1.643
  420   2HB   SER  52          2HB       SER  52  11.160  -2.043   1.977
  421    HG   SER  52           HG       SER  52   9.897  -4.209   0.644
  422    H    ASP  53           H        ASP  53  13.567  -3.692  -1.091
  423    HA   ASP  53           HA       ASP  53  12.418  -5.047  -3.266
  424   1HB   ASP  53          1HB       ASP  53  14.856  -4.773  -2.896
  425   2HB   ASP  53          2HB       ASP  53  14.769  -5.871  -1.508
  426    H    LEU  54           H        LEU  54  11.855  -7.310  -3.506
  427    HA   LEU  54           HA       LEU  54   9.834  -8.042  -1.734
  428   1HB   LEU  54          1HB       LEU  54  10.162  -8.744  -4.167
  429   2HB   LEU  54          2HB       LEU  54  11.288  -9.962  -3.584
  430    HG   LEU  54           HG       LEU  54   9.258 -11.063  -3.915
  431   1HD1  LEU  54          1HD1      LEU  54  10.277 -11.616  -1.695
  432   2HD1  LEU  54          2HD1      LEU  54   9.014 -10.571  -0.967
  433   3HD1  LEU  54          3HD1      LEU  54   8.560 -11.986  -1.876
  434   1HD2  LEU  54          1HD2      LEU  54   7.867  -8.743  -2.559
  435   2HD2  LEU  54          2HD2      LEU  54   7.647  -9.360  -4.209
  436   3HD2  LEU  54          3HD2      LEU  54   7.079 -10.283  -2.813
  437    H    SER  55           H        SER  55   9.931  -8.805   0.232
  438    HA   SER  55           HA       SER  55  12.061 -10.721   1.078
  439   1HB   SER  55          1HB       SER  55  12.347  -8.629   2.338
  440   2HB   SER  55          2HB       SER  55  10.625  -8.629   2.773
  441    HG   SER  55           HG       SER  55  11.979  -9.553   4.396
  442    H    PHE  56           H        PHE  56  10.928 -12.617   0.702
  443    HA   PHE  56           HA       PHE  56   8.082 -12.746   1.428
  444   1HB   PHE  56          1HB       PHE  56   7.998 -14.737   0.262
  445   2HB   PHE  56          2HB       PHE  56   9.106 -13.774  -0.671
  446    HD1  PHE  56           HD1      PHE  56   8.557 -16.824   1.171
  447    HD2  PHE  56           HD2      PHE  56  11.544 -14.330  -0.663
  448    HE1  PHE  56           HE1      PHE  56  10.190 -18.700   1.301
  449    HE2  PHE  56           HE2      PHE  56  13.188 -16.213  -0.529
  450    HZ   PHE  56           HZ       PHE  56  12.489 -18.403   0.404
  451    H    SER  57           H        SER  57  10.446 -12.407   3.405
  452    HA   SER  57           HA       SER  57  11.548 -13.325   5.079
  453   1HB   SER  57          1HB       SER  57   9.277 -13.313   6.176
  454   2HB   SER  57          2HB       SER  57   9.078 -15.004   5.687
  455    HG   SER  57           HG       SER  57  10.031 -15.188   7.621
  456    H    LYS  58           H        LYS  58  11.538 -16.077   6.029
  457    HA   LYS  58           HA       LYS  58  12.195 -17.709   3.630
  458   1HB   LYS  58          1HB       LYS  58  13.604 -17.591   5.716
  459   2HB   LYS  58          2HB       LYS  58  12.323 -18.528   6.520
  460   1HG   LYS  58          1HG       LYS  58  12.584 -20.261   4.667
  461   2HG   LYS  58          2HG       LYS  58  13.929 -19.318   4.032
  462   1HD   LYS  58          1HD       LYS  58  13.733 -20.628   6.793
  463   2HD   LYS  58          2HD       LYS  58  14.683 -21.224   5.430
  464   1HE   LYS  58          1HE       LYS  58  15.176 -18.640   6.982
  465   2HE   LYS  58          2HE       LYS  58  16.132 -20.122   7.047
  466   1HZ   LYS  58          1HZ       LYS  58  15.801 -18.403   4.694
  467   2HZ   LYS  58          2HZ       LYS  58  17.146 -18.524   5.637
