*HEADER    HYDROLASE                               16-DEC-04   1Y9O              
*TITLE     1H NMR STRUCTURE OF ACYLPHOSPHATASE FROM THE                          
*TITLE    2 HYPERTHERMOPHILE SULFOLOBUS SOLFATARICUS                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ACYLPHOSPHATASE;                                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 EC: 3.6.1.7;                                                         
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS;                        
*SOURCE   3 ORGANISM_COMMON: ARCHAEA;                                            
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PGEX-2T                                   
*KEYWDS    SSO, ACYLPHOSPHATASE, HYPERTHERMOPHILE, NMR                           
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    A.CORAZZA, C.ROSANO, K.PAGANO, V.ALVERDI, G.ESPOSITO,                 
*AUTHOR   2 C.CAPANNI, F.BEMPORAD, G.PLAKOUTSI, M.STEFANI, F.CHITI,              
*AUTHOR   3 S.ZUCCOTTI, M.BOLOGNESI, P.VIGLINO                                   
*REVDAT   1   29-NOV-05 1Y9O    0                                                

UPPER LIMIT     
80 ALA HA 80 ALA QB 3.25
80 ALA QB 81 ALA HA 6.90
80 ALA HN 80 ALA QB 3.74
80 ALA HN 81 ALA QB 5.10
81 ALA HA 81 ALA QB 3.46
80 ALA QB 81 ALA HN 7.29
81 ALA QB 82 GLU- HN 7.29
81 ALA HN 81 ALA QB 3.59
8 ASP- HN 8 ASP- HA 2.72
13 GLU- HB2 13 GLU- QG 2.34
13 GLU- HB3 13 GLU- QG 2.73
15 LEU HA 15 LEU HB2 2.45
16 LYS+ HN 18 MET HN 6.46
17 ARG+ QG 18 MET HN 4.55
18 MET HN 61 GLU- HA 3.29
19 TYR HA 20 ALA HN 2.21
19 TYR HA 20 ALA QB 4.88
19 TYR HN 19 TYR HA 2.91
20 ALA HN 58 VAL HB 3.28
21 ARG+ HN 21 ARG+ HA 2.91
21 ARG+ HN 88 TYR QB 4.77
23 TYR HA 23 TYR HB3 2.70
23 TYR HN 23 TYR HA 2.96
24 GLY HA1 25 LEU HN 2.96
25 LEU HA 26 VAL HN 2.95
25 LEU HN 25 LEU HA 2.89
26 VAL HN 26 VAL HB 3.69
26 VAL HN 84 GLU- QB 5.77
31 PHE HN 31 PHE HB3 3.68
33 LYS+ HA 34 PHE HN 4.39
33 LYS+ HN 33 LYS+ HA 2.76
34 PHE HA 35 VAL HN 4.29
34 PHE HN 34 PHE HB3 2.70
35 VAL HN 35 VAL HA 2.92
36 GLN HA 36 GLN QE2 3.71
35 VAL HA 36 GLN HN 3.39
35 VAL HB 36 GLN HN 6.25
36 GLN HN 36 GLN HA 3.37
36 GLN QE2 39 ALA QB 6.25
37 ILE HA 37 ILE HB 3.14
37 ILE HA 38 HIS HN 4.21
37 ILE HA 40 ILE QG2 4.33
37 ILE HA 41 ARG+ HN 3.82
36 GLN HA 37 ILE HN 3.63
36 GLN HN 37 ILE HN 2.79
37 ILE HN 37 ILE HA 2.83
37 ILE QG1 38 HIS HD2 6.30
38 HIS HA 38 HIS HB2 4.13
38 HIS HA 38 HIS HB3 3.95
38 HIS HA 39 ALA HN 3.82
38 HIS HB2 38 HIS HD2 4.21
38 HIS HB3 38 HIS HD2 4.04
38 HIS HN 38 HIS HB2 6.25
38 HIS HN 38 HIS HB3 6.25
38 HIS HN 38 HIS QB 6.25
39 ALA HA 40 ILE HN 3.63
39 ALA HA 44 ILE HB 2.65
39 ALA HA 44 ILE HG21 3.64
40 ILE HA 41 ARG+ HN 3.62
40 ILE HN 40 ILE QG2 4.36
41 ARG+ HA 42 LEU HN 3.62
42 LEU HA 43 GLY HN 3.43
43 GLY HA2 44 ILE HN 3.59
44 ILE HA 44 ILE HB 3.00
44 ILE HA 45 LYS+ HN 2.88
44 ILE HB 45 LYS+ HN 4.09
44 ILE HB 61 GLU- HN 4.90
44 ILE HN 44 ILE HA 2.92
44 ILE QG2 61 GLU- HA 5.04
45 LYS+ HN 45 LYS+ HB3 3.71
46 GLY HA2 47 TYR HN 2.65
46 GLY HN 100 PHE HA 2.67
49 LYS+ HA 49 LYS+ HG2 6.05
49 LYS+ HA 49 LYS+ QD 6.05
49 LYS+ QG 49 LYS+ QE 6.00
50 ASN HN 103 TYR HN 3.35
51 LEU HA 51 LEU HB2 2.98
51 LEU HN 51 LEU HB3 3.47
51 LEU HN 52 PRO QD 4.60
53 ASP- HA 54 GLY HN 6.00
54 GLY HN 54 GLY HA1 2.94
54 GLY HN 54 GLY HA2 2.95
58 VAL HA 58 VAL HB 3.01
61 GLU- HN 61 GLU- HA 2.85
62 GLY HA1 63 TYR HN 2.64
62 GLY HA2 63 TYR HN 3.22
63 TYR HA 63 TYR HB2 2.98
63 TYR HA 63 TYR HB3 2.83
63 TYR HN 63 TYR HB3 3.34
64 GLU- HA 65 GLU- HN 4.75
64 GLU- HA 67 LEU HN 3.50
64 GLU- HA 67 LEU QB 5.00
65 GLU- HA 66 ALA HN 4.86
65 GLU- HA 68 SER HN 6.05
65 GLU- HN 65 GLU- HB2 3.49
65 GLU- HN 65 GLU- HB3 3.43
66 ALA HA 67 LEU QB 5.99
66 ALA HA 69 LYS+ QB 3.12
67 LEU HA 68 SER HN 3.62
67 LEU HA 70 LEU HN 3.92
67 LEU HA 70 LEU QB 6.05
67 LEU HG 68 SER HN 3.24
68 SER HA 69 LYS+ HN 3.56
68 SER HA 71 LEU HB2 2.98
68 SER HA 71 LEU HB3 3.40
69 LYS+ HA 70 LEU HN 3.71
69 LYS+ HA 72 GLU- HN 4.78
69 LYS+ HA 72 GLU- QB 6.05
70 LEU HA 70 LEU HG 3.72
70 LEU HA 71 LEU HN 3.58
70 LEU HA 73 ARG+ HN 4.94
70 LEU HA 73 ARG+ QB 6.05
70 LEU HN 70 LEU HG 4.33
71 LEU HA 72 GLU- HN 4.21
71 LEU HA 74 ILE HB 6.05
71 LEU HA 75 LYS+ HN 4.650
72 GLU- HA 73 ARG+ HN 4.43
72 GLU- HA 75 LYS+ QB 6.05
73 ARG+ HA 73 ARG+ HD3 3.87
73 ARG+ HA 74 ILE HN 3.65
73 ARG+ HA 76 GLN QB 6.05
73 ARG+ QG 74 ILE QD1 4.94
73 ARG+ QH1 74 ILE QG2 4.84
74 ILE HA 74 ILE HB 3.01
74 ILE HA 75 LYS+ HN 4.36
74 ILE HB 75 LYS+ HN 3.11
74 ILE HN 74 ILE HB 3.02
74 ILE QG2 74 ILE QD1 6.05
75 LYS+ HA 76 GLN HN 4.70
76 GLN HA 77 GLY HN 3.64
80 ALA HN 80 ALA HA 2.85
81 ALA HN 81 ALA HA 2.93
82 GLU- HA 83 VAL HN 2.27
85 LYS+ HN 85 LYS+ HA 2.80
86 VAL HA 87 ASP- HN 2.35
86 VAL HN 86 VAL HB 3.34
87 ASP- HA 87 ASP- HB2 2.61
87 ASP- HA 88 TYR HN 2.41
87 ASP- HN 88 TYR HA 4.55
89 SER HN 89 SER HA 2.87
90 PHE HA 90 PHE HB2 2.65
90 PHE HA 91 SER HN 2.40
92 GLU- HA 93 TYR HN 2.30
93 TYR HN 93 TYR HB2 4.21
96 GLU- HA 96 GLU- HB2 2.37
96 GLU- HA 96 GLU- HB3 2.55
96 GLU- HA 96 GLU- QB 2.33
98 GLU- HA 99 ASP- HN 2.27
98 GLU- HN 98 GLU- HA 2.60
101 GLU- HA 102 THR HN 2.50
101 GLU- HN 101 GLU- HA 2.98
4 LYS+ HA 5 LYS+ HN 3.62
6 TRP HA 7 SER HN 2.93
6 TRP HN 6 TRP HZ3 7.20
6 TRP HN 6 TRP QB 3.91
6 TRP HN 7 SER HN 4.15
7 SER HA 8 ASP- HN 3.54
7 SER HN 7 SER QB 3.87
8 ASP- HN 8 ASP- HB2 3.54
8 ASP- HN 8 ASP- HB3 3.54
8 ASP- HN 8 ASP- QB 3.27
9 THR HA 9 THR QG2 3.65
9 THR HN 10 GLU- HN 5.02
9 THR HN 9 THR QG2 4.97
10 GLU- HA 10 GLU- QB 2.86
10 GLU- HA 10 GLU- QG 3.38
10 GLU- HA 11 VAL HN 2.82
10 GLU- HN 10 GLU- HG2 6.26
10 GLU- HN 10 GLU- HG3 6.26
10 GLU- HN 11 VAL HN 7.20
11 VAL HA 12 PHE HN 2.70
11 VAL HB 12 PHE HN 4.83
11 VAL HN 12 PHE HN 4.51
12 PHE HA 12 PHE HB2 3.19
12 PHE HA 12 PHE HB3 3.19
12 PHE HN 12 PHE QB 3.68
12 PHE HN 13 GLU- HN 3.03
13 GLU- HA 13 GLU- HB2 2.96
13 GLU- HA 13 GLU- HB3 2.65
13 GLU- HA 13 GLU- QG 3.83
13 GLU- HA 14 MET HN 2.64
13 GLU- HN 13 GLU- HB3 3.61
13 GLU- HN 13 GLU- QG 7.18
13 GLU- HN 14 MET HN 4.27
14 MET HN 14 MET QG 5.46
14 MET HN 15 LEU HN 4.51
15 LEU HA 63 TYR HA 2.59
15 LEU HB2 16 LYS+ HN 3.15
15 LEU HB3 16 LYS+ HN 4.20
15 LEU HN 15 LEU HG 6.26
15 LEU HN 16 LYS+ HN 5.74
16 LYS+ HA 16 LYS+ QD 4.21
16 LYS+ HA 16 LYS+ QG 3.79
16 LYS+ HA 17 ARG+ HN 2.67
16 LYS+ HA 93 TYR HN 3.14
16 LYS+ HN 16 LYS+ HA 3.03
16 LYS+ HN 16 LYS+ QD 7.18
16 LYS+ HN 16 LYS+ QE 5.52
16 LYS+ HN 62 GLY HN 4.35
16 LYS+ HN 63 TYR HA 3.34
16 LYS+ HN 63 TYR HN 5.55
16 LYS+ QB 16 LYS+ QE 8.09
16 LYS+ QB 17 ARG+ HN 4.01
16 LYS+ QB 18 MET HN 6.60
16 LYS+ QD 17 ARG+ HN 7.18
16 LYS+ QD 18 MET HN 4.86
16 LYS+ QG 17 ARG+ HN 4.07
17 ARG+ HA 18 MET HN 2.61
17 ARG+ HA 61 GLU- HA 6.26
17 ARG+ HA 62 GLY HN 3.77
17 ARG+ HN 17 ARG+ QD 5.55
17 ARG+ HN 17 ARG+ QG 4.04
17 ARG+ HN 91 SER HN 5.01
18 MET HA 18 MET QE 5.07
18 MET HA 18 MET QG 3.82
18 MET HA 90 PHE HA 2.71
18 MET HA 91 SER HN 3.33
18 MET HB2 19 TYR HN 3.61
18 MET HB2 61 GLU- HA 5.29
18 MET HN 18 MET HB2 3.67
18 MET HN 18 MET QG 5.74
18 MET HN 19 TYR HN 5.81
18 MET HN 60 ALA HN 4.56
18 MET HN 60 ALA QB 4.67
18 MET QE 20 ALA QB 3.88
18 MET QE 60 ALA QB 3.65
19 TYR HA 19 TYR QB 2.79
19 TYR HA 60 ALA HN 6.00
19 TYR HN 19 TYR QB 3.66
19 TYR HN 20 ALA HN 5.46
19 TYR HN 89 SER HN 4.22
19 TYR HN 90 PHE HA 3.82
20 ALA HA 21 ARG+ HN 2.27
20 ALA HA 88 TYR HA 2.44
20 ALA HA 89 SER HN 3.06
20 ALA HN 20 ALA QB 3.28
20 ALA HN 58 VAL HN 3.66
20 ALA HN 59 VAL HA 6.00
20 ALA QB 21 ARG+ HN 3.69
20 ALA QB 58 VAL HN 4.76
20 ALA QB 88 TYR HB2 3.73
20 ALA QB 88 TYR HB3 3.73
20 ALA QB 88 TYR QB 3.43
21 ARG+ HA 21 ARG+ HD2 2.94
21 ARG+ HA 21 ARG+ HD3 2.94
21 ARG+ HA 21 ARG+ QB 2.80
21 ARG+ HA 21 ARG+ QG 3.74
21 ARG+ HA 57 GLU- HA 2.80
21 ARG+ HA 58 VAL HN 3.23
21 ARG+ HN 21 ARG+ HD2 4.80
21 ARG+ HN 21 ARG+ HD3 4.88
21 ARG+ HN 21 ARG+ QD 4.63
21 ARG+ HN 87 ASP- HN 7.20
21 ARG+ HN 88 TYR HA 3.46
21 ARG+ QB 21 ARG+ HE 4.41
21 ARG+ QB 21 ARG+ QD 3.30
22 VAL HA 23 TYR HN 2.20
22 VAL HA 86 VAL HA 2.94
22 VAL HA 87 ASP- HN 4.02
22 VAL HN 22 VAL HB 2.94
22 VAL HN 23 TYR HN 6.08
22 VAL HN 56 VAL HN 4.42
22 VAL HN 57 GLU- HA 3.04
23 TYR HA 23 TYR HB2 3.07
23 TYR HA 24 GLY HN 2.34
23 TYR HB2 24 GLY HN 4.10
23 TYR HB3 24 GLY HN 4.39
23 TYR HB3 85 LYS+ HN 3.40
23 TYR HN 23 TYR HB2 3.47
23 TYR HN 24 GLY HN 5.31
23 TYR HN 85 LYS+ HN 5.08
23 TYR HN 86 VAL HA 3.58
24 GLY HA1 84 GLU- HN 3.37
24 GLY HA2 25 LEU HN 2.70
24 GLY HA2 84 GLU- HN 3.37
24 GLY HN 24 GLY HA1 3.04
24 GLY HN 24 GLY HA2 3.04
24 GLY HN 24 GLY QA 2.68
24 GLY QA 25 LEU HN 2.52
24 GLY QA 83 VAL HA 3.81
24 GLY QA 84 GLU- HN 2.91
25 LEU HA 25 LEU HG 2.75
25 LEU HN 82 GLU- HN 4.91
25 LEU HN 83 VAL HA 3.75
25 LEU HN 83 VAL HB 6.26
27 GLN HA 27 GLN HG2 3.32
27 GLN HA 27 GLN HG3 3.23
27 GLN HA 27 GLN QG 3.02
27 GLN HA 28 GLY HN 2.73
27 GLN HE21 50 ASN HA 3.55
27 GLN HE21 51 LEU HN 4.54
27 GLN HE21 52 PRO QB 4.70
27 GLN HE22 50 ASN HA 3.91
27 GLN HE22 51 LEU HD11 6.00
27 GLN HN 27 GLN QB 3.98
27 GLN HN 27 GLN QG 7.18
27 GLN HN 28 GLY HN 7.20
27 GLN QB 27 GLN QG 2.46
28 GLY HN 28 GLY HA1 2.85
28 GLY HN 28 GLY HA2 2.85
28 GLY HN 28 GLY QA 2.62
28 GLY HN 29 VAL HN 7.20
29 VAL HA 30 GLY HN 2.64
29 VAL HN 30 GLY HN 7.20
30 GLY HN 30 GLY QA 2.77
30 GLY HN 31 PHE HN 4.77
30 GLY QA 33 LYS+ HN 6.77
31 PHE HA 31 PHE QB 2.64
31 PHE HA 34 PHE HB2 3.60
31 PHE HA 34 PHE HB3 3.13
31 PHE HA 34 PHE HN 3.56
31 PHE HN 31 PHE HA 2.89
31 PHE HN 31 PHE HB2 3.53
31 PHE HN 31 PHE QB 3.05
33 LYS+ HA 102 THR QG2 3.62
33 LYS+ HA 33 LYS+ QG 3.71
33 LYS+ HA 36 GLN HB2 3.86
33 LYS+ HA 36 GLN HB3 3.86
33 LYS+ HA 36 GLN HN 6.26
33 LYS+ HA 36 GLN QB 3.16
33 LYS+ HN 33 LYS+ QG 4.66
33 LYS+ HN 34 PHE HN 4.56
34 PHE HA 34 PHE HB2 3.01
34 PHE HA 37 ILE HB 6.26
34 PHE HA 37 ILE HN 4.15
34 PHE HB2 35 VAL HN 3.74
34 PHE HB3 35 VAL HN 3.14
34 PHE HN 34 PHE HB2 2.58
34 PHE HN 35 VAL HN 4.05
35 VAL HA 38 HIS HN 4.58
36 GLN HA 39 ALA HN 4.11
36 GLN HA 39 ALA QB 3.28
36 GLN HA 40 ILE HN 4.48
36 GLN HB2 36 GLN HE21 5.19
36 GLN HB2 36 GLN HE22 5.19
36 GLN HB3 36 GLN HE21 5.19
36 GLN HB3 36 GLN HE22 5.19
36 GLN HG2 37 ILE HN 6.12
36 GLN HG3 37 ILE HN 6.12
36 GLN HN 36 GLN QE2 4.28
36 GLN HN 36 GLN QG 6.12
36 GLN QB 36 GLN QE2 4.02
36 GLN QB 37 ILE HN 6.12
36 GLN QE2 40 ILE QD1 5.12
36 GLN QG 37 ILE HN 6.12
37 ILE HA 37 ILE QD1 3.06
37 ILE HA 37 ILE QG1 4.50
37 ILE HA 37 ILE QG2 3.93
37 ILE HA 40 ILE HB 3.06
37 ILE HA 40 ILE HN 6.26
37 ILE HA 40 ILE QD1 6.43
37 ILE HB 37 ILE QG1 3.36
37 ILE HB 38 HIS HN 3.15
37 ILE HN 37 ILE QD1 5.55
37 ILE HN 37 ILE QG1 5.45
37 ILE HN 37 ILE QG2 4.91
37 ILE HN 38 HIS HD2 6.48
37 ILE HN 38 HIS HN 4.29
37 ILE QD1 38 HIS HD2 6.07
37 ILE QG1 38 HIS HN 5.91
37 ILE QG2 37 ILE QD1 5.15
37 ILE QG2 37 ILE QG1 5.36
37 ILE QG2 38 HIS HA 5.18
37 ILE QG2 38 HIS HD2 5.59
37 ILE QG2 38 HIS HN 5.50
37 ILE QG2 41 ARG+ QD 6.81
38 HIS HA 38 HIS HD2 4.26
38 HIS HA 41 ARG+ HB2 4.22
38 HIS HA 41 ARG+ HB3 4.22
38 HIS HA 41 ARG+ HN 3.97
38 HIS HA 41 ARG+ QD 4.87
38 HIS HA 42 LEU HN 6.04
38 HIS HB2 39 ALA HN 3.44
38 HIS HB3 39 ALA HN 3.44
38 HIS HN 38 HIS HD2 6.78
38 HIS HN 39 ALA HN 3.97
38 HIS HN 42 LEU HN 7.08
38 HIS QB 39 ALA HN 3.14
39 ALA HA 41 ARG+ HN 4.55
39 ALA HA 42 LEU HN 4.18
39 ALA HN 39 ALA HA 2.85
39 ALA HN 39 ALA QB 2.94
39 ALA HN 40 ILE HN 4.15
39 ALA QB 40 ILE HN 3.13
39 ALA QB 40 ILE QD1 3.80
39 ALA QB 40 ILE QG1 8.07
39 ALA QB 44 ILE HB 3.11
40 ILE HA 40 ILE QG2 3.50
40 ILE HA 43 GLY HN 4.54
40 ILE HB 41 ARG+ HN 6.26
40 ILE HN 40 ILE HA 2.84
40 ILE HN 40 ILE QD1 7.20
40 ILE HN 40 ILE QG1 5.26
40 ILE HN 41 ARG+ HN 4.41
40 ILE QG2 40 ILE QG1 4.25
40 ILE QG2 41 ARG+ HN 5.37
41 ARG+ HA 41 ARG+ QD 6.03
41 ARG+ HA 41 ARG+ QG 3.12
41 ARG+ HN 41 ARG+ HA 3.04
41 ARG+ HN 41 ARG+ QB 3.52
41 ARG+ HN 41 ARG+ QD 6.51
41 ARG+ HN 41 ARG+ QG 3.98
41 ARG+ HN 42 LEU HN 2.76
41 ARG+ HN 43 GLY HN 4.50
41 ARG+ QB 41 ARG+ QG 2.41
41 ARG+ QB 42 LEU HN 4.05
41 ARG+ QG 41 ARG+ QD 2.61
41 ARG+ QG 42 LEU HN 7.18
42 LEU HA 42 LEU QB 2.63
42 LEU HN 42 LEU HG 2.59
42 LEU HN 43 GLY HN 3.95
42 LEU HN 44 ILE HN 7.29
43 GLY HA1 44 ILE HN 3.38
43 GLY HN 43 GLY QA 2.68
43 GLY HN 44 ILE HN 4.02
43 GLY QA 44 ILE HN 3.18
44 ILE HA 44 ILE QD1 2.92
44 ILE HA 44 ILE QG1 4.55
44 ILE HA 44 ILE QG2 4.04
44 ILE HB 44 ILE QG1 3.65
44 ILE HN 44 ILE QD1 6.30
44 ILE HN 44 ILE QG1 8.14
44 ILE HN 44 ILE QG2 4.83
44 ILE HN 45 LYS+ HN 4.87
44 ILE QD1 61 GLU- HN 7.18
44 ILE QG1 45 LYS+ HN 4.86
44 ILE QG1 61 GLU- HN 5.58
44 ILE QG2 44 ILE QD1 4.04
44 ILE QG2 61 GLU- HN 4.96
45 LYS+ HA 45 LYS+ HZ1 5.26
45 LYS+ HA 45 LYS+ QG 3.81
45 LYS+ HA 99 ASP- HN 4.19
45 LYS+ HB2 45 LYS+ HE2 5.95
45 LYS+ HB2 45 LYS+ HE3 5.95
45 LYS+ HB2 45 LYS+ HZ1 5.81
45 LYS+ HB2 46 GLY HN 3.25
45 LYS+ HB3 45 LYS+ HE2 5.95
45 LYS+ HB3 45 LYS+ HE3 5.95
45 LYS+ HB3 45 LYS+ HZ1 5.81
45 LYS+ HB3 46 GLY HN 3.25
45 LYS+ HN 45 LYS+ HB2 3.31
45 LYS+ HN 45 LYS+ HG2 3.70
45 LYS+ HN 45 LYS+ HG3 3.70
45 LYS+ HN 45 LYS+ QB 3.23
45 LYS+ HN 45 LYS+ QG 3.52
45 LYS+ QB 45 LYS+ HZ1 5.07
45 LYS+ QB 45 LYS+ QE 4.53
45 LYS+ QB 46 GLY HN 2.95
45 LYS+ QG 45 LYS+ HZ1 4.57
45 LYS+ QG 45 LYS+ QE 3.80
45 LYS+ QG 46 GLY QA 8.09
46 GLY HA1 47 TYR HN 3.06
46 GLY HA1 60 ALA HA 4.59
46 GLY HA2 60 ALA HA 4.59
46 GLY HN 101 GLU- HN 5.08
46 GLY QA 47 TYR HN 2.55
46 GLY QA 60 ALA HA 3.86
46 GLY QA 61 GLU- HN 4.60
47 TYR HA 101 GLU- HN 6.00
47 TYR HB2 48 ALA HN 4.18
47 TYR HB3 48 ALA HN 3.79
47 TYR HN 59 VAL HN 4.40
47 TYR HN 60 ALA HA 3.92
47 TYR QB 48 ALA HN 3.69
48 ALA HA 49 LYS+ HA 6.26
48 ALA HA 49 LYS+ HN 2.30
48 ALA HA 58 VAL HA 2.66
48 ALA HA 59 VAL HN 3.83
48 ALA HN 102 THR HA 3.06
48 ALA HN 103 TYR HN 3.70
48 ALA QB 102 THR HA 4.35
48 ALA QB 102 THR HB 3.14
49 LYS+ HA 103 TYR HN 2.89
49 LYS+ HA 49 LYS+ HG3 3.68
49 LYS+ HA 49 LYS+ QG 3.04
49 LYS+ HA 50 ASN HN 2.43
49 LYS+ HN 49 LYS+ QG 5.78
49 LYS+ HN 50 ASN HA 5.00
49 LYS+ HN 57 GLU- HN 4.30
49 LYS+ HN 58 VAL HA 3.33
50 ASN HA 50 ASN HB2 2.52
50 ASN HA 57 GLU- HN 6.00
50 ASN HB2 51 LEU HN 6.00
50 ASN HB3 51 LEU HN 6.00
50 ASN HN 50 ASN HB2 3.00
50 ASN HN 50 ASN HB3 2.70
50 ASN HN 50 ASN QD2 8.07
50 ASN QD2 51 LEU HN 6.73
51 LEU HA 51 LEU HB3 2.56
51 LEU HA 51 LEU HG 2.93
51 LEU HN 51 LEU HA 3.06
51 LEU HN 51 LEU HB2 3.15
51 LEU HN 51 LEU HG 2.81
51 LEU HN 51 LEU QB 2.92
53 ASP- HN 53 ASP- HB2 4.08
53 ASP- HN 53 ASP- HB3 4.08
53 ASP- HN 53 ASP- QB 3.68
53 ASP- HN 54 GLY HN 3.64
54 GLY HN 55 SER HN 3.86
55 SER HA 56 VAL HN 2.51
55 SER QB 56 VAL HN 4.13
56 VAL HA 56 VAL HB 2.48
56 VAL HA 57 GLU- HN 2.26
57 GLU- HN 57 GLU- QG 7.18
58 VAL HA 59 VAL HN 2.24
58 VAL HN 58 VAL HB 2.68
59 VAL HA 60 ALA HN 2.33
59 VAL HN 59 VAL HA 3.01
60 ALA HA 61 GLU- HN 2.45
60 ALA HN 60 ALA QB 3.37
60 ALA QB 61 GLU- HN 3.89
61 GLU- HA 61 GLU- HG2 3.08
61 GLU- HA 61 GLU- HG3 3.08
61 GLU- HA 61 GLU- QG 2.81
61 GLU- HA 62 GLY HN 2.37
61 GLU- HN 61 GLU- HB2 3.88
61 GLU- HN 61 GLU- HB3 3.88
61 GLU- HN 61 GLU- QB 3.55
61 GLU- HN 61 GLU- QG 4.71
61 GLU- QB 62 GLY HN 4.30
63 TYR HA 64 GLU- HN 3.50
63 TYR HB2 64 GLU- HN 4.02
63 TYR HN 63 TYR HA 2.84
63 TYR HN 63 TYR HB2 3.03
64 GLU- HA 64 GLU- QG 3.59
64 GLU- HN 65 GLU- HN 3.82
64 GLU- QB 67 LEU HN 4.40
65 GLU- HB2 66 ALA HN 4.84
65 GLU- HB3 66 ALA HN 4.84
65 GLU- HN 65 GLU- HA 3.03
65 GLU- HN 65 GLU- HG2 3.43
65 GLU- HN 65 GLU- HG3 3.43
65 GLU- HN 65 GLU- QB 2.83
65 GLU- HN 65 GLU- QG 3.01
65 GLU- HN 66 ALA HN 4.39
65 GLU- QB 66 ALA HN 4.50
66 ALA HA 67 LEU HN 3.36
66 ALA HA 69 LYS+ HN 3.45
66 ALA HN 66 ALA QB 2.88
66 ALA HN 67 LEU HN 3.92
67 LEU HN 67 LEU HA 2.92
67 LEU HN 67 LEU HG 6.26
67 LEU HN 67 LEU QB 3.69
67 LEU HN 68 SER HN 3.70
67 LEU QB 67 LEU HG 2.43
67 LEU QB 68 SER HN 4.40
68 SER HA 68 SER QB 2.43
68 SER HA 71 LEU HN 3.50
68 SER HN 69 LYS+ HN 4.10
68 SER QB 69 LYS+ HN 4.34
69 LYS+ HA 69 LYS+ QB 2.70
69 LYS+ HA 69 LYS+ QD 7.18
69 LYS+ HA 69 LYS+ QG 3.60
69 LYS+ HB2 70 LEU HN 6.26
69 LYS+ HB3 70 LEU HN 6.26
69 LYS+ HN 69 LYS+ QB 3.53
69 LYS+ HN 69 LYS+ QD 3.71
69 LYS+ HN 69 LYS+ QG 4.12
69 LYS+ HN 70 LEU HN 6.00
69 LYS+ QB 69 LYS+ QD 3.60
69 LYS+ QB 69 LYS+ QE 5.99
69 LYS+ QB 69 LYS+ QG 2.47
70 LEU HN 70 LEU QB 3.01
70 LEU HN 71 LEU HN 3.84
70 LEU QB 70 LEU HG 2.60
70 LEU QB 71 LEU HA 7.18
70 LEU QB 71 LEU HG 7.18
70 LEU QB 71 LEU HN 4.74
71 LEU HA 71 LEU QB 2.70
71 LEU HA 72 GLU- QG 6.27
71 LEU HA 74 ILE HN 6.26
71 LEU HN 71 LEU HA 2.77
71 LEU HN 71 LEU HG 4.02
71 LEU HN 71 LEU QB 3.43
71 LEU HN 72 GLU- HN 4.38
71 LEU QB 72 GLU- HN 3.88
72 GLU- HA 72 GLU- QB 2.71
72 GLU- HA 75 LYS+ HN 6.26
72 GLU- HA 75 LYS+ QD 3.51
72 GLU- HN 72 GLU- QB 3.37
72 GLU- HN 72 GLU- QG 7.70
72 GLU- HN 73 ARG+ HN 3.82
72 GLU- QB 73 ARG+ HN 4.15
73 ARG+ HA 73 ARG+ HB2 2.90
73 ARG+ HA 73 ARG+ HB3 3.00
73 ARG+ HA 73 ARG+ HD2 2.90
73 ARG+ HA 73 ARG+ QB 2.51
73 ARG+ HA 73 ARG+ QG 3.76
73 ARG+ HB3 74 ILE HN 3.30
73 ARG+ HN 73 ARG+ HB2 3.60
73 ARG+ HN 73 ARG+ HB3 3.60
73 ARG+ HN 73 ARG+ QB 3.21
73 ARG+ HN 73 ARG+ QD 6.72
73 ARG+ HN 73 ARG+ QG 4.45
73 ARG+ HN 74 ILE HN 4.06
73 ARG+ QB 74 ILE HN 3.26
73 ARG+ QH1 74 ILE HA 6.00
74 ILE HA 74 ILE QG1 4.48
74 ILE HA 74 ILE QG2 4.10
74 ILE HA 77 GLY HN 3.87
74 ILE HB 74 ILE QD1 3.26
74 ILE HB 74 ILE QG1 3.65
74 ILE HB 75 LYS+ QG 5.11
74 ILE HN 74 ILE HA 2.87
74 ILE HN 74 ILE QD1 5.37
74 ILE HN 74 ILE QG1 4.62
74 ILE HN 74 ILE QG2 5.01
74 ILE HN 75 LYS+ HN 4.42
74 ILE QD1 75 LYS+ QE 5.35
74 ILE QG2 74 ILE QG1 4.15
74 ILE QG2 75 LYS+ HN 4.91
75 LYS+ HA 75 LYS+ QB 2.66
75 LYS+ HB2 76 GLN HN 3.92
75 LYS+ HB3 76 GLN HN 3.92
75 LYS+ HN 75 LYS+ HA 2.79
75 LYS+ HN 75 LYS+ QB 3.42
75 LYS+ HN 75 LYS+ QD 3.99
75 LYS+ HN 75 LYS+ QG 4.54
75 LYS+ HN 76 GLN HN 3.83
75 LYS+ QG 75 LYS+ QE 3.75
76 GLN HA 76 GLN QG 3.76
76 GLN HN 76 GLN QB 3.53
76 GLN HN 76 GLN QG 4.62
76 GLN HN 77 GLY HN 3.84
77 GLY HN 77 GLY QA 2.71
79 PRO HA 80 ALA HN 3.36
79 PRO HA 81 ALA HN 4.66
79 PRO QD 83 VAL HG11 4.90
79 PRO QG 80 ALA HN 5.27
80 ALA HN 81 ALA HN 4.03
81 ALA HA 82 GLU- HN 2.36
81 ALA HN 82 GLU- HA 6.26
81 ALA HN 82 GLU- HN 7.20
82 GLU- HN 82 GLU- HG2 6.26
82 GLU- HN 82 GLU- HG3 6.26
82 GLU- HN 82 GLU- QB 3.52
83 VAL HA 83 VAL HB 2.54
83 VAL HA 84 GLU- HN 2.34
83 VAL HA 85 LYS+ HN 3.95
83 VAL HN 83 VAL HB 2.43
84 GLU- HA 84 GLU- HG2 3.91
84 GLU- HA 84 GLU- HG3 3.91
84 GLU- HA 84 GLU- QB 2.73
84 GLU- HA 84 GLU- QG 3.39
84 GLU- HN 84 GLU- HA 2.96
84 GLU- HN 84 GLU- QB 3.60
84 GLU- HN 85 LYS+ HN 3.75
84 GLU- HN 86 VAL HN 7.18
84 GLU- QB 85 LYS+ QG 4.82
85 LYS+ HB2 85 LYS+ HE2 5.56
85 LYS+ HB2 85 LYS+ HE3 5.56
85 LYS+ HB3 85 LYS+ HE2 5.56
85 LYS+ HB3 85 LYS+ HE3 5.56
85 LYS+ HN 85 LYS+ QG 5.54
85 LYS+ QB 85 LYS+ QE 4.45
85 LYS+ QB 86 VAL HN 4.10
86 VAL HA 86 VAL HB 2.74
86 VAL HB 87 ASP- HN 6.26
86 VAL HN 87 ASP- HN 7.57
87 ASP- HA 87 ASP- HB3 3.03
87 ASP- HN 87 ASP- HB2 2.95
87 ASP- HN 87 ASP- HB3 3.09
87 ASP- HN 88 TYR HN 8.76
88 TYR HA 88 TYR HB2 2.56
88 TYR HA 88 TYR HB3 2.69
88 TYR HA 89 SER HN 2.39
88 TYR HN 89 SER HN 7.20
88 TYR QB 89 SER HN 4.02
89 SER HA 90 PHE HN 2.25
89 SER HN 89 SER QB 4.09
89 SER HN 90 PHE HN 4.89
89 SER QB 90 PHE HN 4.01
90 PHE HA 90 PHE HB3 2.97
90 PHE HB2 91 SER HN 5.23
90 PHE HB3 91 SER HN 6.00
90 PHE HN 90 PHE HB2 3.20
90 PHE HN 90 PHE HB3 2.97
90 PHE HN 91 SER HN 5.54
91 SER HN 91 SER HA 2.88
91 SER HN 92 GLU- HN 7.20
92 GLU- HA 92 GLU- QB 2.71
92 GLU- HN 92 GLU- HA 2.94
92 GLU- HN 92 GLU- HG2 4.06
92 GLU- HN 92 GLU- HG3 4.06
92 GLU- HN 92 GLU- QB 3.55
92 GLU- HN 92 GLU- QG 3.77
92 GLU- QB 92 GLU- QG 2.37
92 GLU- QB 93 TYR HN 4.40
92 GLU- QB 94 LYS+ HN 7.18
93 TYR HA 93 TYR QB 2.88
93 TYR HA 94 LYS+ HN 2.48
93 TYR HN 93 TYR HB3 2.70
93 TYR HN 93 TYR QB 2.60
94 LYS+ HA 94 LYS+ QB 2.58
94 LYS+ HA 94 LYS+ QD 3.99
94 LYS+ HA 94 LYS+ QG 3.65
94 LYS+ HB2 95 GLY HN 3.98
94 LYS+ HB3 95 GLY HN 3.98
94 LYS+ HN 94 LYS+ QD 6.56
94 LYS+ HN 94 LYS+ QG 5.26
94 LYS+ HN 95 GLY HN 4.07
94 LYS+ QG 95 GLY QA 4.78
95 GLY HN 96 GLU- HN 4.22
96 GLU- HA 96 GLU- QG 3.63
96 GLU- HN 96 GLU- HB2 4.01
96 GLU- HN 96 GLU- HB3 4.01
96 GLU- HN 96 GLU- QB 3.50
96 GLU- HN 96 GLU- QG 5.04
96 GLU- HN 97 PHE HN 4.08
97 PHE HA 97 PHE HB2 3.01
97 PHE HN 97 PHE HB2 3.24
97 PHE HN 97 PHE HB3 3.37
97 PHE HN 99 ASP- HN 6.68
98 GLU- HN 98 GLU- HG2 3.16
98 GLU- HN 98 GLU- HG3 3.16
98 GLU- HN 98 GLU- QB 3.89
98 GLU- HN 99 ASP- HN 7.20
99 ASP- HA 100 PHE HN 2.66
99 ASP- HA 99 ASP- QB 2.68
99 ASP- HN 100 PHE HN 7.20
99 ASP- HN 99 ASP- QB 3.84
100 PHE HA 100 PHE HB2 2.89
100 PHE HA 100 PHE HB3 3.05
100 PHE HA 101 GLU- HN 2.40
100 PHE HB2 101 GLU- HN 5.19
100 PHE HB3 101 GLU- HN 6.00
100 PHE HN 100 PHE HZ 8.66
101 GLU- HA 101 GLU- HG2 3.17
101 GLU- HA 101 GLU- HG3 2.94
101 GLU- HA 101 GLU- QG 2.71
101 GLU- HA 102 THR QG2 3.80
101 GLU- HN 101 GLU- QG 4.48
101 GLU- QG 102 THR QG2 4.37
102 THR HA 102 THR HB 2.43
102 THR HA 102 THR QG2 3.43
102 THR HA 103 TYR HN 2.37
102 THR HB 103 TYR HN 6.26
102 THR HN 102 THR QG2 3.71
103 TYR HA 103 TYR QB 2.75
103 TYR HN 103 TYR QB 3.58
19 TYR HA 59 VAL QG1 8.28
19 TYR HA 59 VAL QG2 8.28
19 TYR QD 59 VAL HB 7.27
19 TYR QD 59 VAL QG1 9.42
19 TYR QD 59 VAL QG2 9.42
19 TYR QE 20 ALA QB 8.19
23 TYR HA 26 VAL QG1 6.40
23 TYR HA 26 VAL QG2 6.40
24 GLY HA1 26 VAL QG1 8.95
24 GLY HA1 26 VAL QG2 8.95
24 GLY HN 26 VAL QG1 5.91
24 GLY HN 26 VAL QG2 5.91
26 VAL HN 26 VAL QG1 4.89
26 VAL HN 26 VAL QG2 4.89
26 VAL QG1 81 ALA QB 7.82
26 VAL QG2 81 ALA QB 7.82
34 PHE HA 34 PHE QE 5.92
34 PHE HN 34 PHE QE 8.15
34 PHE QD 73 ARG+ QB 8.24
34 PHE QE 73 ARG+ HB2 8.08
34 PHE QE 73 ARG+ HB3 8.08
34 PHE QE 73 ARG+ HD2 9.57
34 PHE QE 73 ARG+ HD3 9.57
34 PHE QE 73 ARG+ QB 8.38
39 ALA QB 100 PHE QD 9.15
39 ALA QB 100 PHE QE 9.15
42 LEU HA 42 LEU QD1 4.34
44 ILE QG1 100 PHE QE 9.63
47 TYR HN 100 PHE QE 7.01
48 ALA QB 100 PHE QE 7.86
49 LYS+ HN 103 TYR QD 7.68
16 LYS+ QB 63 TYR QD 8.82
67 LEU HG 90 PHE QD 8.12
71 LEU QD1 88 TYR QE 10.33
71 LEU QD2 88 TYR QE 10.33
23 TYR QE 86 VAL HA 7.61
23 TYR QE 86 VAL HB 8.38
90 PHE QD 91 SER HN 8.89
100 PHE QE 102 THR QG2 7.01
14 MET HB2 63 TYR QD 6.24
14 MET HB3 63 TYR QD 6.24
14 MET QB 63 TYR QD 6.94
15 LEU HA 15 LEU QD1 5.79
15 LEU HA 15 LEU QD2 5.79
15 LEU HA 93 TYR QD 8.92
15 LEU HN 15 LEU QD1 5.56
15 LEU HN 15 LEU QD2 5.50
15 LEU QD1 63 TYR QE 9.47
15 LEU QD1 93 TYR QD 8.20
15 LEU QD1 93 TYR QE 7.84
15 LEU QD2 63 TYR QE 9.47
15 LEU QD2 93 TYR QD 8.20
15 LEU QD2 93 TYR QE 7.84
15 LEU QQD 63 TYR QD 10.59
15 LEU QQD 63 TYR QE 9.46
15 LEU QQD 93 TYR QD 8.77
15 LEU QQD 93 TYR QE 8.49
16 LYS+ HN 93 TYR QD 9.34
18 MET HA 90 PHE QD 6.28
18 MET QE 70 LEU QD1 5.97
18 MET QE 70 LEU QD2 5.83
19 TYR QD 20 ALA HA 6.59
19 TYR QD 20 ALA HN 8.49
19 TYR QD 20 ALA QB 9.95
19 TYR QD 21 ARG+ QB 7.45
19 TYR QE 20 ALA HA 6.15
19 TYR QE 21 ARG+ HB2 5.58
19 TYR QE 21 ARG+ HB3 5.58
19 TYR QE 21 ARG+ HN 12.01
19 TYR QE 21 ARG+ QB 6.19
19 TYR QE 21 ARG+ QG 7.62
19 TYR QE 89 SER HN 9.33
21 ARG+ QB 23 TYR QD 7.12
22 VAL HA 23 TYR QD 7.03
22 VAL HA 86 VAL QG1 8.78
22 VAL HA 86 VAL QG2 7.08
23 TYR QD 24 GLY HN 7.81
23 TYR QE 86 VAL QG2 8.56
24 GLY HA2 26 VAL QG2 8.95
26 VAL HA 31 PHE QD 7.21
26 VAL HB 31 PHE QD 5.73
26 VAL QG1 31 PHE QD 8.45
26 VAL QG2 31 PHE QD 8.45
29 VAL QG1 81 ALA HA 4.49
29 VAL QG2 81 ALA HA 4.49
31 PHE HA 34 PHE QD 7.58
31 PHE QD 35 VAL QG1 10.27
34 PHE QD 35 VAL HN 7.47
34 PHE QD 35 VAL QG2 11.45
34 PHE QD 38 HIS HD2 9.01
34 PHE QD 73 ARG+ HA 8.12
34 PHE QD 74 ILE HA 6.49
34 PHE QD 77 GLY HN 10.38
34 PHE QD 78 PRO HA 7.62
34 PHE QE 35 VAL HN 8.85
34 PHE QE 35 VAL QG2 9.07
34 PHE QE 38 HIS HD2 9.00
34 PHE QE 73 ARG+ HA 6.77
34 PHE QE 74 ILE HA 6.00
34 PHE QE 77 GLY HN 7.31
34 PHE QE 78 PRO HA 7.12
35 VAL QG1 36 GLN HN 8.40
35 VAL QG2 36 GLN HN 9.33
39 ALA HA 70 LEU QD1 6.00
39 ALA HA 70 LEU QD2 6.00
39 ALA HN 70 LEU QD1 6.37
39 ALA HN 70 LEU QD2 6.37
39 ALA QB 70 LEU QD1 5.45
39 ALA QB 70 LEU QD2 5.45
42 LEU HA 42 LEU QD2 4.34
46 GLY HN 100 PHE QD 8.23
47 TYR QB 100 PHE QE 9.11
47 TYR QD 48 ALA HA 5.76
47 TYR QD 48 ALA HN 7.41
47 TYR QD 48 ALA QB 8.19
47 TYR QD 49 LYS+ HN 7.82
47 TYR QD 59 VAL QQG 11.50
48 ALA HA 58 VAL QG1 5.70
48 ALA HA 58 VAL QG2 5.70
48 ALA HN 103 TYR QD 9.89
49 LYS+ QD 103 TYR QD 8.45
49 LYS+ QE 103 TYR QD 8.81
49 LYS+ QG 103 TYR QD 7.61
59 VAL QG1 97 PHE HZ 7.99
59 VAL QG2 97 PHE HZ 7.99
59 VAL QQG 97 PHE QD 10.88
59 VAL QQG 97 PHE QE 10.18
61 GLU- HG2 97 PHE QD 8.12
61 GLU- HG2 97 PHE QE 8.12
61 GLU- HG3 97 PHE QD 8.12
61 GLU- HG3 97 PHE QE 8.12
67 LEU HA 67 LEU QD1 3.99
67 LEU HA 67 LEU QD2 4.15
67 LEU HN 67 LEU QD1 7.29
67 LEU HN 67 LEU QD2 7.29
67 LEU QD1 90 PHE QD 8.04
67 LEU QD2 90 PHE QD 8.04
68 SER HA 71 LEU QD1 6.83
68 SER HA 71 LEU QD2 6.83
70 LEU HA 70 LEU QD1 7.29
70 LEU HA 70 LEU QD2 7.29
70 LEU HN 70 LEU QD1 5.32
70 LEU HN 70 LEU QD2 5.32
71 LEU HA 71 LEU QD1 6.69
71 LEU HA 71 LEU QD2 6.69
71 LEU HN 71 LEU QD1 5.92
71 LEU HN 71 LEU QD2 5.92
71 LEU QD1 88 TYR QD 7.59
71 LEU QD2 88 TYR QD 7.59
86 VAL QG1 88 TYR QD 12.43
86 VAL QG2 87 ASP- HN 9.33
86 VAL QG2 88 TYR HA 9.33
86 VAL QG2 88 TYR HB2 7.10
86 VAL QG2 88 TYR HB3 7.10
86 VAL QG2 88 TYR QB 7.44
86 VAL QG2 88 TYR QE 11.46
87 ASP- HA 88 TYR QD 7.17
87 ASP- HN 88 TYR QD 8.68
88 TYR HN 88 TYR QE 10.61
88 TYR QD 89 SER HN 9.34
88 TYR QD 90 PHE HB2 6.32
88 TYR QD 90 PHE HB3 5.99
88 TYR QD 90 PHE QD 9.79
88 TYR QE 90 PHE QD 9.51
92 GLU- QG 93 TYR QD 7.06
92 GLU- QG 93 TYR QE 7.42
93 TYR QD 94 LYS+ HA 8.92
93 TYR QD 94 LYS+ HN 8.71
93 TYR QE 95 GLY HA1 6.98
93 TYR QE 95 GLY HA2 6.98
93 TYR QE 95 GLY QA 7.63
100 PHE QD 101 GLU- HN 7.57
100 PHE QD 101 GLU- QG 10.83
102 THR HA 103 TYR QD 6.34
24 GLY QA 26 VAL QQG 7.41
24 GLY HA2 26 VAL QG1 8.95
26 VAL QQG 31 PHE QD 7.83
26 VAL QQG 81 ALA QB 7.17
42 LEU HA 42 LEU QQD 3.97
61 GLU- QG 97 PHE QD 7.95
15 LEU QQD 62 GLY HA2 5.64
25 LEU HN 26 VAL QQG 5.22
26 VAL QQG 27 GLN HA 6.78
26 VAL QQG 27 GLN HN 5.45
26 VAL QQG 81 ALA HN 6.20
26 VAL QQG 84 GLU- HN 6.36
83 VAL HA 83 VAL QQG 5.31
11 VAL QQG 12 PHE HN 7.46
15 LEU QQD 16 LYS+ HN 6.75
15 LEU QQD 62 GLY HN 6.05
15 LEU QQD 63 TYR HA 6.23
15 LEU QQD 63 TYR HB2 6.25
15 LEU QQD 63 TYR HB3 7.05
15 LEU QQD 63 TYR HN 5.50
18 MET HN 67 LEU QQD 8.33
22 VAL QQG 23 TYR HN 5.70
22 VAL QQG 26 VAL QQG 6.30
25 LEU HA 25 LEU QQD 4.99
25 LEU HN 25 LEU QQD 6.36
26 VAL QQG 83 VAL HA 4.69
26 VAL QQG 83 VAL QQG 6.38
29 VAL QQG 30 GLY HN 8.36
29 VAL QQG 31 PHE HN 6.54
29 VAL QQG 31 PHE QB 7.53
41 ARG+ HA 42 LEU QQD 6.42
42 LEU HN 42 LEU QQD 7.36
47 TYR HN 58 VAL QQG 5.65
49 LYS+ HN 58 VAL QQG 7.99
51 LEU HA 51 LEU QQD 4.40
51 LEU HN 51 LEU QQD 5.87
56 VAL HN 56 VAL QQG 4.61
59 VAL QQG 60 ALA HA 8.14
59 VAL QQG 60 ALA HN 5.03
62 GLY HN 67 LEU QQD 5.46
66 ALA QB 67 LEU QQD 8.56
70 LEU QB 70 LEU QQD 7.00
70 LEU QQD 73 ARG+ QD 7.20
71 LEU QB 71 LEU QQD 3.23
71 LEU QQD 72 GLU- HA 11.25
71 LEU QQD 72 GLU- HN 7.60
71 LEU QQD 74 ILE HA 8.01
71 LEU QQD 75 LYS+ HN 11.53
83 VAL HN 83 VAL QQG 4.25
83 VAL QQG 84 GLU- HA 5.95
83 VAL QQG 84 GLU- HN 5.75
83 VAL QQG 85 LYS+ HN 5.27
75 LYS+ HA 83 VAL QQG 8.43
91 SER HA 91 SER HB2 2.98
91 SER HA 91 SER HB3 2.40
91 SER HB2 92 GLU- HN 2.98
91 SER HB3 92 GLU- HN 2.55
101 GLU- HA 101 GLU- HB2 2.52
101 GLU- HB2 102 THR HN 3.90
101 GLU- HB3 102 THR HN 3.77
101 GLU- HN 101 GLU- HB3 2.90
101 GLU- HN 101 GLU- HB2 3.36
47 TYR QE 101 GLU- HB2 5.68
47 TYR QE 101 GLU- HB3 6.32
101 GLU- HB3 101 GLU- QG 2.63
48 ALA HA 49 LYS+ HB3 4.45
49 LYS+ HA 49 LYS+ HB2 2.63
49 LYS+ HA 49 LYS+ HB3 2.97
49 LYS+ HN 49 LYS+ HB2 3.34
49 LYS+ HN 49 LYS+ HB3 3.19
49 LYS+ HB2 49 LYS+ QE 6.88
49 LYS+ HB3 49 LYS+ QE 5.26
47 TYR QD 49 LYS+ HB3 5.70
47 TYR QD 49 LYS+ HB2 5.18
49 LYS+ HB2 103 TYR QD 5.04
49 LYS+ HB3 103 TYR QD 5.24
33 LYS+ HA 33 LYS+ HB2 2.72
33 LYS+ HA 33 LYS+ HB3 2.95
33 LYS+ HB2 34 PHE HN 3.54
33 LYS+ HB3 34 PHE HN 3.00
33 LYS+ HN 33 LYS+ HB2 2.74
33 LYS+ HN 33 LYS+ HB3 3.01
25 LEU HA 25 LEU HB3 3.02
25 LEU HA 25 LEU HB2 2.41
25 LEU HN 25 LEU HB3 2.79
25 LEU HN 25 LEU HB2 2.99
31 PHE HA 34 PHE QE 7.98
48 ALA HN 102 THR QG2 5.33
47 TYR HB3 101 GLU- HN 5.02
47 TYR HB2 101 GLU- HN 4.89
63 TYR HB3 66 ALA HN 3.77
63 TYR HB2 66 ALA HN 3.36
34 PHE QD 74 ILE QG1 6.55
34 PHE QE 74 ILE QG1 6.78
34 PHE QD 74 ILE QG2 9.15
34 PHE QE 74 ILE QG2 9.15
34 PHE QD 74 ILE QD1 9.15
34 PHE QE 74 ILE QD1 9.15
47 TYR HN 59 VAL QQG 6.03
47 TYR QB 101 GLU- HN 4.63
44 ILE QG2 45 LYS+ HN 7.03
23 TYR HN 86 VAL QG1 5.84
40 ILE QG1 100 PHE HN 5.19
70 LEU HG 71 LEU HN 6.00
56 VAL HB 57 GLU- HN 4.22
40 ILE QG1 100 PHE QD 9.00
27 GLN HB3 28 GLY HN 4.88
27 GLN HB2 28 GLY HN 4.88
19 TYR QE 57 GLU- QB 9.01
14 MET HB3 15 LEU HN 3.72
14 MET HB2 15 LEU HN 3.72
23 TYR QD 87 ASP- HN 8.14
23 TYR QE 87 ASP- HN 7.77
46 GLY HN 97 PHE HB3 3.77
46 GLY HN 97 PHE HB2 3.27
23 TYR QD 55 SER QB 6.81
21 ARG+ HE 55 SER HA 6.00
23 TYR QD 86 VAL HA 6.25
23 TYR HN 86 VAL QG2 6.05
14 MET QB 15 LEU HN 3.32
26 VAL QQG 56 VAL HN 6.57
27 GLN QB 28 GLY HN 4.09
45 LYS+ QB 97 PHE HN 4.51
45 LYS+ QB 99 ASP- HN 4.30
45 LYS+ QG 99 ASP- HN 4.58
58 VAL QQG 59 VAL HN 6.59
67 LEU QQD 68 SER HN 8.60
85 LYS+ QG 86 VAL HN 4.77
100 PHE HN 100 PHE QB 3.59
101 GLU- QG 102 THR HN 4.46
23 TYR QD 85 LYS+ HG3 6.37
23 TYR QE 85 LYS+ HG3 8.13
23 TYR QD 85 LYS+ HG2 6.37
23 TYR QE 85 LYS+ HG2 8.13
27 GLN HE21 54 GLY HN 7.20
27 GLN HE22 55 SER HN 4.59
27 GLN HE22 54 GLY QA 5.19
34 PHE HA 37 ILE QG2 5.68
35 VAL HN 36 GLN HN 2.58
45 LYS+ HN 61 GLU- HN 3.12
70 LEU QD2 71 LEU HA 5.55
70 LEU QD1 71 LEU HA 4.60
22 VAL QQG 31 PHE QD 9.25
68 SER HA 72 GLU- QB 5.10
      
LOWER LIMIT     
4 LYS+ HA 5 LYS+ HN 2.41
4 LYS+ HN 4 LYS+ HA 2.91
6 TRP HN 6 TRP HA 2.31
6 TRP HN 6 TRP HB2 2.42
6 TRP HN 6 TRP HB3 2.42
6 TRP HN 6 TRP HZ3 2.00
6 TRP HN 6 TRP QB 2.84
6 TRP HN 7 SER HN 2.77
7 SER HA 7 SER HB2 2.13
7 SER HA 7 SER HB3 2.13
7 SER HA 7 SER QB 2.21
7 SER HA 8 ASP- HN 2.35
7 SER HN 7 SER HA 2.87
8 ASP- HN 8 ASP- HB2 2.16
8 ASP- HN 8 ASP- HB3 2.16
9 THR HN 10 GLU- HN 3.34
9 THR HN 9 THR HA 2.30
9 THR HN 9 THR HB 3.78
9 THR HN 9 THR QG2 2.96
10 GLU- HN 10 GLU- HG2 1.69
10 GLU- HN 10 GLU- HG3 1.69
10 GLU- HN 11 VAL HN 2.00
11 VAL HB 12 PHE HN 3.22
11 VAL HN 12 PHE HN 3.01
11 VAL QQG 12 PHE HN 1.85
12 PHE HA 12 PHE QD 3.12
12 PHE HN 12 PHE HA 2.08
12 PHE HN 12 PHE HB2 2.09
12 PHE HN 12 PHE HB3 2.09
12 PHE HN 12 PHE QB 2.82
12 PHE HN 13 GLU- HN 2.02
13 GLU- HN 13 GLU- QG 0.87
13 GLU- HN 14 MET HN 2.84
14 MET HB2 63 TYR QD 2.14
14 MET HN 14 MET QG 2.21
14 MET HN 15 LEU HN 3.01
15 LEU HA 63 TYR HA 1.72
15 LEU HA 93 TYR QD 1.48
15 LEU HN 15 LEU HG 1.69
15 LEU HN 15 LEU QD1 2.59
15 LEU HN 15 LEU QD2 2.59
15 LEU HN 15 LEU QQD 2.08
15 LEU HN 16 LYS+ HN 3.83
15 LEU QD1 63 TYR QE 2.45
15 LEU QD1 93 TYR QD 2.50
15 LEU QD1 93 TYR QE 2.42
15 LEU QD2 63 TYR QE 2.45
15 LEU QD2 93 TYR QD 2.50
15 LEU QD2 93 TYR QE 2.42
15 LEU QQD 16 LYS+ HN 1.39
15 LEU QQD 62 GLY HN 1.41
15 LEU QQD 63 TYR HA 1.54
15 LEU QQD 63 TYR HN 0.99
15 LEU QQD 63 TYR QD 1.59
15 LEU QQD 63 TYR QE 2.66
15 LEU QQD 93 TYR QD 2.26
15 LEU QQD 93 TYR QE 2.11
16 LYS+ HA 16 LYS+ QD 1.12
16 LYS+ HA 93 TYR HN 2.10
16 LYS+ HN 16 LYS+ QD 0.87
16 LYS+ HN 16 LYS+ QE 2.25
16 LYS+ HN 62 GLY HN 2.90
16 LYS+ HN 63 TYR HA 2.22
16 LYS+ HN 63 TYR HN 3.70
16 LYS+ HN 93 TYR QD 2.00
20 ALA HA 88 TYR HA 1.63
20 ALA HA 89 SER HN 2.04
20 ALA HN 58 VAL HB 2.09
20 ALA HN 58 VAL HN 2.44
20 ALA HN 59 VAL HA 1.50
20 ALA QB 58 VAL HN 3.17
20 ALA QB 88 TYR HB2 2.24
20 ALA QB 88 TYR HB3 2.24
20 ALA QB 88 TYR QB 2.22
21 ARG+ HA 21 ARG+ HD2 1.95
21 ARG+ HA 21 ARG+ HD3 1.95
21 ARG+ HA 57 GLU- HA 1.86
21 ARG+ HA 58 VAL HN 1.90
21 ARG+ HN 21 ARG+ HD2 2.80
21 ARG+ HN 21 ARG+ HD3 2.80
21 ARG+ HN 21 ARG+ QD 2.86
21 ARG+ HN 87 ASP- HN 2.00
21 ARG+ HN 88 TYR HA 2.31
21 ARG+ HN 88 TYR QB 1.58
21 ARG+ QB 21 ARG+ HE 1.34
21 ARG+ QB 23 TYR QD 0.96
22 VAL HA 23 TYR QD 2.64
22 VAL HA 86 VAL HA 1.91
22 VAL HA 87 ASP- HN 2.68
22 VAL HN 22 VAL HA 2.27
22 VAL HN 22 VAL HB 1.97
22 VAL HN 23 TYR HN 4.05
22 VAL HN 56 VAL HN 2.95
22 VAL HN 57 GLU- HA 1.99
23 TYR HA 26 VAL QG1 3.13
23 TYR HA 26 VAL QG2 3.13
23 TYR HN 23 TYR QD 2.56
23 TYR HN 24 GLY HN 3.54
23 TYR HN 85 LYS+ HN 3.39
23 TYR HN 86 VAL HA 2.39
23 TYR QD 24 GLY HN 3.78
24 GLY HA1 26 VAL QG1 1.03
24 GLY HA1 26 VAL QG2 1.03
24 GLY HA1 84 GLU- HN 1.80
24 GLY HA2 26 VAL QG2 1.03
24 GLY HA2 84 GLU- HN 1.80
24 GLY HN 26 VAL QG1 2.43
24 GLY HN 26 VAL QG2 2.43
24 GLY HN 26 VAL QQG 2.32
24 GLY QA 84 GLU- HN 1.86
25 LEU HN 25 LEU QQD 1.18
25 LEU HN 26 VAL QQG 0.46
25 LEU HN 82 GLU- HN 3.27
25 LEU HN 83 VAL HA 2.23
25 LEU HN 83 VAL HB 1.69
26 VAL HA 26 VAL HB 2.27
26 VAL HA 26 VAL QG1 2.44
26 VAL HA 26 VAL QG2 2.74
26 VAL HA 27 GLN HN 2.44
26 VAL HB 31 PHE QD 2.41
26 VAL HN 26 VAL HA 2.30
26 VAL HN 26 VAL HB 2.36
26 VAL HN 84 GLU- QB 2.05
26 VAL QG1 31 PHE QD 2.56
26 VAL QG1 81 ALA QB 2.07
26 VAL QG2 31 PHE QD 2.56
26 VAL QG2 81 ALA QB 2.07
26 VAL QQG 27 GLN HA 1.74
26 VAL QQG 31 PHE QD 2.17
26 VAL QQG 81 ALA HN 1.36
26 VAL QQG 81 ALA QB 2.09
26 VAL QQG 84 GLU- HN 1.47
27 GLN HA 27 GLN HB2 2.24
27 GLN HA 27 GLN HB3 2.24
27 GLN HA 27 GLN HG2 2.04
27 GLN HA 27 GLN HG3 2.04
27 GLN HN 27 GLN HA 2.47
27 GLN HN 27 GLN QG 0.87
27 GLN HN 28 GLY HN 2.00
28 GLY HN 29 VAL HN 2.00
29 VAL HN 30 GLY HN 2.00
29 VAL QQG 30 GLY HN 1.83
29 VAL QQG 31 PHE HN 0.68
29 VAL QQG 81 ALA HA 1.56
30 GLY HN 31 PHE HN 3.18
30 GLY QA 33 LYS+ HN 3.08
31 PHE HN 31 PHE HB2 1.86
31 PHE HN 31 PHE HB3 1.86
33 LYS+ HA 102 THR QG2 2.42
33 LYS+ HA 34 PHE HN 2.80
33 LYS+ HA 36 GLN HN 1.69
33 LYS+ HN 33 LYS+ QG 1.68
33 LYS+ HN 34 PHE HN 2.71
34 PHE HA 35 VAL HN 2.75
34 PHE HA 37 ILE HB 1.69
34 PHE HA 37 ILE HN 2.77
34 PHE HN 34 PHE QD 3.48
34 PHE HN 34 PHE QE 3.85
34 PHE HN 35 VAL HN 2.70
34 PHE QD 35 VAL HN 3.57
34 PHE QD 38 HIS HD2 4.59
34 PHE QD 73 ARG+ QB 1.89
34 PHE QD 77 GLY HN 5.50
34 PHE QD 78 PRO HA 2.96
34 PHE QE 35 VAL HN 4.48
34 PHE QE 37 ILE HA 2.25
34 PHE QE 38 HIS HD2 4.39
34 PHE QE 73 ARG+ HB2 3.16
34 PHE QE 73 ARG+ HB3 3.16
34 PHE QE 73 ARG+ HD2 3.52
34 PHE QE 73 ARG+ HD3 3.50
34 PHE QE 73 ARG+ QB 3.39
34 PHE QE 77 GLY HN 3.46
34 PHE QE 78 PRO HA 2.69
35 VAL HA 35 VAL HB 2.54
35 VAL HA 36 GLN HN 2.06
35 VAL HA 38 HIS HN 3.05
36 GLN HA 36 GLN QE2 0.96
36 GLN HA 37 ILE HN 1.86
36 GLN HA 39 ALA HN 2.74
36 GLN HA 39 ALA QB 2.18
36 GLN HA 40 ILE HN 2.98
36 GLN HN 36 GLN QE2 1.41
36 GLN QE2 39 ALA QB 1.23
36 GLN QE2 40 ILE QD1 1.97
37 ILE HA 37 ILE QD1 2.00
37 ILE HA 38 HIS HN 2.69
37 ILE HA 40 ILE HB 2.03
37 ILE HA 40 ILE HN 1.69
37 ILE HA 40 ILE QD1 3.64
37 ILE HA 40 ILE QG2 2.15
37 ILE HA 41 ARG+ HN 2.31
37 ILE HB 38 HIS HN 2.11
37 ILE HN 37 ILE QD1 3.70
37 ILE HN 37 ILE QG1 1.56
37 ILE HN 37 ILE QG2 2.64
37 ILE HN 38 HIS HD2 4.32
37 ILE HN 38 HIS HN 2.86
37 ILE QD1 38 HIS HD2 3.89
37 ILE QG1 38 HIS HD2 1.95
37 ILE QG1 38 HIS HN 1.86
37 ILE QG2 38 HIS HA 2.80
37 ILE QG2 38 HIS HD2 2.97
37 ILE QG2 38 HIS HN 3.02
37 ILE QG2 41 ARG+ QD 2.47
38 HIS HA 38 HIS HD2 2.83
38 HIS HA 39 ALA HN 2.44
38 HIS HA 41 ARG+ HB2 2.51
38 HIS HA 41 ARG+ HB3 2.51
38 HIS HA 41 ARG+ HN 2.64
38 HIS HA 41 ARG+ QD 1.82
38 HIS HA 42 LEU HN 3.73
38 HIS HB2 39 ALA HN 2.05
38 HIS HB3 39 ALA HN 2.05
38 HIS HN 38 HIS HA 2.18
38 HIS HN 38 HIS HD2 3.22
38 HIS HN 39 ALA HN 2.64
38 HIS HN 42 LEU HN 4.72
38 HIS QB 39 ALA HN 2.01
39 ALA HA 40 ILE HN 1.85
39 ALA HA 41 ARG+ HN 2.99
39 ALA HA 42 LEU HN 2.79
39 ALA HA 44 ILE HB 1.69
39 ALA HA 44 ILE HG21 2.07
39 ALA HA 70 LEU QD1 2.09
39 ALA HA 70 LEU QD2 2.09
39 ALA HA 70 LEU QQD 1.60
39 ALA HN 40 ILE HN 2.77
39 ALA HN 70 LEU QD1 2.66
39 ALA HN 70 LEU QD2 2.66
39 ALA HN 70 LEU QQD 2.43
39 ALA QB 40 ILE QD1 2.31
39 ALA QB 40 ILE QG1 3.30
39 ALA QB 44 ILE HB 2.07
39 ALA QB 70 LEU QD1 2.15
39 ALA QB 70 LEU QD2 2.15
39 ALA QB 70 LEU QQD 1.43
40 ILE HA 41 ARG+ HN 2.31
40 ILE HA 43 GLY HN 3.03
40 ILE HB 41 ARG+ HN 1.69
40 ILE HN 40 ILE QD1 2.00
40 ILE HN 40 ILE QG1 1.43
40 ILE HN 40 ILE QG2 2.14
40 ILE HN 41 ARG+ HN 2.24
44 ILE QG1 100 PHE QE 3.61
40 ILE QG2 41 ARG+ HN 2.94
41 ARG+ HA 41 ARG+ QD 2.59
41 ARG+ HA 42 LEU HN 2.37
41 ARG+ HA 42 LEU QQD 1.21
41 ARG+ HA 44 ILE HN 2.77
41 ARG+ HB2 42 LEU HN 1.69
41 ARG+ HB3 42 LEU HN 1.69
41 ARG+ HN 41 ARG+ HG2 2.00
41 ARG+ HN 41 ARG+ HG3 2.00
41 ARG+ HN 41 ARG+ QD 2.91
41 ARG+ HN 41 ARG+ QG 2.61
41 ARG+ HN 42 LEU HN 1.77
41 ARG+ HN 43 GLY HN 3.00
41 ARG+ QB 42 LEU HN 1.71
41 ARG+ QG 42 LEU HN 0.87
42 LEU HA 43 GLY HN 2.19
42 LEU HN 42 LEU HA 2.15
42 LEU HN 42 LEU HG 1.72
42 LEU HN 42 LEU QQD 1.72
42 LEU HN 43 GLY HN 2.63
42 LEU HN 44 ILE HN 4.56
43 GLY HA1 44 ILE HN 2.16
43 GLY HA2 44 ILE HN 2.16
43 GLY HN 44 ILE HN 2.68
44 ILE HA 44 ILE QD1 1.95
44 ILE HB 45 LYS+ HN 2.56
44 ILE HB 61 GLU- HN 3.13
44 ILE HN 44 ILE QD1 3.75
44 ILE HN 44 ILE QG1 0.87
44 ILE HN 44 ILE QG2 2.59
44 ILE HN 45 LYS+ HN 3.25
44 ILE QG1 45 LYS+ HN 1.17
44 ILE QG1 61 GLU- HN 1.65
44 ILE QG2 61 GLU- HA 2.58
44 ILE QG2 61 GLU- HN 2.16
45 LYS+ HA 45 LYS+ HZ1 3.51
45 LYS+ HA 99 ASP- HN 2.79
45 LYS+ HB2 45 LYS+ HE2 0.52
45 LYS+ HB2 45 LYS+ HE3 0.52
45 LYS+ HB2 45 LYS+ HZ1 2.93
45 LYS+ HB2 46 GLY HN 1.96
45 LYS+ HB3 45 LYS+ HE2 0.52
45 LYS+ HB3 45 LYS+ HE3 0.52
45 LYS+ HB3 45 LYS+ HZ1 2.93
45 LYS+ HB3 46 GLY HN 1.96
45 LYS+ HN 45 LYS+ HB2 1.98
45 LYS+ HN 45 LYS+ HB3 1.98
45 LYS+ HN 45 LYS+ HG2 2.37
45 LYS+ HN 45 LYS+ HG3 2.37
45 LYS+ HN 45 LYS+ QG 2.28
45 LYS+ QB 45 LYS+ HZ1 3.33
45 LYS+ QB 45 LYS+ QE 1.44
45 LYS+ QB 46 GLY HN 1.89
45 LYS+ QG 45 LYS+ HZ1 1.61
46 GLY HA1 60 ALA HA 2.16
46 GLY HA2 60 ALA HA 2.16
46 GLY HN 100 PHE HA 1.68
46 GLY HN 100 PHE QD 4.07
46 GLY HN 101 GLU- HN 3.39
46 GLY QA 60 ALA HA 2.51
46 GLY QA 61 GLU- HN 1.61
47 TYR HA 101 GLU- HN 1.50
47 TYR HB2 48 ALA HN 2.01
47 TYR HB3 48 ALA HN 2.01
47 TYR HN 100 PHE QE 3.13
47 TYR HN 47 TYR QD 3.40
47 TYR HN 58 VAL QQG 0.63
47 TYR HN 59 VAL HN 2.93
47 TYR HN 60 ALA HA 2.61
47 TYR QB 100 PHE QE 2.04
47 TYR QB 48 ALA HN 2.13
47 TYR QD 48 ALA HA 1.95
47 TYR QD 48 ALA HN 2.94
47 TYR QD 48 ALA QB 2.71
47 TYR QD 49 LYS+ HN 3.78
47 TYR QD 59 VAL QQG 2.23
48 ALA HA 49 LYS+ HA 1.69
48 ALA HA 58 VAL HA 1.78
48 ALA HA 58 VAL QG1 2.32
48 ALA HA 58 VAL QG2 2.32
48 ALA HA 58 VAL QQG 1.66
48 ALA HA 59 VAL HN 2.55
48 ALA HN 102 THR HA 2.04
48 ALA HN 103 TYR HN 2.38
48 ALA HN 103 TYR QD 5.17
48 ALA HN 48 ALA HA 2.54
48 ALA HN 48 ALA QB 2.39
48 ALA QB 100 PHE QE 1.92
48 ALA QB 102 THR HA 2.90
48 ALA QB 102 THR HB 2.10
49 LYS+ HA 103 TYR HN 1.93
49 LYS+ HA 49 LYS+ QD 1.52
49 LYS+ HN 103 TYR QD 3.54
49 LYS+ HN 49 LYS+ HA 2.16
49 LYS+ HN 49 LYS+ QG 2.42
49 LYS+ HN 50 ASN HA 3.33
49 LYS+ HN 57 GLU- HN 2.86
49 LYS+ HN 58 VAL HA 2.22
49 LYS+ HN 58 VAL QQG 1.55
49 LYS+ QD 103 TYR QD 1.67
49 LYS+ QE 103 TYR QD 1.86
49 LYS+ QG 103 TYR QD 1.22
50 ASN HA 57 GLU- HN 1.50
50 ASN HN 103 TYR HN 2.13
50 ASN HN 50 ASN QD2 1.13
50 ASN QD2 51 LEU HN 3.04
51 LEU HA 51 LEU HG 1.95
51 LEU HN 51 LEU HB2 1.98
51 LEU HN 51 LEU HB3 1.98
51 LEU HN 51 LEU HG 1.86
51 LEU HN 51 LEU QQD 0.86
51 LEU HN 52 PRO QD 2.54
53 ASP- HN 53 ASP- HB2 2.32
53 ASP- HN 53 ASP- HB3 2.32
53 ASP- HN 53 ASP- QB 2.39
53 ASP- HN 54 GLY HN 2.43
57 GLU- HN 57 GLU- QG 0.87
58 VAL HN 58 VAL QG1 2.00
58 VAL HN 58 VAL QG2 2.00
59 VAL QQG 60 ALA HA 1.63
59 VAL QQG 97 PHE QD 1.83
59 VAL QQG 97 PHE QE 1.35
60 ALA QB 61 GLU- HN 2.59
61 GLU- HA 61 GLU- HG2 1.88
61 GLU- HA 61 GLU- HG3 1.88
61 GLU- HB2 62 GLY HN 2.26
61 GLU- HB3 62 GLY HN 2.26
61 GLU- HG3 97 PHE QD 3.84
61 GLU- HN 61 GLU- HB2 2.29
61 GLU- HN 61 GLU- HB3 2.29
61 GLU- HN 61 GLU- QB 2.30
61 GLU- HN 61 GLU- QG 1.70
61 GLU- QB 62 GLY HN 3.04
62 GLY HN 67 LEU QQD 0.94
63 TYR HN 63 TYR QD 2.37
16 LYS+ QB 63 TYR QD 1.75
64 GLU- HA 65 GLU- HN 3.04
64 GLU- HA 67 LEU HN 2.00
64 GLU- HN 65 GLU- HN 2.54
64 GLU- QB 65 GLU- HN 1.86
64 GLU- QB 67 LEU HN 0.87
65 GLU- HA 66 ALA HN 3.11
65 GLU- HA 68 SER HN 2.00
65 GLU- HB2 66 ALA HN 2.88
65 GLU- HB3 66 ALA HN 2.88
65 GLU- HN 65 GLU- HG2 1.89
65 GLU- HN 65 GLU- HG3 1.89
65 GLU- HN 65 GLU- QG 1.93
65 GLU- HN 66 ALA HN 2.50
65 GLU- QB 66 ALA HN 2.95
66 ALA HA 67 LEU HN 2.24
66 ALA HA 67 LEU QB 1.14
66 ALA HA 69 LYS+ HN 2.31
66 ALA HA 69 LYS+ QB 1.20
66 ALA HN 67 LEU HN 2.02
66 ALA QB 69 LYS+ HA 1.69
67 LEU HA 68 SER HN 2.19
67 LEU HA 70 LEU HN 2.98
67 LEU HG 68 SER HN 2.05
67 LEU HG 90 PHE QD 4.68
67 LEU HN 67 LEU HG 1.69
67 LEU HN 67 LEU QD1 1.69
67 LEU HN 67 LEU QD2 1.69
67 LEU HN 67 LEU QQD 1.42
67 LEU HN 68 SER HN 2.47
68 SER HA 69 LYS+ HN 2.28
68 SER HA 71 LEU HB2 1.92
68 SER HA 71 LEU HB3 1.92
68 SER HA 71 LEU HN 1.95
68 SER HB2 69 LYS+ HN 1.69
68 SER HB3 69 LYS+ HN 1.69
68 SER HN 69 LYS+ HN 2.65
68 SER HN 69 LYS+ QB 3.67
68 SER QB 69 LYS+ HN 1.84
69 LYS+ HA 69 LYS+ QD 0.87
69 LYS+ HA 70 LEU HN 2.37
69 LYS+ HA 72 GLU- HN 3.06
69 LYS+ HB2 69 LYS+ HE2 1.12
69 LYS+ HB2 69 LYS+ HE3 1.12
69 LYS+ HB2 70 LEU HN 1.69
69 LYS+ HB3 69 LYS+ HE2 1.12
69 LYS+ HB3 69 LYS+ HE3 1.12
69 LYS+ HB3 70 LEU HN 1.69
69 LYS+ HN 69 LYS+ QD 1.04
69 LYS+ HN 69 LYS+ QG 1.31
69 LYS+ HN 70 LEU HN 2.00
69 LYS+ QB 69 LYS+ QE 2.50
70 LEU HA 70 LEU HG 1.95
70 LEU HA 71 LEU HN 2.14
70 LEU HA 73 ARG+ HN 2.00
70 LEU HB2 71 LEU HN 1.69
70 LEU HB3 71 LEU HN 1.69
70 LEU HN 70 LEU HA 2.22
70 LEU HN 70 LEU HG 1.84
70 LEU HN 70 LEU QD1 2.77
70 LEU HN 70 LEU QD2 2.77
70 LEU HN 71 LEU HN 1.86
70 LEU QB 71 LEU HA 0.87
70 LEU QB 71 LEU HG 0.87
70 LEU QB 71 LEU HN 2.00
70 LEU QD1 71 LEU HN 2.60
70 LEU QD2 71 LEU HN 2.60
71 LEU HA 71 LEU QD1 2.16
71 LEU HA 71 LEU QD2 2.16
71 LEU HA 71 LEU QQD 2.36
71 LEU HA 72 GLU- HN 2.70
71 LEU HA 72 GLU- QG 2.68
71 LEU HA 74 ILE HN 1.69
71 LEU HA 75 LYS+ HN 2.51
71 LEU HB2 72 GLU- HN 1.98
71 LEU HB3 72 GLU- HN 1.98
71 LEU HN 71 LEU HG 2.11
71 LEU HN 71 LEU QD1 3.13
71 LEU HN 71 LEU QD2 3.13
71 LEU HN 71 LEU QQD 2.48
71 LEU HN 72 GLU- HN 1.97
71 LEU QB 72 GLU- HN 2.60
71 LEU QD1 88 TYR QD 2.36
71 LEU QD2 88 TYR QD 2.36
71 LEU QQD 72 GLU- HA 3.80
71 LEU QQD 72 GLU- HN 1.84
71 LEU QQD 75 LYS+ HN 3.96
71 LEU QQD 88 TYR QE 0.87
72 GLU- HA 72 GLU- QB 2.14
72 GLU- HA 72 GLU- QG 2.28
72 GLU- HA 73 ARG+ HN 2.83
72 GLU- HA 75 LYS+ HN 1.69
72 GLU- HA 75 LYS+ QD 0.90
72 GLU- HN 72 GLU- HA 2.22
72 GLU- HN 72 GLU- QG 2.54
72 GLU- HN 73 ARG+ HN 2.55
73 ARG+ HA 73 ARG+ HD2 1.87
73 ARG+ HA 73 ARG+ HD3 1.87
73 ARG+ HA 74 ILE HN 2.31
73 ARG+ HA 74 ILE QG2 2.55
73 ARG+ HB3 74 ILE HN 1.88
73 ARG+ HN 73 ARG+ HA 2.04
73 ARG+ HN 73 ARG+ HB2 2.05
73 ARG+ HN 73 ARG+ HB3 2.05
73 ARG+ HN 73 ARG+ QD 3.05
73 ARG+ HN 73 ARG+ QG 1.53
73 ARG+ HN 74 ILE HN 2.00
73 ARG+ QB 74 ILE HN 1.87
73 ARG+ QG 74 ILE QD1 1.71
73 ARG+ QH1 74 ILE QG2 1.30
74 ILE HA 75 LYS+ HN 2.59
74 ILE HA 77 GLY HN 2.54
74 ILE HB 75 LYS+ HN 1.98
74 ILE HB 75 LYS+ QG 1.98
74 ILE HN 74 ILE QD1 3.38
74 ILE HN 74 ILE QG1 1.04
74 ILE HN 74 ILE QG2 2.70
74 ILE HN 75 LYS+ HN 2.95
74 ILE QD1 75 LYS+ QE 2.14
74 ILE QG2 75 LYS+ HN 3.28
75 LYS+ HA 76 GLN HN 3.01
75 LYS+ HB2 76 GLN HN 2.58
75 LYS+ HB3 76 GLN HN 2.58
75 LYS+ HN 75 LYS+ QD 1.22
75 LYS+ HN 75 LYS+ QG 1.59
75 LYS+ HN 76 GLN HN 2.56
76 GLN HA 77 GLY HN 2.33
76 GLN HN 76 GLN HA 2.40
76 GLN HN 76 GLN QG 1.65
76 GLN HN 77 GLY HN 2.56
79 PRO HA 80 ALA HN 2.24
79 PRO HA 81 ALA HN 3.11
80 ALA HA 81 ALA HN 2.77
80 ALA HB1 81 ALA HA 2.03
80 ALA HB1 81 ALA HN 1.69
80 ALA HN 81 ALA HB1 2.42
80 ALA HN 81 ALA HN 2.31
81 ALA HB1 82 GLU- HN 1.69
81 ALA HB1 84 GLU- HA 1.69
81 ALA HN 82 GLU- HA 1.69
81 ALA HN 82 GLU- HN 2.00
82 GLU- HN 82 GLU- HG2 1.69
82 GLU- HN 82 GLU- HG3 1.69
83 VAL HA 85 LYS+ HN 2.40
83 VAL HN 83 VAL HA 2.54
83 VAL QQG 84 GLU- HA 0.94
83 VAL QQG 85 LYS+ HN 0.36
84 GLU- HA 84 GLU- HG2 2.05
84 GLU- HA 84 GLU- HG3 2.05
84 GLU- HA 84 GLU- QG 2.19
84 GLU- HA 85 LYS+ HN 2.67
84 GLU- HN 85 LYS+ HN 2.50
84 GLU- HN 86 VAL HN 4.79
85 LYS+ HB2 85 LYS+ HE2 0.69
85 LYS+ HB2 85 LYS+ HE3 0.69
85 LYS+ HB3 85 LYS+ HE2 0.69
85 LYS+ HB3 85 LYS+ HE3 0.69
85 LYS+ HN 85 LYS+ QB 2.35
85 LYS+ HN 85 LYS+ QG 2.26
85 LYS+ QB 85 LYS+ QE 1.36
85 LYS+ QB 86 VAL HN 2.97
86 VAL HA 88 TYR QD 2.82
86 VAL HB 87 ASP- HN 1.69
86 VAL HB 88 TYR QD 1.84
86 VAL HN 86 VAL HA 2.40
86 VAL HN 86 VAL HB 2.04
87 ASP- HA 88 TYR QD 2.71
87 ASP- HN 87 ASP- HA 2.08
87 ASP- HN 88 TYR HA 2.82
87 ASP- HN 88 TYR QD 4.36
88 TYR HN 88 TYR HA 2.31
88 TYR HN 88 TYR QB 2.35
88 TYR HN 88 TYR QD 2.92
88 TYR HN 89 SER HN 2.00
88 TYR QD 89 SER HN 2.00
89 SER HN 90 PHE HN 3.26
90 PHE HN 90 PHE HA 2.44
90 PHE HN 91 SER HN 3.70
90 PHE QD 91 SER HN 2.80
91 SER HN 92 GLU- HN 2.00
92 GLU- HN 92 GLU- HG2 2.47
92 GLU- HN 92 GLU- HG3 2.47
92 GLU- HN 92 GLU- QG 2.46
92 GLU- QB 93 TYR HN 1.67
92 GLU- QB 94 LYS+ HN 0.87
92 GLU- QG 93 TYR QD 0.92
92 GLU- QG 93 TYR QE 1.12
93 TYR HN 93 TYR HA 2.47
93 TYR QD 94 LYS+ HA 1.48
93 TYR QD 94 LYS+ HN 4.08
93 TYR QE 95 GLY HA1 2.48
93 TYR QE 95 GLY HA2 2.48
93 TYR QE 95 GLY QA 2.44
94 LYS+ HA 94 LYS+ QD 1.22
94 LYS+ HA 95 GLY HN 3.04
94 LYS+ HB2 95 GLY HN 2.64
94 LYS+ HN 94 LYS+ QD 2.94
94 LYS+ HN 94 LYS+ QG 2.07
95 GLY HN 96 GLU- HN 2.82
96 GLU- HN 96 GLU- HA 2.22
96 GLU- HN 96 GLU- HB2 2.03
96 GLU- HN 96 GLU- HB3 2.03
96 GLU- HN 96 GLU- QB 2.22
96 GLU- HN 96 GLU- QG 1.93
96 GLU- HN 97 PHE HN 2.67
97 PHE HN 97 PHE HA 2.58
97 PHE HN 97 PHE QD 3.32
97 PHE HN 99 ASP- HN 4.45
98 GLU- HN 98 GLU- HG2 2.07
98 GLU- HN 98 GLU- HG3 2.07
98 GLU- HN 99 ASP- HN 2.00
99 ASP- HN 100 PHE HN 2.00
99 ASP- HN 99 ASP- HA 2.12
100 PHE HN 100 PHE HA 2.16
100 PHE HN 100 PHE HZ 5.77
100 PHE QD 101 GLU- HN 3.63
100 PHE QD 101 GLU- QG 2.96
100 PHE QE 102 THR QG2 1.99
101 GLU- HA 101 GLU- HG2 1.85
101 GLU- HA 101 GLU- HG3 1.85
101 GLU- HA 102 THR QG2 2.47
101 GLU- HN 101 GLU- QG 1.16
101 GLU- QG 102 THR QG2 1.28
102 THR HA 103 TYR QD 2.26
102 THR HB 103 TYR HN 1.69
102 THR HN 102 THR HA 2.27
102 THR HN 102 THR HB 3.33
102 THR HN 102 THR QG2 2.48
103 TYR HN 103 TYR QD 3.38
13 GLU- HN 13 GLU- HB2 3.80
13 GLU- HN 13 GLU- HB3 2.41
31 PHE HA 34 PHE HB2 2.40
31 PHE HA 34 PHE HB3 2.08
34 PHE HB2 35 VAL HN 2.49
34 PHE HB3 35 VAL HN 2.10
87 ASP- HN 87 ASP- HB3 2.06
97 PHE HA 97 PHE HB3 2.37
97 PHE HN 97 PHE HB3 2.04
97 PHE HN 97 PHE HB2 1.96
27 GLN HG2 27 GLN HE22 2.43
27 GLN HE22 50 ASN HA 2.57
27 GLN HE21 50 ASN HA 2.37
27 GLN HG3 27 GLN HE22 2.43
27 GLN HE21 51 LEU HN 3.03
27 GLN QG 27 GLN HE22 3.19
27 GLN HE21 52 PRO QB 1.64
34 PHE QE 73 ARG+ HA 3.10
34 PHE QE 74 ILE HA 1.74
34 PHE QD 74 ILE HA 2.25
79 PRO HD3 83 VAL HG11 2.68
79 PRO HD2 83 VAL HG11 2.68
79 PRO QD 83 VAL HG11 3.29
36 GLN HG3 36 GLN HE21 2.27
36 GLN HG2 36 GLN HE21 2.27
33 LYS+ HA 36 GLN HB2 1.72
33 LYS+ HA 36 GLN HB3 1.72
36 GLN HG2 37 ILE HN 1.90
36 GLN HG3 37 ILE HN 1.90
33 LYS+ HA 36 GLN QB 2.01
36 GLN HN 36 GLN QB 2.50
36 GLN HN 36 GLN QG 3.12
36 GLN HA 36 GLN QG 2.02
36 GLN QB 36 GLN QG 2.00
36 GLN QB 37 ILE HN 2.60
36 GLN QG 36 GLN QE2 2.50
36 GLN HG2 36 GLN HE22 2.27
36 GLN HG3 36 GLN HE22 2.27
36 GLN QG 37 ILE HN 2.00
26 VAL HA 31 PHE QD 3.39
24 GLY QA 83 VAL HA 1.08
68 SER HA 71 LEU HA 2.56
68 SER HA 71 LEU QD1 2.75
68 SER HA 71 LEU QD2 2.75
68 SER HA 71 LEU QQD 2.97
70 LEU QB 73 ARG+ QH1 3.12
71 LEU QQD 74 ILE HA 2.41
15 LEU HA 15 LEU HB3 2.00
15 LEU HB3 16 LYS+ HN 2.60
15 LEU HB3 15 LEU QD1 2.00
15 LEU HB3 15 LEU QD2 2.00
63 TYR HN 63 TYR HB2 1,90
63 TYR HB2 64 GLU- HN 2.14
15 LEU QQD 63 TYR HB2 1.40
15 LEU QQD 63 TYR HB3 2.08
23 TYR HB3 24 GLY HN 2.92
23 TYR HB2 24 GLY HN 1.96
23 TYR HN 23 TYR HB3 2.00
23 TYR HN 23 TYR HB2 2.25
23 TYR HB3 85 LYS+ HN 2.02
90 PHE HB2 91 SER HN 3.48
90 PHE HN 90 PHE HB2 1.93
90 PHE HN 90 PHE HB3 1.98
100 PHE HB3 101 GLU- HN 3.00
100 PHE HB2 101 GLU- HN 3.46
88 TYR QD 90 PHE HB2 2.79
88 TYR QD 90 PHE HB3 2.56
67 LEU QD1 90 PHE QD 2.48
67 LEU QD2 90 PHE QD 2.48
88 TYR QD 90 PHE QD 3.84
88 TYR QE 90 PHE QD 3.65
34 PHE QE 35 VAL QG2 0.65
34 PHE QD 35 VAL QG2 1.00
31 PHE QD 35 VAL QG1 0.17
86 VAL QG2 88 TYR HA 0.10
86 VAL QG2 88 TYR HB3 0.06
86 VAL QG2 88 TYR HB2 0.06
86 VAL QG1 88 TYR QD 1.00
86 VAL QG2 88 TYR QE 1.00
23 TYR QE 86 VAL QG2 0.07
22 VAL HA 86 VAL QG2 0.10
22 VAL HA 86 VAL QG1 0.60
75 LYS+ HA 83 VAL QQG 2.20
91 SER HB2 92 GLU- HN 1.99
91 SER HB3 92 GLU- HN 1.70
91 SER HN 91 SER HB2 2.89
91 SER HN 91 SER HB3 2.89
101 GLU- HA 101 GLU- HB3 2.00
101 GLU- HB2 101 GLU- HG2 2.00
101 GLU- HB2 101 GLU- HG3 2.00
101 GLU- HB2 102 THR HN 1.87
101 GLU- HB3 102 THR HN 2.31
101 GLU- HN 101 GLU- HB2 2.07
47 TYR QE 101 GLU- HB2 3.54
47 TYR QE 101 GLU- HB3 3.94
101 GLU- HB3 101 GLU- QG 2.62
48 ALA HA 49 LYS+ HB3 2.66
49 LYS+ HN 49 LYS+ HB2 2.23
49 LYS+ HN 49 LYS+ HB3 2.13
49 LYS+ HB2 49 LYS+ QE 2.00
49 LYS+ HB3 49 LYS+ QE 2.93
47 TYR QD 49 LYS+ HB3 2.24
47 TYR QD 49 LYS+ HB2 2.03
49 LYS+ HB2 103 TYR QD 1.94
49 LYS+ HB3 103 TYR QD 2.07
33 LYS+ HB2 34 PHE HN 1.99
33 LYS+ HB3 34 PHE HN 2.00
25 LEU HN 25 LEU HB2 1.99
29 VAL QG1 81 ALA HA 2.30
29 VAL QG2 81 ALA HA 2.30
55 SER QB 56 VAL HN 2.52
54 GLY HN 55 SER HN 2.57
31 PHE HB3 32 ARG+ HN 2.29
31 PHE HB2 32 ARG+ HN 2.29
32 ARG+ HA 33 LYS+ HN 2.24
31 PHE QB 32 ARG+ HN 3.14
31 PHE HA 34 PHE QD 3.64
31 PHE HA 34 PHE QE 3.90
31 PHE HA 32 ARG+ HN 2.64
31 PHE HA 34 PHE HN 2.37
48 ALA HN 102 THR QG2 2.87
47 TYR HB3 101 GLU- HN 2.67
47 TYR HB2 101 GLU- HN 2.67
63 TYR HB3 66 ALA HN 2.51
63 TYR HB2 66 ALA HN 2.13
34 PHE QD 74 ILE QG1 1.92
34 PHE QE 74 ILE QG1 2.52
34 PHE QD 74 ILE QG2 1.50
34 PHE QE 74 ILE QG2 1.50
34 PHE QD 74 ILE QD1 1.50
34 PHE QE 74 ILE QD1 1.50
47 TYR HN 59 VAL QQG 0.46
47 TYR QB 101 GLU- HN 2.85
44 ILE QG2 45 LYS+ HN 2.00
40 ILE QG1 100 PHE HN 2.88
70 LEU HG 71 LEU HN 2.00
56 VAL HB 57 GLU- HN 2.81
27 GLN HB3 28 GLY HN 2.23
27 GLN HB2 28 GLY HN 2.23
14 MET HB3 15 LEU HN 2.08
14 MET HB2 15 LEU HN 2.08
23 TYR QD 87 ASP- HN 2.00
23 TYR QE 87 ASP- HN 3.76
46 GLY HN 97 PHE HB2 2.18
23 TYR QD 55 SER QB 2.53
21 ARG+ HE 55 SER HA 2.00
23 TYR QD 86 VAL HA 2.74
23 TYR HN 86 VAL QG1 3.21
23 TYR HN 86 VAL QG2 3.35
14 MET QB 15 LEU HN 2.11
26 VAL QQG 56 VAL HN 1.05
27 GLN QB 28 GLY HN 2.65
45 LYS+ QB 97 PHE HN 1.54
45 LYS+ QB 99 ASP- HN 1.40
45 LYS+ QG 99 ASP- HN 1.59
67 LEU QQD 68 SER HN 2.43
85 LYS+ QG 86 VAL HN 1.71
101 GLU- QG 102 THR HN 1.51
23 TYR QD 85 LYS+ HG3 2.50
23 TYR QE 85 LYS+ HG3 2.95
23 TYR QD 85 LYS+ HG2 2.50
23 TYR QE 85 LYS+ HG2 2.95
27 GLN HE21 54 GLY HN 2.00
27 GLN HE22 55 SER HN 3.06
27 GLN HE22 54 GLY QA 1.63
34 PHE HA 37 ILE QG2 3.10
35 VAL HN 36 GLN HN 1.56
45 LYS+ HN 61 GLU- HN 2.08
70 LEU QD2 71 LEU HA 2.38
70 LEU QD1 71 LEU HA 2.38
22 VAL QQG 31 PHE QD 1.47
68 SER HA 72 GLU- QB 1.20
16 LYS+ HN 18 MET HN 2.13
16 LYS+ QB 18 MET HN 2.68
16 LYS+ QD 17 ARG+ HN 0.87
16 LYS+ QD 18 MET HN 1.81
16 LYS+ QG 17 ARG+ HN 1.17
17 ARG+ HA 61 GLU- HA 1.69
17 ARG+ HA 62 GLY HN 2.52
17 ARG+ HN 17 ARG+ HA 2.47
17 ARG+ HN 17 ARG+ QD 2.27
17 ARG+ HN 17 ARG+ QG 1.20
17 ARG+ HN 91 SER HN 2.84
18 MET HA 18 MET QE 2.67
18 MET HA 90 PHE HA 1.61
18 MET HA 90 PHE QD 2.24
18 MET HA 91 SER HN 2.22
18 MET QE 20 ALA QB 2.43
18 MET QE 60 ALA QB 2.43
18 MET QE 70 LEU QD1 2.26
18 MET QE 70 LEU QD2 2.26
17 ARG+ QG 18 MET HN 2.00
18 MET HN 18 MET HA 2.10
18 MET HN 18 MET QG 2.29
18 MET HN 19 TYR HN 2.87
18 MET HN 60 ALA HN 2.04
18 MET HN 60 ALA QB 2.00
18 MET HN 61 GLU- HA 2.10
18 MET HN 67 LEU QQD 2.12
19 TYR HA 19 TYR QD 2.26
19 TYR HA 20 ALA QB 2.40
19 TYR HA 59 VAL QG1 2.00
19 TYR HA 59 VAL QG2 2.00
19 TYR HA 60 ALA HN 1.50
19 TYR HN 20 ALA HN 2.64
19 TYR HN 89 SER HN 2.81
19 TYR HN 90 PHE HA 2.55
19 TYR QB 20 ALA HN 1.87
19 TYR QD 20 ALA HA 2.40
19 TYR QD 20 ALA HN 2.24
19 TYR QD 20 ALA QB 1.48
19 TYR QD 21 ARG+ QB 1.14
19 TYR QD 59 VAL HB 2.89
19 TYR QD 59 VAL QG1 2.00
19 TYR QD 59 VAL QG2 2.00
19 TYR QE 20 ALA HA 2.16
19 TYR QE 20 ALA QB 2.54
19 TYR QE 21 ARG+ HB2 1.72
19 TYR QE 21 ARG+ HB3 1.72
19 TYR QE 21 ARG+ QB 1.64
19 TYR QE 89 SER HN 2.00
18 MET HN 18 MET HB2 2.34
18 MET HN 18 MET HB3 2.85
18 MET HB2 19 TYR HN 1.88
18 MET HB2 61 GLU- HA 2.82
19 TYR QE 21 ARG+ QG 2.87
19 TYR QE 57 GLU- QB 2.00
59 VAL QG1 97 PHE HZ 2.00
59 VAL QG2 97 PHE HZ 2.00
61 GLU- HG2 97 PHE QD 2.00
61 GLU- HG2 97 PHE QE 2.00
61 GLU- HG3 97 PHE QE 2.00
87 ASP- HN 88 TYR HN 2.00
50 ASN HB2 51 LEU HN 2.00
50 ASN HB3 51 LEU HN 2.00
27 GLN HE22 51 LEU HD11 2.00
34 PHE QD 73 ARG+ HA 2.00
90 PHE HB3 91 SER HN 2.00
40 ILE QG1 100 PHE QD 2.00
      
ANGLES      
4 LYS+ PHI -179.9 -60.1  
6 TRP PHI 18.8 308.4  
6 TRP PHI -188.4 101.2  
6 TRP PHI -111.6 231.6  
7 SER PHI -114.5 234.5  
7 SER PHI -185.5 -54.5  
12 PHE PHI 15.1 309.8  
12 PHE PHI -189.8 104.9  
12 PHE PHI -110.3 230.3  
13 GLU- PHI -119.8 239.8  
13 GLU- PHI -180.2 -59.8  
16 LYS+ PHI -170.4 -69.6  
17 ARG+ PHI -150.0 -90.0  
18 MET PHI -150.0 -90.0  
21 ARG+ PHI -150.0 -90.0  
22 VAL PHI -169.2 -70.8  
23 TYR PHI -157.7 -82.4  
25 LEU PHI -171.4 -68.6  
27 GLN PHI -150.0 -90.0  
33 LYS+ PHI -9.0 324.6  
33 LYS+ PHI -291.0 51.0  
33 LYS+ PHI -204.6 129.0  
33 LYS+ PHI -95.4 215.4  
34 PHE PHI -0.7 318.5  
34 PHE PHI -299.3 59.3  
34 PHE PHI -198.5 120.7  
34 PHE PHI -101.5 221.5  
35 VAL PHI 0.9 317.5  
35 VAL PHI -197.5 119.2  
35 VAL PHI -102.5 222.5  
36 GLN PHI -17.19 325.0  
36 GLN PHI -282.81 42.8  
36 GLN PHI -204.80 137.2  
36 GLN PHI -95.00 215.8  
37 ILE PHI -289.9 49.9  
37 ILE PHI -205.4 130.1  
37 ILE PHI -94.6 214.6  
38 HIS PHI 6.7 313.9  
38 HIS PHI -193.9 113.3  
38 HIS PHI -106.1 226.1  
39 ALA PHI -8.7 324.3  
39 ALA PHI -291.3 51.3  
39 ALA PHI -204.3 128.7  
39 ALA PHI -95.7 215.7  
40 ILE PHI -7.8 323.7  
40 ILE PHI -292.2 52.2  
40 ILE PHI -206.7 127.8  
40 ILE PHI -96.3 216.3  
41 ARG+ PHI -11.1 326.2  
41 ARG+ PHI -288.9 48.9  
41 ARG+ PHI -206.2 131.1  
41 ARG+ PHI -93.8 213.8  
42 LEU PHI -115.2 235.2  
42 LEU PHI -184.8 -55.2  
44 ILE PHI -119.2 239.2  
44 ILE PHI -180.9 -59.2  
45 LYS+ PHI -171.6 -68.4  
47 TYR PHI -3.4 320.4  
47 TYR PHI -296.6 56.6  
47 TYR PHI -200.4 123.4  
47 TYR PHI -99.6 219.6  
48 ALA PHI -150.0 -90.0 
49 LYS+ PHI -150.0 -90.0  
50 ASN PHI -176.8 -63.2  
51 LEU PHI -169.8 -70.2  
55 SER PHI -178.8 -61.2  
56 VAL PHI -167.6 -72.4  
57 GLU- PHI -150.0 -90.0  
58 VAL PHI -170.2 -69.8  
61 GLU- PHI -150.0 -90.0  
63 TYR PHI 3.3 315.9  
63 TYR PHI -195.9 116.7  
63 TYR PHI -104.1 224.1  
64 GLU- PHI -215.7 -24.3 
64 GLU- PHI -84.3 204.3  
65 GLU- PHI -207.1 32.9 
65 GLU- PHI -92.9 212.9  
67 LEU PHI -198.5 -41.5 
67 LEU PHI -101.5 221.5  
68 SER PHI -201.7 -38.3 
68 SER PHI -98.4 218.4  
69 LYS+ PHI -191.2 -48.8 
69 LYS+ PHI -108.8 228.8  
70 LEU PHI -203.7 -36.3 
70 LEU PHI -96.3 216.3  
71 LEU PHI -210.3 -29.7
71 LEU PHI -89.8 209.8  
72 GLU- PHI -204.8 -35.2 
72 GLU- PHI -95.2 215.2  
73 ARG+ PHI -190.1 -49.0 
73 ARG+ PHI -109.9 229.9  
74 ILE PHI -200.6 -39.4 
74 ILE PHI -99.4 219.4  
75 LYS+ PHI -204.3 -35.7 
75 LYS+ PHI -95.7 215.7  
80 ALA PHI 13.2 310.6  
80 ALA PHI -190.6 106.7  
80 ALA PHI -109.5 229.5  
81 ALA PHI 172.2 307.8 
81 ALA PHI -117.2 237.2  
83 VAL PHI 174.3 305.7  
83 VAL PHI -114.3 234.3  
84 GLU- PHI -290.2 50.2  
84 GLU- PHI -205.2 129.8  
84 GLU- PHI -94.8 214.8  
84 GLU- PHI -9.8 325.2  
86 VAL PHI -150.0 -90.0  
87 ASP- PHI -150.0 -90.0  
88 TYR PHI -150.0 -90.0  
90 PHE PHI -150.0 -90.0  
91 SER PHI 23.1 307.3  
91 SER PHI -187.3 96.9  
91 SER PHI -112.7 232.7  
92 GLU- PHI -8.9 324.5  
92 GLU- PHI -291.1 51.1  
92 GLU- PHI -204.6 128.9  
92 GLU- PHI -95.5 215.5  
93 TYR PHI -105.1 224.9  
93 TYR PHI 5.0 314.9  
93 TYR PHI -194.9 115.0  
94 LYS+ PHI -150.0 -90.0  
96 GLU- PHI -150.0 -90.0  
97 PHE PHI -170.4 -69.6  
99 ASP- PHI 12.0 311.0  
99 ASP- PHI -191.0 107.0  
99 ASP- PHI -109.0 230.0  
101 GLU- PHI -155.72 -84.28  
102 THR PHI -150.0 -90.0  
103 TYR PHI -168.8 -71.17  


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY  -1          1H        GLY  -1 -38.995 -24.696  17.128
    2   2H    GLY  -1          2H        GLY  -1 -39.016 -25.218  15.559
    3   3H    GLY  -1          3H        GLY  -1 -38.638 -26.270  16.765
    4   1HA   GLY  -1          1HA       GLY  -1 -37.054 -23.933  15.978
    5   2HA   GLY  -1          2HA       GLY  -1 -36.645 -25.075  17.275
    6    H    SER   0           H        SER   0 -34.684 -24.879  15.572
    7    HA   SER   0           HA       SER   0 -34.902 -26.639  13.258
    8   1HB   SER   0          1HB       SER   0 -32.517 -26.152  12.982
    9   2HB   SER   0          2HB       SER   0 -33.435 -24.659  13.241
   10    HG   SER   0           HG       SER   0 -32.760 -24.737  15.435
   11    H    MET   1           H        MET   1 -33.362 -28.443  12.985
   12    HA   MET   1           HA       MET   1 -32.633 -29.920  15.468
   13   1HB   MET   1          1HB       MET   1 -33.884 -31.196  12.987
   14   2HB   MET   1          2HB       MET   1 -33.263 -32.013  14.428
   15   1HG   MET   1          1HG       MET   1 -35.543 -31.990  14.801
   16   2HG   MET   1          2HG       MET   1 -34.989 -30.613  15.754
   17   1HE   MET   1          1HE       MET   1 -37.960 -30.961  15.311
   18   2HE   MET   1          2HE       MET   1 -38.505 -29.388  14.684
   19   3HE   MET   1          3HE       MET   1 -37.306 -29.452  15.997
   20    H    LYS   2           H        LYS   2 -32.341 -29.943  11.880
   21    HA   LYS   2           HA       LYS   2 -29.604 -30.829  11.892
   22   1HB   LYS   2          1HB       LYS   2 -29.633 -30.310   9.523
   23   2HB   LYS   2          2HB       LYS   2 -31.089 -31.202   9.984
   24   1HG   LYS   2          1HG       LYS   2 -32.395 -29.092   9.979
   25   2HG   LYS   2          2HG       LYS   2 -30.935 -28.179   9.547
   26   1HD   LYS   2          1HD       LYS   2 -30.708 -29.498   7.470
   27   2HD   LYS   2          2HD       LYS   2 -32.191 -30.387   7.858
   28   1HE   LYS   2          1HE       LYS   2 -32.015 -27.359   7.453
   29   2HE   LYS   2          2HE       LYS   2 -32.526 -28.524   6.218
   30   1HZ   LYS   2          1HZ       LYS   2 -34.453 -27.655   7.303
   31   2HZ   LYS   2          2HZ       LYS   2 -33.899 -28.183   8.808
   32    H    LYS   3           H        LYS   3 -27.751 -29.568  11.187
   33    HA   LYS   3           HA       LYS   3 -27.788 -26.673  11.348
   34   1HB   LYS   3          1HB       LYS   3 -27.883 -27.424  13.737
   35   2HB   LYS   3          2HB       LYS   3 -26.362 -28.297  13.516
   36   1HG   LYS   3          1HG       LYS   3 -25.160 -26.232  13.117
   37   2HG   LYS   3          2HG       LYS   3 -26.662 -25.292  13.041
   38   1HD   LYS   3          1HD       LYS   3 -25.668 -26.783  15.513
   39   2HD   LYS   3          2HD       LYS   3 -25.349 -25.075  15.165
   40   1HE   LYS   3          1HE       LYS   3 -27.825 -24.648  15.110
   41   2HE   LYS   3          2HE       LYS   3 -28.097 -26.322  15.637
   42   1HZ   LYS   3          1HZ       LYS   3 -28.040 -24.904  17.539
   43   2HZ   LYS   3          2HZ       LYS   3 -26.485 -24.374  17.148
   44    H    TRP   4           H        TRP   4 -25.473 -25.904  11.071
   45    HA   TRP   4           HA       TRP   4 -23.407 -27.518  10.239
   46   1HB   TRP   4          1HB       TRP   4 -24.906 -26.145   7.920
   47   2HB   TRP   4          2HB       TRP   4 -23.281 -26.807   7.786
   48    HD1  TRP   4           HD       TRP   4 -26.676 -27.685   6.941
   49    HE1  TRP   4           1HE      TRP   4 -26.936 -30.216   6.476
   50    HE3  TRP   4           3HE      TRP   4 -22.271 -29.355   8.945
   51    HZ2  TRP   4           2HZ      TRP   4 -25.452 -32.615   6.934
   52    HZ3  TRP   4           3HZ      TRP   4 -21.751 -31.766   8.968
   53    HH2  TRP   4           HH       TRP   4 -23.316 -33.408   7.944
   54    H    SER   5           H        SER   5 -21.562 -26.347   9.621
   55    HA   SER   5           HA       SER   5 -21.656 -23.411  10.161
   56   1HB   SER   5          1HB       SER   5 -19.462 -23.681  11.260
   57   2HB   SER   5          2HB       SER   5 -20.744 -24.564  12.108
   58    HG   SER   5           HG       SER   5 -20.019 -26.461  11.091
   59    H    ASP   6           H        ASP   6 -19.820 -22.249   9.121
   60    HA   ASP   6           HA       ASP   6 -18.358 -23.485   6.994
   61   1HB   ASP   6          1HB       ASP   6 -20.648 -23.373   5.965
   62   2HB   ASP   6          2HB       ASP   6 -20.699 -21.640   6.312
   63    HD2  ASP   6           HD       ASP   6 -19.558 -21.176   3.080
   64    H    THR   7           H        THR   7 -17.061 -21.889   5.845
   65    HA   THR   7           HA       THR   7 -15.745 -20.120   5.578
   66    HB   THR   7           HB       THR   7 -17.814 -18.491   7.103
   67    HG1  THR   7           1HG      THR   7 -18.673 -18.207   5.025
   68   1HG2  THR   7          1HG2      THR   7 -16.982 -16.666   5.666
   69   2HG2  THR   7          2HG2      THR   7 -15.679 -17.293   6.689
   70   3HG2  THR   7          3HG2      THR   7 -15.760 -17.749   4.973
   71    H    GLU   8           H        GLU   8 -13.918 -20.691   6.630
   72    HA   GLU   8           HA       GLU   8 -13.321 -19.291   9.134
   73   1HB   GLU   8          1HB       GLU   8 -14.161 -21.517   9.854
   74   2HB   GLU   8          2HB       GLU   8 -12.963 -22.309   8.814
   75   1HG   GLU   8          1HG       GLU   8 -11.133 -21.335  10.156
   76   2HG   GLU   8          2HG       GLU   8 -12.304 -20.413  11.116
   77    HE2  GLU   8           HE       GLU   8 -11.937 -24.428  11.671
   78    H    VAL   9           H        VAL   9 -11.112 -18.776   9.254
   79    HA   VAL   9           HA       VAL   9  -9.716 -18.699   6.762
   80    HB   VAL   9           HB       VAL   9  -9.598 -16.945   8.476
   81   1HG1  VAL   9          1HG1      VAL   9  -7.755 -18.779  10.063
   82   2HG1  VAL   9          2HG1      VAL   9  -8.217 -17.114  10.441
   83   3HG1  VAL   9          3HG1      VAL   9  -9.430 -18.399  10.521
   84   1HG2  VAL   9          1HG2      VAL   9  -6.903 -18.149   7.733
   85   2HG2  VAL   9          2HG2      VAL   9  -7.905 -17.076   6.730
   86   3HG2  VAL   9          3HG2      VAL   9  -7.201 -16.474   8.237
   87    H    PHE  10           H        PHE  10  -8.318 -20.092   5.911
   88    HA   PHE  10           HA       PHE  10  -7.192 -22.335   7.503
   89   1HB   PHE  10          1HB       PHE  10  -7.875 -23.781   5.480
   90   2HB   PHE  10          2HB       PHE  10  -8.994 -23.382   6.765
   91    HD1  PHE  10           1HD      PHE  10 -10.861 -24.110   5.483
   92    HD2  PHE  10           2HD      PHE  10  -8.452 -20.806   4.069
   93    HE1  PHE  10           1HE      PHE  10 -12.641 -23.458   3.895
   94    HE2  PHE  10           2HE      PHE  10 -10.212 -20.194   2.499
   95    HZ   PHE  10           HZ       PHE  10 -12.328 -21.492   2.403
   96    H    GLU  11           H        GLU  11  -7.053 -22.291   4.028
   97    HA   GLU  11           HA       GLU  11  -4.213 -21.390   4.060
   98   1HB   GLU  11          1HB       GLU  11  -3.839 -23.034   2.279
   99   2HB   GLU  11          2HB       GLU  11  -4.323 -23.801   3.800
  100   1HG   GLU  11          1HG       GLU  11  -6.592 -24.111   2.885
  101   2HG   GLU  11          2HG       GLU  11  -6.129 -23.226   1.410
  102    HE2  GLU  11           HE       GLU  11  -4.637 -26.964   1.990
  103    H    MET  12           H        MET  12  -3.530 -20.730   1.889
  104    HA   MET  12           HA       MET  12  -3.563 -19.543  -0.011
  105   1HB   MET  12          1HB       MET  12  -6.353 -20.762  -0.246
  106   2HB   MET  12          2HB       MET  12  -5.605 -19.774  -1.488
  107   1HG   MET  12          1HG       MET  12  -3.664 -21.335  -1.550
  108   2HG   MET  12          2HG       MET  12  -4.441 -22.346  -0.326
  109   1HE   MET  12          1HE       MET  12  -3.275 -23.208  -3.241
  110   2HE   MET  12          2HE       MET  12  -4.497 -24.425  -3.679
  111   3HE   MET  12          3HE       MET  12  -3.877 -24.347  -2.013
  112    H    LEU  13           H        LEU  13  -4.599 -17.771  -1.323
  113    HA   LEU  13           HA       LEU  13  -6.646 -16.153  -0.286
  114   1HB   LEU  13          1HB       LEU  13  -5.280 -14.160   0.366
  115   2HB   LEU  13          2HB       LEU  13  -5.318 -15.487   1.497
  116    HG   LEU  13           HG       LEU  13  -2.992 -16.160   0.308
  117   1HD1  LEU  13          1HD1      LEU  13  -1.747 -14.119  -0.292
  118   2HD1  LEU  13          2HD1      LEU  13  -3.142 -14.293  -1.373
  119   3HD1  LEU  13          3HD1      LEU  13  -3.207 -13.152  -0.014
  120   1HD2  LEU  13          1HD2      LEU  13  -1.886 -14.752   2.055
  121   2HD2  LEU  13          2HD2      LEU  13  -3.450 -13.959   2.361
  122   3HD2  LEU  13          3HD2      LEU  13  -3.250 -15.701   2.663
  123    H    LYS  14           H        LYS  14  -6.998 -14.254  -1.544
  124    HA   LYS  14           HA       LYS  14  -6.169 -14.710  -4.350
  125   1HB   LYS  14          1HB       LYS  14  -8.493 -14.924  -3.870
  126   2HB   LYS  14          2HB       LYS  14  -8.554 -13.397  -2.985
  127   1HG   LYS  14          1HG       LYS  14  -7.666 -13.370  -5.859
  128   2HG   LYS  14          2HG       LYS  14  -9.372 -13.645  -5.534
  129   1HD   LYS  14          1HD       LYS  14  -7.892 -11.218  -4.416
  130   2HD   LYS  14          2HD       LYS  14  -8.697 -11.248  -5.978
  131   1HE   LYS  14          1HE       LYS  14 -10.822 -11.981  -4.686
  132   2HE   LYS  14          2HE       LYS  14  -9.914 -11.585  -3.216
  133   1HZ   LYS  14          1HZ       LYS  14 -11.152  -9.671  -3.939
  134   2HZ   LYS  14          2HZ       LYS  14 -10.353  -9.678  -5.424
  135    H    ARG  15           H        ARG  15  -5.317 -13.050  -5.633
  136    HA   ARG  15           HA       ARG  15  -4.168 -10.738  -4.282
  137   1HB   ARG  15          1HB       ARG  15  -2.766 -11.939  -5.771
  138   2HB   ARG  15          2HB       ARG  15  -3.982 -11.849  -7.071
  139   1HG   ARG  15          1HG       ARG  15  -3.751  -9.481  -7.247
  140   2HG   ARG  15          2HG       ARG  15  -2.662  -9.414  -5.847
  141   1HD   ARG  15          1HD       ARG  15  -0.855 -10.192  -7.050
  142   2HD   ARG  15          2HD       ARG  15  -1.822 -11.264  -8.060
  143    HE   ARG  15           HE       ARG  15  -1.102  -8.497  -8.601
  144   1HH1  ARG  15          2HH1      ARG  15  -3.425 -11.101  -9.380
  145   2HH1  ARG  15          1HH1      ARG  15  -3.943 -10.342 -10.860
  146   1HH2  ARG  15          1HH2      ARG  15  -1.824  -7.534 -10.551
  147   2HH2  ARG  15          2HH2      ARG  15  -3.043  -8.315 -11.522
  148    H    MET  16           H        MET  16  -5.473  -9.070  -3.928
  149    HA   MET  16           HA       MET  16  -7.622  -8.262  -5.815
  150   1HB   MET  16          1HB       MET  16  -7.941  -6.546  -4.085
  151   2HB   MET  16          2HB       MET  16  -8.422  -8.199  -3.694
  152   1HG   MET  16          1HG       MET  16  -6.507  -8.513  -2.263
  153   2HG   MET  16          2HG       MET  16  -5.814  -6.976  -2.803
  154   1HE   MET  16          1HE       MET  16  -6.673  -4.710  -2.448
  155   2HE   MET  16          2HE       MET  16  -7.661  -4.238  -1.057
  156   3HE   MET  16          3HE       MET  16  -8.438  -4.865  -2.522
  157    H    TYR  17           H        TYR  17  -6.661  -7.282  -7.567
  158    HA   TYR  17           HA       TYR  17  -4.402  -5.417  -7.304
  159   1HB   TYR  17          1HB       TYR  17  -4.681  -6.739  -9.347
  160   2HB   TYR  17          2HB       TYR  17  -6.271  -6.046  -9.618
  161    HD1  TYR  17           1HD      TYR  17  -2.628  -5.365  -9.653
  162    HD2  TYR  17           2HD      TYR  17  -6.538  -3.790 -10.545
  163    HE1  TYR  17           1HE      TYR  17  -1.600  -3.625 -11.083
  164    HE2  TYR  17           2HE      TYR  17  -5.519  -2.153 -12.093
  165    HH   TYR  17           HH       TYR  17  -3.570  -1.348 -13.015
  166    H    ALA  18           H        ALA  18  -4.680  -3.287  -6.746
  167    HA   ALA  18           HA       ALA  18  -7.379  -2.069  -7.036
  168   1HB   ALA  18          1HB       ALA  18  -7.183  -1.017  -4.881
  169   2HB   ALA  18          2HB       ALA  18  -7.258  -2.790  -4.764
  170   3HB   ALA  18          3HB       ALA  18  -5.700  -1.950  -4.542
  171    H    ARG  19           H        ARG  19  -7.082  -0.720  -8.528
  172    HA   ARG  19           HA       ARG  19  -4.604   0.781  -8.888
  173   1HB   ARG  19          1HB       ARG  19  -6.328  -0.490 -10.625
  174   2HB   ARG  19          2HB       ARG  19  -6.923   1.154 -10.754
  175   1HG   ARG  19          1HG       ARG  19  -4.126   0.121 -11.274
  176   2HG   ARG  19          2HG       ARG  19  -5.290   0.788 -12.436
  177   1HD   ARG  19          1HD       ARG  19  -5.124   2.919 -10.836
  178   2HD   ARG  19          2HD       ARG  19  -3.569   2.215 -10.396
  179    HE   ARG  19           HE       ARG  19  -4.312   3.598 -12.799
  180   1HH1  ARG  19          1HH1      ARG  19  -2.280   0.861 -11.809
  181   2HH1  ARG  19          2HH1      ARG  19  -1.218   0.989 -13.185
  182   1HH2  ARG  19          1HH2      ARG  19  -2.887   3.781 -14.576
  183   2HH2  ARG  19          2HH2      ARG  19  -1.566   2.658 -14.764
  184    H    VAL  20           H        VAL  20  -4.548   2.555  -7.514
  185    HA   VAL  20           HA       VAL  20  -7.079   4.052  -7.010
  186    HB   VAL  20           HB       VAL  20  -4.528   4.165  -5.400
  187   1HG1  VAL  20          1HG1      VAL  20  -7.394   4.971  -4.749
  188   2HG1  VAL  20          2HG1      VAL  20  -5.960   5.218  -3.740
  189   3HG1  VAL  20          3HG1      VAL  20  -6.135   6.113  -5.257
  190   1HG2  VAL  20          1HG2      VAL  20  -6.973   2.382  -5.164
  191   2HG2  VAL  20          2HG2      VAL  20  -5.266   1.910  -5.168
  192   3HG2  VAL  20          3HG2      VAL  20  -5.959   2.762  -3.778
  193    H    TYR  21           H        TYR  21  -7.379   5.732  -8.248
  194    HA   TYR  21           HA       TYR  21  -5.128   7.185  -9.524
  195   1HB   TYR  21          1HB       TYR  21  -8.124   7.092 -10.000
  196   2HB   TYR  21          2HB       TYR  21  -7.024   8.135 -10.883
  197    HD1  TYR  21           1HD      TYR  21  -7.857   4.547 -10.204
  198    HD2  TYR  21           2HD      TYR  21  -5.767   7.319 -12.758
  199    HE1  TYR  21           1HE      TYR  21  -7.808   2.853 -11.999
  200    HE2  TYR  21           2HE      TYR  21  -5.599   5.575 -14.504
  201    HH   TYR  21           HH       TYR  21  -6.227   3.448 -15.158
  202    H    GLY  22           H        GLY  22  -5.012   9.457  -9.413
  203   1HA   GLY  22          1HA       GLY  22  -6.192  11.539  -9.022
  204   2HA   GLY  22          2HA       GLY  22  -6.814  10.887  -7.496
  205    H    LEU  23           H        LEU  23  -5.910  12.786  -6.474
  206    HA   LEU  23           HA       LEU  23  -3.037  13.212  -6.619
  207   1HB   LEU  23          1HB       LEU  23  -4.916  14.951  -6.526
  208   2HB   LEU  23          2HB       LEU  23  -4.966  14.627  -4.789
  209    HG   LEU  23           HG       LEU  23  -2.411  15.216  -4.829
  210   1HD1  LEU  23          1HD1      LEU  23  -1.723  16.704  -6.682
  211   2HD1  LEU  23          2HD1      LEU  23  -2.047  15.077  -7.285
  212   3HD1  LEU  23          3HD1      LEU  23  -3.242  16.367  -7.533
  213   1HD2  LEU  23          1HD2      LEU  23  -2.897  17.641  -4.778
  214   2HD2  LEU  23          2HD2      LEU  23  -4.489  17.336  -5.507
  215   3HD2  LEU  23          3HD2      LEU  23  -4.107  16.708  -3.887
  216    H    VAL  24           H        VAL  24  -4.062  10.661  -5.427
  217    HA   VAL  24           HA       VAL  24  -3.648  10.751  -2.581
  218    HB   VAL  24           HB       VAL  24  -3.771   8.332  -2.690
  219   1HG1  VAL  24          1HG1      VAL  24  -5.869   9.666  -4.456
  220   2HG1  VAL  24          2HG1      VAL  24  -6.050   8.151  -3.556
  221   3HG1  VAL  24          3HG1      VAL  24  -5.850   9.681  -2.684
  222   1HG2  VAL  24          1HG2      VAL  24  -3.945   8.615  -5.721
  223   2HG2  VAL  24          2HG2      VAL  24  -2.524   8.032  -4.832
  224   3HG2  VAL  24          3HG2      VAL  24  -4.043   7.124  -4.764
  225    H    GLN  25           H        GLN  25  -1.405  10.853  -5.128
  226    HA   GLN  25           HA       GLN  25   0.933   9.772  -3.942
  227   1HB   GLN  25          1HB       GLN  25   0.278  11.872  -5.984
  228   2HB   GLN  25          2HB       GLN  25   1.883  11.886  -5.254
  229   1HG   GLN  25          1HG       GLN  25   1.949  10.601  -7.246
  230   2HG   GLN  25          2HG       GLN  25   2.296   9.580  -5.856
  231   1HE2  GLN  25          1HE2      GLN  25   1.881   7.866  -7.536
  232   2HE2  GLN  25          2HE2      GLN  25   0.230   7.343  -7.785
  233    H    GLY  26           H        GLY  26   2.560  10.814  -2.694
  234   1HA   GLY  26          1HA       GLY  26   3.490  12.337  -1.262
  235   2HA   GLY  26          2HA       GLY  26   2.133  13.438  -1.514
  236    H    VAL  27           H        VAL  27  -0.076  12.320  -0.602
  237    HA   VAL  27           HA       VAL  27   0.315  12.318   2.229
  238    HB   VAL  27           HB       VAL  27  -2.056  12.032   2.435
  239   1HG1  VAL  27          1HG1      VAL  27  -1.480  13.863   0.066
  240   2HG1  VAL  27          2HG1      VAL  27  -2.839  13.969   1.191
  241   3HG1  VAL  27          3HG1      VAL  27  -1.194  14.263   1.776
  242   1HG2  VAL  27          1HG2      VAL  27  -2.291  11.609  -0.563
  243   2HG2  VAL  27          2HG2      VAL  27  -2.408  10.293   0.627
  244   3HG2  VAL  27          3HG2      VAL  27  -3.578  11.605   0.667
  245    H    GLY  28           H        GLY  28  -0.629  10.646   3.715
  246   1HA   GLY  28          1HA       GLY  28   0.737   8.121   3.260
  247   2HA   GLY  28          2HA       GLY  28  -0.129   8.645   4.709
  248    H    PHE  29           H        PHE  29  -1.234   8.254   1.319
  249    HA   PHE  29           HA       PHE  29  -3.662   6.845   1.976
  250   1HB   PHE  29          1HB       PHE  29  -3.790   7.923  -0.089
  251   2HB   PHE  29          2HB       PHE  29  -2.109   7.625  -0.472
  252    HD1  PHE  29           1HD      PHE  29  -5.223   5.530   0.073
  253    HD2  PHE  29           2HD      PHE  29  -1.601   6.168  -2.193
  254    HE1  PHE  29           1HE      PHE  29  -5.623   3.436  -1.164
  255    HE2  PHE  29           2HE      PHE  29  -1.941   3.988  -3.313
  256    HZ   PHE  29           HZ       PHE  29  -3.913   2.597  -2.767
  257    H    ARG  30           H        ARG  30  -0.648   5.782   0.342
  258    HA   ARG  30           HA       ARG  30  -1.217   3.028   0.450
  259   1HB   ARG  30          1HB       ARG  30   1.083   2.719  -0.201
  260   2HB   ARG  30          2HB       ARG  30   0.357   4.071  -1.084
  261   1HG   ARG  30          1HG       ARG  30   1.514   5.604   0.675
  262   2HG   ARG  30          2HG       ARG  30   2.401   4.149   1.170
  263   1HD   ARG  30          1HD       ARG  30   2.935   3.857  -1.360
  264   2HD   ARG  30          2HD       ARG  30   2.369   5.529  -1.542
  265    HE   ARG  30           HE       ARG  30   4.904   4.580  -0.573
  266   1HH1  ARG  30          1HH1      ARG  30   2.630   7.284  -0.105
  267   2HH1  ARG  30          2HH1      ARG  30   3.898   8.406   0.316
  268   1HH2  ARG  30          1HH2      ARG  30   6.486   6.014  -0.117
  269   2HH2  ARG  30          2HH2      ARG  30   6.143   7.674   0.347
  270    H    LYS  31           H        LYS  31   0.012   5.166   2.916
  271    HA   LYS  31           HA       LYS  31   1.153   3.136   4.600
  272   1HB   LYS  31          1HB       LYS  31   1.505   5.792   4.486
  273   2HB   LYS  31          2HB       LYS  31   0.200   5.787   5.673
  274   1HG   LYS  31          1HG       LYS  31   2.901   4.382   5.853
  275   2HG   LYS  31          2HG       LYS  31   2.386   5.824   6.733
  276   1HD   LYS  31          1HD       LYS  31   0.590   4.393   7.852
  277   2HD   LYS  31          2HD       LYS  31   1.327   2.987   7.059
  278   1HE   LYS  31          1HE       LYS  31   2.227   3.051   9.260
  279   2HE   LYS  31          2HE       LYS  31   3.517   3.562   8.161
  280   1HZ   LYS  31          1HZ       LYS  31   3.410   5.061  10.014
  281   2HZ   LYS  31          2HZ       LYS  31   1.798   5.430   9.674
  282    H    PHE  32           H        PHE  32  -1.923   5.088   4.616
  283    HA   PHE  32           HA       PHE  32  -3.205   3.901   6.721
  284   1HB   PHE  32          1HB       PHE  32  -3.945   5.854   5.443
  285   2HB   PHE  32          2HB       PHE  32  -4.453   4.812   4.120
  286    HD1  PHE  32           1HD      PHE  32  -6.534   6.241   4.433
  287    HD2  PHE  32           2HD      PHE  32  -5.288   3.313   7.363
  288    HE1  PHE  32           1HE      PHE  32  -8.781   6.275   5.458
  289    HE2  PHE  32           2HE      PHE  32  -7.544   3.260   8.273
  290    HZ   PHE  32           HZ       PHE  32  -9.306   4.785   7.381
  291    H    VAL  33           H        VAL  33  -3.160   2.823   3.307
  292    HA   VAL  33           HA       VAL  33  -4.800   0.463   3.601
  293    HB   VAL  33           HB       VAL  33  -2.595   1.174   1.606
  294   1HG1  VAL  33          1HG1      VAL  33  -4.633  -1.098   1.543
  295   2HG1  VAL  33          2HG1      VAL  33  -3.616  -0.604   0.174
  296   3HG1  VAL  33          3HG1      VAL  33  -2.863  -1.265   1.626
  297   1HG2  VAL  33          1HG2      VAL  33  -5.636   1.266   1.373
  298   2HG2  VAL  33          2HG2      VAL  33  -4.572   2.680   1.480
  299   3HG2  VAL  33          3HG2      VAL  33  -4.485   1.611   0.071
  300    H    GLN  34           H        GLN  34  -1.447   1.186   4.302
  301    HA   GLN  34           HA       GLN  34  -0.651  -1.561   4.603
  302   1HB   GLN  34          1HB       GLN  34   0.716   0.903   4.511
  303   2HB   GLN  34          2HB       GLN  34   0.882   0.441   6.194
  304   1HG   GLN  34          1HG       GLN  34   2.745  -0.306   4.722
  305   2HG   GLN  34          2HG       GLN  34   1.950  -1.629   5.574
  306   1HE2  GLN  34          1HE2      GLN  34   0.702   0.070   2.624
  307   2HE2  GLN  34          2HE2      GLN  34   0.772  -1.362   1.611
  308    H    ILE  35           H        ILE  35  -1.380   0.953   7.101
  309    HA   ILE  35           HA       ILE  35  -1.199  -0.589   9.335
  310    HB   ILE  35           HB       ILE  35  -3.501   1.320   8.716
  311   1HG1  ILE  35          1HG1      ILE  35  -1.391   2.489   8.463
  312   2HG1  ILE  35          2HG1      ILE  35  -2.253   3.033   9.892
  313   1HG2  ILE  35          1HG2      ILE  35  -3.605   1.593  11.230
  314   2HG2  ILE  35          2HG2      ILE  35  -4.164   0.033  10.633
  315   3HG2  ILE  35          3HG2      ILE  35  -2.558   0.162  11.365
  316   1HD1  ILE  35          1HD1      ILE  35   0.098   2.852  10.388
  317   2HD1  ILE  35          2HD1      ILE  35  -0.759   1.613  11.315
  318   3HD1  ILE  35          3HD1      ILE  35   0.152   1.164   9.850
  319    H    HIS  36           H        HIS  36  -4.208  -0.524   7.353
  320    HA   HIS  36           HA       HIS  36  -5.475  -2.487   9.056
  321   1HB   HIS  36          1HB       HIS  36  -6.174  -1.220   6.407
  322   2HB   HIS  36          2HB       HIS  36  -7.094  -2.587   7.054
  323    HD2  HIS  36           2HD      HIS  36  -5.959   0.859   8.775
  324    HE1  HIS  36           1HE      HIS  36  -9.934  -0.108   9.836
  325    HE2  HIS  36           2HE      HIS  36  -8.053   1.591  10.140
  326    H    ALA  37           H        ALA  37  -4.046  -2.703   5.735
  327    HA   ALA  37           HA       ALA  37  -4.308  -5.352   5.262
  328   1HB   ALA  37          1HB       ALA  37  -2.160  -5.169   3.980
  329   2HB   ALA  37          2HB       ALA  37  -3.297  -3.849   3.675
  330   3HB   ALA  37          3HB       ALA  37  -1.882  -3.603   4.724
  331    H    ILE  38           H        ILE  38  -1.719  -3.904   7.188
  332    HA   ILE  38           HA       ILE  38  -0.296  -6.344   7.794
  333    HB   ILE  38           HB       ILE  38  -0.172  -3.412   8.524
  334   1HG1  ILE  38          1HG1      ILE  38   2.171  -3.677   7.909
  335   2HG1  ILE  38          2HG1      ILE  38   1.999  -5.434   7.823
  336   1HG2  ILE  38          1HG2      ILE  38   1.523  -3.733  10.225
  337   2HG2  ILE  38          2HG2      ILE  38  -0.076  -4.262  10.740
  338   3HG2  ILE  38          3HG2      ILE  38   1.151  -5.474  10.275
  339   1HD1  ILE  38          1HD1      ILE  38   2.062  -4.320   5.599
  340   2HD1  ILE  38          2HD1      ILE  38   0.566  -5.233   5.828
  341   3HD1  ILE  38          3HD1      ILE  38   0.567  -3.467   5.977
  342    H    ARG  39           H        ARG  39  -2.605  -4.275   9.629
  343    HA   ARG  39           HA       ARG  39  -2.765  -5.701  11.924
  344   1HB   ARG  39          1HB       ARG  39  -3.801  -3.574  11.380
  345   2HB   ARG  39          2HB       ARG  39  -5.129  -4.403  10.556
  346   1HG   ARG  39          1HG       ARG  39  -4.381  -5.152  13.383
  347   2HG   ARG  39          2HG       ARG  39  -5.187  -3.602  13.088
  348   1HD   ARG  39          1HD       ARG  39  -7.097  -4.643  12.086
  349   2HD   ARG  39          2HD       ARG  39  -6.317  -6.238  12.105
  350    HE   ARG  39           HE       ARG  39  -6.445  -5.095  14.746
  351   1HH1  ARG  39          1HH1      ARG  39  -8.437  -6.781  12.340
  352   2HH1  ARG  39          2HH1      ARG  39  -9.474  -7.520  13.534
  353   1HH2  ARG  39          1HH2      ARG  39  -7.811  -6.062  16.297
  354   2HH2  ARG  39          2HH2      ARG  39  -9.121  -7.098  15.795
  355    H    LEU  40           H        LEU  40  -4.411  -6.355   8.867
  356    HA   LEU  40           HA       LEU  40  -5.928  -8.661   9.872
  357   1HB   LEU  40          1HB       LEU  40  -5.859  -7.219   7.225
  358   2HB   LEU  40          2HB       LEU  40  -7.005  -8.500   7.645
  359    HG   LEU  40           HG       LEU  40  -6.767  -5.916   9.275
  360   1HD1  LEU  40          1HD1      LEU  40  -8.718  -5.152   8.026
  361   2HD1  LEU  40          2HD1      LEU  40  -7.312  -5.382   6.969
  362   3HD1  LEU  40          3HD1      LEU  40  -8.607  -6.601   6.979
  363   1HD2  LEU  40          1HD2      LEU  40  -9.028  -6.538  10.031
  364   2HD2  LEU  40          2HD2      LEU  40  -8.922  -8.059   9.117
  365   3HD2  LEU  40          3HD2      LEU  40  -7.840  -7.760  10.493
  366    H    GLY  41           H        GLY  41  -2.779  -8.388   8.689
  367   1HA   GLY  41          1HA       GLY  41  -1.304  -9.969   7.977
  368   2HA   GLY  41          2HA       GLY  41  -2.532 -11.206   8.276
  369    H    ILE  42           H        ILE  42  -1.951  -8.491   6.007
  370    HA   ILE  42           HA       ILE  42  -2.757 -10.147   3.663
  371    HB   ILE  42           HB       ILE  42  -2.863  -7.190   4.231
  372   1HG1  ILE  42          1HG1      ILE  42  -4.632  -8.344   5.381
  373   2HG1  ILE  42          2HG1      ILE  42  -5.267  -7.350   4.065
  374   1HG2  ILE  42          1HG2      ILE  42  -3.963  -6.760   2.150
  375   2HG2  ILE  42          2HG2      ILE  42  -2.382  -7.471   1.847
  376   3HG2  ILE  42          3HG2      ILE  42  -3.838  -8.448   1.665
  377   1HD1  ILE  42          1HD1      ILE  42  -6.447  -9.485   4.243
  378   2HD1  ILE  42          2HD1      ILE  42  -5.628  -9.315   2.687
  379   3HD1  ILE  42          3HD1      ILE  42  -4.945 -10.373   3.950
  380    H    LYS  43           H        LYS  43  -1.422 -10.156   1.944
  381    HA   LYS  43           HA       LYS  43   1.375  -9.126   2.300
  382   1HB   LYS  43          1HB       LYS  43   0.392 -11.274   0.431
  383   2HB   LYS  43          2HB       LYS  43   2.057 -10.820   0.767
  384   1HG   LYS  43          1HG       LYS  43   1.823 -11.543   3.118
  385   2HG   LYS  43          2HG       LYS  43   0.135 -12.004   2.827
  386   1HD   LYS  43          1HD       LYS  43   0.825 -13.688   1.183
  387   2HD   LYS  43          2HD       LYS  43   2.520 -13.205   1.372
  388   1HE   LYS  43          1HE       LYS  43   2.149 -15.214   2.660
  389   2HE   LYS  43          2HE       LYS  43   2.437 -13.867   3.777
  390   1HZ   LYS  43          1HZ       LYS  43  -0.014 -13.730   4.009
  391   2HZ   LYS  43          2HZ       LYS  43   0.523 -15.282   4.394
  392    H    GLY  44           H        GLY  44   2.380  -8.450   0.122
  393   1HA   GLY  44          1HA       GLY  44   1.324  -8.097  -2.283
  394   2HA   GLY  44          2HA       GLY  44   0.434  -6.824  -1.416
  395    H    TYR  45           H        TYR  45   1.249  -5.163  -2.594
  396    HA   TYR  45           HA       TYR  45   3.474  -3.916  -1.422
  397   1HB   TYR  45          1HB       TYR  45   4.665  -5.468  -3.068
  398   2HB   TYR  45          2HB       TYR  45   3.876  -4.527  -4.330
  399    HD1  TYR  45           1HD      TYR  45   5.996  -4.086  -1.264
  400    HD2  TYR  45           2HD      TYR  45   5.254  -2.927  -5.337
  401    HE1  TYR  45           1HE      TYR  45   8.135  -2.802  -1.291
  402    HE2  TYR  45           2HE      TYR  45   7.399  -1.709  -5.377
  403    HH   TYR  45           HH       TYR  45   9.316  -1.144  -4.215
  404    H    ALA  46           H        ALA  46   3.236  -1.760  -1.674
  405    HA   ALA  46           HA       ALA  46   0.991  -0.739  -3.368
  406   1HB   ALA  46          1HB       ALA  46   0.931   1.114  -1.788
  407   2HB   ALA  46          2HB       ALA  46   0.648  -0.446  -1.009
  408   3HB   ALA  46          3HB       ALA  46   2.210   0.358  -0.821
  409    H    LYS  47           H        LYS  47   2.109  -0.352  -5.338
  410    HA   LYS  47           HA       LYS  47   4.788   0.825  -5.171
  411   1HB   LYS  47          1HB       LYS  47   4.233  -1.240  -6.409
  412   2HB   LYS  47          2HB       LYS  47   3.209  -0.286  -7.467
  413   1HG   LYS  47          1HG       LYS  47   5.304   1.089  -8.051
  414   2HG   LYS  47          2HG       LYS  47   6.226  -0.071  -7.087
  415   1HD   LYS  47          1HD       LYS  47   4.578  -0.733  -9.564
  416   2HD   LYS  47          2HD       LYS  47   6.338  -0.540  -9.503
  417   1HE   LYS  47          1HE       LYS  47   6.462  -2.447  -7.872
  418   2HE   LYS  47          2HE       LYS  47   4.715  -2.702  -8.079
  419   1HZ   LYS  47          1HZ       LYS  47   5.896  -4.120  -9.571
  420   2HZ   LYS  47          2HZ       LYS  47   6.654  -2.796 -10.295
  421    H    ASN  48           H        ASN  48   3.873   2.899  -4.430
  422    HA   ASN  48           HA       ASN  48   2.293   4.588  -6.120
  423   1HB   ASN  48          1HB       ASN  48   2.429   4.665  -3.647
  424   2HB   ASN  48          2HB       ASN  48   4.085   5.267  -3.758
  425   1HD2  ASN  48          2HD2      ASN  48   0.650   6.019  -4.265
  426   2HD2  ASN  48          1HD2      ASN  48   0.848   7.747  -4.432
  427    H    LEU  49           H        LEU  49   3.568   4.121  -8.117
  428    HA   LEU  49           HA       LEU  49   5.943   5.523  -8.687
  429   1HB   LEU  49          1HB       LEU  49   3.808   5.462 -10.772
  430   2HB   LEU  49          2HB       LEU  49   5.526   5.091 -10.849
  431    HG   LEU  49           HG       LEU  49   4.715   2.932  -9.441
  432   1HD1  LEU  49          1HD1      LEU  49   2.482   2.212 -10.144
  433   2HD1  LEU  49          2HD1      LEU  49   2.280   3.848  -9.503
  434   3HD1  LEU  49          3HD1      LEU  49   2.324   3.591 -11.246
  435   1HD2  LEU  49          1HD2      LEU  49   4.542   1.721 -11.577
  436   2HD2  LEU  49          2HD2      LEU  49   4.435   3.266 -12.449
  437   3HD2  LEU  49          3HD2      LEU  49   5.915   2.841 -11.561
  438    HA   PRO  50           HA       PRO  50   3.855   9.387  -7.744
  439   1HB   PRO  50          1HB       PRO  50   5.828  11.206  -8.122
  440   2HB   PRO  50          2HB       PRO  50   5.867   9.970  -6.835
  441   1HG   PRO  50          1HG       PRO  50   7.191   9.795  -9.562
  442   2HG   PRO  50          2HG       PRO  50   7.954   9.537  -7.964
  443   1HD   PRO  50          1HD       PRO  50   7.007   7.449  -9.460
  444   2HD   PRO  50          2HD       PRO  50   6.830   7.454  -7.679
  445    H    ASP  51           H        ASP  51   2.445   8.852  -9.632
  446    HA   ASP  51           HA       ASP  51   2.522  10.994 -11.668
  447   1HB   ASP  51          1HB       ASP  51   2.290   9.385 -13.499
  448   2HB   ASP  51          2HB       ASP  51   3.803   9.130 -12.631
  449    HD2  ASP  51           HD       ASP  51   2.696   5.796 -13.083
  450    H    GLY  52           H        GLY  52   0.784  10.324  -9.294
  451   1HA   GLY  52          1HA       GLY  52  -1.433  10.678  -8.889
  452   2HA   GLY  52          2HA       GLY  52  -1.793  10.659 -10.613
  453    H    SER  53           H        SER  53  -0.870   8.161 -11.400
  454    HA   SER  53           HA       SER  53  -2.994   6.433 -10.345
  455   1HB   SER  53          1HB       SER  53  -2.396   5.113 -12.360
  456   2HB   SER  53          2HB       SER  53  -2.886   6.781 -12.705
  457    HG   SER  53           HG       SER  53  -0.179   6.024 -12.399
  458    H    VAL  54           H        VAL  54  -2.218   5.689  -8.363
  459    HA   VAL  54           HA       VAL  54   0.314   4.121  -8.313
  460    HB   VAL  54           HB       VAL  54   0.343   5.495  -6.508
  461   1HG1  VAL  54          1HG1      VAL  54  -2.560   4.927  -5.918
  462   2HG1  VAL  54          2HG1      VAL  54  -1.467   5.854  -4.882
  463   3HG1  VAL  54          3HG1      VAL  54  -1.867   6.461  -6.492
  464   1HG2  VAL  54          1HG2      VAL  54  -1.006   3.015  -5.330
  465   2HG2  VAL  54          2HG2      VAL  54   0.653   3.017  -5.944
  466   3HG2  VAL  54          3HG2      VAL  54   0.213   4.038  -4.566
  467    H    GLU  55           H        GLU  55   0.263   1.989  -8.587
  468    HA   GLU  55           HA       GLU  55  -2.303   0.551  -8.399
  469   1HB   GLU  55          1HB       GLU  55  -1.319  -1.148  -9.647
  470   2HB   GLU  55          2HB       GLU  55  -0.830   0.381 -10.369
  471   1HG   GLU  55          1HG       GLU  55   1.168  -0.673 -10.459
  472   2HG   GLU  55          2HG       GLU  55   1.359   0.040  -8.862
  473    HE2  GLU  55           HE       GLU  55   1.549  -3.144  -7.374
  474    H    VAL  56           H        VAL  56  -2.722  -0.902  -6.778
  475    HA   VAL  56           HA       VAL  56  -0.530  -1.686  -4.897
  476    HB   VAL  56           HB       VAL  56  -3.490  -1.414  -4.343
  477   1HG1  VAL  56          1HG1      VAL  56  -1.105  -1.949  -2.518
  478   2HG1  VAL  56          2HG1      VAL  56  -2.779  -1.675  -1.988
  479   3HG1  VAL  56          3HG1      VAL  56  -2.382  -3.113  -2.932
  480   1HG2  VAL  56          1HG2      VAL  56  -1.146   0.408  -3.644
  481   2HG2  VAL  56          2HG2      VAL  56  -2.554   0.821  -4.647
  482   3HG2  VAL  56          3HG2      VAL  56  -2.760   0.514  -2.917
  483    H    VAL  57           H        VAL  57  -0.230  -3.889  -4.630
  484    HA   VAL  57           HA       VAL  57  -2.211  -5.781  -5.857
  485    HB   VAL  57           HB       VAL  57  -0.216  -7.290  -6.234
  486   1HG1  VAL  57          1HG1      VAL  57  -0.435  -4.701  -7.807
  487   2HG1  VAL  57          2HG1      VAL  57   0.401  -6.168  -8.360
  488   3HG1  VAL  57          3HG1      VAL  57  -1.341  -6.211  -8.049
  489   1HG2  VAL  57          1HG2      VAL  57   1.401  -4.712  -5.931
  490   2HG2  VAL  57          2HG2      VAL  57   1.477  -6.109  -4.832
  491   3HG2  VAL  57          3HG2      VAL  57   1.987  -6.265  -6.518
  492    H    ALA  58           H        ALA  58  -3.030  -5.196  -3.654
  493    HA   ALA  58           HA       ALA  58  -1.889  -6.507  -1.333
  494   1HB   ALA  58          1HB       ALA  58  -4.222  -6.060  -0.419
  495   2HB   ALA  58          2HB       ALA  58  -3.356  -4.622  -1.012
  496   3HB   ALA  58          3HB       ALA  58  -4.609  -5.357  -2.003
  497    H    GLU  59           H        GLU  59  -2.536  -8.507  -0.470
  498    HA   GLU  59           HA       GLU  59  -4.178 -10.245  -2.195
  499   1HB   GLU  59          1HB       GLU  59  -1.727 -11.002  -0.647
  500   2HB   GLU  59          2HB       GLU  59  -2.634 -11.947  -1.846
  501   1HG   GLU  59          1HG       GLU  59  -2.071 -10.222  -3.574
  502   2HG   GLU  59          2HG       GLU  59  -1.059  -9.422  -2.370
  503    HE2  GLU  59           HE       GLU  59   0.331 -12.553  -4.396
  504    H    GLY  60           H        GLY  60  -6.065 -10.973  -1.017
  505   1HA   GLY  60          1HA       GLY  60  -5.784 -11.569   1.905
  506   2HA   GLY  60          2HA       GLY  60  -7.064 -10.514   1.296
  507    H    TYR  61           H        TYR  61  -7.391 -12.827   2.837
  508    HA   TYR  61           HA       TYR  61  -8.086 -15.159   1.303
  509   1HB   TYR  61          1HB       TYR  61  -8.263 -14.210   4.150
  510   2HB   TYR  61          2HB       TYR  61  -9.250 -15.575   3.681
  511    HD1  TYR  61           1HD      TYR  61  -8.385 -17.786   3.501
  512    HD2  TYR  61           2HD      TYR  61  -5.708 -14.431   3.902
  513    HE1  TYR  61           1HE      TYR  61  -6.725 -19.233   4.619
  514    HE2  TYR  61           2HE      TYR  61  -4.032 -15.898   4.986
  515    HH   TYR  61           HH       TYR  61  -3.525 -18.036   5.680
  516    H    GLU  62           H        GLU  62 -10.359 -13.770   3.590
  517    HA   GLU  62           HA       GLU  62 -12.546 -13.483   1.613
  518   1HB   GLU  62          1HB       GLU  62 -12.243 -15.672   3.708
  519   2HB   GLU  62          2HB       GLU  62 -13.814 -15.168   3.038
  520   1HG   GLU  62          1HG       GLU  62 -13.022 -15.818   0.763
  521   2HG   GLU  62          2HG       GLU  62 -11.488 -16.366   1.466
  522    HE2  GLU  62           HE       GLU  62 -14.853 -18.523   2.181
  523    H    GLU  63           H        GLU  63 -12.832 -14.363   5.072
  524    HA   GLU  63           HA       GLU  63 -14.051 -12.166   6.040
  525   1HB   GLU  63          1HB       GLU  63 -13.137 -12.771   8.214
  526   2HB   GLU  63          2HB       GLU  63 -13.816 -14.101   7.272
  527   1HG   GLU  63          1HG       GLU  63 -11.446 -14.788   6.647
  528   2HG   GLU  63          2HG       GLU  63 -10.870 -13.567   7.797
  529    HE2  GLU  63           HE       GLU  63 -12.725 -16.914   9.160
  530    H    ALA  64           H        ALA  64 -10.461 -12.656   5.902
  531    HA   ALA  64           HA       ALA  64  -9.808 -10.002   6.780
  532   1HB   ALA  64          1HB       ALA  64  -7.521 -10.612   6.143
  533   2HB   ALA  64          2HB       ALA  64  -8.285 -11.966   6.996
  534   3HB   ALA  64          3HB       ALA  64  -8.119 -12.010   5.226
  535    H    LEU  65           H        LEU  65 -10.648 -11.354   3.651
  536    HA   LEU  65           HA       LEU  65  -9.516  -9.207   2.046
  537   1HB   LEU  65          1HB       LEU  65 -10.030 -11.409   1.111
  538   2HB   LEU  65          2HB       LEU  65 -11.750 -11.129   1.417
  539    HG   LEU  65           HG       LEU  65 -11.572  -9.082  -0.053
  540   1HD1  LEU  65          1HD1      LEU  65  -9.741  -9.078  -1.719
  541   2HD1  LEU  65          2HD1      LEU  65  -9.073  -8.853  -0.099
  542   3HD1  LEU  65          3HD1      LEU  65  -8.956 -10.437  -0.890
  543   1HD2  LEU  65          1HD2      LEU  65 -11.769 -10.467  -2.062
  544   2HD2  LEU  65          2HD2      LEU  65 -11.052 -11.843  -1.168
  545   3HD2  LEU  65          3HD2      LEU  65 -12.627 -11.171  -0.679
  546    H    SER  66           H        SER  66 -12.952  -9.979   2.720
  547    HA   SER  66           HA       SER  66 -14.171  -7.597   2.195
  548   1HB   SER  66          1HB       SER  66 -15.923  -8.292   3.742
  549   2HB   SER  66          2HB       SER  66 -15.345  -9.643   2.750
  550    HG   SER  66           HG       SER  66 -14.015 -10.241   4.557
  551    H    LYS  67           H        LYS  67 -12.481  -8.309   5.320
  552    HA   LYS  67           HA       LYS  67 -13.228  -5.807   6.519
  553   1HB   LYS  67          1HB       LYS  67 -11.127  -7.898   7.060
  554   2HB   LYS  67          2HB       LYS  67 -10.838  -6.265   7.666
  555   1HG   LYS  67          1HG       LYS  67 -11.892  -7.423   9.420
  556   2HG   LYS  67          2HG       LYS  67 -13.033  -6.231   8.790
  557   1HD   LYS  67          1HD       LYS  67 -14.123  -8.121   7.466
  558   2HD   LYS  67          2HD       LYS  67 -13.019  -9.236   8.310
  559   1HE   LYS  67          1HE       LYS  67 -13.938  -8.512  10.488
  560   2HE   LYS  67          2HE       LYS  67 -15.053  -7.409   9.652
  561   1HZ   LYS  67          1HZ       LYS  67 -16.161  -9.474  10.103
  562   2HZ   LYS  67          2HZ       LYS  67 -15.003 -10.327   9.218
  563    H    LEU  68           H        LEU  68 -10.016  -6.603   5.040
  564    HA   LEU  68           HA       LEU  68  -9.067  -4.065   4.913
  565   1HB   LEU  68          1HB       LEU  68  -7.858  -6.093   4.584
  566   2HB   LEU  68          2HB       LEU  68  -8.548  -6.322   2.986
  567    HG   LEU  68           HG       LEU  68  -6.143  -5.390   3.353
  568   1HD1  LEU  68          1HD1      LEU  68  -6.227  -4.173   1.222
  569   2HD1  LEU  68          2HD1      LEU  68  -7.098  -5.715   1.239
  570   3HD1  LEU  68          3HD1      LEU  68  -8.007  -4.185   1.302
  571   1HD2  LEU  68          1HD2      LEU  68  -5.801  -3.043   3.334
  572   2HD2  LEU  68          2HD2      LEU  68  -7.526  -2.698   3.400
  573   3HD2  LEU  68          3HD2      LEU  68  -6.722  -3.460   4.795
  574    H    LEU  69           H        LEU  69 -11.386  -5.533   2.620
  575    HA   LEU  69           HA       LEU  69 -11.193  -3.467   0.593
  576   1HB   LEU  69          1HB       LEU  69 -12.825  -5.932   1.134
  577   2HB   LEU  69          2HB       LEU  69 -13.694  -4.679   0.282
  578    HG   LEU  69           HG       LEU  69 -12.653  -6.378  -1.170
  579   1HD1  LEU  69          1HD1      LEU  69 -11.732  -4.794  -2.837
  580   2HD1  LEU  69          2HD1      LEU  69 -13.224  -4.204  -2.093
  581   3HD1  LEU  69          3HD1      LEU  69 -11.658  -3.523  -1.607
  582   1HD2  LEU  69          1HD2      LEU  69 -10.293  -6.393  -1.607
  583   2HD2  LEU  69          2HD2      LEU  69  -9.993  -5.124  -0.400
  584   3HD2  LEU  69          3HD2      LEU  69 -10.559  -6.725   0.115
  585    H    GLU  70           H        GLU  70 -13.733  -4.295   2.955
  586    HA   GLU  70           HA       GLU  70 -15.349  -2.065   2.578
  587   1HB   GLU  70          1HB       GLU  70 -14.838  -3.850   4.980
  588   2HB   GLU  70          2HB       GLU  70 -16.084  -2.593   4.975
  589   1HG   GLU  70          1HG       GLU  70 -17.207  -3.586   3.065
  590   2HG   GLU  70          2HG       GLU  70 -15.974  -4.839   2.917
  591    HE2  GLU  70           HE       GLU  70 -17.058  -6.510   5.905
  592    H    ARG  71           H        ARG  71 -12.424  -2.358   4.559
  593    HA   ARG  71           HA       ARG  71 -12.453   0.143   5.942
  594   1HB   ARG  71          1HB       ARG  71 -10.741  -1.162   6.682
  595   2HB   ARG  71          2HB       ARG  71 -10.451  -1.897   5.114
  596   1HG   ARG  71          1HG       ARG  71  -8.534  -0.637   5.790
  597   2HG   ARG  71          2HG       ARG  71  -9.205  -0.014   4.322
  598   1HD   ARG  71          1HD       ARG  71 -10.416   1.455   6.491
  599   2HD   ARG  71          2HD       ARG  71  -8.701   1.362   6.813
  600    HE   ARG  71           HE       ARG  71  -9.968   3.074   4.990
  601   1HH1  ARG  71          1HH1      ARG  71  -7.181   0.862   4.800
  602   2HH1  ARG  71          2HH1      ARG  71  -6.406   1.801   3.545
  603   1HH2  ARG  71          1HH2      ARG  71  -8.879   4.275   3.405
  604   2HH2  ARG  71          2HH2      ARG  71  -7.329   3.747   2.798
  605    H    ILE  72           H        ILE  72 -10.937  -0.586   2.763
  606    HA   ILE  72           HA       ILE  72  -9.953   1.934   2.501
  607    HB   ILE  72           HB       ILE  72 -10.559   0.101   0.219
  608   1HG1  ILE  72          1HG1      ILE  72  -7.852   0.556   1.525
  609   2HG1  ILE  72          2HG1      ILE  72  -8.956  -0.549   2.300
  610   1HG2  ILE  72          1HG2      ILE  72  -8.647   1.406  -0.827
  611   2HG2  ILE  72          2HG2      ILE  72 -10.081   2.410  -0.562
  612   3HG2  ILE  72          3HG2      ILE  72  -8.700   2.518   0.548
  613   1HD1  ILE  72          1HD1      ILE  72  -7.529  -1.788   0.801
  614   2HD1  ILE  72          2HD1      ILE  72  -9.225  -1.883   0.284
  615   3HD1  ILE  72          3HD1      ILE  72  -8.093  -0.825  -0.585
  616    H    LYS  73           H        LYS  73 -12.700   0.844   0.465
  617    HA   LYS  73           HA       LYS  73 -13.585   3.213  -0.502
  618   1HB   LYS  73          1HB       LYS  73 -15.832   2.136  -0.653
  619   2HB   LYS  73          2HB       LYS  73 -14.443   1.315  -1.335
  620   1HG   LYS  73          1HG       LYS  73 -14.496   0.017   1.082
  621   2HG   LYS  73          2HG       LYS  73 -16.179   0.526   0.976
  622   1HD   LYS  73          1HD       LYS  73 -16.038  -1.632  -0.051
  623   2HD   LYS  73          2HD       LYS  73 -16.216  -0.450  -1.357
  624   1HE   LYS  73          1HE       LYS  73 -13.452  -0.636  -1.231
  625   2HE   LYS  73          2HE       LYS  73 -13.900  -2.228  -0.634
  626   1HZ   LYS  73          1HZ       LYS  73 -13.730  -2.286  -3.002
  627   2HZ   LYS  73          2HZ       LYS  73 -14.916  -1.096  -3.158
  628    H    GLN  74           H        GLN  74 -14.673   1.798   2.642
  629    HA   GLN  74           HA       GLN  74 -16.529   3.812   3.324
  630   1HB   GLN  74          1HB       GLN  74 -16.407   1.639   4.401
  631   2HB   GLN  74          2HB       GLN  74 -14.844   2.036   5.140
  632   1HG   GLN  74          1HG       GLN  74 -17.362   3.665   5.664
  633   2HG   GLN  74          2HG       GLN  74 -16.967   2.205   6.574
  634   1HE2  GLN  74          1HE2      GLN  74 -16.568   5.564   6.574
  635   2HE2  GLN  74          2HE2      GLN  74 -15.253   5.647   7.727
  636    H    GLY  75           H        GLY  75 -13.072   3.503   4.234
  637   1HA   GLY  75          1HA       GLY  75 -13.020   6.289   5.316
  638   2HA   GLY  75          2HA       GLY  75 -11.933   4.965   5.691
  639    HA   PRO  76           HA       PRO  76 -10.778   6.364   1.195
  640   1HB   PRO  76          1HB       PRO  76 -11.305   9.002   0.517
  641   2HB   PRO  76          2HB       PRO  76 -12.454   7.658   0.253
  642   1HG   PRO  76          1HG       PRO  76 -12.334   9.566   2.606
  643   2HG   PRO  76          2HG       PRO  76 -13.756   9.174   1.588
  644   1HD   PRO  76          1HD       PRO  76 -13.373   7.932   3.934
  645   2HD   PRO  76          2HD       PRO  76 -13.907   6.987   2.506
  646    HA   PRO  77           HA       PRO  77  -7.054   8.218   2.734
  647   1HB   PRO  77          1HB       PRO  77  -5.773   9.186   0.510
  648   2HB   PRO  77          2HB       PRO  77  -6.020   7.445   0.826
  649   1HG   PRO  77          1HG       PRO  77  -7.722   9.273  -0.892
  650   2HG   PRO  77          2HG       PRO  77  -7.031   7.684  -1.348
  651   1HD   PRO  77          1HD       PRO  77  -9.582   7.918  -0.483
  652   2HD   PRO  77          2HD       PRO  77  -8.587   6.525   0.020
  653    H    ALA  78           H        ALA  78  -5.842  10.266   2.971
  654    HA   ALA  78           HA       ALA  78  -7.621  12.565   3.170
  655   1HB   ALA  78          1HB       ALA  78  -5.738  13.567   4.377
  656   2HB   ALA  78          2HB       ALA  78  -6.070  11.935   4.981
  657   3HB   ALA  78          3HB       ALA  78  -4.688  12.212   3.900
  658    H    ALA  79           H        ALA  79  -7.306  11.852   0.447
  659    HA   ALA  79           HA       ALA  79  -6.112  14.304  -0.647
  660   1HB   ALA  79          1HB       ALA  79  -5.100  12.798  -2.468
  661   2HB   ALA  79          2HB       ALA  79  -4.231  12.992  -0.943
  662   3HB   ALA  79          3HB       ALA  79  -5.194  11.512  -1.241
  663    H    GLU  80           H        GLU  80  -6.739  14.468  -2.963
  664    HA   GLU  80           HA       GLU  80  -9.526  13.779  -3.397
  665   1HB   GLU  80          1HB       GLU  80  -7.466  15.186  -5.164
  666   2HB   GLU  80          2HB       GLU  80  -9.180  14.985  -5.534
  667   1HG   GLU  80          1HG       GLU  80  -8.936  17.179  -4.673
  668   2HG   GLU  80          2HG       GLU  80  -9.776  16.221  -3.447
  669    HE2  GLU  80           HE       GLU  80  -7.542  17.793  -1.269
  670    H    VAL  81           H        VAL  81  -9.269  11.464  -3.261
  671    HA   VAL  81           HA       VAL  81  -8.085   9.916  -5.377
  672    HB   VAL  81           HB       VAL  81  -8.716   9.030  -3.190
  673   1HG1  VAL  81          1HG1      VAL  81 -11.626   9.111  -4.061
  674   2HG1  VAL  81          2HG1      VAL  81 -10.961   8.476  -2.556
  675   3HG1  VAL  81          3HG1      VAL  81 -10.908  10.217  -2.869
  676   1HG2  VAL  81          1HG2      VAL  81 -10.137   7.661  -5.513
  677   2HG2  VAL  81          2HG2      VAL  81  -8.411   7.525  -5.116
  678   3HG2  VAL  81          3HG2      VAL  81  -9.628   6.897  -3.993
  679    H    GLU  82           H        GLU  82  -8.602   9.811  -7.400
  680    HA   GLU  82           HA       GLU  82 -10.762  11.520  -8.364
  681   1HB   GLU  82          1HB       GLU  82  -8.468  11.736  -9.180
  682   2HB   GLU  82          2HB       GLU  82  -8.466  10.061  -9.739
  683   1HG   GLU  82          1HG       GLU  82  -8.821  11.558 -11.626
  684   2HG   GLU  82          2HG       GLU  82 -10.299  10.630 -11.364
  685    HE2  GLU  82           HE       GLU  82 -10.242  14.614 -10.534
  686    H    LYS  83           H        LYS  83  -9.724   8.097  -8.749
  687    HA   LYS  83           HA       LYS  83 -12.417   7.178  -9.151
  688   1HB   LYS  83          1HB       LYS  83 -12.197   6.436 -11.495
  689   2HB   LYS  83          2HB       LYS  83 -12.321   8.183 -11.295
  690   1HG   LYS  83          1HG       LYS  83  -9.824   8.370 -11.578
  691   2HG   LYS  83          2HG       LYS  83  -9.761   6.634 -11.906
  692   1HD   LYS  83          1HD       LYS  83 -11.332   6.936 -13.805
  693   2HD   LYS  83          2HD       LYS  83 -11.304   8.692 -13.524
  694   1HE   LYS  83          1HE       LYS  83  -8.849   8.714 -13.906
  695   2HE   LYS  83          2HE       LYS  83  -8.868   6.954 -14.160
  696   1HZ   LYS  83          1HZ       LYS  83  -8.969   8.062 -16.269
  697   2HZ   LYS  83          2HZ       LYS  83 -10.390   8.860 -15.822
  698    H    VAL  84           H        VAL  84 -11.386   6.065  -7.386
  699    HA   VAL  84           HA       VAL  84  -9.332   4.120  -7.831
  700    HB   VAL  84           HB       VAL  84  -9.560   4.922  -5.676
  701   1HG1  VAL  84          1HG1      VAL  84 -12.414   3.871  -5.484
  702   2HG1  VAL  84          2HG1      VAL  84 -11.447   4.547  -4.167
  703   3HG1  VAL  84          3HG1      VAL  84 -11.920   5.575  -5.522
  704   1HG2  VAL  84          1HG2      VAL  84 -10.622   2.079  -5.504
  705   2HG2  VAL  84          2HG2      VAL  84  -8.994   2.473  -6.078
  706   3HG2  VAL  84          3HG2      VAL  84  -9.482   2.905  -4.424
  707    H    ASP  85           H        ASP  85  -9.729   2.871  -9.564
  708    HA   ASP  85           HA       ASP  85 -12.216   1.279  -9.768
  709   1HB   ASP  85          1HB       ASP  85 -11.632   2.697 -11.628
  710   2HB   ASP  85          2HB       ASP  85 -10.019   1.981 -11.726
  711    HD2  ASP  85           HD       ASP  85 -11.323  -0.135 -14.135
  712    H    TYR  86           H        TYR  86 -11.525  -0.286  -8.056
  713    HA   TYR  86           HA       TYR  86  -9.034  -1.691  -8.473
  714   1HB   TYR  86          1HB       TYR  86  -9.439  -2.850  -6.502
  715   2HB   TYR  86          2HB       TYR  86 -10.105  -1.258  -6.202
  716    HD1  TYR  86           1HD      TYR  86 -10.713  -4.843  -6.411
  717    HD2  TYR  86           2HD      TYR  86 -12.677  -1.000  -6.282
  718    HE1  TYR  86           1HE      TYR  86 -12.823  -5.941  -5.730
  719    HE2  TYR  86           2HE      TYR  86 -14.788  -2.107  -5.618
  720    HH   TYR  86           HH       TYR  86 -15.820  -4.092  -5.071
  721    H    SER  87           H        SER  87  -8.978  -4.099  -8.622
  722    HA   SER  87           HA       SER  87 -11.142  -5.320 -10.218
  723   1HB   SER  87          1HB       SER  87  -8.211  -5.348 -11.041
  724   2HB   SER  87          2HB       SER  87  -9.560  -6.155 -11.857
  725    HG   SER  87           HG       SER  87 -10.483  -3.987 -12.057
  726    H    PHE  88           H        PHE  88 -11.731  -6.925  -8.936
  727    HA   PHE  88           HA       PHE  88 -10.044  -8.580  -7.284
  728   1HB   PHE  88          1HB       PHE  88 -12.231  -8.859  -6.681
  729   2HB   PHE  88          2HB       PHE  88 -12.843  -8.493  -8.282
  730    HD1  PHE  88           1HD      PHE  88 -10.697 -11.299  -6.955
  731    HD2  PHE  88           2HD      PHE  88 -14.275 -10.135  -9.044
  732    HE1  PHE  88           1HE      PHE  88 -11.270 -13.686  -7.296
  733    HE2  PHE  88           2HE      PHE  88 -14.834 -12.516  -9.406
  734    HZ   PHE  88           HZ       PHE  88 -13.343 -14.299  -8.524
  735    H    SER  89           H        SER  89  -8.513  -9.942  -7.992
  736    HA   SER  89           HA       SER  89  -8.709 -11.182 -10.693
  737   1HB   SER  89          1HB       SER  89  -6.166 -10.167  -9.388
  738   2HB   SER  89          2HB       SER  89  -6.375 -10.789 -11.038
  739    HG   SER  89           HG       SER  89  -7.888  -8.982 -11.294
  740    H    GLU  90           H        GLU  90  -6.188 -12.640 -10.199
  741    HA   GLU  90           HA       GLU  90  -6.680 -14.166  -7.723
  742   1HB   GLU  90          1HB       GLU  90  -6.346 -16.261  -8.770
  743   2HB   GLU  90          2HB       GLU  90  -7.675 -15.462  -9.612
  744   1HG   GLU  90          1HG       GLU  90  -4.776 -15.626 -10.597
  745   2HG   GLU  90          2HG       GLU  90  -6.101 -16.658 -11.114
  746    HE2  GLU  90           HE       GLU  90  -7.601 -14.280 -13.189
  747    H    TYR  91           H        TYR  91  -4.773 -15.173  -6.901
  748    HA   TYR  91           HA       TYR  91  -2.409 -13.597  -7.357
  749   1HB   TYR  91          1HB       TYR  91  -1.672 -14.460  -5.380
  750   2HB   TYR  91          2HB       TYR  91  -3.415 -14.387  -5.152
  751    HD1  TYR  91           1HD      TYR  91  -4.756 -16.647  -5.630
  752    HD2  TYR  91           2HD      TYR  91  -0.528 -16.411  -4.784
  753    HE1  TYR  91           1HE      TYR  91  -4.781 -18.982  -4.861
  754    HE2  TYR  91           2HE      TYR  91  -0.564 -18.743  -3.986
  755    HH   TYR  91           HH       TYR  91  -1.849 -20.619  -3.600
  756    H    LYS  92           H        LYS  92  -0.819 -14.037  -8.715
  757    HA   LYS  92           HA       LYS  92  -0.463 -16.642  -9.989
  758   1HB   LYS  92          1HB       LYS  92   0.099 -14.566 -11.176
  759   2HB   LYS  92          2HB       LYS  92   1.239 -14.119  -9.900
  760   1HG   LYS  92          1HG       LYS  92   2.467 -14.962 -11.761
  761   2HG   LYS  92          2HG       LYS  92   2.623 -16.132 -10.450
  762   1HD   LYS  92          1HD       LYS  92   0.935 -17.588 -11.489
  763   2HD   LYS  92          2HD       LYS  92   0.627 -16.391 -12.759
  764   1HE   LYS  92          1HE       LYS  92   3.311 -17.775 -12.289
  765   2HE   LYS  92          2HE       LYS  92   2.086 -18.319 -13.450
  766   1HZ   LYS  92          1HZ       LYS  92   3.658 -16.940 -14.578
  767   2HZ   LYS  92          2HZ       LYS  92   3.335 -15.649 -13.541
  768    H    GLY  93           H        GLY  93   1.088 -14.611  -7.473
  769   1HA   GLY  93          1HA       GLY  93   1.978 -16.920  -5.964
  770   2HA   GLY  93          2HA       GLY  93   3.278 -15.922  -6.657
  771    H    GLU  94           H        GLU  94   2.962 -16.132  -3.898
  772    HA   GLU  94           HA       GLU  94   1.530 -13.797  -2.902
  773   1HB   GLU  94          1HB       GLU  94   2.067 -14.609  -0.721
  774   2HB   GLU  94          2HB       GLU  94   1.268 -15.844  -1.701
  775   1HG   GLU  94          1HG       GLU  94   3.488 -16.933  -2.098
  776   2HG   GLU  94          2HG       GLU  94   4.255 -15.697  -1.083
  777    HE2  GLU  94           HE       GLU  94   1.962 -18.562   0.645
  778    H    PHE  95           H        PHE  95   2.480 -11.987  -2.353
  779    HA   PHE  95           HA       PHE  95   5.274 -11.381  -2.925
  780   1HB   PHE  95          1HB       PHE  95   2.899  -9.880  -1.801
  781   2HB   PHE  95          2HB       PHE  95   4.512  -9.207  -1.706
  782    HD1  PHE  95           1HD      PHE  95   5.340  -7.884  -3.456
  783    HD2  PHE  95           2HD      PHE  95   2.158 -10.682  -4.269
  784    HE1  PHE  95           1HE      PHE  95   5.214  -7.075  -5.792
  785    HE2  PHE  95           2HE      PHE  95   2.041  -9.870  -6.600
  786    HZ   PHE  95           HZ       PHE  95   3.596  -8.093  -7.381
  787    H    GLU  96           H        GLU  96   6.900 -10.973  -1.432
  788    HA   GLU  96           HA       GLU  96   6.762 -12.276   1.101
  789   1HB   GLU  96          1HB       GLU  96   9.068 -11.324   1.398
  790   2HB   GLU  96          2HB       GLU  96   8.814 -12.427   0.044
  791   1HG   GLU  96          1HG       GLU  96   8.844 -10.607  -1.566
  792   2HG   GLU  96          2HG       GLU  96   8.877  -9.393  -0.281
  793    HE2  GLU  96           HE       GLU  96  12.216 -11.576  -1.056
  794    H    ASP  97           H        ASP  97   5.038 -11.250   2.179
  795    HA   ASP  97           HA       ASP  97   4.083  -9.815   3.667
  796   1HB   ASP  97          1HB       ASP  97   6.675  -8.231   3.788
  797   2HB   ASP  97          2HB       ASP  97   5.336  -8.228   4.933
  798    HD2  ASP  97           HD       ASP  97   8.078 -11.135   5.135
  799    H    PHE  98           H        PHE  98   4.280  -6.995   3.817
  800    HA   PHE  98           HA       PHE  98   3.505  -6.108   1.086
  801   1HB   PHE  98          1HB       PHE  98   1.623  -6.954   2.583
  802   2HB   PHE  98          2HB       PHE  98   1.883  -5.543   3.579
  803    HD1  PHE  98           1HD      PHE  98  -0.687  -6.161   2.573
  804    HD2  PHE  98           2HD      PHE  98   2.443  -3.955   0.612
  805    HE1  PHE  98           1HE      PHE  98  -2.386  -4.819   1.350
  806    HE2  PHE  98           2HE      PHE  98   0.762  -2.667  -0.627
  807    HZ   PHE  98           HZ       PHE  98  -1.657  -3.038  -0.221
  808    H    GLU  99           H        GLU  99   5.075  -4.564   0.732
  809    HA   GLU  99           HA       GLU  99   5.464  -2.432   2.797
  810   1HB   GLU  99          1HB       GLU  99   7.342  -3.875   2.304
  811   2HB   GLU  99          2HB       GLU  99   7.318  -3.374   0.630
  812   1HG   GLU  99          1HG       GLU  99   7.871  -1.076   1.247
  813   2HG   GLU  99          2HG       GLU  99   7.557  -1.408   2.958
  814    HE2  GLU  99           HE       GLU  99  10.996  -2.724   1.205
  815    H    THR 100           H        THR 100   5.833  -0.264   1.950
  816    HA   THR 100           HA       THR 100   4.351   0.363  -0.521
  817    HB   THR 100           HB       THR 100   3.487   2.069   0.483
  818    HG1  THR 100           1HG      THR 100   4.656   3.514   1.821
  819   1HG2  THR 100          1HG2      THR 100   3.218   1.941   2.888
  820   2HG2  THR 100          2HG2      THR 100   3.306   0.290   2.255
  821   3HG2  THR 100          3HG2      THR 100   4.709   1.006   3.073
  822    H    TYR 101           H        TYR 101   5.259   1.521  -2.218
  823    HA   TYR 101           HA       TYR 101   8.044   1.834  -2.599
  824   1HB   TYR 101          1HB       TYR 101   5.644   2.420  -3.983
  825   2HB   TYR 101          2HB       TYR 101   6.451   3.961  -3.877
  826    HD1  TYR 101           1HD      TYR 101   6.957   4.289  -6.190
  827    HD2  TYR 101           2HD      TYR 101   7.817   0.488  -4.389
  828    HE1  TYR 101           1HE      TYR 101   8.139   3.589  -8.241
  829    HE2  TYR 101           2HE      TYR 101   9.138  -0.167  -6.387
  830    HH   TYR 101           HH       TYR 101   9.755   0.404  -8.528
  Start of MODEL    2
    1   1H    GLY  -1          1H        GLY  -1 -15.592 -57.838  -0.020
    2   2H    GLY  -1          2H        GLY  -1 -13.982 -57.473  -0.106
    3   3H    GLY  -1          3H        GLY  -1 -14.718 -57.581   1.359
    4   1HA   GLY  -1          1HA       GLY  -1 -15.304 -55.576  -0.698
    5   2HA   GLY  -1          2HA       GLY  -1 -16.078 -55.689   0.895
    6    H    SER   0           H        SER   0 -15.199 -53.346   0.837
    7    HA   SER   0           HA       SER   0 -12.853 -53.248   2.536
    8   1HB   SER   0          1HB       SER   0 -11.628 -51.614   1.126
    9   2HB   SER   0          2HB       SER   0 -11.737 -53.197   0.340
   10    HG   SER   0           HG       SER   0 -13.516 -52.364  -0.860
   11    H    MET   1           H        MET   1 -12.659 -51.188   3.576
   12    HA   MET   1           HA       MET   1 -14.650 -49.105   3.165
   13   1HB   MET   1          1HB       MET   1 -15.678 -49.374   5.421
   14   2HB   MET   1          2HB       MET   1 -16.067 -50.679   4.305
   15   1HG   MET   1          1HG       MET   1 -14.374 -52.140   5.382
   16   2HG   MET   1          2HG       MET   1 -13.944 -50.832   6.483
   17   1HE   MET   1          1HE       MET   1 -17.491 -52.304   5.250
   18   2HE   MET   1          2HE       MET   1 -17.777 -53.384   6.627
   19   3HE   MET   1          3HE       MET   1 -16.379 -53.659   5.562
   20    H    LYS   2           H        LYS   2 -11.951 -49.009   2.920
   21    HA   LYS   2           HA       LYS   2 -10.985 -47.574   5.363
   22   1HB   LYS   2          1HB       LYS   2  -8.739 -48.338   4.730
   23   2HB   LYS   2          2HB       LYS   2  -9.827 -49.671   5.122
   24   1HG   LYS   2          1HG       LYS   2 -10.118 -50.255   2.795
   25   2HG   LYS   2          2HG       LYS   2  -9.283 -48.784   2.257
   26   1HD   LYS   2          1HD       LYS   2  -7.182 -49.583   3.284
   27   2HD   LYS   2          2HD       LYS   2  -8.017 -51.021   3.895
   28   1HE   LYS   2          1HE       LYS   2  -6.765 -51.594   1.885
   29   2HE   LYS   2          2HE       LYS   2  -8.503 -51.732   1.558
   30   1HZ   LYS   2          1HZ       LYS   2  -7.444 -50.552  -0.228
   31   2HZ   LYS   2          2HZ       LYS   2  -6.877 -49.372   0.840
   32    H    LYS   3           H        LYS   3 -12.526 -46.364   3.200
   33    HA   LYS   3           HA       LYS   3 -10.542 -44.757   1.726
   34   1HB   LYS   3          1HB       LYS   3 -12.377 -43.777   0.580
   35   2HB   LYS   3          2HB       LYS   3 -12.560 -45.528   0.605
   36   1HG   LYS   3          1HG       LYS   3 -14.702 -45.005   1.102
   37   2HG   LYS   3          2HG       LYS   3 -14.097 -44.964   2.761
   38   1HD   LYS   3          1HD       LYS   3 -13.766 -42.439   2.453
   39   2HD   LYS   3          2HD       LYS   3 -14.500 -42.607   0.852
   40   1HE   LYS   3          1HE       LYS   3 -16.571 -43.503   1.903
   41   2HE   LYS   3          2HE       LYS   3 -15.826 -43.326   3.507
   42   1HZ   LYS   3          1HZ       LYS   3 -17.153 -41.403   3.035
   43   2HZ   LYS   3          2HZ       LYS   3 -16.256 -41.081   1.640
   44    H    TRP   4           H        TRP   4  -9.801 -42.847   2.452
   45    HA   TRP   4           HA       TRP   4 -11.107 -41.514   4.789
   46   1HB   TRP   4          1HB       TRP   4  -8.160 -42.142   4.474
   47   2HB   TRP   4          2HB       TRP   4  -8.934 -41.313   5.828
   48    HD1  TRP   4           HD       TRP   4  -7.569 -44.519   5.007
   49    HE1  TRP   4           1HE      TRP   4  -8.511 -46.443   6.449
   50    HE3  TRP   4           3HE      TRP   4 -11.658 -42.154   7.010
   51    HZ2  TRP   4           2HZ      TRP   4 -10.734 -46.903   8.176
   52    HZ3  TRP   4           3HZ      TRP   4 -13.177 -43.377   8.523
   53    HH2  TRP   4           HH       TRP   4 -12.731 -45.747   9.115
   54    H    SER   5           H        SER   5 -11.941 -40.170   3.035
   55    HA   SER   5           HA       SER   5  -9.999 -38.071   2.160
   56   1HB   SER   5          1HB       SER   5 -11.416 -37.796   0.156
   57   2HB   SER   5          2HB       SER   5 -10.681 -39.406   0.236
   58    HG   SER   5           HG       SER   5 -12.674 -40.173   1.079
   59    H    ASP   6           H        ASP   6 -10.861 -35.928   2.099
   60    HA   ASP   6           HA       ASP   6 -13.498 -35.340   3.040
   61   1HB   ASP   6          1HB       ASP   6 -12.507 -35.885   5.226
   62   2HB   ASP   6          2HB       ASP   6 -11.140 -34.809   4.913
   63    HD2  ASP   6           HD       ASP   6 -14.804 -33.130   5.574
   64    H    THR   7           H        THR   7 -10.216 -33.853   3.106
   65    HA   THR   7           HA       THR   7 -11.001 -31.900   1.032
   66    HB   THR   7           HB       THR   7  -9.959 -30.076   2.439
   67    HG1  THR   7           1HG      THR   7  -9.911 -30.516   4.702
   68   1HG2  THR   7          1HG2      THR   7 -11.906 -29.593   3.767
   69   2HG2  THR   7          2HG2      THR   7 -12.435 -30.314   2.236
   70   3HG2  THR   7          3HG2      THR   7 -12.437 -31.283   3.727
   71    H    GLU   8           H        GLU   8  -9.002 -30.591   0.427
   72    HA   GLU   8           HA       GLU   8  -6.456 -32.089   0.688
   73   1HB   GLU   8          1HB       GLU   8  -7.663 -31.152  -1.956
   74   2HB   GLU   8          2HB       GLU   8  -6.064 -31.878  -1.723
   75   1HG   GLU   8          1HG       GLU   8  -7.165 -33.976  -0.910
   76   2HG   GLU   8          2HG       GLU   8  -8.749 -33.251  -1.249
   77    HE2  GLU   8           HE       GLU   8  -6.359 -34.314  -4.359
   78    H    VAL   9           H        VAL   9  -4.638 -30.734  -0.112
   79    HA   VAL   9           HA       VAL   9  -5.107 -27.810   0.247
   80    HB   VAL   9           HB       VAL   9  -3.991 -28.724   2.179
   81   1HG1  VAL   9          1HG1      VAL   9  -1.734 -29.681   0.364
   82   2HG1  VAL   9          2HG1      VAL   9  -1.791 -29.740   2.130
   83   3HG1  VAL   9          3HG1      VAL   9  -2.905 -30.738   1.186
   84   1HG2  VAL   9          1HG2      VAL   9  -2.043 -27.156   0.438
   85   2HG2  VAL   9          2HG2      VAL   9  -3.389 -26.465   1.372
   86   3HG2  VAL   9          3HG2      VAL   9  -2.043 -27.260   2.209
   87    H    PHE  10           H        PHE  10  -4.669 -26.660  -1.520
   88    HA   PHE  10           HA       PHE  10  -2.691 -27.624  -3.521
   89   1HB   PHE  10          1HB       PHE  10  -4.462 -26.894  -5.241
   90   2HB   PHE  10          2HB       PHE  10  -4.540 -28.461  -4.481
   91    HD1  PHE  10           1HD      PHE  10  -6.450 -25.434  -5.103
   92    HD2  PHE  10           2HD      PHE  10  -6.182 -29.006  -2.697
   93    HE1  PHE  10           1HE      PHE  10  -8.787 -25.134  -4.395
   94    HE2  PHE  10           2HE      PHE  10  -8.539 -28.701  -2.004
   95    HZ   PHE  10           HZ       PHE  10  -9.842 -26.757  -2.834
   96    H    GLU  11           H        GLU  11  -4.822 -24.952  -4.140
   97    HA   GLU  11           HA       GLU  11  -2.769 -22.950  -3.343
   98   1HB   GLU  11          1HB       GLU  11  -3.636 -21.586  -5.219
   99   2HB   GLU  11          2HB       GLU  11  -2.585 -22.926  -5.645
  100   1HG   GLU  11          1HG       GLU  11  -5.626 -23.141  -5.779
  101   2HG   GLU  11          2HG       GLU  11  -4.668 -22.443  -7.085
  102    HE2  GLU  11           HE       GLU  11  -5.207 -25.940  -7.921
  103    H    MET  12           H        MET  12  -3.574 -21.261  -2.164
  104    HA   MET  12           HA       MET  12  -6.502 -20.892  -1.881
  105   1HB   MET  12          1HB       MET  12  -4.639 -21.156   0.509
  106   2HB   MET  12          2HB       MET  12  -6.376 -20.848   0.529
  107   1HG   MET  12          1HG       MET  12  -6.741 -23.086  -0.572
  108   2HG   MET  12          2HG       MET  12  -5.006 -23.393  -0.417
  109   1HE   MET  12          1HE       MET  12  -7.884 -22.017   2.031
  110   2HE   MET  12          2HE       MET  12  -8.122 -23.518   2.950
  111   3HE   MET  12          3HE       MET  12  -8.451 -23.487   1.204
  112    H    LEU  13           H        LEU  13  -7.090 -18.893  -1.247
  113    HA   LEU  13           HA       LEU  13  -7.223 -16.761  -1.314
  114   1HB   LEU  13          1HB       LEU  13  -6.244 -15.571   0.296
  115   2HB   LEU  13          2HB       LEU  13  -5.929 -17.213   0.808
  116    HG   LEU  13           HG       LEU  13  -3.547 -16.902  -0.195
  117   1HD1  LEU  13          1HD1      LEU  13  -2.829 -14.485  -0.066
  118   2HD1  LEU  13          2HD1      LEU  13  -3.826 -14.822  -1.478
  119   3HD1  LEU  13          3HD1      LEU  13  -4.543 -14.020  -0.066
  120   1HD2  LEU  13          1HD2      LEU  13  -2.837 -15.771   1.895
  121   2HD2  LEU  13          2HD2      LEU  13  -4.517 -15.276   2.193
  122   3HD2  LEU  13          3HD2      LEU  13  -4.073 -16.999   2.209
  123    H    LYS  14           H        LYS  14  -6.890 -14.863  -2.382
  124    HA   LYS  14           HA       LYS  14  -5.171 -15.124  -4.818
  125   1HB   LYS  14          1HB       LYS  14  -7.038 -14.387  -6.092
  126   2HB   LYS  14          2HB       LYS  14  -7.477 -15.778  -5.110
  127   1HG   LYS  14          1HG       LYS  14  -9.302 -14.505  -4.670
  128   2HG   LYS  14          2HG       LYS  14  -8.261 -13.860  -3.399
  129   1HD   LYS  14          1HD       LYS  14  -7.606 -12.180  -5.443
  130   2HD   LYS  14          2HD       LYS  14  -9.214 -12.646  -5.956
  131   1HE   LYS  14          1HE       LYS  14  -9.416 -10.641  -4.632
  132   2HE   LYS  14          2HE       LYS  14 -10.038 -11.997  -3.656
  133   1HZ   LYS  14          1HZ       LYS  14  -8.576 -10.642  -2.330
  134   2HZ   LYS  14          2HZ       LYS  14  -7.299 -10.926  -3.399
  135    H    ARG  15           H        ARG  15  -5.102 -12.986  -6.038
  136    HA   ARG  15           HA       ARG  15  -4.406 -10.809  -4.157
  137   1HB   ARG  15          1HB       ARG  15  -3.035  -9.848  -5.681
  138   2HB   ARG  15          2HB       ARG  15  -2.709 -11.582  -5.691
  139   1HG   ARG  15          1HG       ARG  15  -4.088 -11.747  -7.786
  140   2HG   ARG  15          2HG       ARG  15  -4.258  -9.984  -7.795
  141   1HD   ARG  15          1HD       ARG  15  -2.041  -9.561  -8.251
  142   2HD   ARG  15          2HD       ARG  15  -1.484 -11.136  -7.664
  143    HE   ARG  15           HE       ARG  15  -3.196 -11.675  -9.806
  144   1HH1  ARG  15          2HH1      ARG  15  -0.052 -10.104  -9.328
  145   2HH1  ARG  15          1HH1      ARG  15   0.592 -10.668 -10.849
  146   1HH2  ARG  15          1HH2      ARG  15  -2.361 -12.406 -11.762
  147   2HH2  ARG  15          2HH2      ARG  15  -0.740 -11.985 -12.259
  148    H    MET  16           H        MET  16  -5.695  -9.114  -3.897
  149    HA   MET  16           HA       MET  16  -7.688  -8.123  -5.822
  150   1HB   MET  16          1HB       MET  16  -7.871  -7.706  -3.459
  151   2HB   MET  16          2HB       MET  16  -6.330  -6.832  -3.462
  152   1HG   MET  16          1HG       MET  16  -7.401  -5.162  -5.044
  153   2HG   MET  16          2HG       MET  16  -8.904  -6.092  -4.933
  154   1HE   MET  16          1HE       MET  16  -6.052  -4.852  -2.630
  155   2HE   MET  16          2HE       MET  16  -6.850  -3.597  -1.665
  156   3HE   MET  16          3HE       MET  16  -6.601  -3.375  -3.420
  157    H    TYR  17           H        TYR  17  -7.293  -6.215  -6.992
  158    HA   TYR  17           HA       TYR  17  -4.607  -5.100  -7.168
  159   1HB   TYR  17          1HB       TYR  17  -4.279  -6.652  -8.936
  160   2HB   TYR  17          2HB       TYR  17  -5.920  -6.458  -9.523
  161    HD1  TYR  17           1HD      TYR  17  -3.366  -3.785  -8.704
  162    HD2  TYR  17           2HD      TYR  17  -5.721  -5.743 -11.748
  163    HE1  TYR  17           1HE      TYR  17  -3.031  -1.862 -10.215
  164    HE2  TYR  17           2HE      TYR  17  -5.362  -3.818 -13.257
  165    HH   TYR  17           HH       TYR  17  -4.455  -1.715 -13.489
  166    H    ALA  18           H        ALA  18  -5.322  -3.249  -6.298
  167    HA   ALA  18           HA       ALA  18  -7.587  -1.853  -7.631
  168   1HB   ALA  18          1HB       ALA  18  -7.984  -0.706  -5.580
  169   2HB   ALA  18          2HB       ALA  18  -8.051  -2.463  -5.328
  170   3HB   ALA  18          3HB       ALA  18  -6.613  -1.534  -4.803
  171    H    ARG  19           H        ARG  19  -6.970  -0.376  -8.927
  172    HA   ARG  19           HA       ARG  19  -4.435   1.070  -8.624
  173   1HB   ARG  19          1HB       ARG  19  -5.125   0.046 -10.787
  174   2HB   ARG  19          2HB       ARG  19  -6.519   1.132 -10.836
  175   1HG   ARG  19          1HG       ARG  19  -4.807   2.029 -12.223
  176   2HG   ARG  19          2HG       ARG  19  -4.918   3.085 -10.803
  177   1HD   ARG  19          1HD       ARG  19  -2.912   2.008  -9.850
  178   2HD   ARG  19          2HD       ARG  19  -2.898   0.838 -11.183
  179    HE   ARG  19           HE       ARG  19  -2.711   3.802 -11.575
  180   1HH1  ARG  19          1HH1      ARG  19  -1.165   0.631 -12.150
  181   2HH1  ARG  19          2HH1      ARG  19   0.026   1.307 -13.228
  182   1HH2  ARG  19          1HH2      ARG  19  -1.161   4.621 -12.930
  183   2HH2  ARG  19          2HH2      ARG  19   0.045   3.592 -13.671
  184    H    VAL  20           H        VAL  20  -4.589   2.832  -7.228
  185    HA   VAL  20           HA       VAL  20  -7.215   4.120  -6.836
  186    HB   VAL  20           HB       VAL  20  -4.648   4.604  -5.317
  187   1HG1  VAL  20          1HG1      VAL  20  -7.574   4.947  -4.520
  188   2HG1  VAL  20          2HG1      VAL  20  -6.143   5.438  -3.593
  189   3HG1  VAL  20          3HG1      VAL  20  -6.554   6.267  -5.105
  190   1HG2  VAL  20          1HG2      VAL  20  -6.821   2.515  -4.872
  191   2HG2  VAL  20          2HG2      VAL  20  -5.082   2.224  -5.098
  192   3HG2  VAL  20          3HG2      VAL  20  -5.666   3.016  -3.633
  193    H    TYR  21           H        TYR  21  -7.685   5.675  -8.272
  194    HA   TYR  21           HA       TYR  21  -5.564   7.449  -9.362
  195   1HB   TYR  21          1HB       TYR  21  -8.489   7.141 -10.123
  196   2HB   TYR  21          2HB       TYR  21  -7.373   8.241 -10.848
  197    HD1  TYR  21           1HD      TYR  21  -5.607   7.473 -12.379
  198    HD2  TYR  21           2HD      TYR  21  -8.317   4.663 -10.542
  199    HE1  TYR  21           1HE      TYR  21  -4.966   5.750 -14.036
  200    HE2  TYR  21           2HE      TYR  21  -7.694   2.967 -12.207
  201    HH   TYR  21           HH       TYR  21  -6.525   2.530 -14.153
  202    H    GLY  22           H        GLY  22  -5.621   9.665  -9.143
  203   1HA   GLY  22          1HA       GLY  22  -7.331  11.531  -8.543
  204   2HA   GLY  22          2HA       GLY  22  -7.244  10.764  -6.935
  205    H    LEU  23           H        LEU  23  -6.516  12.912  -6.294
  206    HA   LEU  23           HA       LEU  23  -3.693  13.513  -6.817
  207   1HB   LEU  23          1HB       LEU  23  -5.572  15.203  -6.454
  208   2HB   LEU  23          2HB       LEU  23  -5.499  14.767  -4.745
  209    HG   LEU  23           HG       LEU  23  -2.956  15.413  -4.928
  210   1HD1  LEU  23          1HD1      LEU  23  -2.440  17.052  -6.693
  211   2HD1  LEU  23          2HD1      LEU  23  -2.808  15.478  -7.406
  212   3HD1  LEU  23          3HD1      LEU  23  -4.025  16.772  -7.443
  213   1HD2  LEU  23          1HD2      LEU  23  -3.489  17.796  -4.597
  214   2HD2  LEU  23          2HD2      LEU  23  -5.118  17.533  -5.258
  215   3HD2  LEU  23          3HD2      LEU  23  -4.636  16.758  -3.732
  216    H    VAL  24           H        VAL  24  -4.740  10.920  -5.569
  217    HA   VAL  24           HA       VAL  24  -4.006  10.809  -2.825
  218    HB   VAL  24           HB       VAL  24  -4.089   8.372  -3.154
  219   1HG1  VAL  24          1HG1      VAL  24  -6.387   9.880  -4.488
  220   2HG1  VAL  24          2HG1      VAL  24  -6.465   8.267  -3.751
  221   3HG1  VAL  24          3HG1      VAL  24  -6.144   9.686  -2.746
  222   1HG2  VAL  24          1HG2      VAL  24  -4.723   8.943  -6.086
  223   2HG2  VAL  24          2HG2      VAL  24  -3.137   8.389  -5.516
  224   3HG2  VAL  24          3HG2      VAL  24  -4.563   7.375  -5.274
  225    H    GLN  25           H        GLN  25  -2.016  11.018  -5.607
  226    HA   GLN  25           HA       GLN  25   0.311   9.668  -4.643
  227   1HB   GLN  25          1HB       GLN  25  -0.475  11.182  -6.964
  228   2HB   GLN  25          2HB       GLN  25   1.001  11.892  -6.309
  229   1HG   GLN  25          1HG       GLN  25   1.582  10.192  -7.874
  230   2HG   GLN  25          2HG       GLN  25   2.078   9.677  -6.264
  231   1HE2  GLN  25          1HE2      GLN  25   2.164   7.679  -7.761
  232   2HE2  GLN  25          2HE2      GLN  25   0.747   6.647  -7.809
  233    H    GLY  26           H        GLY  26   1.406  10.180  -2.873
  234   1HA   GLY  26          1HA       GLY  26   2.625  11.347  -1.356
  235   2HA   GLY  26          2HA       GLY  26   2.545  12.741  -2.441
  236    H    VAL  27           H        VAL  27  -0.003  10.966  -0.597
  237    HA   VAL  27           HA       VAL  27  -0.182  13.189   1.340
  238    HB   VAL  27           HB       VAL  27  -2.576  13.276   1.323
  239   1HG1  VAL  27          1HG1      VAL  27  -1.648  13.655  -1.545
  240   2HG1  VAL  27          2HG1      VAL  27  -3.022  14.427  -0.737
  241   3HG1  VAL  27          3HG1      VAL  27  -1.376  14.802  -0.212
  242   1HG2  VAL  27          1HG2      VAL  27  -2.654  11.453  -1.093
  243   2HG2  VAL  27          2HG2      VAL  27  -3.000  10.879   0.552
  244   3HG2  VAL  27          3HG2      VAL  27  -4.015  12.111  -0.164
  245    H    GLY  28           H        GLY  28  -2.135  12.203   2.938
  246   1HA   GLY  28          1HA       GLY  28  -0.944   9.981   4.311
  247   2HA   GLY  28          2HA       GLY  28  -2.511  10.737   4.634
  248    H    PHE  29           H        PHE  29  -0.840   8.475   2.456
  249    HA   PHE  29           HA       PHE  29  -2.989   6.552   2.576
  250   1HB   PHE  29          1HB       PHE  29  -3.678   8.185   0.736
  251   2HB   PHE  29          2HB       PHE  29  -2.218   7.737  -0.122
  252    HD1  PHE  29           1HD      PHE  29  -2.645   6.299  -1.920
  253    HD2  PHE  29           2HD      PHE  29  -4.984   5.831   1.669
  254    HE1  PHE  29           1HE      PHE  29  -3.524   4.131  -2.761
  255    HE2  PHE  29           2HE      PHE  29  -5.917   3.719   0.780
  256    HZ   PHE  29           HZ       PHE  29  -5.134   2.827  -1.385
  257    H    ARG  30           H        ARG  30  -2.208   4.751   0.726
  258    HA   ARG  30           HA       ARG  30  -0.728   3.267   0.013
  259   1HB   ARG  30          1HB       ARG  30   0.598   5.209  -0.823
  260   2HB   ARG  30          2HB       ARG  30   1.510   5.225   0.688
  261   1HG   ARG  30          1HG       ARG  30   2.075   2.740   0.185
  262   2HG   ARG  30          2HG       ARG  30   1.416   3.063  -1.429
  263   1HD   ARG  30          1HD       ARG  30   3.781   3.388  -1.554
  264   2HD   ARG  30          2HD       ARG  30   3.039   5.002  -1.601
  265    HE   ARG  30           HE       ARG  30   3.562   4.515   1.083
  266   1HH1  ARG  30          1HH1      ARG  30   5.568   4.628  -1.863
  267   2HH1  ARG  30          2HH1      ARG  30   6.916   5.368  -1.055
  268   1HH2  ARG  30          1HH2      ARG  30   5.381   5.419   2.134
  269   2HH2  ARG  30          2HH2      ARG  30   6.830   5.772   1.229
  270    H    LYS  31           H        LYS  31   0.974   4.822   2.729
  271    HA   LYS  31           HA       LYS  31   1.751   2.383   4.034
  272   1HB   LYS  31          1HB       LYS  31   2.810   4.712   4.251
  273   2HB   LYS  31          2HB       LYS  31   1.397   5.194   5.184
  274   1HG   LYS  31          1HG       LYS  31   1.885   3.447   6.877
  275   2HG   LYS  31          2HG       LYS  31   3.295   2.921   5.933
  276   1HD   LYS  31          1HD       LYS  31   4.340   5.132   6.233
  277   2HD   LYS  31          2HD       LYS  31   2.904   5.713   7.106
  278   1HE   LYS  31          1HE       LYS  31   3.270   4.031   8.874
  279   2HE   LYS  31          2HE       LYS  31   4.683   3.397   8.003
  280   1HZ   LYS  31          1HZ       LYS  31   5.397   4.953   9.666
  281   2HZ   LYS  31          2HZ       LYS  31   4.468   6.177   8.966
  282    H    PHE  32           H        PHE  32  -0.954   4.674   4.305
  283    HA   PHE  32           HA       PHE  32  -2.362   3.757   6.458
  284   1HB   PHE  32          1HB       PHE  32  -2.953   5.596   4.900
  285   2HB   PHE  32          2HB       PHE  32  -3.559   4.412   3.748
  286    HD1  PHE  32           1HD      PHE  32  -4.529   3.296   7.063
  287    HD2  PHE  32           2HD      PHE  32  -5.442   6.246   4.029
  288    HE1  PHE  32           1HE      PHE  32  -6.729   3.592   8.026
  289    HE2  PHE  32           2HE      PHE  32  -7.622   6.640   5.115
  290    HZ   PHE  32           HZ       PHE  32  -8.306   5.289   7.086
  291    H    VAL  33           H        VAL  33  -2.349   2.261   3.184
  292    HA   VAL  33           HA       VAL  33  -4.237   0.161   3.789
  293    HB   VAL  33           HB       VAL  33  -2.036   0.253   1.672
  294   1HG1  VAL  33          1HG1      VAL  33  -4.526  -1.483   1.887
  295   2HG1  VAL  33          2HG1      VAL  33  -3.427  -1.415   0.498
  296   3HG1  VAL  33          3HG1      VAL  33  -2.846  -2.042   2.035
  297   1HG2  VAL  33          1HG2      VAL  33  -4.984   1.017   1.470
  298   2HG2  VAL  33          2HG2      VAL  33  -3.610   2.145   1.401
  299   3HG2  VAL  33          3HG2      VAL  33  -3.831   0.946   0.122
  300    H    GLN  34           H        GLN  34  -0.780   0.583   4.225
  301    HA   GLN  34           HA       GLN  34  -0.274  -2.199   4.865
  302   1HB   GLN  34          1HB       GLN  34   1.398   0.305   4.930
  303   2HB   GLN  34          2HB       GLN  34   1.890  -1.094   5.885
  304   1HG   GLN  34          1HG       GLN  34   2.934  -1.105   3.679
  305   2HG   GLN  34          2HG       GLN  34   1.886  -2.508   3.922
  306   1HE2  GLN  34          1HE2      GLN  34  -0.108  -2.655   2.818
  307   2HE2  GLN  34          2HE2      GLN  34  -0.490  -1.644   1.437
  308    H    ILE  35           H        ILE  35  -0.652   0.740   6.973
  309    HA   ILE  35           HA       ILE  35  -0.415  -0.434   9.414
  310    HB   ILE  35           HB       ILE  35  -2.698   1.420   8.604
  311   1HG1  ILE  35          1HG1      ILE  35  -0.625   2.508   8.051
  312   2HG1  ILE  35          2HG1      ILE  35  -1.331   3.255   9.469
  313   1HG2  ILE  35          1HG2      ILE  35  -2.651   2.101  11.032
  314   2HG2  ILE  35          2HG2      ILE  35  -3.262   0.476  10.739
  315   3HG2  ILE  35          3HG2      ILE  35  -1.612   0.693  11.348
  316   1HD1  ILE  35          1HD1      ILE  35   1.061   3.053   9.754
  317   2HD1  ILE  35          2HD1      ILE  35   0.269   1.975  10.915
  318   3HD1  ILE  35          3HD1      ILE  35   1.019   1.312   9.440
  319    H    HIS  36           H        HIS  36  -3.449  -0.615   7.495
  320    HA   HIS  36           HA       HIS  36  -4.772  -2.278   9.454
  321   1HB   HIS  36          1HB       HIS  36  -5.381  -1.450   6.610
  322   2HB   HIS  36          2HB       HIS  36  -6.336  -2.681   7.442
  323    HD2  HIS  36           2HD      HIS  36  -5.133   0.883   8.844
  324    HE1  HIS  36           1HE      HIS  36  -9.263   0.320   9.548
  325    HE2  HIS  36           2HE      HIS  36  -7.286   1.899   9.896
  326    H    ALA  37           H        ALA  37  -3.378  -3.032   6.199
  327    HA   ALA  37           HA       ALA  37  -3.687  -5.717   6.189
  328   1HB   ALA  37          1HB       ALA  37  -1.660  -5.830   4.794
  329   2HB   ALA  37          2HB       ALA  37  -2.714  -4.468   4.331
  330   3HB   ALA  37          3HB       ALA  37  -1.228  -4.188   5.273
  331    H    ILE  38           H        ILE  38  -1.061  -4.017   7.809
  332    HA   ILE  38           HA       ILE  38   0.432  -6.354   8.640
  333    HB   ILE  38           HB       ILE  38   0.600  -3.353   8.949
  334   1HG1  ILE  38          1HG1      ILE  38   2.925  -3.745   8.272
  335   2HG1  ILE  38          2HG1      ILE  38   2.700  -5.493   8.388
  336   1HG2  ILE  38          1HG2      ILE  38   2.387  -3.451  10.572
  337   2HG2  ILE  38          2HG2      ILE  38   0.818  -3.878  11.243
  338   3HG2  ILE  38          3HG2      ILE  38   2.009  -5.161  10.891
  339   1HD1  ILE  38          1HD1      ILE  38   2.678  -4.700   6.049
  340   2HD1  ILE  38          2HD1      ILE  38   1.119  -5.417   6.460
  341   3HD1  ILE  38          3HD1      ILE  38   1.304  -3.653   6.386
  342    H    ARG  39           H        ARG  39  -1.783  -4.024  10.265
  343    HA   ARG  39           HA       ARG  39  -1.778  -5.062  12.777
  344   1HB   ARG  39          1HB       ARG  39  -2.741  -3.023  12.107
  345   2HB   ARG  39          2HB       ARG  39  -4.095  -3.824  11.296
  346   1HG   ARG  39          1HG       ARG  39  -3.506  -4.416  14.193
  347   2HG   ARG  39          2HG       ARG  39  -4.186  -2.836  13.756
  348   1HD   ARG  39          1HD       ARG  39  -6.117  -3.895  12.665
  349   2HD   ARG  39          2HD       ARG  39  -5.442  -5.493  12.984
  350    HE   ARG  39           HE       ARG  39  -6.144  -5.452  15.134
  351   1HH1  ARG  39          1HH1      ARG  39  -6.415  -2.149  13.851
  352   2HH1  ARG  39          2HH1      ARG  39  -7.325  -1.562  15.219
  353   1HH2  ARG  39          1HH2      ARG  39  -7.329  -4.665  16.916
  354   2HH2  ARG  39          2HH2      ARG  39  -7.840  -2.999  16.972
  355    H    LEU  40           H        LEU  40  -3.718  -6.071   9.990
  356    HA   LEU  40           HA       LEU  40  -5.303  -8.014  11.487
  357   1HB   LEU  40          1HB       LEU  40  -5.369  -7.077   8.622
  358   2HB   LEU  40          2HB       LEU  40  -6.552  -8.148   9.381
  359    HG   LEU  40           HG       LEU  40  -5.949  -5.345  10.450
  360   1HD1  LEU  40          1HD1      LEU  40  -7.958  -4.617   9.274
  361   2HD1  LEU  40          2HD1      LEU  40  -6.707  -5.179   8.146
  362   3HD1  LEU  40          3HD1      LEU  40  -8.096  -6.225   8.513
  363   1HD2  LEU  40          1HD2      LEU  40  -8.112  -5.535  11.548
  364   2HD2  LEU  40          2HD2      LEU  40  -8.356  -7.160  10.882
  365   3HD2  LEU  40          3HD2      LEU  40  -7.081  -6.865  12.076
  366    H    GLY  41           H        GLY  41  -3.190  -8.078   8.631
  367   1HA   GLY  41          1HA       GLY  41  -1.452  -9.825   8.618
  368   2HA   GLY  41          2HA       GLY  41  -2.685 -11.016   9.023
  369    H    ILE  42           H        ILE  42  -2.061  -8.494   6.525
  370    HA   ILE  42           HA       ILE  42  -2.751 -10.428   4.367
  371    HB   ILE  42           HB       ILE  42  -3.336  -7.471   4.598
  372   1HG1  ILE  42          1HG1      ILE  42  -4.975  -8.901   5.732
  373   2HG1  ILE  42          2HG1      ILE  42  -5.639  -8.038   4.342
  374   1HG2  ILE  42          1HG2      ILE  42  -4.454  -7.782   2.333
  375   2HG2  ILE  42          2HG2      ILE  42  -2.694  -7.683   2.354
  376   3HG2  ILE  42          3HG2      ILE  42  -3.486  -9.257   2.170
  377   1HD1  ILE  42          1HD1      ILE  42  -6.518 -10.306   4.453
  378   2HD1  ILE  42          2HD1      ILE  42  -5.558 -10.091   2.985
  379   3HD1  ILE  42          3HD1      ILE  42  -4.893 -10.996   4.367
  380    H    LYS  43           H        LYS  43  -1.448 -10.321   2.541
  381    HA   LYS  43           HA       LYS  43   1.196  -8.932   2.806
  382   1HB   LYS  43          1HB       LYS  43   0.526 -11.391   1.177
  383   2HB   LYS  43          2HB       LYS  43   2.108 -10.659   1.456
  384   1HG   LYS  43          1HG       LYS  43   1.804 -11.072   3.932
  385   2HG   LYS  43          2HG       LYS  43   0.340 -11.998   3.550
  386   1HD   LYS  43          1HD       LYS  43   1.687 -13.511   2.101
  387   2HD   LYS  43          2HD       LYS  43   3.156 -12.642   2.582
  388   1HE   LYS  43          1HE       LYS  43   1.279 -14.094   4.504
  389   2HE   LYS  43          2HE       LYS  43   2.804 -14.740   3.871
  390   1HZ   LYS  43          1HZ       LYS  43   2.529 -12.347   5.573
  391   2HZ   LYS  43          2HZ       LYS  43   3.976 -12.969   4.960
  392    H    GLY  44           H        GLY  44   2.117  -8.542   0.413
  393   1HA   GLY  44          1HA       GLY  44   0.776  -8.304  -1.897
  394   2HA   GLY  44          2HA       GLY  44   0.049  -6.960  -0.981
  395    H    TYR  45           H        TYR  45   0.843  -5.383  -2.423
  396    HA   TYR  45           HA       TYR  45   3.232  -4.329  -1.437
  397   1HB   TYR  45          1HB       TYR  45   3.978  -6.044  -3.331
  398   2HB   TYR  45          2HB       TYR  45   3.539  -4.720  -4.386
  399    HD1  TYR  45           1HD      TYR  45   4.767  -2.489  -4.142
  400    HD2  TYR  45           2HD      TYR  45   6.046  -6.117  -2.192
  401    HE1  TYR  45           1HE      TYR  45   7.011  -1.505  -3.740
  402    HE2  TYR  45           2HE      TYR  45   8.301  -5.140  -1.869
  403    HH   TYR  45           HH       TYR  45   9.538  -3.176  -1.859
  404    H    ALA  46           H        ALA  46   3.248  -2.178  -1.712
  405    HA   ALA  46           HA       ALA  46   0.879  -0.928  -3.048
  406   1HB   ALA  46          1HB       ALA  46   1.069   0.729  -1.256
  407   2HB   ALA  46          2HB       ALA  46   0.885  -0.915  -0.630
  408   3HB   ALA  46          3HB       ALA  46   2.472  -0.133  -0.598
  409    H    LYS  47           H        LYS  47   1.979  -0.543  -5.108
  410    HA   LYS  47           HA       LYS  47   4.551   0.816  -4.919
  411   1HB   LYS  47          1HB       LYS  47   4.655  -1.107  -6.157
  412   2HB   LYS  47          2HB       LYS  47   3.199  -0.742  -7.056
  413   1HG   LYS  47          1HG       LYS  47   4.334   1.062  -8.284
  414   2HG   LYS  47          2HG       LYS  47   5.818   0.792  -7.365
  415   1HD   LYS  47          1HD       LYS  47   4.475  -1.284  -9.150
  416   2HD   LYS  47          2HD       LYS  47   5.787  -0.207  -9.655
  417   1HE   LYS  47          1HE       LYS  47   7.262  -1.165  -7.888
  418   2HE   LYS  47          2HE       LYS  47   5.982  -2.319  -7.456
  419   1HZ   LYS  47          1HZ       LYS  47   7.460  -3.336  -9.008
  420   2HZ   LYS  47          2HZ       LYS  47   7.165  -2.124 -10.146
  421    H    ASN  48           H        ASN  48   4.432   2.966  -4.687
  422    HA   ASN  48           HA       ASN  48   2.418   4.527  -6.078
  423   1HB   ASN  48          1HB       ASN  48   3.346   5.076  -3.805
  424   2HB   ASN  48          2HB       ASN  48   4.881   5.504  -4.578
  425   1HD2  ASN  48          2HD2      ASN  48   1.868   6.708  -3.556
  426   2HD2  ASN  48          1HD2      ASN  48   1.882   8.206  -4.462
  427    H    LEU  49           H        LEU  49   2.619   5.221  -8.114
  428    HA   LEU  49           HA       LEU  49   5.244   5.393  -9.490
  429   1HB   LEU  49          1HB       LEU  49   2.374   5.526 -10.454
  430   2HB   LEU  49          2HB       LEU  49   3.807   5.565 -11.485
  431    HG   LEU  49           HG       LEU  49   3.125   3.244  -9.612
  432   1HD1  LEU  49          1HD1      LEU  49   2.203   2.087 -11.529
  433   2HD1  LEU  49          2HD1      LEU  49   1.320   3.590 -11.245
  434   3HD1  LEU  49          3HD1      LEU  49   2.498   3.498 -12.574
  435   1HD2  LEU  49          1HD2      LEU  49   4.635   1.955 -11.078
  436   2HD2  LEU  49          2HD2      LEU  49   5.011   3.426 -11.999
  437   3HD2  LEU  49          3HD2      LEU  49   5.492   3.287 -10.293
  438    HA   PRO  50           HA       PRO  50   4.155   9.410  -7.651
  439   1HB   PRO  50          1HB       PRO  50   6.559  10.577  -7.301
  440   2HB   PRO  50          2HB       PRO  50   6.088   9.092  -6.429
  441   1HG   PRO  50          1HG       PRO  50   7.704   9.240  -8.997
  442   2HG   PRO  50          2HG       PRO  50   8.154   8.412  -7.477
  443   1HD   PRO  50          1HD       PRO  50   6.945   7.072  -9.514
  444   2HD   PRO  50          2HD       PRO  50   6.527   6.734  -7.807
  445    H    ASP  51           H        ASP  51   3.017   9.784  -9.615
  446    HA   ASP  51           HA       ASP  51   3.331  12.240 -10.885
  447   1HB   ASP  51          1HB       ASP  51   3.881  11.556 -13.182
  448   2HB   ASP  51          2HB       ASP  51   5.253  11.352 -12.106
  449    HD2  ASP  51           HD       ASP  51   5.368   7.866 -12.481
  450    H    GLY  52           H        GLY  52   2.278   8.826 -11.245
  451   1HA   GLY  52          1HA       GLY  52  -0.290   9.666 -12.483
  452   2HA   GLY  52          2HA       GLY  52   0.479   8.080 -12.550
  453    H    SER  53           H        SER  53  -0.515   6.601 -11.370
  454    HA   SER  53           HA       SER  53  -2.144   7.339  -8.976
  455   1HB   SER  53          1HB       SER  53  -3.664   5.486  -9.945
  456   2HB   SER  53          2HB       SER  53  -3.677   7.093 -10.698
  457    HG   SER  53           HG       SER  53  -2.465   6.364 -12.353
  458    H    VAL  54           H        VAL  54  -1.670   6.187  -7.221
  459    HA   VAL  54           HA       VAL  54   0.403   4.205  -7.259
  460    HB   VAL  54           HB       VAL  54   0.376   5.628  -5.422
  461   1HG1  VAL  54          1HG1      VAL  54  -2.459   4.807  -4.732
  462   2HG1  VAL  54          2HG1      VAL  54  -1.389   5.846  -3.773
  463   3HG1  VAL  54          3HG1      VAL  54  -1.957   6.397  -5.343
  464   1HG2  VAL  54          1HG2      VAL  54  -0.762   3.023  -4.317
  465   2HG2  VAL  54          2HG2      VAL  54   0.895   3.205  -4.907
  466   3HG2  VAL  54          3HG2      VAL  54   0.346   4.150  -3.516
  467    H    GLU  55           H        GLU  55   0.271   2.120  -7.652
  468    HA   GLU  55           HA       GLU  55  -2.354   0.798  -7.744
  469   1HB   GLU  55          1HB       GLU  55  -1.398  -0.792  -9.121
  470   2HB   GLU  55          2HB       GLU  55  -0.709   0.748  -9.624
  471   1HG   GLU  55          1HG       GLU  55   1.156  -0.586  -9.677
  472   2HG   GLU  55          2HG       GLU  55   1.294   0.066  -8.047
  473    HE2  GLU  55           HE       GLU  55   0.260  -3.840  -8.682
  474    H    VAL  56           H        VAL  56  -2.981  -0.785  -6.348
  475    HA   VAL  56           HA       VAL  56  -1.066  -1.729  -4.243
  476    HB   VAL  56           HB       VAL  56  -4.045  -1.184  -4.081
  477   1HG1  VAL  56          1HG1      VAL  56  -2.051  -2.055  -1.954
  478   2HG1  VAL  56          2HG1      VAL  56  -3.773  -1.681  -1.700
  479   3HG1  VAL  56          3HG1      VAL  56  -3.319  -3.100  -2.637
  480   1HG2  VAL  56          1HG2      VAL  56  -1.625   0.249  -2.885
  481   2HG2  VAL  56          2HG2      VAL  56  -2.743   0.913  -4.096
  482   3HG2  VAL  56          3HG2      VAL  56  -3.317   0.576  -2.456
  483    H    VAL  57           H        VAL  57  -0.868  -3.950  -4.090
  484    HA   VAL  57           HA       VAL  57  -2.987  -5.676  -5.282
  485    HB   VAL  57           HB       VAL  57  -1.122  -7.256  -5.938
  486   1HG1  VAL  57          1HG1      VAL  57  -1.358  -4.594  -7.389
  487   2HG1  VAL  57          2HG1      VAL  57  -0.722  -6.101  -8.081
  488   3HG1  VAL  57          3HG1      VAL  57  -2.415  -6.011  -7.575
  489   1HG2  VAL  57          1HG2      VAL  57   0.618  -4.750  -5.799
  490   2HG2  VAL  57          2HG2      VAL  57   0.775  -6.143  -4.705
  491   3HG2  VAL  57          3HG2      VAL  57   1.073  -6.330  -6.437
  492    H    ALA  58           H        ALA  58  -3.799  -5.569  -3.085
  493    HA   ALA  58           HA       ALA  58  -2.335  -6.850  -0.936
  494   1HB   ALA  58          1HB       ALA  58  -4.357  -6.576   0.320
  495   2HB   ALA  58          2HB       ALA  58  -4.148  -5.097  -0.648
  496   3HB   ALA  58          3HB       ALA  58  -5.324  -6.341  -1.138
  497    H    GLU  59           H        GLU  59  -2.694  -8.954  -0.061
  498    HA   GLU  59           HA       GLU  59  -3.909 -10.886  -1.942
  499   1HB   GLU  59          1HB       GLU  59  -1.679 -11.212   0.033
  500   2HB   GLU  59          2HB       GLU  59  -2.373 -12.457  -1.027
  501   1HG   GLU  59          1HG       GLU  59  -1.899 -10.884  -2.996
  502   2HG   GLU  59          2HG       GLU  59  -0.924  -9.935  -1.870
  503    HE2  GLU  59           HE       GLU  59   0.463 -13.284  -3.542
  504    H    GLY  60           H        GLY  60  -6.054 -11.149  -1.171
  505   1HA   GLY  60          1HA       GLY  60  -6.405 -12.053   1.674
  506   2HA   GLY  60          2HA       GLY  60  -7.517 -10.960   0.843
  507    H    TYR  61           H        TYR  61  -8.588 -13.132   1.941
  508    HA   TYR  61           HA       TYR  61  -8.934 -15.254  -0.057
  509   1HB   TYR  61          1HB       TYR  61  -9.812 -14.769   2.789
  510   2HB   TYR  61          2HB       TYR  61 -10.506 -16.057   1.817
  511    HD1  TYR  61           1HD      TYR  61  -9.284 -18.103   1.378
  512    HD2  TYR  61           2HD      TYR  61  -7.428 -14.825   3.486
  513    HE1  TYR  61           1HE      TYR  61  -7.615 -19.655   2.336
  514    HE2  TYR  61           2HE      TYR  61  -5.770 -16.386   4.448
  515    HH   TYR  61           HH       TYR  61  -5.032 -18.568   4.564
  516    H    GLU  62           H        GLU  62 -11.614 -14.181   1.905
  517    HA   GLU  62           HA       GLU  62 -13.024 -12.763  -0.261
  518   1HB   GLU  62          1HB       GLU  62 -13.804 -15.469   0.896
  519   2HB   GLU  62          2HB       GLU  62 -14.931 -14.399   0.044
  520   1HG   GLU  62          1HG       GLU  62 -12.459 -15.785  -1.098
  521   2HG   GLU  62          2HG       GLU  62 -14.142 -16.221  -1.380
  522    HE2  GLU  62           HE       GLU  62 -14.483 -12.949  -3.185
  523    H    GLU  63           H        GLU  63 -14.226 -14.628   2.570
  524    HA   GLU  63           HA       GLU  63 -15.596 -12.770   3.965
  525   1HB   GLU  63          1HB       GLU  63 -13.784 -14.982   4.969
  526   2HB   GLU  63          2HB       GLU  63 -14.926 -14.076   5.973
  527   1HG   GLU  63          1HG       GLU  63 -16.805 -14.836   4.589
  528   2HG   GLU  63          2HG       GLU  63 -15.699 -15.687   3.500
  529    HE2  GLU  63           HE       GLU  63 -16.433 -17.216   7.188
  530    H    ALA  64           H        ALA  64 -12.049 -13.421   4.088
  531    HA   ALA  64           HA       ALA  64 -11.528 -11.233   5.899
  532   1HB   ALA  64          1HB       ALA  64  -9.162 -11.881   5.605
  533   2HB   ALA  64          2HB       ALA  64 -10.163 -13.313   5.920
  534   3HB   ALA  64          3HB       ALA  64  -9.608 -12.955   4.268
  535    H    LEU  65           H        LEU  65 -11.442 -11.708   2.368
  536    HA   LEU  65           HA       LEU  65  -9.889  -9.541   1.599
  537   1HB   LEU  65          1HB       LEU  65 -10.733 -11.030  -0.017
  538   2HB   LEU  65          2HB       LEU  65 -12.397 -10.467   0.245
  539    HG   LEU  65           HG       LEU  65 -11.873  -8.255  -0.534
  540   1HD1  LEU  65          1HD1      LEU  65  -9.643  -7.838  -1.680
  541   2HD1  LEU  65          2HD1      LEU  65  -9.539  -7.900   0.079
  542   3HD1  LEU  65          3HD1      LEU  65  -9.026  -9.300  -0.885
  543   1HD2  LEU  65          1HD2      LEU  65 -11.450  -8.845  -2.886
  544   2HD2  LEU  65          2HD2      LEU  65 -10.907 -10.454  -2.346
  545   3HD2  LEU  65          3HD2      LEU  65 -12.593  -9.963  -2.096
  546    H    SER  66           H        SER  66 -13.452  -9.532   2.008
  547    HA   SER  66           HA       SER  66 -14.114  -6.911   1.769
  548   1HB   SER  66          1HB       SER  66 -16.072  -7.352   3.067
  549   2HB   SER  66          2HB       SER  66 -15.694  -8.761   2.061
  550    HG   SER  66           HG       SER  66 -14.740  -9.703   3.954
  551    H    LYS  67           H        LYS  67 -12.571  -8.367   4.658
  552    HA   LYS  67           HA       LYS  67 -13.206  -6.275   6.462
  553   1HB   LYS  67          1HB       LYS  67 -12.447  -7.793   7.910
  554   2HB   LYS  67          2HB       LYS  67 -12.201  -8.865   6.551
  555   1HG   LYS  67          1HG       LYS  67  -9.794  -7.791   6.414
  556   2HG   LYS  67          2HG       LYS  67 -10.183  -7.210   8.055
  557   1HD   LYS  67          1HD       LYS  67 -10.883  -9.671   8.508
  558   2HD   LYS  67          2HD       LYS  67 -10.115 -10.030   6.948
  559   1HE   LYS  67          1HE       LYS  67  -7.976  -9.075   7.769
  560   2HE   LYS  67          2HE       LYS  67  -8.740  -8.831   9.364
  561   1HZ   LYS  67          1HZ       LYS  67  -7.569 -10.911   9.346
  562   2HZ   LYS  67          2HZ       LYS  67  -8.500 -11.458   8.048
  563    H    LEU  68           H        LEU  68 -10.493  -6.773   4.223
  564    HA   LEU  68           HA       LEU  68  -9.107  -4.312   5.059
  565   1HB   LEU  68          1HB       LEU  68  -7.662  -5.980   4.243
  566   2HB   LEU  68          2HB       LEU  68  -8.725  -6.381   2.890
  567    HG   LEU  68           HG       LEU  68  -8.202  -4.313   1.737
  568   1HD1  LEU  68          1HD1      LEU  68  -6.508  -2.754   2.491
  569   2HD1  LEU  68          2HD1      LEU  68  -7.782  -2.778   3.700
  570   3HD1  LEU  68          3HD1      LEU  68  -6.278  -3.658   4.008
  571   1HD2  LEU  68          1HD2      LEU  68  -5.851  -4.739   1.253
  572   2HD2  LEU  68          2HD2      LEU  68  -5.700  -5.712   2.732
  573   3HD2  LEU  68          3HD2      LEU  68  -6.752  -6.264   1.405
  574    H    LEU  69           H        LEU  69 -10.975  -5.509   2.218
  575    HA   LEU  69           HA       LEU  69 -10.837  -3.436   0.645
  576   1HB   LEU  69          1HB       LEU  69 -12.133  -5.736   0.586
  577   2HB   LEU  69          2HB       LEU  69 -13.540  -4.787   1.042
  578    HG   LEU  69           HG       LEU  69 -13.443  -5.303  -1.267
  579   1HD1  LEU  69          1HD1      LEU  69 -13.805  -3.092  -2.251
  580   2HD1  LEU  69          2HD1      LEU  69 -14.423  -3.100  -0.582
  581   3HD1  LEU  69          3HD1      LEU  69 -12.856  -2.342  -0.955
  582   1HD2  LEU  69          1HD2      LEU  69 -11.759  -4.561  -2.828
  583   2HD2  LEU  69          2HD2      LEU  69 -10.876  -3.699  -1.559
  584   3HD2  LEU  69          3HD2      LEU  69 -10.980  -5.477  -1.523
  585    H    GLU  70           H        GLU  70 -13.411  -3.774   3.123