  468   3HZ   LYS  58          3HZ       LYS  58  16.659 -19.811   4.731
  469    H    ASP  59           H        ASP  59   9.656 -17.045   5.916
  470    HA   ASP  59           HA       ASP  59   8.883 -19.732   6.192
  471   1HB   ASP  59          1HB       ASP  59   7.627 -17.165   7.261
  472   2HB   ASP  59          2HB       ASP  59   7.348 -18.789   7.908
  473    H    TRP  60           H        TRP  60   8.365 -19.335   3.560
  474    HA   TRP  60           HA       TRP  60   6.859 -19.678   1.944
  475   1HB   TRP  60          1HB       TRP  60   5.045 -20.693   4.143
  476   2HB   TRP  60          2HB       TRP  60   4.995 -21.122   2.438
  477    HD1  TRP  60           HD1      TRP  60   7.074 -21.686   5.585
  478    HE1  TRP  60           HE1      TRP  60   8.512 -23.816   5.318
  479    HE3  TRP  60           HE3      TRP  60   6.037 -22.777   0.691
  480    HZ2  TRP  60           HZ2      TRP  60   9.105 -25.722   3.281
  481    HZ3  TRP  60           HZ3      TRP  60   7.020 -24.787  -0.369
  482    HH2  TRP  60           HH2      TRP  60   8.570 -26.252   0.906
  483    H    SER  61           H        SER  61   6.613 -17.047   3.559
  484    HA   SER  61           HA       SER  61   3.840 -16.206   2.928
  485   1HB   SER  61          1HB       SER  61   6.181 -14.805   4.302
  486   2HB   SER  61          2HB       SER  61   4.526 -14.166   4.160
  487    HG   SER  61           HG       SER  61   4.968 -15.240   6.154
  488    H    PHE  62           H        PHE  62   4.263 -13.592   2.132
  489    HA   PHE  62           HA       PHE  62   6.404 -13.224   0.273
  490   1HB   PHE  62          1HB       PHE  62   4.324 -14.701  -0.812
  491   2HB   PHE  62          2HB       PHE  62   3.927 -13.066  -1.311
  492    HD1  PHE  62           HD1      PHE  62   5.524 -11.832  -2.838
  493    HD2  PHE  62           HD2      PHE  62   6.256 -15.896  -1.586
  494    HE1  PHE  62           HE1      PHE  62   7.301 -12.057  -4.514
  495    HE2  PHE  62           HE2      PHE  62   8.114 -16.068  -3.159
  496    HZ   PHE  62           HZ       PHE  62   8.702 -14.119  -4.608
  497    H    TYR  63           H        TYR  63   6.743 -10.957   0.398
  498    HA   TYR  63           HA       TYR  63   4.439  -9.179   0.544
  499   1HB   TYR  63          1HB       TYR  63   4.971  -8.273   2.786
  500   2HB   TYR  63          2HB       TYR  63   4.423  -9.948   2.810
  501    HD1  TYR  63           HD1      TYR  63   7.305  -7.787   3.327
  502    HD2  TYR  63           HD2      TYR  63   5.655 -11.747   3.657
  503    HE1  TYR  63           HE1      TYR  63   8.937  -8.286   5.079
  504    HE2  TYR  63           HE2      TYR  63   7.316 -12.299   5.380
  505    HH   TYR  63           HH       TYR  63   9.701  -9.890   6.604
  506    H    LEU  64           H        LEU  64   5.226  -6.944   1.202
  507    HA   LEU  64           HA       LEU  64   7.878  -6.104   0.810
  508   1HB   LEU  64          1HB       LEU  64   7.797  -5.044  -1.367
  509   2HB   LEU  64          2HB       LEU  64   7.655  -6.781  -1.528
  510    HG   LEU  64           HG       LEU  64   5.506  -4.687  -1.863
  511   1HD1  LEU  64          1HD1      LEU  64   6.547  -6.773  -3.832
  512   2HD1  LEU  64          2HD1      LEU  64   5.306  -5.566  -4.164
  513   3HD1  LEU  64          3HD1      LEU  64   6.966  -5.039  -3.857
  514   1HD2  LEU  64          1HD2      LEU  64   5.268  -7.712  -1.818
  515   2HD2  LEU  64          2HD2      LEU  64   4.264  -6.519  -0.925