  586    HA   GLU  70           HA       GLU  70 -14.802  -1.408   2.619
  587   1HB   GLU  70          1HB       GLU  70 -16.008  -1.894   4.618
  588   2HB   GLU  70          2HB       GLU  70 -15.594  -3.429   3.849
  589   1HG   GLU  70          1HG       GLU  70 -13.618  -3.584   5.471
  590   2HG   GLU  70          2HG       GLU  70 -14.262  -2.156   6.285
  591    HE2  GLU  70           HE       GLU  70 -16.332  -5.645   6.547
  592    H    ARG  71           H        ARG  71 -12.011  -1.937   4.767
  593    HA   ARG  71           HA       ARG  71 -11.833   0.430   6.265
  594   1HB   ARG  71          1HB       ARG  71 -10.103  -0.671   6.877
  595   2HB   ARG  71          2HB       ARG  71 -10.090  -1.688   5.475
  596   1HG   ARG  71          1HG       ARG  71  -7.976  -0.651   5.646
  597   2HG   ARG  71          2HG       ARG  71  -8.746   0.046   4.242
  598   1HD   ARG  71          1HD       ARG  71  -9.430   1.593   6.632
  599   2HD   ARG  71          2HD       ARG  71  -7.708   1.336   6.587
  600    HE   ARG  71           HE       ARG  71  -9.258   3.131   5.000
  601   1HH1  ARG  71          1HH1      ARG  71  -6.462   0.982   4.568
  602   2HH1  ARG  71          2HH1      ARG  71  -5.779   1.957   3.288
  603   1HH2  ARG  71          1HH2      ARG  71  -8.308   4.398   3.385
  604   2HH2  ARG  71          2HH2      ARG  71  -6.782   3.939   2.673
  605    H    ILE  72           H        ILE  72 -10.918  -0.088   2.879
  606    HA   ILE  72           HA       ILE  72  -9.878   2.605   2.647
  607    HB   ILE  72           HB       ILE  72 -10.514   0.753   0.333
  608   1HG1  ILE  72          1HG1      ILE  72  -7.912   0.899   1.951
  609   2HG1  ILE  72          2HG1      ILE  72  -9.068  -0.433   2.059
  610   1HG2  ILE  72          1HG2      ILE  72  -8.710   2.046  -0.774
  611   2HG2  ILE  72          2HG2      ILE  72  -9.912   3.171  -0.134
  612   3HG2  ILE  72          3HG2      ILE  72  -8.387   2.920   0.734
  613   1HD1  ILE  72          1HD1      ILE  72  -7.320  -1.155   0.654
  614   2HD1  ILE  72          2HD1      ILE  72  -8.746  -0.894  -0.370
  615   3HD1  ILE  72          3HD1      ILE  72  -7.408   0.287  -0.364
  616    H    LYS  73           H        LYS  73 -12.758   1.138   1.034
  617    HA   LYS  73           HA       LYS  73 -13.865   3.439   0.058
  618   1HB   LYS  73          1HB       LYS  73 -15.288   1.054   1.272
  619   2HB   LYS  73          2HB       LYS  73 -16.118   2.425   0.538
  620   1HG   LYS  73          1HG       LYS  73 -16.015   0.863  -1.146
  621   2HG   LYS  73          2HG       LYS  73 -14.801   2.063  -1.591
  622   1HD   LYS  73          1HD       LYS  73 -13.856  -0.269   0.024
  623   2HD   LYS  73          2HD       LYS  73 -14.485  -0.668  -1.568
  624   1HE   LYS  73          1HE       LYS  73 -12.370   1.498  -1.245
  625   2HE   LYS  73          2HE       LYS  73 -11.951  -0.214  -1.416
  626   1HZ   LYS  73          1HZ       LYS  73 -12.007   0.791  -3.566
  627   2HZ   LYS  73          2HZ       LYS  73 -13.618   1.252  -3.356
  628    H    GLN  74           H        GLN  74 -14.506   2.104   3.350
  629    HA   GLN  74           HA       GLN  74 -15.690   4.663   4.230
  630   1HB   GLN  74          1HB       GLN  74 -16.610   2.191   4.555
  631   2HB   GLN  74          2HB       GLN  74 -15.558   2.197   5.966
  632   1HG   GLN  74          1HG       GLN  74 -17.781   4.187   5.275
  633   2HG   GLN  74          2HG       GLN  74 -17.888   2.892   6.469
  634   1HE2  GLN  74          1HE2      GLN  74 -16.375   3.008   8.369
  635   2HE2  GLN  74          2HE2      GLN  74 -15.951   4.596   8.975
  636    H    GLY  75           H        GLY  75 -13.011   4.876   3.626
  637   1HA   GLY  75          1HA       GLY  75 -12.074   6.239   5.908
  638   2HA   GLY  75          2HA       GLY  75 -11.228   4.691   5.828
  639    HA   PRO  76           HA       PRO  76 -10.421   6.635   1.542
  640   1HB   PRO  76          1HB       PRO  76 -11.202   9.213   0.949
  641   2HB   PRO  76          2HB       PRO  76 -12.298   7.803   0.839
  642   1HG   PRO  76          1HG       PRO  76 -11.979   9.722   3.167
  643   2HG   PRO  76          2HG       PRO  76 -13.496   9.253   2.342
  644   1HD   PRO  76          1HD       PRO  76 -12.712   8.020   4.618
  645   2HD   PRO  76          2HD       PRO  76 -13.422   7.071   3.277
  646    HA   PRO  77           HA       PRO  77  -6.688   8.761   2.692
  647   1HB   PRO  77          1HB       PRO  77  -5.639   9.550   0.294
  648   2HB   PRO  77          2HB       PRO  77  -5.881   7.831   0.732
  649   1HG   PRO  77          1HG       PRO  77  -7.758   9.551  -0.891
  650   2HG   PRO  77          2HG       PRO  77  -7.057   7.959  -1.344
  651   1HD   PRO  77          1HD       PRO  77  -9.504   8.126  -0.223
  652   2HD   PRO  77          2HD       PRO  77  -8.382   6.819   0.252
  653    H    ALA  78           H        ALA  78  -5.487  10.872   2.488
  654    HA   ALA  78           HA       ALA  78  -7.325  13.118   2.799
  655   1HB   ALA  78          1HB       ALA  78  -5.323  14.279   3.615
  656   2HB   ALA  78          2HB       ALA  78  -5.519  12.704   4.406
  657   3HB   ALA  78          3HB       ALA  78  -4.309  12.903   3.120
  658    H    ALA  79           H        ALA  79  -7.495  12.284   0.158
  659    HA   ALA  79           HA       ALA  79  -6.487  14.650  -1.278
  660   1HB   ALA  79          1HB       ALA  79  -5.912  12.999  -3.190
  661   2HB   ALA  79          2HB       ALA  79  -4.747  13.209  -1.881
  662   3HB   ALA  79          3HB       ALA  79  -5.819  11.782  -1.903
  663    H    GLU  80           H        GLU  80  -7.527  14.772  -3.429
  664    HA   GLU  80           HA       GLU  80 -10.318  13.926  -3.488
  665   1HB   GLU  80          1HB       GLU  80  -9.409  16.091  -4.418
  666   2HB   GLU  80          2HB       GLU  80  -8.654  15.173  -5.722
  667   1HG   GLU  80          1HG       GLU  80 -11.636  15.270  -5.042
  668   2HG   GLU  80          2HG       GLU  80 -10.850  16.171  -6.341
  669    HE2  GLU  80           HE       GLU  80 -10.467  13.345  -8.433
  670    H    VAL  81           H        VAL  81 -10.100  11.659  -3.290
  671    HA   VAL  81           HA       VAL  81  -8.651  10.047  -5.191
  672    HB   VAL  81           HB       VAL  81  -9.029   9.365  -2.945
  673   1HG1  VAL  81          1HG1      VAL  81 -11.994   8.950  -3.473
  674   2HG1  VAL  81          2HG1      VAL  81 -11.084   8.596  -2.010
  675   3HG1  VAL  81          3HG1      VAL  81 -11.312  10.275  -2.506
  676   1HG2  VAL  81          1HG2      VAL  81 -10.457   7.496  -4.888
  677   2HG2  VAL  81          2HG2      VAL  81  -8.696   7.683  -4.748
  678   3HG2  VAL  81          3HG2      VAL  81  -9.628   7.041  -3.385
  679    H    GLU  82           H        GLU  82  -9.246  10.937  -7.144
  680    HA   GLU  82           HA       GLU  82 -11.574  11.326  -8.413
  681   1HB   GLU  82          1HB       GLU  82  -9.372  11.592  -9.404
  682   2HB   GLU  82          2HB       GLU  82  -9.162   9.839  -9.519
  683   1HG   GLU  82          1HG       GLU  82 -11.136   9.744 -11.075
  684   2HG   GLU  82          2HG       GLU  82 -11.306  11.500 -10.929
  685    HE2  GLU  82           HE       GLU  82  -8.385   9.880 -13.214
  686    H    LYS  83           H        LYS  83 -10.013   8.048  -8.428
  687    HA   LYS  83           HA       LYS  83 -12.465   6.739  -7.759
  688   1HB   LYS  83          1HB       LYS  83 -12.867   5.502  -9.844
  689   2HB   LYS  83          2HB       LYS  83 -13.058   7.232 -10.118
  690   1HG   LYS  83          1HG       LYS  83 -10.660   7.258 -11.001
  691   2HG   LYS  83          2HG       LYS  83 -10.696   5.483 -10.915
  692   1HD   LYS  83          1HD       LYS  83 -12.648   5.465 -12.444
  693   2HD   LYS  83          2HD       LYS  83 -12.562   7.239 -12.549
  694   1HE   LYS  83          1HE       LYS  83 -10.231   7.062 -13.425
  695   2HE   LYS  83          2HE       LYS  83 -10.343   5.292 -13.348
  696   1HZ   LYS  83          1HZ       LYS  83 -10.882   6.030 -15.550
  697   2HZ   LYS  83          2HZ       LYS  83 -12.146   6.982 -14.961
  698    H    VAL  84           H        VAL  84 -11.935   4.765  -6.821
  699    HA   VAL  84           HA       VAL  84  -9.325   3.538  -7.542
  700    HB   VAL  84           HB       VAL  84  -9.469   3.789  -5.331
  701   1HG1  VAL  84          1HG1      VAL  84 -12.198   2.463  -5.256
  702   2HG1  VAL  84          2HG1      VAL  84 -11.188   2.879  -3.854
  703   3HG1  VAL  84          3HG1      VAL  84 -11.818   4.161  -4.887
  704   1HG2  VAL  84          1HG2      VAL  84 -10.184   0.882  -5.866
  705   2HG2  VAL  84          2HG2      VAL  84  -8.620   1.631  -6.248
  706   3HG2  VAL  84          3HG2      VAL  84  -9.169   1.532  -4.563
  707    H    ASP  85           H        ASP  85  -9.601   2.538  -9.495
  708    HA   ASP  85           HA       ASP  85 -12.115   1.141 -10.162
  709   1HB   ASP  85          1HB       ASP  85 -11.118   2.664 -11.795
  710   2HB   ASP  85          2HB       ASP  85  -9.595   1.770 -11.738
  711    HD2  ASP  85           HD       ASP  85 -12.777  -0.099 -13.468
  712    H    TYR  86           H        TYR  86 -11.863  -0.573  -8.541
  713    HA   TYR  86           HA       TYR  86  -9.427  -2.040  -8.533
  714   1HB   TYR  86          1HB       TYR  86 -10.147  -3.154  -6.695
  715   2HB   TYR  86          2HB       TYR  86 -11.071  -1.671  -6.563
  716    HD1  TYR  86           1HD      TYR  86 -11.170  -5.305  -6.810
  717    HD2  TYR  86           2HD      TYR  86 -13.548  -1.759  -7.449
  718    HE1  TYR  86           1HE      TYR  86 -13.233  -6.658  -6.684
  719    HE2  TYR  86           2HE      TYR  86 -15.608  -3.124  -7.332
  720    HH   TYR  86           HH       TYR  86 -16.497  -5.225  -7.001
  721    H    SER  87           H        SER  87  -9.101  -4.291  -8.852
  722    HA   SER  87           HA       SER  87 -10.956  -5.703 -10.669
  723   1HB   SER  87          1HB       SER  87  -7.987  -5.284 -11.195
  724   2HB   SER  87          2HB       SER  87  -9.087  -6.303 -12.146
  725    HG   SER  87           HG       SER  87 -10.344  -4.276 -12.392
  726    H    PHE  88           H        PHE  88 -11.461  -7.395  -9.444
  727    HA   PHE  88           HA       PHE  88  -9.685  -8.764  -7.603
  728   1HB   PHE  88          1HB       PHE  88 -12.073  -8.730  -7.299
  729   2HB   PHE  88          2HB       PHE  88 -12.355  -9.386  -8.897
  730    HD1  PHE  88           1HD      PHE  88 -11.530 -11.831  -9.375
  731    HD2  PHE  88           2HD      PHE  88 -12.017 -10.149  -5.429
  732    HE1  PHE  88           1HE      PHE  88 -11.628 -14.105  -8.414
  733    HE2  PHE  88           2HE      PHE  88 -12.247 -12.423  -4.499
  734    HZ   PHE  88           HZ       PHE  88 -11.990 -14.414  -5.976
  735    H    SER  89           H        SER  89  -8.118 -10.229  -8.182
  736    HA   SER  89           HA       SER  89  -8.269 -11.597 -10.826
  737   1HB   SER  89          1HB       SER  89  -5.777 -10.375  -9.625
  738   2HB   SER  89          2HB       SER  89  -5.953 -11.126 -11.220
  739    HG   SER  89           HG       SER  89  -7.548  -9.448 -11.639
  740    H    GLU  90           H        GLU  90  -6.114 -13.182 -10.720
  741    HA   GLU  90           HA       GLU  90  -6.253 -14.705  -8.164
  742   1HB   GLU  90          1HB       GLU  90  -5.714 -16.680  -9.252
  743   2HB   GLU  90          2HB       GLU  90  -7.068 -15.984 -10.144
  744   1HG   GLU  90          1HG       GLU  90  -4.122 -15.881 -10.985
  745   2HG   GLU  90          2HG       GLU  90  -5.318 -17.025 -11.565
  746    HE2  GLU  90           HE       GLU  90  -6.908 -14.804 -13.738
  747    H    TYR  91           H        TYR  91  -4.279 -15.181  -7.144
  748    HA   TYR  91           HA       TYR  91  -2.255 -13.263  -7.583
  749   1HB   TYR  91          1HB       TYR  91  -1.270 -14.115  -5.655
  750   2HB   TYR  91          2HB       TYR  91  -3.012 -14.128  -5.405
  751    HD1  TYR  91           1HD      TYR  91  -3.353 -16.963  -7.005
  752    HD2  TYR  91           2HD      TYR  91  -0.977 -15.500  -3.698
  753    HE1  TYR  91           1HE      TYR  91  -3.260 -19.207  -6.094
  754    HE2  TYR  91           2HE      TYR  91  -0.926 -17.780  -2.761
  755    HH   TYR  91           HH       TYR  91  -1.620 -19.955  -2.979
  756    H    LYS  92           H        LYS  92  -0.280 -13.309  -8.410
  757    HA   LYS  92           HA       LYS  92   0.552 -15.396 -10.233
  758   1HB   LYS  92          1HB       LYS  92   1.180 -13.018 -10.536
  759   2HB   LYS  92          2HB       LYS  92   2.010 -13.030  -8.992
  760   1HG   LYS  92          1HG       LYS  92   3.636 -13.187 -10.758
  761   2HG   LYS  92          2HG       LYS  92   3.641 -14.663  -9.807
  762   1HD   LYS  92          1HD       LYS  92   3.927 -15.243 -12.073
  763   2HD   LYS  92          2HD       LYS  92   2.328 -15.817 -11.629
  764   1HE   LYS  92          1HE       LYS  92   2.784 -13.136 -13.037
  765   2HE   LYS  92          2HE       LYS  92   2.692 -14.664 -13.925
  766   1HZ   LYS  92          1HZ       LYS  92   0.534 -13.694 -13.862
  767   2HZ   LYS  92          2HZ       LYS  92   0.525 -13.697 -12.176
  768    H    GLY  93           H        GLY  93   1.667 -14.164  -7.053
  769   1HA   GLY  93          1HA       GLY  93   2.212 -16.771  -5.964
  770   2HA   GLY  93          2HA       GLY  93   3.687 -15.849  -6.354
  771    H    GLU  94           H        GLU  94   3.664 -16.162  -3.830
  772    HA   GLU  94           HA       GLU  94   2.023 -14.233  -2.367
  773   1HB   GLU  94          1HB       GLU  94   2.956 -15.187  -0.384
  774   2HB   GLU  94          2HB       GLU  94   2.217 -16.398  -1.437
  775   1HG   GLU  94          1HG       GLU  94   4.502 -17.068  -2.230
  776   2HG   GLU  94          2HG       GLU  94   5.205 -15.913  -1.080
  777    HE2  GLU  94           HE       GLU  94   5.394 -19.043   0.615
  778    H    PHE  95           H        PHE  95   2.669 -12.216  -2.190
  779    HA   PHE  95           HA       PHE  95   5.406 -11.266  -2.541
  780   1HB   PHE  95          1HB       PHE  95   2.845 -10.021  -1.473
  781   2HB   PHE  95          2HB       PHE  95   4.396  -9.206  -1.476
  782    HD1  PHE  95           1HD      PHE  95   5.592  -8.689  -3.623
  783    HD2  PHE  95           2HD      PHE  95   1.505 -10.057  -3.509
  784    HE1  PHE  95           1HE      PHE  95   5.216  -7.776  -5.897
  785    HE2  PHE  95           2HE      PHE  95   1.136  -9.147  -5.778
  786    HZ   PHE  95           HZ       PHE  95   2.994  -8.014  -6.985
  787    H    GLU  96           H        GLU  96   6.928 -11.066  -0.932
  788    HA   GLU  96           HA       GLU  96   6.486 -12.256   1.621
  789   1HB   GLU  96          1HB       GLU  96   8.805 -11.466   2.107
  790   2HB   GLU  96          2HB       GLU  96   8.599 -12.570   0.746
  791   1HG   GLU  96          1HG       GLU  96   8.882 -10.742  -0.865
  792   2HG   GLU  96          2HG       GLU  96   8.975  -9.556   0.444
  793    HE2  GLU  96           HE       GLU  96  12.087 -12.085  -0.210
  794    H    ASP  97           H        ASP  97   4.824 -11.163   2.643
  795    HA   ASP  97           HA       ASP  97   3.847  -9.649   4.005
  796   1HB   ASP  97          1HB       ASP  97   6.296  -9.423   4.895
  797   2HB   ASP  97          2HB       ASP  97   6.288  -7.867   4.055
  798    HD2  ASP  97           HD       ASP  97   3.991  -8.493   7.352
  799    H    PHE  98           H        PHE  98   4.012  -6.818   3.954
  800    HA   PHE  98           HA       PHE  98   3.067  -6.215   1.193
  801   1HB   PHE  98          1HB       PHE  98   1.400  -6.683   3.140
  802   2HB   PHE  98          2HB       PHE  98   1.791  -5.069   3.680
  803    HD1  PHE  98           1HD      PHE  98   2.070  -3.982   0.626
  804    HD2  PHE  98           2HD      PHE  98  -0.880  -6.241   2.809
  805    HE1  PHE  98           1HE      PHE  98   0.303  -3.132  -0.863
  806    HE2  PHE  98           2HE      PHE  98  -2.666  -5.184   1.467
  807    HZ   PHE  98           HZ       PHE  98  -2.076  -3.753  -0.464
  808    H    GLU  99           H        GLU  99   5.071  -5.224   0.632
  809    HA   GLU  99           HA       GLU  99   5.923  -2.906   2.312
  810   1HB   GLU  99          1HB       GLU  99   7.547  -4.589   2.094
  811   2HB   GLU  99          2HB       GLU  99   7.404  -4.608   0.341
  812   1HG   GLU  99          1HG       GLU  99   8.240  -2.264   0.242
  813   2HG   GLU  99          2HG       GLU  99   8.287  -2.204   2.009
  814    HE2  GLU  99           HE       GLU  99  11.275  -4.106   2.137
  815    H    THR 100           H        THR 100   6.557  -0.966   1.196
  816    HA   THR 100           HA       THR 100   4.735  -0.383  -1.048
  817    HB   THR 100           HB       THR 100   4.229   1.539  -0.055
  818    HG1  THR 100           1HG      THR 100   5.621   2.534   1.539
  819   1HG2  THR 100          1HG2      THR 100   3.777   1.124   2.256
  820   2HG2  THR 100          2HG2      THR 100   3.800  -0.474   1.471
  821   3HG2  THR 100          3HG2      THR 100   5.181   0.061   2.439
  822    H    TYR 101           H        TYR 101   5.366   0.821  -2.837
  823    HA   TYR 101           HA       TYR 101   8.272   1.437  -3.214
  824   1HB   TYR 101          1HB       TYR 101   6.610   0.205  -4.982
  825   2HB   TYR 101          2HB       TYR 101   6.304   1.893  -5.395
  826    HD1  TYR 101           1HD      TYR 101   8.788  -0.820  -5.292
  827    HD2  TYR 101           2HD      TYR 101   7.777   3.088  -6.764
  828    HE1  TYR 101           1HE      TYR 101  10.756  -0.890  -6.811
  829    HE2  TYR 101           2HE      TYR 101   9.752   3.041  -8.271
  830    HH   TYR 101           HH       TYR 101  11.584   1.841  -8.979
  Start of MODEL    3
    1   1H    GLY  -1          1H        GLY  -1  17.774 -51.695  12.821
    2   2H    GLY  -1          2H        GLY  -1  18.223 -50.679  11.595
    3   3H    GLY  -1          3H        GLY  -1  18.179 -50.125  13.142
    4   1HA   GLY  -1          1HA       GLY  -1  15.865 -51.000  11.572
    5   2HA   GLY  -1          2HA       GLY  -1  15.818 -50.410  13.244
    6    H    SER   0           H        SER   0  14.198 -48.999  11.842
    7    HA   SER   0           HA       SER   0  15.356 -46.358  11.711
    8   1HB   SER   0          1HB       SER   0  14.599 -45.892   9.380
    9   2HB   SER   0          2HB       SER   0  15.921 -47.068   9.428
   10    HG   SER   0           HG       SER   0  14.334 -48.717   9.239
   11    H    MET   1           H        MET   1  13.621 -44.734  11.403
   12    HA   MET   1           HA       MET   1  10.902 -45.703  12.173
   13   1HB   MET   1          1HB       MET   1  12.509 -43.452  13.453
   14   2HB   MET   1          2HB       MET   1  10.820 -43.853  13.805
   15   1HG   MET   1          1HG       MET   1  13.230 -45.645  14.310
   16   2HG   MET   1          2HG       MET   1  12.350 -44.710  15.515
   17   1HE   MET   1          1HE       MET   1  13.074 -47.814  15.708
   18   2HE   MET   1          2HE       MET   1  11.570 -48.456  16.404
   19   3HE   MET   1          3HE       MET   1  12.235 -46.919  17.000
   20    H    LYS   2           H        LYS   2   9.654 -45.121  10.529
   21    HA   LYS   2           HA       LYS   2  10.035 -42.471   9.208
   22   1HB   LYS   2          1HB       LYS   2   8.860 -43.456   7.294
   23   2HB   LYS   2          2HB       LYS   2  10.430 -44.164   7.633
   24   1HG   LYS   2          1HG       LYS   2   8.413 -45.769   9.002
   25   2HG   LYS   2          2HG       LYS   2   7.874 -45.445   7.363
   26   1HD   LYS   2          1HD       LYS   2   9.108 -47.483   7.302
   27   2HD   LYS   2          2HD       LYS   2  10.072 -46.250   6.488
   28   1HE   LYS   2          1HE       LYS   2  11.520 -47.615   7.876
   29   2HE   LYS   2          2HE       LYS   2  11.451 -46.001   8.596
   30   1HZ   LYS   2          1HZ       LYS   2  11.143 -47.625  10.304
   31   2HZ   LYS   2          2HZ       LYS   2   9.819 -48.294   9.496
   32    H    LYS   3           H        LYS   3   8.530 -40.996   9.670
   33    HA   LYS   3           HA       LYS   3   6.066 -41.797  11.114
   34   1HB   LYS   3          1HB       LYS   3   7.482 -39.113  10.795
   35   2HB   LYS   3          2HB       LYS   3   5.965 -39.392  11.651
   36   1HG   LYS   3          1HG       LYS   3   7.561 -39.324  13.325
   37   2HG   LYS   3          2HG       LYS   3   7.187 -41.043  13.150
   38   1HD   LYS   3          1HD       LYS   3   9.309 -41.410  11.965
   39   2HD   LYS   3          2HD       LYS   3   9.604 -39.658  11.886
   40   1HE   LYS   3          1HE       LYS   3   9.743 -39.587  14.364
   41   2HE   LYS   3          2HE       LYS   3   9.417 -41.333  14.432
   42   1HZ   LYS   3          1HZ       LYS   3  11.771 -40.958  14.516
   43   2HZ   LYS   3          2HZ       LYS   3  11.732 -40.152  13.032
   44    H    TRP   4           H        TRP   4   7.175 -39.805   8.410
   45    HA   TRP   4           HA       TRP   4   5.926 -38.361   7.047
   46   1HB   TRP   4          1HB       TRP   4   7.182 -40.014   5.908
   47   2HB   TRP   4          2HB       TRP   4   5.961 -41.245   6.191
   48    HD1  TRP   4           HD       TRP   4   6.494 -38.098   4.006
   49    HE1  TRP   4           1HE      TRP   4   5.065 -38.381   1.860
   50    HE3  TRP   4           3HE      TRP   4   4.031 -42.387   5.238
   51    HZ2  TRP   4           2HZ      TRP   4   3.099 -40.226   0.853
   52    HZ3  TRP   4           3HZ      TRP   4   2.370 -43.341   3.768
   53    HH2  TRP   4           HH       TRP   4   1.879 -42.299   1.521
   54    H    SER   5           H        SER   5   4.220 -37.714   8.515
   55    HA   SER   5           HA       SER   5   1.513 -38.718   7.718
   56   1HB   SER   5          1HB       SER   5   0.761 -37.527   9.778
   57   2HB   SER   5          2HB       SER   5   1.833 -38.903  10.083
   58    HG   SER   5           HG       SER   5   3.539 -37.471  10.382
   59    H    ASP   6           H        ASP   6   2.455 -37.546   5.706
   60    HA   ASP   6           HA       ASP   6   2.720 -34.727   5.723
   61   1HB   ASP   6          1HB       ASP   6   2.863 -34.991   3.277
   62   2HB   ASP   6          2HB       ASP   6   3.922 -36.100   4.156
   63    HD2  ASP   6           HD       ASP   6   1.468 -37.609   1.511
   64    H    THR   7           H        THR   7   1.122 -33.256   5.866
   65    HA   THR   7           HA       THR   7  -1.053 -33.301   4.017
   66    HB   THR   7           HB       THR   7  -2.138 -34.763   5.603
   67    HG1  THR   7           1HG      THR   7  -3.930 -33.451   5.985
   68   1HG2  THR   7          1HG2      THR   7  -2.604 -34.144   7.888
   69   2HG2  THR   7          2HG2      THR   7  -0.848 -34.114   7.655
   70   3HG2  THR   7          3HG2      THR   7  -1.765 -32.590   7.703
   71    H    GLU   8           H        GLU   8  -1.740 -31.251   3.596
   72    HA   GLU   8           HA       GLU   8  -1.466 -29.026   5.334
   73   1HB   GLU   8          1HB       GLU   8   0.979 -29.374   4.778
   74   2HB   GLU   8          2HB       GLU   8   0.577 -29.238   3.065
   75   1HG   GLU   8          1HG       GLU   8   1.554 -27.186   3.928
   76   2HG   GLU   8          2HG       GLU   8  -0.103 -26.874   3.418
   77    HE2  GLU   8           HE       GLU   8  -1.228 -26.208   6.695
   78    H    VAL   9           H        VAL   9  -2.477 -27.200   4.413
   79    HA   VAL   9           HA       VAL   9  -3.648 -27.517   1.682
   80    HB   VAL   9           HB       VAL   9  -4.908 -26.189   4.113
   81   1HG1  VAL   9          1HG1      VAL   9  -5.884 -26.553   1.240
   82   2HG1  VAL   9          2HG1      VAL   9  -6.878 -25.962   2.587
   83   3HG1  VAL   9          3HG1      VAL   9  -5.496 -25.011   2.032
   84   1HG2  VAL   9          1HG2      VAL   9  -5.611 -28.754   2.609
   85   2HG2  VAL   9          2HG2      VAL   9  -5.044 -28.642   4.290
   86   3HG2  VAL   9          3HG2      VAL   9  -6.626 -27.988   3.848
   87    H    PHE  10           H        PHE  10  -3.041 -26.011   0.340
   88    HA   PHE  10           HA       PHE  10  -1.785 -23.455   1.245
   89   1HB   PHE  10          1HB       PHE  10   0.119 -24.022  -0.242
   90   2HB   PHE  10          2HB       PHE  10  -0.049 -25.101   1.135
   91    HD1  PHE  10           1HD      PHE  10  -0.461 -27.474   0.848
   92    HD2  PHE  10           2HD      PHE  10  -0.646 -24.812  -2.543
   93    HE1  PHE  10           1HE      PHE  10  -0.697 -29.415  -0.670
   94    HE2  PHE  10           2HE      PHE  10  -0.944 -26.755  -4.047
   95    HZ   PHE  10           HZ       PHE  10  -0.932 -29.063  -3.121
   96    H    GLU  11           H        GLU  11  -3.698 -25.185  -1.079
   97    HA   GLU  11           HA       GLU  11  -3.219 -23.443  -3.339
   98   1HB   GLU  11          1HB       GLU  11  -4.904 -24.914  -4.411
   99   2HB   GLU  11          2HB       GLU  11  -3.544 -25.792  -3.724
  100   1HG   GLU  11          1HG       GLU  11  -5.947 -25.487  -1.936
  101   2HG   GLU  11          2HG       GLU  11  -6.144 -26.484  -3.374
  102    HE2  GLU  11           HE       GLU  11  -4.694 -29.208  -1.891
  103    H    MET  12           H        MET  12  -3.959 -21.679  -1.489
  104    HA   MET  12           HA       MET  12  -6.720 -20.837  -2.182
  105   1HB   MET  12          1HB       MET  12  -5.699 -21.231   0.672
  106   2HB   MET  12          2HB       MET  12  -7.247 -20.513   0.207
  107   1HG   MET  12          1HG       MET  12  -7.815 -22.707  -0.945
  108   2HG   MET  12          2HG       MET  12  -6.366 -23.389  -0.193
  109   1HE   MET  12          1HE       MET  12  -9.292 -20.976   1.271
  110   2HE   MET  12          2HE       MET  12 -10.307 -22.294   1.892
  111   3HE   MET  12          3HE       MET  12  -9.959 -22.191   0.152
  112    H    LEU  13           H        LEU  13  -7.148 -18.720  -1.029
  113    HA   LEU  13           HA       LEU  13  -6.922 -16.619  -0.720
  114   1HB   LEU  13          1HB       LEU  13  -5.524 -15.873   0.858
  115   2HB   LEU  13          2HB       LEU  13  -5.521 -17.600   1.108
  116    HG   LEU  13           HG       LEU  13  -3.268 -17.372  -0.440
  117   1HD1  LEU  13          1HD1      LEU  13  -2.070 -15.366   0.135
  118   2HD1  LEU  13          2HD1      LEU  13  -3.606 -14.892  -0.626
  119   3HD1  LEU  13          3HD1      LEU  13  -3.415 -14.784   1.136
  120   1HD2  LEU  13          1HD2      LEU  13  -2.013 -17.381   1.667
  121   2HD2  LEU  13          2HD2      LEU  13  -3.451 -16.817   2.546
  122   3HD2  LEU  13          3HD2      LEU  13  -3.440 -18.426   1.791
  123    H    LYS  14           H        LYS  14  -6.762 -14.845  -1.875
  124    HA   LYS  14           HA       LYS  14  -5.130 -15.039  -4.372
  125   1HB   LYS  14          1HB       LYS  14  -7.038 -14.607  -5.633
  126   2HB   LYS  14          2HB       LYS  14  -7.503 -15.794  -4.424
  127   1HG   LYS  14          1HG       LYS  14  -9.265 -14.396  -4.113
  128   2HG   LYS  14          2HG       LYS  14  -8.133 -13.535  -3.064
  129   1HD   LYS  14          1HD       LYS  14  -7.542 -12.325  -5.437
  130   2HD   LYS  14          2HD       LYS  14  -9.147 -12.906  -5.833
  131   1HE   LYS  14          1HE       LYS  14  -9.237 -10.610  -5.034
  132   2HE   LYS  14          2HE       LYS  14 -10.063 -11.690  -3.888
  133   1HZ   LYS  14          1HZ       LYS  14  -8.601 -10.150  -2.743
  134   2HZ   LYS  14          2HZ       LYS  14  -7.267 -10.817  -3.532
  135    H    ARG  15           H        ARG  15  -5.040 -12.990  -5.647
  136    HA   ARG  15           HA       ARG  15  -4.438 -10.715  -3.862
  137   1HB   ARG  15          1HB       ARG  15  -2.976  -9.864  -5.376
  138   2HB   ARG  15          2HB       ARG  15  -2.687 -11.604  -5.287
  139   1HG   ARG  15          1HG       ARG  15  -4.023 -11.842  -7.414
  140   2HG   ARG  15          2HG       ARG  15  -4.114 -10.076  -7.520
  141   1HD   ARG  15          1HD       ARG  15  -1.838  -9.786  -7.851
  142   2HD   ARG  15          2HD       ARG  15  -1.421 -11.405  -7.265
  143    HE   ARG  15           HE       ARG  15  -2.996 -11.970  -9.410
  144   1HH1  ARG  15          2HH1      ARG  15  -0.056 -10.021  -9.015
  145   2HH1  ARG  15          1HH1      ARG  15   0.541 -10.381 -10.615
  146   1HH2  ARG  15          1HH2      ARG  15  -2.212 -12.435 -11.480
  147   2HH2  ARG  15          2HH2      ARG  15  -0.712 -11.742 -12.039
  148    H    MET  16           H        MET  16  -5.589  -8.944  -3.741
  149    HA   MET  16           HA       MET  16  -7.635  -8.012  -5.593
  150   1HB   MET  16          1HB       MET  16  -7.272  -7.413  -3.139
  151   2HB   MET  16          2HB       MET  16  -5.964  -6.359  -3.684
  152   1HG   MET  16          1HG       MET  16  -7.658  -5.109  -5.069
  153   2HG   MET  16          2HG       MET  16  -8.901  -6.238  -4.518
  154   1HE   MET  16          1HE       MET  16  -6.039  -4.594  -2.061
  155   2HE   MET  16          2HE       MET  16  -6.765  -2.978  -2.092
  156   3HE   MET  16          3HE       MET  16  -6.205  -3.748  -3.605
  157    H    TYR  17           H        TYR  17  -7.280  -6.023  -6.784
  158    HA   TYR  17           HA       TYR  17  -4.598  -5.001  -7.138
  159   1HB   TYR  17          1HB       TYR  17  -4.551  -6.664  -8.936
  160   2HB   TYR  17          2HB       TYR  17  -6.070  -6.059  -9.587
  161    HD1  TYR  17           1HD      TYR  17  -2.565  -4.964  -8.765
  162    HD2  TYR  17           2HD      TYR  17  -6.065  -4.313 -11.202
  163    HE1  TYR  17           1HE      TYR  17  -1.322  -3.307 -10.121
  164    HE2  TYR  17           2HE      TYR  17  -4.839  -2.632 -12.522
  165    HH   TYR  17           HH       TYR  17  -2.798  -1.666 -12.947
  166    H    ALA  18           H        ALA  18  -5.461  -3.329  -5.987
  167    HA   ALA  18           HA       ALA  18  -7.702  -1.848  -7.208
  168   1HB   ALA  18          1HB       ALA  18  -7.903  -0.691  -5.121
  169   2HB   ALA  18          2HB       ALA  18  -7.978  -2.454  -4.885
  170   3HB   ALA  18          3HB       ALA  18  -6.488  -1.557  -4.470
  171    H    ARG  19           H        ARG  19  -7.090  -0.570  -8.677
  172    HA   ARG  19           HA       ARG  19  -4.582   0.898  -8.539
  173   1HB   ARG  19          1HB       ARG  19  -6.207  -0.183 -10.631
  174   2HB   ARG  19          2HB       ARG  19  -6.286   1.559 -10.834
  175   1HG   ARG  19          1HG       ARG  19  -3.809  -0.185 -10.743
  176   2HG   ARG  19          2HG       ARG  19  -4.469   0.725 -12.118
  177   1HD   ARG  19          1HD       ARG  19  -4.147   2.730 -10.249
  178   2HD   ARG  19          2HD       ARG  19  -2.828   1.667  -9.795
  179    HE   ARG  19           HE       ARG  19  -2.956   3.462 -11.976
  180   1HH1  ARG  19          1HH1      ARG  19  -1.794   0.147 -11.406
  181   2HH1  ARG  19          2HH1      ARG  19  -0.596   0.237 -12.666
  182   1HH2  ARG  19          1HH2      ARG  19  -1.450   3.526 -13.644
  183   2HH2  ARG  19          2HH2      ARG  19  -0.422   2.154 -13.976
  184    H    VAL  20           H        VAL  20  -4.714   2.611  -7.117
  185    HA   VAL  20           HA       VAL  20  -7.252   4.064  -6.830
  186    HB   VAL  20           HB       VAL  20  -4.738   4.466  -5.227
  187   1HG1  VAL  20          1HG1      VAL  20  -7.683   4.903  -4.566
  188   2HG1  VAL  20          2HG1      VAL  20  -6.280   5.375  -3.588
  189   3HG1  VAL  20          3HG1      VAL  20  -6.603   6.187  -5.131
  190   1HG2  VAL  20          1HG2      VAL  20  -6.981   2.437  -4.885
  191   2HG2  VAL  20          2HG2      VAL  20  -5.232   2.126  -4.951
  192   3HG2  VAL  20          3HG2      VAL  20  -5.934   2.950  -3.554
  193    H    TYR  21           H        TYR  21  -7.648   5.634  -8.212
  194    HA   TYR  21           HA       TYR  21  -5.431   7.215  -9.430
  195   1HB   TYR  21          1HB       TYR  21  -8.398   7.264 -10.059
  196   2HB   TYR  21          2HB       TYR  21  -7.125   8.045 -10.959
  197    HD1  TYR  21           1HD      TYR  21  -5.412   5.198 -10.530
  198    HD2  TYR  21           2HD      TYR  21  -9.065   6.496 -12.404
  199    HE1  TYR  21           1HE      TYR  21  -5.280   3.322 -12.131
  200    HE2  TYR  21           2HE      TYR  21  -9.079   4.443 -13.783
  201    HH   TYR  21           HH       TYR  21  -7.992   2.426 -14.242
  202    H    GLY  22           H        GLY  22  -5.295   9.438  -9.218
  203   1HA   GLY  22          1HA       GLY  22  -6.725  11.471  -8.899
  204   2HA   GLY  22          2HA       GLY  22  -7.112  10.825  -7.294
  205    H    LEU  23           H        LEU  23  -6.259  12.761  -6.390
  206    HA   LEU  23           HA       LEU  23  -3.395  13.271  -6.587
  207   1HB   LEU  23          1HB       LEU  23  -5.274  14.979  -6.344
  208   2HB   LEU  23          2HB       LEU  23  -5.351  14.493  -4.646
  209    HG   LEU  23           HG       LEU  23  -2.826  15.133  -4.553
  210   1HD1  LEU  23          1HD1      LEU  23  -2.074  16.755  -6.250
  211   2HD1  LEU  23          2HD1      LEU  23  -2.357  15.176  -6.988
  212   3HD1  LEU  23          3HD1      LEU  23  -3.551  16.477  -7.192
  213   1HD2  LEU  23          1HD2      LEU  23  -3.353  17.521  -4.296
  214   2HD2  LEU  23          2HD2      LEU  23  -4.880  17.290  -5.177
  215   3HD2  LEU  23          3HD2      LEU  23  -4.635  16.517  -3.595
  216    H    VAL  24           H        VAL  24  -4.594  10.672  -5.479
  217    HA   VAL  24           HA       VAL  24  -3.687  10.435  -2.749
  218    HB   VAL  24           HB       VAL  24  -3.735   7.993  -3.271
  219   1HG1  VAL  24          1HG1      VAL  24  -6.245   9.570  -4.008
  220   2HG1  VAL  24          2HG1      VAL  24  -6.189   7.889  -3.446
  221   3HG1  VAL  24          3HG1      VAL  24  -5.698   9.199  -2.362
  222   1HG2  VAL  24          1HG2      VAL  24  -5.002   8.753  -5.930
  223   2HG2  VAL  24          2HG2      VAL  24  -3.286   8.334  -5.801
  224   3HG2  VAL  24          3HG2      VAL  24  -4.525   7.157  -5.335
  225    H    GLN  25           H        GLN  25  -2.082  10.508  -5.859
  226    HA   GLN  25           HA       GLN  25   0.485   9.562  -5.056
  227   1HB   GLN  25          1HB       GLN  25  -0.682  10.826  -7.365
  228   2HB   GLN  25          2HB       GLN  25   0.687  11.811  -6.855
  229   1HG   GLN  25          1HG       GLN  25   1.469  10.148  -8.382
  230   2HG   GLN  25          2HG       GLN  25   2.123   9.772  -6.791
  231   1HE2  GLN  25          1HE2      GLN  25   2.394   7.696  -8.174
  232   2HE2  GLN  25          2HE2      GLN  25   1.103   6.511  -8.093
  233    H    GLY  26           H        GLY  26   2.205  10.638  -4.070
  234   1HA   GLY  26          1HA       GLY  26   3.355  12.387  -3.111
  235   2HA   GLY  26          2HA       GLY  26   1.953  13.448  -3.258
  236    H    VAL  27           H        VAL  27  -0.044  12.527  -1.829
  237    HA   VAL  27           HA       VAL  27   0.834  12.749   0.881
  238    HB   VAL  27           HB       VAL  27  -1.453  12.465   1.530
  239   1HG1  VAL  27          1HG1      VAL  27  -1.403  14.064  -1.060
  240   2HG1  VAL  27          2HG1      VAL  27  -2.542  14.233   0.285
  241   3HG1  VAL  27          3HG1      VAL  27  -0.832  14.639   0.523
  242   1HG2  VAL  27          1HG2      VAL  27  -2.204  11.731  -1.314
  243   2HG2  VAL  27          2HG2      VAL  27  -2.033  10.531  -0.016
  244   3HG2  VAL  27          3HG2      VAL  27  -3.238  11.794   0.136
  245    H    GLY  28           H        GLY  28   0.049  11.149   2.618
  246   1HA   GLY  28          1HA       GLY  28   1.584   8.810   2.469
  247   2HA   GLY  28          2HA       GLY  28   0.350   9.162   3.685
  248    H    PHE  29           H        PHE  29  -1.722   8.281   3.464
  249    HA   PHE  29           HA       PHE  29  -3.344   6.870   2.959
  250   1HB   PHE  29          1HB       PHE  29  -4.097   7.820   1.130
  251   2HB   PHE  29          2HB       PHE  29  -2.521   7.998   0.396
  252    HD1  PHE  29           1HD      PHE  29  -1.805   6.602  -1.374
  253    HD2  PHE  29           2HD      PHE  29  -5.205   5.443   1.012
  254    HE1  PHE  29           1HE      PHE  29  -2.049   4.518  -2.694
  255    HE2  PHE  29           2HE      PHE  29  -5.616   3.528  -0.510
  256    HZ   PHE  29           HZ       PHE  29  -3.967   3.008  -2.302
  257    H    ARG  30           H        ARG  30  -0.703   5.748   0.866
  258    HA   ARG  30           HA       ARG  30  -0.822   3.051   0.779
  259   1HB   ARG  30          1HB       ARG  30   1.542   4.869   1.387
  260   2HB   ARG  30          2HB       ARG  30   1.689   3.191   0.848
  261   1HG   ARG  30          1HG       ARG  30   0.823   3.640  -1.293
  262   2HG   ARG  30          2HG       ARG  30   0.181   5.223  -0.850
  263   1HD   ARG  30          1HD       ARG  30   3.146   4.606  -0.717
  264   2HD   ARG  30          2HD       ARG  30   2.350   5.194  -2.187
  265    HE   ARG  30           HE       ARG  30   1.551   6.951  -0.180
  266   1HH1  ARG  30          1HH1      ARG  30   4.721   5.955  -1.483
  267   2HH1  ARG  30          2HH1      ARG  30   5.369   7.570  -1.439
  268   1HH2  ARG  30          1HH2      ARG  30   2.460   9.045  -0.099
  269   2HH2  ARG  30          2HH2      ARG  30   4.124   9.308  -0.549
  270    H    LYS  31           H        LYS  31   0.064   4.972   3.667
  271    HA   LYS  31           HA       LYS  31   1.103   2.714   5.115
  272   1HB   LYS  31          1HB       LYS  31   1.534   5.359   5.343
  273   2HB   LYS  31          2HB       LYS  31   0.232   5.232   6.524
  274   1HG   LYS  31          1HG       LYS  31   2.883   3.720   6.496
  275   2HG   LYS  31          2HG       LYS  31   2.446   5.074   7.546
  276   1HD   LYS  31          1HD       LYS  31   0.632   3.620   8.563
  277   2HD   LYS  31          2HD       LYS  31   1.238   2.277   7.571
  278   1HE   LYS  31          1HE       LYS  31   2.261   1.997   9.697
  279   2HE   LYS  31          2HE       LYS  31   3.518   2.603   8.615
  280   1HZ   LYS  31          1HZ       LYS  31   3.561   3.822  10.670
  281   2HZ   LYS  31          2HZ       LYS  31   1.962   4.318  10.450
  282    H    PHE  32           H        PHE  32  -1.881   4.736   5.385
  283    HA   PHE  32           HA       PHE  32  -3.270   3.385   7.303
  284   1HB   PHE  32          1HB       PHE  32  -3.912   5.472   6.181
  285   2HB   PHE  32          2HB       PHE  32  -4.396   4.573   4.756
  286    HD1  PHE  32           1HD      PHE  32  -5.369   2.891   7.885
  287    HD2  PHE  32           2HD      PHE  32  -6.531   5.853   4.947
  288    HE1  PHE  32           1HE      PHE  32  -7.673   2.760   8.659
  289    HE2  PHE  32           2HE      PHE  32  -8.793   5.888   5.918
  290    HZ   PHE  32           HZ       PHE  32  -9.406   4.307   7.741
  291    H    VAL  33           H        VAL  33  -2.925   2.541   3.870
  292    HA   VAL  33           HA       VAL  33  -4.791   0.321   3.782
  293    HB   VAL  33           HB       VAL  33  -2.345   1.070   2.110
  294   1HG1  VAL  33          1HG1      VAL  33  -4.399  -1.094   1.511
  295   2HG1  VAL  33          2HG1      VAL  33  -3.115  -0.511   0.427
  296   3HG1  VAL  33          3HG1      VAL  33  -2.685  -1.371   1.902
  297   1HG2  VAL  33          1HG2      VAL  33  -5.329   1.278   1.521
  298   2HG2  VAL  33          2HG2      VAL  33  -4.252   2.638   1.913
  299   3HG2  VAL  33          3HG2      VAL  33  -4.007   1.719   0.420
  300    H    GLN  34           H        GLN  34  -1.415   0.701   4.656
  301    HA   GLN  34           HA       GLN  34  -0.858  -2.137   4.827
  302   1HB   GLN  34          1HB       GLN  34   0.672   0.346   5.038
  303   2HB   GLN  34          2HB       GLN  34   0.952  -0.651   6.465
  304   1HG   GLN  34          1HG       GLN  34   2.605  -1.230   4.902
  305   2HG   GLN  34          2HG       GLN  34   1.478  -2.579   4.928
  306   1HE2  GLN  34          1HE2      GLN  34  -0.558  -1.276   3.117
  307   2HE2  GLN  34          2HE2      GLN  34   0.201  -1.264   1.548
  308    H    ILE  35           H        ILE  35  -1.473   0.348   7.384
  309    HA   ILE  35           HA       ILE  35  -1.312  -1.216   9.588
  310    HB   ILE  35           HB       ILE  35  -3.567   0.758   9.004
  311   1HG1  ILE  35          1HG1      ILE  35  -1.506   1.936   8.757
  312   2HG1  ILE  35          2HG1      ILE  35  -2.185   2.367  10.315
  313   1HG2  ILE  35          1HG2      ILE  35  -3.674   1.057  11.487
  314   2HG2  ILE  35          2HG2      ILE  35  -4.222  -0.527  10.949
  315   3HG2  ILE  35          3HG2      ILE  35  -2.615  -0.356  11.674
  316   1HD1  ILE  35          1HD1      ILE  35   0.140   2.057  10.651
  317   2HD1  ILE  35          2HD1      ILE  35  -0.614   0.628  11.365
  318   3HD1  ILE  35          3HD1      ILE  35   0.165   0.518   9.768
  319    H    HIS  36           H        HIS  36  -4.331  -1.193   7.633
  320    HA   HIS  36           HA       HIS  36  -5.558  -3.156   9.395
  321   1HB   HIS  36          1HB       HIS  36  -6.354  -1.852   6.787
  322   2HB   HIS  36          2HB       HIS  36  -7.270  -3.194   7.479
  323    HD2  HIS  36           2HD      HIS  36  -5.993   0.263   9.081
  324    HE1  HIS  36           1HE      HIS  36  -9.939  -0.591  10.330
  325    HE2  HIS  36           2HE      HIS  36  -8.010   1.069  10.516
  326    H    ALA  37           H        ALA  37  -4.276  -3.282   6.017
  327    HA   ALA  37           HA       ALA  37  -4.558  -5.932   5.477
  328   1HB   ALA  37          1HB       ALA  37  -2.644  -5.678   3.989
  329   2HB   ALA  37          2HB       ALA  37  -3.662  -4.240   3.970
  330   3HB   ALA  37          3HB       ALA  37  -2.124  -4.231   4.857
  331    H    ILE  38           H        ILE  38  -1.899  -4.502   7.322
  332    HA   ILE  38           HA       ILE  38  -0.457  -6.929   7.929
  333    HB   ILE  38           HB       ILE  38  -0.362  -4.004   8.708
  334   1HG1  ILE  38          1HG1      ILE  38   1.917  -4.143   7.953
  335   2HG1  ILE  38          2HG1      ILE  38   1.873  -5.910   7.905
  336   1HG2  ILE  38          1HG2      ILE  38   1.452  -4.378  10.300
  337   2HG2  ILE  38          2HG2      ILE  38  -0.123  -4.907  10.890
  338   3HG2  ILE  38          3HG2      ILE  38   1.063  -6.114  10.318
  339   1HD1  ILE  38          1HD1      ILE  38   1.779  -4.796   5.687
  340   2HD1  ILE  38          2HD1      ILE  38   0.400  -5.877   5.951
  341   3HD1  ILE  38          3HD1      ILE  38   0.200  -4.121   6.080
  342    H    ARG  39           H        ARG  39  -2.826  -4.908   9.777
  343    HA   ARG  39           HA       ARG  39  -2.946  -6.307  12.088
  344   1HB   ARG  39          1HB       ARG  39  -4.188  -4.271  11.452
  345   2HB   ARG  39          2HB       ARG  39  -5.385  -5.291  10.627
  346   1HG   ARG  39          1HG       ARG  39  -5.872  -6.411  12.726
  347   2HG   ARG  39          2HG       ARG  39  -4.623  -5.432  13.545
  348   1HD   ARG  39          1HD       ARG  39  -5.808  -3.365  13.010
  349   2HD   ARG  39          2HD       ARG  39  -7.027  -4.229  12.074
  350    HE   ARG  39           HE       ARG  39  -6.875  -3.878  14.951
  351   1HH1  ARG  39          1HH1      ARG  39  -8.122  -6.057  12.441
  352   2HH1  ARG  39          2HH1      ARG  39  -9.491  -6.572  13.391
  353   1HH2  ARG  39          1HH2      ARG  39  -8.659  -4.581  16.196
  354   2HH2  ARG  39          2HH2      ARG  39  -9.784  -5.744  15.545
  355    H    LEU  40           H        LEU  40  -4.478  -7.132   8.981
  356    HA   LEU  40           HA       LEU  40  -5.646  -9.657  10.013
  357   1HB   LEU  40          1HB       LEU  40  -6.007  -8.241   7.371
  358   2HB   LEU  40          2HB       LEU  40  -6.925  -9.636   7.962
  359    HG   LEU  40           HG       LEU  40  -6.905  -6.855   9.240
  360   1HD1  LEU  40          1HD1      LEU  40  -9.198  -6.753   8.469
  361   2HD1  LEU  40          2HD1      LEU  40  -8.093  -6.981   7.096
  362   3HD1  LEU  40          3HD1      LEU  40  -9.043  -8.360   7.711
  363   1HD2  LEU  40          1HD2      LEU  40  -8.831  -7.804  10.579
  364   2HD2  LEU  40          2HD2      LEU  40  -8.353  -9.419  10.018
  365   3HD2  LEU  40          3HD2      LEU  40  -7.250  -8.451  11.026
  366    H    GLY  41           H        GLY  41  -2.603  -9.067   9.044
  367   1HA   GLY  41          1HA       GLY  41  -0.954 -10.417   8.248
  368   2HA   GLY  41          2HA       GLY  41  -2.076 -11.771   8.436
  369    H    ILE  42           H        ILE  42  -1.572  -8.950   6.262
  370    HA   ILE  42           HA       ILE  42  -2.222 -10.624   3.878
  371    HB   ILE  42           HB       ILE  42  -2.761  -7.727   4.516
  372   1HG1  ILE  42          1HG1      ILE  42  -4.326  -9.316   5.592
  373   2HG1  ILE  42          2HG1      ILE  42  -5.080  -8.209   4.432
  374   1HG2  ILE  42          1HG2      ILE  42  -4.038  -7.624   2.399
  375   2HG2  ILE  42          2HG2      ILE  42  -2.289  -7.725   2.189
  376   3HG2  ILE  42          3HG2      ILE  42  -3.291  -9.157   1.918
  377   1HD1  ILE  42          1HD1      ILE  42  -5.974 -10.500   4.276
  378   2HD1  ILE  42          2HD1      ILE  42  -5.233  -9.929   2.774
  379   3HD1  ILE  42          3HD1      ILE  42  -4.377 -11.107   3.811
  380    H    LYS  43           H        LYS  43  -0.894 -10.498   2.190
  381    HA   LYS  43           HA       LYS  43   1.709  -9.059   2.483
  382   1HB   LYS  43          1HB       LYS  43   0.994 -11.260   0.553
  383   2HB   LYS  43          2HB       LYS  43   2.588 -10.575   0.858
  384   1HG   LYS  43          1HG       LYS  43   2.586 -11.423   3.145
  385   2HG   LYS  43          2HG       LYS  43   0.945 -12.057   2.968
  386   1HD   LYS  43          1HD       LYS  43   1.599 -13.621   1.265
  387   2HD   LYS  43          2HD       LYS  43   3.256 -13.010   1.244
  388   1HE   LYS  43          1HE       LYS  43   1.942 -14.229   3.712
  389   2HE   LYS  43          2HE       LYS  43   2.930 -15.147   2.559
  390   1HZ   LYS  43          1HZ       LYS  43   3.860 -12.860   4.174
  391   2HZ   LYS  43          2HZ       LYS  43   4.786 -13.749   3.078
  392    H    GLY  44           H        GLY  44   2.526  -8.260   0.159
  393   1HA   GLY  44          1HA       GLY  44   1.165  -7.885  -2.108
  394   2HA   GLY  44          2HA       GLY  44   0.332  -6.700  -1.074
  395    H    TYR  45           H        TYR  45   0.979  -4.865  -2.076
  396    HA   TYR  45           HA       TYR  45   3.256  -3.679  -1.065
  397   1HB   TYR  45          1HB       TYR  45   4.054  -5.134  -3.304
  398   2HB   TYR  45          2HB       TYR  45   3.791  -3.528  -3.944
  399    HD1  TYR  45           1HD      TYR  45   5.214  -1.648  -3.338
  400    HD2  TYR  45           2HD      TYR  45   5.858  -5.594  -1.728
  401    HE1  TYR  45           1HE      TYR  45   7.526  -1.006  -2.634
  402    HE2  TYR  45           2HE      TYR  45   8.146  -4.951  -1.055
  403    HH   TYR  45           HH       TYR  45   9.703  -3.258  -0.934
  404    H    ALA  46           H        ALA  46   3.072  -1.448  -1.274
  405    HA   ALA  46           HA       ALA  46   0.657  -0.460  -2.714
  406   1HB   ALA  46          1HB       ALA  46   0.645   1.360  -1.194
  407   2HB   ALA  46          2HB       ALA  46   0.815  -0.137  -0.262
  408   3HB   ALA  46          3HB       ALA  46   2.208   0.920  -0.512
  409    H    LYS  47           H        LYS  47   1.664  -0.332  -4.817
  410    HA   LYS  47           HA       LYS  47   4.289   0.975  -4.975
  411   1HB   LYS  47          1HB       LYS  47   4.322  -1.091  -5.961
  412   2HB   LYS  47          2HB       LYS  47   2.757  -0.864  -6.732
  413   1HG   LYS  47          1HG       LYS  47   3.697   0.670  -8.381
  414   2HG   LYS  47          2HG       LYS  47   5.189   0.820  -7.446
  415   1HD   LYS  47          1HD       LYS  47   5.621  -0.568  -9.351
  416   2HD   LYS  47          2HD       LYS  47   5.703  -1.576  -7.897
  417   1HE   LYS  47          1HE       LYS  47   3.406  -2.427  -8.371
  418   2HE   LYS  47          2HE       LYS  47   3.323  -1.389  -9.812
  419   1HZ   LYS  47          1HZ       LYS  47   4.029  -3.580 -10.437
  420   2HZ   LYS  47          2HZ       LYS  47   5.360  -3.483  -9.404
  421    H    ASN  48           H        ASN  48   4.378   2.995  -5.286
  422    HA   ASN  48           HA       ASN  48   2.226   4.569  -6.482
  423   1HB   ASN  48          1HB       ASN  48   3.242   5.165  -4.288
  424   2HB   ASN  48          2HB       ASN  48   4.814   5.356  -5.061
  425   1HD2  ASN  48          2HD2      ASN  48   2.035   7.007  -4.056
  426   2HD2  ASN  48          1HD2      ASN  48   2.280   8.474  -4.978
  427    H    LEU  49           H        LEU  49   2.354   4.984  -8.681
  428    HA   LEU  49           HA       LEU  49   4.965   4.997 -10.052
  429   1HB   LEU  49          1HB       LEU  49   2.151   5.233 -11.112
  430   2HB   LEU  49          2HB       LEU  49   3.617   5.018 -12.052
  431    HG   LEU  49           HG       LEU  49   2.729   2.982  -9.951
  432   1HD1  LEU  49          1HD1      LEU  49   1.665   1.710 -11.719
  433   2HD1  LEU  49          2HD1      LEU  49   0.896   3.294 -11.547
  434   3HD1  LEU  49          3HD1      LEU  49   2.012   2.998 -12.899
  435   1HD2  LEU  49          1HD2      LEU  49   4.090   1.427 -11.270
  436   2HD2  LEU  49          2HD2      LEU  49   4.518   2.723 -12.405
  437   3HD2  LEU  49          3HD2      LEU  49   5.079   2.786 -10.719
  438    HA   PRO  50           HA       PRO  50   4.304   9.331  -8.741
  439   1HB   PRO  50          1HB       PRO  50   6.747  10.436  -9.322
  440   2HB   PRO  50          2HB       PRO  50   6.440   9.376  -7.914
  441   1HG   PRO  50          1HG       PRO  50   7.540   8.552 -10.617
  442   2HG   PRO  50          2HG       PRO  50   8.232   8.201  -9.004
  443   1HD   PRO  50          1HD       PRO  50   6.684   6.389 -10.258
  444   2HD   PRO  50          2HD       PRO  50   6.475   6.672  -8.501
  445    H    ASP  51           H        ASP  51   3.740  11.235  -9.754
  446    HA   ASP  51           HA       ASP  51   2.640  12.351 -11.338
  447   1HB   ASP  51          1HB       ASP  51   4.927  12.870 -12.160
  448   2HB   ASP  51          2HB       ASP  51   4.861  11.468 -13.235
  449    HD2  ASP  51           HD       ASP  51   3.815  13.778 -15.611
  450    H    GLY  52           H        GLY  52   1.415  10.151 -10.690
  451   1HA   GLY  52          1HA       GLY  52  -0.172   9.419 -12.921
  452   2HA   GLY  52          2HA       GLY  52   1.004   8.129 -12.572
  453    H    SER  53           H        SER  53  -0.150   6.614 -11.566
  454    HA   SER  53           HA       SER  53  -1.987   7.275  -9.298
  455   1HB   SER  53          1HB       SER  53  -3.224   5.231 -10.125
  456   2HB   SER  53          2HB       SER  53  -3.342   6.688 -11.136
  457    HG   SER  53           HG       SER  53  -1.736   5.815 -12.477
  458    H    VAL  54           H        VAL  54  -2.261   5.543  -7.749
  459    HA   VAL  54           HA       VAL  54   0.227   3.944  -7.369
  460    HB   VAL  54           HB       VAL  54   0.213   5.682  -5.852
  461   1HG1  VAL  54          1HG1      VAL  54  -2.599   4.996  -4.971
  462   2HG1  VAL  54          2HG1      VAL  54  -1.542   6.247  -4.289
  463   3HG1  VAL  54          3HG1      VAL  54  -2.131   6.404  -5.939
  464   1HG2  VAL  54          1HG2      VAL  54  -0.810   3.226  -4.366
  465   2HG2  VAL  54          2HG2      VAL  54   0.853   3.488  -4.908
  466   3HG2  VAL  54          3HG2      VAL  54   0.153   4.555  -3.691
  467    H    GLU  55           H        GLU  55  -0.017   1.831  -7.602
  468    HA   GLU  55           HA       GLU  55  -2.693   0.626  -7.426
  469   1HB   GLU  55          1HB       GLU  55  -1.962  -1.072  -8.753
  470   2HB   GLU  55          2HB       GLU  55  -1.050   0.306  -9.349
  471   1HG   GLU  55          1HG       GLU  55   0.524  -1.406  -9.301
  472   2HG   GLU  55          2HG       GLU  55   0.878  -0.442  -7.865
  473    HE2  GLU  55           HE       GLU  55   1.038  -3.648  -6.387
  474    H    VAL  56           H        VAL  56  -3.292  -0.877  -5.960
  475    HA   VAL  56           HA       VAL  56  -1.359  -1.685  -3.817
  476    HB   VAL  56           HB       VAL  56  -4.364  -1.260  -3.702
  477   1HG1  VAL  56          1HG1      VAL  56  -2.345  -1.962  -1.556
  478   2HG1  VAL  56          2HG1      VAL  56  -4.078  -1.649  -1.288
  479   3HG1  VAL  56          3HG1      VAL  56  -3.575  -3.085  -2.181
  480   1HG2  VAL  56          1HG2      VAL  56  -2.033   0.331  -2.546
  481   2HG2  VAL  56          2HG2      VAL  56  -3.163   0.886  -3.801
  482   3HG2  VAL  56          3HG2      VAL  56  -3.746   0.590  -2.156
  483    H    VAL  57           H        VAL  57  -0.909  -3.853  -3.859
  484    HA   VAL  57           HA       VAL  57  -2.868  -5.732  -5.133
  485    HB   VAL  57           HB       VAL  57  -0.914  -5.328  -6.494
  486   1HG1  VAL  57          1HG1      VAL  57   0.845  -6.631  -4.384
  487   2HG1  VAL  57          2HG1      VAL  57   1.308  -5.969  -5.956
  488   3HG1  VAL  57          3HG1      VAL  57   0.771  -4.886  -4.675
  489   1HG2  VAL  57          1HG2      VAL  57  -0.848  -8.171  -5.444
  490   2HG2  VAL  57          2HG2      VAL  57  -2.052  -7.515  -6.573
  491   3HG2  VAL  57          3HG2      VAL  57  -0.350  -7.570  -7.036
  492    H    ALA  58           H        ALA  58  -3.718  -5.486  -2.862
  493    HA   ALA  58           HA       ALA  58  -2.295  -6.760  -0.720
  494   1HB   ALA  58          1HB       ALA  58  -4.314  -6.418   0.555
  495   2HB   ALA  58          2HB       ALA  58  -4.096  -4.997  -0.483
  496   3HB   ALA  58          3HB       ALA  58  -5.285  -6.260  -0.907
  497    H    GLU  59           H        GLU  59  -2.210  -8.896  -0.196
  498    HA   GLU  59           HA       GLU  59  -3.622 -10.833  -1.905
  499   1HB   GLU  59          1HB       GLU  59  -1.234 -10.498  -2.154
  500   2HB   GLU  59          2HB       GLU  59  -0.998 -11.023  -0.474
  501   1HG   GLU  59          1HG       GLU  59  -2.019 -13.221  -1.041
  502   2HG   GLU  59          2HG       GLU  59  -2.295 -12.664  -2.698
  503    HE2  GLU  59           HE       GLU  59   0.676 -14.161  -3.549
  504    H    GLY  60           H        GLY  60  -5.355 -11.794  -0.769
  505   1HA   GLY  60          1HA       GLY  60  -4.787 -13.097   1.819
  506   2HA   GLY  60          2HA       GLY  60  -5.922 -11.744   1.857
  507    H    TYR  61           H        TYR  61  -6.815 -13.925   2.807
  508    HA   TYR  61           HA       TYR  61  -8.530 -15.404   1.022
  509   1HB   TYR  61          1HB       TYR  61  -8.494 -14.764   3.995
  510   2HB   TYR  61          2HB       TYR  61  -9.660 -15.863   3.275
  511    HD1  TYR  61           1HD      TYR  61  -8.854 -18.073   2.319
  512    HD2  TYR  61           2HD      TYR  61  -6.249 -15.423   4.516
  513    HE1  TYR  61           1HE      TYR  61  -7.281 -19.948   2.734
  514    HE2  TYR  61           2HE      TYR  61  -4.689 -17.294   4.925
  515    HH   TYR  61           HH       TYR  61  -4.251 -19.527   4.600
  516    H    GLU  62           H        GLU  62 -11.058 -15.090   1.577
  517    HA   GLU  62           HA       GLU  62 -11.591 -12.346   0.679
  518   1HB   GLU  62          1HB       GLU  62 -13.442 -14.723   0.978
  519   2HB   GLU  62          2HB       GLU  62 -13.866 -13.131   0.304
  520   1HG   GLU  62          1HG       GLU  62 -12.027 -13.457  -1.423
  521   2HG   GLU  62          2HG       GLU  62 -11.872 -15.129  -0.860
  522    HE2  GLU  62           HE       GLU  62 -15.051 -13.950  -3.086
  523    H    GLU  63           H        GLU  63 -11.980 -14.189   3.656
  524    HA   GLU  63           HA       GLU  63 -13.960 -12.435   4.808
  525   1HB   GLU  63          1HB       GLU  63 -13.369 -13.602   6.891
  526   2HB   GLU  63          2HB       GLU  63 -13.703 -14.723   5.569
  527   1HG   GLU  63          1HG       GLU  63 -11.877 -15.607   6.797
  528   2HG   GLU  63          2HG       GLU  63 -11.238 -15.067   5.251
  529    HE2  GLU  63           HE       GLU  63  -8.693 -13.652   7.135
  530    H    ALA  64           H        ALA  64 -10.508 -12.266   4.337
  531    HA   ALA  64           HA       ALA  64 -10.381  -9.812   6.037
  532   1HB   ALA  64          1HB       ALA  64  -7.940 -10.035   5.693
  533   2HB   ALA  64          2HB       ALA  64  -8.645 -11.461   6.472
  534   3HB   ALA  64          3HB       ALA  64  -8.218 -11.516   4.746
  535    H    LEU  65           H        LEU  65 -10.896 -10.767   2.746
  536    HA   LEU  65           HA       LEU  65  -9.556  -8.506   1.515
  537   1HB   LEU  65          1HB       LEU  65 -10.095 -10.588   0.309
  538   2HB   LEU  65          2HB       LEU  65 -11.828 -10.187   0.461
  539    HG   LEU  65           HG       LEU  65 -11.452  -8.108  -0.766
  540   1HD1  LEU  65          1HD1      LEU  65  -9.258  -8.024  -2.141
  541   2HD1  LEU  65          2HD1      LEU  65  -9.099  -7.566  -0.447
  542   3HD1  LEU  65          3HD1      LEU  65  -8.590  -9.182  -0.971
  543   1HD2  LEU  65          1HD2      LEU  65 -11.009  -9.320  -2.962
  544   2HD2  LEU  65          2HD2      LEU  65 -10.656 -10.757  -1.956
  545   3HD2  LEU  65          3HD2      LEU  65 -12.265 -10.013  -1.904
  546    H    SER  66           H        SER  66 -12.997  -9.335   1.963
  547    HA   SER  66           HA       SER  66 -14.392  -7.003   1.710
  548   1HB   SER  66          1HB       SER  66 -15.850  -7.908   3.548
  549   2HB   SER  66          2HB       SER  66 -15.467  -9.065   2.262
  550    HG   SER  66           HG       SER  66 -13.959 -10.031   3.586
  551    H    LYS  67           H        LYS  67 -12.492  -7.848   4.645
  552    HA   LYS  67           HA       LYS  67 -13.155  -5.452   6.056
  553   1HB   LYS  67          1HB       LYS  67 -10.846  -7.399   6.353
  554   2HB   LYS  67          2HB       LYS  67 -11.257  -6.146   7.526
  555   1HG   LYS  67          1HG       LYS  67 -12.985  -8.501   6.688
  556   2HG   LYS  67          2HG       LYS  67 -12.148  -8.312   8.230
  557   1HD   LYS  67          1HD       LYS  67 -14.537  -6.736   7.176
  558   2HD   LYS  67          2HD       LYS  67 -14.498  -7.901   8.496
  559   1HE   LYS  67          1HE       LYS  67 -12.978  -6.383   9.788
  560   2HE   LYS  67          2HE       LYS  67 -13.117  -5.173   8.495
  561   1HZ   LYS  67          1HZ       LYS  67 -14.733  -4.706  10.171
  562   2HZ   LYS  67          2HZ       LYS  67 -15.421  -6.237   9.991
  563    H    LEU  68           H        LEU  68 -10.404  -6.236   3.886
  564    HA   LEU  68           HA       LEU  68  -9.113  -3.676   4.312
  565   1HB   LEU  68          1HB       LEU  68  -7.991  -5.807   3.840
  566   2HB   LEU  68          2HB       LEU  68  -8.719  -5.875   2.237
  567    HG   LEU  68           HG       LEU  68  -6.267  -5.192   2.614
  568   1HD1  LEU  68          1HD1      LEU  68  -6.192  -3.789   0.635
  569   2HD1  LEU  68          2HD1      LEU  68  -7.281  -5.172   0.421
  570   3HD1  LEU  68          3HD1      LEU  68  -7.948  -3.545   0.706
  571   1HD2  LEU  68          1HD2      LEU  68  -5.727  -2.883   2.868
  572   2HD2  LEU  68          2HD2      LEU  68  -7.424  -2.403   2.915
  573   3HD2  LEU  68          3HD2      LEU  68  -6.736  -3.357   4.256
  574    H    LEU  69           H        LEU  69 -11.718  -4.858   2.304
  575    HA   LEU  69           HA       LEU  69 -11.530  -2.725   0.358
  576   1HB   LEU  69          1HB       LEU  69 -13.148  -5.178   0.841
  577   2HB   LEU  69          2HB       LEU  69 -14.128  -3.854   0.253
  578    HG   LEU  69           HG       LEU  69 -13.279  -5.405  -1.466
  579   1HD1  LEU  69          1HD1      LEU  69 -12.689  -3.638  -3.099
  580   2HD1  LEU  69          2HD1      LEU  69 -14.042  -3.167  -2.057
  581   3HD1  LEU  69          3HD1      LEU  69 -12.426  -2.490  -1.770
  582   1HD2  LEU  69          1HD2      LEU  69 -11.016  -5.329  -2.254
  583   2HD2  LEU  69          2HD2      LEU  69 -10.549  -4.128  -1.033
  584   3HD2  LEU  69          3HD2      LEU  69 -10.996  -5.771  -0.538
  585    H    GLU  70           H        GLU  70 -13.910  -3.599   2.891
  586    HA   GLU  70           HA       GLU  70 -15.446  -1.299   2.715
  587   1HB   GLU  70          1HB       GLU  70 -16.510  -2.006   4.692
  588   2HB   GLU  70          2HB       GLU  70 -15.989  -3.441   3.823
  589   1HG   GLU  70          1HG       GLU  70 -15.511  -3.939   6.052
  590   2HG   GLU  70          2HG       GLU  70 -13.955  -3.513   5.335
  591    HE2  GLU  70           HE       GLU  70 -13.655  -1.757   8.354
  592    H    ARG  71           H        ARG  71 -12.596  -1.914   4.702
  593    HA   ARG  71           HA       ARG  71 -11.982   0.287   6.140
  594   1HB   ARG  71          1HB       ARG  71 -10.423  -1.404   6.154
  595   2HB   ARG  71          2HB       ARG  71 -10.570  -1.657   4.416
  596   1HG   ARG  71          1HG       ARG  71  -8.375  -1.082   4.820
  597   2HG   ARG  71          2HG       ARG  71  -9.148   0.181   3.890
  598   1HD   ARG  71          1HD       ARG  71  -9.370   1.441   6.175
  599   2HD   ARG  71          2HD       ARG  71  -8.280   0.214   6.785
  600    HE   ARG  71           HE       ARG  71  -6.510   1.093   5.585
  601   1HH1  ARG  71          1HH1      ARG  71  -9.540   2.652   4.572
  602   2HH1  ARG  71          2HH1      ARG  71  -8.764   3.728   3.451
  603   1HH2  ARG  71          1HH2      ARG  71  -5.547   2.378   3.892
  604   2HH2  ARG  71          2HH2      ARG  71  -6.517   3.539   3.023
  605    H    ILE  72           H        ILE  72 -11.711   0.143   2.556
  606    HA   ILE  72           HA       ILE  72 -10.481   2.767   2.389
  607    HB   ILE  72           HB       ILE  72 -11.533   0.906   0.268
  608   1HG1  ILE  72          1HG1      ILE  72  -8.649   1.722   0.867
  609   2HG1  ILE  72          2HG1      ILE  72  -9.400   0.404   1.744
  610   1HG2  ILE  72          1HG2      ILE  72 -10.309   2.413  -1.326
  611   2HG2  ILE  72          2HG2      ILE  72 -11.676   3.225  -0.570
  612   3HG2  ILE  72          3HG2      ILE  72 -10.029   3.553   0.000
  613   1HD1  ILE  72          1HD1      ILE  72  -8.232  -0.533  -0.157
  614   2HD1  ILE  72          2HD1      ILE  72  -9.978  -0.770  -0.341
  615   3HD1  ILE  72          3HD1      ILE  72  -9.154   0.487  -1.286
  616    H    LYS  73           H        LYS  73 -13.553   1.725   0.855
  617    HA   LYS  73           HA       LYS  73 -14.633   4.180   0.490
  618   1HB   LYS  73          1HB       LYS  73 -16.881   3.033   0.600
  619   2HB   LYS  73          2HB       LYS  73 -15.641   2.489  -0.513
  620   1HG   LYS  73          1HG       LYS  73 -15.144   0.696   1.494
  621   2HG   LYS  73          2HG       LYS  73 -16.836   1.065   1.820
  622   1HD   LYS  73          1HD       LYS  73 -16.848  -0.777   0.331
  623   2HD   LYS  73          2HD       LYS  73 -17.219   0.622  -0.693
  624   1HE   LYS  73          1HE       LYS  73 -14.672   0.650  -1.278
  625   2HE   LYS  73          2HE       LYS  73 -14.575  -0.898  -0.439
  626   1HZ   LYS  73          1HZ       LYS  73 -14.973  -1.276  -2.753
  627   2HZ   LYS  73          2HZ       LYS  73 -16.403  -0.380  -2.694
  628    H    GLN  74           H        GLN  74 -15.015   2.270   3.495
  629    HA   GLN  74           HA       GLN  74 -16.564   4.131   4.978
  630   1HB   GLN  74          1HB       GLN  74 -16.268   1.790   5.588
  631   2HB   GLN  74          2HB       GLN  74 -14.553   2.051   5.948
  632   1HG   GLN  74          1HG       GLN  74 -16.700   3.626   7.399
  633   2HG   GLN  74          2HG       GLN  74 -16.290   1.973   7.869
  634   1HE2  GLN  74          1HE2      GLN  74 -15.405   5.253   8.287
  635   2HE2  GLN  74          2HE2      GLN  74 -13.891   4.966   9.119
  636    H    GLY  75           H        GLY  75 -12.993   3.651   4.844
  637   1HA   GLY  75          1HA       GLY  75 -12.540   6.262   6.252
  638   2HA   GLY  75          2HA       GLY  75 -11.501   4.849   6.277
  639    HA   PRO  76           HA       PRO  76 -11.251   6.585   1.779
  640   1HB   PRO  76          1HB       PRO  76 -11.675   9.297   1.405
  641   2HB   PRO  76          2HB       PRO  76 -12.961   8.058   1.320
  642   1HG   PRO  76          1HG       PRO  76 -12.181   9.771   3.694
  643   2HG   PRO  76          2HG       PRO  76 -13.819   9.529   3.010
  644   1HD   PRO  76          1HD       PRO  76 -12.983   8.109   5.140
  645   2HD   PRO  76          2HD       PRO  76 -13.920   7.296   3.847
  646    HA   PRO  77           HA       PRO  77  -7.110   7.963   2.511
  647   1HB   PRO  77          1HB       PRO  77  -6.218   8.786   0.070
  648   2HB   PRO  77          2HB       PRO  77  -6.694   7.089   0.378
  649   1HG   PRO  77          1HG       PRO  77  -8.421   9.267  -0.814
  650   2HG   PRO  77          2HG       PRO  77  -8.080   7.646  -1.503
  651   1HD   PRO  77          1HD       PRO  77 -10.314   8.106  -0.050
  652   2HD   PRO  77          2HD       PRO  77  -9.412   6.578   0.162
  653    H    ALA  78           H        ALA  78  -5.697   9.852   2.618
  654    HA   ALA  78           HA       ALA  78  -7.169  12.306   3.152
  655   1HB   ALA  78          1HB       ALA  78  -5.032  13.055   4.091
  656   2HB   ALA  78          2HB       ALA  78  -5.460  11.446   4.698
  657   3HB   ALA  78          3HB       ALA  78  -4.221  11.613   3.437
  658    H    ALA  79           H        ALA  79  -7.430  11.843   0.426
  659    HA   ALA  79           HA       ALA  79  -6.101  14.186  -0.718
  660   1HB   ALA  79          1HB       ALA  79  -5.477  12.596  -2.724
  661   2HB   ALA  79          2HB       ALA  79  -4.379  12.833  -1.368
  662   3HB   ALA  79          3HB       ALA  79  -5.391  11.361  -1.457
  663    H    GLU  80           H        GLU  80  -6.864  14.510  -2.958
  664    HA   GLU  80           HA       GLU  80  -9.715  13.981  -3.288
  665   1HB   GLU  80          1HB       GLU  80  -7.733  15.302  -5.201
  666   2HB   GLU  80          2HB       GLU  80  -9.499  15.383  -5.261
  667   1HG   GLU  80          1HG       GLU  80  -7.641  16.584  -3.158
  668   2HG   GLU  80          2HG       GLU  80  -8.639  17.447  -4.328
  669    HE2  GLU  80           HE       GLU  80 -11.671  16.684  -2.544
  670    H    VAL  81           H        VAL  81  -9.474  11.660  -3.200
  671    HA   VAL  81           HA       VAL  81  -8.298  10.133  -5.322
  672    HB   VAL  81           HB       VAL  81  -8.900   9.250  -3.136
  673   1HG1  VAL  81          1HG1      VAL  81 -11.815   9.286  -4.017
  674   2HG1  VAL  81          2HG1      VAL  81 -11.148   8.640  -2.512
  675   3HG1  VAL  81          3HG1      VAL  81 -11.112  10.385  -2.808
  676   1HG2  VAL  81          1HG2      VAL  81 -10.280   7.828  -5.453
  677   2HG2  VAL  81          2HG2      VAL  81  -8.556   7.734  -5.032
  678   3HG2  VAL  81          3HG2      VAL  81  -9.773   7.087  -3.922
  679    H    GLU  82           H        GLU  82  -8.875   9.851  -7.315
  680    HA   GLU  82           HA       GLU  82 -11.236  11.204  -8.412
  681   1HB   GLU  82          1HB       GLU  82  -9.061  11.542  -9.430
  682   2HB   GLU  82          2HB       GLU  82  -8.835   9.805  -9.662
  683   1HG   GLU  82          1HG       GLU  82  -9.497  11.067 -11.727
  684   2HG   GLU  82          2HG       GLU  82 -10.534   9.701 -11.334
  685    HE2  GLU  82           HE       GLU  82 -11.992  13.470 -10.742
  686    H    LYS  83           H        LYS  83  -9.684   7.966  -8.585
  687    HA   LYS  83           HA       LYS  83 -12.247   6.602  -8.365
  688   1HB   LYS  83          1HB       LYS  83 -10.665   6.394 -10.954
  689   2HB   LYS  83          2HB       LYS  83 -11.982   5.324 -10.471
  690   1HG   LYS  83          1HG       LYS  83 -13.493   7.315 -10.412
  691   2HG   LYS  83          2HG       LYS  83 -12.183   8.283 -11.112
  692   1HD   LYS  83          1HD       LYS  83 -12.047   6.739 -13.040
  693   2HD   LYS  83          2HD       LYS  83 -13.393   5.788 -12.375
  694   1HE   LYS  83          1HE       LYS  83 -14.881   7.764 -12.539
  695   2HE   LYS  83          2HE       LYS  83 -13.533   8.734 -13.175
  696   1HZ   LYS  83          1HZ       LYS  83 -14.831   7.882 -14.991
  697   2HZ   LYS  83          2HZ       LYS  83 -14.550   6.294 -14.487
  698    H    VAL  84           H        VAL  84 -11.719   5.099  -6.910
  699    HA   VAL  84           HA       VAL  84  -9.255   3.501  -7.167
  700    HB   VAL  84           HB       VAL  84  -9.861   3.820  -4.987
  701   1HG1  VAL  84          1HG1      VAL  84 -12.674   2.867  -5.605
  702   2HG1  VAL  84          2HG1      VAL  84 -11.994   3.115  -3.982
  703   3HG1  VAL  84          3HG1      VAL  84 -12.162   4.488  -5.080
  704   1HG2  VAL  84          1HG2      VAL  84 -10.782   1.005  -5.668
  705   2HG2  VAL  84          2HG2      VAL  84  -9.090   1.545  -5.658
  706   3HG2  VAL  84          3HG2      VAL  84 -10.044   1.572  -4.161
  707    H    ASP  85           H        ASP  85  -9.336   2.823  -9.259
  708    HA   ASP  85           HA       ASP  85 -11.752   1.537 -10.340
  709   1HB   ASP  85          1HB       ASP  85 -10.451   3.220 -11.643
  710   2HB   ASP  85          2HB       ASP  85  -9.032   2.164 -11.559
  711    HD2  ASP  85           HD       ASP  85 -10.059   0.891 -14.626
  712    H    TYR  86           H        TYR  86 -11.428  -0.110  -8.539
  713    HA   TYR  86           HA       TYR  86  -9.106  -1.763  -8.754
  714   1HB   TYR  86          1HB       TYR  86  -9.660  -2.615  -6.737
  715   2HB   TYR  86          2HB       TYR  86 -10.684  -1.196  -6.655
  716    HD1  TYR  86           1HD      TYR  86 -13.203  -1.541  -7.182
  717    HD2  TYR  86           2HD      TYR  86 -10.452  -4.833  -6.691
  718    HE1  TYR  86           1HE      TYR  86 -15.096  -3.063  -6.683
  719    HE2  TYR  86           2HE      TYR  86 -12.337  -6.333  -6.177
  720    HH   TYR  86           HH       TYR  86 -14.623  -6.534  -5.941
  721    H    SER  87           H        SER  87  -8.963  -3.996  -9.073
  722    HA   SER  87           HA       SER  87 -11.208  -5.356 -10.416
  723   1HB   SER  87          1HB       SER  87  -8.369  -5.242 -11.518
  724   2HB   SER  87          2HB       SER  87  -9.658  -6.322 -12.089
  725    HG   SER  87           HG       SER  87  -9.849  -3.491 -12.043
  726    H    PHE  88           H        PHE  88 -11.592  -7.024  -9.162
  727    HA   PHE  88           HA       PHE  88  -9.776  -8.391  -7.392
  728   1HB   PHE  88          1HB       PHE  88 -12.141  -8.540  -7.075
  729   2HB   PHE  88          2HB       PHE  88 -12.421  -8.982  -8.745
  730    HD1  PHE  88           1HD      PHE  88 -11.759 -11.298  -9.577
  731    HD2  PHE  88           2HD      PHE  88 -11.903 -10.226  -5.400
  732    HE1  PHE  88           1HE      PHE  88 -11.863 -13.689  -8.966
  733    HE2  PHE  88           2HE      PHE  88 -12.127 -12.624  -4.806
  734    HZ   PHE  88           HZ       PHE  88 -12.051 -14.361  -6.579
  735    H    SER  89           H        SER  89  -8.214  -9.874  -7.940
  736    HA   SER  89           HA       SER  89  -8.160 -11.032 -10.687
  737   1HB   SER  89          1HB       SER  89  -5.760 -10.046  -9.120
  738   2HB   SER  89          2HB       SER  89  -5.786 -10.653 -10.787
  739    HG   SER  89           HG       SER  89  -7.245  -8.858 -11.221
  740    H    GLU  90           H        GLU  90  -5.870 -12.655 -10.227
  741    HA   GLU  90           HA       GLU  90  -6.401 -14.161  -7.754
  742   1HB   GLU  90          1HB       GLU  90  -6.289 -16.303  -8.840
  743   2HB   GLU  90          2HB       GLU  90  -7.646 -15.365  -9.487
  744   1HG   GLU  90          1HG       GLU  90  -6.232 -14.791 -11.476
  745   2HG   GLU  90          2HG       GLU  90  -4.945 -15.828 -10.818
  746    HE2  GLU  90           HE       GLU  90  -8.340 -17.531 -12.275
  747    H    TYR  91           H        TYR  91  -4.579 -14.975  -6.804
  748    HA   TYR  91           HA       TYR  91  -2.345 -13.484  -7.035
  749   1HB   TYR  91          1HB       TYR  91  -1.355 -14.908  -5.463
  750   2HB   TYR  91          2HB       TYR  91  -3.063 -14.757  -5.093
  751    HD1  TYR  91           1HD      TYR  91  -4.636 -16.749  -5.869
  752    HD2  TYR  91           2HD      TYR  91  -0.335 -17.029  -5.622
  753    HE1  TYR  91           1HE      TYR  91  -4.804 -19.198  -5.728
  754    HE2  TYR  91           2HE      TYR  91  -0.511 -19.489  -5.477
  755    HH   TYR  91           HH       TYR  91  -1.929 -21.302  -5.339
  756    H    LYS  92           H        LYS  92  -0.446 -13.490  -8.072
  757    HA   LYS  92           HA       LYS  92   0.216 -15.478 -10.117
  758   1HB   LYS  92          1HB       LYS  92   0.878 -13.192 -10.512
  759   2HB   LYS  92          2HB       LYS  92   1.653 -13.068  -8.936
  760   1HG   LYS  92          1HG       LYS  92   3.276 -13.295 -10.783
  761   2HG   LYS  92          2HG       LYS  92   3.422 -14.567  -9.575
  762   1HD   LYS  92          1HD       LYS  92   3.698 -15.494 -11.791
  763   2HD   LYS  92          2HD       LYS  92   2.235 -16.153 -11.062
  764   1HE   LYS  92          1HE       LYS  92   0.880 -14.483 -12.396
  765   2HE   LYS  92          2HE       LYS  92   2.392 -13.932 -13.153
  766   1HZ   LYS  92          1HZ       LYS  92   1.346 -15.591 -14.519
  767   2HZ   LYS  92          2HZ       LYS  92   1.414 -16.715 -13.260
  768    H    GLY  93           H        GLY  93   1.596 -14.327  -6.993
  769   1HA   GLY  93          1HA       GLY  93   2.036 -16.940  -5.913
  770   2HA   GLY  93          2HA       GLY  93   3.540 -16.216  -6.525
  771    H    GLU  94           H        GLU  94   3.761 -16.478  -3.963
  772    HA   GLU  94           HA       GLU  94   2.505 -14.586  -2.279
  773   1HB   GLU  94          1HB       GLU  94   4.250 -15.096  -0.673
  774   2HB   GLU  94          2HB       GLU  94   3.367 -16.506  -1.271
  775   1HG   GLU  94          1HG       GLU  94   5.221 -17.188  -2.675
  776   2HG   GLU  94          2HG       GLU  94   6.130 -15.719  -2.298
  777    HE2  GLU  94           HE       GLU  94   7.604 -18.190  -0.189
  778    H    PHE  95           H        PHE  95   2.744 -12.531  -2.204
  779    HA   PHE  95           HA       PHE  95   4.884 -11.022  -3.465
  780   1HB   PHE  95          1HB       PHE  95   2.465 -10.345  -1.781
  781   2HB   PHE  95          2HB       PHE  95   3.708  -9.150  -2.107
  782    HD1  PHE  95           1HD      PHE  95   1.392 -11.534  -3.856
  783    HD2  PHE  95           2HD      PHE  95   3.797  -7.972  -4.172
  784    HE1  PHE  95           1HE      PHE  95   0.649 -11.246  -6.189
  785    HE2  PHE  95           2HE      PHE  95   3.047  -7.686  -6.515
  786    HZ   PHE  95           HZ       PHE  95   1.482  -9.319  -7.535
  787    H    GLU  96           H        GLU  96   4.331 -12.366  -0.281
  788    HA   GLU  96           HA       GLU  96   5.578 -12.527   1.570
  789   1HB   GLU  96          1HB       GLU  96   7.903 -11.769  -0.234
  790   2HB   GLU  96          2HB       GLU  96   7.999 -12.484   1.385
  791   1HG   GLU  96          1HG       GLU  96   6.621 -14.418   0.579
  792   2HG   GLU  96          2HG       GLU  96   6.683 -13.746  -1.058
  793    HE2  GLU  96           HE       GLU  96  10.184 -14.384  -1.408
  794    H    ASP  97           H        ASP  97   4.586 -10.992   2.760
  795    HA   ASP  97           HA       ASP  97   4.338  -9.185   4.059
  796   1HB   ASP  97          1HB       ASP  97   7.087  -8.188   3.207
  797   2HB   ASP  97          2HB       ASP  97   6.125  -7.660   4.581
  798    HD2  ASP  97           HD       ASP  97   8.230 -11.080   4.827
  799    H    PHE  98           H        PHE  98   4.497  -6.557   3.812
  800    HA   PHE  98           HA       PHE  98   3.491  -5.828   1.116
  801   1HB   PHE  98          1HB       PHE  98   1.732  -6.913   2.555
  802   2HB   PHE  98          2HB       PHE  98   1.894  -5.616   3.695
  803    HD1  PHE  98           1HD      PHE  98   2.132  -3.692   0.851
  804    HD2  PHE  98           2HD      PHE  98  -0.647  -6.288   2.863
  805    HE1  PHE  98           1HE      PHE  98   0.266  -2.637  -0.367
  806    HE2  PHE  98           2HE      PHE  98  -2.526  -5.176   1.676
  807    HZ   PHE  98           HZ       PHE  98  -2.073  -3.411   0.032
  808    H    GLU  99           H        GLU  99   5.260  -4.326   0.996
  809    HA   GLU  99           HA       GLU  99   5.167  -2.085   2.982
  810   1HB   GLU  99          1HB       GLU  99   7.134  -3.427   3.030
  811   2HB   GLU  99          2HB       GLU  99   7.498  -3.032   1.349
  812   1HG   GLU  99          1HG       GLU  99   7.772  -0.667   1.921
  813   2HG   GLU  99          2HG       GLU  99   7.083  -0.927   3.533
  814    HE2  GLU  99           HE       GLU  99  10.891  -2.154   2.716
  815    H    THR 100           H        THR 100   5.798   0.049   2.018
  816    HA   THR 100           HA       THR 100   4.315   0.470  -0.482
  817    HB   THR 100           HB       THR 100   3.823   2.558   0.323
  818    HG1  THR 100           1HG      THR 100   4.996   3.615   1.897
  819   1HG2  THR 100          1HG2      THR 100   3.033   2.283   2.646
  820   2HG2  THR 100          2HG2      THR 100   2.765   0.798   1.720
  821   3HG2  THR 100          3HG2      THR 100   4.093   0.901   2.895
  822    H    TYR 101           H        TYR 101   5.090   1.741  -2.194
  823    HA   TYR 101           HA       TYR 101   7.948   2.456  -2.405
  824   1HB   TYR 101          1HB       TYR 101   5.411   3.223  -3.833
  825   2HB   TYR 101          2HB       TYR 101   6.896   4.122  -4.088
  826    HD1  TYR 101           1HD      TYR 101   6.311   0.381  -3.898
  827    HD2  TYR 101           2HD      TYR 101   7.569   3.737  -6.281
  828    HE1  TYR 101           1HE      TYR 101   7.268  -1.169  -5.569
  829    HE2  TYR 101           2HE      TYR 101   8.502   2.193  -7.965
  830    HH   TYR 101           HH       TYR 101   8.848  -0.005  -8.565
  Start of MODEL    4
    1   1H    GLY  -1          1H        GLY  -1   3.775 -50.619  19.202
    2   2H    GLY  -1          2H        GLY  -1   2.219 -50.605  19.760
    3   3H    GLY  -1          3H        GLY  -1   2.561 -51.310  18.316
    4   1HA   GLY  -1          1HA       GLY  -1   2.811 -48.456  18.929
    5   2HA   GLY  -1          2HA       GLY  -1   3.188 -49.213  17.369
    6    H    SER   0           H        SER   0   1.451 -47.249  17.132
    7    HA   SER   0           HA       SER   0  -1.136 -48.558  16.562
    8   1HB   SER   0          1HB       SER   0  -0.869 -45.983  18.181
    9   2HB   SER   0          2HB       SER   0  -2.380 -46.696  17.583
   10    HG   SER   0           HG       SER   0  -1.808 -48.583  18.834
   11    H    MET   1           H        MET   1  -1.791 -47.993  14.585
   12    HA   MET   1           HA       MET   1  -0.456 -45.719  13.174
   13   1HB   MET   1          1HB       MET   1  -1.521 -48.375  12.121
   14   2HB   MET   1          2HB       MET   1  -0.916 -47.031  11.143
   15   1HG   MET   1          1HG       MET   1   0.876 -48.529  11.297
   16   2HG   MET   1          2HG       MET   1   1.279 -47.205  12.391
   17   1HE   MET   1          1HE       MET   1   2.964 -49.744  12.409
   18   2HE   MET   1          2HE       MET   1   3.046 -50.184  14.130
   19   3HE   MET   1          3HE       MET   1   3.170 -48.477  13.644
   20    H    LYS   2           H        LYS   2  -1.827 -44.046  13.198
   21    HA   LYS   2           HA       LYS   2  -4.730 -44.499  12.690
   22   1HB   LYS   2          1HB       LYS   2  -5.068 -42.308  13.750
   23   2HB   LYS   2          2HB       LYS   2  -4.512 -43.559  14.857
   24   1HG   LYS   2          1HG       LYS   2  -2.465 -41.688  13.630
   25   2HG   LYS   2          2HG       LYS   2  -3.542 -41.101  14.897
   26   1HD   LYS   2          1HD       LYS   2  -2.801 -42.854  16.443
   27   2HD   LYS   2          2HD       LYS   2  -1.746 -43.548  15.207
   28   1HE   LYS   2          1HE       LYS   2  -0.402 -42.205  16.687
   29   2HE   LYS   2          2HE       LYS   2  -0.467 -41.403  15.107
   30   1HZ   LYS   2          1HZ       LYS   2  -0.865 -39.801  16.834
   31   2HZ   LYS   2          2HZ       LYS   2  -2.197 -40.680  17.390
   32    H    LYS   3           H        LYS   3  -5.731 -43.286  11.116
   33    HA   LYS   3           HA       LYS   3  -4.446 -41.222   9.603
   34   1HB   LYS   3          1HB       LYS   3  -4.369 -42.403   7.465
   35   2HB   LYS   3          2HB       LYS   3  -3.189 -43.041   8.600
   36   1HG   LYS   3          1HG       LYS   3  -5.866 -44.389   7.972
   37   2HG   LYS   3          2HG       LYS   3  -4.334 -44.718   7.163
   38   1HD   LYS   3          1HD       LYS   3  -3.344 -45.314   9.431
   39   2HD   LYS   3          2HD       LYS   3  -5.005 -45.285  10.070
   40   1HE   LYS   3          1HE       LYS   3  -5.693 -46.988   8.435
   41   2HE   LYS   3          2HE       LYS   3  -4.042 -47.038   7.776
   42   1HZ   LYS   3          1HZ       LYS   3  -4.311 -48.771   9.397
   43   2HZ   LYS   3          2HZ       LYS   3  -4.687 -47.638  10.593
   44    H    TRP   4           H        TRP   4  -6.006 -40.047   8.495
   45    HA   TRP   4           HA       TRP   4  -8.757 -41.111   8.384
   46   1HB   TRP   4          1HB       TRP   4  -8.297 -39.935  10.543
   47   2HB   TRP   4          2HB       TRP   4  -7.920 -38.472   9.627
   48    HD1  TRP   4           HD       TRP   4  -9.957 -36.914   9.345
   49    HE1  TRP   4           1HE      TRP   4 -12.530 -37.163   9.319
   50    HE3  TRP   4           3HE      TRP   4 -10.302 -41.982   9.965
   51    HZ2  TRP   4           2HZ      TRP   4 -14.457 -39.279   9.497
   52    HZ3  TRP   4           3HZ      TRP   4 -12.490 -43.090   9.952
   53    HH2  TRP   4           HH       TRP   4 -14.590 -41.756   9.750
   54    H    SER   5           H        SER   5 -10.130 -39.938   7.073
   55    HA   SER   5           HA       SER   5  -9.093 -38.557   4.723
   56   1HB   SER   5          1HB       SER   5 -11.941 -38.947   5.750
   57   2HB   SER   5          2HB       SER   5 -11.473 -38.345   4.144
   58    HG   SER   5           HG       SER   5 -10.365 -40.363   3.860
   59    H    ASP   6           H        ASP   6  -7.895 -36.952   5.990
   60    HA   ASP   6           HA       ASP   6  -8.986 -35.095   7.752
   61   1HB   ASP   6          1HB       ASP   6  -6.580 -35.534   7.323
   62   2HB   ASP   6          2HB       ASP   6  -6.694 -34.672   5.784
   63    HD2  ASP   6           HD       ASP   6  -7.023 -31.494   7.360
   64    H    THR   7           H        THR   7  -8.462 -34.743   4.221
   65    HA   THR   7           HA       THR   7  -9.467 -33.559   2.610
   66    HB   THR   7           HB       THR   7 -11.872 -33.322   4.469
   67    HG1  THR   7           1HG      THR   7 -12.423 -35.320   3.640
   68   1HG2  THR   7          1HG2      THR   7 -13.126 -33.379   2.355
   69   2HG2  THR   7          2HG2      THR   7 -12.003 -32.008   2.357
   70   3HG2  THR   7          3HG2      THR   7 -11.612 -33.473   1.432
   71    H    GLU   8           H        GLU   8  -7.954 -31.874   2.703
   72    HA   GLU   8           HA       GLU   8  -8.973 -29.274   3.697
   73   1HB   GLU   8          1HB       GLU   8  -6.757 -28.757   4.666
   74   2HB   GLU   8          2HB       GLU   8  -7.686 -29.987   5.528
   75   1HG   GLU   8          1HG       GLU   8  -6.355 -31.780   4.510
   76   2HG   GLU   8          2HG       GLU   8  -5.459 -30.596   3.547
   77    HE2  GLU   8           HE       GLU   8  -3.070 -30.679   6.057
   78    H    VAL   9           H        VAL   9  -9.337 -29.733   1.197
   79    HA   VAL   9           HA       VAL   9  -7.246 -28.166  -0.200
   80    HB   VAL   9           HB       VAL   9  -6.622 -30.391  -0.687
   81   1HG1  VAL   9          1HG1      VAL   9  -9.423 -31.051  -1.687
   82   2HG1  VAL   9          2HG1      VAL   9  -7.989 -32.079  -1.725
   83   3HG1  VAL   9          3HG1      VAL   9  -8.704 -31.636  -0.172
   84   1HG2  VAL   9          1HG2      VAL   9  -8.139 -29.302  -3.088
   85   2HG2  VAL   9          2HG2      VAL   9  -6.551 -28.738  -2.525
   86   3HG2  VAL   9          3HG2      VAL   9  -6.751 -30.401  -3.105
   87    H    PHE  10           H        PHE  10  -8.535 -26.373  -0.120
   88    HA   PHE  10           HA       PHE  10 -11.014 -26.438  -1.781
   89   1HB   PHE  10          1HB       PHE  10 -10.660 -25.159   0.954
   90   2HB   PHE  10          2HB       PHE  10 -12.045 -24.933  -0.121
   91    HD1  PHE  10           1HD      PHE  10 -13.491 -26.936  -0.715
   92    HD2  PHE  10           2HD      PHE  10 -10.483 -27.091   2.375
   93    HE1  PHE  10           1HE      PHE  10 -14.518 -29.002   0.187
   94    HE2  PHE  10           2HE      PHE  10 -11.543 -29.132   3.293
   95    HZ   PHE  10           HZ       PHE  10 -13.559 -30.093   2.203
   96    H    GLU  11           H        GLU  11  -9.905 -23.595  -0.020
   97    HA   GLU  11           HA       GLU  11  -8.977 -22.375  -2.565
   98   1HB   GLU  11          1HB       GLU  11 -10.260 -20.485  -2.194
   99   2HB   GLU  11          2HB       GLU  11 -11.343 -21.863  -2.025
  100   1HG   GLU  11          1HG       GLU  11 -10.144 -20.213   0.244
  101   2HG   GLU  11          2HG       GLU  11 -11.786 -20.102  -0.372
  102    HE2  GLU  11           HE       GLU  11 -12.958 -22.922   1.302
  103    H    MET  12           H        MET  12  -8.030 -20.166  -2.024
  104    HA   MET  12           HA       MET  12  -6.240 -20.198   0.352
  105   1HB   MET  12          1HB       MET  12  -5.290 -19.682  -2.478
  106   2HB   MET  12          2HB       MET  12  -4.316 -19.763  -1.007
  107   1HG   MET  12          1HG       MET  12  -3.872 -21.806  -1.950
  108   2HG   MET  12          2HG       MET  12  -5.139 -22.201  -0.793
  109   1HE   MET  12          1HE       MET  12  -4.901 -24.549  -2.413
  110   2HE   MET  12          2HE       MET  12  -6.475 -24.762  -3.215
  111   3HE   MET  12          3HE       MET  12  -6.408 -24.200  -1.531
  112    H    LEU  13           H        LEU  13  -4.830 -17.977  -0.056
  113    HA   LEU  13           HA       LEU  13  -6.786 -15.794  -0.189
  114   1HB   LEU  13          1HB       LEU  13  -4.743 -14.382   0.103
  115   2HB   LEU  13          2HB       LEU  13  -5.285 -15.321   1.490
  116    HG   LEU  13           HG       LEU  13  -3.082 -16.444  -0.246
  117   1HD1  LEU  13          1HD1      LEU  13  -1.460 -15.154   1.149
  118   2HD1  LEU  13          2HD1      LEU  13  -2.454 -14.099   0.128
  119   3HD1  LEU  13          3HD1      LEU  13  -2.818 -14.251   1.860
  120   1HD2  LEU  13          1HD2      LEU  13  -2.328 -17.304   1.965
  121   2HD2  LEU  13          2HD2      LEU  13  -3.656 -16.445   2.767
  122   3HD2  LEU  13          3HD2      LEU  13  -3.997 -17.799   1.679
  123    H    LYS  14           H        LYS  14  -7.140 -14.535  -1.895
  124    HA   LYS  14           HA       LYS  14  -5.617 -15.060  -4.397
  125   1HB   LYS  14          1HB       LYS  14  -7.530 -14.427  -5.628
  126   2HB   LYS  14          2HB       LYS  14  -8.025 -15.575  -4.387
  127   1HG   LYS  14          1HG       LYS  14  -9.687 -14.044  -4.132
  128   2HG   LYS  14          2HG       LYS  14  -8.513 -13.377  -2.990
  129   1HD   LYS  14          1HD       LYS  14  -7.769 -11.959  -5.165
  130   2HD   LYS  14          2HD       LYS  14  -9.361 -12.426  -5.738
  131   1HE   LYS  14          1HE       LYS  14  -9.482 -10.253  -4.662
  132   2HE   LYS  14          2HE       LYS  14 -10.297 -11.441  -3.618
  133   1HZ   LYS  14          1HZ       LYS  14  -8.818 -10.083  -2.309
  134   2HZ   LYS  14          2HZ       LYS  14  -7.498 -10.584  -3.234
  135    H    ARG  15           H        ARG  15  -5.474 -13.142  -5.840
  136    HA   ARG  15           HA       ARG  15  -4.171 -10.970  -4.348
  137   1HB   ARG  15          1HB       ARG  15  -2.890 -12.293  -5.843
  138   2HB   ARG  15          2HB       ARG  15  -3.998 -11.974  -7.197
  139   1HG   ARG  15          1HG       ARG  15  -3.399  -9.623  -7.193
  140   2HG   ARG  15          2HG       ARG  15  -2.442  -9.834  -5.704
  141   1HD   ARG  15          1HD       ARG  15  -0.997 -11.473  -6.909
  142   2HD   ARG  15          2HD       ARG  15  -1.919 -11.177  -8.388
  143    HE   ARG  15           HE       ARG  15  -1.207  -8.760  -8.170
  144   1HH1  ARG  15          2HH1      ARG  15   0.935 -11.339  -6.893
  145   2HH1  ARG  15          1HH1      ARG  15   2.380 -10.462  -7.302
  146   1HH2  ARG  15          1HH2      ARG  15   0.715  -7.697  -8.717
  147   2HH2  ARG  15          2HH2      ARG  15   2.261  -8.406  -8.331
  148    H    MET  16           H        MET  16  -5.724  -9.400  -3.871
  149    HA   MET  16           HA       MET  16  -7.542  -8.336  -5.905
  150   1HB   MET  16          1HB       MET  16  -8.020  -8.138  -3.527
  151   2HB   MET  16          2HB       MET  16  -6.579  -7.141  -3.285
  152   1HG   MET  16          1HG       MET  16  -7.864  -5.674  -5.203
  153   2HG   MET  16          2HG       MET  16  -9.237  -6.523  -4.515
  154   1HE   MET  16          1HE       MET  16  -5.858  -4.971  -3.228
  155   2HE   MET  16          2HE       MET  16  -6.439  -3.473  -2.464
  156   3HE   MET  16          3HE       MET  16  -6.595  -3.715  -4.220
  157    H    TYR  17           H        TYR  17  -7.172  -6.576  -7.059
  158    HA   TYR  17           HA       TYR  17  -4.547  -5.166  -7.041
  159   1HB   TYR  17          1HB       TYR  17  -4.566  -6.646  -8.996
  160   2HB   TYR  17          2HB       TYR  17  -6.176  -6.109  -9.443
  161    HD1  TYR  17           1HD      TYR  17  -6.563  -3.791 -10.325
  162    HD2  TYR  17           2HD      TYR  17  -2.627  -5.457  -9.772
  163    HE1  TYR  17           1HE      TYR  17  -5.623  -2.102 -11.855
  164    HE2  TYR  17           2HE      TYR  17  -1.672  -3.673 -11.174
  165    HH   TYR  17           HH       TYR  17  -2.073  -1.676 -12.266
  166    H    ALA  18           H        ALA  18  -4.827  -2.954  -6.898
  167    HA   ALA  18           HA       ALA  18  -7.387  -1.824  -7.800
  168   1HB   ALA  18          1HB       ALA  18  -7.667  -0.490  -5.786
  169   2HB   ALA  18          2HB       ALA  18  -7.839  -2.228  -5.460
  170   3HB   ALA  18          3HB       ALA  18  -6.337  -1.381  -4.997
  171    H    ARG  19           H        ARG  19  -6.663  -0.591  -9.297
  172    HA   ARG  19           HA       ARG  19  -4.295   1.145  -9.006
  173   1HB   ARG  19          1HB       ARG  19  -5.167  -0.033 -11.175
  174   2HB   ARG  19          2HB       ARG  19  -6.240   1.359 -11.281
  175   1HG   ARG  19          1HG       ARG  19  -3.190   1.271 -11.177
  176   2HG   ARG  19          2HG       ARG  19  -4.222   1.781 -12.521
  177   1HD   ARG  19          1HD       ARG  19  -5.122   3.584 -10.925
  178   2HD   ARG  19          2HD       ARG  19  -3.778   3.227  -9.865
  179    HE   ARG  19           HE       ARG  19  -3.697   4.557 -12.463
  180   1HH1  ARG  19          1HH1      ARG  19  -1.785   2.773 -10.063
  181   2HH1  ARG  19          2HH1      ARG  19  -0.276   3.529 -10.501
  182   1HH2  ARG  19          1HH2      ARG  19  -1.664   5.517 -13.070
  183   2HH2  ARG  19          2HH2      ARG  19  -0.200   5.047 -12.243
  184    H    VAL  20           H        VAL  20  -4.716   2.606  -7.378
  185    HA   VAL  20           HA       VAL  20  -7.436   3.668  -7.021
  186    HB   VAL  20           HB       VAL  20  -4.945   4.486  -5.509
  187   1HG1  VAL  20          1HG1      VAL  20  -7.859   4.380  -4.651
  188   2HG1  VAL  20          2HG1      VAL  20  -6.505   5.113  -3.774
  189   3HG1  VAL  20          3HG1      VAL  20  -7.082   5.840  -5.286
  190   1HG2  VAL  20          1HG2      VAL  20  -6.766   2.109  -4.968
  191   2HG2  VAL  20          2HG2      VAL  20  -5.017   2.069  -5.281
  192   3HG2  VAL  20          3HG2      VAL  20  -5.626   2.796  -3.792
  193    H    TYR  21           H        TYR  21  -7.974   5.051  -8.653
  194    HA   TYR  21           HA       TYR  21  -6.015   6.851  -9.850
  195   1HB   TYR  21          1HB       TYR  21  -8.974   6.395 -10.272
  196   2HB   TYR  21          2HB       TYR  21  -8.044   7.561 -11.187
  197    HD1  TYR  21           1HD      TYR  21  -8.840   4.005 -10.820
  198    HD2  TYR  21           2HD      TYR  21  -6.070   6.785 -12.598
  199    HE1  TYR  21           1HE      TYR  21  -8.215   2.300 -12.482
  200    HE2  TYR  21           2HE      TYR  21  -5.366   5.037 -14.205
  201    HH   TYR  21           HH       TYR  21  -5.714   2.894 -14.980
  202    H    GLY  22           H        GLY  22  -6.063   9.069  -9.866
  203   1HA   GLY  22          1HA       GLY  22  -7.355  11.117  -9.409
  204   2HA   GLY  22          2HA       GLY  22  -7.665  10.490  -7.774
  205    H    LEU  23           H        LEU  23  -6.680  12.462  -7.029
  206    HA   LEU  23           HA       LEU  23  -3.762  12.751  -7.434
  207   1HB   LEU  23          1HB       LEU  23  -5.353  14.705  -7.554
  208   2HB   LEU  23          2HB       LEU  23  -5.598  14.504  -5.817
  209    HG   LEU  23           HG       LEU  23  -2.967  14.704  -5.667
  210   1HD1  LEU  23          1HD1      LEU  23  -1.990  16.102  -7.442
  211   2HD1  LEU  23          2HD1      LEU  23  -2.519  14.551  -8.107
  212   3HD1  LEU  23          3HD1      LEU  23  -3.498  16.009  -8.374
  213   1HD2  LEU  23          1HD2      LEU  23  -3.154  17.155  -5.553
  214   2HD2  LEU  23          2HD2      LEU  23  -4.718  17.087  -6.398
  215   3HD2  LEU  23          3HD2      LEU  23  -4.540  16.370  -4.780
  216    H    VAL  24           H        VAL  24  -4.430  10.379  -6.300
  217    HA   VAL  24           HA       VAL  24  -4.103  10.588  -3.360
  218    HB   VAL  24           HB       VAL  24  -4.494   8.151  -3.416
  219   1HG1  VAL  24          1HG1      VAL  24  -6.574   9.877  -4.813
  220   2HG1  VAL  24          2HG1      VAL  24  -6.889   8.306  -4.041
  221   3HG1  VAL  24          3HG1      VAL  24  -6.378   9.691  -3.065
  222   1HG2  VAL  24          1HG2      VAL  24  -5.296   8.466  -6.335
  223   2HG2  VAL  24          2HG2      VAL  24  -3.671   7.923  -5.887
  224   3HG2  VAL  24          3HG2      VAL  24  -5.088   6.994  -5.367
  225    H    GLN  25           H        GLN  25  -1.960  11.529  -4.974
  226    HA   GLN  25           HA       GLN  25   0.164   9.529  -4.496
  227   1HB   GLN  25          1HB       GLN  25  -0.474  11.011  -6.705
  228   2HB   GLN  25          2HB       GLN  25   0.786  11.995  -5.962
  229   1HG   GLN  25          1HG       GLN  25   1.809  10.427  -7.453
  230   2HG   GLN  25          2HG       GLN  25   2.217   9.930  -5.814
  231   1HE2  GLN  25          1HE2      GLN  25   2.600   8.031  -7.682
  232   2HE2  GLN  25          2HE2      GLN  25   1.300   6.868  -7.791
  233    H    GLY  26           H        GLY  26   2.094  10.112  -3.393
  234   1HA   GLY  26          1HA       GLY  26   3.529  11.348  -2.102
  235   2HA   GLY  26          2HA       GLY  26   2.477  12.757  -2.252
  236    H    VAL  27           H        VAL  27   0.177  12.131  -1.151
  237    HA   VAL  27           HA       VAL  27   0.377  12.330   1.592
  238    HB   VAL  27           HB       VAL  27  -1.868  11.284  -0.183
  239   1HG1  VAL  27          1HG1      VAL  27  -2.025  12.179   2.726
  240   2HG1  VAL  27          2HG1      VAL  27  -3.414  11.984   1.650
  241   3HG1  VAL  27          3HG1      VAL  27  -2.453  10.572   2.072
  242   1HG2  VAL  27          1HG2      VAL  27  -1.345  14.028   1.040
  243   2HG2  VAL  27          2HG2      VAL  27  -1.136  13.610  -0.672
  244   3HG2  VAL  27          3HG2      VAL  27  -2.746  13.583   0.047
  245    H    GLY  28           H        GLY  28  -0.044  10.913   3.369
  246   1HA   GLY  28          1HA       GLY  28   1.339   8.377   3.099
  247   2HA   GLY  28          2HA       GLY  28   0.728   9.128   4.575
  248    H    PHE  29           H        PHE  29  -1.197   8.292   1.662
  249    HA   PHE  29           HA       PHE  29  -3.145   6.807   3.175
  250   1HB   PHE  29          1HB       PHE  29  -4.162   6.373   1.065
  251   2HB   PHE  29          2HB       PHE  29  -3.637   8.061   1.100
  252    HD1  PHE  29           1HD      PHE  29  -3.040   4.726  -0.417
  253    HD2  PHE  29           2HD      PHE  29  -1.895   8.877  -0.419
  254    HE1  PHE  29           1HE      PHE  29  -1.142   4.194  -1.883
  255    HE2  PHE  29           2HE      PHE  29  -0.024   8.359  -1.956
  256    HZ   PHE  29           HZ       PHE  29   0.416   6.014  -2.631
  257    H    ARG  30           H        ARG  30  -0.267   6.016   1.235
  258    HA   ARG  30           HA       ARG  30  -0.591   3.253   0.973
  259   1HB   ARG  30          1HB       ARG  30   1.747   3.178   0.482
  260   2HB   ARG  30          2HB       ARG  30   1.073   4.650  -0.208
  261   1HG   ARG  30          1HG       ARG  30   1.972   5.899   1.842
  262   2HG   ARG  30          2HG       ARG  30   2.775   4.389   2.309
  263   1HD   ARG  30          1HD       ARG  30   4.409   5.691   1.131
  264   2HD   ARG  30          2HD       ARG  30   3.938   4.368   0.068
  265    HE   ARG  30           HE       ARG  30   3.048   5.828  -1.432
  266   1HH1  ARG  30          1HH1      ARG  30   3.591   7.603   1.621
  267   2HH1  ARG  30          2HH1      ARG  30   3.160   9.144   0.914
  268   1HH2  ARG  30          1HH2      ARG  30   2.455   7.883  -2.283
  269   2HH2  ARG  30          2HH2      ARG  30   2.602   9.299  -1.271
  270    H    LYS  31           H        LYS  31   0.417   5.158   3.744
  271    HA   LYS  31           HA       LYS  31   1.443   2.965   5.297
  272   1HB   LYS  31          1HB       LYS  31   2.103   5.408   5.505
  273   2HB   LYS  31          2HB       LYS  31   0.517   5.711   6.219
  274   1HG   LYS  31          1HG       LYS  31   1.012   4.076   8.028
  275   2HG   LYS  31          2HG       LYS  31   2.612   3.783   7.313
  276   1HD   LYS  31          1HD       LYS  31   3.230   6.137   7.656
  277   2HD   LYS  31          2HD       LYS  31   1.605   6.497   8.279
  278   1HE   LYS  31          1HE       LYS  31   1.963   4.931  10.165
  279   2HE   LYS  31          2HE       LYS  31   3.586   4.548   9.546
  280   1HZ   LYS  31          1HZ       LYS  31   3.761   6.241  11.211
  281   2HZ   LYS  31          2HZ       LYS  31   2.725   7.258  10.346
  282    H    PHE  32           H        PHE  32  -1.534   5.014   5.335
  283    HA   PHE  32           HA       PHE  32  -2.964   3.759   7.297
  284   1HB   PHE  32          1HB       PHE  32  -3.601   5.806   6.117
  285   2HB   PHE  32          2HB       PHE  32  -4.071   4.869   4.708
  286    HD1  PHE  32           1HD      PHE  32  -6.212   6.170   4.878
  287    HD2  PHE  32           2HD      PHE  32  -5.042   3.321   7.920
  288    HE1  PHE  32           1HE      PHE  32  -8.524   6.093   5.738
  289    HE2  PHE  32           2HE      PHE  32  -7.341   3.205   8.705
  290    HZ   PHE  32           HZ       PHE  32  -9.122   4.580   7.614
  291    H    VAL  33           H        VAL  33  -2.774   2.823   3.859
  292    HA   VAL  33           HA       VAL  33  -4.538   0.533   3.939
  293    HB   VAL  33           HB       VAL  33  -2.205   1.318   2.121
  294   1HG1  VAL  33          1HG1      VAL  33  -4.133  -1.022   1.812
  295   2HG1  VAL  33          2HG1      VAL  33  -3.043  -0.424   0.545
  296   3HG1  VAL  33          3HG1      VAL  33  -2.368  -1.122   2.016
  297   1HG2  VAL  33          1HG2      VAL  33  -5.221   1.306   1.650
  298   2HG2  VAL  33          2HG2      VAL  33  -4.223   2.753   1.909
  299   3HG2  VAL  33          3HG2      VAL  33  -3.985   1.767   0.465
  300    H    GLN  34           H        GLN  34  -1.207   1.110   4.830
  301    HA   GLN  34           HA       GLN  34  -0.469  -1.663   4.985
  302   1HB   GLN  34          1HB       GLN  34   0.921   0.791   5.032
  303   2HB   GLN  34          2HB       GLN  34   1.088   0.231   6.688
  304   1HG   GLN  34          1HG       GLN  34   2.941  -0.428   5.147
  305   2HG   GLN  34          2HG       GLN  34   2.153  -1.797   5.936
  306   1HE2  GLN  34          1HE2      GLN  34   0.866   0.062   3.094
  307   2HE2  GLN  34          2HE2      GLN  34   0.929  -1.315   2.010
  308    H    ILE  35           H        ILE  35  -1.159   0.726   7.603
  309    HA   ILE  35           HA       ILE  35  -1.082  -0.918   9.769
  310    HB   ILE  35           HB       ILE  35  -3.344   1.054   9.184
  311   1HG1  ILE  35          1HG1      ILE  35  -1.295   2.272   8.944
  312   2HG1  ILE  35          2HG1      ILE  35  -2.062   2.718  10.456
  313   1HG2  ILE  35          1HG2      ILE  35  -3.476   1.297  11.670
  314   2HG2  ILE  35          2HG2      ILE  35  -3.972  -0.289  11.091
  315   3HG2  ILE  35          3HG2      ILE  35  -2.376  -0.088  11.831
  316   1HD1  ILE  35          1HD1      ILE  35   0.327   2.507  10.772
  317   2HD1  ILE  35          2HD1      ILE  35  -0.480   1.224  11.689
  318   3HD1  ILE  35          3HD1      ILE  35   0.326   0.852  10.142
  319    H    HIS  36           H        HIS  36  -3.949  -0.739   7.629
  320    HA   HIS  36           HA       HIS  36  -5.391  -2.712   9.168
  321   1HB   HIS  36          1HB       HIS  36  -5.814  -1.366   6.497
  322   2HB   HIS  36          2HB       HIS  36  -6.805  -2.741   6.998
  323    HD2  HIS  36           2HD      HIS  36  -5.755   0.576   9.008
  324    HE1  HIS  36           1HE      HIS  36  -9.826  -0.341   9.678
  325    HE2  HIS  36           2HE      HIS  36  -7.938   1.284  10.235
  326    H    ALA  37           H        ALA  37  -3.855  -2.927   5.890
  327    HA   ALA  37           HA       ALA  37  -4.052  -5.575   5.392
  328   1HB   ALA  37          1HB       ALA  37  -1.909  -5.339   4.150
  329   2HB   ALA  37          2HB       ALA  37  -3.036  -3.995   3.875
  330   3HB   ALA  37          3HB       ALA  37  -1.637  -3.789   4.950
  331    H    ILE  38           H        ILE  38  -1.562  -4.116   7.455
  332    HA   ILE  38           HA       ILE  38  -0.097  -6.555   7.979
  333    HB   ILE  38           HB       ILE  38   0.071  -3.638   8.737
  334   1HG1  ILE  38          1HG1      ILE  38   2.404  -3.934   8.074
  335   2HG1  ILE  38          2HG1      ILE  38   2.195  -5.685   7.950
  336   1HG2  ILE  38          1HG2      ILE  38   1.824  -3.997  10.376
  337   2HG2  ILE  38          2HG2      ILE  38   0.241  -4.512  10.946
  338   3HG2  ILE  38          3HG2      ILE  38   1.435  -5.732  10.422
  339   1HD1  ILE  38          1HD1      ILE  38   2.232  -4.511   5.759
  340   2HD1  ILE  38          2HD1      ILE  38   0.723  -5.405   5.998
  341   3HD1  ILE  38          3HD1      ILE  38   0.757  -3.642   6.199
  342    H    ARG  39           H        ARG  39  -2.612  -4.668   9.722
  343    HA   ARG  39           HA       ARG  39  -2.505  -6.342  12.072
  344   1HB   ARG  39          1HB       ARG  39  -3.354  -3.990  11.955
  345   2HB   ARG  39          2HB       ARG  39  -4.718  -4.519  10.958
  346   1HG   ARG  39          1HG       ARG  39  -4.185  -5.841  13.611
  347   2HG   ARG  39          2HG       ARG  39  -4.832  -4.187  13.583
  348   1HD   ARG  39          1HD       ARG  39  -6.768  -4.872  12.285
  349   2HD   ARG  39          2HD       ARG  39  -6.169  -6.538  12.181
  350    HE   ARG  39           HE       ARG  39  -6.328  -5.731  14.915
  351   1HH1  ARG  39          1HH1      ARG  39  -8.412  -6.663  12.201
  352   2HH1  ARG  39          2HH1      ARG  39  -9.679  -7.295  13.222
  353   1HH2  ARG  39          1HH2      ARG  39  -7.994  -6.552  16.247
  354   2HH2  ARG  39          2HH2      ARG  39  -9.441  -7.224  15.539
  355    H    LEU  40           H        LEU  40  -4.144  -6.534   8.979
  356    HA   LEU  40           HA       LEU  40  -5.804  -8.794   9.851
  357   1HB   LEU  40          1HB       LEU  40  -5.596  -7.243   7.275
  358   2HB   LEU  40          2HB       LEU  40  -6.794  -8.501   7.598
  359    HG   LEU  40           HG       LEU  40  -6.520  -6.023   9.383
  360   1HD1  LEU  40          1HD1      LEU  40  -8.405  -5.110   8.117
  361   2HD1  LEU  40          2HD1      LEU  40  -6.958  -5.308   7.106
  362   3HD1  LEU  40          3HD1      LEU  40  -8.283  -6.478   6.972
  363   1HD2  LEU  40          1HD2      LEU  40  -8.833  -6.592  10.009
  364   2HD2  LEU  40          2HD2      LEU  40  -8.740  -8.071   9.025
  365   3HD2  LEU  40          3HD2      LEU  40  -7.705  -7.874  10.456
  366    H    GLY  41           H        GLY  41  -2.610  -8.609   8.803
  367   1HA   GLY  41          1HA       GLY  41  -1.159 -10.229   8.139
  368   2HA   GLY  41          2HA       GLY  41  -2.442 -11.422   8.393
  369    H    ILE  42           H        ILE  42  -1.711  -8.727   6.134
  370    HA   ILE  42           HA       ILE  42  -2.452 -10.417   3.790
  371    HB   ILE  42           HB       ILE  42  -2.752  -7.435   4.228
  372   1HG1  ILE  42          1HG1      ILE  42  -4.402  -8.668   5.534
  373   2HG1  ILE  42          2HG1      ILE  42  -5.126  -7.745   4.210
  374   1HG2  ILE  42          1HG2      ILE  42  -4.104  -7.490   2.127
  375   2HG2  ILE  42          2HG2      ILE  42  -2.384  -7.778   1.889
  376   3HG2  ILE  42          3HG2      ILE  42  -3.514  -9.136   1.843
  377   1HD1  ILE  42          1HD1      ILE  42  -6.168  -9.961   4.504
  378   2HD1  ILE  42          2HD1      ILE  42  -5.448  -9.751   2.902
  379   3HD1  ILE  42          3HD1      ILE  42  -4.632 -10.754   4.126
  380    H    LYS  43           H        LYS  43  -1.118 -10.345   2.073
  381    HA   LYS  43           HA       LYS  43   1.564  -9.041   2.379
  382   1HB   LYS  43          1HB       LYS  43   0.854 -11.319   0.536
  383   2HB   LYS  43          2HB       LYS  43   2.445 -10.663   0.911
  384   1HG   LYS  43          1HG       LYS  43   2.095 -11.299   3.325
  385   2HG   LYS  43          2HG       LYS  43   0.603 -12.131   2.859
  386   1HD   LYS  43          1HD       LYS  43   1.872 -13.586   1.322
  387   2HD   LYS  43          2HD       LYS  43   3.387 -12.803   1.817
  388   1HE   LYS  43          1HE       LYS  43   1.492 -14.321   3.673
  389   2HE   LYS  43          2HE       LYS  43   3.003 -14.958   2.998
  390   1HZ   LYS  43          1HZ       LYS  43   2.764 -12.694   4.867
  391   2HZ   LYS  43          2HZ       LYS  43   4.200 -13.253   4.178
  392    H    GLY  44           H        GLY  44   2.430  -8.284   0.108
  393   1HA   GLY  44          1HA       GLY  44   0.982  -7.843  -2.142
  394   2HA   GLY  44          2HA       GLY  44   0.240  -6.679  -1.024
  395    H    TYR  45           H        TYR  45   0.778  -4.868  -2.142
  396    HA   TYR  45           HA       TYR  45   3.137  -3.689  -1.207
  397   1HB   TYR  45          1HB       TYR  45   3.577  -5.041  -3.648
  398   2HB   TYR  45          2HB       TYR  45   3.436  -3.347  -4.078
  399    HD1  TYR  45           1HD      TYR  45   4.890  -1.621  -2.879
  400    HD2  TYR  45           2HD      TYR  45   5.625  -5.867  -2.830
  401    HE1  TYR  45           1HE      TYR  45   7.213  -1.225  -2.101
  402    HE2  TYR  45           2HE      TYR  45   8.000  -5.452  -2.268
  403    HH   TYR  45           HH       TYR  45   9.544  -3.881  -1.565
  404    H    ALA  46           H        ALA  46   2.855  -1.567  -1.157
  405    HA   ALA  46           HA       ALA  46   0.596  -0.260  -2.609
  406   1HB   ALA  46          1HB       ALA  46   0.921   1.545  -0.931
  407   2HB   ALA  46          2HB       ALA  46   0.460  -0.009  -0.234
  408   3HB   ALA  46          3HB       ALA  46   2.136   0.541  -0.119
  409    H    LYS  47           H        LYS  47   1.674   0.014  -4.650
  410    HA   LYS  47           HA       LYS  47   4.371   1.171  -4.659
  411   1HB   LYS  47          1HB       LYS  47   3.974  -0.976  -5.686
  412   2HB   LYS  47          2HB       LYS  47   2.721  -0.266  -6.691
  413   1HG   LYS  47          1HG       LYS  47   4.558   1.217  -7.732
  414   2HG   LYS  47          2HG       LYS  47   5.707   0.308  -6.734
  415   1HD   LYS  47          1HD       LYS  47   5.761  -0.573  -8.943
  416   2HD   LYS  47          2HD       LYS  47   5.051  -1.792  -7.871
  417   1HE   LYS  47          1HE       LYS  47   2.800  -1.275  -8.725
  418   2HE   LYS  47          2HE       LYS  47   3.436   0.087  -9.670
  419   1HZ   LYS  47          1HZ       LYS  47   3.219  -1.826 -11.069
  420   2HZ   LYS  47          2HZ       LYS  47   4.258  -2.715 -10.075
  421    H    ASN  48           H        ASN  48   3.993   3.321  -4.283
  422    HA   ASN  48           HA       ASN  48   2.214   4.951  -5.909
  423   1HB   ASN  48          1HB       ASN  48   2.673   5.389  -3.529
  424   2HB   ASN  48          2HB       ASN  48   4.378   5.675  -3.883
  425   1HD2  ASN  48          2HD2      ASN  48   4.860   7.446  -5.501
  426   2HD2  ASN  48          1HD2      ASN  48   3.889   8.902  -5.379
  427    H    LEU  49           H        LEU  49   2.890   4.663  -8.042
  428    HA   LEU  49           HA       LEU  49   5.509   5.036  -9.109
  429   1HB   LEU  49          1HB       LEU  49   2.762   5.434 -10.304
  430   2HB   LEU  49          2HB       LEU  49   4.267   5.343 -11.222
  431    HG   LEU  49           HG       LEU  49   3.215   3.093  -9.447
  432   1HD1  LEU  49          1HD1      LEU  49   2.329   2.071 -11.426
  433   2HD1  LEU  49          2HD1      LEU  49   1.675   3.711 -11.353
  434   3HD1  LEU  49          3HD1      LEU  49   3.007   3.345 -12.469
  435   1HD2  LEU  49          1HD2      LEU  49   4.764   1.702 -10.848
  436   2HD2  LEU  49          2HD2      LEU  49   5.383   3.187 -11.592
  437   3HD2  LEU  49          3HD2      LEU  49   5.624   2.886  -9.857
  438    HA   PRO  50           HA       PRO  50   4.932   9.288  -7.762
  439   1HB   PRO  50          1HB       PRO  50   7.458  10.164  -7.506
  440   2HB   PRO  50          2HB       PRO  50   6.866   8.751  -6.592
  441   1HG   PRO  50          1HG       PRO  50   8.357   8.682  -9.241
  442   2HG   PRO  50          2HG       PRO  50   8.832   7.867  -7.720
  443   1HD   PRO  50          1HD       PRO  50   7.346   6.585  -9.643
  444   2HD   PRO  50          2HD       PRO  50   7.068   6.306  -7.906
  445    H    ASP  51           H        ASP  51   4.330   8.902 -10.516
  446    HA   ASP  51           HA       ASP  51   4.432  11.653 -11.284
  447   1HB   ASP  51          1HB       ASP  51   6.608  10.810 -12.275
  448   2HB   ASP  51          2HB       ASP  51   5.680   9.626 -13.202
  449    HD2  ASP  51           HD       ASP  51   5.783  12.044 -15.712
  450    H    GLY  52           H        GLY  52   2.354  10.084 -10.374
  451   1HA   GLY  52          1HA       GLY  52   0.355  10.318 -12.306
  452   2HA   GLY  52          2HA       GLY  52   0.957   8.643 -12.371
  453    H    SER  53           H        SER  53  -0.556   7.507 -11.388
  454    HA   SER  53           HA       SER  53  -1.560   8.258  -8.676
  455   1HB   SER  53          1HB       SER  53  -2.921   6.682 -10.874
  456   2HB   SER  53          2HB       SER  53  -3.531   6.896  -9.225
  457    HG   SER  53           HG       SER  53  -3.543   9.145  -9.598
  458    H    VAL  54           H        VAL  54  -2.188   6.228  -7.412
  459    HA   VAL  54           HA       VAL  54   0.236   4.560  -7.319
  460    HB   VAL  54           HB       VAL  54  -0.278   5.822  -5.353
  461   1HG1  VAL  54          1HG1      VAL  54  -2.809   4.191  -4.932
  462   2HG1  VAL  54          2HG1      VAL  54  -2.242   5.595  -4.019
  463   3HG1  VAL  54          3HG1      VAL  54  -2.850   5.811  -5.650
  464   1HG2  VAL  54          1HG2      VAL  54  -0.919   2.907  -4.713
  465   2HG2  VAL  54          2HG2      VAL  54   0.666   3.425  -5.268
  466   3HG2  VAL  54          3HG2      VAL  54   0.036   4.058  -3.766
  467    H    GLU  55           H        GLU  55   0.319   2.439  -7.622
  468    HA   GLU  55           HA       GLU  55  -2.146   0.881  -8.117
  469   1HB   GLU  55          1HB       GLU  55  -0.350   0.840  -9.765
  470   2HB   GLU  55          2HB       GLU  55   0.792   0.250  -8.550
  471   1HG   GLU  55          1HG       GLU  55  -0.563  -1.806  -8.259
  472   2HG   GLU  55          2HG       GLU  55  -1.755  -1.194  -9.419
  473    HE2  GLU  55           HE       GLU  55   0.525  -1.598 -12.177
  474    H    VAL  56           H        VAL  56  -2.943  -0.290  -6.408
  475    HA   VAL  56           HA       VAL  56  -1.120  -1.291  -4.260
  476    HB   VAL  56           HB       VAL  56  -4.126  -0.891  -4.301
  477   1HG1  VAL  56          1HG1      VAL  56  -2.264  -1.915  -2.113
  478   2HG1  VAL  56          2HG1      VAL  56  -3.952  -1.434  -1.850
  479   3HG1  VAL  56          3HG1      VAL  56  -3.589  -2.816  -2.883
  480   1HG2  VAL  56          1HG2      VAL  56  -1.897   0.556  -2.783
  481   2HG2  VAL  56          2HG2      VAL  56  -2.862   1.247  -4.105
  482   3HG2  VAL  56          3HG2      VAL  56  -3.636   0.839  -2.567
  483    H    VAL  57           H        VAL  57  -1.079  -3.500  -3.858
  484    HA   VAL  57           HA       VAL  57  -2.874  -5.308  -5.358
  485    HB   VAL  57           HB       VAL  57  -0.773  -6.745  -5.834
  486   1HG1  VAL  57          1HG1      VAL  57  -1.256  -4.263  -7.513
  487   2HG1  VAL  57          2HG1      VAL  57  -0.520  -5.785  -8.038
  488   3HG1  VAL  57          3HG1      VAL  57  -2.220  -5.760  -7.541
  489   1HG2  VAL  57          1HG2      VAL  57   0.574  -3.994  -5.790
  490   2HG2  VAL  57          2HG2      VAL  57   0.923  -5.322  -4.661
  491   3HG2  VAL  57          3HG2      VAL  57   1.266  -5.500  -6.389
  492    H    ALA  58           H        ALA  58  -3.896  -5.695  -3.392
  493    HA   ALA  58           HA       ALA  58  -2.339  -6.700  -1.092
  494   1HB   ALA  58          1HB       ALA  58  -4.444  -6.486   0.099
  495   2HB   ALA  58          2HB       ALA  58  -4.142  -4.991  -0.823
  496   3HB   ALA  58          3HB       ALA  58  -5.322  -6.194  -1.405
  497    H    GLU  59           H        GLU  59  -2.431  -8.807  -0.370
  498    HA   GLU  59           HA       GLU  59  -3.767 -10.791  -2.118
  499   1HB   GLU  59          1HB       GLU  59  -1.193 -10.946  -0.599
  500   2HB   GLU  59          2HB       GLU  59  -1.906 -12.183  -1.646
  501   1HG   GLU  59          1HG       GLU  59  -1.918 -10.504  -3.529
  502   2HG   GLU  59          2HG       GLU  59  -1.027  -9.379  -2.494
  503    HE2  GLU  59           HE       GLU  59   0.981 -11.987  -4.602
  504    H    GLY  60           H        GLY  60  -5.698 -11.386  -0.909
  505   1HA   GLY  60          1HA       GLY  60  -5.217 -12.738   1.692
  506   2HA   GLY  60          2HA       GLY  60  -6.310 -11.353   1.667
  507    H    TYR  61           H        TYR  61  -7.066 -13.877   2.479
  508    HA   TYR  61           HA       TYR  61  -8.882 -15.100   0.585
  509   1HB   TYR  61          1HB       TYR  61  -8.598 -14.978   3.605
  510   2HB   TYR  61          2HB       TYR  61  -9.926 -15.792   2.814
  511    HD1  TYR  61           1HD      TYR  61  -6.347 -16.022   3.604
  512    HD2  TYR  61           2HD      TYR  61  -9.667 -17.892   1.580
  513    HE1  TYR  61           1HE      TYR  61  -5.275 -18.236   3.881
  514    HE2  TYR  61           2HE      TYR  61  -8.614 -20.110   1.931
  515    HH   TYR  61           HH       TYR  61  -6.774 -21.251   2.659
  516    H    GLU  62           H        GLU  62 -11.357 -14.893   1.239
  517    HA   GLU  62           HA       GLU  62 -11.929 -12.064   0.727
  518   1HB   GLU  62          1HB       GLU  62 -13.834 -14.411   0.933
  519   2HB   GLU  62          2HB       GLU  62 -14.225 -12.756   0.410
  520   1HG   GLU  62          1HG       GLU  62 -12.567 -12.992  -1.467
  521   2HG   GLU  62          2HG       GLU  62 -12.356 -14.697  -1.032
  522    HE2  GLU  62           HE       GLU  62 -15.662 -15.568  -2.077
  523    H    GLU  63           H        GLU  63 -12.479 -14.395   3.370
  524    HA   GLU  63           HA       GLU  63 -13.963 -13.066   5.156
  525   1HB   GLU  63          1HB       GLU  63 -12.690 -14.184   6.888
  526   2HB   GLU  63          2HB       GLU  63 -13.033 -15.227   5.501
  527   1HG   GLU  63          1HG       GLU  63 -10.700 -14.753   4.653
  528   2HG   GLU  63          2HG       GLU  63 -10.368 -13.915   6.168
  529    HE2  GLU  63           HE       GLU  63 -10.338 -16.884   8.088
  530    H    ALA  64           H        ALA  64 -10.541 -12.329   4.387
  531    HA   ALA  64           HA       ALA  64 -10.577  -9.899   6.132
  532   1HB   ALA  64          1HB       ALA  64  -8.158 -10.081   6.094
  533   2HB   ALA  64          2HB       ALA  64  -8.874 -11.605   6.644
  534   3HB   ALA  64          3HB       ALA  64  -8.250 -11.470   4.985
  535    H    LEU  65           H        LEU  65 -11.205 -10.631   2.886
  536    HA   LEU  65           HA       LEU  65  -9.600  -8.536   1.678
  537   1HB   LEU  65          1HB       LEU  65 -10.440 -10.349   0.328
  538   2HB   LEU  65          2HB       LEU  65 -12.123  -9.858   0.683
  539    HG   LEU  65           HG       LEU  65 -11.790  -7.735  -0.425
  540   1HD1  LEU  65          1HD1      LEU  65  -9.677  -7.414  -1.826
  541   2HD1  LEU  65          2HD1      LEU  65  -9.433  -7.201  -0.095
  542   3HD1  LEU  65          3HD1      LEU  65  -8.927  -8.712  -0.874
  543   1HD2  LEU  65          1HD2      LEU  65 -11.444  -8.688  -2.731
  544   2HD2  LEU  65          2HD2      LEU  65 -10.938 -10.199  -1.930
  545   3HD2  LEU  65          3HD2      LEU  65 -12.586  -9.590  -1.704
  546    H    SER  66           H        SER  66 -13.099  -8.871   2.371
  547    HA   SER  66           HA       SER  66 -14.074  -6.363   2.055
  548   1HB   SER  66          1HB       SER  66 -15.701  -6.941   3.852
  549   2HB   SER  66          2HB       SER  66 -15.438  -8.260   2.699
  550    HG   SER  66           HG       SER  66 -14.074  -9.251   4.199
  551    H    LYS  67           H        LYS  67 -12.450  -7.531   4.983
  552    HA   LYS  67           HA       LYS  67 -12.600  -5.311   6.624
  553   1HB   LYS  67          1HB       LYS  67 -10.339  -7.323   6.419
  554   2HB   LYS  67          2HB       LYS  67 -10.711  -6.309   7.823
  555   1HG   LYS  67          1HG       LYS  67 -12.440  -8.539   6.666
  556   2HG   LYS  67          2HG       LYS  67 -11.506  -8.567   8.161
  557   1HD   LYS  67          1HD       LYS  67 -12.955  -6.745   9.072
  558   2HD   LYS  67          2HD       LYS  67 -13.937  -6.815   7.588
  559   1HE   LYS  67          1HE       LYS  67 -14.478  -9.172   8.000
  560   2HE   LYS  67          2HE       LYS  67 -13.484  -9.162   9.475
  561   1HZ   LYS  67          1HZ       LYS  67 -15.769  -8.771  10.046
  562   2HZ   LYS  67          2HZ       LYS  67 -15.815  -7.398   9.063
  563    H    LEU  68           H        LEU  68 -10.326  -5.804   3.931
  564    HA   LEU  68           HA       LEU  68  -8.908  -3.255   4.434
  565   1HB   LEU  68          1HB       LEU  68  -7.489  -4.937   3.602
  566   2HB   LEU  68          2HB       LEU  68  -8.679  -5.508   2.434
  567    HG   LEU  68           HG       LEU  68  -8.397  -3.512   1.050
  568   1HD1  LEU  68          1HD1      LEU  68  -6.572  -1.934   1.452
  569   2HD1  LEU  68          2HD1      LEU  68  -7.736  -1.837   2.775
  570   3HD1  LEU  68          3HD1      LEU  68  -6.207  -2.710   3.012
  571   1HD2  LEU  68          1HD2      LEU  68  -6.149  -4.002   0.250
  572   2HD2  LEU  68          2HD2      LEU  68  -5.781  -4.879   1.753
  573   3HD2  LEU  68          3HD2      LEU  68  -7.027  -5.493   0.640
  574    H    LEU  69           H        LEU  69 -10.912  -4.752   1.856
  575    HA   LEU  69           HA       LEU  69 -10.997  -2.788   0.142
  576   1HB   LEU  69          1HB       LEU  69 -11.991  -5.210   0.238
  577   2HB   LEU  69          2HB       LEU  69 -13.498  -4.432   0.681
  578    HG   LEU  69           HG       LEU  69 -13.413  -5.012  -1.600
  579   1HD1  LEU  69          1HD1      LEU  69 -14.019  -2.921  -2.683
  580   2HD1  LEU  69          2HD1      LEU  69 -14.542  -2.836  -0.985
  581   3HD1  LEU  69          3HD1      LEU  69 -13.060  -2.000  -1.510
  582   1HD2  LEU  69          1HD2      LEU  69 -11.837  -4.191  -3.244
  583   2HD2  LEU  69          2HD2      LEU  69 -10.985  -3.223  -2.033
  584   3HD2  LEU  69          3HD2      LEU  69 -10.964  -4.999  -1.929
  585    H    GLU  70           H        GLU  70 -13.499  -3.253   2.681
  586    HA   GLU  70           HA       GLU  70 -15.032  -0.914   2.073
  587   1HB   GLU  70          1HB       GLU  70 -14.905  -2.650   4.578
  588   2HB   GLU  70          2HB       GLU  70 -16.159  -1.448   4.229
  589   1HG   GLU  70          1HG       GLU  70 -16.824  -2.690   2.200
  590   2HG   GLU  70          2HG       GLU  70 -15.592  -3.922   2.523
  591    HE2  GLU  70           HE       GLU  70 -17.328  -5.042   5.500
  592    H    ARG  71           H        ARG  71 -12.384  -1.585   4.340
  593    HA   ARG  71           HA       ARG  71 -12.239   0.698   5.931
  594   1HB   ARG  71          1HB       ARG  71 -10.515  -0.442   6.588
  595   2HB   ARG  71          2HB       ARG  71 -10.580  -1.456   5.168
  596   1HG   ARG  71          1HG       ARG  71  -8.409  -0.723   5.204
  597   2HG   ARG  71          2HG       ARG  71  -9.144   0.290   3.975
  598   1HD   ARG  71          1HD       ARG  71  -9.484   2.013   5.915
  599   2HD   ARG  71          2HD       ARG  71  -8.446   0.970   6.851
  600    HE   ARG  71           HE       ARG  71  -6.578   1.488   5.575
  601   1HH1  ARG  71          1HH1      ARG  71  -9.446   3.203   4.319
  602   2HH1  ARG  71          2HH1      ARG  71  -8.524   4.131   3.181
  603   1HH2  ARG  71          1HH2      ARG  71  -5.429   2.655   3.977
  604   2HH2  ARG  71          2HH2      ARG  71  -6.253   3.807   2.959
  605    H    ILE  72           H        ILE  72 -11.246   0.345   2.561
  606    HA   ILE  72           HA       ILE  72 -10.419   3.130   2.266
  607    HB   ILE  72           HB       ILE  72 -11.042   1.006   0.209
  608   1HG1  ILE  72          1HG1      ILE  72  -8.322   2.222   0.812
  609   2HG1  ILE  72          2HG1      ILE  72  -8.929   0.930   1.836
  610   1HG2  ILE  72          1HG2      ILE  72  -9.911   2.553  -1.413
  611   2HG2  ILE  72          2HG2      ILE  72 -11.444   3.187  -0.827
  612   3HG2  ILE  72          3HG2      ILE  72  -9.919   3.815  -0.168
  613   1HD1  ILE  72          1HD1      ILE  72  -7.557   0.000   0.049
  614   2HD1  ILE  72          2HD1      ILE  72  -9.236  -0.565  -0.070
  615   3HD1  ILE  72          3HD1      ILE  72  -8.638   0.688  -1.179
  616    H    LYS  73           H        LYS  73 -13.282   1.467   0.888
  617    HA   LYS  73           HA       LYS  73 -14.377   3.736  -0.159
  618   1HB   LYS  73          1HB       LYS  73 -15.696   1.183   0.742
  619   2HB   LYS  73          2HB       LYS  73 -16.629   2.528   0.080
  620   1HG   LYS  73          1HG       LYS  73 -16.177   1.124  -1.742
  621   2HG   LYS  73          2HG       LYS  73 -15.168   2.560  -1.952
  622   1HD   LYS  73          1HD       LYS  73 -13.222   1.228  -1.011
  623   2HD   LYS  73          2HD       LYS  73 -14.301  -0.179  -0.951
  624   1HE   LYS  73          1HE       LYS  73 -13.472   1.430  -3.423
  625   2HE   LYS  73          2HE       LYS  73 -12.759  -0.110  -2.928
  626   1HZ   LYS  73          1HZ       LYS  73 -14.434  -0.525  -4.565
  627   2HZ   LYS  73          2HZ       LYS  73 -15.611   0.229  -3.618
  628    H    GLN  74           H        GLN  74 -15.166   2.367   3.063
  629    HA   GLN  74           HA       GLN  74 -16.607   4.826   3.873
  630   1HB   GLN  74          1HB       GLN  74 -17.490   2.426   4.149
  631   2HB   GLN  74          2HB       GLN  74 -16.283   2.243   5.430
  632   1HG   GLN  74          1HG       GLN  74 -17.354   4.240   6.592
  633   2HG   GLN  74          2HG       GLN  74 -18.544   4.298   5.285
  634   1HE2  GLN  74          1HE2      GLN  74 -19.636   4.112   7.690
  635   2HE2  GLN  74          2HE2      GLN  74 -20.178   2.486   8.048
  636    H    GLY  75           H        GLY  75 -13.716   4.987   3.424
  637   1HA   GLY  75          1HA       GLY  75 -12.974   6.407   5.774
  638   2HA   GLY  75          2HA       GLY  75 -12.218   4.820   5.811
  639    HA   PRO  76           HA       PRO  76 -11.118   6.750   1.533
  640   1HB   PRO  76          1HB       PRO  76 -10.932   9.556   1.399
  641   2HB   PRO  76          2HB       PRO  76 -12.350   8.569   0.948
  642   1HG   PRO  76          1HG       PRO  76 -11.789   9.956   3.572
  643   2HG   PRO  76          2HG       PRO  76 -13.308   9.965   2.624
  644   1HD   PRO  76          1HD       PRO  76 -12.997   8.338   4.738
  645   2HD   PRO  76          2HD       PRO  76 -13.799   7.710   3.265
  646    HA   PRO  77           HA       PRO  77  -6.891   6.894   2.386
  647   1HB   PRO  77          1HB       PRO  77  -5.720   8.028   0.128
  648   2HB   PRO  77          2HB       PRO  77  -6.474   6.409   0.193
  649   1HG   PRO  77          1HG       PRO  77  -7.705   9.017  -0.722
  650   2HG   PRO  77          2HG       PRO  77  -7.705   7.440  -1.569
  651   1HD   PRO  77          1HD       PRO  77  -9.826   8.221  -0.116
  652   2HD   PRO  77          2HD       PRO  77  -9.272   6.526  -0.024
  653    H    ALA  78           H        ALA  78  -8.475   9.858   2.419
  654    HA   ALA  78           HA       ALA  78  -8.099  11.851   3.327
  655   1HB   ALA  78          1HB       ALA  78  -6.249  12.352   4.769
  656   2HB   ALA  78          2HB       ALA  78  -6.808  10.710   5.127
  657   3HB   ALA  78          3HB       ALA  78  -5.315  10.964   4.197
  658    H    ALA  79           H        ALA  79  -7.553  11.017   0.594
  659    HA   ALA  79           HA       ALA  79  -6.131  13.411  -0.342
  660   1HB   ALA  79          1HB       ALA  79  -5.013  12.013  -2.034
  661   2HB   ALA  79          2HB       ALA  79  -4.419  11.690  -0.391
  662   3HB   ALA  79          3HB       ALA  79  -5.532  10.544  -1.156
  663    H    GLU  80           H        GLU  80  -6.706  13.719  -2.682
  664    HA   GLU  80           HA       GLU  80  -9.563  13.337  -3.010
  665   1HB   GLU  80          1HB       GLU  80  -7.523  14.647  -4.833
  666   2HB   GLU  80          2HB       GLU  80  -9.281  14.731  -5.006
  667   1HG   GLU  80          1HG       GLU  80  -9.428  15.830  -2.773
  668   2HG   GLU  80          2HG       GLU  80  -7.662  15.786  -2.638
  669    HE2  GLU  80           HE       GLU  80  -9.424  18.647  -4.789
  670    H    VAL  81           H        VAL  81  -9.568  11.011  -3.077
  671    HA   VAL  81           HA       VAL  81  -8.680   9.557  -5.406
  672    HB   VAL  81           HB       VAL  81  -9.191   8.535  -3.222
  673   1HG1  VAL  81          1HG1      VAL  81 -12.143   8.942  -3.835
  674   2HG1  VAL  81          2HG1      VAL  81 -11.437   8.069  -2.470
  675   3HG1  VAL  81          3HG1      VAL  81 -11.229   9.821  -2.588
  676   1HG2  VAL  81          1HG2      VAL  81 -10.921   7.452  -5.490
  677   2HG2  VAL  81          2HG2      VAL  81  -9.180   7.168  -5.286
  678   3HG2  VAL  81          3HG2      VAL  81 -10.326   6.540  -4.089
  679    H    GLU  82           H        GLU  82  -9.435   9.451  -7.335
  680    HA   GLU  82           HA       GLU  82 -11.733  11.136  -8.057
  681   1HB   GLU  82          1HB       GLU  82  -9.568  11.490  -9.122
  682   2HB   GLU  82          2HB       GLU  82  -9.531   9.818  -9.694
  683   1HG   GLU  82          1HG       GLU  82 -10.194  11.290 -11.511
  684   2HG   GLU  82          2HG       GLU  82 -11.577  10.282 -11.078
  685    HE2  GLU  82           HE       GLU  82 -11.634  14.281 -10.354
  686    H    LYS  83           H        LYS  83 -10.481   7.786  -8.672
  687    HA   LYS  83           HA       LYS  83 -13.153   6.672  -8.700
  688   1HB   LYS  83          1HB       LYS  83 -13.163   6.015 -11.087
  689   2HB   LYS  83          2HB       LYS  83 -13.343   7.748 -10.812
  690   1HG   LYS  83          1HG       LYS  83 -10.835   7.992 -11.273
  691   2HG   LYS  83          2HG       LYS  83 -10.847   6.308 -11.808
  692   1HD   LYS  83          1HD       LYS  83 -12.532   6.840 -13.521
  693   2HD   LYS  83          2HD       LYS  83 -12.501   8.546 -13.012
  694   1HE   LYS  83          1HE       LYS  83 -10.077   8.666 -13.527
  695   2HE   LYS  83          2HE       LYS  83 -10.081   6.954 -14.002
  696   1HZ   LYS  83          1HZ       LYS  83 -10.297   8.325 -15.939
  697   2HZ   LYS  83          2HZ       LYS  83 -11.708   9.025 -15.333
  698    H    VAL  84           H        VAL  84 -11.964   5.490  -7.108
  699    HA   VAL  84           HA       VAL  84  -9.820   3.713  -7.843
  700    HB   VAL  84           HB       VAL  84  -9.956   4.439  -5.629
  701   1HG1  VAL  84          1HG1      VAL  84 -12.619   3.012  -5.243
  702   2HG1  VAL  84          2HG1      VAL  84 -11.628   3.763  -3.991
  703   3HG1  VAL  84          3HG1      VAL  84 -12.354   4.766  -5.250
  704   1HG2  VAL  84          1HG2      VAL  84 -10.585   1.460  -5.629
  705   2HG2  VAL  84          2HG2      VAL  84  -9.040   2.161  -6.141
  706   3HG2  VAL  84          3HG2      VAL  84  -9.593   2.360  -4.468
  707    H    ASP  85           H        ASP  85 -10.379   2.622  -9.664
  708    HA   ASP  85           HA       ASP  85 -12.792   0.911  -9.746
  709   1HB   ASP  85          1HB       ASP  85 -12.399   2.443 -11.581
  710   2HB   ASP  85          2HB       ASP  85 -10.787   1.772 -11.857
  711    HD2  ASP  85           HD       ASP  85 -12.023  -0.705 -13.923
  712    H    TYR  86           H        TYR  86 -12.009  -0.723  -8.228
  713    HA   TYR  86           HA       TYR  86  -9.411  -1.854  -8.642
  714   1HB   TYR  86          1HB       TYR  86  -9.662  -2.920  -6.667
  715   2HB   TYR  86          2HB       TYR  86 -10.774  -1.587  -6.430
  716    HD1  TYR  86           1HD      TYR  86 -13.330  -2.163  -7.110
  717    HD2  TYR  86           2HD      TYR  86 -10.315  -5.134  -6.271
  718    HE1  TYR  86           1HE      TYR  86 -15.092  -3.783  -6.484
  719    HE2  TYR  86           2HE      TYR  86 -12.073  -6.735  -5.619
  720    HH   TYR  86           HH       TYR  86 -14.338  -7.101  -5.363
  721    H    SER  87           H        SER  87  -9.127  -4.280  -8.619
  722    HA   SER  87           HA       SER  87 -11.018  -5.766 -10.330
  723   1HB   SER  87          1HB       SER  87  -8.030  -5.651 -10.900
  724   2HB   SER  87          2HB       SER  87  -9.274  -6.534 -11.802
  725    HG   SER  87           HG       SER  87 -10.249  -4.364 -12.096
  726    H    PHE  88           H        PHE  88 -11.584  -7.387  -9.044
  727    HA   PHE  88           HA       PHE  88  -9.853  -8.848  -7.224
  728   1HB   PHE  88          1HB       PHE  88 -12.279  -8.765  -6.993
  729   2HB   PHE  88          2HB       PHE  88 -12.495  -9.431  -8.594
  730    HD1  PHE  88           1HD      PHE  88 -11.609 -11.880  -9.012
  731    HD2  PHE  88           2HD      PHE  88 -12.337 -10.175  -5.114
  732    HE1  PHE  88           1HE      PHE  88 -11.715 -14.148  -8.035
  733    HE2  PHE  88           2HE      PHE  88 -12.549 -12.452  -4.169
  734    HZ   PHE  88           HZ       PHE  88 -12.188 -14.443  -5.611
  735    H    SER  89           H        SER  89  -8.787 -10.839  -7.754
  736    HA   SER  89           HA       SER  89  -8.972 -12.186 -10.139
  737   1HB   SER  89          1HB       SER  89  -6.246 -10.813 -10.068
  738   2HB   SER  89          2HB       SER  89  -6.967 -11.720 -11.402
  739    HG   SER  89           HG       SER  89  -8.531  -9.890 -11.437
  740    H    GLU  90           H        GLU  90  -7.049 -13.740 -10.474
  741    HA   GLU  90           HA       GLU  90  -6.771 -15.060  -7.884
  742   1HB   GLU  90          1HB       GLU  90  -6.285 -16.998  -9.045
  743   2HB   GLU  90          2HB       GLU  90  -7.501 -16.196 -10.033
  744   1HG   GLU  90          1HG       GLU  90  -4.491 -16.358 -10.544
  745   2HG   GLU  90          2HG       GLU  90  -5.764 -17.209 -11.412
  746    HE2  GLU  90           HE       GLU  90  -4.573 -14.020 -13.101
  747    H    TYR  91           H        TYR  91  -4.801 -15.589  -6.844
  748    HA   TYR  91           HA       TYR  91  -2.518 -13.934  -7.440
  749   1HB   TYR  91          1HB       TYR  91  -1.694 -14.668  -5.437
  750   2HB   TYR  91          2HB       TYR  91  -3.429 -14.669  -5.163
  751    HD1  TYR  91           1HD      TYR  91  -4.672 -16.993  -5.440
  752    HD2  TYR  91           2HD      TYR  91  -0.406 -16.574  -4.934
  753    HE1  TYR  91           1HE      TYR  91  -4.518 -19.358  -4.767
  754    HE2  TYR  91           2HE      TYR  91  -0.266 -18.931  -4.207
  755    HH   TYR  91           HH       TYR  91  -1.431 -20.879  -3.779
  756    H    LYS  92           H        LYS  92  -0.871 -14.428  -8.751
  757    HA   LYS  92           HA       LYS  92  -0.456 -17.161  -9.779
  758   1HB   LYS  92          1HB       LYS  92   1.528 -16.126 -10.883
  759   2HB   LYS  92          2HB       LYS  92  -0.080 -15.699 -11.455
  760   1HG   LYS  92          1HG       LYS  92   1.133 -13.857  -9.431
  761   2HG   LYS  92          2HG       LYS  92   1.855 -13.907 -11.046
  762   1HD   LYS  92          1HD       LYS  92  -0.223 -13.349 -12.127
  763   2HD   LYS  92          2HD       LYS  92  -1.138 -13.535 -10.627
  764   1HE   LYS  92          1HE       LYS  92  -0.814 -11.165 -11.079
  765   2HE   LYS  92          2HE       LYS  92   0.079 -11.639  -9.621
  766   1HZ   LYS  92          1HZ       LYS  92   1.478 -10.294 -11.002
  767   2HZ   LYS  92          2HZ       LYS  92   1.320 -11.383 -12.284
  768    H    GLY  93           H        GLY  93   1.054 -14.755  -7.624
  769   1HA   GLY  93          1HA       GLY  93   2.152 -16.780  -5.891
  770   2HA   GLY  93          2HA       GLY  93   3.395 -15.909  -6.813
  771    H    GLU  94           H        GLU  94   3.204 -15.737  -4.017
  772    HA   GLU  94           HA       GLU  94   1.855 -13.268  -3.320
  773   1HB   GLU  94          1HB       GLU  94   2.426 -13.790  -1.058
  774   2HB   GLU  94          2HB       GLU  94   1.570 -15.118  -1.851
  775   1HG   GLU  94          1HG       GLU  94   3.718 -16.339  -2.133
  776   2HG   GLU  94          2HG       GLU  94   4.586 -14.989  -1.376
  777    HE2  GLU  94           HE       GLU  94   2.093 -17.201   0.971
  778    H    PHE  95           H        PHE  95   2.888 -11.540  -2.463
  779    HA   PHE  95           HA       PHE  95   5.700 -10.955  -3.125
  780   1HB   PHE  95          1HB       PHE  95   3.466  -9.448  -1.719
  781   2HB   PHE  95          2HB       PHE  95   5.112  -8.858  -1.794
  782    HD1  PHE  95           1HD      PHE  95   1.999  -9.198  -3.644
  783    HD2  PHE  95           2HD      PHE  95   6.193  -8.283  -3.993
  784    HE1  PHE  95           1HE      PHE  95   1.526  -7.826  -5.633
  785    HE2  PHE  95           2HE      PHE  95   5.733  -6.993  -6.059
  786    HZ   PHE  95           HZ       PHE  95   3.404  -6.736  -6.875
  787    H    GLU  96           H        GLU  96   7.270 -10.560  -1.493
  788    HA   GLU  96           HA       GLU  96   7.098 -12.111   0.911
  789   1HB   GLU  96          1HB       GLU  96   9.337 -11.068   1.385
  790   2HB   GLU  96          2HB       GLU  96   9.208 -12.060  -0.068
  791   1HG   GLU  96          1HG       GLU  96   9.210 -10.127  -1.522
  792   2HG   GLU  96          2HG       GLU  96   9.061  -9.014  -0.154
  793    HE2  GLU  96           HE       GLU  96  12.617 -10.867  -0.839
  794    H    ASP  97           H        ASP  97   5.153 -11.167   1.732
  795    HA   ASP  97           HA       ASP  97   3.966  -9.911   3.199
  796   1HB   ASP  97          1HB       ASP  97   6.459  -8.334   3.902
  797   2HB   ASP  97          2HB       ASP  97   4.969  -8.507   4.832
  798    HD2  ASP  97           HD       ASP  97   5.647 -11.871   5.777
  799    H    PHE  98           H        PHE  98   4.047  -7.156   3.716
  800    HA   PHE  98           HA       PHE  98   3.373  -6.016   1.036
  801   1HB   PHE  98          1HB       PHE  98   1.559  -6.877   2.694
  802   2HB   PHE  98          2HB       PHE  98   1.898  -5.441   3.617
  803    HD1  PHE  98           1HD      PHE  98   2.242  -3.550   1.061
  804    HD2  PHE  98           2HD      PHE  98  -0.688  -6.419   2.370
  805    HE1  PHE  98           1HE      PHE  98   0.462  -2.241  -0.019
  806    HE2  PHE  98           2HE      PHE  98  -2.462  -5.123   1.227
  807    HZ   PHE  98           HZ       PHE  98  -1.889  -3.033   0.018
  808    H    GLU  99           H        GLU  99   4.981  -4.488   0.696
  809    HA   GLU  99           HA       GLU  99   5.500  -2.537   2.917
  810   1HB   GLU  99          1HB       GLU  99   7.297  -3.973   2.449
  811   2HB   GLU  99          2HB       GLU  99   7.330  -3.490   0.756
  812   1HG   GLU  99          1HG       GLU  99   7.928  -1.189   1.384
  813   2HG   GLU  99          2HG       GLU  99   7.652  -1.548   3.095
  814    HE2  GLU  99           HE       GLU  99  10.711  -3.303   3.429
  815    H    THR 100           H        THR 100   6.022  -0.324   2.140
  816    HA   THR 100           HA       THR 100   4.343   0.476  -0.137
  817    HB   THR 100           HB       THR 100   3.745   2.248   0.952
  818    HG1  THR 100           1HG      THR 100   5.034   3.389   2.455
  819   1HG2  THR 100          1HG2      THR 100   3.358   1.832   3.292
  820   2HG2  THR 100          2HG2      THR 100   3.334   0.277   2.440
  821   3HG2  THR 100          3HG2      THR 100   4.747   0.742   3.407
  822    H    TYR 101           H        TYR 101   5.223   1.144  -2.001
  823    HA   TYR 101           HA       TYR 101   8.058   2.083  -2.141
  824   1HB   TYR 101          1HB       TYR 101   7.908   0.275  -3.516
  825   2HB   TYR 101          2HB       TYR 101   6.264   0.567  -4.009
  826    HD1  TYR 101           1HD      TYR 101   9.503   0.451  -5.147
  827    HD2  TYR 101           2HD      TYR 101   5.905   2.766  -5.537
  828    HE1  TYR 101           1HE      TYR 101  10.349   1.412  -7.268
  829    HE2  TYR 101           2HE      TYR 101   6.727   3.702  -7.657
  830    HH   TYR 101           HH       TYR 101   8.482   3.831  -9.141
  Start of MODEL    5
    1   1H    GLY  -1          1H        GLY  -1  24.816 -42.334   6.161
    2   2H    GLY  -1          2H        GLY  -1  24.012 -43.229   7.296
    3   3H    GLY  -1          3H        GLY  -1  24.215 -43.825   5.778
    4   1HA   GLY  -1          1HA       GLY  -1  22.636 -41.451   6.465
    5   2HA   GLY  -1          2HA       GLY  -1  22.820 -42.156   4.845
    6    H    SER   0           H        SER   0  20.330 -42.072   5.186
    7    HA   SER   0           HA       SER   0  19.414 -44.766   5.687
    8   1HB   SER   0          1HB       SER   0  17.692 -44.110   7.372
    9   2HB   SER   0          2HB       SER   0  19.338 -43.983   8.007
   10    HG   SER   0           HG       SER   0  19.250 -41.743   7.586
   11    H    MET   1           H        MET   1  17.210 -45.057   4.967
   12    HA   MET   1           HA       MET   1  16.562 -43.302   2.706
   13   1HB   MET   1          1HB       MET   1  15.375 -45.934   3.672
   14   2HB   MET   1          2HB       MET   1  14.931 -45.084   2.178
   15   1HG   MET   1          1HG       MET   1  17.272 -45.253   1.387
   16   2HG   MET   1          2HG       MET   1  17.702 -46.149   2.852
   17   1HE   MET   1          1HE       MET   1  18.450 -47.214   0.016
   18   2HE   MET   1          2HE       MET   1  18.014 -48.930   0.198
   19   3HE   MET   1          3HE       MET   1  18.787 -48.062   1.545
   20    H    LYS   2           H        LYS   2  16.194 -41.580   4.474
   21    HA   LYS   2           HA       LYS   2  13.332 -41.574   5.365
   22   1HB   LYS   2          1HB       LYS   2  15.751 -40.078   6.446
   23   2HB   LYS   2          2HB       LYS   2  14.076 -39.852   6.977
   24   1HG   LYS   2          1HG       LYS   2  13.965 -42.227   7.674
   25   2HG   LYS   2          2HG       LYS   2  15.655 -42.453   7.180
   26   1HD   LYS   2          1HD       LYS   2  16.333 -40.645   8.774
   27   2HD   LYS   2          2HD       LYS   2  14.660 -40.543   9.346
   28   1HE   LYS   2          1HE       LYS   2  16.418 -43.043   9.465
   29   2HE   LYS   2          2HE       LYS   2  16.139 -41.929  10.813
   30   1HZ   LYS   2          1HZ       LYS   2  14.620 -43.756  10.974
   31   2HZ   LYS   2          2HZ       LYS   2  13.979 -43.407   9.451
   32    H    LYS   3           H        LYS   3  12.031 -40.121   4.342
   33    HA   LYS   3           HA       LYS   3  13.085 -38.391   2.297
   34   1HB   LYS   3          1HB       LYS   3  10.889 -37.816   1.798
   35   2HB   LYS   3          2HB       LYS   3  10.850 -39.528   2.208
   36   1HG   LYS   3          1HG       LYS   3   9.957 -37.221   4.019
   37   2HG   LYS   3          2HG       LYS   3   8.919 -38.257   3.043
   38   1HD   LYS   3          1HD       LYS   3   9.711 -40.249   4.344
   39   2HD   LYS   3          2HD       LYS   3  10.594 -39.141   5.425
   40   1HE   LYS   3          1HE       LYS   3   8.502 -37.993   6.010
   41   2HE   LYS   3          2HE       LYS   3   7.591 -39.051   4.910
   42   1HZ   LYS   3          1HZ       LYS   3   7.470 -39.914   7.131
   43   2HZ   LYS   3          2HZ       LYS   3   9.152 -40.047   7.207
   44    H    TRP   4           H        TRP   4  13.111 -36.135   2.241
   45    HA   TRP   4           HA       TRP   4  12.911 -34.648   4.828
   46   1HB   TRP   4          1HB       TRP   4  14.992 -33.417   3.955
   47   2HB   TRP   4          2HB       TRP   4  15.151 -34.992   4.704
   48    HD1  TRP   4           HD       TRP   4  14.840 -33.784   1.014
   49    HE1  TRP   4           1HE      TRP   4  16.489 -35.150  -0.416
   50    HE3  TRP   4           3HE      TRP   4  16.797 -36.826   4.653
   51    HZ2  TRP   4           2HZ      TRP   4  18.389 -37.242  -0.045
   52    HZ3  TRP   4           3HZ      TRP   4  18.532 -38.489   4.074
   53    HH2  TRP   4           HH       TRP   4  19.338 -38.707   1.734
   54    H    SER   5           H        SER   5  10.747 -34.601   3.436
   55    HA   SER   5           HA       SER   5  10.755 -32.054   1.853
   56   1HB   SER   5          1HB       SER   5  10.553 -33.973   0.356
   57   2HB   SER   5          2HB       SER   5   9.211 -34.623   1.319
   58    HG   SER   5           HG       SER   5   8.052 -32.715   0.823
   59    H    ASP   6           H        ASP   6  10.365 -31.227   4.132
   60    HA   ASP   6           HA       ASP   6   7.726 -31.683   5.244
   61   1HB   ASP   6          1HB       ASP   6   9.715 -31.246   6.650
   62   2HB   ASP   6          2HB       ASP   6   9.857 -29.627   5.948
   63    HD2  ASP   6           HD       ASP   6   6.686 -30.441   8.396
   64    H    THR   7           H        THR   7   7.004 -31.152   2.854
   65    HA   THR   7           HA       THR   7   6.876 -28.301   2.174
   66    HB   THR   7           HB       THR   7   5.702 -29.270   0.129
   67    HG1  THR   7           1HG      THR   7   5.977 -31.523  -0.109
   68   1HG2  THR   7          1HG2      THR   7   7.805 -30.185  -0.804
   69   2HG2  THR   7          2HG2      THR   7   8.087 -28.694   0.114
   70   3HG2  THR   7          3HG2      THR   7   8.503 -30.266   0.827
   71    H    GLU   8           H        GLU   8   5.693 -27.878   4.221
   72    HA   GLU   8           HA       GLU   8   3.024 -28.696   4.654
   73   1HB   GLU   8          1HB       GLU   8   4.679 -27.555   6.226
   74   2HB   GLU   8          2HB       GLU   8   4.243 -26.022   5.466
   75   1HG   GLU   8          1HG       GLU   8   2.335 -27.955   6.881
   76   2HG   GLU   8          2HG       GLU   8   3.048 -26.515   7.613
   77    HE2  GLU   8           HE       GLU   8   1.164 -24.380   5.325
   78    H    VAL   9           H        VAL   9   1.064 -27.903   3.926
   79    HA   VAL   9           HA       VAL   9   0.942 -26.893   1.322
   80    HB   VAL   9           HB       VAL   9  -1.230 -27.026   3.452
   81   1HG1  VAL   9          1HG1      VAL   9  -1.441 -26.806   0.414
   82   2HG1  VAL   9          2HG1      VAL   9  -2.793 -27.110   1.522
   83   3HG1  VAL   9          3HG1      VAL   9  -1.939 -25.565   1.584
   84   1HG2  VAL   9          1HG2      VAL   9  -0.397 -28.994   1.269
   85   2HG2  VAL   9          2HG2      VAL   9  -0.206 -29.240   3.018
   86   3HG2  VAL   9          3HG2      VAL   9  -1.822 -29.161   2.313
   87    H    PHE  10           H        PHE  10   0.976 -24.932   0.487
   88    HA   PHE  10           HA       PHE  10   0.811 -22.509   2.235
   89   1HB   PHE  10          1HB       PHE  10   2.448 -21.521   0.710
   90   2HB   PHE  10          2HB       PHE  10   3.068 -22.935   1.551
   91    HD1  PHE  10           1HD      PHE  10   3.630 -25.001   0.346
   92    HD2  PHE  10           2HD      PHE  10   2.048 -21.575  -1.746
   93    HE1  PHE  10           1HE      PHE  10   4.202 -26.056  -1.823
   94    HE2  PHE  10           2HE      PHE  10   2.593 -22.652  -3.910
   95    HZ   PHE  10           HZ       PHE  10   3.663 -24.894  -3.953
   96    H    GLU  11           H        GLU  11   0.046 -23.907  -0.936
   97    HA   GLU  11           HA       GLU  11  -0.847 -21.572  -2.206
   98   1HB   GLU  11          1HB       GLU  11  -2.021 -23.194  -3.762
   99   2HB   GLU  11          2HB       GLU  11  -0.268 -23.287  -3.629
  100   1HG   GLU  11          1HG       GLU  11  -1.924 -25.124  -1.886
  101   2HG   GLU  11          2HG       GLU  11  -1.810 -25.443  -3.618
  102    HE2  GLU  11           HE       GLU  11   1.354 -26.204  -1.289
  103    H    MET  12           H        MET  12  -2.279 -20.309  -1.135
  104    HA   MET  12           HA       MET  12  -5.086 -21.203  -0.929
  105   1HB   MET  12          1HB       MET  12  -3.486 -19.991   1.377
  106   2HB   MET  12          2HB       MET  12  -5.239 -20.243   1.366
  107   1HG   MET  12          1HG       MET  12  -4.831 -22.699   1.126
  108   2HG   MET  12          2HG       MET  12  -3.093 -22.387   1.289
  109   1HE   MET  12          1HE       MET  12  -4.138 -24.507   3.083
  110   2HE   MET  12          2HE       MET  12  -3.594 -24.011   4.703
  111   3HE   MET  12          3HE       MET  12  -2.511 -23.815   3.308
  112    H    LEU  13           H        LEU  13  -6.400 -19.204  -0.221
  113    HA   LEU  13           HA       LEU  13  -7.322 -17.265  -0.818
  114   1HB   LEU  13          1HB       LEU  13  -6.310 -15.394   0.093
  115   2HB   LEU  13          2HB       LEU  13  -5.943 -16.764   1.105
  116    HG   LEU  13           HG       LEU  13  -3.814 -16.158  -0.891
  117   1HD1  LEU  13          1HD1      LEU  13  -3.021 -14.210   0.377
  118   2HD1  LEU  13          2HD1      LEU  13  -4.579 -13.916  -0.426
  119   3HD1  LEU  13          3HD1      LEU  13  -4.527 -14.223   1.328
  120   1HD2  LEU  13          1HD2      LEU  13  -2.378 -16.497   1.051
  121   2HD2  LEU  13          2HD2      LEU  13  -3.758 -16.389   2.162
  122   3HD2  LEU  13          3HD2      LEU  13  -3.601 -17.778   1.080
  123    H    LYS  14           H        LYS  14  -6.704 -14.890  -1.856
  124    HA   LYS  14           HA       LYS  14  -5.699 -15.372  -4.628
  125   1HB   LYS  14          1HB       LYS  14  -7.639 -14.424  -5.483
  126   2HB   LYS  14          2HB       LYS  14  -8.021 -15.751  -4.407
  127   1HG   LYS  14          1HG       LYS  14  -9.622 -14.110  -4.076
  128   2HG   LYS  14          2HG       LYS  14  -8.619 -14.117  -2.620
  129   1HD   LYS  14          1HD       LYS  14  -7.617 -11.994  -3.233
  130   2HD   LYS  14          2HD       LYS  14  -8.164 -12.188  -4.913
  131   1HE   LYS  14          1HE       LYS  14 -10.547 -11.979  -3.990
  132   2HE   LYS  14          2HE       LYS  14  -9.785 -11.551  -2.441
  133   1HZ   LYS  14          1HZ       LYS  14 -10.234  -9.567  -3.734
  134   2HZ   LYS  14          2HZ       LYS  14  -9.242 -10.131  -4.978
  135    H    ARG  15           H        ARG  15  -5.713 -13.106  -5.828
  136    HA   ARG  15           HA       ARG  15  -4.465 -11.045  -4.078
  137   1HB   ARG  15          1HB       ARG  15  -3.310 -10.162  -5.773
  138   2HB   ARG  15          2HB       ARG  15  -3.129 -11.914  -5.860
  139   1HG   ARG  15          1HG       ARG  15  -4.796 -11.917  -7.728
  140   2HG   ARG  15          2HG       ARG  15  -4.850 -10.148  -7.682
  141   1HD   ARG  15          1HD       ARG  15  -2.242 -11.639  -8.089
  142   2HD   ARG  15          2HD       ARG  15  -3.292 -11.211  -9.428
  143    HE   ARG  15           HE       ARG  15  -1.609  -9.456  -7.806
  144   1HH1  ARG  15          2HH1      ARG  15  -4.413  -9.517  -9.997
  145   2HH1  ARG  15          1HH1      ARG  15  -4.086  -7.937 -10.655
  146   1HH2  ARG  15          1HH2      ARG  15  -1.192  -7.391  -8.703
  147   2HH2  ARG  15          2HH2      ARG  15  -2.253  -6.731  -9.920
  148    H    MET  16           H        MET  16  -5.631  -9.262  -3.566
  149    HA   MET  16           HA       MET  16  -7.683  -8.092  -5.337
  150   1HB   MET  16          1HB       MET  16  -7.772  -7.828  -2.899
  151   2HB   MET  16          2HB       MET  16  -6.254  -6.920  -2.941
  152   1HG   MET  16          1HG       MET  16  -7.547  -5.322  -4.578
  153   2HG   MET  16          2HG       MET  16  -8.986  -6.180  -4.030
  154   1HE   MET  16          1HE       MET  16  -5.630  -4.784  -2.505
  155   2HE   MET  16          2HE       MET  16  -6.237  -3.351  -1.645
  156   3HE   MET  16          3HE       MET  16  -6.346  -3.451  -3.421
  157    H    TYR  17           H        TYR  17  -7.296  -6.392  -6.557
  158    HA   TYR  17           HA       TYR  17  -4.645  -5.072  -6.745
  159   1HB   TYR  17          1HB       TYR  17  -4.686  -6.466  -8.698
  160   2HB   TYR  17          2HB       TYR  17  -6.372  -6.113  -9.025
  161    HD1  TYR  17           1HD      TYR  17  -2.920  -4.782  -9.274
  162    HD2  TYR  17           2HD      TYR  17  -7.080  -4.065 -10.145
  163    HE1  TYR  17           1HE      TYR  17  -2.274  -3.353 -11.190
  164    HE2  TYR  17           2HE      TYR  17  -6.435  -2.596 -12.028
  165    HH   TYR  17           HH       TYR  17  -4.706  -1.831 -13.342
  166    H    ALA  18           H        ALA  18  -4.909  -2.861  -6.582
  167    HA   ALA  18           HA       ALA  18  -7.508  -1.736  -7.327
  168   1HB   ALA  18          1HB       ALA  18  -7.757  -0.467  -5.279
  169   2HB   ALA  18          2HB       ALA  18  -7.832  -2.217  -4.979
  170   3HB   ALA  18          3HB       ALA  18  -6.353  -1.305  -4.570
  171    H    ARG  19           H        ARG  19  -6.990  -0.392  -8.778
  172    HA   ARG  19           HA       ARG  19  -4.606   1.319  -8.699
  173   1HB   ARG  19          1HB       ARG  19  -6.788   0.579 -10.655
  174   2HB   ARG  19          2HB       ARG  19  -6.106   2.188 -10.803
  175   1HG   ARG  19          1HG       ARG  19  -4.421  -0.337 -10.790
  176   2HG   ARG  19          2HG       ARG  19  -5.030   0.479 -12.247
  177   1HD   ARG  19          1HD       ARG  19  -3.956   2.615 -11.154
  178   2HD   ARG  19          2HD       ARG  19  -2.967   1.472 -10.258
  179    HE   ARG  19           HE       ARG  19  -2.761   2.266 -13.021
  180   1HH1  ARG  19          1HH1      ARG  19  -2.307  -0.617 -11.005
  181   2HH1  ARG  19          2HH1      ARG  19  -0.985  -1.234 -11.960
  182   1HH2  ARG  19          1HH2      ARG  19  -1.037   1.440 -14.275
  183   2HH2  ARG  19          2HH2      ARG  19  -0.282  -0.072 -13.844
  184    H    VAL  20           H        VAL  20  -4.872   2.802  -7.034
  185    HA   VAL  20           HA       VAL  20  -7.458   4.194  -6.707
  186    HB   VAL  20           HB       VAL  20  -4.918   4.375  -5.071
  187   1HG1  VAL  20          1HG1      VAL  20  -7.771   5.287  -4.475
  188   2HG1  VAL  20          2HG1      VAL  20  -6.356   5.471  -3.418
  189   3HG1  VAL  20          3HG1      VAL  20  -6.452   6.375  -4.936
  190   1HG2  VAL  20          1HG2      VAL  20  -7.489   2.779  -4.695
  191   2HG2  VAL  20          2HG2      VAL  20  -5.853   2.116  -4.902
  192   3HG2  VAL  20          3HG2      VAL  20  -6.268   3.015  -3.439
  193    H    TYR  21           H        TYR  21  -7.804   5.727  -8.153
  194    HA   TYR  21           HA       TYR  21  -5.575   7.383  -9.227
  195   1HB   TYR  21          1HB       TYR  21  -8.498   7.248 -10.054
  196   2HB   TYR  21          2HB       TYR  21  -7.254   8.137 -10.858
  197    HD1  TYR  21           1HD      TYR  21  -5.019   6.453 -11.321
  198    HD2  TYR  21           2HD      TYR  21  -9.196   5.375 -11.316
  199    HE1  TYR  21           1HE      TYR  21  -4.512   4.428 -12.642
  200    HE2  TYR  21           2HE      TYR  21  -8.697   3.422 -12.710
  201    HH   TYR  21           HH       TYR  21  -7.057   2.129 -13.681
  202    H    GLY  22           H        GLY  22  -5.594   9.625  -9.107
  203   1HA   GLY  22          1HA       GLY  22  -7.281  11.525  -8.857
  204   2HA   GLY  22          2HA       GLY  22  -7.442  10.938  -7.182
  205    H    LEU  23           H        LEU  23  -6.712  13.031  -6.508
  206    HA   LEU  23           HA       LEU  23  -3.909  13.723  -6.953
  207   1HB   LEU  23          1HB       LEU  23  -5.892  15.330  -6.702
  208   2HB   LEU  23          2HB       LEU  23  -5.792  14.982  -4.969
  209    HG   LEU  23           HG       LEU  23  -3.290  15.753  -5.189
  210   1HD1  LEU  23          1HD1      LEU  23  -2.849  17.318  -7.031
  211   2HD1  LEU  23          2HD1      LEU  23  -3.157  15.703  -7.676
  212   3HD1  LEU  23          3HD1      LEU  23  -4.423  16.945  -7.759
  213   1HD2  LEU  23          1HD2      LEU  23  -3.954  18.115  -4.974
  214   2HD2  LEU  23          2HD2      LEU  23  -5.568  17.728  -5.614
  215   3HD2  LEU  23          3HD2      LEU  23  -5.039  17.056  -4.055
  216    H    VAL  24           H        VAL  24  -4.814  11.141  -5.613
  217    HA   VAL  24           HA       VAL  24  -3.793  11.166  -2.903
  218    HB   VAL  24           HB       VAL  24  -3.753   8.686  -3.253
  219   1HG1  VAL  24          1HG1      VAL  24  -6.340  10.182  -3.842
  220   2HG1  VAL  24          2HG1      VAL  24  -6.246   8.459  -3.421
  221   3HG1  VAL  24          3HG1      VAL  24  -5.716   9.680  -2.260
  222   1HG2  VAL  24          1HG2      VAL  24  -5.173   9.215  -5.890
  223   2HG2  VAL  24          2HG2      VAL  24  -3.437   8.854  -5.800
  224   3HG2  VAL  24          3HG2      VAL  24  -4.621   7.681  -5.206
  225    H    GLN  25           H        GLN  25  -2.289  11.331  -6.011
  226    HA   GLN  25           HA       GLN  25  -0.060   9.710  -5.512
  227   1HB   GLN  25          1HB       GLN  25  -1.042  10.772  -7.728
  228   2HB   GLN  25          2HB       GLN  25   0.138  12.044  -7.385
  229   1HG   GLN  25          1HG       GLN  25   1.181  10.383  -8.772
  230   2HG   GLN  25          2HG       GLN  25   1.911  10.250  -7.172
  231   1HE2  GLN  25          1HE2      GLN  25   2.553   8.059  -7.930
  232   2HE2  GLN  25          2HE2      GLN  25   1.394   6.748  -7.873
  233    H    GLY  26           H        GLY  26   1.612   9.958  -4.235
  234   1HA   GLY  26          1HA       GLY  26   3.263  10.829  -2.944
  235   2HA   GLY  26          2HA       GLY  26   3.258  12.231  -4.027
  236    H    VAL  27           H        VAL  27   0.529  11.152  -1.966
  237    HA   VAL  27           HA       VAL  27   1.196  13.066   0.146
  238    HB   VAL  27           HB       VAL  27   0.025  14.575  -1.194
  239   1HG1  VAL  27          1HG1      VAL  27  -2.175  12.517  -1.597
  240   2HG1  VAL  27          2HG1      VAL  27  -2.291  14.241  -1.992
  241   3HG1  VAL  27          3HG1      VAL  27  -1.108  13.220  -2.821
  242   1HG2  VAL  27          1HG2      VAL  27  -2.019  13.573   0.829
  243   2HG2  VAL  27          2HG2      VAL  27  -0.583  14.544   1.223
  244   3HG2  VAL  27          3HG2      VAL  27  -1.852  15.206   0.179
  245    H    GLY  28           H        GLY  28   1.560  11.335   1.415
  246   1HA   GLY  28          1HA       GLY  28   1.060   9.748   2.963
  247   2HA   GLY  28          2HA       GLY  28  -0.612  10.328   2.898
  248    H    PHE  29           H        PHE  29  -1.733   8.463   2.853
  249    HA   PHE  29           HA       PHE  29  -2.562   6.487   2.325
  250   1HB   PHE  29          1HB       PHE  29  -3.139   7.873   0.351
  251   2HB   PHE  29          2HB       PHE  29  -1.715   7.263  -0.488
  252    HD1  PHE  29           1HD      PHE  29  -2.302   5.741  -2.180
  253    HD2  PHE  29           2HD      PHE  29  -4.545   5.690   1.506
  254    HE1  PHE  29           1HE      PHE  29  -3.472   3.687  -2.914
  255    HE2  PHE  29           2HE      PHE  29  -5.744   3.665   0.740
  256    HZ   PHE  29           HZ       PHE  29  -5.155   2.615  -1.428