  516   3HD2  LEU  64          3HD2      LEU  64   4.100  -6.720  -2.675
  517    H    LEU  65           H        LEU  65   8.013  -3.789   1.019
  518    HA   LEU  65           HA       LEU  65   5.570  -2.536   2.139
  519   1HB   LEU  65          1HB       LEU  65   7.869  -3.141   3.386
  520   2HB   LEU  65          2HB       LEU  65   8.406  -1.636   2.634
  521    HG   LEU  65           HG       LEU  65   6.085  -2.062   4.565
  522   1HD1  LEU  65          1HD1      LEU  65   8.377  -2.092   5.489
  523   2HD1  LEU  65          2HD1      LEU  65   8.680  -0.496   4.771
  524   3HD1  LEU  65          3HD1      LEU  65   7.451  -0.681   6.047
  525   1HD2  LEU  65          1HD2      LEU  65   6.880   0.373   2.946
  526   2HD2  LEU  65          2HD2      LEU  65   5.264  -0.333   3.160
  527   3HD2  LEU  65          3HD2      LEU  65   6.037   0.516   4.503
  528    H    TYR  66           H        TYR  66   4.851  -0.656   1.139
  529    HA   TYR  66           HA       TYR  66   6.406   0.289  -1.219
  530   1HB   TYR  66          1HB       TYR  66   3.383   0.027  -1.165
  531   2HB   TYR  66          2HB       TYR  66   4.454   0.167  -2.542
  532    HD1  TYR  66           HD1      TYR  66   4.555  -1.831  -3.861
  533    HD2  TYR  66           HD2      TYR  66   3.736  -2.214   0.371
  534    HE1  TYR  66           HE1      TYR  66   3.409  -3.983  -4.240
  535    HE2  TYR  66           HE2      TYR  66   2.785  -4.408  -0.020
  536    HH   TYR  66           HH       TYR  66   1.983  -5.555  -3.316
  537    H    TYR  67           H        TYR  67   7.028   2.236  -0.415
  538    HA   TYR  67           HA       TYR  67   4.988   3.973   0.844
  539   1HB   TYR  67          1HB       TYR  67   7.116   5.014   1.868
  540   2HB   TYR  67          2HB       TYR  67   6.254   3.632   2.493
  541    HD1  TYR  67           HD1      TYR  67   7.884   2.452   3.703
  542    HD2  TYR  67           HD2      TYR  67   8.677   3.683  -0.321
  543    HE1  TYR  67           HE1      TYR  67   9.995   1.149   3.721
  544    HE2  TYR  67           HE2      TYR  67  10.746   2.307  -0.355
  545    HH   TYR  67           HH       TYR  67  11.827   0.449   2.512
  546    H    THR  68           H        THR  68   4.884   6.054   0.503
  547    HA   THR  68           HA       THR  68   6.477   7.381  -1.674
  548    HB   THR  68           HB       THR  68   4.440   6.630  -2.556
  549    HG1  THR  68           HG1      THR  68   5.266   8.521  -3.338
  550   1HG2  THR  68          1HG2      THR  68   2.989   8.469  -0.606
  551   2HG2  THR  68          2HG2      THR  68   2.278   7.491  -1.896
  552   3HG2  THR  68          3HG2      THR  68   3.011   6.692  -0.496
  553    H    GLU  69           H        GLU  69   7.035   9.569  -1.272
  554    HA   GLU  69           HA       GLU  69   6.638  10.664   1.411
  555   1HB   GLU  69          1HB       GLU  69   8.133  12.479   0.528
  556   2HB   GLU  69          2HB       GLU  69   8.822  10.861   0.610
  557   1HG   GLU  69          1HG       GLU  69   8.641  10.549  -1.788
  558   2HG   GLU  69          2HG       GLU  69   7.754  12.071  -1.968
  559    H    PHE  70           H        PHE  70   4.258  10.790   1.118
  560    HA   PHE  70           HA       PHE  70   3.226  12.708  -0.814
  561   1HB   PHE  70          1HB       PHE  70   1.134  12.086  -0.216
  562   2HB   PHE  70          2HB       PHE  70   2.016  10.562  -0.101
  563    HD1  PHE  70           HD1      PHE  70  -0.510  12.557   1.454