  257    H    ARG  30           H        ARG  30  -1.982   4.372   0.662
  258    HA   ARG  30           HA       ARG  30  -0.784   2.502   0.512
  259   1HB   ARG  30          1HB       ARG  30   1.695   4.182   1.074
  260   2HB   ARG  30          2HB       ARG  30   1.666   2.487   0.617
  261   1HG   ARG  30          1HG       ARG  30   0.838   2.942  -1.559
  262   2HG   ARG  30          2HG       ARG  30   0.303   4.567  -1.134
  263   1HD   ARG  30          1HD       ARG  30   3.229   3.782  -0.952
  264   2HD   ARG  30          2HD       ARG  30   2.497   4.323  -2.458
  265    HE   ARG  30           HE       ARG  30   1.688   6.201  -0.566
  266   1HH1  ARG  30          1HH1      ARG  30   4.840   5.132  -1.836
  267   2HH1  ARG  30          2HH1      ARG  30   5.658   6.588  -1.342
  268   1HH2  ARG  30          1HH2      ARG  30   2.724   8.103  -0.015
  269   2HH2  ARG  30          2HH2      ARG  30   4.430   8.324  -0.332
  270    H    LYS  31           H        LYS  31   1.136   4.108   3.052
  271    HA   LYS  31           HA       LYS  31   1.391   2.139   4.834
  272   1HB   LYS  31          1HB       LYS  31   2.235   4.566   4.864
  273   2HB   LYS  31          2HB       LYS  31   0.749   4.963   5.713
  274   1HG   LYS  31          1HG       LYS  31   2.391   4.661   7.391
  275   2HG   LYS  31          2HG       LYS  31   1.384   3.208   7.467
  276   1HD   LYS  31          1HD       LYS  31   3.115   1.959   6.167
  277   2HD   LYS  31          2HD       LYS  31   4.069   3.450   6.022
  278   1HE   LYS  31          1HE       LYS  31   4.308   3.521   8.494
  279   2HE   LYS  31          2HE       LYS  31   3.350   2.031   8.629
  280   1HZ   LYS  31          1HZ       LYS  31   5.676   1.491   8.627
  281   2HZ   LYS  31          2HZ       LYS  31   5.877   2.217   7.115
  282    H    PHE  32           H        PHE  32  -1.435   4.266   4.505
  283    HA   PHE  32           HA       PHE  32  -2.844   3.447   6.877
  284   1HB   PHE  32          1HB       PHE  32  -3.281   5.582   5.685
  285   2HB   PHE  32          2HB       PHE  32  -3.812   4.694   4.262
  286    HD1  PHE  32           1HD      PHE  32  -5.908   5.959   4.178
  287    HD2  PHE  32           2HD      PHE  32  -4.997   3.389   7.539
  288    HE1  PHE  32           1HE      PHE  32  -8.187   6.259   5.053
  289    HE2  PHE  32           2HE      PHE  32  -7.282   3.636   8.349
  290    HZ   PHE  32           HZ       PHE  32  -8.900   5.104   7.135
  291    H    VAL  33           H        VAL  33  -3.217   2.506   3.413
  292    HA   VAL  33           HA       VAL  33  -5.176   0.470   4.081
  293    HB   VAL  33           HB       VAL  33  -5.277   1.547   1.948
  294   1HG1  VAL  33          1HG1      VAL  33  -2.579   0.311   1.342
  295   2HG1  VAL  33          2HG1      VAL  33  -3.667   1.001   0.128
  296   3HG1  VAL  33          3HG1      VAL  33  -3.002   2.042   1.387
  297   1HG2  VAL  33          1HG2      VAL  33  -4.581  -1.380   1.538
  298   2HG2  VAL  33          2HG2      VAL  33  -6.124  -0.764   2.186
  299   3HG2  VAL  33          3HG2      VAL  33  -5.628  -0.363   0.535
  300    H    GLN  34           H        GLN  34  -1.736   0.576   4.302
  301    HA   GLN  34           HA       GLN  34  -1.418  -2.310   4.447
  302   1HB   GLN  34          1HB       GLN  34   0.360   0.034   5.023
  303   2HB   GLN  34          2HB       GLN  34   0.684  -1.491   5.851
  304   1HG   GLN  34          1HG       GLN  34   2.007  -1.382   3.866
  305   2HG   GLN  34          2HG       GLN  34   0.799  -2.655   3.668
  306   1HE2  GLN  34          1HE2      GLN  34  -1.123  -2.165   2.350
  307   2HE2  GLN  34          2HE2      GLN  34  -0.997  -0.978   1.066
  308    H    ILE  35           H        ILE  35  -1.707   0.267   7.009
  309    HA   ILE  35           HA       ILE  35  -1.435  -1.189   9.247
  310    HB   ILE  35           HB       ILE  35  -3.596   0.860   8.684
  311   1HG1  ILE  35          1HG1      ILE  35  -1.181   1.601   8.625
  312   2HG1  ILE  35          2HG1      ILE  35  -2.225   2.455   9.752
  313   1HG2  ILE  35          1HG2      ILE  35  -3.779   1.146  11.176
  314   2HG2  ILE  35          2HG2      ILE  35  -4.495  -0.337  10.556
  315   3HG2  ILE  35          3HG2      ILE  35  -2.921  -0.400  11.362
  316   1HD1  ILE  35          1HD1      ILE  35   0.002   1.981  10.686
  317   2HD1  ILE  35          2HD1      ILE  35  -1.268   1.203  11.638
  318   3HD1  ILE  35          3HD1      ILE  35  -0.272   0.240  10.522
  319    H    HIS  36           H        HIS  36  -4.591  -1.196   7.547
  320    HA   HIS  36           HA       HIS  36  -5.739  -3.089   9.405
  321   1HB   HIS  36          1HB       HIS  36  -6.583  -1.927   6.743
  322   2HB   HIS  36          2HB       HIS  36  -7.475  -3.248   7.499
  323    HD2  HIS  36           2HD      HIS  36  -6.235   0.285   8.949
  324    HE1  HIS  36           1HE      HIS  36 -10.128  -0.614  10.323
  325    HE2  HIS  36           2HE      HIS  36  -8.238   1.099  10.397
  326    H    ALA  37           H        ALA  37  -4.664  -3.448   5.977
  327    HA   ALA  37           HA       ALA  37  -4.782  -6.127   5.579
  328   1HB   ALA  37          1HB       ALA  37  -2.995  -5.862   3.993
  329   2HB   ALA  37          2HB       ALA  37  -4.040  -4.450   3.973
  330   3HB   ALA  37          3HB       ALA  37  -2.457  -4.372   4.756
  331    H    ILE  38           H        ILE  38  -1.741  -4.664   6.691
  332    HA   ILE  38           HA       ILE  38  -0.274  -6.713   7.655
  333    HB   ILE  38           HB       ILE  38  -0.557  -3.828   8.424
  334   1HG1  ILE  38          1HG1      ILE  38   1.682  -3.680   7.547
  335   2HG1  ILE  38          2HG1      ILE  38   1.854  -5.438   7.484
  336   1HG2  ILE  38          1HG2      ILE  38   1.424  -3.990   9.889
  337   2HG2  ILE  38          2HG2      ILE  38  -0.013  -4.717  10.594
  338   3HG2  ILE  38          3HG2      ILE  38   1.256  -5.757   9.897
  339   1HD1  ILE  38          1HD1      ILE  38   1.522  -4.319   5.288
  340   2HD1  ILE  38          2HD1      ILE  38   0.312  -5.585   5.602
  341   3HD1  ILE  38          3HD1      ILE  38  -0.106  -3.870   5.755
  342    H    ARG  39           H        ARG  39  -2.752  -4.926   9.633
  343    HA   ARG  39           HA       ARG  39  -2.292  -6.016  12.040
  344   1HB   ARG  39          1HB       ARG  39  -3.897  -4.224  11.500
  345   2HB   ARG  39          2HB       ARG  39  -5.070  -5.449  10.970
  346   1HG   ARG  39          1HG       ARG  39  -4.977  -6.442  13.224
  347   2HG   ARG  39          2HG       ARG  39  -3.779  -5.210  13.704
  348   1HD   ARG  39          1HD       ARG  39  -5.396  -3.419  13.295
  349   2HD   ARG  39          2HD       ARG  39  -6.601  -4.568  12.714
  350    HE   ARG  39           HE       ARG  39  -5.860  -3.947  15.468
  351   1HH1  ARG  39          1HH1      ARG  39  -7.360  -6.421  13.404
  352   2HH1  ARG  39          2HH1      ARG  39  -8.278  -7.125  14.709
  353   1HH2  ARG  39          1HH2      ARG  39  -7.060  -4.889  17.164
  354   2HH2  ARG  39          2HH2      ARG  39  -8.101  -6.255  16.857
  355    H    LEU  40           H        LEU  40  -4.431  -7.360   9.508
  356    HA   LEU  40           HA       LEU  40  -4.613  -9.983  10.951
  357   1HB   LEU  40          1HB       LEU  40  -6.294  -8.994   8.655
  358   2HB   LEU  40          2HB       LEU  40  -6.515 -10.470   9.604
  359    HG   LEU  40           HG       LEU  40  -6.858  -7.603  10.561
  360   1HD1  LEU  40          1HD1      LEU  40  -9.181  -8.277  10.850
  361   2HD1  LEU  40          2HD1      LEU  40  -8.680  -8.716   9.203
  362   3HD1  LEU  40          3HD1      LEU  40  -8.786  -9.966  10.452
  363   1HD2  LEU  40          1HD2      LEU  40  -7.650  -8.685  12.717
  364   2HD2  LEU  40          2HD2      LEU  40  -6.939 -10.209  12.157
  365   3HD2  LEU  40          3HD2      LEU  40  -5.906  -8.795  12.467
  366    H    GLY  41           H        GLY  41  -2.162  -9.206   9.617
  367   1HA   GLY  41          1HA       GLY  41  -0.544 -10.224   8.402
  368   2HA   GLY  41          2HA       GLY  41  -1.459 -11.697   8.737
  369    H    ILE  42           H        ILE  42  -1.482  -8.887   6.486
  370    HA   ILE  42           HA       ILE  42  -2.115 -10.719   4.212
  371    HB   ILE  42           HB       ILE  42  -2.849  -7.849   4.742
  372   1HG1  ILE  42          1HG1      ILE  42  -4.316  -9.498   5.818
  373   2HG1  ILE  42          2HG1      ILE  42  -5.128  -8.500   4.603
  374   1HG2  ILE  42          1HG2      ILE  42  -4.072  -7.946   2.521
  375   2HG2  ILE  42          2HG2      ILE  42  -2.316  -7.800   2.454
  376   3HG2  ILE  42          3HG2      ILE  42  -3.078  -9.371   2.150
  377   1HD1  ILE  42          1HD1      ILE  42  -5.864 -10.840   4.511
  378   2HD1  ILE  42          2HD1      ILE  42  -5.095 -10.318   3.006
  379   3HD1  ILE  42          3HD1      ILE  42  -4.219 -11.373   4.145
  380    H    LYS  43           H        LYS  43  -0.913 -10.549   2.418
  381    HA   LYS  43           HA       LYS  43   1.672  -9.062   2.584
  382   1HB   LYS  43          1HB       LYS  43   0.977 -11.409   0.822
  383   2HB   LYS  43          2HB       LYS  43   2.551 -10.652   1.082
  384   1HG   LYS  43          1HG       LYS  43   2.390 -11.269   3.527
  385   2HG   LYS  43          2HG       LYS  43   0.909 -12.174   3.155
  386   1HD   LYS  43          1HD       LYS  43   2.224 -13.527   1.486
  387   2HD   LYS  43          2HD       LYS  43   3.699 -12.748   2.089
  388   1HE   LYS  43          1HE       LYS  43   1.764 -14.399   3.774
  389   2HE   LYS  43          2HE       LYS  43   3.310 -14.969   3.118
  390   1HZ   LYS  43          1HZ       LYS  43   2.973 -12.799   5.087
  391   2HZ   LYS  43          2HZ       LYS  43   4.440 -13.350   4.459
  392    H    GLY  44           H        GLY  44   2.408  -8.452   0.127
  393   1HA   GLY  44          1HA       GLY  44   0.773  -7.997  -2.018
  394   2HA   GLY  44          2HA       GLY  44   0.244  -6.754  -0.864
  395    H    TYR  45           H        TYR  45   0.931  -5.075  -2.314
  396    HA   TYR  45           HA       TYR  45   3.326  -4.027  -1.389
  397   1HB   TYR  45          1HB       TYR  45   4.239  -5.656  -3.235
  398   2HB   TYR  45          2HB       TYR  45   3.628  -4.451  -4.340
  399    HD1  TYR  45           1HD      TYR  45   6.256  -5.377  -1.996
  400    HD2  TYR  45           2HD      TYR  45   4.590  -2.133  -4.290
  401    HE1  TYR  45           1HE      TYR  45   8.288  -4.017  -1.564
  402    HE2  TYR  45           2HE      TYR  45   6.527  -0.745  -3.735
  403    HH   TYR  45           HH       TYR  45   8.498  -0.567  -2.486
  404    H    ALA  46           H        ALA  46   3.332  -1.858  -1.656
  405    HA   ALA  46           HA       ALA  46   0.920  -0.638  -2.934
  406   1HB   ALA  46          1HB       ALA  46   0.908   0.809  -1.030
  407   2HB   ALA  46          2HB       ALA  46   0.973  -0.878  -0.521
  408   3HB   ALA  46          3HB       ALA  46   2.426   0.119  -0.429
  409    H    LYS  47           H        LYS  47   1.921   0.113  -4.935
  410    HA   LYS  47           HA       LYS  47   4.449   1.605  -4.674
  411   1HB   LYS  47          1HB       LYS  47   4.592  -0.405  -5.822
  412   2HB   LYS  47          2HB       LYS  47   3.202  -0.012  -6.834
  413   1HG   LYS  47          1HG       LYS  47   4.416   1.622  -8.069
  414   2HG   LYS  47          2HG       LYS  47   5.732   1.612  -6.891
  415   1HD   LYS  47          1HD       LYS  47   6.404   0.452  -8.890
  416   2HD   LYS  47          2HD       LYS  47   6.393  -0.652  -7.517
  417   1HE   LYS  47          1HE       LYS  47   4.002  -0.463  -9.401
  418   2HE   LYS  47          2HE       LYS  47   5.425  -1.431  -9.822
  419   1HZ   LYS  47          1HZ       LYS  47   3.815  -2.789  -8.694
  420   2HZ   LYS  47          2HZ       LYS  47   3.940  -1.832  -7.310
  421    H    ASN  48           H        ASN  48   4.111   3.729  -4.477
  422    HA   ASN  48           HA       ASN  48   2.160   5.183  -6.089
  423   1HB   ASN  48          1HB       ASN  48   2.616   5.918  -3.836
  424   2HB   ASN  48          2HB       ASN  48   4.338   6.130  -4.189
  425   1HD2  ASN  48          2HD2      ASN  48   4.820   7.814  -5.942
  426   2HD2  ASN  48          1HD2      ASN  48   3.807   9.248  -5.947
  427    H    LEU  49           H        LEU  49   2.720   4.959  -8.299
  428    HA   LEU  49           HA       LEU  49   5.398   5.256  -9.295
  429   1HB   LEU  49          1HB       LEU  49   2.732   5.473 -10.706
  430   2HB   LEU  49          2HB       LEU  49   4.300   5.278 -11.476
  431    HG   LEU  49           HG       LEU  49   3.085   3.253  -9.547
  432   1HD1  LEU  49          1HD1      LEU  49   2.420   1.975 -11.492
  433   2HD1  LEU  49          2HD1      LEU  49   1.692   3.582 -11.599
  434   3HD1  LEU  49          3HD1      LEU  49   3.115   3.193 -12.590
  435   1HD2  LEU  49          1HD2      LEU  49   4.736   1.707 -10.595
  436   2HD2  LEU  49          2HD2      LEU  49   5.425   3.073 -11.496
  437   3HD2  LEU  49          3HD2      LEU  49   5.523   3.030  -9.722
  438    HA   PRO  50           HA       PRO  50   4.667   9.611  -8.275
  439   1HB   PRO  50          1HB       PRO  50   7.091  10.742  -8.751
  440   2HB   PRO  50          2HB       PRO  50   6.766   9.651  -7.368
  441   1HG   PRO  50          1HG       PRO  50   7.970   8.884 -10.054
  442   2HG   PRO  50          2HG       PRO  50   8.628   8.533  -8.427
  443   1HD   PRO  50          1HD       PRO  50   7.115   6.699  -9.746
  444   2HD   PRO  50          2HD       PRO  50   6.930   6.960  -7.987
  445    H    ASP  51           H        ASP  51   3.869  11.298  -9.400
  446    HA   ASP  51           HA       ASP  51   2.824  12.289 -11.101
  447   1HB   ASP  51          1HB       ASP  51   5.126  13.129 -11.578
  448   2HB   ASP  51          2HB       ASP  51   5.366  11.797 -12.715
  449    HD2  ASP  51           HD       ASP  51   2.649  14.692 -13.654
  450    H    GLY  52           H        GLY  52   1.891   9.906 -10.668
  451   1HA   GLY  52          1HA       GLY  52   0.864   8.966 -13.205
  452   2HA   GLY  52          2HA       GLY  52   1.989   7.824 -12.433
  453    H    SER  53           H        SER  53   0.736   6.284 -11.487
  454    HA   SER  53           HA       SER  53  -1.637   7.087  -9.843
  455   1HB   SER  53          1HB       SER  53  -2.225   5.933 -11.951
  456   2HB   SER  53          2HB       SER  53  -1.222   4.550 -11.463
  457    HG   SER  53           HG       SER  53  -2.580   4.368  -9.604
  458    H    VAL  54           H        VAL  54  -1.962   5.949  -7.914
  459    HA   VAL  54           HA       VAL  54   0.378   4.448  -6.883
  460    HB   VAL  54           HB       VAL  54  -0.030   6.330  -5.595
  461   1HG1  VAL  54          1HG1      VAL  54  -2.874   5.433  -5.008
  462   2HG1  VAL  54          2HG1      VAL  54  -2.037   6.860  -4.379
  463   3HG1  VAL  54          3HG1      VAL  54  -2.428   6.762  -6.098
  464   1HG2  VAL  54          1HG2      VAL  54  -1.080   3.935  -4.042
  465   2HG2  VAL  54          2HG2      VAL  54   0.623   4.215  -4.452
  466   3HG2  VAL  54          3HG2      VAL  54  -0.229   5.358  -3.405
  467    H    GLU  55           H        GLU  55   0.188   2.530  -7.654
  468    HA   GLU  55           HA       GLU  55  -2.403   1.148  -7.671
  469   1HB   GLU  55          1HB       GLU  55  -1.467  -0.407  -9.082
  470   2HB   GLU  55          2HB       GLU  55  -0.748   1.129  -9.577
  471   1HG   GLU  55          1HG       GLU  55   1.072  -0.272  -9.664
  472   2HG   GLU  55          2HG       GLU  55   1.266   0.417  -8.053
  473    HE2  GLU  55           HE       GLU  55   1.214  -2.793  -6.661
  474    H    VAL  56           H        VAL  56  -2.991  -0.398  -6.265
  475    HA   VAL  56           HA       VAL  56  -1.021  -1.316  -4.200
  476    HB   VAL  56           HB       VAL  56  -4.021  -0.978  -3.991
  477   1HG1  VAL  56          1HG1      VAL  56  -1.906  -1.892  -1.990
  478   2HG1  VAL  56          2HG1      VAL  56  -3.571  -1.453  -1.553
  479   3HG1  VAL  56          3HG1      VAL  56  -3.278  -2.849  -2.593
  480   1HG2  VAL  56          1HG2      VAL  56  -1.692   0.589  -2.783
  481   2HG2  VAL  56          2HG2      VAL  56  -2.863   1.201  -3.974
  482   3HG2  VAL  56          3HG2      VAL  56  -3.398   0.794  -2.339
  483    H    VAL  57           H        VAL  57  -0.846  -3.488  -3.843
  484    HA   VAL  57           HA       VAL  57  -2.881  -5.324  -4.976
  485    HB   VAL  57           HB       VAL  57   0.140  -5.783  -4.935
  486   1HG1  VAL  57          1HG1      VAL  57  -2.111  -7.628  -5.853
  487   2HG1  VAL  57          2HG1      VAL  57  -0.380  -7.945  -6.008
  488   3HG1  VAL  57          3HG1      VAL  57  -1.113  -7.867  -4.402
  489   1HG2  VAL  57          1HG2      VAL  57  -1.831  -5.519  -7.247
  490   2HG2  VAL  57          2HG2      VAL  57  -0.554  -4.359  -6.831
  491   3HG2  VAL  57          3HG2      VAL  57  -0.118  -5.969  -7.406
  492    H    ALA  58           H        ALA  58  -3.585  -6.789  -3.419
  493    HA   ALA  58           HA       ALA  58  -2.129  -7.003  -0.848
  494   1HB   ALA  58          1HB       ALA  58  -4.075  -6.515   0.468
  495   2HB   ALA  58          2HB       ALA  58  -3.840  -5.135  -0.629
  496   3HB   ALA  58          3HB       ALA  58  -5.096  -6.347  -0.962
  497    H    GLU  59           H        GLU  59  -2.323  -9.101  -0.016
  498    HA   GLU  59           HA       GLU  59  -3.717 -10.997  -1.807
  499   1HB   GLU  59          1HB       GLU  59  -1.346 -11.356   0.012
  500   2HB   GLU  59          2HB       GLU  59  -2.098 -12.587  -1.025
  501   1HG   GLU  59          1HG       GLU  59  -1.763 -10.962  -2.986
  502   2HG   GLU  59          2HG       GLU  59  -0.730 -10.023  -1.905
  503    HE2  GLU  59           HE       GLU  59   0.628 -13.275  -3.761
  504    H    GLY  60           H        GLY  60  -5.851 -10.972  -0.806
  505   1HA   GLY  60          1HA       GLY  60  -5.954 -12.191   1.932
  506   2HA   GLY  60          2HA       GLY  60  -7.056 -10.927   1.374
  507    H    TYR  61           H        TYR  61  -8.011 -13.238   2.367
  508    HA   TYR  61           HA       TYR  61  -8.685 -15.222   0.372
  509   1HB   TYR  61          1HB       TYR  61  -9.475 -14.592   3.229
  510   2HB   TYR  61          2HB       TYR  61 -10.234 -15.893   2.325
  511    HD1  TYR  61           1HD      TYR  61  -9.082 -17.989   1.936
  512    HD2  TYR  61           2HD      TYR  61  -7.055 -14.683   3.828
  513    HE1  TYR  61           1HE      TYR  61  -7.305 -19.525   2.726
  514    HE2  TYR  61           2HE      TYR  61  -5.245 -16.209   4.549
  515    HH   TYR  61           HH       TYR  61  -4.471 -18.377   4.592
  516    H    GLU  62           H        GLU  62 -11.269 -14.020   2.352
  517    HA   GLU  62           HA       GLU  62 -12.599 -12.421   0.268
  518   1HB   GLU  62          1HB       GLU  62 -13.645 -15.065   1.307
  519   2HB   GLU  62          2HB       GLU  62 -14.635 -13.814   0.517
  520   1HG   GLU  62          1HG       GLU  62 -13.199 -13.992  -1.523
  521   2HG   GLU  62          2HG       GLU  62 -12.315 -15.331  -0.765
  522    HE2  GLU  62           HE       GLU  62 -15.051 -17.583  -0.970
  523    H    GLU  63           H        GLU  63 -13.424 -14.282   3.281
  524    HA   GLU  63           HA       GLU  63 -14.734 -12.449   4.773
  525   1HB   GLU  63          1HB       GLU  63 -12.566 -14.390   5.627
  526   2HB   GLU  63          2HB       GLU  63 -13.657 -13.518   6.716
  527   1HG   GLU  63          1HG       GLU  63 -15.613 -14.560   5.590
  528   2HG   GLU  63          2HG       GLU  63 -14.519 -15.466   4.531
  529    HE2  GLU  63           HE       GLU  63 -14.654 -16.439   8.486
  530    H    ALA  64           H        ALA  64 -11.162 -12.745   4.340
  531    HA   ALA  64           HA       ALA  64 -10.537 -10.361   5.869
  532   1HB   ALA  64          1HB       ALA  64  -8.254 -10.751   5.060
  533   2HB   ALA  64          2HB       ALA  64  -8.948 -12.268   5.664
  534   3HB   ALA  64          3HB       ALA  64  -8.843 -11.974   3.912
  535    H    LEU  65           H        LEU  65 -11.080 -11.133   2.426
  536    HA   LEU  65           HA       LEU  65 -10.023  -8.847   1.291
  537   1HB   LEU  65          1HB       LEU  65 -10.888 -10.706   0.006
  538   2HB   LEU  65          2HB       LEU  65 -12.547 -10.161   0.354
  539    HG   LEU  65           HG       LEU  65 -12.032  -7.977  -0.650
  540   1HD1  LEU  65          1HD1      LEU  65 -10.031  -7.946  -2.261
  541   2HD1  LEU  65          2HD1      LEU  65  -9.593  -7.798  -0.564
  542   3HD1  LEU  65          3HD1      LEU  65  -9.399  -9.355  -1.381
  543   1HD2  LEU  65          1HD2      LEU  65 -12.109  -8.839  -2.975
  544   2HD2  LEU  65          2HD2      LEU  65 -11.754 -10.464  -2.326
  545   3HD2  LEU  65          3HD2      LEU  65 -13.236  -9.628  -1.848
  546    H    SER  66           H        SER  66 -13.485  -9.328   2.047
  547    HA   SER  66           HA       SER  66 -14.591  -6.865   1.817
  548   1HB   SER  66          1HB       SER  66 -16.239  -7.560   3.499
  549   2HB   SER  66          2HB       SER  66 -15.857  -8.862   2.357
  550    HG   SER  66           HG       SER  66 -14.424  -9.703   3.971
  551    H    LYS  67           H        LYS  67 -12.918  -7.983   4.842
  552    HA   LYS  67           HA       LYS  67 -13.303  -5.730   6.383
  553   1HB   LYS  67          1HB       LYS  67 -12.605  -7.446   7.565
  554   2HB   LYS  67          2HB       LYS  67 -11.564  -8.109   6.330
  555   1HG   LYS  67          1HG       LYS  67 -10.643  -5.589   7.687
  556   2HG   LYS  67          2HG       LYS  67 -10.618  -7.120   8.578
  557   1HD   LYS  67          1HD       LYS  67  -9.291  -8.229   6.949
  558   2HD   LYS  67          2HD       LYS  67  -9.427  -6.906   5.798
  559   1HE   LYS  67          1HE       LYS  67  -8.117  -5.422   7.175
  560   2HE   LYS  67          2HE       LYS  67  -8.043  -6.605   8.494
  561   1HZ   LYS  67          1HZ       LYS  67  -6.056  -6.757   7.195
  562   2HZ   LYS  67          2HZ       LYS  67  -6.947  -7.079   5.796
  563    H    LEU  68           H        LEU  68 -10.740  -6.319   3.934
  564    HA   LEU  68           HA       LEU  68  -9.360  -3.815   4.472
  565   1HB   LEU  68          1HB       LEU  68  -8.257  -5.909   4.020
  566   2HB   LEU  68          2HB       LEU  68  -9.016  -6.049   2.439
  567    HG   LEU  68           HG       LEU  68  -6.565  -5.418   2.698
  568   1HD1  LEU  68          1HD1      LEU  68  -6.518  -4.093   0.675
  569   2HD1  LEU  68          2HD1      LEU  68  -7.684  -5.425   0.563
  570   3HD1  LEU  68          3HD1      LEU  68  -8.259  -3.757   0.817
  571   1HD2  LEU  68          1HD2      LEU  68  -5.943  -3.120   2.858
  572   2HD2  LEU  68          2HD2      LEU  68  -7.620  -2.590   3.031
  573   3HD2  LEU  68          3HD2      LEU  68  -6.856  -3.556   4.320
  574    H    LEU  69           H        LEU  69 -11.916  -4.945   2.334
  575    HA   LEU  69           HA       LEU  69 -11.611  -2.784   0.420
  576   1HB   LEU  69          1HB       LEU  69 -13.326  -5.202   0.794
  577   2HB   LEU  69          2HB       LEU  69 -14.157  -3.864   0.039
  578    HG   LEU  69           HG       LEU  69 -13.120  -5.517  -1.512
  579   1HD1  LEU  69          1HD1      LEU  69 -12.232  -3.836  -3.099
  580   2HD1  LEU  69          2HD1      LEU  69 -13.730  -3.308  -2.319
  581   3HD1  LEU  69          3HD1      LEU  69 -12.170  -2.630  -1.800
  582   1HD2  LEU  69          1HD2      LEU  69 -10.783  -5.538  -1.965
  583   2HD2  LEU  69          2HD2      LEU  69 -10.454  -4.244  -0.795
  584   3HD2  LEU  69          3HD2      LEU  69 -10.981  -5.841  -0.232
  585    H    GLU  70           H        GLU  70 -14.153  -3.624   2.818
  586    HA   GLU  70           HA       GLU  70 -15.656  -1.318   2.541
  587   1HB   GLU  70          1HB       GLU  70 -16.756  -1.915   4.531
  588   2HB   GLU  70          2HB       GLU  70 -16.281  -3.408   3.721
  589   1HG   GLU  70          1HG       GLU  70 -14.267  -3.479   5.313
  590   2HG   GLU  70          2HG       GLU  70 -15.034  -2.154   6.198
  591    HE2  GLU  70           HE       GLU  70 -17.561  -4.162   7.552
  592    H    ARG  71           H        ARG  71 -12.936  -1.908   4.711
  593    HA   ARG  71           HA       ARG  71 -12.373   0.349   6.107
  594   1HB   ARG  71          1HB       ARG  71 -10.868  -1.370   6.301
  595   2HB   ARG  71          2HB       ARG  71 -10.868  -1.701   4.570
  596   1HG   ARG  71          1HG       ARG  71  -8.702  -1.042   5.179
  597   2HG   ARG  71          2HG       ARG  71  -9.403   0.151   4.114
  598   1HD   ARG  71          1HD       ARG  71  -9.930   1.530   6.274
  599   2HD   ARG  71          2HD       ARG  71  -8.967   0.335   7.112
  600    HE   ARG  71           HE       ARG  71  -7.023   1.173   6.152
  601   1HH1  ARG  71          1HH1      ARG  71  -9.858   2.646   4.593
  602   2HH1  ARG  71          2HH1      ARG  71  -8.911   3.546   3.449
  603   1HH2  ARG  71          1HH2      ARG  71  -5.819   2.346   4.589
  604   2HH2  ARG  71          2HH2      ARG  71  -6.624   3.341   3.401
  605    H    ILE  72           H        ILE  72 -11.788   0.029   2.558
  606    HA   ILE  72           HA       ILE  72 -10.548   2.652   2.365
  607    HB   ILE  72           HB       ILE  72 -11.487   0.705   0.264
  608   1HG1  ILE  72          1HG1      ILE  72  -8.608   1.490   0.874
  609   2HG1  ILE  72          2HG1      ILE  72  -9.394   0.311   1.902
  610   1HG2  ILE  72          1HG2      ILE  72 -10.111   2.104  -1.310
  611   2HG2  ILE  72          2HG2      ILE  72 -11.548   2.940  -0.727
  612   3HG2  ILE  72          3HG2      ILE  72  -9.958   3.327  -0.035
  613   1HD1  ILE  72          1HD1      ILE  72  -8.262  -0.877   0.116
  614   2HD1  ILE  72          2HD1      ILE  72 -10.014  -1.087  -0.037
  615   3HD1  ILE  72          3HD1      ILE  72  -9.166   0.030  -1.116
  616    H    LYS  73           H        LYS  73 -13.515   1.553   0.679
  617    HA   LYS  73           HA       LYS  73 -14.509   3.993   0.078
  618   1HB   LYS  73          1HB       LYS  73 -16.752   2.890   0.009
  619   2HB   LYS  73          2HB       LYS  73 -15.410   2.190  -0.876
  620   1HG   LYS  73          1HG       LYS  73 -15.188   0.599   1.291
  621   2HG   LYS  73          2HG       LYS  73 -16.863   1.103   1.513
  622   1HD   LYS  73          1HD       LYS  73 -16.913  -0.900   0.242
  623   2HD   LYS  73          2HD       LYS  73 -17.221   0.400  -0.924
  624   1HE   LYS  73          1HE       LYS  73 -14.700   0.252  -1.536
  625   2HE   LYS  73          2HE       LYS  73 -14.620  -1.160  -0.491
  626   1HZ   LYS  73          1HZ       LYS  73 -15.061  -1.820  -2.744
  627   2HZ   LYS  73          2HZ       LYS  73 -16.495  -0.932  -2.753
  628    H    GLN  74           H        GLN  74 -15.082   2.300   3.177
  629    HA   GLN  74           HA       GLN  74 -16.787   4.271   4.355
  630   1HB   GLN  74          1HB       GLN  74 -16.589   1.956   5.128
  631   2HB   GLN  74          2HB       GLN  74 -14.937   2.249   5.689
  632   1HG   GLN  74          1HG       GLN  74 -17.374   3.782   6.700
  633   2HG   GLN  74          2HG       GLN  74 -16.793   2.285   7.436
  634   1HE2  GLN  74          1HE2      GLN  74 -14.184   2.378   7.745
  635   2HE2  GLN  74          2HE2      GLN  74 -13.678   3.793   8.641
  636    H    GLY  75           H        GLY  75 -13.240   3.693   4.681
  637   1HA   GLY  75          1HA       GLY  75 -12.871   6.386   5.946
  638   2HA   GLY  75          2HA       GLY  75 -11.881   4.955   6.167
  639    HA   PRO  76           HA       PRO  76 -10.929   6.458   1.678
  640   1HB   PRO  76          1HB       PRO  76 -11.465   9.101   1.037
  641   2HB   PRO  76          2HB       PRO  76 -12.628   7.761   0.826
  642   1HG   PRO  76          1HG       PRO  76 -12.399   9.668   3.171
  643   2HG   PRO  76          2HG       PRO  76 -13.866   9.267   2.226
  644   1HD   PRO  76          1HD       PRO  76 -13.352   8.033   4.559
  645   2HD   PRO  76          2HD       PRO  76 -13.969   7.084   3.169
  646    HA   PRO  77           HA       PRO  77  -7.075   8.062   3.016
  647   1HB   PRO  77          1HB       PRO  77  -5.816   8.935   0.742
  648   2HB   PRO  77          2HB       PRO  77  -6.243   7.221   1.020
  649   1HG   PRO  77          1HG       PRO  77  -7.858   9.268  -0.521
  650   2HG   PRO  77          2HG       PRO  77  -7.320   7.655  -1.086
  651   1HD   PRO  77          1HD       PRO  77  -9.786   7.999  -0.054
  652   2HD   PRO  77          2HD       PRO  77  -8.841   6.550   0.388
  653    H    ALA  78           H        ALA  78  -5.666   9.967   3.243
  654    HA   ALA  78           HA       ALA  78  -7.181  12.429   3.598
  655   1HB   ALA  78          1HB       ALA  78  -5.141  13.200   4.715
  656   2HB   ALA  78          2HB       ALA  78  -5.619  11.599   5.308
  657   3HB   ALA  78          3HB       ALA  78  -4.268  11.751   4.164
  658    H    ALA  79           H        ALA  79  -7.231  11.926   0.912
  659    HA   ALA  79           HA       ALA  79  -5.955  14.257  -0.252
  660   1HB   ALA  79          1HB       ALA  79  -4.829  12.929  -2.002
  661   2HB   ALA  79          2HB       ALA  79  -4.080  12.748  -0.397
  662   3HB   ALA  79          3HB       ALA  79  -5.115  11.456  -1.032
  663    H    GLU  80           H        GLU  80  -6.847  14.533  -2.470
  664    HA   GLU  80           HA       GLU  80  -9.612  13.679  -2.555
  665   1HB   GLU  80          1HB       GLU  80  -8.808  15.957  -3.186
  666   2HB   GLU  80          2HB       GLU  80  -8.067  15.266  -4.637
  667   1HG   GLU  80          1HG       GLU  80 -10.373  14.366  -5.266
  668   2HG   GLU  80          2HG       GLU  80 -11.024  15.260  -3.885
  669    HE2  GLU  80           HE       GLU  80 -10.264  18.430  -5.444
  670    H    VAL  81           H        VAL  81  -9.357  11.389  -2.691
  671    HA   VAL  81           HA       VAL  81  -8.399  10.030  -5.039
  672    HB   VAL  81           HB       VAL  81  -8.856   8.957  -2.879
  673   1HG1  VAL  81          1HG1      VAL  81 -11.826   9.169  -3.535
  674   2HG1  VAL  81          2HG1      VAL  81 -11.080   8.351  -2.159
  675   3HG1  VAL  81          3HG1      VAL  81 -10.998  10.114  -2.278
  676   1HG2  VAL  81          1HG2      VAL  81 -10.488   7.804  -5.186
  677   2HG2  VAL  81          2HG2      VAL  81  -8.732   7.646  -4.974
  678   3HG2  VAL  81          3HG2      VAL  81  -9.835   6.907  -3.800
  679    H    GLU  82           H        GLU  82  -9.172   9.909  -6.978
  680    HA   GLU  82           HA       GLU  82 -11.668  11.307  -7.700
  681   1HB   GLU  82          1HB       GLU  82  -9.525  11.806  -8.852
  682   2HB   GLU  82          2HB       GLU  82  -9.465  10.138  -9.453
  683   1HG   GLU  82          1HG       GLU  82 -11.699  10.559 -10.573
  684   2HG   GLU  82          2HG       GLU  82 -11.609  12.239 -10.021
  685    HE2  GLU  82           HE       GLU  82  -8.979  13.069 -12.258
  686    H    LYS  83           H        LYS  83  -9.947   8.202  -8.456
  687    HA   LYS  83           HA       LYS  83 -12.506   6.749  -8.318
  688   1HB   LYS  83          1HB       LYS  83 -10.825   7.033 -10.830
  689   2HB   LYS  83          2HB       LYS  83 -11.905   5.653 -10.583
  690   1HG   LYS  83          1HG       LYS  83 -12.841   8.535 -10.511
  691   2HG   LYS  83          2HG       LYS  83 -12.822   7.510 -11.951
  692   1HD   LYS  83          1HD       LYS  83 -14.340   5.896 -10.864
  693   2HD   LYS  83          2HD       LYS  83 -14.408   6.917  -9.411
  694   1HE   LYS  83          1HE       LYS  83 -15.331   8.782 -10.741
  695   2HE   LYS  83          2HE       LYS  83 -15.271   7.775 -12.204
  696   1HZ   LYS  83          1HZ       LYS  83 -17.452   7.659 -11.260
  697   2HZ   LYS  83          2HZ       LYS  83 -16.834   7.085  -9.799
  698    H    VAL  84           H        VAL  84 -12.174   5.104  -7.121
  699    HA   VAL  84           HA       VAL  84  -9.583   3.652  -7.153
  700    HB   VAL  84           HB       VAL  84 -10.148   4.072  -5.044
  701   1HG1  VAL  84          1HG1      VAL  84 -12.982   3.122  -5.564
  702   2HG1  VAL  84          2HG1      VAL  84 -12.286   3.451  -3.959
  703   3HG1  VAL  84          3HG1      VAL  84 -12.436   4.762  -5.134
  704   1HG2  VAL  84          1HG2      VAL  84 -11.120   1.223  -5.490
  705   2HG2  VAL  84          2HG2      VAL  84  -9.426   1.736  -5.609
  706   3HG2  VAL  84          3HG2      VAL  84 -10.293   1.890  -4.068
  707    H    ASP  85           H        ASP  85  -9.450   2.458  -8.951
  708    HA   ASP  85           HA       ASP  85 -11.794   1.056 -10.084
  709   1HB   ASP  85          1HB       ASP  85 -10.529   2.598 -11.460
  710   2HB   ASP  85          2HB       ASP  85  -9.021   1.745 -11.089
  711    HD2  ASP  85           HD       ASP  85  -9.568   0.214 -14.165
  712    H    TYR  86           H        TYR  86 -11.749  -0.612  -8.321
  713    HA   TYR  86           HA       TYR  86  -9.304  -2.186  -8.185
  714   1HB   TYR  86          1HB       TYR  86  -9.843  -2.817  -6.140
  715   2HB   TYR  86          2HB       TYR  86 -10.870  -1.405  -6.185
  716    HD1  TYR  86           1HD      TYR  86 -10.684  -5.074  -6.031
  717    HD2  TYR  86           2HD      TYR  86 -13.379  -1.744  -6.547
  718    HE1  TYR  86           1HE      TYR  86 -12.580  -6.497  -5.340
  719    HE2  TYR  86           2HE      TYR  86 -15.270  -3.166  -5.817
  720    HH   TYR  86           HH       TYR  86 -15.928  -5.247  -5.084
  721    H    SER  87           H        SER  87  -9.143  -4.412  -8.357
  722    HA   SER  87           HA       SER  87 -11.337  -5.881  -9.653
  723   1HB   SER  87          1HB       SER  87  -8.564  -5.785 -10.916
  724   2HB   SER  87          2HB       SER  87  -9.982  -6.679 -11.495
  725    HG   SER  87           HG       SER  87 -10.993  -4.478 -11.526
  726    H    PHE  88           H        PHE  88 -11.407  -7.964  -9.102
  727    HA   PHE  88           HA       PHE  88  -9.441  -9.060  -7.183
  728   1HB   PHE  88          1HB       PHE  88 -11.446  -9.415  -6.257
  729   2HB   PHE  88          2HB       PHE  88 -12.314  -9.333  -7.774
  730    HD1  PHE  88           1HD      PHE  88  -9.673 -11.658  -6.416
  731    HD2  PHE  88           2HD      PHE  88 -13.589 -11.265  -8.155
  732    HE1  PHE  88           1HE      PHE  88  -9.876 -14.129  -6.511
  733    HE2  PHE  88           2HE      PHE  88 -13.807 -13.730  -8.211
  734    HZ   PHE  88           HZ       PHE  88 -11.954 -15.169  -7.384
  735    H    SER  89           H        SER  89  -7.875 -10.436  -7.917
  736    HA   SER  89           HA       SER  89  -8.543 -12.342 -10.115
  737   1HB   SER  89          1HB       SER  89  -5.818 -11.106  -9.808
  738   2HB   SER  89          2HB       SER  89  -6.456 -12.074 -11.146
  739    HG   SER  89           HG       SER  89  -8.024 -10.309 -11.395
  740    H    GLU  90           H        GLU  90  -6.479 -14.048 -10.078
  741    HA   GLU  90           HA       GLU  90  -6.108 -14.967  -7.271
  742   1HB   GLU  90          1HB       GLU  90  -5.679 -16.302  -9.972
  743   2HB   GLU  90          2HB       GLU  90  -5.104 -16.992  -8.454
  744   1HG   GLU  90          1HG       GLU  90  -8.008 -16.371  -9.119
  745   2HG   GLU  90          2HG       GLU  90  -7.247 -17.969  -9.103
  746    HE2  GLU  90           HE       GLU  90  -6.789 -17.699  -5.445
  747    H    TYR  91           H        TYR  91  -4.014 -15.529  -6.506
  748    HA   TYR  91           HA       TYR  91  -2.055 -13.551  -7.048
  749   1HB   TYR  91          1HB       TYR  91  -0.826 -14.643  -5.329
  750   2HB   TYR  91          2HB       TYR  91  -2.527 -14.588  -4.857
  751    HD1  TYR  91           1HD      TYR  91   0.313 -16.773  -5.740
  752    HD2  TYR  91           2HD      TYR  91  -3.877 -16.658  -4.785
  753    HE1  TYR  91           1HE      TYR  91   0.331 -19.221  -5.359
  754    HE2  TYR  91           2HE      TYR  91  -3.878 -19.107  -4.447
  755    HH   TYR  91           HH       TYR  91  -2.620 -21.013  -4.391
  756    H    LYS  92           H        LYS  92  -0.312 -13.544  -8.285
  757    HA   LYS  92           HA       LYS  92   0.333 -15.712 -10.118
  758   1HB   LYS  92          1HB       LYS  92   0.696 -13.314 -10.671
  759   2HB   LYS  92          2HB       LYS  92   1.822 -13.182  -9.318
  760   1HG   LYS  92          1HG       LYS  92   3.225 -13.426 -11.178
  761   2HG   LYS  92          2HG       LYS  92   3.220 -15.019 -10.437
  762   1HD   LYS  92          1HD       LYS  92   3.025 -15.425 -12.741
  763   2HD   LYS  92          2HD       LYS  92   1.373 -15.644 -12.152
  764   1HE   LYS  92          1HE       LYS  92   0.806 -13.337 -12.936
  765   2HE   LYS  92          2HE       LYS  92   2.491 -13.102 -13.442
  766   1HZ   LYS  92          1HZ       LYS  92   1.199 -13.777 -15.316
  767   2HZ   LYS  92          2HZ       LYS  92   0.724 -15.197 -14.533
  768    H    GLY  93           H        GLY  93   1.727 -14.187  -7.180
  769   1HA   GLY  93          1HA       GLY  93   2.715 -16.701  -6.131
  770   2HA   GLY  93          2HA       GLY  93   3.979 -15.550  -6.620
  771    H    GLU  94           H        GLU  94   3.906 -16.115  -4.004
  772    HA   GLU  94           HA       GLU  94   2.278 -14.189  -2.523
  773   1HB   GLU  94          1HB       GLU  94   3.264 -15.119  -0.542
  774   2HB   GLU  94          2HB       GLU  94   2.453 -16.316  -1.556
  775   1HG   GLU  94          1HG       GLU  94   4.680 -17.096  -2.392
  776   2HG   GLU  94          2HG       GLU  94   5.464 -15.936  -1.304
  777    HE2  GLU  94           HE       GLU  94   3.743 -19.272   0.208
  778    H    PHE  95           H        PHE  95   2.883 -12.167  -2.552
  779    HA   PHE  95           HA       PHE  95   5.522 -11.106  -3.034
  780   1HB   PHE  95          1HB       PHE  95   2.978 -10.006  -1.779
  781   2HB   PHE  95          2HB       PHE  95   4.463  -9.091  -1.888
  782    HD1  PHE  95           1HD      PHE  95   5.009  -7.844  -3.819
  783    HD2  PHE  95           2HD      PHE  95   1.950 -10.872  -4.055
  784    HE1  PHE  95           1HE      PHE  95   4.251  -6.921  -5.988
  785    HE2  PHE  95           2HE      PHE  95   1.221  -9.970  -6.234
  786    HZ   PHE  95           HZ       PHE  95   2.347  -7.970  -7.194
  787    H    GLU  96           H        GLU  96   7.205 -10.874  -1.547
  788    HA   GLU  96           HA       GLU  96   6.985 -11.978   1.062
  789   1HB   GLU  96          1HB       GLU  96   9.182 -10.274  -0.172
  790   2HB   GLU  96          2HB       GLU  96   9.285 -11.200   1.339
  791   1HG   GLU  96          1HG       GLU  96   8.695 -13.278  -0.002
  792   2HG   GLU  96          2HG       GLU  96   8.884 -12.318  -1.475
  793    HE2  GLU  96           HE       GLU  96  12.407 -11.921  -1.002
  794    H    ASP  97           H        ASP  97   5.456 -10.917   2.292
  795    HA   ASP  97           HA       ASP  97   4.564  -9.405   3.707
  796   1HB   ASP  97          1HB       ASP  97   7.007  -7.629   3.312
  797   2HB   ASP  97          2HB       ASP  97   5.803  -7.538   4.592
  798    HD2  ASP  97           HD       ASP  97   8.729 -10.260   4.860
  799    H    PHE  98           H        PHE  98   4.325  -6.668   3.636
  800    HA   PHE  98           HA       PHE  98   3.253  -6.033   0.931
  801   1HB   PHE  98          1HB       PHE  98   1.549  -6.910   2.532
  802   2HB   PHE  98          2HB       PHE  98   1.894  -5.585   3.599
  803    HD1  PHE  98           1HD      PHE  98  -0.771  -5.974   3.052
  804    HD2  PHE  98           2HD      PHE  98   2.064  -3.970   0.492
  805    HE1  PHE  98           1HE      PHE  98  -2.629  -4.917   1.782
  806    HE2  PHE  98           2HE      PHE  98   0.215  -3.028  -0.818
  807    HZ   PHE  98           HZ       PHE  98  -2.137  -3.510  -0.196
  808    H    GLU  99           H        GLU  99   5.278  -4.841   0.686
  809    HA   GLU  99           HA       GLU  99   5.629  -2.569   2.581
  810   1HB   GLU  99          1HB       GLU  99   7.420  -4.164   2.423
  811   2HB   GLU  99          2HB       GLU  99   7.639  -3.803   0.708
  812   1HG   GLU  99          1HG       GLU  99   8.245  -1.482   1.235
  813   2HG   GLU  99          2HG       GLU  99   7.752  -1.696   2.923
  814    HE2  GLU  99           HE       GLU  99  11.220  -3.418   1.630
  815    H    THR 100           H        THR 100   6.286  -0.511   1.697
  816    HA   THR 100           HA       THR 100   4.667   0.114  -0.666
  817    HB   THR 100           HB       THR 100   3.932   1.921   0.394
  818    HG1  THR 100           1HG      THR 100   5.107   3.000   2.058
  819   1HG2  THR 100          1HG2      THR 100   3.351   1.399   2.654
  820   2HG2  THR 100          2HG2      THR 100   3.532  -0.170   1.839
  821   3HG2  THR 100          3HG2      THR 100   4.810   0.432   2.905
  822    H    TYR 101           H        TYR 101   5.387   1.310  -2.376
  823    HA   TYR 101           HA       TYR 101   8.140   2.503  -2.344
  824   1HB   TYR 101          1HB       TYR 101   8.056   0.818  -3.913
  825   2HB   TYR 101          2HB       TYR 101   6.487   1.285  -4.536
  826    HD1  TYR 101           1HD      TYR 101   6.310   3.631  -5.696
  827    HD2  TYR 101           2HD      TYR 101   9.774   1.122  -5.369
  828    HE1  TYR 101           1HE      TYR 101   7.275   4.690  -7.715
  829    HE2  TYR 101           2HE      TYR 101  10.792   2.254  -7.326
  830    HH   TYR 101           HH       TYR 101  10.549   3.906  -8.914
  Start of MODEL    6
    1   1H    GLY  -1          1H        GLY  -1  20.320 -33.663  10.617
    2   2H    GLY  -1          2H        GLY  -1  20.012 -32.934   9.166
    3   3H    GLY  -1          3H        GLY  -1  19.643 -32.156  10.565
    4   1HA   GLY  -1          1HA       GLY  -1  18.393 -34.624   9.602
    5   2HA   GLY  -1          2HA       GLY  -1  17.990 -33.780  11.111
    6    H    SER   0           H        SER   0  15.857 -34.097   9.696
    7    HA   SER   0           HA       SER   0  15.216 -31.436   8.588
    8   1HB   SER   0          1HB       SER   0  14.691 -34.025   7.052
    9   2HB   SER   0          2HB       SER   0  14.098 -32.407   6.626
   10    HG   SER   0           HG       SER   0  16.353 -31.780   6.566
   11    H    MET   1           H        MET   1  13.782 -34.705   8.937
   12    HA   MET   1           HA       MET   1  11.704 -35.346   9.504
   13   1HB   MET   1          1HB       MET   1  11.273 -35.173  11.905
   14   2HB   MET   1          2HB       MET   1  12.904 -35.702  11.512
   15   1HG   MET   1          1HG       MET   1  12.362 -32.790  12.148
   16   2HG   MET   1          2HG       MET   1  12.517 -33.991  13.424
   17   1HE   MET   1          1HE       MET   1  14.332 -31.252  12.709
   18   2HE   MET   1          2HE       MET   1  15.870 -31.833  13.389
   19   3HE   MET   1          3HE       MET   1  14.347 -32.129  14.260
   20    H    LYS   2           H        LYS   2  11.353 -33.211   7.899
   21    HA   LYS   2           HA       LYS   2   8.822 -31.986   8.939
   22   1HB   LYS   2          1HB       LYS   2  11.043 -30.884   7.203
   23   2HB   LYS   2          2HB       LYS   2   9.398 -30.238   7.112
   24   1HG   LYS   2          1HG       LYS   2   9.371 -29.731   9.486
   25   2HG   LYS   2          2HG       LYS   2  10.977 -30.422   9.717
   26   1HD   LYS   2          1HD       LYS   2  10.382 -28.057   7.883
   27   2HD   LYS   2          2HD       LYS   2  10.872 -27.910   9.580
   28   1HE   LYS   2          1HE       LYS   2  12.986 -29.118   9.094
   29   2HE   LYS   2          2HE       LYS   2  12.545 -29.204   7.376
   30   1HZ   LYS   2          1HZ       LYS   2  13.922 -27.299   7.748
   31   2HZ   LYS   2          2HZ       LYS   2  12.823 -26.677   8.869
   32    H    LYS   3           H        LYS   3  10.508 -32.587   5.848
   33    HA   LYS   3           HA       LYS   3  10.106 -33.769   4.050
   34   1HB   LYS   3          1HB       LYS   3   9.705 -35.631   5.583
   35   2HB   LYS   3          2HB       LYS   3   7.985 -35.243   5.663
   36   1HG   LYS   3          1HG       LYS   3   8.352 -37.095   4.181
   37   2HG   LYS   3          2HG       LYS   3   7.719 -35.724   3.265
   38   1HD   LYS   3          1HD       LYS   3   9.927 -35.247   2.343
   39   2HD   LYS   3          2HD       LYS   3  10.681 -36.445   3.420
   40   1HE   LYS   3          1HE       LYS   3   9.425 -38.257   2.299
   41   2HE   LYS   3          2HE       LYS   3   8.624 -37.068   1.250
   42   1HZ   LYS   3          1HZ       LYS   3  10.504 -37.985   0.110
   43   2HZ   LYS   3          2HZ       LYS   3  11.546 -37.475   1.338
   44    H    TRP   4           H        TRP   4   6.846 -33.238   5.372
   45    HA   TRP   4           HA       TRP   4   4.849 -32.935   4.187
   46   1HB   TRP   4          1HB       TRP   4   6.356 -30.314   3.837
   47   2HB   TRP   4          2HB       TRP   4   4.618 -30.517   4.079
   48    HD1  TRP   4           HD       TRP   4   7.361 -29.252   5.858
   49    HE1  TRP   4           1HE      TRP   4   7.186 -29.489   8.427
   50    HE3  TRP   4           3HE      TRP   4   3.609 -32.745   6.135
   51    HZ2  TRP   4           2HZ      TRP   4   5.680 -31.001  10.312
   52    HZ3  TRP   4           3HZ      TRP   4   2.854 -33.575   8.332
   53    HH2  TRP   4           HH       TRP   4   3.876 -32.716  10.425
   54    H    SER   5           H        SER   5   5.749 -34.469   2.416
   55    HA   SER   5           HA       SER   5   6.015 -33.157  -0.203
   56   1HB   SER   5          1HB       SER   5   6.228 -35.496  -1.009
   57   2HB   SER   5          2HB       SER   5   7.401 -35.067   0.244
   58    HG   SER   5           HG       SER   5   6.130 -36.163   1.754
   59    H    ASP   6           H        ASP   6   3.749 -32.198   0.685
   60    HA   ASP   6           HA       ASP   6   1.761 -33.185  -1.103
   61   1HB   ASP   6          1HB       ASP   6   1.418 -34.832   0.741
   62   2HB   ASP   6          2HB       ASP   6   1.220 -33.502   1.889
   63    HD2  ASP   6           HD       ASP   6  -2.168 -34.204   1.264
   64    H    THR   7           H        THR   7   2.650 -30.958  -1.535
   65    HA   THR   7           HA       THR   7   1.113 -28.828  -0.091
   66    HB   THR   7           HB       THR   7   3.007 -27.346  -0.888
   67    HG1  THR   7           1HG      THR   7   4.952 -28.471  -1.353
   68   1HG2  THR   7          1HG2      THR   7   4.534 -28.022   0.930
   69   2HG2  THR   7          2HG2      THR   7   2.839 -28.089   1.450
   70   3HG2  THR   7          3HG2      THR   7   3.706 -29.586   1.057
   71    H    GLU   8           H        GLU   8  -0.559 -29.747  -1.627
   72    HA   GLU   8           HA       GLU   8  -0.514 -28.131  -4.122
   73   1HB   GLU   8          1HB       GLU   8   0.150 -30.453  -4.677
   74   2HB   GLU   8          2HB       GLU   8  -1.369 -31.051  -3.984
   75   1HG   GLU   8          1HG       GLU   8  -2.635 -29.649  -5.629
   76   2HG   GLU   8          2HG       GLU   8  -1.101 -29.078  -6.308
   77    HE2  GLU   8           HE       GLU   8  -0.346 -32.330  -7.674
   78    H    VAL   9           H        VAL   9  -1.916 -26.637  -3.382
   79    HA   VAL   9           HA       VAL   9  -4.708 -27.398  -3.162
   80    HB   VAL   9           HB       VAL   9  -3.985 -27.613  -0.834
   81   1HG1  VAL   9          1HG1      VAL   9  -3.181 -24.683  -0.918
   82   2HG1  VAL   9          2HG1      VAL   9  -3.151 -25.760   0.485
   83   3HG1  VAL   9          3HG1      VAL   9  -2.038 -26.042  -0.863
   84   1HG2  VAL   9          1HG2      VAL   9  -5.665 -25.106  -1.257
   85   2HG2  VAL   9          2HG2      VAL   9  -6.250 -26.787  -1.291
   86   3HG2  VAL   9          3HG2      VAL   9  -5.601 -26.105   0.207
   87    H    PHE  10           H        PHE  10  -5.944 -25.831  -4.067
   88    HA   PHE  10           HA       PHE  10  -4.466 -23.559  -5.320
   89   1HB   PHE  10          1HB       PHE  10  -7.021 -24.903  -6.237
   90   2HB   PHE  10          2HB       PHE  10  -5.982 -23.810  -7.147
   91    HD1  PHE  10           1HD      PHE  10  -3.519 -24.619  -7.593
   92    HD2  PHE  10           2HD      PHE  10  -6.706 -27.258  -6.364
   93    HE1  PHE  10           1HE      PHE  10  -2.230 -26.571  -8.416
   94    HE2  PHE  10           2HE      PHE  10  -5.410 -29.200  -7.191
   95    HZ   PHE  10           HZ       PHE  10  -3.192 -28.858  -8.258
   96    H    GLU  11           H        GLU  11  -7.372 -24.493  -3.584
   97    HA   GLU  11           HA       GLU  11  -8.718 -21.932  -3.768
   98   1HB   GLU  11          1HB       GLU  11 -10.316 -23.015  -2.190
   99   2HB   GLU  11          2HB       GLU  11 -10.096 -23.848  -3.724
  100   1HG   GLU  11          1HG       GLU  11  -8.426 -24.754  -1.369
  101   2HG   GLU  11          2HG       GLU  11 -10.141 -25.161  -1.417
  102    HE2  GLU  11           HE       GLU  11  -9.869 -27.520  -3.946
  103    H    MET  12           H        MET  12  -6.546 -20.952  -2.987
  104    HA   MET  12           HA       MET  12  -6.493 -20.702  -0.018
  105   1HB   MET  12          1HB       MET  12  -4.412 -19.796  -2.012
  106   2HB   MET  12          2HB       MET  12  -4.265 -19.890  -0.248
  107   1HG   MET  12          1HG       MET  12  -4.587 -22.354  -0.366
  108   2HG   MET  12          2HG       MET  12  -4.471 -22.258  -2.129
  109   1HE   MET  12          1HE       MET  12  -2.346 -21.877  -3.466
  110   2HE   MET  12          2HE       MET  12  -0.800 -21.310  -2.795
  111   3HE   MET  12          3HE       MET  12  -2.211 -20.231  -2.795
  112    H    LEU  13           H        LEU  13  -5.016 -18.089  -0.511
  113    HA   LEU  13           HA       LEU  13  -7.295 -16.290  -0.538
  114   1HB   LEU  13          1HB       LEU  13  -5.474 -14.568  -0.391
  115   2HB   LEU  13          2HB       LEU  13  -5.647 -15.650   0.981
  116    HG   LEU  13           HG       LEU  13  -3.647 -16.485  -1.091
  117   1HD1  LEU  13          1HD1      LEU  13  -1.975 -14.885  -0.216
  118   2HD1  LEU  13          2HD1      LEU  13  -3.308 -14.074  -1.057
  119   3HD1  LEU  13          3HD1      LEU  13  -3.250 -14.069   0.720
  120   1HD2  LEU  13          1HD2      LEU  13  -2.360 -17.053   0.946
  121   2HD2  LEU  13          2HD2      LEU  13  -3.565 -16.241   1.964
  122   3HD2  LEU  13          3HD2      LEU  13  -3.990 -17.722   1.093
  123    H    LYS  14           H        LYS  14  -7.354 -14.377  -1.898
  124    HA   LYS  14           HA       LYS  14  -6.649 -14.918  -4.744
  125   1HB   LYS  14          1HB       LYS  14  -8.861 -14.968  -4.854
  126   2HB   LYS  14          2HB       LYS  14  -9.116 -14.221  -3.290
  127   1HG   LYS  14          1HG       LYS  14  -8.436 -12.612  -5.778
  128   2HG   LYS  14          2HG       LYS  14 -10.064 -13.042  -5.260
  129   1HD   LYS  14          1HD       LYS  14  -9.503 -11.968  -2.980
  130   2HD   LYS  14          2HD       LYS  14  -8.141 -11.192  -3.802
  131   1HE   LYS  14          1HE       LYS  14 -11.051 -10.948  -4.573
  132   2HE   LYS  14          2HE       LYS  14 -10.038  -9.727  -3.783
  133   1HZ   LYS  14          1HZ       LYS  14 -10.096  -9.288  -6.117
  134   2HZ   LYS  14          2HZ       LYS  14  -9.465 -10.815  -6.458
  135    H    ARG  15           H        ARG  15  -5.905 -13.096  -5.993
  136    HA   ARG  15           HA       ARG  15  -4.624 -10.951  -4.440
  137   1HB   ARG  15          1HB       ARG  15  -3.168 -12.052  -5.760
  138   2HB   ARG  15          2HB       ARG  15  -4.280 -12.127  -7.156
  139   1HG   ARG  15          1HG       ARG  15  -3.953  -9.843  -7.664
  140   2HG   ARG  15          2HG       ARG  15  -3.117  -9.530  -6.122
  141   1HD   ARG  15          1HD       ARG  15  -1.245 -10.879  -6.753
  142   2HD   ARG  15          2HD       ARG  15  -2.100 -11.565  -8.152
  143    HE   ARG  15           HE       ARG  15  -2.097  -8.960  -8.810
  144   1HH1  ARG  15          2HH1      ARG  15   0.542 -11.067  -7.706
  145   2HH1  ARG  15          1HH1      ARG  15   1.754 -10.286  -8.685
  146   1HH2  ARG  15          1HH2      ARG  15  -0.511  -8.003 -10.168
  147   2HH2  ARG  15          2HH2      ARG  15   1.140  -8.568 -10.122
  148    H    MET  16           H        MET  16  -5.842  -9.136  -4.119
  149    HA   MET  16           HA       MET  16  -7.658  -8.124  -6.229
  150   1HB   MET  16          1HB       MET  16  -8.019  -6.350  -4.636
  151   2HB   MET  16          2HB       MET  16  -8.550  -7.936  -4.092
  152   1HG   MET  16          1HG       MET  16  -6.670  -8.078  -2.573
  153   2HG   MET  16          2HG       MET  16  -5.963  -6.619  -3.316
  154   1HE   MET  16          1HE       MET  16  -6.614  -4.359  -3.082
  155   2HE   MET  16          2HE       MET  16  -7.745  -3.692  -1.885
  156   3HE   MET  16          3HE       MET  16  -8.363  -4.424  -3.386
  157    H    TYR  17           H        TYR  17  -7.256  -5.931  -7.045
  158    HA   TYR  17           HA       TYR  17  -4.519  -4.857  -6.842
  159   1HB   TYR  17          1HB       TYR  17  -4.194  -6.355  -8.656
  160   2HB   TYR  17          2HB       TYR  17  -5.785  -6.023  -9.320
  161    HD1  TYR  17           1HD      TYR  17  -5.126  -5.530 -11.551
  162    HD2  TYR  17           2HD      TYR  17  -3.317  -3.374  -8.276
  163    HE1  TYR  17           1HE      TYR  17  -4.438  -3.738 -13.107
  164    HE2  TYR  17           2HE      TYR  17  -2.677  -1.571  -9.840
  165    HH   TYR  17           HH       TYR  17  -2.664  -0.824 -12.007
  166    H    ALA  18           H        ALA  18  -5.468  -3.249  -5.669
  167    HA   ALA  18           HA       ALA  18  -7.611  -1.655  -6.928
  168   1HB   ALA  18          1HB       ALA  18  -7.660  -0.486  -4.804
  169   2HB   ALA  18          2HB       ALA  18  -7.914  -2.243  -4.635
  170   3HB   ALA  18          3HB       ALA  18  -6.337  -1.527  -4.201
  171    H    ARG  19           H        ARG  19  -6.696  -0.685  -8.534
  172    HA   ARG  19           HA       ARG  19  -4.429   1.140  -8.245
  173   1HB   ARG  19          1HB       ARG  19  -4.672  -0.067 -10.305
  174   2HB   ARG  19          2HB       ARG  19  -6.318   0.521 -10.551
  175   1HG   ARG  19          1HG       ARG  19  -4.489   1.558 -11.935
  176   2HG   ARG  19          2HG       ARG  19  -5.538   2.697 -11.089
  177   1HD   ARG  19          1HD       ARG  19  -3.880   3.236  -9.477
  178   2HD   ARG  19          2HD       ARG  19  -2.962   1.765  -9.826
  179    HE   ARG  19           HE       ARG  19  -1.777   2.793 -11.347
  180   1HH1  ARG  19          1HH1      ARG  19  -4.867   4.559 -11.278
  181   2HH1  ARG  19          2HH1      ARG  19  -4.368   5.715 -12.482
  182   1HH2  ARG  19          1HH2      ARG  19  -1.116   4.382 -12.847
  183   2HH2  ARG  19          2HH2      ARG  19  -2.231   5.616 -13.373
  184    H    VAL  20           H        VAL  20  -4.815   2.875  -7.019
  185    HA   VAL  20           HA       VAL  20  -7.597   3.732  -6.526
  186    HB   VAL  20           HB       VAL  20  -4.974   4.613  -5.234
  187   1HG1  VAL  20          1HG1      VAL  20  -7.799   4.715  -4.113
  188   2HG1  VAL  20          2HG1      VAL  20  -6.326   5.354  -3.374
  189   3HG1  VAL  20          3HG1      VAL  20  -6.972   6.108  -4.838
  190   1HG2  VAL  20          1HG2      VAL  20  -6.838   2.331  -4.486
  191   2HG2  VAL  20          2HG2      VAL  20  -5.109   2.242  -4.889
  192   3HG2  VAL  20          3HG2      VAL  20  -5.623   3.021  -3.399
  193    H    TYR  21           H        TYR  21  -8.187   4.889  -8.399
  194    HA   TYR  21           HA       TYR  21  -6.346   6.501  -9.834
  195   1HB   TYR  21          1HB       TYR  21  -9.369   6.752  -9.831
  196   2HB   TYR  21          2HB       TYR  21  -8.287   7.443 -11.013
  197    HD1  TYR  21           1HD      TYR  21 -10.093   6.384 -12.476
  198    HD2  TYR  21           2HD      TYR  21  -7.113   4.117 -10.354
  199    HE1  TYR  21           1HE      TYR  21 -10.599   4.388 -13.862
  200    HE2  TYR  21           2HE      TYR  21  -7.806   2.075 -11.567
  201    HH   TYR  21           HH       TYR  21  -9.213   1.173 -13.142
  202    H    GLY  22           H        GLY  22  -6.018   8.732  -9.976
  203   1HA   GLY  22          1HA       GLY  22  -7.025  10.917  -9.762
  204   2HA   GLY  22          2HA       GLY  22  -7.530  10.527  -8.118
  205    H    LEU  23           H        LEU  23  -6.466  12.525  -7.555
  206    HA   LEU  23           HA       LEU  23  -3.532  12.627  -7.778
  207   1HB   LEU  23          1HB       LEU  23  -5.123  14.531  -8.317
  208   2HB   LEU  23          2HB       LEU  23  -5.366  14.692  -6.573
  209    HG   LEU  23           HG       LEU  23  -2.771  14.953  -6.438
  210   1HD1  LEU  23          1HD1      LEU  23  -1.702  15.811  -8.497
  211   2HD1  LEU  23          2HD1      LEU  23  -2.175  14.123  -8.690
  212   3HD1  LEU  23          3HD1      LEU  23  -3.153  15.406  -9.429
  213   1HD2  LEU  23          1HD2      LEU  23  -2.906  17.337  -7.032
  214   2HD2  LEU  23          2HD2      LEU  23  -4.422  17.044  -7.912
  215   3HD2  LEU  23          3HD2      LEU  23  -4.355  16.821  -6.150
  216    H    VAL  24           H        VAL  24  -4.686  10.559  -6.138
  217    HA   VAL  24           HA       VAL  24  -4.546  11.285  -3.366
  218    HB   VAL  24           HB       VAL  24  -4.667   8.913  -2.925
  219   1HG1  VAL  24          1HG1      VAL  24  -6.430   9.678  -5.294
  220   2HG1  VAL  24          2HG1      VAL  24  -6.775   8.446  -4.074
  221   3HG1  VAL  24          3HG1      VAL  24  -6.711  10.160  -3.605
  222   1HG2  VAL  24          1HG2      VAL  24  -4.277   8.500  -5.924
  223   2HG2  VAL  24          2HG2      VAL  24  -3.111   8.074  -4.655
  224   3HG2  VAL  24          3HG2      VAL  24  -4.679   7.255  -4.728
  225    H    GLN  25           H        GLN  25  -2.043  10.681  -5.659
  226    HA   GLN  25           HA       GLN  25  -0.038   9.572  -4.053
  227   1HB   GLN  25          1HB       GLN  25  -0.271  10.528  -6.704
  228   2HB   GLN  25          2HB       GLN  25   0.995  11.513  -5.975
  229   1HG   GLN  25          1HG       GLN  25   2.055   9.636  -6.882
  230   2HG   GLN  25          2HG       GLN  25   2.064   9.337  -5.145
  231   1HE2  GLN  25          1HE2      GLN  25   2.313   7.445  -7.379
  232   2HE2  GLN  25          2HE2      GLN  25   0.988   6.305  -7.282
  233    H    GLY  26           H        GLY  26   1.574  10.393  -2.745
  234   1HA   GLY  26          1HA       GLY  26   2.797  11.942  -1.565
  235   2HA   GLY  26          2HA       GLY  26   1.825  13.260  -2.226
  236    H    VAL  27           H        VAL  27  -0.778  12.321  -1.480
  237    HA   VAL  27           HA       VAL  27  -0.800  13.293   1.244
  238    HB   VAL  27           HB       VAL  27  -3.088  12.337  -0.517
  239   1HG1  VAL  27          1HG1      VAL  27  -3.008  14.120   1.969
  240   2HG1  VAL  27          2HG1      VAL  27  -4.426  13.874   0.941
  241   3HG1  VAL  27          3HG1      VAL  27  -3.774  12.522   1.858
  242   1HG2  VAL  27          1HG2      VAL  27  -1.844  15.096  -0.160
  243   2HG2  VAL  27          2HG2      VAL  27  -1.884  14.135  -1.658
  244   3HG2  VAL  27          3HG2      VAL  27  -3.382  14.785  -0.988
  245    H    GLY  28           H        GLY  28   0.464  11.525   2.145
  246   1HA   GLY  28          1HA       GLY  28   0.721   9.635   3.399
  247   2HA   GLY  28          2HA       GLY  28  -0.953   9.940   3.889
  248    H    PHE  29           H        PHE  29  -2.234   8.283   3.571
  249    HA   PHE  29           HA       PHE  29  -3.277   6.455   2.932
  250   1HB   PHE  29          1HB       PHE  29  -3.648   7.924   1.027
  251   2HB   PHE  29          2HB       PHE  29  -2.285   7.212   0.173
  252    HD1  PHE  29           1HD      PHE  29  -2.448   4.994  -0.839
  253    HD2  PHE  29           2HD      PHE  29  -5.689   6.528   1.555
  254    HE1  PHE  29           1HE      PHE  29  -3.938   3.226  -1.719
  255    HE2  PHE  29           2HE      PHE  29  -7.190   4.791   0.635
  256    HZ   PHE  29           HZ       PHE  29  -6.313   3.109  -0.979
  257    H    ARG  30           H        ARG  30  -0.246   6.327   1.060
  258    HA   ARG  30           HA       ARG  30   0.364   3.794   0.567
  259   1HB   ARG  30          1HB       ARG  30   1.741   5.829   0.222
  260   2HB   ARG  30          2HB       ARG  30   2.158   5.844   1.944
  261   1HG   ARG  30          1HG       ARG  30   3.122   3.515   1.610
  262   2HG   ARG  30          2HG       ARG  30   2.914   3.757  -0.137
  263   1HD   ARG  30          1HD       ARG  30   4.682   5.267   1.833
  264   2HD   ARG  30          2HD       ARG  30   5.180   4.269   0.458
  265    HE   ARG  30           HE       ARG  30   3.560   6.711  -0.045
  266   1HH1  ARG  30          1HH1      ARG  30   6.783   5.159  -0.356
  267   2HH1  ARG  30          2HH1      ARG  30   7.458   6.538  -1.161
  268   1HH2  ARG  30          1HH2      ARG  30   4.459   8.381  -1.274
  269   2HH2  ARG  30          2HH2      ARG  30   6.134   8.314  -1.761
  270    H    LYS  31           H        LYS  31   0.804   5.262   3.822
  271    HA   LYS  31           HA       LYS  31   1.793   2.789   4.948
  272   1HB   LYS  31          1HB       LYS  31   2.522   5.158   5.538
  273   2HB   LYS  31          2HB       LYS  31   0.997   5.339   6.406
  274   1HG   LYS  31          1HG       LYS  31   1.570   3.411   7.858
  275   2HG   LYS  31          2HG       LYS  31   3.065   3.153   6.934
  276   1HD   LYS  31          1HD       LYS  31   3.869   5.403   7.612
  277   2HD   LYS  31          2HD       LYS  31   2.388   5.638   8.567
  278   1HE   LYS  31          1HE       LYS  31   2.965   3.672   9.961
  279   2HE   LYS  31          2HE       LYS  31   4.423   3.394   8.985
  280   1HZ   LYS  31          1HZ       LYS  31   5.003   4.635  10.933
  281   2HZ   LYS  31          2HZ       LYS  31   3.926   5.867  10.517
  282    H    PHE  32           H        PHE  32  -1.181   4.772   5.240
  283    HA   PHE  32           HA       PHE  32  -2.604   3.382   7.110
  284   1HB   PHE  32          1HB       PHE  32  -3.279   5.435   5.861
  285   2HB   PHE  32          2HB       PHE  32  -3.760   4.425   4.503
  286    HD1  PHE  32           1HD      PHE  32  -4.680   2.809   7.647
  287    HD2  PHE  32           2HD      PHE  32  -5.846   5.859   4.809
  288    HE1  PHE  32           1HE      PHE  32  -6.876   2.939   8.690
  289    HE2  PHE  32           2HE      PHE  32  -8.053   6.001   5.903
  290    HZ   PHE  32           HZ       PHE  32  -8.592   4.532   7.836
  291    H    VAL  33           H        VAL  33  -2.154   2.547   3.696
  292    HA   VAL  33           HA       VAL  33  -3.818   0.202   3.553
  293    HB   VAL  33           HB       VAL  33  -1.453   1.273   1.958
  294   1HG1  VAL  33          1HG1      VAL  33  -3.073  -1.226   1.336
  295   2HG1  VAL  33          2HG1      VAL  33  -1.942  -0.402   0.236
  296   3HG1  VAL  33          3HG1      VAL  33  -1.332  -1.157   1.705
  297   1HG2  VAL  33          1HG2      VAL  33  -4.405   0.964   1.257
  298   2HG2  VAL  33          2HG2      VAL  33  -3.632   2.483   1.756
  299   3HG2  VAL  33          3HG2      VAL  33  -3.144   1.700   0.247
  300    H    GLN  34           H        GLN  34  -0.480   0.748   4.554
  301    HA   GLN  34           HA       GLN  34   0.240  -2.033   4.759
  302   1HB   GLN  34          1HB       GLN  34   1.824   0.126   4.760
  303   2HB   GLN  34          2HB       GLN  34   1.394   0.234   6.465
  304   1HG   GLN  34          1HG       GLN  34   3.288  -0.924   6.686
  305   2HG   GLN  34          2HG       GLN  34   2.164  -2.278   6.589
  306   1HE2  GLN  34          1HE2      GLN  34   1.748  -2.014   3.625
  307   2HE2  GLN  34          2HE2      GLN  34   3.251  -2.525   2.900
  308    H    ILE  35           H        ILE  35  -0.682   0.339   7.302
  309    HA   ILE  35           HA       ILE  35  -0.741  -1.345   9.450
  310    HB   ILE  35           HB       ILE  35  -2.858   0.760   8.854
  311   1HG1  ILE  35          1HG1      ILE  35  -0.767   1.878   8.708
  312   2HG1  ILE  35          2HG1      ILE  35  -1.445   2.240  10.287
  313   1HG2  ILE  35          1HG2      ILE  35  -3.034   0.906  11.351
  314   2HG2  ILE  35          2HG2      ILE  35  -3.608  -0.623  10.696
  315   3HG2  ILE  35          3HG2      ILE  35  -2.020  -0.544  11.477
  316   1HD1  ILE  35          1HD1      ILE  35   0.903   1.827  10.555
  317   2HD1  ILE  35          2HD1      ILE  35   0.058   0.439  11.265
  318   3HD1  ILE  35          3HD1      ILE  35   0.819   0.304   9.658
  319    H    HIS  36           H        HIS  36  -3.621  -0.914   7.328
  320    HA   HIS  36           HA       HIS  36  -5.068  -2.918   8.820
  321   1HB   HIS  36          1HB       HIS  36  -5.615  -1.323   6.331
  322   2HB   HIS  36          2HB       HIS  36  -6.634  -2.701   6.768
  323    HD2  HIS  36           2HD      HIS  36  -5.352   0.500   8.821
  324    HE1  HIS  36           1HE      HIS  36  -9.271  -0.554  10.014
  325    HE2  HIS  36           2HE      HIS  36  -7.376   1.124  10.347
  326    H    ALA  37           H        ALA  37  -3.381  -3.006   5.617
  327    HA   ALA  37           HA       ALA  37  -3.850  -5.576   4.904
  328   1HB   ALA  37          1HB       ALA  37  -1.510  -5.628   3.997
  329   2HB   ALA  37          2HB       ALA  37  -2.453  -4.195   3.538
  330   3HB   ALA  37          3HB       ALA  37  -1.199  -4.088   4.786
  331    H    ILE  38           H        ILE  38  -0.969  -4.696   6.803
  332    HA   ILE  38           HA       ILE  38  -0.116  -7.069   7.820
  333    HB   ILE  38           HB       ILE  38  -0.016  -4.226   8.689
  334   1HG1  ILE  38          1HG1      ILE  38   2.357  -4.559   8.388
  335   2HG1  ILE  38          2HG1      ILE  38   2.163  -6.314   8.291
  336   1HG2  ILE  38          1HG2      ILE  38   1.408  -4.727  10.608
  337   2HG2  ILE  38          2HG2      ILE  38  -0.281  -5.153  10.870
  338   3HG2  ILE  38          3HG2      ILE  38   0.911  -6.434  10.523
  339   1HD1  ILE  38          1HD1      ILE  38   2.602  -5.257   6.098
  340   2HD1  ILE  38          2HD1      ILE  38   1.055  -6.109   6.102
  341   3HD1  ILE  38          3HD1      ILE  38   1.098  -4.341   6.218
  342    H    ARG  39           H        ARG  39  -2.545  -4.937   9.437
  343    HA   ARG  39           HA       ARG  39  -3.088  -6.367  11.676
  344   1HB   ARG  39          1HB       ARG  39  -3.955  -4.149  10.833
  345   2HB   ARG  39          2HB       ARG  39  -5.320  -5.015  10.147
  346   1HG   ARG  39          1HG       ARG  39  -4.481  -5.180  13.082
  347   2HG   ARG  39          2HG       ARG  39  -5.425  -3.844  12.427
  348   1HD   ARG  39          1HD       ARG  39  -6.994  -5.280  13.400
  349   2HD   ARG  39          2HD       ARG  39  -7.169  -5.456  11.642
  350    HE   ARG  39           HE       ARG  39  -5.346  -7.421  12.563
  351   1HH1  ARG  39          1HH1      ARG  39  -8.807  -6.705  12.912
  352   2HH1  ARG  39          2HH1      ARG  39  -9.261  -8.387  13.004
  353   1HH2  ARG  39          1HH2      ARG  39  -5.946  -9.576  12.609
  354   2HH2  ARG  39          2HH2      ARG  39  -7.610 -10.047  12.868
  355    H    LEU  40           H        LEU  40  -4.693  -6.687   8.534
  356    HA   LEU  40           HA       LEU  40  -6.355  -8.949   9.358
  357   1HB   LEU  40          1HB       LEU  40  -6.130  -7.404   6.773
  358   2HB   LEU  40          2HB       LEU  40  -7.380  -8.604   7.134
  359    HG   LEU  40           HG       LEU  40  -6.944  -6.072   8.807
  360   1HD1  LEU  40          1HD1      LEU  40  -8.906  -5.216   7.615
  361   2HD1  LEU  40          2HD1      LEU  40  -7.528  -5.495   6.530
  362   3HD1  LEU  40          3HD1      LEU  40  -8.874  -6.659   6.562
  363   1HD2  LEU  40          1HD2      LEU  40  -9.250  -6.584   9.593
  364   2HD2  LEU  40          2HD2      LEU  40  -9.197  -8.124   8.704
  365   3HD2  LEU  40          3HD2      LEU  40  -8.100  -7.832  10.067
  366    H    GLY  41           H        GLY  41  -3.172  -8.961   8.404
  367   1HA   GLY  41          1HA       GLY  41  -1.820 -10.634   7.662
  368   2HA   GLY  41          2HA       GLY  41  -3.186 -11.748   7.814
  369    H    ILE  42           H        ILE  42  -2.307  -8.942   5.754
  370    HA   ILE  42           HA       ILE  42  -3.146 -10.392   3.290
  371    HB   ILE  42           HB       ILE  42  -2.934  -7.457   3.953
  372   1HG1  ILE  42          1HG1      ILE  42  -4.822  -8.446   5.102
  373   2HG1  ILE  42          2HG1      ILE  42  -5.348  -7.342   3.824
  374   1HG2  ILE  42          1HG2      ILE  42  -3.967  -6.878   1.892
  375   2HG2  ILE  42          2HG2      ILE  42  -2.531  -7.828   1.552
  376   3HG2  ILE  42          3HG2      ILE  42  -4.125  -8.563   1.398
  377   1HD1  ILE  42          1HD1      ILE  42  -6.768  -9.313   3.933
  378   2HD1  ILE  42          2HD1      ILE  42  -5.930  -9.265   2.386
  379   3HD1  ILE  42          3HD1      ILE  42  -5.386 -10.386   3.661
  380    H    LYS  43           H        LYS  43  -1.714 -10.454   1.623
  381    HA   LYS  43           HA       LYS  43   1.088  -9.435   2.033
  382   1HB   LYS  43          1HB       LYS  43   0.181 -11.517   0.046
  383   2HB   LYS  43          2HB       LYS  43   1.813 -11.017   0.435
  384   1HG   LYS  43          1HG       LYS  43   1.520 -11.844   2.778
  385   2HG   LYS  43          2HG       LYS  43  -0.083 -12.462   2.331
  386   1HD   LYS  43          1HD       LYS  43   0.963 -13.920   0.601
  387   2HD   LYS  43          2HD       LYS  43   2.555 -13.275   1.033
  388   1HE   LYS  43          1HE       LYS  43   2.285 -15.428   2.102
  389   2HE   LYS  43          2HE       LYS  43   2.279 -14.173   3.355
  390   1HZ   LYS  43          1HZ       LYS  43  -0.105 -14.357   3.456
  391   2HZ   LYS  43          2HZ       LYS  43  -0.095 -15.547   2.258
  392    H    GLY  44           H        GLY  44   2.080  -8.595  -0.074
  393   1HA   GLY  44          1HA       GLY  44   1.005  -7.992  -2.433
  394   2HA   GLY  44          2HA       GLY  44   0.059  -6.881  -1.417
  395    H    TYR  45           H        TYR  45   0.837  -4.990  -2.372
  396    HA   TYR  45           HA       TYR  45   3.140  -3.984  -1.133
  397   1HB   TYR  45          1HB       TYR  45   4.187  -5.432  -2.993
  398   2HB   TYR  45          2HB       TYR  45   3.438  -4.319  -4.116
  399    HD1  TYR  45           1HD      TYR  45   4.663  -2.464  -4.823
  400    HD2  TYR  45           2HD      TYR  45   5.895  -4.622  -1.325
  401    HE1  TYR  45           1HE      TYR  45   6.887  -1.345  -4.913
  402    HE2  TYR  45           2HE      TYR  45   8.091  -3.444  -1.368
  403    HH   TYR  45           HH       TYR  45   9.384  -1.871  -2.400
  404    H    ALA  46           H        ALA  46   3.156  -1.777  -1.240
  405    HA   ALA  46           HA       ALA  46   0.850  -0.450  -2.598
  406   1HB   ALA  46          1HB       ALA  46   1.204   1.350  -0.973
  407   2HB   ALA  46          2HB       ALA  46   0.908  -0.214  -0.197
  408   3HB   ALA  46          3HB       ALA  46   2.538   0.459  -0.247
  409    H    LYS  47           H        LYS  47   1.883  -0.344  -4.697
  410    HA   LYS  47           HA       LYS  47   4.462   1.052  -4.865
  411   1HB   LYS  47          1HB       LYS  47   4.736  -0.708  -6.090
  412   2HB   LYS  47          2HB       LYS  47   3.056  -0.866  -6.544
  413   1HG   LYS  47          1HG       LYS  47   3.349   0.869  -8.243
  414   2HG   LYS  47          2HG       LYS  47   5.022   1.155  -7.728
  415   1HD   LYS  47          1HD       LYS  47   3.998  -1.569  -8.656
  416   2HD   LYS  47          2HD       LYS  47   4.545  -0.342  -9.804
  417   1HE   LYS  47          1HE       LYS  47   6.772  -0.276  -8.724
  418   2HE   LYS  47          2HE       LYS  47   6.263  -1.535  -7.581
  419   1HZ   LYS  47          1HZ       LYS  47   7.391  -2.530  -9.436
  420   2HZ   LYS  47          2HZ       LYS  47   6.246  -1.901 -10.507
  421    H    ASN  48           H        ASN  48   4.079   3.075  -4.368
  422    HA   ASN  48           HA       ASN  48   2.009   4.707  -5.501
  423   1HB   ASN  48          1HB       ASN  48   3.203   6.359  -3.977
  424   2HB   ASN  48          2HB       ASN  48   2.457   4.953  -3.226
  425   1HD2  ASN  48          2HD2      ASN  48   5.671   6.080  -4.465
  426   2HD2  ASN  48          1HD2      ASN  48   6.606   5.124  -3.322
  427    H    LEU  49           H        LEU  49   2.904   4.167  -7.720
  428    HA   LEU  49           HA       LEU  49   5.223   5.012  -8.918
  429   1HB   LEU  49          1HB       LEU  49   2.368   5.155  -9.910
  430   2HB   LEU  49          2HB       LEU  49   3.780   5.289 -10.960
  431    HG   LEU  49           HG       LEU  49   3.227   2.862  -9.210
  432   1HD1  LEU  49          1HD1      LEU  49   2.294   1.806 -11.186
  433   2HD1  LEU  49          2HD1      LEU  49   1.363   3.253 -10.789
  434   3HD1  LEU  49          3HD1      LEU  49   2.526   3.290 -12.135
  435   1HD2  LEU  49          1HD2      LEU  49   4.739   1.735 -10.848
  436   2HD2  LEU  49          2HD2      LEU  49   5.038   3.293 -11.631
  437   3HD2  LEU  49          3HD2      LEU  49   5.575   3.014  -9.961
  438    HA   PRO  50           HA       PRO  50   4.431   9.282  -7.714
  439   1HB   PRO  50          1HB       PRO  50   6.906  10.303  -7.554
  440   2HB   PRO  50          2HB       PRO  50   6.375   8.947  -6.521
  441   1HG   PRO  50          1HG       PRO  50   7.887   8.720  -9.149
  442   2HG   PRO  50          2HG       PRO  50   8.380   8.054  -7.563
  443   1HD   PRO  50          1HD       PRO  50   6.987   6.561  -9.377
  444   2HD   PRO  50          2HD       PRO  50   6.679   6.415  -7.625
  445    H    ASP  51           H        ASP  51   4.129   8.515 -10.577
  446    HA   ASP  51           HA       ASP  51   3.790  11.251 -11.428
  447   1HB   ASP  51          1HB       ASP  51   6.024  10.679 -12.419
  448   2HB   ASP  51          2HB       ASP  51   5.284   9.302 -13.247
  449    HD2  ASP  51           HD       ASP  51   4.240  13.070 -14.436
  450    H    GLY  52           H        GLY  52   2.040   9.427 -10.330
  451   1HA   GLY  52          1HA       GLY  52  -0.042   9.141 -12.229
  452   2HA   GLY  52          2HA       GLY  52   0.791   7.585 -11.954
  453    H    SER  53           H        SER  53  -0.979   6.727 -10.879
  454    HA   SER  53           HA       SER  53  -1.558   7.782  -8.142
  455   1HB   SER  53          1HB       SER  53  -3.510   6.119  -9.705
  456   2HB   SER  53          2HB       SER  53  -3.748   7.167  -8.298
  457    HG   SER  53           HG       SER  53  -3.495   8.950  -9.562
  458    H    VAL  54           H        VAL  54  -1.836   6.198  -6.498
  459    HA   VAL  54           HA       VAL  54   0.139   4.187  -6.670
  460    HB   VAL  54           HB       VAL  54  -0.199   5.428  -4.654
  461   1HG1  VAL  54          1HG1      VAL  54  -2.870   4.039  -4.209
  462   2HG1  VAL  54          2HG1      VAL  54  -2.084   5.251  -3.190
  463   3HG1  VAL  54          3HG1      VAL  54  -2.709   5.713  -4.773
  464   1HG2  VAL  54          1HG2      VAL  54  -0.953   2.529  -4.086
  465   2HG2  VAL  54          2HG2      VAL  54   0.685   3.087  -4.453
  466   3HG2  VAL  54          3HG2      VAL  54  -0.139   3.662  -2.996
  467    H    GLU  55           H        GLU  55   0.075   2.142  -7.302
  468    HA   GLU  55           HA       GLU  55  -2.493   0.690  -7.429
  469   1HB   GLU  55          1HB       GLU  55  -1.091  -1.146  -8.330
  470   2HB   GLU  55          2HB       GLU  55  -1.255   0.297  -9.346
  471   1HG   GLU  55          1HG       GLU  55   0.983   1.004  -8.866
  472   2HG   GLU  55          2HG       GLU  55   1.173  -0.234  -7.611
  473    HE2  GLU  55           HE       GLU  55   1.578  -2.891  -9.882
  474    H    VAL  56           H        VAL  56  -3.149  -0.568  -5.800
  475    HA   VAL  56           HA       VAL  56  -1.206  -1.495  -3.726
  476    HB   VAL  56           HB       VAL  56  -4.204  -1.015  -3.565
  477   1HG1  VAL  56          1HG1      VAL  56  -2.146  -1.861  -1.507
  478   2HG1  VAL  56          2HG1      VAL  56  -3.839  -1.457  -1.134
  479   3HG1  VAL  56          3HG1      VAL  56  -3.466  -2.885  -2.107
  480   1HG2  VAL  56          1HG2      VAL  56  -1.835   0.502  -2.378
  481   2HG2  VAL  56          2HG2      VAL  56  -2.951   1.109  -3.623
  482   3HG2  VAL  56          3HG2      VAL  56  -3.545   0.788  -1.990
  483    H    VAL  57           H        VAL  57  -0.549  -3.435  -4.598
  484    HA   VAL  57           HA       VAL  57  -2.550  -5.262  -5.787
  485    HB   VAL  57           HB       VAL  57  -0.569  -4.794  -7.035
  486   1HG1  VAL  57          1HG1      VAL  57   1.093  -6.049  -4.813
  487   2HG1  VAL  57          2HG1      VAL  57   1.644  -5.628  -6.441
  488   3HG1  VAL  57          3HG1      VAL  57   1.119  -4.356  -5.349
  489   1HG2  VAL  57          1HG2      VAL  57  -0.583  -7.690  -6.111
  490   2HG2  VAL  57          2HG2      VAL  57  -1.692  -6.954  -7.289
  491   3HG2  VAL  57          3HG2      VAL  57   0.048  -7.029  -7.627
  492    H    ALA  58           H        ALA  58  -3.516  -5.173  -3.586
  493    HA   ALA  58           HA       ALA  58  -2.268  -6.647  -1.415
  494   1HB   ALA  58          1HB       ALA  58  -4.687  -6.365  -0.487
  495   2HB   ALA  58          2HB       ALA  58  -3.721  -4.893  -0.769
  496   3HB   ALA  58          3HB       ALA  58  -4.953  -5.359  -1.919
  497    H    GLU  59           H        GLU  59  -2.801  -8.689  -0.697
  498    HA   GLU  59           HA       GLU  59  -4.535 -10.357  -2.397
  499   1HB   GLU  59          1HB       GLU  59  -1.954 -11.102  -1.025
  500   2HB   GLU  59          2HB       GLU  59  -2.899 -12.079  -2.155
  501   1HG   GLU  59          1HG       GLU  59  -2.425 -10.449  -3.960
  502   2HG   GLU  59          2HG       GLU  59  -1.509  -9.459  -2.822
  503    HE2  GLU  59           HE       GLU  59   0.179 -12.725  -4.388
  504    H    GLY  60           H        GLY  60  -6.189 -11.496  -1.142
  505   1HA   GLY  60          1HA       GLY  60  -5.447 -12.702   1.398
  506   2HA   GLY  60          2HA       GLY  60  -6.603 -11.369   1.578
  507    H    TYR  61           H        TYR  61  -7.183 -13.920   2.375
  508    HA   TYR  61           HA       TYR  61  -9.021 -15.280   0.622
  509   1HB   TYR  61          1HB       TYR  61  -8.580 -15.072   3.611
  510   2HB   TYR  61          2HB       TYR  61  -9.889 -16.014   2.919
  511    HD1  TYR  61           1HD      TYR  61  -9.440 -18.025   1.500
  512    HD2  TYR  61           2HD      TYR  61  -6.293 -15.946   3.606
  513    HE1  TYR  61           1HE      TYR  61  -8.111 -20.105   1.580
  514    HE2  TYR  61           2HE      TYR  61  -4.928 -18.005   3.589
  515    HH   TYR  61           HH       TYR  61  -4.803 -20.212   2.964
  516    H    GLU  62           H        GLU  62 -11.496 -15.199   1.292
  517    HA   GLU  62           HA       GLU  62 -12.073 -12.426   0.545
  518   1HB   GLU  62          1HB       GLU  62 -13.910 -14.817   0.634
  519   2HB   GLU  62          2HB       GLU  62 -14.276 -13.206  -0.033
  520   1HG   GLU  62          1HG       GLU  62 -12.365 -13.479  -1.649
  521   2HG   GLU  62          2HG       GLU  62 -12.166 -15.151  -1.094
  522    HE2  GLU  62           HE       GLU  62 -15.363 -16.113  -2.482
  523    H    GLU  63           H        GLU  63 -12.426 -14.318   3.473
  524    HA   GLU  63           HA       GLU  63 -14.366 -12.521   4.644
  525   1HB   GLU  63          1HB       GLU  63 -13.590 -13.573   6.759
  526   2HB   GLU  63          2HB       GLU  63 -14.239 -14.671   5.537
  527   1HG   GLU  63          1HG       GLU  63 -12.440 -15.757   6.628
  528   2HG   GLU  63          2HG       GLU  63 -11.968 -15.459   4.966
  529    HE2  GLU  63           HE       GLU  63 -10.211 -13.222   7.900
  530    H    ALA  64           H        ALA  64 -10.792 -12.710   4.486
  531    HA   ALA  64           HA       ALA  64 -10.460 -10.219   5.940
  532   1HB   ALA  64          1HB       ALA  64  -8.105 -10.494   5.404
  533   2HB   ALA  64          2HB       ALA  64  -8.770 -12.012   6.011
  534   3HB   ALA  64          3HB       ALA  64  -8.481 -11.808   4.266
  535    H    LEU  65           H        LEU  65 -11.405 -10.925   2.682
  536    HA   LEU  65           HA       LEU  65 -10.016  -8.735   1.410
  537   1HB   LEU  65          1HB       LEU  65 -10.838 -10.655   0.162
  538   2HB   LEU  65          2HB       LEU  65 -12.518 -10.196   0.568
  539    HG   LEU  65           HG       LEU  65 -12.174  -8.057  -0.617
  540   1HD1  LEU  65          1HD1      LEU  65 -10.237  -7.908  -2.211
  541   2HD1  LEU  65          2HD1      LEU  65  -9.697  -7.834  -0.534
  542   3HD1  LEU  65          3HD1      LEU  65  -9.516  -9.343  -1.448
  543   1HD2  LEU  65          1HD2      LEU  65 -12.252  -9.100  -2.858
  544   2HD2  LEU  65          2HD2      LEU  65 -11.649 -10.622  -2.137
  545   3HD2  LEU  65          3HD2      LEU  65 -13.233  -9.971  -1.655
  546    H    SER  66           H        SER  66 -13.509  -9.145   2.157
  547    HA   SER  66           HA       SER  66 -14.362  -6.563   1.943
  548   1HB   SER  66          1HB       SER  66 -16.150  -7.175   3.531
  549   2HB   SER  66          2HB       SER  66 -15.834  -8.462   2.355
  550    HG   SER  66           HG       SER  66 -14.559  -9.497   3.982
  551    H    LYS  67           H        LYS  67 -12.746  -7.933   4.861
  552    HA   LYS  67           HA       LYS  67 -13.119  -5.661   6.533
  553   1HB   LYS  67          1HB       LYS  67 -11.135  -7.966   6.490
  554   2HB   LYS  67          2HB       LYS  67 -11.228  -6.785   7.812
  555   1HG   LYS  67          1HG       LYS  67 -13.497  -7.390   8.332
  556   2HG   LYS  67          2HG       LYS  67 -13.648  -8.401   6.883
  557   1HD   LYS  67          1HD       LYS  67 -11.937  -9.936   7.715
  558   2HD   LYS  67          2HD       LYS  67 -11.683  -8.904   9.132
  559   1HE   LYS  67          1HE       LYS  67 -13.083 -10.782   9.789
  560   2HE   LYS  67          2HE       LYS  67 -14.083  -9.317   9.804
  561   1HZ   LYS  67          1HZ       LYS  67 -15.245 -11.073   8.673
  562   2HZ   LYS  67          2HZ       LYS  67 -13.993 -11.221   7.547
  563    H    LEU  68           H        LEU  68 -10.557  -6.453   4.157
  564    HA   LEU  68           HA       LEU  68  -9.004  -4.063   4.809
  565   1HB   LEU  68          1HB       LEU  68  -7.781  -5.840   3.866
  566   2HB   LEU  68          2HB       LEU  68  -8.956  -6.106   2.578
  567    HG   LEU  68           HG       LEU  68  -8.326  -4.068   1.438
  568   1HD1  LEU  68          1HD1      LEU  68  -6.368  -2.725   2.198
  569   2HD1  LEU  68          2HD1      LEU  68  -7.736  -2.542   3.288
  570   3HD1  LEU  68          3HD1      LEU  68  -6.389  -3.596   3.749
  571   1HD2  LEU  68          1HD2      LEU  68  -6.084  -4.697   0.785
  572   2HD2  LEU  68          2HD2      LEU  68  -5.839  -5.570   2.312
  573   3HD2  LEU  68          3HD2      LEU  68  -7.010  -6.178   1.122
  574    H    LEU  69           H        LEU  69 -11.089  -5.008   2.028
  575    HA   LEU  69           HA       LEU  69 -11.038  -2.732   0.676
  576   1HB   LEU  69          1HB       LEU  69 -12.986  -4.925   0.964
  577   2HB   LEU  69          2HB       LEU  69 -13.746  -3.468   0.378
  578    HG   LEU  69           HG       LEU  69 -13.023  -4.964  -1.412
  579   1HD1  LEU  69          1HD1      LEU  69 -12.003  -3.327  -2.870
  580   2HD1  LEU  69          2HD1      LEU  69 -13.186  -2.523  -1.825
  581   3HD1  LEU  69          3HD1      LEU  69 -11.447  -2.358  -1.498
  582   1HD2  LEU  69          1HD2      LEU  69 -10.715  -5.354  -1.972
  583   2HD2  LEU  69          2HD2      LEU  69 -10.142  -4.354  -0.626
  584   3HD2  LEU  69          3HD2      LEU  69 -10.992  -5.874  -0.301
  585    H    GLU  70           H        GLU  70 -13.501  -3.357   3.237
  586    HA   GLU  70           HA       GLU  70 -14.857  -0.923   2.967
  587   1HB   GLU  70          1HB       GLU  70 -16.074  -1.525   4.882
  588   2HB   GLU  70          2HB       GLU  70 -15.677  -3.023   4.033
  589   1HG   GLU  70          1HG       GLU  70 -13.751  -3.330   5.672
  590   2HG   GLU  70          2HG       GLU  70 -14.369  -1.936   6.568
  591    HE2  GLU  70           HE       GLU  70 -17.193  -3.607   7.807
  592    H    ARG  71           H        ARG  71 -12.089  -1.737   5.065
  593    HA   ARG  71           HA       ARG  71 -11.620   0.602   6.543
  594   1HB   ARG  71          1HB       ARG  71  -9.963  -0.654   7.036
  595   2HB   ARG  71          2HB       ARG  71 -10.135  -1.665   5.637
  596   1HG   ARG  71          1HG       ARG  71  -7.934  -0.822   5.649
  597   2HG   ARG  71          2HG       ARG  71  -8.726  -0.041   4.313
  598   1HD   ARG  71          1HD       ARG  71  -9.101   1.536   6.746
  599   2HD   ARG  71          2HD       ARG  71  -7.419   1.125   6.581
  600    HE   ARG  71           HE       ARG  71  -8.904   3.070   5.118
  601   1HH1  ARG  71          1HH1      ARG  71  -6.378   0.671   4.421
  602   2HH1  ARG  71          2HH1      ARG  71  -5.706   1.613   3.108
  603   1HH2  ARG  71          1HH2      ARG  71  -7.970   4.277   3.449
  604   2HH2  ARG  71          2HH2      ARG  71  -6.568   3.678   2.594
  605    H    ILE  72           H        ILE  72 -10.937   0.003   3.111
  606    HA   ILE  72           HA       ILE  72  -9.751   2.619   2.740
  607    HB   ILE  72           HB       ILE  72 -10.684   0.767   0.528
  608   1HG1  ILE  72          1HG1      ILE  72  -7.938   0.831   1.897
  609   2HG1  ILE  72          2HG1      ILE  72  -9.137  -0.427   2.181
  610   1HG2  ILE  72          1HG2      ILE  72  -8.919   1.938  -0.751
  611   2HG2  ILE  72          2HG2      ILE  72  -9.999   3.141  -0.040
  612   3HG2  ILE  72          3HG2      ILE  72  -8.425   2.813   0.710
  613   1HD1  ILE  72          1HD1      ILE  72  -7.569  -1.291   0.635
  614   2HD1  ILE  72          2HD1      ILE  72  -9.103  -1.038  -0.218
  615   3HD1  ILE  72          3HD1      ILE  72  -7.743   0.091  -0.453
  616    H    LYS  73           H        LYS  73 -12.861   1.237   1.505
  617    HA   LYS  73           HA       LYS  73 -13.876   3.535   0.422
  618   1HB   LYS  73          1HB       LYS  73 -15.295   1.264   1.806
  619   2HB   LYS  73          2HB       LYS  73 -16.159   2.660   1.171
  620   1HG   LYS  73          1HG       LYS  73 -16.294   1.110  -0.510
  621   2HG   LYS  73          2HG       LYS  73 -15.116   2.287  -1.091
  622   1HD   LYS  73          1HD       LYS  73 -14.173  -0.202   0.322
  623   2HD   LYS  73          2HD       LYS  73 -14.829  -0.386  -1.293
  624   1HE   LYS  73          1HE       LYS  73 -12.577   1.593  -0.751
  625   2HE   LYS  73          2HE       LYS  73 -12.304  -0.104  -1.176
  626   1HZ   LYS  73          1HZ       LYS  73 -12.321   1.210  -3.151
  627   2HZ   LYS  73          2HZ       LYS  73 -13.880   1.764  -2.820
  628    H    GLN  74           H        GLN  74 -14.289   2.524   3.858
  629    HA   GLN  74           HA       GLN  74 -15.733   4.871   4.677
  630   1HB   GLN  74          1HB       GLN  74 -14.219   2.752   6.262
  631   2HB   GLN  74          2HB       GLN  74 -15.255   3.982   6.981
  632   1HG   GLN  74          1HG       GLN  74 -16.192   1.864   4.991
  633   2HG   GLN  74          2HG       GLN  74 -16.380   1.782   6.745
  634   1HE2  GLN  74          1HE2      GLN  74 -18.496   1.742   4.709
  635   2HE2  GLN  74          2HE2      GLN  74 -19.521   3.118   5.054
  636    H    GLY  75           H        GLY  75 -12.293   3.950   4.702
  637   1HA   GLY  75          1HA       GLY  75 -11.504   6.600   5.866
  638   2HA   GLY  75          2HA       GLY  75 -10.611   5.091   5.963
  639    HA   PRO  76           HA       PRO  76 -10.183   6.429   1.337
  640   1HB   PRO  76          1HB       PRO  76 -11.096   8.910   0.551
  641   2HB   PRO  76          2HB       PRO  76 -12.178   7.493   0.689
  642   1HG   PRO  76          1HG       PRO  76 -11.656   9.653   2.759
  643   2HG   PRO  76          2HG       PRO  76 -13.241   9.132   2.107
  644   1HD   PRO  76          1HD       PRO  76 -12.290   8.129   4.424
  645   2HD   PRO  76          2HD       PRO  76 -13.124   7.067   3.246
  646    HA   PRO  77           HA       PRO  77  -6.624   9.155   2.155
  647   1HB   PRO  77          1HB       PRO  77  -5.962  10.164  -0.294
  648   2HB   PRO  77          2HB       PRO  77  -5.698   8.451   0.111
  649   1HG   PRO  77          1HG       PRO  77  -8.013   9.650  -1.390
  650   2HG   PRO  77          2HG       PRO  77  -7.043   8.204  -1.827
  651   1HD   PRO  77          1HD       PRO  77  -9.458   8.024  -0.601
  652   2HD   PRO  77          2HD       PRO  77  -8.156   6.870  -0.252
  653    H    ALA  78           H        ALA  78  -6.331  11.427   2.539
  654    HA   ALA  78           HA       ALA  78  -8.731  13.077   2.339
  655   1HB   ALA  78          1HB       ALA  78  -7.424  14.672   3.656
  656   2HB   ALA  78          2HB       ALA  78  -7.342  13.050   4.366
  657   3HB   ALA  78          3HB       ALA  78  -5.963  13.680   3.439
  658    H    ALA  79           H        ALA  79  -7.962  12.404  -0.242
  659    HA   ALA  79           HA       ALA  79  -6.862  14.907  -1.417
  660   1HB   ALA  79          1HB       ALA  79  -5.557  13.463  -2.929
  661   2HB   ALA  79          2HB       ALA  79  -5.099  13.171  -1.242
  662   3HB   ALA  79          3HB       ALA  79  -6.170  12.026  -2.067
  663    H    GLU  80           H        GLU  80  -7.204  14.738  -3.848
  664    HA   GLU  80           HA       GLU  80 -10.001  14.148  -4.452
  665   1HB   GLU  80          1HB       GLU  80  -7.700  15.119  -6.203
  666   2HB   GLU  80          2HB       GLU  80  -9.395  14.999  -6.704
  667   1HG   GLU  80          1HG       GLU  80 -10.047  16.598  -4.935
  668   2HG   GLU  80          2HG       GLU  80  -8.353  16.762  -4.442
  669    HE2  GLU  80           HE       GLU  80  -7.424  18.551  -7.367
  670    H    VAL  81           H        VAL  81  -9.725  11.875  -3.793
  671    HA   VAL  81           HA       VAL  81  -8.626  10.004  -5.710
  672    HB   VAL  81           HB       VAL  81  -9.005   9.448  -3.389
  673   1HG1  VAL  81          1HG1      VAL  81 -11.988   9.315  -3.856
  674   2HG1  VAL  81          2HG1      VAL  81 -11.092   9.006  -2.370
  675   3HG1  VAL  81          3HG1      VAL  81 -11.185  10.655  -3.002
  676   1HG2  VAL  81          1HG2      VAL  81 -10.671   7.731  -5.281
  677   2HG2  VAL  81          2HG2      VAL  81  -8.906   7.676  -5.119
  678   3HG2  VAL  81          3HG2      VAL  81  -9.933   7.202  -3.756
  679    H    GLU  82           H        GLU  82  -9.319   9.608  -7.628
  680    HA   GLU  82           HA       GLU  82 -11.601  11.077  -8.671
  681   1HB   GLU  82          1HB       GLU  82  -9.411  10.973  -9.811
  682   2HB   GLU  82          2HB       GLU  82  -9.524   9.221  -9.929
  683   1HG   GLU  82          1HG       GLU  82 -10.111  10.269 -12.070
  684   2HG   GLU  82          2HG       GLU  82 -11.518   9.435 -11.406
  685    HE2  GLU  82           HE       GLU  82 -11.462  13.514 -11.396
  686    H    LYS  83           H        LYS  83 -10.587   7.659  -8.433
  687    HA   LYS  83           HA       LYS  83 -12.991   6.682  -7.489
  688   1HB   LYS  83          1HB       LYS  83 -13.924   5.400  -9.406
  689   2HB   LYS  83          2HB       LYS  83 -14.189   7.127  -9.473
  690   1HG   LYS  83          1HG       LYS  83 -12.034   7.142 -11.008
  691   2HG   LYS  83          2HG       LYS  83 -12.377   5.408 -11.166
  692   1HD   LYS  83          1HD       LYS  83 -14.718   5.990 -11.900
  693   2HD   LYS  83          2HD       LYS  83 -14.314   7.707 -11.727
  694   1HE   LYS  83          1HE       LYS  83 -14.140   7.212 -14.044
  695   2HE   LYS  83          2HE       LYS  83 -12.480   7.390 -13.441
  696   1HZ   LYS  83          1HZ       LYS  83 -12.639   5.423 -14.789
  697   2HZ   LYS  83          2HZ       LYS  83 -13.845   4.791 -13.791
  698    H    VAL  84           H        VAL  84 -12.113   5.181  -6.315
  699    HA   VAL  84           HA       VAL  84  -9.812   3.593  -7.146
  700    HB   VAL  84           HB       VAL  84  -9.842   4.335  -4.939
  701   1HG1  VAL  84          1HG1      VAL  84 -12.560   3.059  -4.536
  702   2HG1  VAL  84          2HG1      VAL  84 -11.492   3.598  -3.226
  703   3HG1  VAL  84          3HG1      VAL  84 -12.115   4.770  -4.389
  704   1HG2  VAL  84          1HG2      VAL  84 -10.501   1.376  -4.714
  705   2HG2  VAL  84          2HG2      VAL  84  -8.998   1.998  -5.426
  706   3HG2  VAL  84          3HG2      VAL  84  -9.392   2.340  -3.730
  707    H    ASP  85           H        ASP  85 -10.720   2.754  -9.040
  708    HA   ASP  85           HA       ASP  85 -12.956   0.823  -8.850
  709   1HB   ASP  85          1HB       ASP  85 -13.003   2.492 -10.613
  710   2HB   ASP  85          2HB       ASP  85 -11.421   1.973 -11.206
  711    HD2  ASP  85           HD       ASP  85 -12.755  -0.614 -13.085
  712    H    TYR  86           H        TYR  86 -11.914  -0.887  -7.677
  713    HA   TYR  86           HA       TYR  86  -9.278  -1.658  -8.374
  714   1HB   TYR  86          1HB       TYR  86  -9.299  -3.013  -6.558
  715   2HB   TYR  86          2HB       TYR  86 -10.613  -1.942  -6.101
  716    HD1  TYR  86           1HD      TYR  86 -13.047  -2.901  -7.004
  717    HD2  TYR  86           2HD      TYR  86  -9.518  -5.302  -6.360
  718    HE1  TYR  86           1HE      TYR  86 -14.461  -4.897  -6.623
  719    HE2  TYR  86           2HE      TYR  86 -10.933  -7.276  -5.950
  720    HH   TYR  86           HH       TYR  86 -13.082  -8.065  -5.692
  721    H    SER  87           H        SER  87  -8.607  -3.895  -8.878
  722    HA   SER  87           HA       SER  87 -10.357  -5.244 -10.881
  723   1HB   SER  87          1HB       SER  87  -7.335  -5.008 -10.777
  724   2HB   SER  87          2HB       SER  87  -8.257  -5.940 -11.973
  725    HG   SER  87           HG       SER  87  -9.285  -3.921 -12.525
  726    H    PHE  88           H        PHE  88 -10.967  -7.222 -10.274
  727    HA   PHE  88           HA       PHE  88  -9.703  -8.636  -8.027
  728   1HB   PHE  88          1HB       PHE  88 -12.137  -8.548  -8.264
  729   2HB   PHE  88          2HB       PHE  88 -12.041  -9.249  -9.864
  730    HD1  PHE  88           1HD      PHE  88 -12.825  -9.963  -6.538
  731    HD2  PHE  88           2HD      PHE  88 -10.877 -11.702  -9.977
  732    HE1  PHE  88           1HE      PHE  88 -13.186 -12.226  -5.614
  733    HE2  PHE  88           2HE      PHE  88 -11.132 -13.942  -8.983
  734    HZ   PHE  88           HZ       PHE  88 -12.296 -14.218  -6.803
  735    H    SER  89           H        SER  89  -8.056 -10.114  -8.369
  736    HA   SER  89           HA       SER  89  -7.809 -11.402 -11.041
  737   1HB   SER  89          1HB       SER  89  -5.459 -10.389  -9.455
  738   2HB   SER  89          2HB       SER  89  -5.490 -10.987 -11.115
  739    HG   SER  89           HG       SER  89  -6.923  -9.171 -11.560
  740    H    GLU  90           H        GLU  90  -5.949 -13.119 -10.806
  741    HA   GLU  90           HA       GLU  90  -6.645 -14.943  -8.575
  742   1HB   GLU  90          1HB       GLU  90  -5.230 -15.355 -11.247
  743   2HB   GLU  90          2HB       GLU  90  -5.424 -16.595 -10.003
  744   1HG   GLU  90          1HG       GLU  90  -7.150 -16.914 -11.632
  745   2HG   GLU  90          2HG       GLU  90  -7.886 -16.365 -10.117
  746    HE2  GLU  90           HE       GLU  90  -9.598 -13.923 -11.859
  747    H    TYR  91           H        TYR  91  -4.990 -15.884  -7.266
  748    HA   TYR  91           HA       TYR  91  -3.008 -13.988  -6.578
  749   1HB   TYR  91          1HB       TYR  91  -2.622 -15.350  -4.709
  750   2HB   TYR  91          2HB       TYR  91  -4.350 -15.430  -5.048
  751    HD1  TYR  91           1HD      TYR  91  -5.363 -17.527  -5.963
  752    HD2  TYR  91           2HD      TYR  91  -1.172 -17.298  -4.961
  753    HE1  TYR  91           1HE      TYR  91  -5.143 -19.956  -6.325
  754    HE2  TYR  91           2HE      TYR  91  -0.950 -19.726  -5.333
  755    HH   TYR  91           HH       TYR  91  -2.016 -21.678  -5.967
  756    H    LYS  92           H        LYS  92  -0.948 -13.833  -6.851
  757    HA   LYS  92           HA       LYS  92   0.504 -15.668  -8.641
  758   1HB   LYS  92          1HB       LYS  92   0.720 -13.246  -8.958
  759   2HB   LYS  92          2HB       LYS  92   1.209 -13.046  -7.278
  760   1HG   LYS  92          1HG       LYS  92   3.189 -12.943  -8.568
  761   2HG   LYS  92          2HG       LYS  92   3.227 -14.459  -7.680
  762   1HD   LYS  92          1HD       LYS  92   4.046 -14.820  -9.911
  763   2HD   LYS  92          2HD       LYS  92   2.509 -15.675  -9.751
  764   1HE   LYS  92          1HE       LYS  92   1.356 -13.873 -11.004
  765   2HE   LYS  92          2HE       LYS  92   2.857 -12.920 -11.039
  766   1HZ   LYS  92          1HZ       LYS  92   2.614 -14.113 -13.084
  767   2HZ   LYS  92          2HZ       LYS  92   2.571 -15.589 -12.263
  768    H    GLY  93           H        GLY  93   0.821 -14.169  -5.409
  769   1HA   GLY  93          1HA       GLY  93   1.527 -15.064  -3.416
  770   2HA   GLY  93          2HA       GLY  93   2.024 -16.561  -4.222
  771    H    GLU  94           H        GLU  94   3.117 -13.379  -5.402
  772    HA   GLU  94           HA       GLU  94   5.879 -14.196  -5.040
  773   1HB   GLU  94          1HB       GLU  94   6.439 -12.274  -6.336
  774   2HB   GLU  94          2HB       GLU  94   5.134 -13.169  -7.113
  775   1HG   GLU  94          1HG       GLU  94   3.497 -11.484  -6.128
  776   2HG   GLU  94          2HG       GLU  94   4.900 -10.579  -5.527
  777    HE2  GLU  94           HE       GLU  94   5.980  -9.685  -8.822
  778    H    PHE  95           H        PHE  95   3.686 -11.843  -3.443
  779    HA   PHE  95           HA       PHE  95   5.892 -10.277  -2.430
  780   1HB   PHE  95          1HB       PHE  95   2.893 -10.162  -2.012
  781   2HB   PHE  95          2HB       PHE  95   4.056  -9.003  -1.391
  782    HD1  PHE  95           1HD      PHE  95   5.670  -7.861  -3.123
  783    HD2  PHE  95           2HD      PHE  95   1.920  -9.724  -4.161
  784    HE1  PHE  95           1HE      PHE  95   5.674  -6.677  -5.299
  785    HE2  PHE  95           2HE      PHE  95   1.915  -8.512  -6.313
  786    HZ   PHE  95           HZ       PHE  95   3.802  -7.005  -6.900
  787    H    GLU  96           H        GLU  96   6.998 -11.980  -1.206
  788    HA   GLU  96           HA       GLU  96   5.939 -12.995   1.216
  789   1HB   GLU  96          1HB       GLU  96   8.826 -12.470   0.406
  790   2HB   GLU  96          2HB       GLU  96   8.279 -13.457   1.775
  791   1HG   GLU  96          1HG       GLU  96   7.025 -14.913   0.136
  792   2HG   GLU  96          2HG       GLU  96   7.741 -13.985  -1.186
  793    HE2  GLU  96           HE       GLU  96  10.044 -16.564   0.925
  794    H    ASP  97           H        ASP  97   4.870 -11.277   2.194
  795    HA   ASP  97           HA       ASP  97   4.674  -9.831   3.937
  796   1HB   ASP  97          1HB       ASP  97   7.062  -9.942   4.629
  797   2HB   ASP  97          2HB       ASP  97   7.457  -8.708   3.413
  798    HD2  ASP  97           HD       ASP  97   6.275  -6.044   5.243
  799    H    PHE  98           H        PHE  98   3.767  -7.771   3.911
  800    HA   PHE  98           HA       PHE  98   3.402  -6.604   1.235
  801   1HB   PHE  98          1HB       PHE  98   1.568  -7.290   2.881
  802   2HB   PHE  98          2HB       PHE  98   1.955  -5.835   3.777
  803    HD1  PHE  98           1HD      PHE  98  -0.561  -6.906   2.129
  804    HD2  PHE  98           2HD      PHE  98   2.383  -3.823   1.498
  805    HE1  PHE  98           1HE      PHE  98  -2.191  -5.600   0.814
  806    HE2  PHE  98           2HE      PHE  98   0.759  -2.546   0.183
  807    HZ   PHE  98           HZ       PHE  98  -1.529  -3.453  -0.201
  808    H    GLU  99           H        GLU  99   5.052  -5.139   0.786
  809    HA   GLU  99           HA       GLU  99   5.758  -3.119   2.881
  810   1HB   GLU  99          1HB       GLU  99   7.471  -4.671   2.232
  811   2HB   GLU  99          2HB       GLU  99   7.372  -4.144   0.566
  812   1HG   GLU  99          1HG       GLU  99   8.112  -1.891   1.182
  813   2HG   GLU  99          2HG       GLU  99   7.920  -2.244   2.904
  814    HE2  GLU  99           HE       GLU  99  10.978  -3.992   3.094
  815    H    THR 100           H        THR 100   6.295  -0.957   2.089
  816    HA   THR 100           HA       THR 100   4.583  -0.088  -0.144
  817    HB   THR 100           HB       THR 100   4.260   1.816   0.922
  818    HG1  THR 100           1HG      THR 100   5.672   2.681   2.513
  819   1HG2  THR 100          1HG2      THR 100   3.783   1.372   3.278
  820   2HG2  THR 100          2HG2      THR 100   3.481  -0.107   2.338
  821   3HG2  THR 100          3HG2      THR 100   4.956   0.056   3.324
  822    H    TYR 101           H        TYR 101   5.351   1.222  -1.861
  823    HA   TYR 101           HA       TYR 101   8.236   1.181  -2.333
  824   1HB   TYR 101          1HB       TYR 101   6.354   0.657  -3.950
  825   2HB   TYR 101          2HB       TYR 101   5.969   2.382  -3.951
  826    HD1  TYR 101           1HD      TYR 101   6.217   2.755  -6.275
  827    HD2  TYR 101           2HD      TYR 101   9.281   0.580  -4.184
  828    HE1  TYR 101           1HE      TYR 101   7.685   2.900  -8.264
  829    HE2  TYR 101           2HE      TYR 101  10.755   0.735  -6.150
  830    HH   TYR 101           HH       TYR 101  11.012   1.561  -8.277
  Start of MODEL    7
    1   1H    GLY  -1          1H        GLY  -1  23.560 -35.797   9.532
    2   2H    GLY  -1          2H        GLY  -1  22.788 -37.241   9.323
    3   3H    GLY  -1          3H        GLY  -1  24.039 -36.828   8.334
    4   1HA   GLY  -1          1HA       GLY  -1  21.458 -35.451   8.506
    5   2HA   GLY  -1          2HA       GLY  -1  22.786 -35.012   7.418
    6    H    SER   0           H        SER   0  22.716 -35.886   5.401
    7    HA   SER   0           HA       SER   0  22.106 -37.082   3.606
    8   1HB   SER   0          1HB       SER   0  23.459 -38.803   4.737
    9   2HB   SER   0          2HB       SER   0  22.012 -39.436   5.546
   10    HG   SER   0           HG       SER   0  21.140 -39.833   3.478
   11    H    MET   1           H        MET   1  20.120 -35.605   4.030
   12    HA   MET   1           HA       MET   1  17.760 -37.190   3.460
   13   1HB   MET   1          1HB       MET   1  16.366 -36.392   5.201
   14   2HB   MET   1          2HB       MET   1  17.794 -37.070   5.982
   15   1HG   MET   1          1HG       MET   1  17.149 -34.120   5.567
   16   2HG   MET   1          2HG       MET   1  17.081 -35.029   7.072
   17   1HE   MET   1          1HE       MET   1  18.445 -32.205   6.770
   18   2HE   MET   1          2HE       MET   1  19.917 -32.449   7.739
   19   3HE   MET   1          3HE       MET   1  18.363 -33.109   8.302
   20    H    LYS   2           H        LYS   2  16.146 -35.962   2.432
   21    HA   LYS   2           HA       LYS   2  16.955 -33.225   1.547
   22   1HB   LYS   2          1HB       LYS   2  16.014 -33.763  -0.624
   23   2HB   LYS   2          2HB       LYS   2  17.468 -34.663  -0.230
   24   1HG   LYS   2          1HG       LYS   2  14.708 -35.886   0.150
   25   2HG   LYS   2          2HG       LYS   2  15.447 -35.827  -1.434
   26   1HD   LYS   2          1HD       LYS   2  17.031 -37.090   0.823
   27   2HD   LYS   2          2HD       LYS   2  15.676 -37.944   0.088
   28   1HE   LYS   2          1HE       LYS   2  17.681 -38.638  -1.010
   29   2HE   LYS   2          2HE       LYS   2  16.712 -37.698  -2.156
   30   1HZ   LYS   2          1HZ       LYS   2  18.995 -37.000  -2.254
   31   2HZ   LYS   2          2HZ       LYS   2  18.975 -36.586  -0.617
   32    H    LYS   3           H        LYS   3  14.252 -35.439   2.205
   33    HA   LYS   3           HA       LYS   3  12.137 -35.159   2.803
   34   1HB   LYS   3          1HB       LYS   3  12.603 -32.180   3.188
   35   2HB   LYS   3          2HB       LYS   3  11.306 -33.166   3.848
   36   1HG   LYS   3          1HG       LYS   3  14.258 -33.344   4.597
   37   2HG   LYS   3          2HG       LYS   3  12.942 -32.652   5.549
   38   1HD   LYS   3          1HD       LYS   3  11.848 -34.926   5.624
   39   2HD   LYS   3          2HD       LYS   3  13.249 -35.585   4.758
   40   1HE   LYS   3          1HE       LYS   3  13.559 -36.036   7.094
   41   2HE   LYS   3          2HE       LYS   3  14.737 -34.805   6.604
   42   1HZ   LYS   3          1HZ       LYS   3  13.702 -34.153   8.653
   43   2HZ   LYS   3          2HZ       LYS   3  12.175 -34.185   7.931
   44    H    TRP   4           H        TRP   4  10.107 -34.684   1.961
   45    HA   TRP   4           HA       TRP   4   9.998 -33.192  -0.624
   46   1HB   TRP   4          1HB       TRP   4   8.611 -34.949  -1.531
   47   2HB   TRP   4          2HB       TRP   4  10.228 -35.516  -1.148
   48    HD1  TRP   4           HD       TRP   4  10.398 -36.957   1.261
   49    HE1  TRP   4           1HE      TRP   4   8.798 -38.784   2.136
   50    HE3  TRP   4           3HE      TRP   4   6.241 -35.841  -1.525
   51    HZ2  TRP   4           2HZ      TRP   4   6.122 -39.652   1.676
   52    HZ3  TRP   4           3HZ      TRP   4   4.213 -37.241  -1.333
   53    HH2  TRP   4           HH       TRP   4   4.125 -39.123   0.283
   54    H    SER   5           H        SER   5   9.419 -31.749   1.410
   55    HA   SER   5           HA       SER   5   6.775 -32.097   2.533
   56   1HB   SER   5          1HB       SER   5   8.702 -29.739   2.638
   57   2HB   SER   5          2HB       SER   5   7.286 -29.998   3.680
   58    HG   SER   5           HG       SER   5   8.302 -31.955   4.368
   59    H    ASP   6           H        ASP   6   5.855 -32.285   0.250
   60    HA   ASP   6           HA       ASP   6   4.406 -29.855  -0.311
   61   1HB   ASP   6          1HB       ASP   6   6.387 -29.473  -1.729
   62   2HB   ASP   6          2HB       ASP   6   6.215 -31.083  -2.444
   63    HD2  ASP   6           HD       ASP   6   3.417 -28.255  -3.373
   64    H    THR   7           H        THR   7   2.752 -31.177   0.513
   65    HA   THR   7           HA       THR   7   1.663 -33.205  -1.358
   66    HB   THR   7           HB       THR   7   1.173 -34.672   0.590
   67    HG1  THR   7           1HG      THR   7   2.280 -34.223   2.539
   68   1HG2  THR   7          1HG2      THR   7   3.369 -35.616   0.904
   69   2HG2  THR   7          2HG2      THR   7   3.236 -35.051  -0.775
   70   3HG2  THR   7          3HG2      THR   7   4.165 -34.112   0.417
   71    H    GLU   8           H        GLU   8  -0.580 -33.753  -0.737
   72    HA   GLU   8           HA       GLU   8  -2.697 -33.340  -0.232
   73   1HB   GLU   8          1HB       GLU   8  -1.737 -31.300   1.815
   74   2HB   GLU   8          2HB       GLU   8  -3.328 -32.057   1.717
   75   1HG   GLU   8          1HG       GLU   8  -2.289 -34.296   2.062
   76   2HG   GLU   8          2HG       GLU   8  -0.706 -33.522   2.251
   77    HE2  GLU   8           HE       GLU   8  -1.797 -34.016   5.611
   78    H    VAL   9           H        VAL   9  -4.465 -31.698  -0.193
   79    HA   VAL   9           HA       VAL   9  -4.099 -29.810  -2.442
   80    HB   VAL   9           HB       VAL   9  -6.513 -31.034  -1.036
   81   1HG1  VAL   9          1HG1      VAL   9  -6.465 -29.212  -3.471
   82   2HG1  VAL   9          2HG1      VAL   9  -7.883 -30.061  -2.830
   83   3HG1  VAL   9          3HG1      VAL   9  -7.122 -28.790  -1.868
   84   1HG2  VAL   9          1HG2      VAL   9  -5.357 -31.463  -3.829
   85   2HG2  VAL   9          2HG2      VAL   9  -5.250 -32.615  -2.481
   86   3HG2  VAL   9          3HG2      VAL   9  -6.825 -32.221  -3.180
   87    H    PHE  10           H        PHE  10  -4.085 -27.624  -2.084
   88    HA   PHE  10           HA       PHE  10  -5.527 -26.268  -0.192
   89   1HB   PHE  10          1HB       PHE  10  -3.894 -27.275   1.517
   90   2HB   PHE  10          2HB       PHE  10  -2.602 -26.417   0.709
   91    HD1  PHE  10           1HD      PHE  10  -2.394 -23.940   1.001
   92    HD2  PHE  10           2HD      PHE  10  -5.604 -26.158   2.847
   93    HE1  PHE  10           1HE      PHE  10  -3.062 -21.925   2.271
   94    HE2  PHE  10           2HE      PHE  10  -6.225 -24.151   4.160
   95    HZ   PHE  10           HZ       PHE  10  -4.980 -22.026   3.851
   96    H    GLU  11           H        GLU  11  -5.892 -25.110  -2.038
   97    HA   GLU  11           HA       GLU  11  -3.789 -23.130  -2.809
   98   1HB   GLU  11          1HB       GLU  11  -4.602 -23.207  -5.069
   99   2HB   GLU  11          2HB       GLU  11  -3.814 -24.682  -4.524
  100   1HG   GLU  11          1HG       GLU  11  -6.817 -24.314  -4.896
  101   2HG   GLU  11          2HG       GLU  11  -5.703 -25.135  -5.982
  102    HE2  GLU  11           HE       GLU  11  -7.450 -27.252  -3.232
  103    H    MET  12           H        MET  12  -4.852 -21.866  -1.042
  104    HA   MET  12           HA       MET  12  -7.426 -20.599  -1.906
  105   1HB   MET  12          1HB       MET  12  -6.414 -21.135   0.917
  106   2HB   MET  12          2HB       MET  12  -7.869 -20.229   0.479
  107   1HG   MET  12          1HG       MET  12  -8.744 -22.283   0.977
  108   2HG   MET  12          2HG       MET  12  -8.620 -22.355  -0.783
  109   1HE   MET  12          1HE       MET  12  -9.237 -24.901   0.741
  110   2HE   MET  12          2HE       MET  12  -8.032 -26.074   0.163
  111   3HE   MET  12          3HE       MET  12  -8.806 -24.960  -0.987
  112    H    LEU  13           H        LEU  13  -7.766 -18.489  -0.981
  113    HA   LEU  13           HA       LEU  13  -7.451 -16.399  -0.666
  114   1HB   LEU  13          1HB       LEU  13  -5.942 -15.632   0.759
  115   2HB   LEU  13          2HB       LEU  13  -5.699 -17.344   0.996
  116    HG   LEU  13           HG       LEU  13  -3.753 -16.939  -0.855
  117   1HD1  LEU  13          1HD1      LEU  13  -2.736 -14.734  -0.534
  118   2HD1  LEU  13          2HD1      LEU  13  -4.374 -14.519  -1.173
  119   3HD1  LEU  13          3HD1      LEU  13  -4.058 -14.246   0.549
  120   1HD2  LEU  13          1HD2      LEU  13  -2.205 -16.612   1.018
  121   2HD2  LEU  13          2HD2      LEU  13  -3.559 -16.148   2.073
  122   3HD2  LEU  13          3HD2      LEU  13  -3.450 -17.805   1.432
  123    H    LYS  14           H        LYS  14  -7.337 -14.713  -1.961
  124    HA   LYS  14           HA       LYS  14  -5.895 -15.104  -4.559
  125   1HB   LYS  14          1HB       LYS  14  -7.780 -14.356  -5.716
  126   2HB   LYS  14          2HB       LYS  14  -8.193 -15.686  -4.654
  127   1HG   LYS  14          1HG       LYS  14  -9.948 -14.198  -4.607
  128   2HG   LYS  14          2HG       LYS  14  -9.150 -14.030  -3.031
  129   1HD   LYS  14          1HD       LYS  14  -8.579 -11.843  -3.411
  130   2HD   LYS  14          2HD       LYS  14  -8.320 -12.068  -5.148
  131   1HE   LYS  14          1HE       LYS  14 -11.106 -12.141  -3.952
  132   2HE   LYS  14          2HE       LYS  14 -10.310 -10.636  -4.455
  133   1HZ   LYS  14          1HZ       LYS  14 -11.572 -11.496  -6.285
  134   2HZ   LYS  14          2HZ       LYS  14 -10.711 -12.948  -6.246
  135    H    ARG  15           H        ARG  15  -5.848 -13.062  -5.911
  136    HA   ARG  15           HA       ARG  15  -4.541 -11.021  -4.238
  137   1HB   ARG  15          1HB       ARG  15  -3.298 -10.261  -5.942
  138   2HB   ARG  15          2HB       ARG  15  -3.253 -12.017  -6.008
  139   1HG   ARG  15          1HG       ARG  15  -5.008 -11.838  -7.864
  140   2HG   ARG  15          2HG       ARG  15  -4.758 -10.083  -7.825
  141   1HD   ARG  15          1HD       ARG  15  -2.354 -10.372  -8.325
  142   2HD   ARG  15          2HD       ARG  15  -2.574 -12.121  -8.353
  143    HE   ARG  15           HE       ARG  15  -3.442 -12.038 -10.443
  144   1HH1  ARG  15          2HH1      ARG  15  -3.571  -8.749  -9.107
  145   2HH1  ARG  15          1HH1      ARG  15  -4.080  -8.022 -10.608
  146   1HH2  ARG  15          1HH2      ARG  15  -4.074 -11.062 -12.417
  147   2HH2  ARG  15          2HH2      ARG  15  -4.382  -9.346 -12.491
  148    H    MET  16           H        MET  16  -5.749  -9.353  -3.559
  149    HA   MET  16           HA       MET  16  -7.824  -8.174  -5.303
  150   1HB   MET  16          1HB       MET  16  -8.267  -6.786  -3.479
  151   2HB   MET  16          2HB       MET  16  -8.601  -8.491  -3.191
  152   1HG   MET  16          1HG       MET  16  -6.898  -8.705  -1.597
  153   2HG   MET  16          2HG       MET  16  -6.027  -7.285  -2.150
  154   1HE   MET  16          1HE       MET  16  -6.407  -4.756  -1.238
  155   2HE   MET  16          2HE       MET  16  -8.054  -4.276  -0.803
  156   3HE   MET  16          3HE       MET  16  -7.725  -4.933  -2.410
  157    H    TYR  17           H        TYR  17  -6.500  -7.355  -6.902
  158    HA   TYR  17           HA       TYR  17  -4.370  -5.390  -6.362
  159   1HB   TYR  17          1HB       TYR  17  -3.850  -6.663  -8.213
  160   2HB   TYR  17          2HB       TYR  17  -5.526  -6.783  -8.741
  161    HD1  TYR  17           1HD      TYR  17  -3.536  -3.637  -8.050
  162    HD2  TYR  17           2HD      TYR  17  -5.435  -6.166 -10.989
  163    HE1  TYR  17           1HE      TYR  17  -3.508  -1.784  -9.694
  164    HE2  TYR  17           2HE      TYR  17  -5.224  -4.371 -12.670
  165    HH   TYR  17           HH       TYR  17  -4.630  -2.179 -13.062
  166    H    ALA  18           H        ALA  18  -4.960  -3.370  -5.770
  167    HA   ALA  18           HA       ALA  18  -7.521  -2.235  -6.788
  168   1HB   ALA  18          1HB       ALA  18  -7.641  -1.018  -4.673
  169   2HB   ALA  18          2HB       ALA  18  -7.697  -2.783  -4.447
  170   3HB   ALA  18          3HB       ALA  18  -6.198  -1.889  -4.089
  171    H    ARG  19           H        ARG  19  -7.047  -0.849  -8.269
  172    HA   ARG  19           HA       ARG  19  -4.606   0.771  -8.237
  173   1HB   ARG  19          1HB       ARG  19  -5.860  -0.504 -10.274
  174   2HB   ARG  19          2HB       ARG  19  -6.648   1.063 -10.410
  175   1HG   ARG  19          1HG       ARG  19  -3.707   0.399 -10.567
  176   2HG   ARG  19          2HG       ARG  19  -4.759   1.064 -11.830
  177   1HD   ARG  19          1HD       ARG  19  -5.092   3.032 -10.085
  178   2HD   ARG  19          2HD       ARG  19  -3.563   2.452  -9.408
  179    HE   ARG  19           HE       ARG  19  -3.980   4.099 -11.628
  180   1HH1  ARG  19          1HH1      ARG  19  -1.997   1.211 -10.992
  181   2HH1  ARG  19          2HH1      ARG  19  -0.838   1.601 -12.232
  182   1HH2  ARG  19          1HH2      ARG  19  -2.403   4.632 -13.134
  183   2HH2  ARG  19          2HH2      ARG  19  -1.085   3.538 -13.493
  184    H    VAL  20           H        VAL  20  -4.783   2.626  -6.976
  185    HA   VAL  20           HA       VAL  20  -7.434   3.910  -6.626
  186    HB   VAL  20           HB       VAL  20  -4.875   4.556  -5.179
  187   1HG1  VAL  20          1HG1      VAL  20  -7.793   4.893  -4.384
  188   2HG1  VAL  20          2HG1      VAL  20  -6.371   5.491  -3.510
  189   3HG1  VAL  20          3HG1      VAL  20  -6.804   6.181  -5.084
  190   1HG2  VAL  20          1HG2      VAL  20  -6.973   2.494  -4.407
  191   2HG2  VAL  20          2HG2      VAL  20  -5.259   2.178  -4.759
  192   3HG2  VAL  20          3HG2      VAL  20  -5.706   3.120  -3.334
  193    H    TYR  21           H        TYR  21  -7.898   5.398  -8.163
  194    HA   TYR  21           HA       TYR  21  -5.726   6.939  -9.473
  195   1HB   TYR  21          1HB       TYR  21  -8.654   6.626 -10.193
  196   2HB   TYR  21          2HB       TYR  21  -7.542   7.628 -11.032
  197    HD1  TYR  21           1HD      TYR  21  -5.679   6.660 -12.382
  198    HD2  TYR  21           2HD      TYR  21  -8.569   4.135 -10.412
  199    HE1  TYR  21           1HE      TYR  21  -5.061   4.775 -13.862
  200    HE2  TYR  21           2HE      TYR  21  -7.970   2.276 -11.906
  201    HH   TYR  21           HH       TYR  21  -6.702   1.596 -13.708
  202    H    GLY  22           H        GLY  22  -5.815   9.169  -9.743
  203   1HA   GLY  22          1HA       GLY  22  -7.202  11.202  -9.510
  204   2HA   GLY  22          2HA       GLY  22  -7.466  10.744  -7.812
  205    H    LEU  23           H        LEU  23  -6.552  12.764  -7.210
  206    HA   LEU  23           HA       LEU  23  -3.652  13.153  -7.614
  207   1HB   LEU  23          1HB       LEU  23  -5.327  15.027  -7.763
  208   2HB   LEU  23          2HB       LEU  23  -5.593  14.830  -6.028
  209    HG   LEU  23           HG       LEU  23  -2.991  15.185  -5.825
  210   1HD1  LEU  23          1HD1      LEU  23  -2.001  16.540  -7.622
  211   2HD1  LEU  23          2HD1      LEU  23  -2.438  14.941  -8.235
  212   3HD1  LEU  23          3HD1      LEU  23  -3.463  16.343  -8.607
  213   1HD2  LEU  23          1HD2      LEU  23  -3.293  17.635  -5.837
  214   2HD2  LEU  23          2HD2      LEU  23  -4.816  17.447  -6.735
  215   3HD2  LEU  23          3HD2      LEU  23  -4.670  16.819  -5.079
  216    H    VAL  24           H        VAL  24  -4.211  10.771  -6.469
  217    HA   VAL  24           HA       VAL  24  -3.885  10.992  -3.519
  218    HB   VAL  24           HB       VAL  24  -4.268   8.513  -3.626
  219   1HG1  VAL  24          1HG1      VAL  24  -6.370  10.340  -4.811
  220   2HG1  VAL  24          2HG1      VAL  24  -6.679   8.706  -4.167
  221   3HG1  VAL  24          3HG1      VAL  24  -6.106   9.993  -3.096
  222   1HG2  VAL  24          1HG2      VAL  24  -5.116   8.979  -6.518
  223   2HG2  VAL  24          2HG2      VAL  24  -3.534   8.301  -6.098
  224   3HG2  VAL  24          3HG2      VAL  24  -5.018   7.460  -5.627
  225    H    GLN  25           H        GLN  25  -1.713  11.896  -5.147
  226    HA   GLN  25           HA       GLN  25   0.291   9.736  -4.918
  227   1HB   GLN  25          1HB       GLN  25  -0.378  11.461  -6.938
  228   2HB   GLN  25          2HB       GLN  25   1.048  12.231  -6.250
  229   1HG   GLN  25          1HG       GLN  25   1.710  10.658  -7.972
  230   2HG   GLN  25          2HG       GLN  25   2.252  10.022  -6.420
  231   1HE2  GLN  25          1HE2      GLN  25   2.347   8.028  -7.911
  232   2HE2  GLN  25          2HE2      GLN  25   0.895   7.071  -8.119
  233    H    GLY  26           H        GLY  26  -0.604  10.998  -2.528
  234   1HA   GLY  26          1HA       GLY  26   1.802  11.524  -1.149
  235   2HA   GLY  26          2HA       GLY  26   1.052  13.081  -1.578
  236    H    VAL  27           H        VAL  27   0.839  13.354   0.774
  237    HA   VAL  27           HA       VAL  27  -0.332  13.480   2.672
  238    HB   VAL  27           HB       VAL  27  -2.315  13.155   0.730
  239   1HG1  VAL  27          1HG1      VAL  27  -3.305  11.545   3.099
  240   2HG1  VAL  27          2HG1      VAL  27  -4.114  11.919   1.595
  241   3HG1  VAL  27          3HG1      VAL  27  -2.760  10.788   1.583
  242   1HG2  VAL  27          1HG2      VAL  27  -2.658  13.898   3.640
  243   2HG2  VAL  27          2HG2      VAL  27  -2.125  14.974   2.324
  244   3HG2  VAL  27          3HG2      VAL  27  -3.752  14.289   2.295
  245    H    GLY  28           H        GLY  28  -1.689  11.787   4.292
  246   1HA   GLY  28          1HA       GLY  28   0.263   9.730   4.928
  247   2HA   GLY  28          2HA       GLY  28  -1.251  10.080   5.766
  248    H    PHE  29           H        PHE  29  -0.540   9.099   2.397
  249    HA   PHE  29           HA       PHE  29  -2.551   6.974   2.443
  250   1HB   PHE  29          1HB       PHE  29  -2.412   7.070   0.111
  251   2HB   PHE  29          2HB       PHE  29  -2.282   8.741   0.601
  252    HD1  PHE  29           1HD      PHE  29   0.918   8.397   1.348
  253    HD2  PHE  29           2HD      PHE  29  -1.554   7.450  -2.065
  254    HE1  PHE  29           1HE      PHE  29   2.766   8.955  -0.138
  255    HE2  PHE  29           2HE      PHE  29   0.376   7.855  -3.541
  256    HZ   PHE  29           HZ       PHE  29   2.510   8.754  -2.599
  257    H    ARG  30           H        ARG  30  -1.842   5.061   0.925
  258    HA   ARG  30           HA       ARG  30  -0.822   3.106   0.719
  259   1HB   ARG  30          1HB       ARG  30   1.696   4.802   0.987
  260   2HB   ARG  30          2HB       ARG  30   1.697   3.059   0.673
  261   1HG   ARG  30          1HG       ARG  30   0.228   3.423  -1.305
  262   2HG   ARG  30          2HG       ARG  30   0.354   5.170  -1.070
  263   1HD   ARG  30          1HD       ARG  30   2.772   3.344  -1.428
  264   2HD   ARG  30          2HD       ARG  30   1.921   4.050  -2.780
  265    HE   ARG  30           HE       ARG  30   2.524   6.232  -2.175
  266   1HH1  ARG  30          1HH1      ARG  30   4.039   3.939   0.041
  267   2HH1  ARG  30          2HH1      ARG  30   5.620   4.678  -0.076
  268   1HH2  ARG  30          1HH2      ARG  30   4.495   7.408  -2.021
  269   2HH2  ARG  30          2HH2      ARG  30   5.794   6.789  -1.029
  270    H    LYS  31           H        LYS  31   1.376   4.462   3.168
  271    HA   LYS  31           HA       LYS  31   1.717   2.462   4.895
  272   1HB   LYS  31          1HB       LYS  31   2.570   4.815   5.013
  273   2HB   LYS  31          2HB       LYS  31   1.036   5.300   5.714
  274   1HG   LYS  31          1HG       LYS  31   2.663   5.030   7.455
  275   2HG   LYS  31          2HG       LYS  31   1.441   3.776   7.661
  276   1HD   LYS  31          1HD       LYS  31   3.806   3.004   5.989
  277   2HD   LYS  31          2HD       LYS  31   4.178   3.390   7.671
  278   1HE   LYS  31          1HE       LYS  31   2.701   1.717   8.528
  279   2HE   LYS  31          2HE       LYS  31   2.000   1.402   6.936
  280   1HZ   LYS  31          1HZ       LYS  31   3.634  -0.253   7.397
  281   2HZ   LYS  31          2HZ       LYS  31   4.831   0.923   7.588
  282    H    PHE  32           H        PHE  32  -1.095   4.737   4.968
  283    HA   PHE  32           HA       PHE  32  -2.534   3.749   7.065
  284   1HB   PHE  32          1HB       PHE  32  -3.093   5.739   5.806
  285   2HB   PHE  32          2HB       PHE  32  -3.599   4.776   4.423
  286    HD1  PHE  32           1HD      PHE  32  -5.736   6.023   4.444
  287    HD2  PHE  32           2HD      PHE  32  -4.598   3.544   7.801
  288    HE1  PHE  32           1HE      PHE  32  -7.999   6.250   5.414
  289    HE2  PHE  32           2HE      PHE  32  -6.860   3.701   8.688
  290    HZ   PHE  32           HZ       PHE  32  -8.585   5.076   7.524
  291    H    VAL  33           H        VAL  33  -2.700   2.602   3.672
  292    HA   VAL  33           HA       VAL  33  -4.667   0.530   4.088
  293    HB   VAL  33           HB       VAL  33  -2.536   0.731   1.907
  294   1HG1  VAL  33          1HG1      VAL  33  -5.126  -0.851   2.141
  295   2HG1  VAL  33          2HG1      VAL  33  -4.233  -0.630   0.627
  296   3HG1  VAL  33          3HG1      VAL  33  -3.479  -1.498   1.971
  297   1HG2  VAL  33          1HG2      VAL  33  -5.416   1.714   1.814
  298   2HG2  VAL  33          2HG2      VAL  33  -3.991   2.773   1.930
  299   3HG2  VAL  33          3HG2      VAL  33  -4.231   1.765   0.501
  300    H    GLN  34           H        GLN  34  -1.185   0.752   4.498
  301    HA   GLN  34           HA       GLN  34  -0.787  -2.106   4.761
  302   1HB   GLN  34          1HB       GLN  34   0.951   0.291   5.222
  303   2HB   GLN  34          2HB       GLN  34   1.360  -1.227   6.031
  304   1HG   GLN  34          1HG       GLN  34   2.542  -1.000   3.922
  305   2HG   GLN  34          2HG       GLN  34   1.436  -2.376   3.864
  306   1HE2  GLN  34          1HE2      GLN  34  -0.562  -2.164   2.670
  307   2HE2  GLN  34          2HE2      GLN  34  -0.741  -0.955   1.413
  308    H    ILE  35           H        ILE  35  -1.115   0.492   7.280
  309    HA   ILE  35           HA       ILE  35  -1.033  -1.074   9.521
  310    HB   ILE  35           HB       ILE  35  -3.176   1.034   8.994
  311   1HG1  ILE  35          1HG1      ILE  35  -1.160   2.163   8.561
  312   2HG1  ILE  35          2HG1      ILE  35  -1.605   2.588  10.196
  313   1HG2  ILE  35          1HG2      ILE  35  -3.092   1.393  11.458
  314   2HG2  ILE  35          2HG2      ILE  35  -3.734  -0.181  11.002
  315   3HG2  ILE  35          3HG2      ILE  35  -2.070  -0.053  11.607
  316   1HD1  ILE  35          1HD1      ILE  35   0.761   2.181  10.139
  317   2HD1  ILE  35          2HD1      ILE  35   0.025   0.840  11.038
  318   3HD1  ILE  35          3HD1      ILE  35   0.549   0.608   9.350
  319    H    HIS  36           H        HIS  36  -3.969  -0.821   7.489
  320    HA   HIS  36           HA       HIS  36  -5.472  -2.647   9.179
  321   1HB   HIS  36          1HB       HIS  36  -5.961  -1.401   6.456
  322   2HB   HIS  36          2HB       HIS  36  -7.048  -2.590   7.191
  323    HD2  HIS  36           2HD      HIS  36  -5.544   0.861   8.599
  324    HE1  HIS  36           1HE      HIS  36  -9.590   0.390   9.738
  325    HE2  HIS  36           2HE      HIS  36  -7.549   1.917   9.885
  326    H    ALA  37           H        ALA  37  -4.024  -2.926   5.882
  327    HA   ALA  37           HA       ALA  37  -4.441  -5.547   5.314
  328   1HB   ALA  37          1HB       ALA  37  -2.385  -5.424   3.983
  329   2HB   ALA  37          2HB       ALA  37  -3.308  -3.927   3.847
  330   3HB   ALA  37          3HB       ALA  37  -1.860  -4.012   4.878
  331    H    ILE  38           H        ILE  38  -1.837  -4.303   7.326
  332    HA   ILE  38           HA       ILE  38  -0.474  -6.798   7.818
  333    HB   ILE  38           HB       ILE  38  -0.279  -3.913   8.704
  334   1HG1  ILE  38          1HG1      ILE  38   2.098  -4.258   8.145
  335   2HG1  ILE  38          2HG1      ILE  38   1.804  -5.976   7.862
  336   1HG2  ILE  38          1HG2      ILE  38   1.393  -4.388  10.399
  337   2HG2  ILE  38          2HG2      ILE  38  -0.229  -4.881  10.867
  338   3HG2  ILE  38          3HG2      ILE  38   0.953  -6.112  10.347
  339   1HD1  ILE  38          1HD1      ILE  38   2.005  -4.697   5.775
  340   2HD1  ILE  38          2HD1      ILE  38   0.386  -5.403   5.887
  341   3HD1  ILE  38          3HD1      ILE  38   0.650  -3.677   6.214
  342    H    ARG  39           H        ARG  39  -2.765  -4.739   9.733
  343    HA   ARG  39           HA       ARG  39  -3.055  -6.318  11.922
  344   1HB   ARG  39          1HB       ARG  39  -4.183  -4.138  11.402
  345   2HB   ARG  39          2HB       ARG  39  -5.447  -5.074  10.578
  346   1HG   ARG  39          1HG       ARG  39  -5.675  -6.427  12.698
  347   2HG   ARG  39          2HG       ARG  39  -4.534  -5.284  13.456
  348   1HD   ARG  39          1HD       ARG  39  -6.103  -3.423  12.952
  349   2HD   ARG  39          2HD       ARG  39  -7.229  -4.584  12.208
  350    HE   ARG  39           HE       ARG  39  -6.636  -5.477  14.829
  351   1HH1  ARG  39          1HH1      ARG  39  -8.347  -2.811  13.237
  352   2HH1  ARG  39          2HH1      ARG  39  -9.471  -2.573  14.549
  353   1HH2  ARG  39          1HH2      ARG  39  -8.117  -5.166  16.547
  354   2HH2  ARG  39          2HH2      ARG  39  -9.339  -3.926  16.446
  355    H    LEU  40           H        LEU  40  -4.627  -6.715   8.768
  356    HA   LEU  40           HA       LEU  40  -6.148  -9.103   9.565
  357   1HB   LEU  40          1HB       LEU  40  -6.088  -7.468   7.030
  358   2HB   LEU  40          2HB       LEU  40  -7.237  -8.767   7.383
  359    HG   LEU  40           HG       LEU  40  -6.961  -6.263   9.124
  360   1HD1  LEU  40          1HD1      LEU  40  -9.004  -5.514   8.012
  361   2HD1  LEU  40          2HD1      LEU  40  -7.638  -5.650   6.886
  362   3HD1  LEU  40          3HD1      LEU  40  -8.898  -6.908   6.898
  363   1HD2  LEU  40          1HD2      LEU  40  -9.192  -6.961   9.953
  364   2HD2  LEU  40          2HD2      LEU  40  -9.063  -8.463   9.012
  365   3HD2  LEU  40          3HD2      LEU  40  -7.947  -8.139  10.357
  366    H    GLY  41           H        GLY  41  -2.994  -8.866   8.658
  367   1HA   GLY  41          1HA       GLY  41  -1.510 -10.391   7.875
  368   2HA   GLY  41          2HA       GLY  41  -2.777 -11.614   8.043
  369    H    ILE  42           H        ILE  42  -2.095  -8.792   5.923
  370    HA   ILE  42           HA       ILE  42  -2.714 -10.400   3.488
  371    HB   ILE  42           HB       ILE  42  -2.913  -7.457   4.112
  372   1HG1  ILE  42          1HG1      ILE  42  -4.762  -8.739   5.027
  373   2HG1  ILE  42          2HG1      ILE  42  -5.263  -7.622   3.749
  374   1HG2  ILE  42          1HG2      ILE  42  -3.832  -7.069   1.894
  375   2HG2  ILE  42          2HG2      ILE  42  -2.154  -7.606   1.816
  376   3HG2  ILE  42          3HG2      ILE  42  -3.451  -8.731   1.429
  377   1HD1  ILE  42          1HD1      ILE  42  -6.449  -9.739   3.575
  378   2HD1  ILE  42          2HD1      ILE  42  -5.439  -9.473   2.156
  379   3HD1  ILE  42          3HD1      ILE  42  -4.929 -10.628   3.419
  380    H    LYS  43           H        LYS  43  -1.242 -10.456   1.905
  381    HA   LYS  43           HA       LYS  43   1.451  -9.203   2.325
  382   1HB   LYS  43          1HB       LYS  43   0.858 -11.403   0.380
  383   2HB   LYS  43          2HB       LYS  43   2.397 -10.809   0.998
  384   1HG   LYS  43          1HG       LYS  43   1.706 -11.579   3.317
  385   2HG   LYS  43          2HG       LYS  43   0.298 -12.357   2.564
  386   1HD   LYS  43          1HD       LYS  43   1.882 -13.699   1.124
  387   2HD   LYS  43          2HD       LYS  43   3.232 -12.943   1.994
  388   1HE   LYS  43          1HE       LYS  43   2.849 -15.114   2.956
  389   2HE   LYS  43          2HE       LYS  43   2.389 -13.876   4.138
  390   1HZ   LYS  43          1HZ       LYS  43   0.072 -14.221   3.389
  391   2HZ   LYS  43          2HZ       LYS  43   0.739 -15.687   3.900
  392    H    GLY  44           H        GLY  44   2.399  -8.275   0.265
  393   1HA   GLY  44          1HA       GLY  44   0.926  -7.652  -2.070
  394   2HA   GLY  44          2HA       GLY  44   0.430  -6.506  -0.810
  395    H    TYR  45           H        TYR  45   1.263  -4.877  -2.281
  396    HA   TYR  45           HA       TYR  45   3.570  -3.862  -1.155
  397   1HB   TYR  45          1HB       TYR  45   4.758  -5.404  -2.779
  398   2HB   TYR  45          2HB       TYR  45   3.991  -4.472  -4.060
  399    HD1  TYR  45           1HD      TYR  45   5.672  -3.230  -5.168
  400    HD2  TYR  45           2HD      TYR  45   5.959  -3.834  -0.929
  401    HE1  TYR  45           1HE      TYR  45   7.808  -1.972  -5.090
  402    HE2  TYR  45           2HE      TYR  45   7.834  -2.183  -0.819
  403    HH   TYR  45           HH       TYR  45   9.116  -0.686  -2.018
  404    H    ALA  46           H        ALA  46   3.524  -1.669  -1.390
  405    HA   ALA  46           HA       ALA  46   1.128  -0.567  -2.783
  406   1HB   ALA  46          1HB       ALA  46   1.231   1.216  -1.175
  407   2HB   ALA  46          2HB       ALA  46   1.189  -0.369  -0.384
  408   3HB   ALA  46          3HB       ALA  46   2.698   0.549  -0.452
  409    H    LYS  47           H        LYS  47   2.021  -0.233  -4.887
  410    HA   LYS  47           HA       LYS  47   4.639   1.054  -5.108
  411   1HB   LYS  47          1HB       LYS  47   4.485  -0.903  -6.354
  412   2HB   LYS  47          2HB       LYS  47   2.853  -0.516  -6.923
  413   1HG   LYS  47          1HG       LYS  47   3.636   1.124  -8.472
  414   2HG   LYS  47          2HG       LYS  47   5.226   1.181  -7.717
  415   1HD   LYS  47          1HD       LYS  47   5.375   0.031  -9.804
  416   2HD   LYS  47          2HD       LYS  47   5.690  -1.139  -8.521
  417   1HE   LYS  47          1HE       LYS  47   2.906  -0.817  -9.737
  418   2HE   LYS  47          2HE       LYS  47   4.151  -1.789 -10.537
  419   1HZ   LYS  47          1HZ       LYS  47   2.856  -3.188  -9.121
  420   2HZ   LYS  47          2HZ       LYS  47   3.285  -2.282  -7.764
  421    H    ASN  48           H        ASN  48   4.702   3.168  -5.239
  422    HA   ASN  48           HA       ASN  48   2.482   4.758  -6.314
  423   1HB   ASN  48          1HB       ASN  48   3.850   5.396  -4.280
  424   2HB   ASN  48          2HB       ASN  48   5.238   5.639  -5.347
  425   1HD2  ASN  48          2HD2      ASN  48   2.059   6.798  -4.373
  426   2HD2  ASN  48          1HD2      ASN  48   2.150   8.355  -5.167
  427    H    LEU  49           H        LEU  49   2.379   5.403  -8.448
  428    HA   LEU  49           HA       LEU  49   4.793   5.232 -10.161
  429   1HB   LEU  49          1HB       LEU  49   1.892   5.659 -10.859
  430   2HB   LEU  49          2HB       LEU  49   3.228   5.422 -11.974
  431    HG   LEU  49           HG       LEU  49   2.364   3.365  -9.892
  432   1HD1  LEU  49          1HD1      LEU  49   1.225   2.204 -11.700
  433   2HD1  LEU  49          2HD1      LEU  49   0.554   3.831 -11.503
  434   3HD1  LEU  49          3HD1      LEU  49   1.665   3.492 -12.849
  435   1HD2  LEU  49          1HD2      LEU  49   3.631   1.779 -11.323
  436   2HD2  LEU  49          2HD2      LEU  49   4.176   3.136 -12.331
  437   3HD2  LEU  49          3HD2      LEU  49   4.678   3.020 -10.628
  438    HA   PRO  50           HA       PRO  50   4.401   9.448  -8.514
  439   1HB   PRO  50          1HB       PRO  50   6.967  10.371  -8.701
  440   2HB   PRO  50          2HB       PRO  50   6.493   9.051  -7.603
  441   1HG   PRO  50          1HG       PRO  50   7.613   8.765 -10.412
  442   2HG   PRO  50          2HG       PRO  50   8.264   8.042  -8.907
  443   1HD   PRO  50          1HD       PRO  50   6.600   6.631 -10.501
  444   2HD   PRO  50          2HD       PRO  50   6.416   6.569  -8.720
  445    H    ASP  51           H        ASP  51   3.904   8.886 -11.514
  446    HA   ASP  51           HA       ASP  51   3.667  11.739 -12.182
  447   1HB   ASP  51          1HB       ASP  51   4.781   9.646 -14.107
  448   2HB   ASP  51          2HB       ASP  51   4.325  11.303 -14.539
  449    HD2  ASP  51           HD       ASP  51   7.099  12.769 -12.886
  450    H    GLY  52           H        GLY  52   1.827   9.972 -10.973
  451   1HA   GLY  52          1HA       GLY  52  -0.426  10.203 -12.650
  452   2HA   GLY  52          2HA       GLY  52   0.212   8.557 -12.826
  453    H    SER  53           H        SER  53  -0.734   7.144 -11.535
  454    HA   SER  53           HA       SER  53  -2.135   8.002  -9.044
  455   1HB   SER  53          1HB       SER  53  -3.619   5.986  -9.773
  456   2HB   SER  53          2HB       SER  53  -3.787   7.558 -10.586
  457    HG   SER  53           HG       SER  53  -2.616   6.805 -12.289
  458    H    VAL  54           H        VAL  54  -2.535   6.149  -7.504
  459    HA   VAL  54           HA       VAL  54   0.054   4.735  -7.139
  460    HB   VAL  54           HB       VAL  54  -0.518   6.399  -5.492
  461   1HG1  VAL  54          1HG1      VAL  54  -2.764   4.603  -4.525
  462   2HG1  VAL  54          2HG1      VAL  54  -2.300   6.194  -3.918
  463   3HG1  VAL  54          3HG1      VAL  54  -3.049   6.057  -5.513
  464   1HG2  VAL  54          1HG2      VAL  54  -0.586   3.562  -4.368
  465   2HG2  VAL  54          2HG2      VAL  54   0.865   4.449  -4.863
  466   3HG2  VAL  54          3HG2      VAL  54  -0.111   5.041  -3.510
  467    H    GLU  55           H        GLU  55   0.176   2.633  -7.360
  468    HA   GLU  55           HA       GLU  55  -2.264   0.988  -7.637
  469   1HB   GLU  55          1HB       GLU  55  -0.688   0.891  -9.418
  470   2HB   GLU  55          2HB       GLU  55   0.659   0.529  -8.333
  471   1HG   GLU  55          1HG       GLU  55  -0.175  -1.635  -7.799
  472   2HG   GLU  55          2HG       GLU  55  -1.780  -1.268  -8.429
  473    HE2  GLU  55           HE       GLU  55  -0.778  -1.677 -11.826
  474    H    VAL  56           H        VAL  56  -2.923  -0.274  -5.908
  475    HA   VAL  56           HA       VAL  56  -0.873  -1.154  -3.917
  476    HB   VAL  56           HB       VAL  56  -3.885  -0.995  -3.640
  477   1HG1  VAL  56          1HG1      VAL  56  -1.640  -1.693  -1.701
  478   2HG1  VAL  56          2HG1      VAL  56  -3.358  -1.538  -1.272
  479   3HG1  VAL  56          3HG1      VAL  56  -2.838  -2.843  -2.339
  480   1HG2  VAL  56          1HG2      VAL  56  -1.626   0.702  -2.459
  481   2HG2  VAL  56          2HG2      VAL  56  -2.847   1.268  -3.621
  482   3HG2  VAL  56          3HG2      VAL  56  -3.334   0.799  -1.984
  483    H    VAL  57           H        VAL  57  -0.138  -3.141  -4.400
  484    HA   VAL  57           HA       VAL  57  -2.016  -5.203  -5.446
  485    HB   VAL  57           HB       VAL  57   0.967  -5.417  -4.881
  486   1HG1  VAL  57          1HG1      VAL  57  -1.053  -7.218  -6.305
  487   2HG1  VAL  57          2HG1      VAL  57   0.698  -7.475  -6.300
  488   3HG1  VAL  57          3HG1      VAL  57  -0.205  -7.566  -4.783
  489   1HG2  VAL  57          1HG2      VAL  57  -0.511  -4.955  -7.514
  490   2HG2  VAL  57          2HG2      VAL  57   0.632  -3.837  -6.735
  491   3HG2  VAL  57          3HG2      VAL  57   1.207  -5.383  -7.365
  492    H    ALA  58           H        ALA  58  -2.829  -6.712  -4.024
  493    HA   ALA  58           HA       ALA  58  -1.817  -7.026  -1.296
  494   1HB   ALA  58          1HB       ALA  58  -4.079  -6.371  -0.359
  495   2HB   ALA  58          2HB       ALA  58  -3.135  -5.008  -1.001
  496   3HB   ALA  58          3HB       ALA  58  -4.459  -5.684  -1.952
  497    H    GLU  59           H        GLU  59  -2.415  -9.060  -0.593
  498    HA   GLU  59           HA       GLU  59  -4.323 -10.635  -2.212
  499   1HB   GLU  59          1HB       GLU  59  -1.710 -11.341  -0.874
  500   2HB   GLU  59          2HB       GLU  59  -2.796 -12.514  -1.615
  501   1HG   GLU  59          1HG       GLU  59  -1.988 -12.149  -3.637
  502   2HG   GLU  59          2HG       GLU  59  -2.326 -10.425  -3.551
  503    HE2  GLU  59           HE       GLU  59   0.957  -9.540  -3.210
  504    H    GLY  60           H        GLY  60  -6.091 -11.525  -0.999
  505   1HA   GLY  60          1HA       GLY  60  -5.522 -12.450   1.769
  506   2HA   GLY  60          2HA       GLY  60  -6.809 -11.257   1.520
  507    H    TYR  61           H        TYR  61  -7.184 -13.664   2.713
  508    HA   TYR  61           HA       TYR  61  -8.829 -15.394   1.078
  509   1HB   TYR  61          1HB       TYR  61  -8.628 -14.717   4.035
  510   2HB   TYR  61          2HB       TYR  61  -9.734 -15.925   3.412
  511    HD1  TYR  61           1HD      TYR  61  -8.900 -18.125   2.653
  512    HD2  TYR  61           2HD      TYR  61  -6.212 -15.099   4.140
  513    HE1  TYR  61           1HE      TYR  61  -7.136 -19.839   2.967
  514    HE2  TYR  61           2HE      TYR  61  -4.446 -16.805   4.421
  515    HH   TYR  61           HH       TYR  61  -3.849 -19.007   4.125
  516    H    GLU  62           H        GLU  62 -11.366 -15.302   1.954
  517    HA   GLU  62           HA       GLU  62 -12.143 -12.702   0.838
  518   1HB   GLU  62          1HB       GLU  62 -13.908 -15.026   1.570
  519   2HB   GLU  62          2HB       GLU  62 -14.328 -13.577   0.622
  520   1HG   GLU  62          1HG       GLU  62 -12.546 -14.251  -1.058
  521   2HG   GLU  62          2HG       GLU  62 -12.386 -15.792  -0.199
  522    HE2  GLU  62           HE       GLU  62 -15.588 -16.947  -1.233
  523    H    GLU  63           H        GLU  63 -12.084 -14.152   4.042
  524    HA   GLU  63           HA       GLU  63 -14.047 -12.329   5.180
  525   1HB   GLU  63          1HB       GLU  63 -11.784 -14.000   6.411
  526   2HB   GLU  63          2HB       GLU  63 -13.005 -13.081   7.306
  527   1HG   GLU  63          1HG       GLU  63 -14.789 -14.451   6.203
  528   2HG   GLU  63          2HG       GLU  63 -13.533 -15.428   5.428
  529    HE2  GLU  63           HE       GLU  63 -12.460 -16.857   8.535
  530    H    ALA  64           H        ALA  64 -10.455 -12.511   4.964
  531    HA   ALA  64           HA       ALA  64 -10.095  -9.845   6.026
  532   1HB   ALA  64          1HB       ALA  64  -7.751 -10.211   5.443
  533   2HB   ALA  64          2HB       ALA  64  -8.401 -11.650   6.245
  534   3HB   ALA  64          3HB       ALA  64  -8.181 -11.643   4.480
  535    H    LEU  65           H        LEU  65 -11.129 -10.983   2.908
  536    HA   LEU  65           HA       LEU  65  -9.944  -8.846   1.350
  537   1HB   LEU  65          1HB       LEU  65 -10.728 -10.865   0.290
  538   2HB   LEU  65          2HB       LEU  65 -12.389 -10.559   0.854
  539    HG   LEU  65           HG       LEU  65 -12.665  -8.714  -0.573
  540   1HD1  LEU  65          1HD1      LEU  65 -10.807  -8.009  -2.156
  541   2HD1  LEU  65          2HD1      LEU  65 -10.514  -7.586  -0.466
  542   3HD1  LEU  65          3HD1      LEU  65  -9.690  -8.994  -1.180
  543   1HD2  LEU  65          1HD2      LEU  65 -12.324  -9.841  -2.736
  544   2HD2  LEU  65          2HD2      LEU  65 -11.120 -10.919  -1.984
  545   3HD2  LEU  65          3HD2      LEU  65 -12.828 -11.019  -1.500
  546    H    SER  66           H        SER  66 -13.356  -9.422   2.300
  547    HA   SER  66           HA       SER  66 -14.413  -6.989   1.821
  548   1HB   SER  66          1HB       SER  66 -16.148  -7.555   3.480
  549   2HB   SER  66          2HB       SER  66 -15.691  -8.965   2.506
  550    HG   SER  66           HG       SER  66 -14.295  -9.565   4.286
  551    H    LYS  67           H        LYS  67 -12.681  -7.855   4.842
  552    HA   LYS  67           HA       LYS  67 -13.250  -5.459   6.270
  553   1HB   LYS  67          1HB       LYS  67 -11.091  -7.600   6.435
  554   2HB   LYS  67          2HB       LYS  67 -11.304  -6.342   7.671
  555   1HG   LYS  67          1HG       LYS  67 -13.511  -7.137   8.230
  556   2HG   LYS  67          2HG       LYS  67 -13.551  -8.239   6.843
  557   1HD   LYS  67          1HD       LYS  67 -11.623  -9.482   7.754
  558   2HD   LYS  67          2HD       LYS  67 -11.641  -8.430   9.186
  559   1HE   LYS  67          1HE       LYS  67 -13.952  -9.206   9.708
  560   2HE   LYS  67          2HE       LYS  67 -13.940 -10.220   8.248
  561   1HZ   LYS  67          1HZ       LYS  67 -13.340 -11.551  10.126
  562   2HZ   LYS  67          2HZ       LYS  67 -12.034 -10.539  10.476
  563    H    LEU  68           H        LEU  68 -10.383  -6.414   4.247
  564    HA   LEU  68           HA       LEU  68  -9.134  -3.852   4.731
  565   1HB   LEU  68          1HB       LEU  68  -7.994  -6.064   4.426
  566   2HB   LEU  68          2HB       LEU  68  -8.432  -6.046   2.723
  567    HG   LEU  68           HG       LEU  68  -6.083  -5.341   3.631
  568   1HD1  LEU  68          1HD1      LEU  68  -5.700  -3.826   1.689
  569   2HD1  LEU  68          2HD1      LEU  68  -6.484  -5.360   1.322
  570   3HD1  LEU  68          3HD1      LEU  68  -7.448  -3.859   1.380
  571   1HD2  LEU  68          1HD2      LEU  68  -5.671  -2.999   3.943
  572   2HD2  LEU  68          2HD2      LEU  68  -7.366  -2.589   3.706
  573   3HD2  LEU  68          3HD2      LEU  68  -6.876  -3.543   5.128
  574    H    LEU  69           H        LEU  69 -11.467  -5.085   2.366
  575    HA   LEU  69           HA       LEU  69 -10.826  -3.080   0.423
  576   1HB   LEU  69          1HB       LEU  69 -12.146  -5.530   0.395
  577   2HB   LEU  69          2HB       LEU  69 -13.514  -4.444   0.429
  578    HG   LEU  69           HG       LEU  69 -12.856  -5.264  -1.741
  579   1HD1  LEU  69          1HD1      LEU  69 -12.906  -3.092  -2.974
  580   2HD1  LEU  69          2HD1      LEU  69 -14.030  -3.103  -1.598
  581   3HD1  LEU  69          3HD1      LEU  69 -12.465  -2.271  -1.465
  582   1HD2  LEU  69          1HD2      LEU  69 -10.870  -4.643  -2.932
  583   2HD2  LEU  69          2HD2      LEU  69 -10.323  -3.577  -1.636
  584   3HD2  LEU  69          3HD2      LEU  69 -10.379  -5.335  -1.378
  585    H    GLU  70           H        GLU  70 -13.588  -3.609   2.665
  586    HA   GLU  70           HA       GLU  70 -14.902  -1.234   2.031
  587   1HB   GLU  70          1HB       GLU  70 -16.344  -1.675   3.824
  588   2HB   GLU  70          2HB       GLU  70 -15.807  -3.236   3.223
  589   1HG   GLU  70          1HG       GLU  70 -15.700  -3.529   5.519
  590   2HG   GLU  70          2HG       GLU  70 -14.025  -3.163   5.118
  591    HE2  GLU  70           HE       GLU  70 -16.223  -0.202   6.904
  592    H    ARG  71           H        ARG  71 -12.298  -1.770   4.364
  593    HA   ARG  71           HA       ARG  71 -12.086   0.553   5.834
  594   1HB   ARG  71          1HB       ARG  71 -10.437  -0.929   6.273
  595   2HB   ARG  71          2HB       ARG  71 -10.211  -1.375   4.582
  596   1HG   ARG  71          1HG       ARG  71  -8.247  -0.312   5.574
  597   2HG   ARG  71          2HG       ARG  71  -8.827   0.433   4.106
  598   1HD   ARG  71          1HD       ARG  71 -10.016   1.790   6.401
  599   2HD   ARG  71          2HD       ARG  71  -8.290   1.663   6.634
  600    HE   ARG  71           HE       ARG  71  -9.653   3.406   4.829
  601   1HH1  ARG  71          1HH1      ARG  71  -6.748   1.368   4.857
  602   2HH1  ARG  71          2HH1      ARG  71  -5.922   2.346   3.664
  603   1HH2  ARG  71          1HH2      ARG  71  -8.529   4.637   3.254
  604   2HH2  ARG  71          2HH2      ARG  71  -6.921   4.173   2.754
  605    H    ILE  72           H        ILE  72 -11.020   0.154   2.410
  606    HA   ILE  72           HA       ILE  72 -10.021   2.865   2.449
  607    HB   ILE  72           HB       ILE  72 -10.250   1.102   0.009
  608   1HG1  ILE  72          1HG1      ILE  72  -7.886   1.281   1.954
  609   2HG1  ILE  72          2HG1      ILE  72  -9.014  -0.076   1.919
  610   1HG2  ILE  72          1HG2      ILE  72  -8.358   2.495  -0.769
  611   2HG2  ILE  72          2HG2      ILE  72  -9.680   3.558  -0.275
  612   3HG2  ILE  72          3HG2      ILE  72  -8.288   3.320   0.795
  613   1HD1  ILE  72          1HD1      ILE  72  -7.122  -0.755   0.692
  614   2HD1  ILE  72          2HD1      ILE  72  -8.429  -0.486  -0.476
  615   3HD1  ILE  72          3HD1      ILE  72  -7.118   0.708  -0.303
  616    H    LYS  73           H        LYS  73 -12.685   1.388   0.498
  617    HA   LYS  73           HA       LYS  73 -13.737   3.692  -0.538
  618   1HB   LYS  73          1HB       LYS  73 -15.329   1.337   0.522
  619   2HB   LYS  73          2HB       LYS  73 -15.968   2.675  -0.427
  620   1HG   LYS  73          1HG       LYS  73 -15.637   1.026  -1.987
  621   2HG   LYS  73          2HG       LYS  73 -14.276   2.114  -2.256
  622   1HD   LYS  73          1HD       LYS  73 -13.779  -0.098  -0.324
  623   2HD   LYS  73          2HD       LYS  73 -14.206  -0.649  -1.932
  624   1HE   LYS  73          1HE       LYS  73 -12.070   1.487  -1.673
  625   2HE   LYS  73          2HE       LYS  73 -11.664  -0.198  -1.336
  626   1HZ   LYS  73          1HZ       LYS  73 -11.315   0.224  -3.638
  627   2HZ   LYS  73          2HZ       LYS  73 -12.925   0.693  -3.842
  628    H    GLN  74           H        GLN  74 -14.646   2.249   2.642
  629    HA   GLN  74           HA       GLN  74 -16.113   4.664   3.467
  630   1HB   GLN  74          1HB       GLN  74 -16.926   2.233   3.650
  631   2HB   GLN  74          2HB       GLN  74 -15.764   2.047   4.969
  632   1HG   GLN  74          1HG       GLN  74 -16.932   3.941   6.171
  633   2HG   GLN  74          2HG       GLN  74 -18.093   4.017   4.841
  634   1HE2  GLN  74          1HE2      GLN  74 -19.587   2.236   4.548
  635   2HE2  GLN  74          2HE2      GLN  74 -19.869   1.079   5.832
  636    H    GLY  75           H        GLY  75 -13.290   5.028   3.147
  637   1HA   GLY  75          1HA       GLY  75 -12.601   6.383   5.525
  638   2HA   GLY  75          2HA       GLY  75 -11.840   4.795   5.579
  639    HA   PRO  76           HA       PRO  76 -10.483   6.696   1.356
  640   1HB   PRO  76          1HB       PRO  76 -10.591   9.469   1.055
  641   2HB   PRO  76          2HB       PRO  76 -11.919   8.346   0.644
  642   1HG   PRO  76          1HG       PRO  76 -11.516   9.902   3.209
  643   2HG   PRO  76          2HG       PRO  76 -12.994   9.807   2.204
  644   1HD   PRO  76          1HD       PRO  76 -12.700   8.266   4.386
  645   2HD   PRO  76          2HD       PRO  76 -13.411   7.559   2.904
  646    HA   PRO  77           HA       PRO  77  -6.423   7.485   2.726
  647   1HB   PRO  77          1HB       PRO  77  -5.082   8.578   0.592
  648   2HB   PRO  77          2HB       PRO  77  -5.695   6.901   0.625
  649   1HG   PRO  77          1HG       PRO  77  -7.066   9.334  -0.556
  650   2HG   PRO  77          2HG       PRO  77  -6.760   7.762  -1.353
  651   1HD   PRO  77          1HD       PRO  77  -9.141   8.294  -0.219
  652   2HD   PRO  77          2HD       PRO  77  -8.412   6.683  -0.007
  653    H    ALA  78           H        ALA  78  -8.361  10.198   2.053
  654    HA   ALA  78           HA       ALA  78  -8.485  12.240   2.949
  655   1HB   ALA  78          1HB       ALA  78  -7.025  13.118   4.604
  656   2HB   ALA  78          2HB       ALA  78  -7.234  11.395   4.965
  657   3HB   ALA  78          3HB       ALA  78  -5.730  11.984   4.213
  658    H    ALA  79           H        ALA  79  -7.343  11.409   0.378
  659    HA   ALA  79           HA       ALA  79  -6.119  13.985  -0.459
  660   1HB   ALA  79          1HB       ALA  79  -4.956  12.596  -2.218
  661   2HB   ALA  79          2HB       ALA  79  -4.333  12.375  -0.578
  662   3HB   ALA  79          3HB       ALA  79  -5.399  11.149  -1.281
  663    H    GLU  80           H        GLU  80  -6.569  14.254  -2.854
  664    HA   GLU  80           HA       GLU  80  -9.403  13.872  -3.339
  665   1HB   GLU  80          1HB       GLU  80  -7.204  15.496  -4.467
  666   2HB   GLU  80          2HB       GLU  80  -8.336  14.939  -5.698
  667   1HG   GLU  80          1HG       GLU  80  -9.167  16.376  -3.155
  668   2HG   GLU  80          2HG       GLU  80  -8.939  17.133  -4.738
  669    HE2  GLU  80           HE       GLU  80 -12.392  15.377  -3.954
  670    H    VAL  81           H        VAL  81  -9.389  11.568  -3.198
  671    HA   VAL  81           HA       VAL  81  -8.429   9.956  -5.392
  672    HB   VAL  81           HB       VAL  81  -8.832   9.104  -3.135
  673   1HG1  VAL  81          1HG1      VAL  81 -11.817   9.240  -3.649
  674   2HG1  VAL  81          2HG1      VAL  81 -10.975   8.641  -2.219
  675   3HG1  VAL  81          3HG1      VAL  81 -10.942  10.369  -2.594
  676   1HG2  VAL  81          1HG2      VAL  81 -10.574   7.766  -5.260
  677   2HG2  VAL  81          2HG2      VAL  81  -8.818   7.581  -5.094
  678   3HG2  VAL  81          3HG2      VAL  81  -9.895   6.989  -3.816
  679    H    GLU  82           H        GLU  82  -9.132   9.759  -7.305
  680    HA   GLU  82           HA       GLU  82 -11.549  11.137  -8.215
  681   1HB   GLU  82          1HB       GLU  82  -9.450  11.371  -9.447
  682   2HB   GLU  82          2HB       GLU  82  -9.321   9.623  -9.652
  683   1HG   GLU  82          1HG       GLU  82 -10.149  10.637 -11.708
  684   2HG   GLU  82          2HG       GLU  82 -11.413   9.622 -11.010
  685    HE2  GLU  82           HE       GLU  82 -11.824  13.680 -10.942
  686    H    LYS  83           H        LYS  83 -10.101   7.821  -8.466
  687    HA   LYS  83           HA       LYS  83 -12.578   6.606  -7.641
  688   1HB   LYS  83          1HB       LYS  83 -13.038   5.329  -9.698
  689   2HB   LYS  83          2HB       LYS  83 -13.239   7.061  -9.955
  690   1HG   LYS  83          1HG       LYS  83 -10.922   7.115 -10.981
  691   2HG   LYS  83          2HG       LYS  83 -10.881   5.343 -10.852
  692   1HD   LYS  83          1HD       LYS  83 -12.900   5.187 -12.261
  693   2HD   LYS  83          2HD       LYS  83 -12.946   6.961 -12.391
  694   1HE   LYS  83          1HE       LYS  83 -10.675   6.925 -13.437
  695   2HE   LYS  83          2HE       LYS  83 -10.677   5.150 -13.352
  696   1HZ   LYS  83          1HZ       LYS  83 -11.436   5.854 -15.503
  697   2HZ   LYS  83          2HZ       LYS  83 -12.704   6.725 -14.810
  698    H    VAL  84           H        VAL  84 -12.092   4.692  -6.623
  699    HA   VAL  84           HA       VAL  84  -9.516   3.372  -7.269
  700    HB   VAL  84           HB       VAL  84  -9.706   3.741  -5.069
  701   1HG1  VAL  84          1HG1      VAL  84 -12.454   2.458  -5.014
  702   2HG1  VAL  84          2HG1      VAL  84 -11.478   2.907  -3.595
  703   3HG1  VAL  84          3HG1      VAL  84 -12.051   4.158  -4.693
  704   1HG2  VAL  84          1HG2      VAL  84 -10.387   0.806  -5.470
  705   2HG2  VAL  84          2HG2      VAL  84  -8.814   1.549  -5.802
  706   3HG2  VAL  84          3HG2      VAL  84  -9.455   1.532  -4.150
  707    H    ASP  85           H        ASP  85 -10.044   2.667  -9.357
  708    HA   ASP  85           HA       ASP  85 -12.350   0.876  -9.790
  709   1HB   ASP  85          1HB       ASP  85 -11.900   2.574 -11.455
  710   2HB   ASP  85          2HB       ASP  85 -10.231   2.028 -11.630
  711    HD2  ASP  85           HD       ASP  85 -11.157  -0.110 -14.166
  712    H    TYR  86           H        TYR  86 -11.453  -0.628  -8.149
  713    HA   TYR  86           HA       TYR  86  -8.924  -1.861  -8.573
  714   1HB   TYR  86          1HB       TYR  86  -9.529  -3.355  -6.774
  715   2HB   TYR  86          2HB       TYR  86 -10.029  -1.722  -6.361
  716    HD1  TYR  86           1HD      TYR  86 -11.111  -5.154  -7.129
  717    HD2  TYR  86           2HD      TYR  86 -12.460  -1.146  -6.276
  718    HE1  TYR  86           1HE      TYR  86 -13.387  -6.020  -6.652
  719    HE2  TYR  86           2HE      TYR  86 -14.734  -2.017  -5.812
  720    HH   TYR  86           HH       TYR  86 -16.093  -3.876  -5.714
  721    H    SER  87           H        SER  87  -8.595  -4.223  -8.951
  722    HA   SER  87           HA       SER  87 -10.611  -5.558 -10.629
  723   1HB   SER  87          1HB       SER  87  -7.821  -4.961 -11.665
  724   2HB   SER  87          2HB       SER  87  -9.093  -5.918 -12.465
  725    HG   SER  87           HG       SER  87 -10.366  -3.869 -12.220
  726    H    PHE  88           H        PHE  88 -10.664  -6.799  -8.729
  727    HA   PHE  88           HA       PHE  88  -8.418  -8.219  -7.751
  728   1HB   PHE  88          1HB       PHE  88  -9.940  -9.172  -6.246
  729   2HB   PHE  88          2HB       PHE  88 -10.249  -7.461  -6.377
  730    HD1  PHE  88           1HD      PHE  88 -12.059  -8.285  -9.171
  731    HD2  PHE  88           2HD      PHE  88 -12.047  -9.039  -4.917
  732    HE1  PHE  88           1HE      PHE  88 -14.444  -8.811  -9.255
  733    HE2  PHE  88           2HE      PHE  88 -14.460  -9.585  -5.023
  734    HZ   PHE  88           HZ       PHE  88 -15.663  -9.482  -7.196
  735    H    SER  89           H        SER  89  -7.687 -10.243  -8.088
  736    HA   SER  89           HA       SER  89  -9.058 -12.020 -10.055
  737   1HB   SER  89          1HB       SER  89  -6.144 -11.289 -10.186
  738   2HB   SER  89          2HB       SER  89  -7.097 -12.173 -11.384
  739    HG   SER  89           HG       SER  89  -8.368 -10.176 -11.542
  740    H    GLU  90           H        GLU  90  -7.400 -14.053 -10.303
  741    HA   GLU  90           HA       GLU  90  -7.073 -15.240  -7.653
  742   1HB   GLU  90          1HB       GLU  90  -6.525 -17.247  -8.732
  743   2HB   GLU  90          2HB       GLU  90  -7.865 -16.522  -9.607
  744   1HG   GLU  90          1HG       GLU  90  -6.434 -17.413 -11.252
  745   2HG   GLU  90          2HG       GLU  90  -6.165 -15.666 -11.321
  746    HE2  GLU  90           HE       GLU  90  -3.290 -17.924  -9.519
  747    H    TYR  91           H        TYR  91  -5.031 -16.039  -6.803
  748    HA   TYR  91           HA       TYR  91  -3.054 -14.009  -6.881
  749   1HB   TYR  91          1HB       TYR  91  -2.002 -15.220  -5.172
  750   2HB   TYR  91          2HB       TYR  91  -3.730 -15.401  -4.905
  751    HD1  TYR  91           1HD      TYR  91  -0.580 -17.114  -5.503
  752    HD2  TYR  91           2HD      TYR  91  -4.867 -17.617  -5.548
  753    HE1  TYR  91           1HE      TYR  91  -0.293 -19.557  -5.724
  754    HE2  TYR  91           2HE      TYR  91  -4.578 -20.052  -5.777
  755    HH   TYR  91           HH       TYR  91  -3.088 -21.800  -5.923
  756    H    LYS  92           H        LYS  92  -1.361 -13.737  -8.121
  757    HA   LYS  92           HA       LYS  92  -0.532 -15.667 -10.127
  758   1HB   LYS  92          1HB       LYS  92  -0.408 -13.269 -10.563