  564    HD2  PHE  70           HD2      PHE  70   2.934  10.160   2.432
  565    HE1  PHE  70           HE1      PHE  70  -0.882  12.919   3.829
  566    HE2  PHE  70           HE2      PHE  70   2.203  10.144   4.813
  567    HZ   PHE  70           HZ       PHE  70   0.458  11.706   5.543
  568    H    THR  71           H        THR  71   2.216  14.604  -0.399
  569    HA   THR  71           HA       THR  71   2.505  15.896   2.267
  570    HB   THR  71           HB       THR  71   2.215  17.135  -0.441
  571    HG1  THR  71           HG1      THR  71   4.420  17.557  -0.063
  572   1HG2  THR  71          1HG2      THR  71   2.823  18.261   2.337
  573   2HG2  THR  71          2HG2      THR  71   2.960  19.163   0.817
  574   3HG2  THR  71          3HG2      THR  71   1.372  18.594   1.364
  575    HA   PRO  72           HA       PRO  72  -2.098  15.291   1.961
  576   1HB   PRO  72          1HB       PRO  72  -2.709  16.029   4.591
  577   2HB   PRO  72          2HB       PRO  72  -2.302  14.412   4.049
  578   1HG   PRO  72          1HG       PRO  72  -0.623  16.430   5.471
  579   2HG   PRO  72          2HG       PRO  72  -0.445  14.653   5.483
  580   1HD   PRO  72          1HD       PRO  72   1.154  16.473   4.058
  581   2HD   PRO  72          2HD       PRO  72   1.069  14.718   3.775
  582    H    THR  73           H        THR  73  -2.921  16.962   0.714
  583    HA   THR  73           HA       THR  73  -2.820  19.757   1.454
  584    HB   THR  73           HB       THR  73  -4.644  19.901  -0.314
  585    HG1  THR  73           HG1      THR  73  -5.337  17.676   0.102
  586   1HG2  THR  73          1HG2      THR  73  -2.102  18.402  -1.087
  587   2HG2  THR  73          2HG2      THR  73  -3.161  19.316  -2.181
  588   3HG2  THR  73          3HG2      THR  73  -2.272  20.162  -0.900
  589    H    GLU  74           H        GLU  74  -4.838  21.015   1.851
  590    HA   GLU  74           HA       GLU  74  -6.153  20.392   4.210
  591   1HB   GLU  74          1HB       GLU  74  -7.654  22.233   3.637
  592   2HB   GLU  74          2HB       GLU  74  -5.975  22.633   3.251
  593   1HG   GLU  74          1HG       GLU  74  -6.420  22.107   0.839
  594   2HG   GLU  74          2HG       GLU  74  -8.095  21.715   1.259
  595    H    LYS  75           H        LYS  75  -6.967  19.332   0.960
  596    HA   LYS  75           HA       LYS  75  -9.342  17.848   1.964
  597   1HB   LYS  75          1HB       LYS  75 -10.618  18.554   0.016
  598   2HB   LYS  75          2HB       LYS  75 -10.101  19.938   0.984
  599   1HG   LYS  75          1HG       LYS  75  -8.064  19.989  -0.766
  600   2HG   LYS  75          2HG       LYS  75  -9.209  19.109  -1.780
  601   1HD   LYS  75          1HD       LYS  75  -9.648  21.826  -0.464
  602   2HD   LYS  75          2HD       LYS  75  -9.270  21.536  -2.166
  603   1HE   LYS  75          1HE       LYS  75 -11.414  20.312  -2.439
  604   2HE   LYS  75          2HE       LYS  75 -11.798  20.596  -0.729
  605   1HZ   LYS  75          1HZ       LYS  75 -11.405  22.682  -2.749
  606   2HZ   LYS  75          2HZ       LYS  75 -12.848  22.195  -2.118
  607   3HZ   LYS  75          3HZ       LYS  75 -11.733  22.936  -1.155
  608    H    ASP  76           H        ASP  76  -6.970  16.611   1.879
  609    HA   ASP  76           HA       ASP  76  -6.454  15.425  -0.722
  610   1HB   ASP  76          1HB       ASP  76  -4.636  14.443   0.265
  611   2HB   ASP  76          2HB       ASP  76  -4.814  15.851   1.285
  612    H    GLU  77           H        GLU  77  -6.420  12.950  -0.879
  613    HA   GLU  77           HA       GLU  77  -8.006  11.458   0.986
  614   1HB   GLU  77          1HB       GLU  77  -9.721  12.437  -0.675
  615   2HB   GLU  77          2HB       GLU  77  -9.024  11.347  -1.875
  616   1HG   GLU  77          1HG       GLU  77  -9.531   9.406  -0.376
  617   2HG   GLU  77          2HG       GLU  77 -10.147  10.522   0.852
  618    H    TYR  78           H        TYR  78  -5.467  11.213   0.835
  619    HA   TYR  78           HA       TYR  78  -4.489   9.562  -1.283
  620   1HB   TYR  78          1HB       TYR  78  -3.428  10.504   1.322
  621   2HB   TYR  78          2HB       TYR  78  -2.655   9.099   0.573
  622    HD1  TYR  78           HD1      TYR  78  -3.955  12.482  -0.360
  623    HD2  TYR  78           HD2      TYR  78  -0.918   9.523  -1.034
  624    HE1  TYR  78           HE1      TYR  78  -2.647  14.138  -1.657
  625    HE2  TYR  78           HE2      TYR  78   0.328  11.142  -2.428
  626    HH   TYR  78           HH       TYR  78   0.599  13.369  -2.974
  627    H    ALA  79           H        ALA  79  -4.129   7.484  -1.464
  628    HA   ALA  79           HA       ALA  79  -5.334   5.494   0.328
  629   1HB   ALA  79          1HB       ALA  79  -7.227   6.542  -0.948
  630   2HB   ALA  79          2HB       ALA  79  -6.393   6.164  -2.466
  631   3HB   ALA  79          3HB       ALA  79  -6.972   4.852  -1.423
  632    H    CYS  80           H        CYS  80  -5.258   3.340  -0.831
  633    HA   CYS  80           HA       CYS  80  -2.930   3.047  -2.667
  634   1HB   CYS  80          1HB       CYS  80  -3.297   1.823   0.078
  635   2HB   CYS  80          2HB       CYS  80  -2.268   1.086  -1.158
  636    H    ARG  81           H        ARG  81  -3.599   1.985  -4.367
  637    HA   ARG  81           HA       ARG  81  -5.882   0.227  -4.506
  638   1HB   ARG  81          1HB       ARG  81  -4.836   1.457  -6.417
  639   2HB   ARG  81          2HB       ARG  81  -3.389   0.455  -6.225
  640   1HG   ARG  81          1HG       ARG  81  -4.715  -1.586  -6.711
  641   2HG   ARG  81          2HG       ARG  81  -6.140  -0.563  -6.950
  642   1HD   ARG  81          1HD       ARG  81  -3.556  -0.401  -8.556
  643   2HD   ARG  81          2HD       ARG  81  -5.049  -1.195  -9.085
  644    HE   ARG  81           HE       ARG  81  -5.608   1.506  -8.337
  645   1HH1  ARG  81          1HH2      ARG  81  -3.972  -0.278 -10.930
  646   2HH1  ARG  81          2HH2      ARG  81  -4.467   0.834 -12.179
  647   1HH2  ARG  81          1HH1      ARG  81  -6.101   3.041  -9.941
  648   2HH2  ARG  81          2HH1      ARG  81  -5.619   2.777 -11.596
  649    H    VAL  82           H        VAL  82  -5.863  -2.079  -4.033
  650    HA   VAL  82           HA       VAL  82  -3.206  -3.368  -3.870
  651    HB   VAL  82           HB       VAL  82  -5.477  -3.795  -1.880
  652   1HG1  VAL  82          1HG1      VAL  82  -2.737  -5.065  -2.275
  653   2HG1  VAL  82          2HG1      VAL  82  -3.752  -5.313  -0.842
  654   3HG1  VAL  82          3HG1      VAL  82  -4.318  -5.872  -2.417
  655   1HG2  VAL  82          1HG2      VAL  82  -4.303  -1.721  -1.333
  656   2HG2  VAL  82          2HG2      VAL  82  -3.777  -2.979  -0.219
  657   3HG2  VAL  82          3HG2      VAL  82  -2.724  -2.510  -1.561
  658    H    ASN  83           H        ASN  83  -3.165  -4.723  -5.519
  659    HA   ASN  83           HA       ASN  83  -5.511  -6.499  -5.940