  759   2HB   LYS  92          2HB       LYS  92   0.617 -13.025  -9.141
  760   1HG   LYS  92          1HG       LYS  92   1.960 -12.950 -11.120
  761   2HG   LYS  92          2HG       LYS  92   2.420 -14.380 -10.195
  762   1HD   LYS  92          1HD       LYS  92   1.174 -15.842 -11.687
  763   2HD   LYS  92          2HD       LYS  92   0.455 -14.465 -12.540
  764   1HE   LYS  92          1HE       LYS  92   3.449 -15.075 -12.467
  765   2HE   LYS  92          2HE       LYS  92   2.347 -15.599 -13.755
  766   1HZ   LYS  92          1HZ       LYS  92   3.358 -13.547 -14.398
  767   2HZ   LYS  92          2HZ       LYS  92   2.757 -12.770 -13.025
  768    H    GLY  93           H        GLY  93   0.765 -14.281  -7.072
  769   1HA   GLY  93          1HA       GLY  93   1.913 -16.749  -6.209
  770   2HA   GLY  93          2HA       GLY  93   3.151 -15.612  -6.779
  771    H    GLU  94           H        GLU  94   3.299 -16.230  -4.202
  772    HA   GLU  94           HA       GLU  94   1.770 -14.396  -2.505
  773   1HB   GLU  94          1HB       GLU  94   2.831 -15.521  -0.654
  774   2HB   GLU  94          2HB       GLU  94   1.928 -16.597  -1.723
  775   1HG   GLU  94          1HG       GLU  94   4.089 -17.352  -2.755
  776   2HG   GLU  94          2HG       GLU  94   4.960 -16.348  -1.582
  777    HE2  GLU  94           HE       GLU  94   3.241 -19.812  -0.427
  778    H    PHE  95           H        PHE  95   2.435 -12.368  -2.508
  779    HA   PHE  95           HA       PHE  95   5.084 -11.438  -3.081
  780   1HB   PHE  95          1HB       PHE  95   2.567 -10.231  -1.919
  781   2HB   PHE  95          2HB       PHE  95   4.077  -9.357  -1.829
  782    HD1  PHE  95           1HD      PHE  95   2.340 -11.369  -4.549
  783    HD2  PHE  95           2HD      PHE  95   4.343  -7.706  -3.437
  784    HE1  PHE  95           1HE      PHE  95   2.125 -10.542  -6.861
  785    HE2  PHE  95           2HE      PHE  95   4.087  -6.875  -5.750
  786    HZ   PHE  95           HZ       PHE  95   3.012  -8.301  -7.478
  787    H    GLU  96           H        GLU  96   6.778 -10.905  -1.740
  788    HA   GLU  96           HA       GLU  96   6.875 -12.107   0.845
  789   1HB   GLU  96          1HB       GLU  96   9.168 -11.215   0.936
  790   2HB   GLU  96          2HB       GLU  96   8.802 -12.236  -0.456
  791   1HG   GLU  96          1HG       GLU  96   8.627 -10.228  -1.914
  792   2HG   GLU  96          2HG       GLU  96   9.042  -9.193  -0.542
  793    HE2  GLU  96           HE       GLU  96  12.402 -10.327  -0.417
  794    H    ASP  97           H        ASP  97   5.288 -11.113   2.120
  795    HA   ASP  97           HA       ASP  97   4.532  -9.691   3.719
  796   1HB   ASP  97          1HB       ASP  97   7.049  -8.014   3.392
  797   2HB   ASP  97          2HB       ASP  97   5.914  -8.021   4.737
  798    HD2  ASP  97           HD       ASP  97   8.767 -10.819   4.560
  799    H    PHE  98           H        PHE  98   4.547  -6.889   3.845
  800    HA   PHE  98           HA       PHE  98   3.528  -6.002   1.203
  801   1HB   PHE  98          1HB       PHE  98   1.730  -7.004   2.632
  802   2HB   PHE  98          2HB       PHE  98   1.965  -5.705   3.776
  803    HD1  PHE  98           1HD      PHE  98   2.429  -3.872   0.867
  804    HD2  PHE  98           2HD      PHE  98  -0.614  -6.199   2.843
  805    HE1  PHE  98           1HE      PHE  98   0.712  -2.750  -0.469
  806    HE2  PHE  98           2HE      PHE  98  -2.358  -4.985   1.539
  807    HZ   PHE  98           HZ       PHE  98  -1.693  -3.293  -0.122
  808    H    GLU  99           H        GLU  99   5.413  -4.770   1.038
  809    HA   GLU  99           HA       GLU  99   5.774  -2.562   3.008
  810   1HB   GLU  99          1HB       GLU  99   7.592  -4.136   2.496
  811   2HB   GLU  99          2HB       GLU  99   7.659  -3.555   0.855
  812   1HG   GLU  99          1HG       GLU  99   8.355  -1.336   1.614
  813   2HG   GLU  99          2HG       GLU  99   7.911  -1.709   3.285
  814    HE2  GLU  99           HE       GLU  99  10.814  -3.725   3.786
  815    H    THR 100           H        THR 100   6.570  -0.485   1.777
  816    HA   THR 100           HA       THR 100   4.809   0.074  -0.540
  817    HB   THR 100           HB       THR 100   4.368   2.054   0.357
  818    HG1  THR 100           1HG      THR 100   5.708   3.049   1.969
  819   1HG2  THR 100          1HG2      THR 100   3.730   1.752   2.643
  820   2HG2  THR 100          2HG2      THR 100   3.682   0.142   1.896
  821   3HG2  THR 100          3HG2      THR 100   5.031   0.593   2.948
  822    H    TYR 101           H        TYR 101   5.556   1.541  -2.252
  823    HA   TYR 101           HA       TYR 101   8.340   1.762  -2.914
  824   1HB   TYR 101          1HB       TYR 101   5.777   3.063  -3.691
  825   2HB   TYR 101          2HB       TYR 101   7.187   4.087  -3.837
  826    HD1  TYR 101           1HD      TYR 101   6.873   0.391  -4.587
  827    HD2  TYR 101           2HD      TYR 101   7.497   4.364  -6.122
  828    HE1  TYR 101           1HE      TYR 101   7.607  -0.550  -6.773
  829    HE2  TYR 101           2HE      TYR 101   8.254   3.422  -8.274
  830    HH   TYR 101           HH       TYR 101   8.690   1.507  -9.476
  Start of MODEL    8
    1   1H    GLY  -1          1H        GLY  -1 -11.218 -52.028  14.397
    2   2H    GLY  -1          2H        GLY  -1 -12.519 -53.046  14.316
    3   3H    GLY  -1          3H        GLY  -1 -11.420 -53.025  13.094
    4   1HA   GLY  -1          1HA       GLY  -1 -13.215 -50.830  13.836
    5   2HA   GLY  -1          2HA       GLY  -1 -11.996 -50.769  12.547
    6    H    SER   0           H        SER   0 -14.238 -50.164  11.504
    7    HA   SER   0           HA       SER   0 -15.033 -52.473   9.876
    8   1HB   SER   0          1HB       SER   0 -16.643 -52.605  11.735
    9   2HB   SER   0          2HB       SER   0 -17.080 -50.900  11.507
   10    HG   SER   0           HG       SER   0 -17.752 -51.458   9.394
   11    H    MET   1           H        MET   1 -13.592 -51.033   8.648
   12    HA   MET   1           HA       MET   1 -13.229 -49.762   6.879
   13   1HB   MET   1          1HB       MET   1 -16.253 -49.391   6.726
   14   2HB   MET   1          2HB       MET   1 -15.082 -48.858   5.531
   15   1HG   MET   1          1HG       MET   1 -15.925 -50.896   4.729
   16   2HG   MET   1          2HG       MET   1 -14.275 -51.196   5.261
   17   1HE   MET   1          1HE       MET   1 -17.823 -51.118   7.167
   18   2HE   MET   1          2HE       MET   1 -18.161 -52.862   7.123
   19   3HE   MET   1          3HE       MET   1 -18.028 -51.946   5.606
   20    H    LYS   2           H        LYS   2 -12.444 -47.782   6.544
   21    HA   LYS   2           HA       LYS   2 -13.355 -45.538   8.297
   22   1HB   LYS   2          1HB       LYS   2 -10.571 -46.074   7.167
   23   2HB   LYS   2          2HB       LYS   2 -11.096 -44.684   8.108
   24   1HG   LYS   2          1HG       LYS   2 -10.026 -45.940   9.700
   25   2HG   LYS   2          2HG       LYS   2 -11.726 -46.276   9.989
   26   1HD   LYS   2          1HD       LYS   2 -10.327 -48.266  10.246
   27   2HD   LYS   2          2HD       LYS   2 -11.495 -48.505   8.961
   28   1HE   LYS   2          1HE       LYS   2  -9.304 -49.430   8.374
   29   2HE   LYS   2          2HE       LYS   2  -9.735 -48.134   7.255
   30   1HZ   LYS   2          1HZ       LYS   2  -7.480 -47.849   7.969
   31   2HZ   LYS   2          2HZ       LYS   2  -7.955 -47.780   9.588
   32    H    LYS   3           H        LYS   3 -13.423 -43.454   7.283
   33    HA   LYS   3           HA       LYS   3 -12.978 -43.163   4.435
   34   1HB   LYS   3          1HB       LYS   3 -15.321 -42.704   3.854
   35   2HB   LYS   3          2HB       LYS   3 -15.098 -44.373   4.381
   36   1HG   LYS   3          1HG       LYS   3 -15.972 -43.707   6.673
   37   2HG   LYS   3          2HG       LYS   3 -16.248 -42.079   6.036
   38   1HD   LYS   3          1HD       LYS   3 -18.326 -43.194   5.975
   39   2HD   LYS   3          2HD       LYS   3 -17.774 -43.069   4.297
   40   1HE   LYS   3          1HE       LYS   3 -17.059 -45.452   4.357
   41   2HE   LYS   3          2HE       LYS   3 -17.493 -45.545   6.077
   42   1HZ   LYS   3          1HZ       LYS   3 -19.290 -46.390   4.774
   43   2HZ   LYS   3          2HZ       LYS   3 -19.410 -44.941   3.917
   44    H    TRP   4           H        TRP   4 -13.295 -40.988   3.746
   45    HA   TRP   4           HA       TRP   4 -14.287 -38.880   5.163
   46   1HB   TRP   4          1HB       TRP   4 -12.335 -37.666   6.002
   47   2HB   TRP   4          2HB       TRP   4 -12.430 -39.186   6.860
   48    HD1  TRP   4           HD       TRP   4 -10.310 -37.225   4.451
   49    HE1  TRP   4           1HE      TRP   4  -8.010 -38.358   4.099
   50    HE3  TRP   4           3HE      TRP   4 -11.141 -41.623   6.959
   51    HZ2  TRP   4           2HZ      TRP   4  -6.752 -40.826   4.754
   52    HZ3  TRP   4           3HZ      TRP   4  -9.382 -43.353   7.034
   53    HH2  TRP   4           HH       TRP   4  -7.191 -42.975   5.939
   54    H    SER   5           H        SER   5 -14.328 -37.069   3.879
   55    HA   SER   5           HA       SER   5 -12.701 -37.072   1.365
   56   1HB   SER   5          1HB       SER   5 -14.873 -38.154   0.995
   57   2HB   SER   5          2HB       SER   5 -15.707 -36.702   1.580
   58    HG   SER   5           HG       SER   5 -14.615 -35.558  -0.123
   59    H    ASP   6           H        ASP   6 -11.562 -35.448   2.921
   60    HA   ASP   6           HA       ASP   6 -12.840 -32.882   3.264
   61   1HB   ASP   6          1HB       ASP   6 -10.778 -32.220   4.285
   62   2HB   ASP   6          2HB       ASP   6 -11.271 -33.794   4.913
   63    HD2  ASP   6           HD       ASP   6  -8.611 -35.404   2.957
   64    H    THR   7           H        THR   7 -13.308 -33.112   0.785
   65    HA   THR   7           HA       THR   7 -11.083 -32.013  -0.896
   66    HB   THR   7           HB       THR   7 -12.206 -33.359  -2.700
   67    HG1  THR   7           1HG      THR   7 -13.657 -34.973  -1.964
   68   1HG2  THR   7          1HG2      THR   7 -11.319 -35.517  -2.000
   69   2HG2  THR   7          2HG2      THR   7 -10.216 -34.230  -1.476
   70   3HG2  THR   7          3HG2      THR   7 -11.297 -35.013  -0.301
   71    H    GLU   8           H        GLU   8 -12.169 -29.943   0.105
   72    HA   GLU   8           HA       GLU   8 -14.005 -28.885  -1.924
   73   1HB   GLU   8          1HB       GLU   8 -15.382 -30.061  -0.118
   74   2HB   GLU   8          2HB       GLU   8 -14.772 -28.855   1.025
   75   1HG   GLU   8          1HG       GLU   8 -15.824 -27.066  -0.400
   76   2HG   GLU   8          2HG       GLU   8 -16.377 -28.317  -1.523
   77    HE2  GLU   8           HE       GLU   8 -18.102 -28.066   2.162
   78    H    VAL   9           H        VAL   9 -13.854 -26.693  -2.117
   79    HA   VAL   9           HA       VAL   9 -12.948 -24.682  -2.154
   80    HB   VAL   9           HB       VAL   9 -12.258 -24.974   0.793
   81   1HG1  VAL   9          1HG1      VAL   9 -12.677 -22.532  -0.990
   82   2HG1  VAL   9          2HG1      VAL   9 -12.373 -22.510   0.757
   83   3HG1  VAL   9          3HG1      VAL   9 -11.118 -23.082  -0.344
   84   1HG2  VAL   9          1HG2      VAL   9 -14.802 -23.993  -0.577
   85   2HG2  VAL   9          2HG2      VAL   9 -14.645 -25.359   0.551
   86   3HG2  VAL   9          3HG2      VAL   9 -14.400 -23.712   1.129
   87    H    PHE  10           H        PHE  10 -11.261 -24.629  -3.495
   88    HA   PHE  10           HA       PHE  10  -8.530 -25.361  -2.504
   89   1HB   PHE  10          1HB       PHE  10  -7.866 -25.379  -4.838
   90   2HB   PHE  10          2HB       PHE  10  -9.119 -26.562  -4.498
   91    HD1  PHE  10           1HD      PHE  10  -8.322 -23.397  -6.252
   92    HD2  PHE  10           2HD      PHE  10 -11.369 -26.350  -5.472
   93    HE1  PHE  10           1HE      PHE  10  -9.649 -22.541  -8.165
   94    HE2  PHE  10           2HE      PHE  10 -12.685 -25.492  -7.383
   95    HZ   PHE  10           HZ       PHE  10 -11.816 -23.606  -8.751
   96    H    GLU  11           H        GLU  11 -10.617 -22.814  -3.723
   97    HA   GLU  11           HA       GLU  11  -8.526 -20.843  -4.110
   98   1HB   GLU  11          1HB       GLU  11 -10.457 -19.292  -4.415
   99   2HB   GLU  11          2HB       GLU  11 -10.355 -20.637  -5.547
  100   1HG   GLU  11          1HG       GLU  11 -12.129 -20.911  -3.101
  101   2HG   GLU  11          2HG       GLU  11 -12.655 -19.958  -4.491
  102    HE2  GLU  11           HE       GLU  11 -13.113 -22.686  -6.616
  103    H    MET  12           H        MET  12  -7.585 -21.268  -1.954
  104    HA   MET  12           HA       MET  12  -8.808 -20.445   0.474
  105   1HB   MET  12          1HB       MET  12  -5.902 -20.613  -0.419
  106   2HB   MET  12          2HB       MET  12  -6.390 -20.214   1.235
  107   1HG   MET  12          1HG       MET  12  -7.654 -22.328   1.387
  108   2HG   MET  12          2HG       MET  12  -7.114 -22.779  -0.234
  109   1HE   MET  12          1HE       MET  12  -4.722 -23.279  -0.912
  110   2HE   MET  12          2HE       MET  12  -3.354 -23.510   0.201
  111   3HE   MET  12          3HE       MET  12  -3.924 -21.870  -0.171
  112    H    LEU  13           H        LEU  13  -6.201 -18.650  -1.269
  113    HA   LEU  13           HA       LEU  13  -7.574 -16.105  -0.636
  114   1HB   LEU  13          1HB       LEU  13  -5.636 -15.158   0.367
  115   2HB   LEU  13          2HB       LEU  13  -6.084 -16.633   1.213
  116    HG   LEU  13           HG       LEU  13  -4.206 -17.624  -0.544
  117   1HD1  LEU  13          1HD1      LEU  13  -2.314 -16.030  -0.573
  118   2HD1  LEU  13          2HD1      LEU  13  -3.696 -15.326  -1.432
  119   3HD1  LEU  13          3HD1      LEU  13  -3.312 -14.795   0.216
  120   1HD2  LEU  13          1HD2      LEU  13  -2.637 -17.484   1.388
  121   2HD2  LEU  13          2HD2      LEU  13  -3.753 -16.354   2.189
  122   3HD2  LEU  13          3HD2      LEU  13  -4.257 -18.027   1.858
  123    H    LYS  14           H        LYS  14  -7.165 -14.441  -1.933
  124    HA   LYS  14           HA       LYS  14  -5.864 -15.109  -4.531
  125   1HB   LYS  14          1HB       LYS  14  -7.605 -14.456  -5.695
  126   2HB   LYS  14          2HB       LYS  14  -8.399 -15.162  -4.315
  127   1HG   LYS  14          1HG       LYS  14  -7.974 -12.212  -4.946
  128   2HG   LYS  14          2HG       LYS  14  -9.491 -13.091  -5.014
  129   1HD   LYS  14          1HD       LYS  14  -7.937 -12.672  -2.439
  130   2HD   LYS  14          2HD       LYS  14  -9.077 -11.511  -3.070
  131   1HE   LYS  14          1HE       LYS  14 -10.194 -12.792  -1.388
  132   2HE   LYS  14          2HE       LYS  14 -10.899 -13.213  -2.958
  133   1HZ   LYS  14          1HZ       LYS  14 -10.498 -15.196  -1.704
  134   2HZ   LYS  14          2HZ       LYS  14  -8.859 -14.825  -1.566
  135    H    ARG  15           H        ARG  15  -5.222 -13.175  -5.908
  136    HA   ARG  15           HA       ARG  15  -4.065 -11.043  -4.237
  137   1HB   ARG  15          1HB       ARG  15  -2.863 -10.266  -6.068
  138   2HB   ARG  15          2HB       ARG  15  -2.670 -12.014  -5.949
  139   1HG   ARG  15          1HG       ARG  15  -4.482 -12.178  -7.749
  140   2HG   ARG  15          2HG       ARG  15  -4.349 -10.429  -7.954
  141   1HD   ARG  15          1HD       ARG  15  -1.896 -12.203  -8.168
  142   2HD   ARG  15          2HD       ARG  15  -2.950 -11.926  -9.547
  143    HE   ARG  15           HE       ARG  15  -1.072 -10.069  -8.323
  144   1HH1  ARG  15          2HH1      ARG  15  -4.028 -10.266 -10.284
  145   2HH1  ARG  15          1HH1      ARG  15  -3.729  -8.768 -11.121
  146   1HH2  ARG  15          1HH2      ARG  15  -0.685  -8.106  -9.437
  147   2HH2  ARG  15          2HH2      ARG  15  -1.821  -7.529 -10.630
  148    H    MET  16           H        MET  16  -5.267  -9.307  -3.715
  149    HA   MET  16           HA       MET  16  -7.465  -8.438  -5.493
  150   1HB   MET  16          1HB       MET  16  -7.857  -6.804  -3.827
  151   2HB   MET  16          2HB       MET  16  -8.121  -8.478  -3.327
  152   1HG   MET  16          1HG       MET  16  -6.328  -8.456  -1.819
  153   2HG   MET  16          2HG       MET  16  -5.546  -7.101  -2.623
  154   1HE   MET  16          1HE       MET  16  -6.142  -4.735  -2.662
  155   2HE   MET  16          2HE       MET  16  -7.110  -3.934  -1.409
  156   3HE   MET  16          3HE       MET  16  -7.904  -4.734  -2.784
  157    H    TYR  17           H        TYR  17  -6.400  -7.717  -7.259
  158    HA   TYR  17           HA       TYR  17  -4.223  -5.727  -7.158
  159   1HB   TYR  17          1HB       TYR  17  -4.020  -7.173  -8.966
  160   2HB   TYR  17          2HB       TYR  17  -5.743  -7.204  -9.298
  161    HD1  TYR  17           1HD      TYR  17  -6.352  -6.224 -11.314
  162    HD2  TYR  17           2HD      TYR  17  -3.045  -4.544  -9.111
  163    HE1  TYR  17           1HE      TYR  17  -6.054  -4.495 -13.066
  164    HE2  TYR  17           2HE      TYR  17  -2.673  -2.908 -10.929
  165    HH   TYR  17           HH       TYR  17  -3.359  -2.144 -12.997
  166    H    ALA  18           H        ALA  18  -4.653  -3.541  -7.027
  167    HA   ALA  18           HA       ALA  18  -7.281  -2.573  -7.853
  168   1HB   ALA  18          1HB       ALA  18  -7.689  -1.444  -5.679
  169   2HB   ALA  18          2HB       ALA  18  -7.636  -3.211  -5.484
  170   3HB   ALA  18          3HB       ALA  18  -6.240  -2.220  -5.005
  171    H    ARG  19           H        ARG  19  -7.186  -0.760  -8.832
  172    HA   ARG  19           HA       ARG  19  -4.611   0.665  -8.926
  173   1HB   ARG  19          1HB       ARG  19  -7.022   0.388 -10.730
  174   2HB   ARG  19          2HB       ARG  19  -5.843   1.673 -10.992
  175   1HG   ARG  19          1HG       ARG  19  -5.007  -1.204 -10.691
  176   2HG   ARG  19          2HG       ARG  19  -5.448  -0.512 -12.259
  177   1HD   ARG  19          1HD       ARG  19  -3.390   0.958 -10.563
  178   2HD   ARG  19          2HD       ARG  19  -2.954  -0.515 -11.399
  179    HE   ARG  19           HE       ARG  19  -4.375   1.429 -13.062
  180   1HH1  ARG  19          1HH1      ARG  19  -1.178   0.735 -11.689
  181   2HH1  ARG  19          2HH1      ARG  19  -0.327   1.721 -12.850
  182   1HH2  ARG  19          1HH2      ARG  19  -3.259   2.685 -14.587
  183   2HH2  ARG  19          2HH2      ARG  19  -1.521   2.830 -14.519
  184    H    VAL  20           H        VAL  20  -4.620   2.053  -7.157
  185    HA   VAL  20           HA       VAL  20  -7.035   3.589  -6.488
  186    HB   VAL  20           HB       VAL  20  -4.356   3.480  -5.096
  187   1HG1  VAL  20          1HG1      VAL  20  -7.102   4.534  -4.253
  188   2HG1  VAL  20          2HG1      VAL  20  -5.684   4.425  -3.199
  189   3HG1  VAL  20          3HG1      VAL  20  -5.670   5.523  -4.584
  190   1HG2  VAL  20          1HG2      VAL  20  -6.922   1.998  -4.445
  191   2HG2  VAL  20          2HG2      VAL  20  -5.443   1.253  -5.093
  192   3HG2  VAL  20          3HG2      VAL  20  -5.431   1.997  -3.491
  193    H    TYR  21           H        TYR  21  -7.377   5.260  -7.861
  194    HA   TYR  21           HA       TYR  21  -5.091   6.956  -8.749
  195   1HB   TYR  21          1HB       TYR  21  -7.978   6.902  -9.675
  196   2HB   TYR  21          2HB       TYR  21  -6.691   7.843 -10.360
  197    HD1  TYR  21           1HD      TYR  21  -4.755   5.117  -9.923
  198    HD2  TYR  21           2HD      TYR  21  -8.390   6.124 -12.023
  199    HE1  TYR  21           1HE      TYR  21  -4.227   3.460 -11.606
  200    HE2  TYR  21           2HE      TYR  21  -7.977   4.256 -13.584
  201    HH   TYR  21           HH       TYR  21  -6.421   2.712 -14.347
  202    H    GLY  22           H        GLY  22  -4.938   9.100  -8.309
  203   1HA   GLY  22          1HA       GLY  22  -6.810  10.961  -7.919
  204   2HA   GLY  22          2HA       GLY  22  -6.688  10.277  -6.281
  205    H    LEU  23           H        LEU  23  -6.151  12.555  -5.879
  206    HA   LEU  23           HA       LEU  23  -3.351  13.279  -6.310
  207   1HB   LEU  23          1HB       LEU  23  -5.339  14.861  -6.176
  208   2HB   LEU  23          2HB       LEU  23  -5.356  14.550  -4.439
  209    HG   LEU  23           HG       LEU  23  -2.825  15.347  -4.551
  210   1HD1  LEU  23          1HD1      LEU  23  -2.366  16.925  -6.380
  211   2HD1  LEU  23          2HD1      LEU  23  -2.605  15.294  -7.021
  212   3HD1  LEU  23          3HD1      LEU  23  -3.901  16.499  -7.159
  213   1HD2  LEU  23          1HD2      LEU  23  -3.533  17.695  -4.360
  214   2HD2  LEU  23          2HD2      LEU  23  -5.125  17.279  -5.036
  215   3HD2  LEU  23          3HD2      LEU  23  -4.619  16.617  -3.464
  216    H    VAL  24           H        VAL  24  -4.276  10.723  -4.900
  217    HA   VAL  24           HA       VAL  24  -3.491  10.915  -2.138
  218    HB   VAL  24           HB       VAL  24  -3.673   8.499  -2.164
  219   1HG1  VAL  24          1HG1      VAL  24  -5.916   9.712  -3.836
  220   2HG1  VAL  24          2HG1      VAL  24  -5.997   8.252  -2.836
  221   3HG1  VAL  24          3HG1      VAL  24  -5.769   9.834  -2.074
  222   1HG2  VAL  24          1HG2      VAL  24  -4.079   8.667  -5.189
  223   2HG2  VAL  24          2HG2      VAL  24  -2.615   8.066  -4.387
  224   3HG2  VAL  24          3HG2      VAL  24  -4.151   7.219  -4.171
  225    H    GLN  25           H        GLN  25  -1.609  11.216  -4.874
  226    HA   GLN  25           HA       GLN  25   0.625   9.528  -4.172
  227   1HB   GLN  25          1HB       GLN  25  -0.433  10.623  -6.486
  228   2HB   GLN  25          2HB       GLN  25   0.956  11.658  -6.207
  229   1HG   GLN  25          1HG       GLN  25   1.742   9.880  -7.523
  230   2HG   GLN  25          2HG       GLN  25   2.314   9.476  -5.904
  231   1HE2  GLN  25          1HE2      GLN  25   2.096   7.518  -7.959
  232   2HE2  GLN  25          2HE2      GLN  25   0.796   6.422  -7.582
  233    H    GLY  26           H        GLY  26  -0.027  11.422  -2.125
  234   1HA   GLY  26          1HA       GLY  26   2.399  12.312  -1.174
  235   2HA   GLY  26          2HA       GLY  26   1.813  13.653  -2.184
  236    H    VAL  27           H        VAL  27   0.341  11.326   0.145
  237    HA   VAL  27           HA       VAL  27  -0.287  13.378   2.042
  238    HB   VAL  27           HB       VAL  27  -2.117  13.355   0.052
  239   1HG1  VAL  27          1HG1      VAL  27  -3.324  11.303   1.962
  240   2HG1  VAL  27          2HG1      VAL  27  -4.151  12.167   0.723
  241   3HG1  VAL  27          3HG1      VAL  27  -2.858  11.049   0.264
  242   1HG2  VAL  27          1HG2      VAL  27  -2.825  13.761   2.962
  243   2HG2  VAL  27          2HG2      VAL  27  -2.027  14.931   1.891
  244   3HG2  VAL  27          3HG2      VAL  27  -3.672  14.403   1.542
  245    H    GLY  28           H        GLY  28  -1.987  12.131   3.707
  246   1HA   GLY  28          1HA       GLY  28  -0.641   9.756   4.669
  247   2HA   GLY  28          2HA       GLY  28  -2.136  10.477   5.277
  248    H    PHE  29           H        PHE  29  -0.935   8.794   2.366
  249    HA   PHE  29           HA       PHE  29  -3.007   6.731   2.614
  250   1HB   PHE  29          1HB       PHE  29  -3.745   8.291   0.781
  251   2HB   PHE  29          2HB       PHE  29  -2.195   8.053  -0.010
  252    HD1  PHE  29           1HD      PHE  29  -5.093   6.037   1.361
  253    HD2  PHE  29           2HD      PHE  29  -2.013   6.336  -1.644
  254    HE1  PHE  29           1HE      PHE  29  -5.699   3.793   0.514
  255    HE2  PHE  29           2HE      PHE  29  -2.576   4.055  -2.431
  256    HZ   PHE  29           HZ       PHE  29  -4.399   2.772  -1.339
  257    H    ARG  30           H        ARG  30  -2.229   4.820   1.196
  258    HA   ARG  30           HA       ARG  30  -0.743   3.363   0.453
  259   1HB   ARG  30          1HB       ARG  30   0.409   5.459  -0.520
  260   2HB   ARG  30          2HB       ARG  30   1.628   5.215   0.752
  261   1HG   ARG  30          1HG       ARG  30   2.012   2.920  -0.085
  262   2HG   ARG  30          2HG       ARG  30   0.672   3.120  -1.232
  263   1HD   ARG  30          1HD       ARG  30   2.658   3.351  -2.465
  264   2HD   ARG  30          2HD       ARG  30   1.900   4.942  -2.389
  265    HE   ARG  30           HE       ARG  30   4.457   4.046  -1.238
  266   1HH1  ARG  30          1HH1      ARG  30   2.072   6.701  -1.301
  267   2HH1  ARG  30          2HH1      ARG  30   3.227   7.876  -0.729
  268   1HH2  ARG  30          1HH2      ARG  30   5.895   5.555  -0.566
  269   2HH2  ARG  30          2HH2      ARG  30   5.437   7.228  -0.292
  270    H    LYS  31           H        LYS  31   1.169   5.210   2.889
  271    HA   LYS  31           HA       LYS  31   1.803   3.245   4.643
  272   1HB   LYS  31          1HB       LYS  31   2.013   5.929   4.623
  273   2HB   LYS  31          2HB       LYS  31   0.773   5.772   5.861
  274   1HG   LYS  31          1HG       LYS  31   3.555   4.517   5.816
  275   2HG   LYS  31          2HG       LYS  31   2.992   5.851   6.836
  276   1HD   LYS  31          1HD       LYS  31   1.393   4.302   7.963
  277   2HD   LYS  31          2HD       LYS  31   2.039   2.961   6.987
  278   1HE   LYS  31          1HE       LYS  31   4.294   3.334   7.919
  279   2HE   LYS  31          2HE       LYS  31   3.671   4.667   8.912
  280   1HZ   LYS  31          1HZ       LYS  31   3.706   2.647  10.191
  281   2HZ   LYS  31          2HZ       LYS  31   2.668   1.898   9.090
  282    H    PHE  32           H        PHE  32  -1.330   5.105   4.441
  283    HA   PHE  32           HA       PHE  32  -2.761   4.069   6.535
  284   1HB   PHE  32          1HB       PHE  32  -3.441   5.848   4.971
  285   2HB   PHE  32          2HB       PHE  32  -3.843   4.636   3.758
  286    HD1  PHE  32           1HD      PHE  32  -5.899   6.307   3.989
  287    HD2  PHE  32           2HD      PHE  32  -4.938   3.254   6.900
  288    HE1  PHE  32           1HE      PHE  32  -8.114   6.567   5.042
  289    HE2  PHE  32           2HE      PHE  32  -7.165   3.431   7.841
  290    HZ   PHE  32           HZ       PHE  32  -8.778   5.132   6.957
  291    H    VAL  33           H        VAL  33  -2.685   2.682   3.182
  292    HA   VAL  33           HA       VAL  33  -4.189   0.350   3.967
  293    HB   VAL  33           HB       VAL  33  -4.459   1.138   1.764
  294   1HG1  VAL  33          1HG1      VAL  33  -1.497   0.675   1.278
  295   2HG1  VAL  33          2HG1      VAL  33  -2.702   1.031   0.026
  296   3HG1  VAL  33          3HG1      VAL  33  -2.384   2.225   1.283
  297   1HG2  VAL  33          1HG2      VAL  33  -2.910  -1.467   1.519
  298   2HG2  VAL  33          2HG2      VAL  33  -4.548  -1.335   2.185
  299   3HG2  VAL  33          3HG2      VAL  33  -4.233  -0.879   0.499
  300    H    GLN  34           H        GLN  34  -0.867   1.168   4.362
  301    HA   GLN  34           HA       GLN  34   0.152  -1.532   4.608
  302   1HB   GLN  34          1HB       GLN  34   1.529   0.761   4.608
  303   2HB   GLN  34          2HB       GLN  34   1.056   0.823   6.309
  304   1HG   GLN  34          1HG       GLN  34   3.160  -0.023   6.369
  305   2HG   GLN  34          2HG       GLN  34   2.078  -1.363   6.747
  306   1HE2  GLN  34          1HE2      GLN  34   1.794  -0.891   3.414
  307   2HE2  GLN  34          2HE2      GLN  34   3.008  -2.051   2.917
  308    H    ILE  35           H        ILE  35  -0.984   0.810   7.104
  309    HA   ILE  35           HA       ILE  35  -1.094  -0.841   9.265
  310    HB   ILE  35           HB       ILE  35  -3.302   1.126   8.523
  311   1HG1  ILE  35          1HG1      ILE  35  -1.234   2.345   8.422
  312   2HG1  ILE  35          2HG1      ILE  35  -2.106   2.777   9.882
  313   1HG2  ILE  35          1HG2      ILE  35  -3.552   1.336  11.011
  314   2HG2  ILE  35          2HG2      ILE  35  -4.067  -0.212  10.342
  315   3HG2  ILE  35          3HG2      ILE  35  -2.510  -0.093  11.182
  316   1HD1  ILE  35          1HD1      ILE  35   0.242   2.557  10.387
  317   2HD1  ILE  35          2HD1      ILE  35  -0.622   1.239  11.197
  318   3HD1  ILE  35          3HD1      ILE  35   0.302   0.923   9.706
  319    H    HIS  36           H        HIS  36  -3.834  -0.591   6.932
  320    HA   HIS  36           HA       HIS  36  -5.352  -2.579   8.372
  321   1HB   HIS  36          1HB       HIS  36  -5.680  -1.188   5.712
  322   2HB   HIS  36          2HB       HIS  36  -6.683  -2.580   6.147
  323    HD2  HIS  36           2HD      HIS  36  -5.763   0.723   8.235
  324    HE1  HIS  36           1HE      HIS  36  -9.836  -0.300   8.752
  325    HE2  HIS  36           2HE      HIS  36  -8.009   1.366   9.396
  326    H    ALA  37           H        ALA  37  -3.415  -2.763   5.318
  327    HA   ALA  37           HA       ALA  37  -3.666  -5.399   4.751
  328   1HB   ALA  37          1HB       ALA  37  -1.347  -5.300   3.852
  329   2HB   ALA  37          2HB       ALA  37  -2.367  -3.932   3.391
  330   3HB   ALA  37          3HB       ALA  37  -1.132  -3.745   4.650
  331    H    ILE  38           H        ILE  38  -0.895  -4.205   6.656
  332    HA   ILE  38           HA       ILE  38   0.110  -6.484   7.722
  333    HB   ILE  38           HB       ILE  38   0.147  -3.601   8.476
  334   1HG1  ILE  38          1HG1      ILE  38   2.564  -3.954   8.148
  335   2HG1  ILE  38          2HG1      ILE  38   2.320  -5.698   7.990
  336   1HG2  ILE  38          1HG2      ILE  38   1.656  -3.958  10.347
  337   2HG2  ILE  38          2HG2      ILE  38  -0.003  -4.426  10.697
  338   3HG2  ILE  38          3HG2      ILE  38   1.223  -5.683  10.372
  339   1HD1  ILE  38          1HD1      ILE  38   2.697  -4.610   5.829
  340   2HD1  ILE  38          2HD1      ILE  38   1.095  -5.348   5.870
  341   3HD1  ILE  38          3HD1      ILE  38   1.270  -3.590   6.056
  342    H    ARG  39           H        ARG  39  -2.595  -4.557   9.159
  343    HA   ARG  39           HA       ARG  39  -2.749  -6.137  11.559
  344   1HB   ARG  39          1HB       ARG  39  -3.498  -3.731  11.175
  345   2HB   ARG  39          2HB       ARG  39  -4.876  -4.340  10.246
  346   1HG   ARG  39          1HG       ARG  39  -4.249  -5.202  13.090
  347   2HG   ARG  39          2HG       ARG  39  -5.084  -3.678  12.731
  348   1HD   ARG  39          1HD       ARG  39  -6.897  -4.877  11.586
  349   2HD   ARG  39          2HD       ARG  39  -6.115  -6.430  11.943
  350    HE   ARG  39           HE       ARG  39  -6.458  -4.947  14.351
  351   1HH1  ARG  39          1HH1      ARG  39  -8.353  -6.786  11.981
  352   2HH1  ARG  39          2HH1      ARG  39  -9.528  -7.328  13.151
  353   1HH2  ARG  39          1HH2      ARG  39  -8.011  -5.655  15.875
  354   2HH2  ARG  39          2HH2      ARG  39  -9.339  -6.668  15.373
  355    H    LEU  40           H        LEU  40  -4.420  -6.278   8.419
  356    HA   LEU  40           HA       LEU  40  -5.975  -8.618   9.315
  357   1HB   LEU  40          1HB       LEU  40  -5.940  -7.102   6.708
  358   2HB   LEU  40          2HB       LEU  40  -7.099  -8.357   7.168
  359    HG   LEU  40           HG       LEU  40  -6.734  -5.728   8.704
  360   1HD1  LEU  40          1HD1      LEU  40  -8.869  -5.102   7.655
  361   2HD1  LEU  40          2HD1      LEU  40  -7.545  -5.293   6.489
  362   3HD1  LEU  40          3HD1      LEU  40  -8.782  -6.568   6.639
  363   1HD2  LEU  40          1HD2      LEU  40  -8.894  -6.327   9.732
  364   2HD2  LEU  40          2HD2      LEU  40  -8.851  -7.906   8.918
  365   3HD2  LEU  40          3HD2      LEU  40  -7.637  -7.490  10.149
  366    H    GLY  41           H        GLY  41  -2.859  -8.582   8.724
  367   1HA   GLY  41          1HA       GLY  41  -1.360 -10.148   8.076
  368   2HA   GLY  41          2HA       GLY  41  -2.695 -11.307   8.146
  369    H    ILE  42           H        ILE  42  -1.702  -8.583   6.016
  370    HA   ILE  42           HA       ILE  42  -2.396 -10.192   3.605
  371    HB   ILE  42           HB       ILE  42  -2.372  -7.244   4.202
  372   1HG1  ILE  42          1HG1      ILE  42  -4.281  -8.382   5.203
  373   2HG1  ILE  42          2HG1      ILE  42  -4.777  -7.290   3.912
  374   1HG2  ILE  42          1HG2      ILE  42  -3.480  -6.899   1.998
  375   2HG2  ILE  42          2HG2      ILE  42  -1.761  -7.270   1.959
  376   3HG2  ILE  42          3HG2      ILE  42  -2.949  -8.529   1.551
  377   1HD1  ILE  42          1HD1      ILE  42  -6.074  -9.321   3.813
  378   2HD1  ILE  42          2HD1      ILE  42  -5.039  -9.218   2.379
  379   3HD1  ILE  42          3HD1      ILE  42  -4.617 -10.318   3.720
  380    H    LYS  43           H        LYS  43  -1.029 -10.394   1.997
  381    HA   LYS  43           HA       LYS  43   1.747  -9.280   2.173
  382   1HB   LYS  43          1HB       LYS  43   0.676 -11.587   0.511
  383   2HB   LYS  43          2HB       LYS  43   2.344 -11.030   0.587
  384   1HG   LYS  43          1HG       LYS  43   2.426 -11.535   3.007
  385   2HG   LYS  43          2HG       LYS  43   0.794 -12.220   2.929
  386   1HD   LYS  43          1HD       LYS  43   1.477 -13.912   1.347
  387   2HD   LYS  43          2HD       LYS  43   3.095 -13.208   1.191
  388   1HE   LYS  43          1HE       LYS  43   1.987 -14.305   3.814
  389   2HE   LYS  43          2HE       LYS  43   2.950 -15.260   2.670
  390   1HZ   LYS  43          1HZ       LYS  43   3.864 -12.830   4.070
  391   2HZ   LYS  43          2HZ       LYS  43   4.763 -13.741   2.968
  392    H    GLY  44           H        GLY  44   2.581  -8.863  -0.218
  393   1HA   GLY  44          1HA       GLY  44   1.502  -8.480  -2.547
  394   2HA   GLY  44          2HA       GLY  44   0.452  -7.379  -1.695
  395    H    TYR  45           H        TYR  45   1.060  -5.424  -2.564
  396    HA   TYR  45           HA       TYR  45   3.322  -4.233  -1.400
  397   1HB   TYR  45          1HB       TYR  45   4.264  -5.659  -3.479
  398   2HB   TYR  45          2HB       TYR  45   3.638  -4.305  -4.392
  399    HD1  TYR  45           1HD      TYR  45   4.680  -2.085  -4.197
  400    HD2  TYR  45           2HD      TYR  45   6.162  -5.459  -1.962
  401    HE1  TYR  45           1HE      TYR  45   6.607  -0.763  -3.490
  402    HE2  TYR  45           2HE      TYR  45   8.200  -4.170  -1.377
  403    HH   TYR  45           HH       TYR  45   9.214  -2.106  -1.389
  404    H    ALA  46           H        ALA  46   3.287  -1.979  -1.624
  405    HA   ALA  46           HA       ALA  46   0.984  -0.750  -3.055
  406   1HB   ALA  46          1HB       ALA  46   1.118   0.990  -1.497
  407   2HB   ALA  46          2HB       ALA  46   1.081  -0.545  -0.623
  408   3HB   ALA  46          3HB       ALA  46   2.581   0.360  -0.749
  409    H    LYS  47           H        LYS  47   2.054  -0.584  -5.136
  410    HA   LYS  47           HA       LYS  47   4.751   0.595  -5.292
  411   1HB   LYS  47          1HB       LYS  47   4.435  -1.415  -6.479
  412   2HB   LYS  47          2HB       LYS  47   2.904  -0.867  -7.148
  413   1HG   LYS  47          1HG       LYS  47   4.038   0.766  -8.588
  414   2HG   LYS  47          2HG       LYS  47   5.598   0.274  -7.926
  415   1HD   LYS  47          1HD       LYS  47   3.695  -1.602  -9.385
  416   2HD   LYS  47          2HD       LYS  47   5.000  -0.698 -10.171
  417   1HE   LYS  47          1HE       LYS  47   6.679  -1.806  -8.725
  418   2HE   LYS  47          2HE       LYS  47   5.392  -2.754  -7.949
  419   1HZ   LYS  47          1HZ       LYS  47   6.339  -4.043  -9.688
  420   2HZ   LYS  47          2HZ       LYS  47   5.986  -2.853 -10.832
  421    H    ASN  48           H        ASN  48   4.745   2.745  -5.264
  422    HA   ASN  48           HA       ASN  48   2.552   4.368  -6.321
  423   1HB   ASN  48          1HB       ASN  48   3.590   4.739  -4.111
  424   2HB   ASN  48          2HB       ASN  48   5.130   5.114  -4.869
  425   1HD2  ASN  48          2HD2      ASN  48   5.028   6.972  -6.537
  426   2HD2  ASN  48          1HD2      ASN  48   4.045   8.353  -6.083
  427    H    LEU  49           H        LEU  49   2.739   4.146  -8.616
  428    HA   LEU  49           HA       LEU  49   5.172   4.862 -10.031
  429   1HB   LEU  49          1HB       LEU  49   2.324   4.703 -11.071
  430   2HB   LEU  49          2HB       LEU  49   3.833   4.730 -11.974
  431    HG   LEU  49           HG       LEU  49   4.243   2.517 -10.387
  432   1HD1  LEU  49          1HD1      LEU  49   2.161   1.193 -10.392
  433   2HD1  LEU  49          2HD1      LEU  49   1.890   2.661  -9.458
  434   3HD1  LEU  49          3HD1      LEU  49   1.267   2.545 -11.108
  435   1HD2  LEU  49          1HD2      LEU  49   3.645   1.183 -12.374
  436   2HD2  LEU  49          2HD2      LEU  49   2.795   2.581 -13.068
  437   3HD2  LEU  49          3HD2      LEU  49   4.556   2.633 -12.832
  438    HA   PRO  50           HA       PRO  50   3.988   8.906  -8.545
  439   1HB   PRO  50          1HB       PRO  50   6.133  10.431  -9.228
  440   2HB   PRO  50          2HB       PRO  50   6.239   9.069  -8.084
  441   1HG   PRO  50          1HG       PRO  50   6.857   8.979 -11.053
  442   2HG   PRO  50          2HG       PRO  50   7.917   8.471  -9.701
  443   1HD   PRO  50          1HD       PRO  50   6.353   6.667 -11.008
  444   2HD   PRO  50          2HD       PRO  50   6.562   6.581  -9.234
  445    H    ASP  51           H        ASP  51   2.172   8.719 -10.158
  446    HA   ASP  51           HA       ASP  51   1.873  11.218 -11.553
  447   1HB   ASP  51          1HB       ASP  51   3.095   9.931 -13.306
  448   2HB   ASP  51          2HB       ASP  51   1.911   8.626 -13.172
  449    HD2  ASP  51           HD       ASP  51   0.361  10.148 -15.877
  450    H    GLY  52           H        GLY  52   0.585  10.537  -9.392
  451   1HA   GLY  52          1HA       GLY  52  -1.540  10.577  -8.581
  452   2HA   GLY  52          2HA       GLY  52  -2.170  10.359 -10.213
  453    H    SER  53           H        SER  53  -0.878   7.869 -10.795
  454    HA   SER  53           HA       SER  53  -2.867   6.135  -9.568
  455   1HB   SER  53          1HB       SER  53  -2.142   4.625 -11.440
  456   2HB   SER  53          2HB       SER  53  -2.803   6.196 -11.939
  457    HG   SER  53           HG       SER  53  -0.678   6.925 -12.257
  458    H    VAL  54           H        VAL  54  -2.124   5.598  -7.540
  459    HA   VAL  54           HA       VAL  54   0.437   4.108  -7.331
  460    HB   VAL  54           HB       VAL  54   0.280   5.518  -5.529
  461   1HG1  VAL  54          1HG1      VAL  54  -2.527   4.598  -4.860
  462   2HG1  VAL  54          2HG1      VAL  54  -1.548   5.803  -4.010
  463   3HG1  VAL  54          3HG1      VAL  54  -2.143   6.146  -5.636
  464   1HG2  VAL  54          1HG2      VAL  54  -0.767   2.844  -4.508
  465   2HG2  VAL  54          2HG2      VAL  54   0.916   3.197  -4.948
  466   3HG2  VAL  54          3HG2      VAL  54   0.144   4.054  -3.601
  467    H    GLU  55           H        GLU  55   0.457   2.041  -7.726
  468    HA   GLU  55           HA       GLU  55  -2.052   0.555  -8.091
  469   1HB   GLU  55          1HB       GLU  55  -0.331   0.628  -9.821
  470   2HB   GLU  55          2HB       GLU  55   0.863  -0.082  -8.740
  471   1HG   GLU  55          1HG       GLU  55  -1.642  -1.683  -8.967
  472   2HG   GLU  55          2HG       GLU  55  -0.827  -1.417 -10.512
  473    HE2  GLU  55           HE       GLU  55   1.493  -3.286  -7.766
  474    H    VAL  56           H        VAL  56  -2.785  -0.806  -6.578
  475    HA   VAL  56           HA       VAL  56  -0.995  -1.813  -4.406
  476    HB   VAL  56           HB       VAL  56  -3.995  -1.377  -4.608
  477   1HG1  VAL  56          1HG1      VAL  56  -2.459  -2.858  -2.452
  478   2HG1  VAL  56          2HG1      VAL  56  -4.128  -2.279  -2.289
  479   3HG1  VAL  56          3HG1      VAL  56  -3.747  -3.509  -3.494
  480   1HG2  VAL  56          1HG2      VAL  56  -1.848  -0.321  -2.714
  481   2HG2  VAL  56          2HG2      VAL  56  -2.640   0.604  -4.008
  482   3HG2  VAL  56          3HG2      VAL  56  -3.583   0.046  -2.614
  483    H    VAL  57           H        VAL  57  -0.580  -3.972  -4.355
  484    HA   VAL  57           HA       VAL  57  -2.395  -5.854  -5.761
  485    HB   VAL  57           HB       VAL  57  -0.327  -7.233  -6.356
  486   1HG1  VAL  57          1HG1      VAL  57  -0.820  -4.629  -7.814
  487   2HG1  VAL  57          2HG1      VAL  57   0.060  -6.025  -8.468
  488   3HG1  VAL  57          3HG1      VAL  57  -1.656  -6.171  -8.046
  489   1HG2  VAL  57          1HG2      VAL  57   1.128  -4.565  -6.028
  490   2HG2  VAL  57          2HG2      VAL  57   1.339  -5.985  -4.986
  491   3HG2  VAL  57          3HG2      VAL  57   1.788  -6.064  -6.695
  492    H    ALA  58           H        ALA  58  -2.967  -5.348  -3.433
  493    HA   ALA  58           HA       ALA  58  -1.644  -6.783  -1.302
  494   1HB   ALA  58          1HB       ALA  58  -3.994  -6.456  -0.254
  495   2HB   ALA  58          2HB       ALA  58  -3.035  -5.005  -0.634
  496   3HB   ALA  58          3HB       ALA  58  -4.338  -5.505  -1.705
  497    H    GLU  59           H        GLU  59  -2.198  -8.816  -0.490
  498    HA   GLU  59           HA       GLU  59  -3.955 -10.521  -2.133
  499   1HB   GLU  59          1HB       GLU  59  -1.382 -11.229  -0.736
  500   2HB   GLU  59          2HB       GLU  59  -2.351 -12.251  -1.809
  501   1HG   GLU  59          1HG       GLU  59  -1.935 -10.551  -3.651
  502   2HG   GLU  59          2HG       GLU  59  -0.865  -9.703  -2.534
  503    HE2  GLU  59           HE       GLU  59   0.343 -13.047  -4.398
  504    H    GLY  60           H        GLY  60  -5.681 -11.545  -0.847
  505   1HA   GLY  60          1HA       GLY  60  -4.913 -12.905   1.552
  506   2HA   GLY  60          2HA       GLY  60  -5.813 -11.438   1.972
  507    H    TYR  61           H        TYR  61  -6.669 -13.915   2.700
  508    HA   TYR  61           HA       TYR  61  -8.537 -15.262   1.231
  509   1HB   TYR  61          1HB       TYR  61  -8.284 -14.460   4.132
  510   2HB   TYR  61          2HB       TYR  61  -9.681 -15.383   3.610
  511    HD1  TYR  61           1HD      TYR  61  -9.525 -17.708   2.939
  512    HD2  TYR  61           2HD      TYR  61  -6.048 -15.498   4.211
  513    HE1  TYR  61           1HE      TYR  61  -8.277 -19.830   3.213
  514    HE2  TYR  61           2HE      TYR  61  -4.819 -17.623   4.533
  515    HH   TYR  61           HH       TYR  61  -4.891 -19.921   4.378
  516    H    GLU  62           H        GLU  62 -10.910 -15.182   1.300
  517    HA   GLU  62           HA       GLU  62 -11.858 -12.466   0.732
  518   1HB   GLU  62          1HB       GLU  62 -13.832 -13.488  -0.152
  519   2HB   GLU  62          2HB       GLU  62 -12.359 -14.173  -0.860
  520   1HG   GLU  62          1HG       GLU  62 -12.573 -16.154   0.679
  521   2HG   GLU  62          2HG       GLU  62 -14.066 -15.453   1.328
  522    HE2  GLU  62           HE       GLU  62 -14.044 -16.894  -2.488
  523    H    GLU  63           H        GLU  63 -11.840 -14.460   3.509
  524    HA   GLU  63           HA       GLU  63 -14.211 -13.317   4.746
  525   1HB   GLU  63          1HB       GLU  63 -11.689 -14.643   5.876
  526   2HB   GLU  63          2HB       GLU  63 -13.132 -14.199   6.801
  527   1HG   GLU  63          1HG       GLU  63 -14.488 -15.734   5.335
  528   2HG   GLU  63          2HG       GLU  63 -12.991 -16.248   4.543
  529    HE2  GLU  63           HE       GLU  63 -13.815 -17.470   8.325
  530    H    ALA  64           H        ALA  64 -10.771 -12.499   4.358
  531    HA   ALA  64           HA       ALA  64 -11.083 -10.048   6.016
  532   1HB   ALA  64          1HB       ALA  64  -8.645 -10.016   5.980
  533   2HB   ALA  64          2HB       ALA  64  -9.224 -11.605   6.519
  534   3HB   ALA  64          3HB       ALA  64  -8.613 -11.397   4.862
  535    H    LEU  65           H        LEU  65 -11.521 -10.860   2.735
  536    HA   LEU  65           HA       LEU  65  -9.981  -8.727   1.551
  537   1HB   LEU  65          1HB       LEU  65 -10.645 -10.681   0.274
  538   2HB   LEU  65          2HB       LEU  65 -12.366 -10.243   0.488
  539    HG   LEU  65           HG       LEU  65 -11.919  -8.130  -0.721
  540   1HD1  LEU  65          1HD1      LEU  65  -9.855  -7.934  -2.067
  541   2HD1  LEU  65          2HD1      LEU  65  -9.440  -7.916  -0.354
  542   3HD1  LEU  65          3HD1      LEU  65  -9.183  -9.392  -1.300
  543   1HD2  LEU  65          1HD2      LEU  65 -11.714  -9.207  -2.935
  544   2HD2  LEU  65          2HD2      LEU  65 -11.146 -10.695  -2.138
  545   3HD2  LEU  65          3HD2      LEU  65 -12.799 -10.109  -1.843
  546    H    SER  66           H        SER  66 -13.531  -9.088   1.982
  547    HA   SER  66           HA       SER  66 -14.455  -6.580   1.524
  548   1HB   SER  66          1HB       SER  66 -15.319  -8.332   3.835
  549   2HB   SER  66          2HB       SER  66 -16.286  -7.106   2.978
  550    HG   SER  66           HG       SER  66 -16.035  -8.386   1.087
  551    H    LYS  67           H        LYS  67 -12.848  -7.628   4.541
  552    HA   LYS  67           HA       LYS  67 -13.419  -5.298   6.107
  553   1HB   LYS  67          1HB       LYS  67 -11.480  -7.621   6.263
  554   2HB   LYS  67          2HB       LYS  67 -11.243  -6.226   7.314
  555   1HG   LYS  67          1HG       LYS  67 -12.502  -7.971   8.430
  556   2HG   LYS  67          2HG       LYS  67 -13.431  -6.469   8.310
  557   1HD   LYS  67          1HD       LYS  67 -14.828  -7.372   6.556
  558   2HD   LYS  67          2HD       LYS  67 -13.765  -8.785   6.363
  559   1HE   LYS  67          1HE       LYS  67 -14.323  -9.510   8.678
  560   2HE   LYS  67          2HE       LYS  67 -15.412  -8.115   8.845
  561   1HZ   LYS  67          1HZ       LYS  67 -16.656 -10.038   8.171
  562   2HZ   LYS  67          2HZ       LYS  67 -15.717 -10.201   6.779
  563    H    LEU  68           H        LEU  68 -10.558  -6.203   4.116
  564    HA   LEU  68           HA       LEU  68  -9.240  -3.657   4.635
  565   1HB   LEU  68          1HB       LEU  68  -7.796  -5.509   4.172
  566   2HB   LEU  68          2HB       LEU  68  -8.743  -5.983   2.757
  567    HG   LEU  68           HG       LEU  68  -7.991  -4.079   1.485
  568   1HD1  LEU  68          1HD1      LEU  68  -6.575  -2.379   2.192
  569   2HD1  LEU  68          2HD1      LEU  68  -7.647  -2.476   3.582
  570   3HD1  LEU  68          3HD1      LEU  68  -6.066  -3.236   3.671
  571   1HD2  LEU  68          1HD2      LEU  68  -5.686  -4.676   1.220
  572   2HD2  LEU  68          2HD2      LEU  68  -5.623  -5.367   2.859
  573   3HD2  LEU  68          3HD2      LEU  68  -6.617  -6.143   1.615
  574    H    LEU  69           H        LEU  69 -11.638  -4.842   2.291
  575    HA   LEU  69           HA       LEU  69 -10.873  -2.811   0.402
  576   1HB   LEU  69          1HB       LEU  69 -12.779  -5.098   0.521
  577   2HB   LEU  69          2HB       LEU  69 -13.457  -3.742  -0.342
  578    HG   LEU  69           HG       LEU  69 -12.259  -5.455  -1.722
  579   1HD1  LEU  69          1HD1      LEU  69 -11.018  -3.790  -3.150
  580   2HD1  LEU  69          2HD1      LEU  69 -12.670  -3.324  -2.737
  581   3HD1  LEU  69          3HD1      LEU  69 -11.297  -2.569  -1.897
  582   1HD2  LEU  69          1HD2      LEU  69  -9.906  -5.575  -1.829
  583   2HD2  LEU  69          2HD2      LEU  69  -9.664  -4.240  -0.696
  584   3HD2  LEU  69          3HD2      LEU  69 -10.337  -5.777  -0.118
  585    H    GLU  70           H        GLU  70 -13.808  -3.302   2.439
  586    HA   GLU  70           HA       GLU  70 -15.073  -0.930   1.719
  587   1HB   GLU  70          1HB       GLU  70 -16.518  -1.298   3.588
  588   2HB   GLU  70          2HB       GLU  70 -16.052  -2.878   2.947
  589   1HG   GLU  70          1HG       GLU  70 -14.257  -2.932   4.815
  590   2HG   GLU  70          2HG       GLU  70 -15.075  -1.522   5.495
  591    HE2  GLU  70           HE       GLU  70 -17.999  -3.331   6.364
  592    H    ARG  71           H        ARG  71 -12.684  -1.429   4.268
  593    HA   ARG  71           HA       ARG  71 -12.227   0.916   5.588
  594   1HB   ARG  71          1HB       ARG  71 -10.654  -0.600   6.003
  595   2HB   ARG  71          2HB       ARG  71 -10.621  -1.203   4.362
  596   1HG   ARG  71          1HG       ARG  71  -8.480  -0.310   4.965
  597   2HG   ARG  71          2HG       ARG  71  -9.158   0.566   3.621
  598   1HD   ARG  71          1HD       ARG  71  -9.921   1.842   6.136
  599   2HD   ARG  71          2HD       ARG  71  -8.190   1.600   6.080
  600    HE   ARG  71           HE       ARG  71  -9.696   3.553   4.665
  601   1HH1  ARG  71          1HH1      ARG  71  -6.981   1.362   3.995
  602   2HH1  ARG  71          2HH1      ARG  71  -6.313   2.395   2.754
  603   1HH2  ARG  71          1HH2      ARG  71  -8.823   4.855   3.076
  604   2HH2  ARG  71          2HH2      ARG  71  -7.372   4.390   2.208
  605    H    ILE  72           H        ILE  72 -11.440   0.421   2.112
  606    HA   ILE  72           HA       ILE  72 -10.172   3.008   2.004
  607    HB   ILE  72           HB       ILE  72 -10.879   1.272  -0.369
  608   1HG1  ILE  72          1HG1      ILE  72  -8.154   1.181   0.953
  609   2HG1  ILE  72          2HG1      ILE  72  -9.431   0.136   1.565
  610   1HG2  ILE  72          1HG2      ILE  72  -8.880   2.427  -1.352
  611   2HG2  ILE  72          2HG2      ILE  72 -10.136   3.585  -0.889
  612   3HG2  ILE  72          3HG2      ILE  72  -8.707   3.368   0.139
  613   1HD1  ILE  72          1HD1      ILE  72  -8.201  -1.085  -0.100
  614   2HD1  ILE  72          2HD1      ILE  72  -9.880  -0.830  -0.601
  615   3HD1  ILE  72          3HD1      ILE  72  -8.586   0.141  -1.330
  616    H    LYS  73           H        LYS  73 -12.789   1.964  -0.180
  617    HA   LYS  73           HA       LYS  73 -13.812   4.375  -0.826
  618   1HB   LYS  73          1HB       LYS  73 -16.093   3.215  -0.962
  619   2HB   LYS  73          2HB       LYS  73 -14.775   2.765  -2.019
  620   1HG   LYS  73          1HG       LYS  73 -15.315   1.119   0.472
  621   2HG   LYS  73          2HG       LYS  73 -16.303   0.962  -0.981
  622   1HD   LYS  73          1HD       LYS  73 -14.059   0.674  -2.279
  623   2HD   LYS  73          2HD       LYS  73 -13.360   0.351  -0.692
  624   1HE   LYS  73          1HE       LYS  73 -13.804  -1.681  -1.771
  625   2HE   LYS  73          2HE       LYS  73 -14.880  -1.549  -0.380
  626   1HZ   LYS  73          1HZ       LYS  73 -16.119  -2.309  -2.275
  627   2HZ   LYS  73          2HZ       LYS  73 -15.697  -0.927  -3.150
  628    H    GLN  74           H        GLN  74 -14.871   2.496   2.031
  629    HA   GLN  74           HA       GLN  74 -16.485   4.741   3.034
  630   1HB   GLN  74          1HB       GLN  74 -17.054   2.173   3.019
  631   2HB   GLN  74          2HB       GLN  74 -16.073   2.130   4.490
  632   1HG   GLN  74          1HG       GLN  74 -17.583   3.934   5.447
  633   2HG   GLN  74          2HG       GLN  74 -18.545   3.836   3.966
  634   1HE2  GLN  74          1HE2      GLN  74 -17.287   1.850   6.691
  635   2HE2  GLN  74          2HE2      GLN  74 -18.642   0.738   6.731
  636    H    GLY  75           H        GLY  75 -13.455   4.985   2.924
  637   1HA   GLY  75          1HA       GLY  75 -13.129   6.447   5.329
  638   2HA   GLY  75          2HA       GLY  75 -12.359   4.874   5.534
  639    HA   PRO  76           HA       PRO  76 -10.234   6.714   1.652
  640   1HB   PRO  76          1HB       PRO  76 -10.792   9.265   0.783
  641   2HB   PRO  76          2HB       PRO  76 -11.863   7.868   0.446
  642   1HG   PRO  76          1HG       PRO  76 -12.095   9.863   2.721
  643   2HG   PRO  76          2HG       PRO  76 -13.354   9.435   1.520
  644   1HD   PRO  76          1HD       PRO  76 -13.276   8.227   3.934
  645   2HD   PRO  76          2HD       PRO  76 -13.622   7.267   2.465
  646    HA   PRO  77           HA       PRO  77  -7.043   9.093   3.762
  647   1HB   PRO  77          1HB       PRO  77  -5.341   9.789   1.765
  648   2HB   PRO  77          2HB       PRO  77  -5.634   8.087   2.214
  649   1HG   PRO  77          1HG       PRO  77  -6.986   9.663  -0.004
  650   2HG   PRO  77          2HG       PRO  77  -6.146   8.091  -0.163
  651   1HD   PRO  77          1HD       PRO  77  -8.836   8.257   0.163
  652   2HD   PRO  77          2HD       PRO  77  -7.906   6.954   0.948
  653    H    ALA  78           H        ALA  78  -5.781  11.335   3.357
  654    HA   ALA  78           HA       ALA  78  -7.878  13.366   3.382
  655   1HB   ALA  78          1HB       ALA  78  -6.100  14.781   4.328
  656   2HB   ALA  78          2HB       ALA  78  -6.220  13.233   5.178
  657   3HB   ALA  78          3HB       ALA  78  -4.910  13.500   4.012
  658    H    ALA  79           H        ALA  79  -7.149  12.185   0.726
  659    HA   ALA  79           HA       ALA  79  -6.448  14.703  -0.681
  660   1HB   ALA  79          1HB       ALA  79  -5.372  13.235  -2.425
  661   2HB   ALA  79          2HB       ALA  79  -4.459  13.492  -0.943
  662   3HB   ALA  79          3HB       ALA  79  -5.341  11.953  -1.205
  663    H    GLU  80           H        GLU  80  -7.186  14.606  -2.959
  664    HA   GLU  80           HA       GLU  80  -9.918  13.640  -3.189
  665   1HB   GLU  80          1HB       GLU  80  -8.074  15.050  -5.164
  666   2HB   GLU  80          2HB       GLU  80  -9.795  14.711  -5.425
  667   1HG   GLU  80          1HG       GLU  80 -10.368  16.071  -3.426
  668   2HG   GLU  80          2HG       GLU  80  -8.653  16.446  -3.187
  669    HE2  GLU  80           HE       GLU  80 -10.774  18.603  -5.744
  670    H    VAL  81           H        VAL  81  -9.367  11.396  -2.843
  671    HA   VAL  81           HA       VAL  81  -8.111   9.723  -4.732
  672    HB   VAL  81           HB       VAL  81  -8.548   9.088  -2.523
  673   1HG1  VAL  81          1HG1      VAL  81 -11.518   8.794  -3.080
  674   2HG1  VAL  81          2HG1      VAL  81 -10.635   8.422  -1.607
  675   3HG1  VAL  81          3HG1      VAL  81 -10.793  10.104  -2.125
  676   1HG2  VAL  81          1HG2      VAL  81 -10.006   7.229  -4.443
  677   2HG2  VAL  81          2HG2      VAL  81  -8.243   7.353  -4.254
  678   3HG2  VAL  81          3HG2      VAL  81  -9.243   6.795  -2.901
  679    H    GLU  82           H        GLU  82  -8.653  10.672  -6.727
  680    HA   GLU  82           HA       GLU  82 -10.907  11.137  -8.073
  681   1HB   GLU  82          1HB       GLU  82  -8.667  11.346  -8.989
  682   2HB   GLU  82          2HB       GLU  82  -8.499   9.584  -9.094
  683   1HG   GLU  82          1HG       GLU  82 -10.462   9.590 -10.709
  684   2HG   GLU  82          2HG       GLU  82 -10.423  11.358 -10.662
  685    HE2  GLU  82           HE       GLU  82  -7.404  11.552 -12.504
  686    H    LYS  83           H        LYS  83  -9.465   7.806  -8.103
  687    HA   LYS  83           HA       LYS  83 -11.970   6.616  -7.499
  688   1HB   LYS  83          1HB       LYS  83 -12.469   5.397  -9.552
  689   2HB   LYS  83          2HB       LYS  83 -12.641   7.132  -9.772
  690   1HG   LYS  83          1HG       LYS  83 -10.380   7.170 -10.901
  691   2HG   LYS  83          2HG       LYS  83 -10.308   5.416 -10.703
  692   1HD   LYS  83          1HD       LYS  83 -11.012   5.765 -12.917
  693   2HD   LYS  83          2HD       LYS  83 -12.396   5.155 -12.008
  694   1HE   LYS  83          1HE       LYS  83 -13.074   6.921 -13.559
  695   2HE   LYS  83          2HE       LYS  83 -13.333   7.470 -11.897
  696   1HZ   LYS  83          1HZ       LYS  83 -12.245   9.189 -13.142
  697   2HZ   LYS  83          2HZ       LYS  83 -10.955   8.161 -13.510
  698    H    VAL  84           H        VAL  84 -11.529   4.792  -6.422
  699    HA   VAL  84           HA       VAL  84  -9.079   3.271  -7.050
  700    HB   VAL  84           HB       VAL  84  -9.305   3.512  -4.818
  701   1HG1  VAL  84          1HG1      VAL  84 -12.185   2.538  -4.932
  702   2HG1  VAL  84          2HG1      VAL  84 -11.227   2.785  -3.460
  703   3HG1  VAL  84          3HG1      VAL  84 -11.616   4.163  -4.494
  704   1HG2  VAL  84          1HG2      VAL  84 -10.372   0.725  -5.398
  705   2HG2  VAL  84          2HG2      VAL  84  -8.715   1.244  -5.748
  706   3HG2  VAL  84          3HG2      VAL  84  -9.310   1.233  -4.073
  707    H    ASP  85           H        ASP  85  -9.310   2.279  -8.982
  708    HA   ASP  85           HA       ASP  85 -11.789   0.829  -9.685
  709   1HB   ASP  85          1HB       ASP  85 -10.722   2.072 -11.442
  710   2HB   ASP  85          2HB       ASP  85  -9.164   1.296 -11.138
  711    HD2  ASP  85           HD       ASP  85  -9.902  -1.394 -13.181
  712    H    TYR  86           H        TYR  86 -11.632  -0.585  -7.751
  713    HA   TYR  86           HA       TYR  86  -9.310  -2.239  -7.523
  714   1HB   TYR  86          1HB       TYR  86 -10.156  -3.207  -5.678
  715   2HB   TYR  86          2HB       TYR  86 -10.841  -1.595  -5.617
  716    HD1  TYR  86           1HD      TYR  86 -13.308  -1.287  -6.115
  717    HD2  TYR  86           2HD      TYR  86 -11.510  -5.207  -5.942
  718    HE1  TYR  86           1HE      TYR  86 -15.531  -2.294  -5.673
  719    HE2  TYR  86           2HE      TYR  86 -13.725  -6.204  -5.505
  720    HH   TYR  86           HH       TYR  86 -15.958  -5.808  -5.113
  721    H    SER  87           H        SER  87  -9.077  -4.461  -8.124
  722    HA   SER  87           HA       SER  87 -11.119  -5.670  -9.870
  723   1HB   SER  87          1HB       SER  87  -8.324  -4.943 -10.802
  724   2HB   SER  87          2HB       SER  87  -9.527  -5.900 -11.701
  725    HG   SER  87           HG       SER  87 -10.899  -3.944 -11.401
  726    H    PHE  88           H        PHE  88 -11.235  -7.097  -8.215
  727    HA   PHE  88           HA       PHE  88  -9.445  -8.846  -7.028
  728   1HB   PHE  88          1HB       PHE  88 -11.696  -8.934  -6.416
  729   2HB   PHE  88          2HB       PHE  88 -12.261  -9.000  -8.071
  730    HD1  PHE  88           1HD      PHE  88 -12.011 -11.142  -9.428
  731    HD2  PHE  88           2HD      PHE  88 -11.495 -10.968  -5.147
  732    HE1  PHE  88           1HE      PHE  88 -12.445 -13.569  -9.277
  733    HE2  PHE  88           2HE      PHE  88 -12.079 -13.375  -4.996
  734    HZ   PHE  88           HZ       PHE  88 -12.481 -14.693  -7.062
  735    H    SER  89           H        SER  89  -8.597 -10.886  -7.604
  736    HA   SER  89           HA       SER  89  -8.955 -12.171 -10.010
  737   1HB   SER  89          1HB       SER  89  -6.086 -11.150  -9.954
  738   2HB   SER  89          2HB       SER  89  -6.960 -11.849 -11.317
  739    HG   SER  89           HG       SER  89  -8.236  -9.801 -11.175
  740    H    GLU  90           H        GLU  90  -7.257 -13.928 -10.373
  741    HA   GLU  90           HA       GLU  90  -6.982 -15.310  -7.806
  742   1HB   GLU  90          1HB       GLU  90  -6.288 -17.217  -9.082
  743   2HB   GLU  90          2HB       GLU  90  -7.798 -16.568  -9.716
  744   1HG   GLU  90          1HG       GLU  90  -5.064 -16.019 -10.976
  745   2HG   GLU  90          2HG       GLU  90  -6.088 -17.381 -11.408
  746    HE2  GLU  90           HE       GLU  90  -8.414 -15.513 -13.220
  747    H    TYR  91           H        TYR  91  -4.986 -15.939  -6.818
  748    HA   TYR  91           HA       TYR  91  -2.994 -13.941  -7.099
  749   1HB   TYR  91          1HB       TYR  91  -2.057 -14.833  -5.186
  750   2HB   TYR  91          2HB       TYR  91  -3.766 -15.167  -4.991
  751    HD1  TYR  91           1HD      TYR  91  -4.637 -17.538  -5.457
  752    HD2  TYR  91           2HD      TYR  91  -0.435 -16.585  -5.250
  753    HE1  TYR  91           1HE      TYR  91  -4.094 -19.947  -5.301
  754    HE2  TYR  91           2HE      TYR  91   0.108 -18.993  -5.165
  755    HH   TYR  91           HH       TYR  91  -0.722 -21.143  -5.142
  756    H    LYS  92           H        LYS  92  -0.898 -14.041  -7.720
  757    HA   LYS  92           HA       LYS  92  -0.168 -16.045  -9.746
  758   1HB   LYS  92          1HB       LYS  92   0.082 -13.689 -10.269
  759   2HB   LYS  92          2HB       LYS  92   1.046 -13.424  -8.818
  760   1HG   LYS  92          1HG       LYS  92   2.484 -13.443 -10.690
  761   2HG   LYS  92          2HG       LYS  92   2.858 -14.877  -9.743
  762   1HD   LYS  92          1HD       LYS  92   0.908 -15.103 -12.061
  763   2HD   LYS  92          2HD       LYS  92   2.626 -14.875 -12.405
  764   1HE   LYS  92          1HE       LYS  92   3.171 -16.877 -11.002
  765   2HE   LYS  92          2HE       LYS  92   1.435 -17.195 -10.836
  766   1HZ   LYS  92          1HZ       LYS  92   2.277 -18.426 -12.677
  767   2HZ   LYS  92          2HZ       LYS  92   2.823 -17.015 -13.429
  768    H    GLY  93           H        GLY  93   1.291 -14.461  -6.847
  769   1HA   GLY  93          1HA       GLY  93   2.173 -16.913  -5.643
  770   2HA   GLY  93          2HA       GLY  93   3.511 -15.999  -6.382
  771    H    GLU  94           H        GLU  94   3.526 -16.317  -3.675
  772    HA   GLU  94           HA       GLU  94   2.208 -14.142  -2.283
  773   1HB   GLU  94          1HB       GLU  94   3.483 -14.892  -0.346
  774   2HB   GLU  94          2HB       GLU  94   2.400 -16.092  -1.055
  775   1HG   GLU  94          1HG       GLU  94   4.259 -17.316  -2.022
  776   2HG   GLU  94          2HG       GLU  94   5.415 -16.075  -1.518
  777    HE2  GLU  94           HE       GLU  94   3.921 -18.638   1.234
  778    H    PHE  95           H        PHE  95   2.826 -12.169  -2.911
  779    HA   PHE  95           HA       PHE  95   5.630 -11.346  -3.226
  780   1HB   PHE  95          1HB       PHE  95   2.991  -9.892  -3.042
  781   2HB   PHE  95          2HB       PHE  95   4.538  -9.087  -3.255
  782    HD1  PHE  95           1HD      PHE  95   4.527 -12.117  -5.245
  783    HD2  PHE  95           2HD      PHE  95   3.086  -8.043  -5.108
  784    HE1  PHE  95           1HE      PHE  95   4.124 -12.175  -7.666
  785    HE2  PHE  95           2HE      PHE  95   2.782  -8.090  -7.572
  786    HZ   PHE  95           HZ       PHE  95   3.268 -10.159  -8.847
  787    H    GLU  96           H        GLU  96   6.301 -12.269  -1.210
  788    HA   GLU  96           HA       GLU  96   5.283 -12.211   1.232
  789   1HB   GLU  96          1HB       GLU  96   8.226 -11.848   0.560
  790   2HB   GLU  96          2HB       GLU  96   7.588 -12.344   2.137
  791   1HG   GLU  96          1HG       GLU  96   6.463 -14.303   0.999
  792   2HG   GLU  96          2HG       GLU  96   7.321 -13.870  -0.490
  793    HE2  GLU  96           HE       GLU  96   9.332 -15.512   2.622
  794    H    ASP  97           H        ASP  97   4.533 -10.762   2.568
  795    HA   ASP  97           HA       ASP  97   4.231  -9.014   3.886
  796   1HB   ASP  97          1HB       ASP  97   6.516  -9.120   4.593
  797   2HB   ASP  97          2HB       ASP  97   7.074  -8.198   3.191
  798    HD2  ASP  97           HD       ASP  97   4.817  -6.044   5.776
  799    H    PHE  98           H        PHE  98   2.842  -7.384   3.465
  800    HA   PHE  98           HA       PHE  98   2.726  -6.205   0.811
  801   1HB   PHE  98          1HB       PHE  98   0.694  -6.737   2.080
  802   2HB   PHE  98          2HB       PHE  98   1.172  -5.642   3.366
  803    HD1  PHE  98           1HD      PHE  98   0.175  -5.852  -0.201
  804    HD2  PHE  98           2HD      PHE  98   0.719  -3.269   3.173
  805    HE1  PHE  98           1HE      PHE  98  -0.745  -3.969  -1.517
  806    HE2  PHE  98           2HE      PHE  98  -0.270  -1.384   1.895
  807    HZ   PHE  98           HZ       PHE  98  -1.042  -1.739  -0.445
  808    H    GLU  99           H        GLU  99   4.754  -4.984   0.633
  809    HA   GLU  99           HA       GLU  99   5.142  -2.792   2.636
  810   1HB   GLU  99          1HB       GLU  99   6.818  -4.517   2.513
  811   2HB   GLU  99          2HB       GLU  99   7.163  -4.098   0.832
  812   1HG   GLU  99          1HG       GLU  99   7.845  -1.823   1.525
  813   2HG   GLU  99          2HG       GLU  99   7.323  -2.142   3.184
  814    HE2  GLU  99           HE       GLU  99  10.152  -4.177   3.881
  815    H    THR 100           H        THR 100   5.964  -0.738   1.835
  816    HA   THR 100           HA       THR 100   4.639   0.009  -0.676
  817    HB   THR 100           HB       THR 100   4.148   1.997   0.260
  818    HG1  THR 100           1HG      THR 100   5.382   3.011   1.853
  819   1HG2  THR 100          1HG2      THR 100   3.466   1.756   2.584
  820   2HG2  THR 100          2HG2      THR 100   3.207   0.211   1.746
  821   3HG2  THR 100          3HG2      THR 100   4.595   0.428   2.846
  822    H    TYR 101           H        TYR 101   5.585   1.146  -2.371
  823    HA   TYR 101           HA       TYR 101   8.468   1.777  -2.388
  824   1HB   TYR 101          1HB       TYR 101   6.054   2.700  -3.972
  825   2HB   TYR 101          2HB       TYR 101   7.609   3.494  -4.140
  826    HD1  TYR 101           1HD      TYR 101   6.550   2.757  -6.591
  827    HD2  TYR 101           2HD      TYR 101   8.643   0.173  -3.833
  828    HE1  TYR 101           1HE      TYR 101   7.692   1.643  -8.470
  829    HE2  TYR 101           2HE      TYR 101   9.611  -1.051  -5.717
  830    HH   TYR 101           HH       TYR 101   9.861  -1.164  -8.009
  Start of MODEL    9
    1   1H    GLY  -1          1H        GLY  -1 -39.750 -31.628  13.108
    2   2H    GLY  -1          2H        GLY  -1 -39.134 -33.026  13.742
    3   3H    GLY  -1          3H        GLY  -1 -38.309 -31.616  13.917
    4   1HA   GLY  -1          1HA       GLY  -1 -38.821 -33.009  11.389
    5   2HA   GLY  -1          2HA       GLY  -1 -37.961 -31.464  11.558
    6    H    SER   0           H        SER   0 -36.451 -33.134  10.296
    7    HA   SER   0           HA       SER   0 -34.358 -33.938  12.204
    8   1HB   SER   0          1HB       SER   0 -35.510 -35.852  10.118
    9   2HB   SER   0          2HB       SER   0 -34.108 -36.152  11.165
   10    HG   SER   0           HG       SER   0 -35.627 -35.789  12.952
   11    H    MET   1           H        MET   1 -32.336 -33.622  11.347
   12    HA   MET   1           HA       MET   1 -31.837 -33.497   8.512
   13   1HB   MET   1          1HB       MET   1 -31.004 -31.165   8.482
   14   2HB   MET   1          2HB       MET   1 -32.751 -31.296   8.677
   15   1HG   MET   1          1HG       MET   1 -32.446 -30.917  11.163
   16   2HG   MET   1          2HG       MET   1 -30.726 -30.647  10.852
   17   1HE   MET   1          1HE       MET   1 -34.063 -29.376   8.943
   18   2HE   MET   1          2HE       MET   1 -34.189 -27.813   9.777
   19   3HE   MET   1          3HE       MET   1 -34.316 -29.324  10.705
   20    H    LYS   2           H        LYS   2 -29.929 -34.424   8.278
   21    HA   LYS   2           HA       LYS   2 -27.878 -34.321  10.457
   22   1HB   LYS   2          1HB       LYS   2 -29.014 -36.623   8.854
   23   2HB   LYS   2          2HB       LYS   2 -27.458 -36.729   9.688
   24   1HG   LYS   2          1HG       LYS   2 -28.376 -36.453  11.818
   25   2HG   LYS   2          2HG       LYS   2 -29.919 -35.837  11.234
   26   1HD   LYS   2          1HD       LYS   2 -29.192 -38.609  10.340
   27   2HD   LYS   2          2HD       LYS   2 -29.537 -38.385  12.058
   28   1HE   LYS   2          1HE       LYS   2 -31.581 -39.013  10.870
   29   2HE   LYS   2          2HE       LYS   2 -31.719 -37.396  11.578
   30   1HZ   LYS   2          1HZ       LYS   2 -32.537 -37.335   9.349
   31   2HZ   LYS   2          2HZ       LYS   2 -31.068 -37.906   8.744
   32    H    LYS   3           H        LYS   3 -25.811 -33.923   9.752
   33    HA   LYS   3           HA       LYS   3 -25.096 -34.175   6.896
   34   1HB   LYS   3          1HB       LYS   3 -24.746 -31.617   8.524
   35   2HB   LYS   3          2HB       LYS   3 -24.113 -31.920   6.897
   36   1HG   LYS   3          1HG       LYS   3 -26.466 -32.225   6.079
   37   2HG   LYS   3          2HG       LYS   3 -27.050 -31.736   7.687
   38   1HD   LYS   3          1HD       LYS   3 -25.782 -29.594   7.461
   39   2HD   LYS   3          2HD       LYS   3 -25.348 -30.046   5.804
   40   1HE   LYS   3          1HE       LYS   3 -28.197 -29.694   6.864
   41   2HE   LYS   3          2HE       LYS   3 -27.296 -28.495   5.919
   42   1HZ   LYS   3          1HZ       LYS   3 -28.680 -29.756   4.455
   43   2HZ   LYS   3          2HZ       LYS   3 -27.945 -31.198   4.932
   44    H    TRP   4           H        TRP   4 -22.706 -33.869   6.632
   45    HA   TRP   4           HA       TRP   4 -21.108 -34.655   9.011
   46   1HB   TRP   4          1HB       TRP   4 -19.943 -36.249   7.613
   47   2HB   TRP   4          2HB       TRP   4 -21.660 -36.621   7.629
   48    HD1  TRP   4           HD       TRP   4 -18.838 -35.699   5.322
   49    HE1  TRP   4           1HE      TRP   4 -19.630 -35.677   2.862
   50    HE3  TRP   4           3HE      TRP   4 -23.883 -36.202   6.063
   51    HZ2  TRP   4           2HZ      TRP   4 -22.100 -35.791   1.434
   52    HZ3  TRP   4           3HZ      TRP   4 -25.429 -36.194   4.135
   53    HH2  TRP   4           HH       TRP   4 -24.555 -35.983   1.820
   54    H    SER   5           H        SER   5 -18.735 -34.501   8.259
   55    HA   SER   5           HA       SER   5 -18.221 -32.009   6.682
   56   1HB   SER   5          1HB       SER   5 -17.929 -31.643   9.117
   57   2HB   SER   5          2HB       SER   5 -16.748 -32.967   9.171
   58    HG   SER   5           HG       SER   5 -15.447 -31.775   7.748
   59    H    ASP   6           H        ASP   6 -16.425 -32.088   5.317
   60    HA   ASP   6           HA       ASP   6 -14.554 -34.250   5.288
   61   1HB   ASP   6          1HB       ASP   6 -16.468 -35.418   4.219
   62   2HB   ASP   6          2HB       ASP   6 -16.620 -34.110   3.040
   63    HD2  ASP   6           HD       ASP   6 -14.785 -36.424   1.124
   64    H    THR   7           H        THR   7 -13.320 -32.308   5.598
   65    HA   THR   7           HA       THR   7 -12.702 -30.814   3.107
   66    HB   THR   7           HB       THR   7 -12.628 -28.723   4.473
   67    HG1  THR   7           1HG      THR   7 -13.706 -28.771   6.487
   68   1HG2  THR   7          1HG2      THR   7 -15.014 -28.278   4.548
   69   2HG2  THR   7          2HG2      THR   7 -14.645 -29.235   3.100
   70   3HG2  THR   7          3HG2      THR   7 -15.395 -30.007   4.517
   71    H    GLU   8           H        GLU   8 -10.600 -29.869   3.129
   72    HA   GLU   8           HA       GLU   8  -8.830 -30.258   5.398
   73   1HB   GLU   8          1HB       GLU   8  -8.789 -32.492   4.210
   74   2HB   GLU   8          2HB       GLU   8  -8.140 -31.671   2.785
   75   1HG   GLU   8          1HG       GLU   8  -6.173 -30.928   4.184
   76   2HG   GLU   8          2HG       GLU   8  -6.893 -31.748   5.578
   77    HE2  GLU   8           HE       GLU   8  -5.343 -33.981   2.545
   78    H    VAL   9           H        VAL   9  -9.438 -27.928   4.909
   79    HA   VAL   9           HA       VAL   9  -7.823 -26.680   2.757
   80    HB   VAL   9           HB       VAL   9  -9.868 -25.528   4.697
   81   1HG1  VAL   9          1HG1      VAL   9  -8.376 -24.244   2.362
   82   2HG1  VAL   9          2HG1      VAL   9  -9.752 -23.519   3.213
   83   3HG1  VAL   9          3HG1      VAL   9  -8.238 -23.795   4.076
   84   1HG2  VAL   9          1HG2      VAL   9 -10.011 -26.140   1.708
   85   2HG2  VAL   9          2HG2      VAL   9 -10.899 -26.994   2.988
   86   3HG2  VAL   9          3HG2      VAL   9 -11.260 -25.298   2.646
   87    H    PHE  10           H        PHE  10  -6.065 -25.397   3.211
   88    HA   PHE  10           HA       PHE  10  -4.999 -25.400   5.995
   89   1HB   PHE  10          1HB       PHE  10  -2.770 -25.199   4.706
   90   2HB   PHE  10          2HB       PHE  10  -3.571 -26.742   4.844
   91    HD1  PHE  10           1HD      PHE  10  -4.827 -27.782   2.965
   92    HD2  PHE  10           2HD      PHE  10  -2.231 -24.370   2.418
   93    HE1  PHE  10           1HE      PHE  10  -4.807 -28.173   0.527
   94    HE2  PHE  10           2HE      PHE  10  -2.249 -24.751  -0.009
   95    HZ   PHE  10           HZ       PHE  10  -3.516 -26.663  -0.971
   96    H    GLU  11           H        GLU  11  -3.473 -23.497   3.591
   97    HA   GLU  11           HA       GLU  11  -4.946 -21.037   4.392
   98   1HB   GLU  11          1HB       GLU  11  -2.870 -19.803   4.200
   99   2HB   GLU  11          2HB       GLU  11  -2.989 -20.862   5.595
  100   1HG   GLU  11          1HG       GLU  11  -1.456 -21.596   3.054
  101   2HG   GLU  11          2HG       GLU  11  -0.749 -20.702   4.398
  102    HE2  GLU  11           HE       GLU  11  -1.239 -23.635   6.584
  103    H    MET  12           H        MET  12  -5.712 -19.905   2.710
  104    HA   MET  12           HA       MET  12  -4.507 -20.044   0.017
  105   1HB   MET  12          1HB       MET  12  -7.421 -20.671   0.649
  106   2HB   MET  12          2HB       MET  12  -6.774 -20.387  -0.958
  107   1HG   MET  12          1HG       MET  12  -5.292 -22.390  -0.701
  108   2HG   MET  12          2HG       MET  12  -5.996 -22.680   0.899
  109   1HE   MET  12          1HE       MET  12  -5.965 -25.103  -0.936
  110   2HE   MET  12          2HE       MET  12  -7.642 -25.662  -0.731
  111   3HE   MET  12          3HE       MET  12  -6.748 -25.007   0.659
  112    H    LEU  13           H        LEU  13  -5.086 -18.214  -1.224
  113    HA   LEU  13           HA       LEU  13  -7.026 -16.290  -0.462
  114   1HB   LEU  13          1HB       LEU  13  -5.532 -14.448   0.231
  115   2HB   LEU  13          2HB       LEU  13  -5.604 -15.748   1.393
  116    HG   LEU  13           HG       LEU  13  -3.371 -16.469  -0.120
  117   1HD1  LEU  13          1HD1      LEU  13  -2.054 -14.412  -0.404
  118   2HD1  LEU  13          2HD1      LEU  13  -3.536 -14.301  -1.377
  119   3HD1  LEU  13          3HD1      LEU  13  -3.418 -13.435   0.170
  120   1HD2  LEU  13          1HD2      LEU  13  -2.097 -15.602   1.804
  121   2HD2  LEU  13          2HD2      LEU  13  -3.523 -14.679   2.339
  122   3HD2  LEU  13          3HD2      LEU  13  -3.559 -16.460   2.322
  123    H    LYS  14           H        LYS  14  -7.070 -14.467  -1.860
  124    HA   LYS  14           HA       LYS  14  -5.609 -14.942  -4.429
  125   1HB   LYS  14          1HB       LYS  14  -7.561 -14.367  -5.611
  126   2HB   LYS  14          2HB       LYS  14  -7.930 -15.611  -4.420
  127   1HG   LYS  14          1HG       LYS  14  -9.707 -14.294  -4.085
  128   2HG   LYS  14          2HG       LYS  14  -8.628 -13.502  -2.918
  129   1HD   LYS  14          1HD       LYS  14  -8.081 -11.791  -4.689
  130   2HD   LYS  14          2HD       LYS  14  -9.188 -12.638  -5.776
  131   1HE   LYS  14          1HE       LYS  14  -9.921 -11.348  -3.120
  132   2HE   LYS  14          2HE       LYS  14 -10.155 -10.591  -4.705
  133   1HZ   LYS  14          1HZ       LYS  14 -12.185 -11.644  -4.026
  134   2HZ   LYS  14          2HZ       LYS  14 -11.417 -13.143  -3.923
  135    H    ARG  15           H        ARG  15  -5.760 -12.972  -5.905
  136    HA   ARG  15           HA       ARG  15  -4.337 -10.830  -4.472
  137   1HB   ARG  15          1HB       ARG  15  -3.094 -12.021  -5.972
  138   2HB   ARG  15          2HB       ARG  15  -4.318 -11.916  -7.270
  139   1HG   ARG  15          1HG       ARG  15  -3.879  -9.606  -7.620
  140   2HG   ARG  15          2HG       ARG  15  -2.944  -9.486  -6.109
  141   1HD   ARG  15          1HD       ARG  15  -1.479  -9.536  -8.117
  142   2HD   ARG  15          2HD       ARG  15  -1.182 -10.898  -7.019
  143    HE   ARG  15           HE       ARG  15  -3.075 -11.728  -8.965
  144   1HH1  ARG  15          2HH1      ARG  15   0.349 -10.846  -8.751
  145   2HH1  ARG  15          1HH1      ARG  15   0.817 -11.806 -10.131
  146   1HH2  ARG  15          1HH2      ARG  15  -2.430 -13.084 -10.685
  147   2HH2  ARG  15          2HH2      ARG  15  -0.786 -13.048 -11.274
  148    H    MET  16           H        MET  16  -5.677  -9.147  -3.922
  149    HA   MET  16           HA       MET  16  -7.670  -8.118  -5.858
  150   1HB   MET  16          1HB       MET  16  -8.038  -6.486  -4.109
  151   2HB   MET  16          2HB       MET  16  -8.594  -8.132  -3.791
  152   1HG   MET  16          1HG       MET  16  -6.867  -8.498  -2.192
  153   2HG   MET  16          2HG       MET  16  -5.976  -7.073  -2.717
  154   1HE   MET  16          1HE       MET  16  -6.793  -4.745  -2.708
  155   2HE   MET  16          2HE       MET  16  -7.477  -4.072  -1.219
  156   3HE   MET  16          3HE       MET  16  -8.553  -4.583  -2.531
  157    H    TYR  17           H        TYR  17  -6.529  -7.198  -7.520
  158    HA   TYR  17           HA       TYR  17  -4.307  -5.324  -7.046
  159   1HB   TYR  17          1HB       TYR  17  -4.501  -6.744  -9.119
  160   2HB   TYR  17          2HB       TYR  17  -5.910  -5.799  -9.575
  161    HD1  TYR  17           1HD      TYR  17  -5.646  -3.599 -10.593
  162    HD2  TYR  17           2HD      TYR  17  -2.263  -5.648  -8.883
  163    HE1  TYR  17           1HE      TYR  17  -4.107  -2.032 -11.739
  164    HE2  TYR  17           2HE      TYR  17  -0.745  -3.948  -9.850
  165    HH   TYR  17           HH       TYR  17  -0.566  -2.186 -11.270
  166    H    ALA  18           H        ALA  18  -4.612  -3.117  -6.728
  167    HA   ALA  18           HA       ALA  18  -7.301  -1.977  -7.251
  168   1HB   ALA  18          1HB       ALA  18  -7.259  -0.818  -5.110
  169   2HB   ALA  18          2HB       ALA  18  -7.404  -2.584  -4.965
  170   3HB   ALA  18          3HB       ALA  18  -5.846  -1.792  -4.621
  171    H    ARG  19           H        ARG  19  -6.886  -0.649  -8.761
  172    HA   ARG  19           HA       ARG  19  -4.365   0.845  -8.959
  173   1HB   ARG  19          1HB       ARG  19  -5.393  -0.399 -10.880
  174   2HB   ARG  19          2HB       ARG  19  -6.739   0.720 -10.857
  175   1HG   ARG  19          1HG       ARG  19  -5.262   1.479 -12.541
  176   2HG   ARG  19          2HG       ARG  19  -5.040   2.613 -11.194
  177   1HD   ARG  19          1HD       ARG  19  -2.972   1.510 -10.539
  178   2HD   ARG  19          2HD       ARG  19  -3.270   0.205 -11.704