  660   1HB   ASN  83          1HB       ASN  83  -5.410  -4.606  -7.646
  661   2HB   ASN  83          2HB       ASN  83  -3.878  -5.249  -8.188
  662   1HD2  ASN  83          2HD2      ASN  83  -4.558  -5.936 -10.280
  663   2HD2  ASN  83          1HD2      ASN  83  -5.785  -7.170 -10.503
  664    H    HIS  84           H        HIS  84  -4.387  -8.179  -4.798
  665    HA   HIS  84           HA       HIS  84  -1.782  -9.189  -5.739
  666   1HB   HIS  84          1HB       HIS  84  -2.564  -9.569  -3.442
  667   2HB   HIS  84          2HB       HIS  84  -3.978 -10.421  -4.064
  668    HD2  HIS  84           HD2      HIS  84  -0.018 -10.967  -4.208
  669    HE1  HIS  84           HE1      HIS  84  -2.061 -14.668  -4.402
  670    HE2  HIS  84           HE2      HIS  84   0.267 -13.550  -4.304
  671    H    VAL  85           H        VAL  85  -1.699 -11.189  -7.077
  672    HA   VAL  85           HA       VAL  85  -3.464 -11.267  -9.234
  673    HB   VAL  85           HB       VAL  85  -1.247 -12.162  -9.329
  674   1HG1  VAL  85          1HG1      VAL  85  -1.032 -13.275  -7.141
  675   2HG1  VAL  85          2HG1      VAL  85  -2.233 -14.487  -7.637
  676   3HG1  VAL  85          3HG1      VAL  85  -0.666 -14.400  -8.456
  677   1HG2  VAL  85          1HG2      VAL  85  -2.892 -12.883 -10.990
  678   2HG2  VAL  85          2HG2      VAL  85  -1.656 -14.117 -10.693
  679   3HG2  VAL  85          3HG2      VAL  85  -3.278 -14.312 -10.002
  680    H    THR  86           H        THR  86  -3.765 -12.989  -6.127
  681    HA   THR  86           HA       THR  86  -5.931 -14.646  -7.051
  682    HB   THR  86           HB       THR  86  -4.272 -15.009  -5.087
  683    HG1  THR  86           HG1      THR  86  -5.756 -16.486  -5.790
  684   1HG2  THR  86          1HG2      THR  86  -6.664 -14.005  -3.526
  685   2HG2  THR  86          2HG2      THR  86  -5.084 -14.556  -2.923
  686   3HG2  THR  86          3HG2      THR  86  -5.225 -12.998  -3.769
  687    H    LEU  87           H        LEU  87  -5.776 -11.316  -5.836
  688    HA   LEU  87           HA       LEU  87  -8.674 -11.084  -5.474
  689   1HB   LEU  87          1HB       LEU  87  -6.342  -9.172  -5.631
  690   2HB   LEU  87          2HB       LEU  87  -7.933  -8.591  -6.075
  691    HG   LEU  87           HG       LEU  87  -8.867  -9.176  -3.941
  692   1HD1  LEU  87          1HD1      LEU  87  -7.520 -11.144  -3.324
  693   2HD1  LEU  87          2HD1      LEU  87  -6.057 -10.143  -3.250
  694   3HD1  LEU  87          3HD1      LEU  87  -7.365  -9.901  -2.073
  695   1HD2  LEU  87          1HD2      LEU  87  -7.808  -6.960  -4.257
  696   2HD2  LEU  87          2HD2      LEU  87  -7.625  -7.510  -2.582
  697   3HD2  LEU  87          3HD2      LEU  87  -6.252  -7.609  -3.702
  698    H    SER  88           H        SER  88  -6.364  -9.927  -7.954
  699    HA   SER  88           HA       SER  88  -6.501  -9.552 -10.139
  700   1HB   SER  88          1HB       SER  88  -7.530 -11.831 -10.343
  701   2HB   SER  88          2HB       SER  88  -9.133 -11.061 -10.328
  702    HG   SER  88           HG       SER  88  -7.031 -10.530 -12.154
  703    H    GLN  89           H        GLN  89  -9.456  -8.930  -8.261
  704    HA   GLN  89           HA       GLN  89 -10.112  -6.542  -9.856
  705   1HB   GLN  89          1HB       GLN  89 -11.468  -7.817  -7.472
  706   2HB   GLN  89          2HB       GLN  89 -12.057  -6.410  -8.376
  707   1HG   GLN  89          1HG       GLN  89 -12.149  -7.814 -10.446
  708   2HG   GLN  89          2HG       GLN  89 -11.677  -9.230  -9.492
  709   1HE2  GLN  89          2HE2      GLN  89 -13.112  -9.329  -7.290
  710   2HE2  GLN  89          1HE2      GLN  89 -14.833  -9.253  -7.605
  711    HA   PRO  90           HA       PRO  90  -7.434  -4.506  -6.860
  712   1HB   PRO  90          1HB       PRO  90  -7.742  -1.883  -7.638
  713   2HB   PRO  90          2HB       PRO  90  -6.806  -3.075  -8.585
  714   1HG   PRO  90          1HG       PRO  90  -9.670  -2.201  -8.995
  715   2HG   PRO  90          2HG       PRO  90  -8.377  -2.349 -10.221
  716   1HD   PRO  90          1HD       PRO  90 -10.227  -4.301  -9.828
  717   2HD   PRO  90          2HD       PRO  90  -8.525  -4.720 -10.205
  718    H    LYS  91           H        LYS  91  -8.025  -4.458  -4.805
  719    HA   LYS  91           HA       LYS  91 -10.516  -3.141  -3.903
  720   1HB   LYS  91          1HB       LYS  91  -9.947  -5.375  -3.057
  721   2HB   LYS  91          2HB       LYS  91  -8.410  -4.768  -2.417
  722   1HG   LYS  91          1HG       LYS  91  -9.623  -3.233  -0.904
  723   2HG   LYS  91          2HG       LYS  91 -11.172  -3.740  -1.614
  724   1HD   LYS  91          1HD       LYS  91 -10.759  -6.063  -0.833
  725   2HD   LYS  91          2HD       LYS  91  -9.221  -5.540  -0.111
  726   1HE   LYS  91          1HE       LYS  91 -10.479  -3.941   1.347
  727   2HE   LYS  91          2HE       LYS  91 -12.001  -4.511   0.636
  728   1HZ   LYS  91          1HZ       LYS  91 -10.099  -6.144   2.164
  729   2HZ   LYS  91          2HZ       LYS  91 -11.551  -5.580   2.702
  730   3HZ   LYS  91          3HZ       LYS  91 -11.500  -6.691   1.487
  731    H    ILE  92           H        ILE  92 -10.322  -0.945  -3.670
  732    HA   ILE  92           HA       ILE  92  -7.713   0.254  -3.154
  733    HB   ILE  92           HB       ILE  92 -10.342   1.728  -3.341
  734   1HG1  ILE  92          1HG1      ILE  92 -10.405   0.390  -5.331
  735   2HG1  ILE  92          2HG1      ILE  92  -9.955   2.038  -5.748
  736   1HG2  ILE  92          1HG2      ILE  92  -7.431   2.418  -3.938
  737   2HG2  ILE  92          2HG2      ILE  92  -8.814   3.494  -4.226
  738   3HG2  ILE  92          3HG2      ILE  92  -8.408   2.988  -2.576
  739   1HD1  ILE  92          1HD1      ILE  92  -7.574   1.347  -5.950
  740   2HD1  ILE  92          2HD1      ILE  92  -8.037  -0.322  -5.533
  741   3HD1  ILE  92          3HD1      ILE  92  -8.641   0.425  -7.020
  742    H    VAL  93           H        VAL  93  -7.004   0.793  -1.148
  743    HA   VAL  93           HA       VAL  93  -8.943   0.927   1.132
  744    HB   VAL  93           HB       VAL  93  -5.993   0.187   1.069
  745   1HG1  VAL  93          1HG1      VAL  93  -7.923   0.502   3.414
  746   2HG1  VAL  93          2HG1      VAL  93  -6.317  -0.248   3.509
  747   3HG1  VAL  93          3HG1      VAL  93  -6.460   1.467   3.115
  748   1HG2  VAL  93          1HG2      VAL  93  -7.444  -1.651   0.325
  749   2HG2  VAL  93          2HG2      VAL  93  -6.879  -1.978   1.972
  750   3HG2  VAL  93          3HG2      VAL  93  -8.530  -1.390   1.709
  751    H    LYS  94           H        LYS  94  -9.424   2.981   1.583
  752    HA   LYS  94           HA       LYS  94  -7.664   5.220   0.972
  753   1HB   LYS  94          1HB       LYS  94 -10.263   4.992   2.542
  754   2HB   LYS  94          2HB       LYS  94  -9.384   6.507   2.259
  755   1HG   LYS  94          1HG       LYS  94  -9.562   6.176  -0.187
  756   2HG   LYS  94          2HG       LYS  94 -10.496   4.689   0.075
  757   1HD   LYS  94          1HD       LYS  94 -12.267   5.966   1.205
  758   2HD   LYS  94          2HD       LYS  94 -11.310   7.458   1.072
  759   1HE   LYS  94          1HE       LYS  94 -11.377   7.296  -1.402
  760   2HE   LYS  94          2HE       LYS  94 -12.345   5.812  -1.283
  761   1HZ   LYS  94          1HZ       LYS  94 -14.047   7.103  -0.194
  762   2HZ   LYS  94          2HZ       LYS  94 -13.127   8.473  -0.310
  763   3HZ   LYS  94          3HZ       LYS  94 -13.685   7.743  -1.672
  764    H    TRP  95           H        TRP  95  -6.213   6.174   2.307
  765    HA   TRP  95           HA       TRP  95  -5.488   4.817   4.802
  766   1HB   TRP  95          1HB       TRP  95  -3.653   5.395   3.467
  767   2HB   TRP  95          2HB       TRP  95  -4.333   6.938   3.039
  768    HD1  TRP  95           HD1      TRP  95  -3.061   5.467   6.421
  769    HE1  TRP  95           HE1      TRP  95  -1.842   7.387   7.668
  770    HE3  TRP  95           HE3      TRP  95  -3.561   9.138   2.945
  771    HZ2  TRP  95           HZ2      TRP  95  -1.466  10.244   7.318
  772    HZ3  TRP  95           HZ3      TRP  95  -2.769  11.449   3.413
  773    HH2  TRP  95           HH2      TRP  95  -1.898  12.022   5.649
  774    H    ASP  96           H        ASP  96  -5.975   5.488   6.792
  775    HA   ASP  96           HA       ASP  96  -7.864   7.584   7.353
  776   1HB   ASP  96          1HB       ASP  96  -7.466   6.901   9.679
  777   2HB   ASP  96          2HB       ASP  96  -7.648   5.474   8.655
  778    H    ARG  97           H        ARG  97  -7.176   9.143   9.304
  779    HA   ARG  97           HA       ARG  97  -4.420  10.212   8.934
  780   1HB   ARG  97          1HB       ARG  97  -7.015  11.787   8.684
  781   2HB   ARG  97          2HB       ARG  97  -5.526  12.512   9.286
  782   1HG   ARG  97          1HG       ARG  97  -5.645  13.072   7.048
  783   2HG   ARG  97          2HG       ARG  97  -4.332  11.907   7.199
  784   1HD   ARG  97          1HD       ARG  97  -5.363  10.418   5.786
  785   2HD   ARG  97          2HD       ARG  97  -6.950  10.675   6.548
  786    HE   ARG  97           HE       ARG  97  -6.096  12.935   4.952
  787   1HH1  ARG  97          1HH2      ARG  97  -7.386   9.655   4.535
  788   2HH1  ARG  97          2HH2      ARG  97  -8.562  10.146   3.342
  789   1HH2  ARG  97          1HH1      ARG  97  -7.593  13.560   3.436
  790   2HH2  ARG  97          2HH1      ARG  97  -8.684  12.423   2.690
  791    H    ASP  98           H        ASP  98  -3.671   9.586  10.853
  792    HA   ASP  98           HA       ASP  98  -5.087  10.033  13.386
  793   1HB   ASP  98          1HB       ASP  98  -3.585   8.103  13.094
  794   2HB   ASP  98          2HB       ASP  98  -2.236   9.182  12.712
  795    H    MET  99           H        MET  99  -5.397  12.285  12.343
  796    HA   MET  99           HA       MET  99  -3.146  14.159  12.895
  797   1HB   MET  99          1HB       MET  99  -3.933  14.004  10.554
  798   2HB   MET  99          2HB       MET  99  -5.580  14.388  11.072
  799   1HG   MET  99          1HG       MET  99  -4.822  16.616  11.843
  800   2HG   MET  99          2HG       MET  99  -3.171  16.238  11.339
  801   1HE   MET  99          1HE       MET  99  -4.655  18.879  10.483
  802   2HE   MET  99          2HE       MET  99  -3.007  18.449   9.965
  803   3HE   MET  99          3HE       MET  99  -4.213  18.960   8.762