  179    HE   ARG  19           HE       ARG  19  -3.193   2.875 -12.869
  180   1HH1  ARG  19          1HH1      ARG  19  -1.248  -0.004 -12.119
  181   2HH1  ARG  19          2HH1      ARG  19   0.167   0.581 -12.949
  182   1HH2  ARG  19          1HH2      ARG  19  -1.379   3.582 -14.047
  183   2HH2  ARG  19          2HH2      ARG  19   0.055   2.595 -14.143
  184    H    VAL  20           H        VAL  20  -4.396   2.553  -7.531
  185    HA   VAL  20           HA       VAL  20  -6.901   4.049  -7.047
  186    HB   VAL  20           HB       VAL  20  -4.284   3.920  -5.542
  187   1HG1  VAL  20          1HG1      VAL  20  -6.935   5.157  -4.687
  188   2HG1  VAL  20          2HG1      VAL  20  -5.394   5.186  -3.808
  189   3HG1  VAL  20          3HG1      VAL  20  -5.568   6.111  -5.291
  190   1HG2  VAL  20          1HG2      VAL  20  -6.983   2.711  -4.864
  191   2HG2  VAL  20          2HG2      VAL  20  -5.586   1.798  -5.460
  192   3HG2  VAL  20          3HG2      VAL  20  -5.503   2.608  -3.905
  193    H    TYR  21           H        TYR  21  -7.220   5.826  -8.166
  194    HA   TYR  21           HA       TYR  21  -4.962   7.338  -9.386
  195   1HB   TYR  21          1HB       TYR  21  -7.959   7.375  -9.851
  196   2HB   TYR  21          2HB       TYR  21  -6.837   8.444 -10.633
  197    HD1  TYR  21           1HD      TYR  21  -5.633   7.781 -12.585
  198    HD2  TYR  21           2HD      TYR  21  -7.780   4.828 -10.288
  199    HE1  TYR  21           1HE      TYR  21  -5.253   6.093 -14.360
  200    HE2  TYR  21           2HE      TYR  21  -7.372   3.159 -12.028
  201    HH   TYR  21           HH       TYR  21  -6.390   2.713 -14.069
  202    H    GLY  22           H        GLY  22  -4.859   9.630  -9.216
  203   1HA   GLY  22          1HA       GLY  22  -6.106  11.650  -8.743
  204   2HA   GLY  22          2HA       GLY  22  -6.608  10.968  -7.190
  205    H    LEU  23           H        LEU  23  -5.762  12.929  -6.264
  206    HA   LEU  23           HA       LEU  23  -2.878  13.410  -6.410
  207   1HB   LEU  23          1HB       LEU  23  -4.743  15.153  -6.452
  208   2HB   LEU  23          2HB       LEU  23  -4.867  14.888  -4.708
  209    HG   LEU  23           HG       LEU  23  -2.340  15.468  -4.617
  210   1HD1  LEU  23          1HD1      LEU  23  -1.521  16.886  -6.497
  211   2HD1  LEU  23          2HD1      LEU  23  -1.729  15.203  -6.987
  212   3HD1  LEU  23          3HD1      LEU  23  -2.938  16.420  -7.457
  213   1HD2  LEU  23          1HD2      LEU  23  -2.800  17.888  -4.705
  214   2HD2  LEU  23          2HD2      LEU  23  -4.302  17.581  -5.604
  215   3HD2  LEU  23          3HD2      LEU  23  -4.134  17.022  -3.925
  216    H    VAL  24           H        VAL  24  -3.821  10.892  -5.254
  217    HA   VAL  24           HA       VAL  24  -3.226  10.938  -2.400
  218    HB   VAL  24           HB       VAL  24  -3.220   8.525  -2.606
  219   1HG1  VAL  24          1HG1      VAL  24  -5.540   9.761  -4.166
  220   2HG1  VAL  24          2HG1      VAL  24  -5.541   8.183  -3.359
  221   3HG1  VAL  24          3HG1      VAL  24  -5.421   9.659  -2.402
  222   1HG2  VAL  24          1HG2      VAL  24  -3.637   8.902  -5.601
  223   2HG2  VAL  24          2HG2      VAL  24  -2.136   8.352  -4.820
  224   3HG2  VAL  24          3HG2      VAL  24  -3.618   7.382  -4.689
  225    H    GLN  25           H        GLN  25  -1.334  11.014  -5.317
  226    HA   GLN  25           HA       GLN  25   1.169  10.095  -4.402
  227   1HB   GLN  25          1HB       GLN  25   0.194  11.987  -6.512
  228   2HB   GLN  25          2HB       GLN  25   1.876  12.132  -5.998
  229   1HG   GLN  25          1HG       GLN  25   1.798  10.619  -7.827
  230   2HG   GLN  25          2HG       GLN  25   2.285   9.767  -6.364
  231   1HE2  GLN  25          1HE2      GLN  25   1.725   7.805  -7.622
  232   2HE2  GLN  25          2HE2      GLN  25   0.057   7.292  -7.738
  233    H    GLY  26           H        GLY  26   2.679  10.912  -3.068
  234   1HA   GLY  26          1HA       GLY  26   3.783  12.300  -1.644
  235   2HA   GLY  26          2HA       GLY  26   2.840  13.670  -2.239
  236    H    VAL  27           H        VAL  27   0.818  11.070  -1.182
  237    HA   VAL  27           HA       VAL  27   0.636  12.090   1.605
  238    HB   VAL  27           HB       VAL  27  -1.725  11.412  -0.204
  239   1HG1  VAL  27          1HG1      VAL  27  -1.522  12.456   2.652
  240   2HG1  VAL  27          2HG1      VAL  27  -3.012  12.507   1.706
  241   3HG1  VAL  27          3HG1      VAL  27  -2.290  10.948   2.097
  242   1HG2  VAL  27          1HG2      VAL  27  -0.689  14.129   0.715
  243   2HG2  VAL  27          2HG2      VAL  27  -0.781  13.540  -0.962
  244   3HG2  VAL  27          3HG2      VAL  27  -2.260  13.854  -0.059
  245    H    GLY  28           H        GLY  28  -0.088  10.471   3.099
  246   1HA   GLY  28          1HA       GLY  28   1.097   7.893   2.492
  247   2HA   GLY  28          2HA       GLY  28   0.456   8.458   4.037
  248    H    PHE  29           H        PHE  29  -1.188   8.137   0.851
  249    HA   PHE  29           HA       PHE  29  -3.517   6.801   1.831
  250   1HB   PHE  29          1HB       PHE  29  -3.499   7.948  -0.312
  251   2HB   PHE  29          2HB       PHE  29  -2.183   6.941  -0.917
  252    HD1  PHE  29           1HD      PHE  29  -5.779   7.202  -0.471
  253    HD2  PHE  29           2HD      PHE  29  -2.586   4.525  -1.521
  254    HE1  PHE  29           1HE      PHE  29  -7.440   5.409  -0.952
  255    HE2  PHE  29           2HE      PHE  29  -4.220   2.725  -1.930
  256    HZ   PHE  29           HZ       PHE  29  -6.655   3.143  -1.602
  257    H    ARG  30           H        ARG  30  -0.557   5.612   0.218
  258    HA   ARG  30           HA       ARG  30  -1.160   2.888   0.245
  259   1HB   ARG  30          1HB       ARG  30   1.225   2.553  -0.097
  260   2HB   ARG  30          2HB       ARG  30   0.575   3.855  -1.107
  261   1HG   ARG  30          1HG       ARG  30   1.522   5.450   0.771
  262   2HG   ARG  30          2HG       ARG  30   2.415   4.011   1.293
  263   1HD   ARG  30          1HD       ARG  30   3.121   3.828  -1.232
  264   2HD   ARG  30          2HD       ARG  30   2.555   5.485  -1.371
  265    HE   ARG  30           HE       ARG  30   4.970   4.473  -0.105
  266   1HH1  ARG  30          1HH1      ARG  30   2.735   7.239  -0.082
  267   2HH1  ARG  30          2HH1      ARG  30   3.971   8.369   0.406
  268   1HH2  ARG  30          1HH2      ARG  30   6.551   5.936   0.371
  269   2HH2  ARG  30          2HH2      ARG  30   6.179   7.609   0.742
  270    H    LYS  31           H        LYS  31   0.298   4.893   2.804
  271    HA   LYS  31           HA       LYS  31   1.046   2.699   4.525
  272   1HB   LYS  31          1HB       LYS  31   2.079   4.985   4.548
  273   2HB   LYS  31          2HB       LYS  31   0.564   5.646   5.155
  274   1HG   LYS  31          1HG       LYS  31   0.719   4.374   7.208
  275   2HG   LYS  31          2HG       LYS  31   2.115   3.457   6.603
  276   1HD   LYS  31          1HD       LYS  31   3.513   5.451   6.614
  277   2HD   LYS  31          2HD       LYS  31   2.114   6.484   6.960
  278   1HE   LYS  31          1HE       LYS  31   3.374   6.187   9.006
  279   2HE   LYS  31          2HE       LYS  31   1.824   5.342   9.164
  280   1HZ   LYS  31          1HZ       LYS  31   3.549   3.905   9.923
  281   2HZ   LYS  31          2HZ       LYS  31   4.376   4.032   8.458
  282    H    PHE  32           H        PHE  32  -1.688   5.054   4.466
  283    HA   PHE  32           HA       PHE  32  -3.106   4.049   6.589
  284   1HB   PHE  32          1HB       PHE  32  -3.743   6.011   5.275
  285   2HB   PHE  32          2HB       PHE  32  -4.299   4.981   3.966
  286    HD1  PHE  32           1HD      PHE  32  -5.119   3.757   7.373
  287    HD2  PHE  32           2HD      PHE  32  -6.463   6.178   4.045
  288    HE1  PHE  32           1HE      PHE  32  -7.371   3.762   8.293
  289    HE2  PHE  32           2HE      PHE  32  -8.734   6.216   5.030
  290    HZ   PHE  32           HZ       PHE  32  -9.199   5.016   7.151
  291    H    VAL  33           H        VAL  33  -3.112   2.824   3.213
  292    HA   VAL  33           HA       VAL  33  -4.951   0.641   3.692
  293    HB   VAL  33           HB       VAL  33  -2.909   1.102   1.477
  294   1HG1  VAL  33          1HG1      VAL  33  -5.119  -0.989   1.667
  295   2HG1  VAL  33          2HG1      VAL  33  -4.152  -0.639   0.225
  296   3HG1  VAL  33          3HG1      VAL  33  -3.369  -1.327   1.648
  297   1HG2  VAL  33          1HG2      VAL  33  -5.953   1.378   1.552
  298   2HG2  VAL  33          2HG2      VAL  33  -4.799   2.729   1.490
  299   3HG2  VAL  33          3HG2      VAL  33  -4.925   1.600   0.131
  300    H    GLN  34           H        GLN  34  -1.514   1.071   4.266
  301    HA   GLN  34           HA       GLN  34  -0.962  -1.758   4.541
  302   1HB   GLN  34          1HB       GLN  34   0.577   0.590   5.779
  303   2HB   GLN  34          2HB       GLN  34   1.023  -1.093   5.840
  304   1HG   GLN  34          1HG       GLN  34   1.223   0.765   3.533
  305   2HG   GLN  34          2HG       GLN  34   2.403  -0.324   4.226
  306   1HE2  GLN  34          1HE2      GLN  34  -0.431  -0.031   2.168
  307   2HE2  GLN  34          2HE2      GLN  34  -0.297  -1.605   1.389
  308    H    ILE  35           H        ILE  35  -1.656   0.777   7.024
  309    HA   ILE  35           HA       ILE  35  -1.470  -0.743   9.244
  310    HB   ILE  35           HB       ILE  35  -3.805   1.161   8.709
  311   1HG1  ILE  35          1HG1      ILE  35  -1.722   2.342   8.270
  312   2HG1  ILE  35          2HG1      ILE  35  -2.492   2.932   9.728
  313   1HG2  ILE  35          1HG2      ILE  35  -3.722   1.534  11.200
  314   2HG2  ILE  35          2HG2      ILE  35  -4.275  -0.071  10.724
  315   3HG2  ILE  35          3HG2      ILE  35  -2.621   0.142  11.318
  316   1HD1  ILE  35          1HD1      ILE  35  -0.066   2.747   9.999
  317   2HD1  ILE  35          2HD1      ILE  35  -0.899   1.664  11.124
  318   3HD1  ILE  35          3HD1      ILE  35  -0.124   1.010   9.660
  319    H    HIS  36           H        HIS  36  -4.603  -0.757   7.426
  320    HA   HIS  36           HA       HIS  36  -5.676  -2.760   9.230
  321   1HB   HIS  36          1HB       HIS  36  -6.603  -1.549   6.627
  322   2HB   HIS  36          2HB       HIS  36  -7.388  -2.985   7.298
  323    HD2  HIS  36           2HD      HIS  36  -6.277   0.235   9.382
  324    HE1  HIS  36           1HE      HIS  36 -10.401  -0.537   9.932
  325    HE2  HIS  36           2HE      HIS  36  -8.450   0.957  10.633
  326    H    ALA  37           H        ALA  37  -4.465  -2.913   5.842
  327    HA   ALA  37           HA       ALA  37  -4.597  -5.558   5.298
  328   1HB   ALA  37          1HB       ALA  37  -2.557  -5.212   3.931
  329   2HB   ALA  37          2HB       ALA  37  -3.759  -3.931   3.744
  330   3HB   ALA  37          3HB       ALA  37  -2.296  -3.664   4.701
  331    H    ILE  38           H        ILE  38  -1.564  -4.187   6.567
  332    HA   ILE  38           HA       ILE  38  -0.181  -6.333   7.456
  333    HB   ILE  38           HB       ILE  38  -0.328  -3.454   8.249
  334   1HG1  ILE  38          1HG1      ILE  38   1.968  -3.464   7.450
  335   2HG1  ILE  38          2HG1      ILE  38   1.987  -5.227   7.352
  336   1HG2  ILE  38          1HG2      ILE  38   1.553  -3.662   9.785
  337   2HG2  ILE  38          2HG2      ILE  38   0.046  -4.295  10.429
  338   3HG2  ILE  38          3HG2      ILE  38   1.300  -5.422   9.845
  339   1HD1  ILE  38          1HD1      ILE  38   1.775  -4.102   5.147
  340   2HD1  ILE  38          2HD1      ILE  38   0.405  -5.175   5.466
  341   3HD1  ILE  38          3HD1      ILE  38   0.229  -3.418   5.641
  342    H    ARG  39           H        ARG  39  -2.713  -4.581   9.397
  343    HA   ARG  39           HA       ARG  39  -2.250  -6.166  11.750
  344   1HB   ARG  39          1HB       ARG  39  -3.198  -3.840  11.662
  345   2HB   ARG  39          2HB       ARG  39  -4.676  -4.460  10.908
  346   1HG   ARG  39          1HG       ARG  39  -3.696  -5.634  13.501
  347   2HG   ARG  39          2HG       ARG  39  -4.390  -4.000  13.510
  348   1HD   ARG  39          1HD       ARG  39  -6.516  -4.786  12.634
  349   2HD   ARG  39          2HD       ARG  39  -5.859  -6.394  12.353
  350    HE   ARG  39           HE       ARG  39  -6.151  -6.980  14.513
  351   1HH1  ARG  39          1HH1      ARG  39  -6.460  -3.443  14.334
  352   2HH1  ARG  39          2HH1      ARG  39  -7.035  -3.292  15.975
  353   1HH2  ARG  39          1HH2      ARG  39  -6.912  -6.761  16.648
  354   2HH2  ARG  39          2HH2      ARG  39  -7.293  -5.187  17.295
  355    H    LEU  40           H        LEU  40  -4.354  -6.558   8.942
  356    HA   LEU  40           HA       LEU  40  -5.479  -9.046  10.131
  357   1HB   LEU  40          1HB       LEU  40  -6.268  -7.440   7.705
  358   2HB   LEU  40          2HB       LEU  40  -7.121  -8.860   8.329
  359    HG   LEU  40           HG       LEU  40  -6.728  -6.263   9.908
  360   1HD1  LEU  40          1HD1      LEU  40  -9.102  -5.909   9.431
  361   2HD1  LEU  40          2HD1      LEU  40  -8.139  -5.960   7.937
  362   3HD1  LEU  40          3HD1      LEU  40  -9.109  -7.377   8.414
  363   1HD2  LEU  40          1HD2      LEU  40  -8.498  -7.222  11.371
  364   2HD2  LEU  40          2HD2      LEU  40  -8.433  -8.741  10.455
  365   3HD2  LEU  40          3HD2      LEU  40  -7.040  -8.211  11.419
  366    H    GLY  41           H        GLY  41  -2.637  -8.719   8.955
  367   1HA   GLY  41          1HA       GLY  41  -1.188 -10.048   7.835
  368   2HA   GLY  41          2HA       GLY  41  -2.353 -11.346   8.119
  369    H    ILE  42           H        ILE  42  -1.886  -8.514   5.948
  370    HA   ILE  42           HA       ILE  42  -2.715 -10.155   3.594
  371    HB   ILE  42           HB       ILE  42  -2.981  -7.238   4.233
  372   1HG1  ILE  42          1HG1      ILE  42  -4.733  -8.653   5.192
  373   2HG1  ILE  42          2HG1      ILE  42  -5.344  -7.492   4.003
  374   1HG2  ILE  42          1HG2      ILE  42  -4.046  -6.848   2.061
  375   2HG2  ILE  42          2HG2      ILE  42  -2.342  -7.282   1.907
  376   3HG2  ILE  42          3HG2      ILE  42  -3.586  -8.474   1.540
  377   1HD1  ILE  42          1HD1      ILE  42  -6.454  -9.650   3.779
  378   2HD1  ILE  42          2HD1      ILE  42  -5.541  -9.255   2.325
  379   3HD1  ILE  42          3HD1      ILE  42  -4.909 -10.456   3.486
  380    H    LYS  43           H        LYS  43  -1.393 -10.183   1.903
  381    HA   LYS  43           HA       LYS  43   1.392  -9.107   2.195
  382   1HB   LYS  43          1HB       LYS  43   0.410 -11.203   0.279
  383   2HB   LYS  43          2HB       LYS  43   2.065 -10.758   0.673
  384   1HG   LYS  43          1HG       LYS  43   1.765 -11.570   2.998
  385   2HG   LYS  43          2HG       LYS  43   0.092 -12.029   2.621
  386   1HD   LYS  43          1HD       LYS  43   0.925 -13.595   0.865
  387   2HD   LYS  43          2HD       LYS  43   2.586 -13.164   1.303
  388   1HE   LYS  43          1HE       LYS  43   2.035 -15.247   2.397
  389   2HE   LYS  43          2HE       LYS  43   2.175 -13.983   3.629
  390   1HZ   LYS  43          1HZ       LYS  43  -0.298 -13.830   3.508
  391   2HZ   LYS  43          2HZ       LYS  43   0.194 -15.395   3.906
  392    H    GLY  44           H        GLY  44   2.313  -8.345   0.000
  393   1HA   GLY  44          1HA       GLY  44   1.076  -8.041  -2.362
  394   2HA   GLY  44          2HA       GLY  44   0.315  -6.728  -1.432
  395    H    TYR  45           H        TYR  45   1.128  -5.103  -2.680
  396    HA   TYR  45           HA       TYR  45   3.410  -3.962  -1.512
  397   1HB   TYR  45          1HB       TYR  45   4.444  -5.481  -3.376
  398   2HB   TYR  45          2HB       TYR  45   3.839  -4.241  -4.460
  399    HD1  TYR  45           1HD      TYR  45   4.721  -1.895  -4.272
  400    HD2  TYR  45           2HD      TYR  45   6.355  -5.146  -1.965
  401    HE1  TYR  45           1HE      TYR  45   6.483  -0.410  -3.437
  402    HE2  TYR  45           2HE      TYR  45   8.306  -3.730  -1.377
  403    HH   TYR  45           HH       TYR  45   9.111  -1.576  -1.248
  404    H    ALA  46           H        ALA  46   3.343  -1.702  -1.798
  405    HA   ALA  46           HA       ALA  46   1.030  -0.618  -3.348
  406   1HB   ALA  46          1HB       ALA  46   1.000   1.153  -1.806
  407   2HB   ALA  46          2HB       ALA  46   0.868  -0.410  -0.981
  408   3HB   ALA  46          3HB       ALA  46   2.382   0.494  -0.912
  409    H    LYS  47           H        LYS  47   2.260  -0.502  -5.349
  410    HA   LYS  47           HA       LYS  47   4.840   0.917  -5.369
  411   1HB   LYS  47          1HB       LYS  47   4.855  -1.078  -6.551
  412   2HB   LYS  47          2HB       LYS  47   3.283  -0.780  -7.278
  413   1HG   LYS  47          1HG       LYS  47   4.137   0.591  -8.951
  414   2HG   LYS  47          2HG       LYS  47   5.504   1.107  -7.965
  415   1HD   LYS  47          1HD       LYS  47   6.307  -0.297  -9.762
  416   2HD   LYS  47          2HD       LYS  47   6.544  -1.129  -8.217
  417   1HE   LYS  47          1HE       LYS  47   4.449  -2.463  -8.664
  418   2HE   LYS  47          2HE       LYS  47   4.302  -1.642 -10.232
  419   1HZ   LYS  47          1HZ       LYS  47   5.444  -3.719 -10.506
  420   2HZ   LYS  47          2HZ       LYS  47   6.650  -3.236  -9.427
  421    H    ASN  48           H        ASN  48   4.019   2.914  -4.717
  422    HA   ASN  48           HA       ASN  48   2.242   4.462  -6.382
  423   1HB   ASN  48          1HB       ASN  48   2.570   4.771  -3.918
  424   2HB   ASN  48          2HB       ASN  48   4.188   5.394  -4.237
  425   1HD2  ASN  48          2HD2      ASN  48   1.148   6.391  -3.492
  426   2HD2  ASN  48          1HD2      ASN  48   1.117   7.945  -4.294
  427    H    LEU  49           H        LEU  49   3.112   4.191  -8.472
  428    HA   LEU  49           HA       LEU  49   5.585   5.376  -9.277
  429   1HB   LEU  49          1HB       LEU  49   3.155   5.382 -11.049
  430   2HB   LEU  49          2HB       LEU  49   4.854   5.113 -11.414
  431    HG   LEU  49           HG       LEU  49   4.321   2.888  -9.889
  432   1HD1  LEU  49          1HD1      LEU  49   2.092   2.087 -10.309
  433   2HD1  LEU  49          2HD1      LEU  49   1.842   3.760  -9.833
  434   3HD1  LEU  49          3HD1      LEU  49   1.789   3.321 -11.542
  435   1HD2  LEU  49          1HD2      LEU  49   4.101   1.663 -12.001
  436   2HD2  LEU  49          2HD2      LEU  49   3.815   3.187 -12.872
  437   3HD2  LEU  49          3HD2      LEU  49   5.382   2.884 -12.093
  438    HA   PRO  50           HA       PRO  50   3.727   9.315  -8.116
  439   1HB   PRO  50          1HB       PRO  50   5.776  11.038  -8.469
  440   2HB   PRO  50          2HB       PRO  50   5.784   9.745  -7.241
  441   1HG   PRO  50          1HG       PRO  50   7.035   9.614 -10.005
  442   2HG   PRO  50          2HG       PRO  50   7.817   9.261  -8.434
  443   1HD   PRO  50          1HD       PRO  50   6.725   7.279  -9.981
  444   2HD   PRO  50          2HD       PRO  50   6.612   7.231  -8.196
  445    H    ASP  51           H        ASP  51   2.343   8.748 -10.108
  446    HA   ASP  51           HA       ASP  51   2.069  11.184 -11.640
  447   1HB   ASP  51          1HB       ASP  51   3.683   9.974 -13.086
  448   2HB   ASP  51          2HB       ASP  51   2.618   8.562 -13.102
  449    HD2  ASP  51           HD       ASP  51   1.310   9.811 -16.054
  450    H    GLY  52           H        GLY  52   0.475  10.460  -9.706
  451   1HA   GLY  52          1HA       GLY  52  -1.776  10.466  -9.372
  452   2HA   GLY  52          2HA       GLY  52  -2.042  10.087 -11.071
  453    H    SER  53           H        SER  53  -0.947   7.659 -11.473
  454    HA   SER  53           HA       SER  53  -3.089   6.115 -10.254
  455   1HB   SER  53          1HB       SER  53  -1.227   5.346 -12.506
  456   2HB   SER  53          2HB       SER  53  -2.854   4.715 -12.116
  457    HG   SER  53           HG       SER  53  -3.567   6.931 -12.479
  458    H    VAL  54           H        VAL  54  -1.760   6.053  -8.160
  459    HA   VAL  54           HA       VAL  54   0.441   4.199  -7.943
  460    HB   VAL  54           HB       VAL  54   0.391   5.637  -6.187
  461   1HG1  VAL  54          1HG1      VAL  54  -2.546   5.154  -5.724
  462   2HG1  VAL  54          2HG1      VAL  54  -1.474   6.082  -4.668
  463   3HG1  VAL  54          3HG1      VAL  54  -1.780   6.640  -6.320
  464   1HG2  VAL  54          1HG2      VAL  54  -1.064   3.271  -4.925
  465   2HG2  VAL  54          2HG2      VAL  54   0.622   3.183  -5.457
  466   3HG2  VAL  54          3HG2      VAL  54   0.146   4.319  -4.181
  467    H    GLU  55           H        GLU  55   0.405   2.096  -8.289
  468    HA   GLU  55           HA       GLU  55  -2.144   0.636  -8.140
  469   1HB   GLU  55          1HB       GLU  55  -1.140  -1.100  -9.240
  470   2HB   GLU  55          2HB       GLU  55  -0.747   0.408 -10.084
  471   1HG   GLU  55          1HG       GLU  55   1.541   0.285  -8.921
  472   2HG   GLU  55          2HG       GLU  55   1.091  -1.354  -8.419
  473    HE2  GLU  55           HE       GLU  55   1.766  -2.790 -11.469
  474    H    VAL  56           H        VAL  56  -2.736  -0.331  -6.371
  475    HA   VAL  56           HA       VAL  56  -0.758  -1.438  -4.440
  476    HB   VAL  56           HB       VAL  56  -3.758  -1.007  -4.247
  477   1HG1  VAL  56          1HG1      VAL  56  -1.777  -2.199  -2.271
  478   2HG1  VAL  56          2HG1      VAL  56  -3.436  -1.709  -1.854
  479   3HG1  VAL  56          3HG1      VAL  56  -3.178  -3.022  -3.000
  480   1HG2  VAL  56          1HG2      VAL  56  -1.418   0.313  -2.791
  481   2HG2  VAL  56          2HG2      VAL  56  -2.478   1.101  -3.982
  482   3HG2  VAL  56          3HG2      VAL  56  -3.132   0.575  -2.423
  483    H    VAL  57           H        VAL  57  -0.748  -3.660  -4.121
  484    HA   VAL  57           HA       VAL  57  -2.617  -5.352  -5.659
  485    HB   VAL  57           HB       VAL  57  -0.832  -5.027  -7.192
  486   1HG1  VAL  57          1HG1      VAL  57   1.147  -5.970  -5.103
  487   2HG1  VAL  57          2HG1      VAL  57   1.468  -5.667  -6.831
  488   3HG1  VAL  57          3HG1      VAL  57   0.997  -4.336  -5.793
  489   1HG2  VAL  57          1HG2      VAL  57  -0.574  -7.822  -6.017
  490   2HG2  VAL  57          2HG2      VAL  57  -1.878  -7.251  -7.077
  491   3HG2  VAL  57          3HG2      VAL  57  -0.209  -7.299  -7.669
  492    H    ALA  58           H        ALA  58  -3.384  -5.181  -3.463
  493    HA   ALA  58           HA       ALA  58  -2.065  -6.581  -1.295
  494   1HB   ALA  58          1HB       ALA  58  -4.492  -6.412  -0.366
  495   2HB   ALA  58          2HB       ALA  58  -3.603  -4.902  -0.652
  496   3HB   ALA  58          3HB       ALA  58  -4.818  -5.437  -1.808
  497    H    GLU  59           H        GLU  59  -2.578  -8.656  -0.549
  498    HA   GLU  59           HA       GLU  59  -4.217 -10.352  -2.318
  499   1HB   GLU  59          1HB       GLU  59  -1.737 -11.064  -0.760
  500   2HB   GLU  59          2HB       GLU  59  -2.659 -12.108  -1.856
  501   1HG   GLU  59          1HG       GLU  59  -2.190 -10.467  -3.715
  502   2HG   GLU  59          2HG       GLU  59  -1.121  -9.602  -2.604
  503    HE2  GLU  59           HE       GLU  59   0.305 -12.665  -4.598
  504    H    GLY  60           H        GLY  60  -6.051 -11.267  -1.167
  505   1HA   GLY  60          1HA       GLY  60  -5.796 -11.769   1.763
  506   2HA   GLY  60          2HA       GLY  60  -7.034 -10.660   1.158
  507    H    TYR  61           H        TYR  61  -7.486 -12.858   2.735
  508    HA   TYR  61           HA       TYR  61  -8.317 -15.201   1.293
  509   1HB   TYR  61          1HB       TYR  61  -8.418 -14.120   4.109
  510   2HB   TYR  61          2HB       TYR  61  -9.491 -15.439   3.720
  511    HD1  TYR  61           1HD      TYR  61  -5.867 -14.503   3.751
  512    HD2  TYR  61           2HD      TYR  61  -8.771 -17.688   3.779
  513    HE1  TYR  61           1HE      TYR  61  -4.226 -15.998   4.862
  514    HE2  TYR  61           2HE      TYR  61  -7.130 -19.179   4.875
  515    HH   TYR  61           HH       TYR  61  -5.062 -19.321   5.892
  516    H    GLU  62           H        GLU  62 -10.493 -13.619   3.562
  517    HA   GLU  62           HA       GLU  62 -12.620 -13.134   1.577
  518   1HB   GLU  62          1HB       GLU  62 -12.637 -15.346   3.670
  519   2HB   GLU  62          2HB       GLU  62 -14.090 -14.687   2.879
  520   1HG   GLU  62          1HG       GLU  62 -13.098 -15.379   0.662
  521   2HG   GLU  62          2HG       GLU  62 -11.783 -16.176   1.551
  522    HE2  GLU  62           HE       GLU  62 -14.258 -18.722   0.789
  523    H    GLU  63           H        GLU  63 -12.912 -13.988   5.076
  524    HA   GLU  63           HA       GLU  63 -14.077 -11.712   5.922
  525   1HB   GLU  63          1HB       GLU  63 -13.422 -12.277   8.137
  526   2HB   GLU  63          2HB       GLU  63 -13.906 -13.662   7.182
  527   1HG   GLU  63          1HG       GLU  63 -12.145 -14.484   8.411
  528   2HG   GLU  63          2HG       GLU  63 -11.437 -14.213   6.824
  529    HE2  GLU  63           HE       GLU  63 -10.423 -11.317   9.477
  530    H    ALA  64           H        ALA  64 -10.504 -12.297   5.779
  531    HA   ALA  64           HA       ALA  64  -9.754  -9.629   6.526
  532   1HB   ALA  64          1HB       ALA  64  -7.522 -10.296   5.701
  533   2HB   ALA  64          2HB       ALA  64  -8.211 -11.535   6.752
  534   3HB   ALA  64          3HB       ALA  64  -8.217 -11.769   4.989
  535    H    LEU  65           H        LEU  65 -10.815 -11.049   3.490
  536    HA   LEU  65           HA       LEU  65  -9.705  -8.997   1.759
  537   1HB   LEU  65          1HB       LEU  65 -10.426 -11.212   0.928
  538   2HB   LEU  65          2HB       LEU  65 -12.106 -10.757   1.257
  539    HG   LEU  65           HG       LEU  65 -11.829  -8.793  -0.235
  540   1HD1  LEU  65          1HD1      LEU  65 -10.009  -8.943  -1.952
  541   2HD1  LEU  65          2HD1      LEU  65  -9.343  -8.631  -0.346
  542   3HD1  LEU  65          3HD1      LEU  65  -9.262 -10.266  -1.030
  543   1HD2  LEU  65          1HD2      LEU  65 -12.030 -10.181  -2.271
  544   2HD2  LEU  65          2HD2      LEU  65 -11.447 -11.585  -1.331
  545   3HD2  LEU  65          3HD2      LEU  65 -12.988 -10.797  -0.908
  546    H    SER  66           H        SER  66 -13.085  -9.616   2.721
  547    HA   SER  66           HA       SER  66 -14.334  -7.267   2.207
  548   1HB   SER  66          1HB       SER  66 -15.391  -9.295   3.036
  549   2HB   SER  66          2HB       SER  66 -14.767  -8.959   4.669
  550    HG   SER  66           HG       SER  66 -15.929  -6.933   4.523
  551    H    LYS  67           H        LYS  67 -12.427  -7.907   5.216
  552    HA   LYS  67           HA       LYS  67 -13.193  -5.433   6.441
  553   1HB   LYS  67          1HB       LYS  67 -11.218  -7.607   7.044
  554   2HB   LYS  67          2HB       LYS  67 -10.888  -6.002   7.701
  555   1HG   LYS  67          1HG       LYS  67 -12.145  -7.223   9.338
  556   2HG   LYS  67          2HG       LYS  67 -13.096  -5.865   8.728
  557   1HD   LYS  67          1HD       LYS  67 -14.313  -7.504   7.206
  558   2HD   LYS  67          2HD       LYS  67 -13.414  -8.807   8.020
  559   1HE   LYS  67          1HE       LYS  67 -14.385  -8.122  10.189
  560   2HE   LYS  67          2HE       LYS  67 -15.297  -6.833   9.372
  561   1HZ   LYS  67          1HZ       LYS  67 -16.669  -8.777   9.600
  562   2HZ   LYS  67          2HZ       LYS  67 -15.569  -9.694   8.704
  563    H    LEU  68           H        LEU  68 -10.317  -6.268   4.436
  564    HA   LEU  68           HA       LEU  68  -9.220  -3.588   4.696
  565   1HB   LEU  68          1HB       LEU  68  -7.885  -5.574   4.588
  566   2HB   LEU  68          2HB       LEU  68  -8.528  -6.002   3.003
  567    HG   LEU  68           HG       LEU  68  -6.176  -5.040   3.291
  568   1HD1  LEU  68          1HD1      LEU  68  -6.205  -4.011   1.072
  569   2HD1  LEU  68          2HD1      LEU  68  -7.148  -5.505   1.176
  570   3HD1  LEU  68          3HD1      LEU  68  -7.981  -3.933   1.124
  571   1HD2  LEU  68          1HD2      LEU  68  -5.827  -2.689   3.130
  572   2HD2  LEU  68          2HD2      LEU  68  -7.548  -2.335   3.126
  573   3HD2  LEU  68          3HD2      LEU  68  -6.790  -3.003   4.590
  574    H    LEU  69           H        LEU  69 -11.577  -5.160   2.588
  575    HA   LEU  69           HA       LEU  69 -11.383  -3.160   0.502
  576   1HB   LEU  69          1HB       LEU  69 -12.990  -5.596   1.108
  577   2HB   LEU  69          2HB       LEU  69 -13.946  -4.326   0.379
  578    HG   LEU  69           HG       LEU  69 -13.040  -5.941  -1.218
  579   1HD1  LEU  69          1HD1      LEU  69 -12.353  -4.309  -2.907
  580   2HD1  LEU  69          2HD1      LEU  69 -13.629  -3.612  -1.894
  581   3HD1  LEU  69          3HD1      LEU  69 -11.936  -3.130  -1.655
  582   1HD2  LEU  69          1HD2      LEU  69 -10.709  -5.946  -1.882
  583   2HD2  LEU  69          2HD2      LEU  69 -10.294  -4.759  -0.633
  584   3HD2  LEU  69          3HD2      LEU  69 -10.841  -6.382  -0.168
  585    H    GLU  70           H        GLU  70 -13.838  -3.813   3.037
  586    HA   GLU  70           HA       GLU  70 -15.322  -1.509   2.486
  587   1HB   GLU  70          1HB       GLU  70 -16.582  -2.045   4.425
  588   2HB   GLU  70          2HB       GLU  70 -16.041  -3.569   3.715
  589   1HG   GLU  70          1HG       GLU  70 -14.135  -3.538   5.434
  590   2HG   GLU  70          2HG       GLU  70 -14.947  -2.167   6.195
  591    HE2  GLU  70           HE       GLU  70 -16.785  -5.801   6.306
  592    H    ARG  71           H        ARG  71 -12.626  -2.007   4.730
  593    HA   ARG  71           HA       ARG  71 -12.203   0.350   6.057
  594   1HB   ARG  71          1HB       ARG  71 -10.568  -1.251   6.342
  595   2HB   ARG  71          2HB       ARG  71 -10.568  -1.674   4.634
  596   1HG   ARG  71          1HG       ARG  71  -8.443  -0.861   5.160
  597   2HG   ARG  71          2HG       ARG  71  -9.230   0.199   4.023
  598   1HD   ARG  71          1HD       ARG  71  -9.767   1.724   6.087
  599   2HD   ARG  71          2HD       ARG  71  -8.657   0.686   6.960
  600    HE   ARG  71           HE       ARG  71  -6.849   1.505   5.765
  601   1HH1  ARG  71          1HH1      ARG  71  -9.863   2.835   4.407
  602   2HH1  ARG  71          2HH1      ARG  71  -9.035   3.729   3.167
  603   1HH2  ARG  71          1HH2      ARG  71  -5.832   2.558   4.015
  604   2HH2  ARG  71          2HH2      ARG  71  -6.744   3.557   2.916
  605    H    ILE  72           H        ILE  72 -11.573  -0.189   2.547
  606    HA   ILE  72           HA       ILE  72 -10.631   2.533   2.151
  607    HB   ILE  72           HB       ILE  72 -11.310   0.375   0.158
  608   1HG1  ILE  72          1HG1      ILE  72  -8.549   1.416   0.947
  609   2HG1  ILE  72          2HG1      ILE  72  -9.304   0.105   1.840
  610   1HG2  ILE  72          1HG2      ILE  72 -10.074   1.805  -1.459
  611   2HG2  ILE  72          2HG2      ILE  72 -11.486   2.658  -0.848
  612   3HG2  ILE  72          3HG2      ILE  72  -9.881   3.054  -0.213
  613   1HD1  ILE  72          1HD1      ILE  72  -7.896  -0.864   0.140
  614   2HD1  ILE  72          2HD1      ILE  72  -9.597  -1.235  -0.203
  615   3HD1  ILE  72          3HD1      ILE  72  -8.751   0.012  -1.144
  616    H    LYS  73           H        LYS  73 -13.422   0.836   0.738
  617    HA   LYS  73           HA       LYS  73 -14.672   2.973  -0.376
  618   1HB   LYS  73          1HB       LYS  73 -15.884   0.428   0.738
  619   2HB   LYS  73          2HB       LYS  73 -16.842   1.685  -0.046
  620   1HG   LYS  73          1HG       LYS  73 -16.435   0.318  -1.828
  621   2HG   LYS  73          2HG       LYS  73 -15.193   1.542  -2.019
  622   1HD   LYS  73          1HD       LYS  73 -13.829  -0.368  -0.550
  623   2HD   LYS  73          2HD       LYS  73 -15.020  -1.379  -1.335
  624   1HE   LYS  73          1HE       LYS  73 -12.957  -1.303  -2.648
  625   2HE   LYS  73          2HE       LYS  73 -14.224  -0.460  -3.556
  626   1HZ   LYS  73          1HZ       LYS  73 -12.213   0.829  -3.543
  627   2HZ   LYS  73          2HZ       LYS  73 -12.236   0.895  -1.855
  628    H    GLN  74           H        GLN  74 -15.388   1.751   2.934
  629    HA   GLN  74           HA       GLN  74 -17.245   3.892   3.495
  630   1HB   GLN  74          1HB       GLN  74 -17.511   1.599   4.368
  631   2HB   GLN  74          2HB       GLN  74 -16.022   1.774   5.307
  632   1HG   GLN  74          1HG       GLN  74 -18.006   2.063   6.694
  633   2HG   GLN  74          2HG       GLN  74 -17.021   3.522   6.685
  634   1HE2  GLN  74          1HE2      GLN  74 -17.869   5.441   5.740
  635   2HE2  GLN  74          2HE2      GLN  74 -19.557   5.580   5.284
  636    H    GLY  75           H        GLY  75 -13.796   3.286   4.161
  637   1HA   GLY  75          1HA       GLY  75 -13.606   5.722   5.892
  638   2HA   GLY  75          2HA       GLY  75 -12.520   4.354   5.864
  639    HA   PRO  76           HA       PRO  76 -11.723   6.750   1.759
  640   1HB   PRO  76          1HB       PRO  76 -12.263   9.449   1.670
  641   2HB   PRO  76          2HB       PRO  76 -13.466   8.187   1.273
  642   1HG   PRO  76          1HG       PRO  76 -13.068   9.571   3.944
  643   2HG   PRO  76          2HG       PRO  76 -14.592   9.409   3.019
  644   1HD   PRO  76          1HD       PRO  76 -14.002   7.692   5.003
  645   2HD   PRO  76          2HD       PRO  76 -14.705   7.070   3.476
  646    HA   PRO  77           HA       PRO  77  -7.887   8.182   3.457
  647   1HB   PRO  77          1HB       PRO  77  -6.472   8.885   1.255
  648   2HB   PRO  77          2HB       PRO  77  -7.095   7.222   1.476
  649   1HG   PRO  77          1HG       PRO  77  -8.427   9.485  -0.069
  650   2HG   PRO  77          2HG       PRO  77  -8.027   7.859  -0.690
  651   1HD   PRO  77          1HD       PRO  77 -10.488   8.402   0.290
  652   2HD   PRO  77          2HD       PRO  77  -9.696   6.836   0.637
  653    H    ALA  78           H        ALA  78  -6.298  10.058   3.442
  654    HA   ALA  78           HA       ALA  78  -7.760  12.588   3.721
  655   1HB   ALA  78          1HB       ALA  78  -5.779  13.300   4.956
  656   2HB   ALA  78          2HB       ALA  78  -6.362  11.738   5.553
  657   3HB   ALA  78          3HB       ALA  78  -4.930  11.802   4.504
  658    H    ALA  79           H        ALA  79  -7.081  11.461   0.959
  659    HA   ALA  79           HA       ALA  79  -5.774  13.909  -0.097
  660   1HB   ALA  79          1HB       ALA  79  -4.862  12.314  -1.861
  661   2HB   ALA  79          2HB       ALA  79  -4.062  12.280  -0.280
  662   3HB   ALA  79          3HB       ALA  79  -5.208  11.001  -0.703
  663    H    GLU  80           H        GLU  80  -6.366  14.215  -2.382
  664    HA   GLU  80           HA       GLU  80  -9.192  13.689  -2.871
  665   1HB   GLU  80          1HB       GLU  80  -7.849  15.841  -3.379
  666   2HB   GLU  80          2HB       GLU  80  -7.243  15.002  -4.806
  667   1HG   GLU  80          1HG       GLU  80 -10.132  15.667  -4.095
  668   2HG   GLU  80          2HG       GLU  80  -9.155  16.372  -5.389
  669    HE2  GLU  80           HE       GLU  80 -11.023  12.832  -5.861
  670    H    VAL  81           H        VAL  81  -9.045  11.358  -2.856
  671    HA   VAL  81           HA       VAL  81  -7.745   9.941  -5.018
  672    HB   VAL  81           HB       VAL  81  -8.465   8.966  -2.827
  673   1HG1  VAL  81          1HG1      VAL  81 -11.235   8.686  -4.045
  674   2HG1  VAL  81          2HG1      VAL  81 -10.672   8.220  -2.432
  675   3HG1  VAL  81          3HG1      VAL  81 -10.821   9.936  -2.846
  676   1HG2  VAL  81          1HG2      VAL  81  -9.344   7.575  -5.390
  677   2HG2  VAL  81          2HG2      VAL  81  -7.737   7.542  -4.629
  678   3HG2  VAL  81          3HG2      VAL  81  -9.114   6.781  -3.815
  679    H    GLU  82           H        GLU  82  -8.301   9.842  -7.045
  680    HA   GLU  82           HA       GLU  82 -10.532  11.424  -8.086
  681   1HB   GLU  82          1HB       GLU  82  -8.345  11.453  -9.162
  682   2HB   GLU  82          2HB       GLU  82  -8.344   9.699  -9.316
  683   1HG   GLU  82          1HG       GLU  82 -10.386   9.909 -10.836
  684   2HG   GLU  82          2HG       GLU  82 -10.156  11.663 -10.780
  685    HE2  GLU  82           HE       GLU  82  -7.110  11.492 -12.648
  686    H    LYS  83           H        LYS  83  -9.420   8.025  -8.239
  687    HA   LYS  83           HA       LYS  83 -11.972   6.908  -7.615
  688   1HB   LYS  83          1HB       LYS  83 -12.459   5.809  -9.769
  689   2HB   LYS  83          2HB       LYS  83 -12.515   7.563  -9.943
  690   1HG   LYS  83          1HG       LYS  83 -10.138   7.460 -10.857
  691   2HG   LYS  83          2HG       LYS  83 -10.288   5.691 -10.839
  692   1HD   LYS  83          1HD       LYS  83 -12.284   5.869 -12.324
  693   2HD   LYS  83          2HD       LYS  83 -12.103   7.633 -12.325
  694   1HE   LYS  83          1HE       LYS  83 -11.137   6.788 -14.364
  695   2HE   LYS  83          2HE       LYS  83  -9.815   7.363 -13.331
  696   1HZ   LYS  83          1HZ       LYS  83  -9.239   5.224 -14.196
  697   2HZ   LYS  83          2HZ       LYS  83 -10.641   4.536 -13.553
  698    H    VAL  84           H        VAL  84 -11.560   4.807  -6.811
  699    HA   VAL  84           HA       VAL  84  -8.984   3.532  -7.572
  700    HB   VAL  84           HB       VAL  84  -9.100   3.618  -5.356
  701   1HG1  VAL  84          1HG1      VAL  84 -11.962   2.623  -5.400
  702   2HG1  VAL  84          2HG1      VAL  84 -10.926   2.728  -3.956
  703   3HG1  VAL  84          3HG1      VAL  84 -11.349   4.198  -4.841
  704   1HG2  VAL  84          1HG2      VAL  84 -10.096   0.826  -6.034
  705   2HG2  VAL  84          2HG2      VAL  84  -8.473   1.427  -6.425
  706   3HG2  VAL  84          3HG2      VAL  84  -8.995   1.300  -4.732
  707    H    ASP  85           H        ASP  85  -9.258   2.640  -9.573
  708    HA   ASP  85           HA       ASP  85 -11.743   1.185 -10.259
  709   1HB   ASP  85          1HB       ASP  85 -10.861   2.805 -11.837
  710   2HB   ASP  85          2HB       ASP  85  -9.296   1.982 -11.861
  711    HD2  ASP  85           HD       ASP  85 -10.319   0.007 -14.485
  712    H    TYR  86           H        TYR  86 -11.226  -0.467  -8.548
  713    HA   TYR  86           HA       TYR  86  -8.761  -1.915  -8.818
  714   1HB   TYR  86          1HB       TYR  86  -9.441  -3.172  -6.891
  715   2HB   TYR  86          2HB       TYR  86  -9.798  -1.479  -6.629
  716    HD1  TYR  86           1HD      TYR  86 -12.169  -0.695  -6.594
  717    HD2  TYR  86           2HD      TYR  86 -11.160  -4.875  -6.960
  718    HE1  TYR  86           1HE      TYR  86 -14.462  -1.312  -5.890
  719    HE2  TYR  86           2HE      TYR  86 -13.439  -5.484  -6.213
  720    HH   TYR  86           HH       TYR  86 -15.492  -4.721  -5.510
  721    H    SER  87           H        SER  87  -8.587  -4.252  -8.933
  722    HA   SER  87           HA       SER  87 -10.551  -5.598 -10.691
  723   1HB   SER  87          1HB       SER  87  -7.542  -5.526 -11.159
  724   2HB   SER  87          2HB       SER  87  -8.748  -6.411 -12.109
  725    HG   SER  87           HG       SER  87  -9.724  -4.281 -12.468
  726    H    PHE  88           H        PHE  88 -11.241  -7.199  -9.448
  727    HA   PHE  88           HA       PHE  88  -9.635  -8.668  -7.528
  728   1HB   PHE  88          1HB       PHE  88 -11.743  -8.957  -6.868
  729   2HB   PHE  88          2HB       PHE  88 -12.416  -8.544  -8.430
  730    HD1  PHE  88           1HD      PHE  88 -13.944 -10.152  -9.142
  731    HD2  PHE  88           2HD      PHE  88 -10.360 -11.420  -7.130
  732    HE1  PHE  88           1HE      PHE  88 -14.631 -12.515  -9.413
  733    HE2  PHE  88           2HE      PHE  88 -11.042 -13.799  -7.410
  734    HZ   PHE  88           HZ       PHE  88 -13.187 -14.344  -8.546
  735    H    SER  89           H        SER  89  -8.054 -10.043  -8.092
  736    HA   SER  89           HA       SER  89  -8.296 -11.682 -10.562
  737   1HB   SER  89          1HB       SER  89  -5.707 -10.487  -9.566
  738   2HB   SER  89          2HB       SER  89  -6.038 -11.257 -11.122
  739    HG   SER  89           HG       SER  89  -7.555  -9.479 -11.474
  740    H    GLU  90           H        GLU  90  -6.376 -13.392 -10.424
  741    HA   GLU  90           HA       GLU  90  -6.306 -14.599  -7.700
  742   1HB   GLU  90          1HB       GLU  90  -5.971 -15.813 -10.468
  743   2HB   GLU  90          2HB       GLU  90  -5.593 -16.665  -8.967
  744   1HG   GLU  90          1HG       GLU  90  -8.324 -15.561  -9.740
  745   2HG   GLU  90          2HG       GLU  90  -7.817 -17.253  -9.774
  746    HE2  GLU  90           HE       GLU  90  -7.686 -17.430  -6.162
  747    H    TYR  91           H        TYR  91  -4.482 -14.745  -6.668
  748    HA   TYR  91           HA       TYR  91  -2.115 -13.494  -7.158
  749   1HB   TYR  91          1HB       TYR  91  -1.324 -14.703  -5.306
  750   2HB   TYR  91          2HB       TYR  91  -3.042 -14.439  -5.046
  751    HD1  TYR  91           1HD      TYR  91  -4.666 -16.457  -5.796
  752    HD2  TYR  91           2HD      TYR  91  -0.438 -16.873  -5.016
  753    HE1  TYR  91           1HE      TYR  91  -4.989 -18.836  -5.367
  754    HE2  TYR  91           2HE      TYR  91  -0.772 -19.279  -4.584
  755    HH   TYR  91           HH       TYR  91  -2.287 -21.025  -4.482
  756    H    LYS  92           H        LYS  92  -0.197 -13.903  -8.129
  757    HA   LYS  92           HA       LYS  92   0.154 -16.305  -9.778
  758   1HB   LYS  92          1HB       LYS  92   1.014 -14.150 -10.602
  759   2HB   LYS  92          2HB       LYS  92   2.029 -13.986  -9.160
  760   1HG   LYS  92          1HG       LYS  92   3.361 -14.746 -11.033
  761   2HG   LYS  92          2HG       LYS  92   3.295 -16.029  -9.821
  762   1HD   LYS  92          1HD       LYS  92   1.589 -17.229 -11.146
  763   2HD   LYS  92          2HD       LYS  92   1.520 -15.886 -12.309
  764   1HE   LYS  92          1HE       LYS  92   3.867 -16.329 -12.952
  765   2HE   LYS  92          2HE       LYS  92   3.963 -17.624 -11.736
  766   1HZ   LYS  92          1HZ       LYS  92   3.435 -18.578 -13.859
  767   2HZ   LYS  92          2HZ       LYS  92   2.047 -17.625 -13.982
  768    H    GLY  93           H        GLY  93   1.523 -14.694  -6.883
  769   1HA   GLY  93          1HA       GLY  93   2.081 -17.258  -5.588
  770   2HA   GLY  93          2HA       GLY  93   3.462 -16.186  -5.905
  771    H    GLU  94           H        GLU  94   3.138 -16.592  -3.370
  772    HA   GLU  94           HA       GLU  94   1.502 -14.538  -2.063
  773   1HB   GLU  94          1HB       GLU  94   2.458 -15.371  -0.012
  774   2HB   GLU  94          2HB       GLU  94   1.603 -16.603  -0.939
  775   1HG   GLU  94          1HG       GLU  94   3.781 -17.526  -1.715
  776   2HG   GLU  94          2HG       GLU  94   4.635 -16.327  -0.726
  777    HE2  GLU  94           HE       GLU  94   3.810 -17.845   2.335
  778    H    PHE  95           H        PHE  95   2.222 -12.513  -2.212
  779    HA   PHE  95           HA       PHE  95   4.867 -11.836  -3.070
  780   1HB   PHE  95          1HB       PHE  95   2.558 -10.204  -1.964
  781   2HB   PHE  95          2HB       PHE  95   4.101  -9.518  -2.432
  782    HD1  PHE  95           1HD      PHE  95   3.092  -8.005  -4.015
  783    HD2  PHE  95           2HD      PHE  95   2.761 -12.279  -4.564
  784    HE1  PHE  95           1HE      PHE  95   2.281  -7.677  -6.323
  785    HE2  PHE  95           2HE      PHE  95   1.853 -11.921  -6.807
  786    HZ   PHE  95           HZ       PHE  95   1.594  -9.605  -7.701
  787    H    GLU  96           H        GLU  96   6.677 -11.243  -1.895
  788    HA   GLU  96           HA       GLU  96   6.877 -12.093   0.758
  789   1HB   GLU  96          1HB       GLU  96   8.739 -10.318  -0.875
  790   2HB   GLU  96          2HB       GLU  96   9.174 -11.226   0.581
  791   1HG   GLU  96          1HG       GLU  96   8.230 -12.459  -2.069
  792   2HG   GLU  96          2HG       GLU  96   9.877 -12.334  -1.514
  793    HE2  GLU  96           HE       GLU  96   9.557 -14.920   0.869
  794    H    ASP  97           H        ASP  97   5.286 -10.980   1.974
  795    HA   ASP  97           HA       ASP  97   4.641  -9.493   3.551
  796   1HB   ASP  97          1HB       ASP  97   7.061  -7.756   2.939
  797   2HB   ASP  97          2HB       ASP  97   6.039  -7.737   4.372
  798    HD2  ASP  97           HD       ASP  97   9.033 -10.369   4.129
  799    H    PHE  98           H        PHE  98   4.536  -6.715   3.514
  800    HA   PHE  98           HA       PHE  98   3.460  -5.966   0.860
  801   1HB   PHE  98          1HB       PHE  98   1.679  -6.961   2.294
  802   2HB   PHE  98          2HB       PHE  98   1.930  -5.695   3.468
  803    HD1  PHE  98           1HD      PHE  98  -0.650  -5.868   2.930
  804    HD2  PHE  98           2HD      PHE  98   2.250  -4.075   0.316
  805    HE1  PHE  98           1HE      PHE  98  -2.469  -4.655   1.716
  806    HE2  PHE  98           2HE      PHE  98   0.445  -2.907  -0.894
  807    HZ   PHE  98           HZ       PHE  98  -1.914  -3.174  -0.170
  808    H    GLU  99           H        GLU  99   5.197  -4.521   0.605
  809    HA   GLU  99           HA       GLU  99   5.442  -2.299   2.598
  810   1HB   GLU  99          1HB       GLU  99   7.311  -3.678   2.520
  811   2HB   GLU  99          2HB       GLU  99   7.431  -3.575   0.768
  812   1HG   GLU  99          1HG       GLU  99   7.888  -1.109   0.981
  813   2HG   GLU  99          2HG       GLU  99   7.759  -1.264   2.739
  814    HE2  GLU  99           HE       GLU  99  10.930  -2.906   2.893
  815    H    THR 100           H        THR 100   5.949  -0.198   1.682
  816    HA   THR 100           HA       THR 100   4.498   0.369  -0.811
  817    HB   THR 100           HB       THR 100   3.715   2.208   0.187
  818    HG1  THR 100           1HG      THR 100   4.814   3.298   1.912
  819   1HG2  THR 100          1HG2      THR 100   3.103   1.809   2.485
  820   2HG2  THR 100          2HG2      THR 100   3.124   0.241   1.641
  821   3HG2  THR 100          3HG2      THR 100   4.451   0.702   2.737
  822    H    TYR 101           H        TYR 101   5.331   1.702  -2.455
  823    HA   TYR 101           HA       TYR 101   8.123   2.745  -2.289
  824   1HB   TYR 101          1HB       TYR 101   5.845   3.208  -4.242
  825   2HB   TYR 101          2HB       TYR 101   7.369   4.078  -4.304
  826    HD1  TYR 101           1HD      TYR 101   6.671   3.030  -6.731
  827    HD2  TYR 101           2HD      TYR 101   8.452   0.876  -3.445
  828    HE1  TYR 101           1HE      TYR 101   7.970   1.648  -8.322
  829    HE2  TYR 101           2HE      TYR 101   9.610  -0.597  -5.032
  830    HH   TYR 101           HH       TYR 101  10.059  -1.054  -7.245
  Start of MODEL   10
    1   1H    GLY  -1          1H        GLY  -1  19.811 -43.493  10.046
    2   2H    GLY  -1          2H        GLY  -1  19.384 -44.120  11.513
    3   3H    GLY  -1          3H        GLY  -1  18.489 -44.478  10.181
    4   1HA   GLY  -1          1HA       GLY  -1  18.754 -41.844  11.433
    5   2HA   GLY  -1          2HA       GLY  -1  17.860 -42.174   9.937
    6    H    SER   0           H        SER   0  16.661 -41.024  12.243
    7    HA   SER   0           HA       SER   0  14.391 -42.781  12.524
    8   1HB   SER   0          1HB       SER   0  15.931 -43.640  14.328
    9   2HB   SER   0          2HB       SER   0  15.932 -42.023  15.055
   10    HG   SER   0           HG       SER   0  13.792 -42.274  15.531
   11    H    MET   1           H        MET   1  12.794 -41.588  14.098
   12    HA   MET   1           HA       MET   1  11.430 -39.826  14.431
   13   1HB   MET   1          1HB       MET   1  14.018 -38.238  14.704
   14   2HB   MET   1          2HB       MET   1  12.417 -37.787  15.308
   15   1HG   MET   1          1HG       MET   1  12.409 -39.800  16.767
   16   2HG   MET   1          2HG       MET   1  14.022 -40.221  16.183
   17   1HE   MET   1          1HE       MET   1  12.607 -36.585  17.326
   18   2HE   MET   1          2HE       MET   1  13.025 -36.757  19.044
   19   3HE   MET   1          3HE       MET   1  11.854 -37.871  18.303
   20    H    LYS   2           H        LYS   2  11.332 -40.422  11.890
   21    HA   LYS   2           HA       LYS   2  11.983 -38.124  10.183
   22   1HB   LYS   2          1HB       LYS   2  10.509 -40.697   9.530
   23   2HB   LYS   2          2HB       LYS   2  11.162 -39.516   8.379
   24   1HG   LYS   2          1HG       LYS   2  12.756 -41.309  10.266
   25   2HG   LYS   2          2HG       LYS   2  12.602 -41.461   8.514
   26   1HD   LYS   2          1HD       LYS   2  13.735 -39.228   8.249
   27   2HD   LYS   2          2HD       LYS   2  13.938 -39.157  10.010
   28   1HE   LYS   2          1HE       LYS   2  16.005 -39.919   9.088
   29   2HE   LYS   2          2HE       LYS   2  15.240 -41.270   9.946
   30   1HZ   LYS   2          1HZ       LYS   2  16.033 -42.022   7.828
   31   2HZ   LYS   2          2HZ       LYS   2  15.081 -40.881   7.025
   32    H    LYS   3           H        LYS   3  10.499 -36.811   9.147
   33    HA   LYS   3           HA       LYS   3   8.364 -36.048  10.894
   34   1HB   LYS   3          1HB       LYS   3   9.424 -34.979   8.251
   35   2HB   LYS   3          2HB       LYS   3   8.024 -34.284   9.071
   36   1HG   LYS   3          1HG       LYS   3   9.970 -33.005   9.611
   37   2HG   LYS   3          2HG       LYS   3   9.333 -33.786  11.065
   38   1HD   LYS   3          1HD       LYS   3  11.150 -35.409  11.064
   39   2HD   LYS   3          2HD       LYS   3  11.667 -34.893   9.443
   40   1HE   LYS   3          1HE       LYS   3  13.168 -33.979  11.128
   41   2HE   LYS   3          2HE       LYS   3  12.268 -32.661  10.354
   42   1HZ   LYS   3          1HZ       LYS   3  12.241 -32.351  12.717
   43   2HZ   LYS   3          2HZ       LYS   3  11.527 -33.864  12.949
   44    H    TRP   4           H        TRP   4   8.429 -37.273   7.548
   45    HA   TRP   4           HA       TRP   4   6.667 -37.290   5.995
   46   1HB   TRP   4          1HB       TRP   4   6.065 -39.492   8.024
   47   2HB   TRP   4          2HB       TRP   4   5.593 -39.500   6.321
   48    HD1  TRP   4           HD       TRP   4   8.176 -40.807   8.514
   49    HE1  TRP   4           1HE      TRP   4  10.225 -41.668   7.188
   50    HE3  TRP   4           3HE      TRP   4   7.165 -38.710   3.949
   51    HZ2  TRP   4           2HZ      TRP   4  11.284 -41.442   4.548
   52    HZ3  TRP   4           3HZ      TRP   4   8.718 -39.048   2.053
   53    HH2  TRP   4           HH       TRP   4  10.780 -40.402   2.340
   54    H    SER   5           H        SER   5   5.941 -35.154   7.196
   55    HA   SER   5           HA       SER   5   3.055 -35.387   7.900
   56   1HB   SER   5          1HB       SER   5   3.334 -32.945   8.415
   57   2HB   SER   5          2HB       SER   5   4.255 -34.048   9.452
   58    HG   SER   5           HG       SER   5   6.103 -33.560   8.305
   59    H    ASP   6           H        ASP   6   2.680 -36.169   5.703
   60    HA   ASP   6           HA       ASP   6   3.311 -34.537   3.435
   61   1HB   ASP   6          1HB       ASP   6   1.560 -37.004   3.729
   62   2HB   ASP   6          2HB       ASP   6   2.121 -36.314   2.198
   63    HD2  ASP   6           HD       ASP   6   5.381 -37.542   2.506
   64    H    THR   7           H        THR   7   2.094 -32.692   4.753
   65    HA   THR   7           HA       THR   7  -0.791 -32.542   4.085
   66    HB   THR   7           HB       THR   7  -0.639 -30.450   5.475
   67    HG1  THR   7           1HG      THR   7   1.295 -30.270   6.725
   68   1HG2  THR   7          1HG2      THR   7  -0.423 -31.611   7.630
   69   2HG2  THR   7          2HG2      THR   7  -1.334 -32.608   6.480
   70   3HG2  THR   7          3HG2      THR   7   0.363 -32.993   6.842
   71    H    GLU   8           H        GLU   8  -1.603 -30.690   2.946
   72    HA   GLU   8           HA       GLU   8   0.279 -29.156   1.251
   73   1HB   GLU   8          1HB       GLU   8  -1.981 -30.913   0.185
   74   2HB   GLU   8          2HB       GLU   8  -1.023 -29.769  -0.768
   75   1HG   GLU   8          1HG       GLU   8   1.042 -31.067  -0.204
   76   2HG   GLU   8          2HG       GLU   8   0.029 -32.283   0.597
   77    HE2  GLU   8           HE       GLU   8  -1.401 -33.446  -2.430
   78    H    VAL   9           H        VAL   9  -0.985 -27.549  -0.060
   79    HA   VAL   9           HA       VAL   9  -2.232 -25.695  -0.141
   80    HB   VAL   9           HB       VAL   9  -4.491 -27.362   1.042
   81   1HG1  VAL   9          1HG1      VAL   9  -4.461 -24.959  -0.846
   82   2HG1  VAL   9          2HG1      VAL   9  -5.900 -25.862  -0.337
   83   3HG1  VAL   9          3HG1      VAL   9  -4.985 -24.925   0.847
   84   1HG2  VAL   9          1HG2      VAL   9  -3.523 -27.133  -1.840
   85   2HG2  VAL   9          2HG2      VAL   9  -3.521 -28.605  -0.843
   86   3HG2  VAL   9          3HG2      VAL   9  -5.052 -27.876  -1.328
   87    H    PHE  10           H        PHE  10  -0.657 -24.990   1.502
   88    HA   PHE  10           HA       PHE  10  -1.383 -24.961   4.284
   89   1HB   PHE  10          1HB       PHE  10   0.747 -23.289   2.907
   90   2HB   PHE  10          2HB       PHE  10   0.668 -23.763   4.599
   91    HD1  PHE  10           1HD      PHE  10   1.944 -24.604   1.341
   92    HD2  PHE  10           2HD      PHE  10   0.692 -26.366   5.077
   93    HE1  PHE  10           1HE      PHE  10   3.090 -26.712   0.736
   94    HE2  PHE  10           2HE      PHE  10   1.844 -28.474   4.458
   95    HZ   PHE  10           HZ       PHE  10   3.052 -28.646   2.295
   96    H    GLU  11           H        GLU  11  -0.895 -22.225   1.975
   97    HA   GLU  11           HA       GLU  11  -3.185 -20.820   3.234
   98   1HB   GLU  11          1HB       GLU  11  -2.205 -18.754   2.916
   99   2HB   GLU  11          2HB       GLU  11  -1.030 -19.755   3.760
  100   1HG   GLU  11          1HG       GLU  11  -0.977 -19.021   0.792
  101   2HG   GLU  11          2HG       GLU  11  -0.021 -18.282   2.071
  102    HE2  GLU  11           HE       GLU  11   1.485 -21.391   0.252
  103    H    MET  12           H        MET  12  -4.788 -20.253   1.842
  104    HA   MET  12           HA       MET  12  -4.530 -21.110  -0.987
  105   1HB   MET  12          1HB       MET  12  -6.315 -22.027   0.435
  106   2HB   MET  12          2HB       MET  12  -7.033 -20.442   0.619
  107   1HG   MET  12          1HG       MET  12  -7.244 -20.318  -1.903
  108   2HG   MET  12          2HG       MET  12  -6.604 -21.960  -1.995
  109   1HE   MET  12          1HE       MET  12  -7.829 -24.084  -1.269
  110   2HE   MET  12          2HE       MET  12  -9.463 -24.143  -0.572
  111   3HE   MET  12          3HE       MET  12  -8.109 -23.536   0.403
  112    H    LEU  13           H        LEU  13  -6.824 -18.673  -0.065
  113    HA   LEU  13           HA       LEU  13  -7.346 -16.702  -0.745
  114   1HB   LEU  13          1HB       LEU  13  -5.977 -14.951  -0.028
  115   2HB   LEU  13          2HB       LEU  13  -5.911 -16.248   1.146
  116    HG   LEU  13           HG       LEU  13  -3.691 -16.261  -0.858
  117   1HD1  LEU  13          1HD1      LEU  13  -2.551 -14.363   0.219
  118   2HD1  LEU  13          2HD1      LEU  13  -4.022 -13.883  -0.651
  119   3HD1  LEU  13          3HD1      LEU  13  -4.035 -13.999   1.129
  120   1HD2  LEU  13          1HD2      LEU  13  -2.345 -16.676   1.135
  121   2HD2  LEU  13          2HD2      LEU  13  -3.680 -16.201   2.198
  122   3HD2  LEU  13          3HD2      LEU  13  -3.791 -17.699   1.259
  123    H    LYS  14           H        LYS  14  -7.303 -14.854  -2.119
  124    HA   LYS  14           HA       LYS  14  -5.712 -15.258  -4.611
  125   1HB   LYS  14          1HB       LYS  14  -7.429 -14.830  -5.930
  126   2HB   LYS  14          2HB       LYS  14  -8.198 -15.755  -4.652
  127   1HG   LYS  14          1HG       LYS  14  -8.331 -12.728  -5.082
  128   2HG   LYS  14          2HG       LYS  14  -9.557 -13.940  -5.450
  129   1HD   LYS  14          1HD       LYS  14  -9.465 -14.501  -2.885
  130   2HD   LYS  14          2HD       LYS  14  -8.627 -12.941  -2.757
  131   1HE   LYS  14          1HE       LYS  14 -10.986 -12.591  -2.344
  132   2HE   LYS  14          2HE       LYS  14 -10.568 -11.840  -3.898
  133   1HZ   LYS  14          1HZ       LYS  14 -12.579 -13.095  -4.135
  134   2HZ   LYS  14          2HZ       LYS  14 -11.812 -14.505  -3.615
  135    H    ARG  15           H        ARG  15  -5.537 -13.221  -5.948
  136    HA   ARG  15           HA       ARG  15  -4.380 -11.111  -4.268
  137   1HB   ARG  15          1HB       ARG  15  -2.985 -12.191  -5.819
  138   2HB   ARG  15          2HB       ARG  15  -4.148 -11.974  -7.151
  139   1HG   ARG  15          1HG       ARG  15  -3.746  -9.611  -7.218
  140   2HG   ARG  15          2HG       ARG  15  -2.863  -9.679  -5.677
  141   1HD   ARG  15          1HD       ARG  15  -1.369  -9.459  -7.687
  142   2HD   ARG  15          2HD       ARG  15  -1.036 -10.909  -6.719
  143    HE   ARG  15           HE       ARG  15  -2.887 -11.631  -8.732
  144   1HH1  ARG  15          2HH1      ARG  15   0.485 -10.539  -8.529
  145   2HH1  ARG  15          1HH1      ARG  15   0.982 -11.432  -9.945
  146   1HH2  ARG  15          1HH2      ARG  15  -2.217 -12.836 -10.513
  147   2HH2  ARG  15          2HH2      ARG  15  -0.582 -12.713 -11.120
  148    H    MET  16           H        MET  16  -6.119  -9.794  -3.651
  149    HA   MET  16           HA       MET  16  -7.886  -8.514  -5.571
  150   1HB   MET  16          1HB       MET  16  -8.354  -8.569  -3.192
  151   2HB   MET  16          2HB       MET  16  -6.918  -7.604  -2.837
  152   1HG   MET  16          1HG       MET  16  -8.408  -6.005  -4.641
  153   2HG   MET  16          2HG       MET  16  -9.610  -6.810  -3.674
  154   1HE   MET  16          1HE       MET  16  -6.171  -5.016  -3.534
  155   2HE   MET  16          2HE       MET  16  -6.472  -3.719  -2.351
  156   3HE   MET  16          3HE       MET  16  -7.326  -3.731  -3.908
  157    H    TYR  17           H        TYR  17  -7.582  -6.416  -6.360
  158    HA   TYR  17           HA       TYR  17  -4.924  -5.168  -6.330
  159   1HB   TYR  17          1HB       TYR  17  -4.556  -6.730  -8.089
  160   2HB   TYR  17          2HB       TYR  17  -6.153  -6.465  -8.769
  161    HD1  TYR  17           1HD      TYR  17  -3.025  -4.512  -7.962
  162    HD2  TYR  17           2HD      TYR  17  -6.345  -5.078 -10.658
  163    HE1  TYR  17           1HE      TYR  17  -2.009  -2.923  -9.561
  164    HE2  TYR  17           2HE      TYR  17  -5.363  -3.432 -12.216
  165    HH   TYR  17           HH       TYR  17  -3.557  -2.086 -12.680
  166    H    ALA  18           H        ALA  18  -5.250  -3.058  -6.122
  167    HA   ALA  18           HA       ALA  18  -7.663  -1.813  -7.338
  168   1HB   ALA  18          1HB       ALA  18  -7.688  -0.250  -5.424
  169   2HB   ALA  18          2HB       ALA  18  -8.096  -1.915  -4.980
  170   3HB   ALA  18          3HB       ALA  18  -6.474  -1.263  -4.608
  171    H    ARG  19           H        ARG  19  -7.083  -0.539  -8.856
  172    HA   ARG  19           HA       ARG  19  -4.474   0.791  -8.938
  173   1HB   ARG  19          1HB       ARG  19  -5.386  -0.407 -10.907
  174   2HB   ARG  19          2HB       ARG  19  -6.812   0.631 -10.895
  175   1HG   ARG  19          1HG       ARG  19  -5.335   1.404 -12.587
  176   2HG   ARG  19          2HG       ARG  19  -5.317   2.616 -11.289
  177   1HD   ARG  19          1HD       ARG  19  -3.176   1.788 -10.483
  178   2HD   ARG  19          2HD       ARG  19  -3.252   0.424 -11.621
  179    HE   ARG  19           HE       ARG  19  -3.433   3.051 -12.879
  180   1HH1  ARG  19          1HH1      ARG  19  -1.191   0.484 -11.878
  181   2HH1  ARG  19          2HH1      ARG  19   0.144   1.105 -12.800
  182   1HH2  ARG  19          1HH2      ARG  19  -1.687   3.842 -14.124
  183   2HH2  ARG  19          2HH2      ARG  19  -0.157   3.006 -14.126
  184    H    VAL  20           H        VAL  20  -4.649   2.431  -7.331
  185    HA   VAL  20           HA       VAL  20  -7.111   4.010  -7.122
  186    HB   VAL  20           HB       VAL  20  -4.593   4.358  -5.505
  187   1HG1  VAL  20          1HG1      VAL  20  -7.503   4.727  -4.717
  188   2HG1  VAL  20          2HG1      VAL  20  -6.058   5.272  -3.847
  189   3HG1  VAL  20          3HG1      VAL  20  -6.521   6.037  -5.381
  190   1HG2  VAL  20          1HG2      VAL  20  -6.798   2.316  -5.056
  191   2HG2  VAL  20          2HG2      VAL  20  -5.067   1.987  -5.281
  192   3HG2  VAL  20          3HG2      VAL  20  -5.626   2.816  -3.829
  193    H    TYR  21           H        TYR  21  -7.365   5.698  -8.514
  194    HA   TYR  21           HA       TYR  21  -4.978   7.184  -9.474
  195   1HB   TYR  21          1HB       TYR  21  -7.873   7.251 -10.383
  196   2HB   TYR  21          2HB       TYR  21  -6.609   8.258 -11.005
  197    HD1  TYR  21           1HD      TYR  21  -4.502   7.133 -12.007
  198    HD2  TYR  21           2HD      TYR  21  -8.235   5.067 -11.378
  199    HE1  TYR  21           1HE      TYR  21  -3.829   5.396 -13.637
  200    HE2  TYR  21           2HE      TYR  21  -7.588   3.370 -13.026
  201    HH   TYR  21           HH       TYR  21  -5.985   2.701 -14.572
  202    H    GLY  22           H        GLY  22  -4.730   9.383  -9.234
  203   1HA   GLY  22          1HA       GLY  22  -6.055  11.483  -9.047
  204   2HA   GLY  22          2HA       GLY  22  -6.642  10.882  -7.486
  205    H    LEU  23           H        LEU  23  -5.838  12.697  -6.443
  206    HA   LEU  23           HA       LEU  23  -2.998  13.279  -6.418
  207   1HB   LEU  23          1HB       LEU  23  -4.984  14.880  -6.187
  208   2HB   LEU  23          2HB       LEU  23  -5.109  14.298  -4.520
  209    HG   LEU  23           HG       LEU  23  -2.590  15.069  -4.337
  210   1HD1  LEU  23          1HD1      LEU  23  -1.962  16.873  -5.860
  211   2HD1  LEU  23          2HD1      LEU  23  -2.235  15.394  -6.790
  212   3HD1  LEU  23          3HD1      LEU  23  -3.466  16.674  -6.777
  213   1HD2  LEU  23          1HD2      LEU  23  -3.315  17.371  -3.830
  214   2HD2  LEU  23          2HD2      LEU  23  -4.846  17.084  -4.685
  215   3HD2  LEU  23          3HD2      LEU  23  -4.467  16.181  -3.203
  216    H    VAL  24           H        VAL  24  -4.261  10.613  -5.399
  217    HA   VAL  24           HA       VAL  24  -3.667  10.444  -2.569
  218    HB   VAL  24           HB       VAL  24  -4.091   8.021  -2.951
  219   1HG1  VAL  24          1HG1      VAL  24  -6.120   9.878  -4.255
  220   2HG1  VAL  24          2HG1      VAL  24  -6.427   8.222  -3.696
  221   3HG1  VAL  24          3HG1      VAL  24  -5.995   9.484  -2.534
  222   1HG2  VAL  24          1HG2      VAL  24  -4.629   8.698  -5.874
  223   2HG2  VAL  24          2HG2      VAL  24  -3.078   8.035  -5.336
  224   3HG2  VAL  24          3HG2      VAL  24  -4.566   7.116  -5.087
  225    H    GLN  25           H        GLN  25  -1.378  11.320  -4.383
  226    HA   GLN  25           HA       GLN  25   0.247   8.912  -4.644
  227   1HB   GLN  25          1HB       GLN  25  -0.482  10.738  -6.402
  228   2HB   GLN  25          2HB       GLN  25   0.957  11.573  -5.808
  229   1HG   GLN  25          1HG       GLN  25   1.490  10.178  -7.733
  230   2HG   GLN  25          2HG       GLN  25   2.286   9.516  -6.307
  231   1HE2  GLN  25          1HE2      GLN  25   2.426   7.523  -7.663
  232   2HE2  GLN  25          2HE2      GLN  25   1.057   6.435  -7.720
  233    H    GLY  26           H        GLY  26   0.296   9.179  -2.215
  234   1HA   GLY  26          1HA       GLY  26   1.996   9.025  -0.562
  235   2HA   GLY  26          2HA       GLY  26   2.959  10.226  -1.425
  236    H    VAL  27           H        VAL  27  -0.312   9.931   0.046
  237    HA   VAL  27           HA       VAL  27   0.167  11.991   2.000
  238    HB   VAL  27           HB       VAL  27  -0.147  13.572   0.312
  239   1HG1  VAL  27          1HG1      VAL  27  -2.382  11.851  -0.800
  240   2HG1  VAL  27          2HG1      VAL  27  -2.180  13.567  -1.210
  241   3HG1  VAL  27          3HG1      VAL  27  -0.904  12.403  -1.590
  242   1HG2  VAL  27          1HG2      VAL  27  -2.912  13.259   1.519
  243   2HG2  VAL  27          2HG2      VAL  27  -1.506  13.953   2.354
  244   3HG2  VAL  27          3HG2      VAL  27  -2.157  14.736   0.904
  245    H    GLY  28           H        GLY  28  -0.514  10.673   3.587
  246   1HA   GLY  28          1HA       GLY  28  -2.044   9.753   5.022
  247   2HA   GLY  28          2HA       GLY  28  -3.350  10.081   3.876
  248    H    PHE  29           H        PHE  29  -3.001   8.741   1.722
  249    HA   PHE  29           HA       PHE  29  -3.299   5.974   2.342
  250   1HB   PHE  29          1HB       PHE  29  -4.313   7.349   0.443
  251   2HB   PHE  29          2HB       PHE  29  -2.769   7.202  -0.385
  252    HD1  PHE  29           1HD      PHE  29  -5.479   5.163   1.265
  253    HD2  PHE  29           2HD      PHE  29  -2.405   5.276  -1.755
  254    HE1  PHE  29           1HE      PHE  29  -6.217   2.943   0.424
  255    HE2  PHE  29           2HE      PHE  29  -3.142   3.068  -2.586
  256    HZ   PHE  29           HZ       PHE  29  -5.031   1.878  -1.476
  257    H    ARG  30           H        ARG  30  -1.992   4.333   0.902
  258    HA   ARG  30           HA       ARG  30  -0.102   3.145   0.590
  259   1HB   ARG  30          1HB       ARG  30   1.556   5.642   1.184
  260   2HB   ARG  30          2HB       ARG  30   2.146   4.061   0.754
  261   1HG   ARG  30          1HG       ARG  30   1.121   4.125  -1.421
  262   2HG   ARG  30          2HG       ARG  30   0.233   5.614  -1.028
  263   1HD   ARG  30          1HD       ARG  30   2.164   6.158  -2.380
  264   2HD   ARG  30          2HD       ARG  30   2.343   6.835  -0.757
  265    HE   ARG  30           HE       ARG  30   3.607   4.324  -0.720
  266   1HH1  ARG  30          1HH1      ARG  30   4.065   7.401  -2.433
  267   2HH1  ARG  30          2HH1      ARG  30   5.806   7.280  -2.410
  268   1HH2  ARG  30          1HH2      ARG  30   5.850   4.233  -0.606
  269   2HH2  ARG  30          2HH2      ARG  30   6.829   5.392  -1.475
  270    H    LYS  31           H        LYS  31   0.384   5.483   3.277
  271    HA   LYS  31           HA       LYS  31   1.503   3.436   4.962
  272   1HB   LYS  31          1HB       LYS  31   1.783   6.150   4.859
  273   2HB   LYS  31          2HB       LYS  31   0.600   6.034   6.163
  274   1HG   LYS  31          1HG       LYS  31   3.331   4.667   6.012
  275   2HG   LYS  31          2HG       LYS  31   2.920   6.093   6.973
  276   1HD   LYS  31          1HD       LYS  31   1.268   4.702   8.263
  277   2HD   LYS  31          2HD       LYS  31   1.842   3.271   7.375
  278   1HE   LYS  31          1HE       LYS  31   4.147   3.671   8.207
  279   2HE   LYS  31          2HE       LYS  31   3.567   5.078   9.124
  280   1HZ   LYS  31          1HZ       LYS  31   3.602   3.178  10.553
  281   2HZ   LYS  31          2HZ       LYS  31   2.567   2.331   9.523
  282    H    PHE  32           H        PHE  32  -1.605   5.344   4.942
  283    HA   PHE  32           HA       PHE  32  -2.866   4.135   7.044
  284   1HB   PHE  32          1HB       PHE  32  -3.757   5.974   5.727
  285   2HB   PHE  32          2HB       PHE  32  -4.093   4.892   4.380
  286    HD1  PHE  32           1HD      PHE  32  -4.900   3.419   7.670
  287    HD2  PHE  32           2HD      PHE  32  -6.368   6.001   4.520
  288    HE1  PHE  32           1HE      PHE  32  -7.136   3.275   8.603
  289    HE2  PHE  32           2HE      PHE  32  -8.596   5.969   5.580
  290    HZ   PHE  32           HZ       PHE  32  -9.013   4.576   7.597
  291    H    VAL  33           H        VAL  33  -2.830   2.939   3.637
  292    HA   VAL  33           HA       VAL  33  -4.359   0.583   4.265
  293    HB   VAL  33           HB       VAL  33  -4.352   1.699   2.052
  294   1HG1  VAL  33          1HG1      VAL  33  -1.603   0.444   1.695
  295   2HG1  VAL  33          2HG1      VAL  33  -2.591   1.174   0.418
  296   3HG1  VAL  33          3HG1      VAL  33  -2.003   2.176   1.750
  297   1HG2  VAL  33          1HG2      VAL  33  -3.600  -1.244   1.944
  298   2HG2  VAL  33          2HG2      VAL  33  -5.197  -0.595   2.366
  299   3HG2  VAL  33          3HG2      VAL  33  -4.532  -0.331   0.745
  300    H    GLN  34           H        GLN  34  -1.032   1.349   4.716
  301    HA   GLN  34           HA       GLN  34  -0.006  -1.365   4.755
  302   1HB   GLN  34          1HB       GLN  34   1.377   0.931   4.815
  303   2HB   GLN  34          2HB       GLN  34   0.955   0.940   6.522
  304   1HG   GLN  34          1HG       GLN  34   3.040   0.053   6.534
  305   2HG   GLN  34          2HG       GLN  34   1.988  -1.344   6.757
  306   1HE2  GLN  34          1HE2      GLN  34   1.533  -0.710   3.544
  307   2HE2  GLN  34          2HE2      GLN  34   2.824  -1.694   2.893
  308    H    ILE  35           H        ILE  35  -0.986   0.826   7.434
  309    HA   ILE  35           HA       ILE  35  -0.970  -0.939   9.505
  310    HB   ILE  35           HB       ILE  35  -3.127   1.136   8.923
  311   1HG1  ILE  35          1HG1      ILE  35  -0.955   2.204   8.890
  312   2HG1  ILE  35          2HG1      ILE  35  -1.834   2.646  10.344
  313   1HG2  ILE  35          1HG2      ILE  35  -3.378   1.235  11.420
  314   2HG2  ILE  35          2HG2      ILE  35  -3.990  -0.238  10.670
  315   3HG2  ILE  35          3HG2      ILE  35  -2.436  -0.269  11.520
  316   1HD1  ILE  35          1HD1      ILE  35   0.461   2.253  10.924
  317   2HD1  ILE  35          2HD1      ILE  35  -0.483   0.929  11.620
  318   3HD1  ILE  35          3HD1      ILE  35   0.472   0.666  10.140
  319    H    HIS  36           H        HIS  36  -3.787  -0.623   7.293
  320    HA   HIS  36           HA       HIS  36  -5.237  -2.654   8.761
  321   1HB   HIS  36          1HB       HIS  36  -5.729  -1.171   6.181
  322   2HB   HIS  36          2HB       HIS  36  -6.735  -2.540   6.680
  323    HD2  HIS  36           2HD      HIS  36  -5.543   0.770   8.619
  324    HE1  HIS  36           1HE      HIS  36  -9.502  -0.242   9.701
  325    HE2  HIS  36           2HE      HIS  36  -7.607   1.430  10.064
  326    H    ALA  37           H        ALA  37  -3.553  -2.714   5.546
  327    HA   ALA  37           HA       ALA  37  -3.807  -5.338   4.911
  328   1HB   ALA  37          1HB       ALA  37  -1.562  -5.155   3.853
  329   2HB   ALA  37          2HB       ALA  37  -2.618  -3.768   3.530
  330   3HB   ALA  37          3HB       ALA  37  -1.308  -3.636   4.721
  331    H    ILE  38           H        ILE  38  -1.358  -3.999   7.144
  332    HA   ILE  38           HA       ILE  38  -0.039  -6.515   7.672
  333    HB   ILE  38           HB       ILE  38   0.244  -3.623   8.476
  334   1HG1  ILE  38          1HG1      ILE  38   2.622  -4.080   7.966
  335   2HG1  ILE  38          2HG1      ILE  38   2.268  -5.800   7.750
  336   1HG2  ILE  38          1HG2      ILE  38   1.863  -4.071  10.223
  337   2HG2  ILE  38          2HG2      ILE  38   0.228  -4.530  10.685
  338   3HG2  ILE  38          3HG2      ILE  38   1.405  -5.790  10.223
  339   1HD1  ILE  38          1HD1      ILE  38   2.521  -4.594   5.621
  340   2HD1  ILE  38          2HD1      ILE  38   0.897  -5.279   5.767
  341   3HD1  ILE  38          3HD1      ILE  38   1.159  -3.539   6.031
  342    H    ARG  39           H        ARG  39  -2.595  -4.628   9.333
  343    HA   ARG  39           HA       ARG  39  -2.564  -6.347  11.649
  344   1HB   ARG  39          1HB       ARG  39  -3.388  -3.949  11.478
  345   2HB   ARG  39          2HB       ARG  39  -4.812  -4.530  10.601
  346   1HG   ARG  39          1HG       ARG  39  -4.012  -5.710  13.269
  347   2HG   ARG  39          2HG       ARG  39  -4.748  -4.102  13.203
  348   1HD   ARG  39          1HD       ARG  39  -6.784  -4.962  12.196
  349   2HD   ARG  39          2HD       ARG  39  -6.067  -6.557  11.975
  350    HE   ARG  39           HE       ARG  39  -6.520  -7.129  14.107
  351   1HH1  ARG  39          1HH1      ARG  39  -6.765  -3.590  13.905
  352   2HH1  ARG  39          2HH1      ARG  39  -7.323  -3.414  15.549
  353   1HH2  ARG  39          1HH2      ARG  39  -7.243  -6.879  16.254
  354   2HH2  ARG  39          2HH2      ARG  39  -7.598  -5.293  16.888
  355    H    LEU  40           H        LEU  40  -4.351  -6.343   8.597
  356    HA   LEU  40           HA       LEU  40  -5.960  -8.654   9.412
  357   1HB   LEU  40          1HB       LEU  40  -5.854  -7.050   6.862
  358   2HB   LEU  40          2HB       LEU  40  -7.068  -8.273   7.257
  359    HG   LEU  40           HG       LEU  40  -6.615  -5.758   8.955
  360   1HD1  LEU  40          1HD1      LEU  40  -8.641  -4.924   7.857
  361   2HD1  LEU  40          2HD1      LEU  40  -7.300  -5.152   6.713
  362   3HD1  LEU  40          3HD1      LEU  40  -8.617  -6.342   6.770
  363   1HD2  LEU  40          1HD2      LEU  40  -8.861  -6.318   9.836
  364   2HD2  LEU  40          2HD2      LEU  40  -8.827  -7.849   8.931
  365   3HD2  LEU  40          3HD2      LEU  40  -7.667  -7.548  10.243
  366    H    GLY  41           H        GLY  41  -2.818  -8.644   8.603
  367   1HA   GLY  41          1HA       GLY  41  -1.409 -10.243   7.831
  368   2HA   GLY  41          2HA       GLY  41  -2.761 -11.379   7.957
  369    H    ILE  42           H        ILE  42  -1.926  -8.571   5.870
  370    HA   ILE  42           HA       ILE  42  -2.591 -10.140   3.431
  371    HB   ILE  42           HB       ILE  42  -2.692  -7.172   3.990
  372   1HG1  ILE  42          1HG1      ILE  42  -4.554  -8.343   5.047
  373   2HG1  ILE  42          2HG1      ILE  42  -5.082  -7.305   3.717
  374   1HG2  ILE  42          1HG2      ILE  42  -3.778  -6.963   1.770
  375   2HG2  ILE  42          2HG2      ILE  42  -2.065  -7.360   1.721
  376   3HG2  ILE  42          3HG2      ILE  42  -3.272  -8.627   1.419
  377   1HD1  ILE  42          1HD1      ILE  42  -6.319  -9.400   3.705
  378   2HD1  ILE  42          2HD1      ILE  42  -5.313  -9.278   2.252
  379   3HD1  ILE  42          3HD1      ILE  42  -4.824 -10.338   3.601
  380    H    LYS  43           H        LYS  43  -1.164 -10.249   1.871
  381    HA   LYS  43           HA       LYS  43   1.539  -8.988   2.165
  382   1HB   LYS  43          1HB       LYS  43   0.851 -11.361   0.450
  383   2HB   LYS  43          2HB       LYS  43   2.426 -10.764   0.942
  384   1HG   LYS  43          1HG       LYS  43   2.008 -11.332   3.275
  385   2HG   LYS  43          2HG       LYS  43   0.384 -11.933   2.921
  386   1HD   LYS  43          1HD       LYS  43   2.607 -13.193   1.369
  387   2HD   LYS  43          2HD       LYS  43   2.560 -13.492   3.112
  388   1HE   LYS  43          1HE       LYS  43   1.409 -15.267   2.013
  389   2HE   LYS  43          2HE       LYS  43   0.239 -14.330   2.949
  390   1HZ   LYS  43          1HZ       LYS  43  -0.467 -13.290   0.900
  391   2HZ   LYS  43          2HZ       LYS  43  -0.415 -14.946   0.613
  392    H    GLY  44           H        GLY  44   2.485  -8.469  -0.141
  393   1HA   GLY  44          1HA       GLY  44   1.502  -8.349  -2.562
  394   2HA   GLY  44          2HA       GLY  44   0.339  -7.253  -1.827
  395    H    TYR  45           H        TYR  45   0.924  -5.269  -2.651
  396    HA   TYR  45           HA       TYR  45   3.189  -3.961  -1.590
  397   1HB   TYR  45          1HB       TYR  45   4.164  -5.528  -3.533
  398   2HB   TYR  45          2HB       TYR  45   3.509  -4.284  -4.564
  399    HD1  TYR  45           1HD      TYR  45   5.039  -2.649  -5.224
  400    HD2  TYR  45           2HD      TYR  45   5.689  -4.768  -1.532
  401    HE1  TYR  45           1HE      TYR  45   7.365  -1.811  -5.150
  402    HE2  TYR  45           2HE      TYR  45   7.997  -3.870  -1.424
  403    HH   TYR  45           HH       TYR  45   9.575  -2.533  -2.420
  404    H    ALA  46           H        ALA  46   2.929  -1.828  -1.773
  405    HA   ALA  46           HA       ALA  46   0.747  -0.694  -3.462
  406   1HB   ALA  46          1HB       ALA  46   0.759   1.121  -1.809
  407   2HB   ALA  46          2HB       ALA  46   0.390  -0.479  -1.138
  408   3HB   ALA  46          3HB       ALA  46   1.982   0.236  -0.877
  409    H    LYS  47           H        LYS  47   1.958  -0.388  -5.430
  410    HA   LYS  47           HA       LYS  47   4.527   1.048  -5.271
  411   1HB   LYS  47          1HB       LYS  47   4.853  -0.752  -6.519
  412   2HB   LYS  47          2HB       LYS  47   3.260  -0.741  -7.253
  413   1HG   LYS  47          1HG       LYS  47   3.858   1.082  -8.728
  414   2HG   LYS  47          2HG       LYS  47   5.393   1.349  -7.896
  415   1HD   LYS  47          1HD       LYS  47   4.672  -1.218  -9.370
  416   2HD   LYS  47          2HD       LYS  47   5.510   0.159 -10.107
  417   1HE   LYS  47          1HE       LYS  47   7.339  -0.056  -8.413
  418   2HE   LYS  47          2HE       LYS  47   6.550  -1.514  -7.776
  419   1HZ   LYS  47          1HZ       LYS  47   8.180  -2.140  -9.389
  420   2HZ   LYS  47          2HZ       LYS  47   7.416  -1.214 -10.576
  421    H    ASN  48           H        ASN  48   4.429   3.118  -5.141
  422    HA   ASN  48           HA       ASN  48   2.370   4.714  -6.454
  423   1HB   ASN  48          1HB       ASN  48   3.065   5.074  -4.121
  424   2HB   ASN  48          2HB       ASN  48   4.721   5.410  -4.635
  425   1HD2  ASN  48          2HD2      ASN  48   5.078   7.264  -6.135
  426   2HD2  ASN  48          1HD2      ASN  48   4.140   8.710  -5.806
  427    H    LEU  49           H        LEU  49   2.878   4.658  -8.727
  428    HA   LEU  49           HA       LEU  49   5.499   5.441  -9.724
  429   1HB   LEU  49          1HB       LEU  49   2.793   5.269 -11.091
  430   2HB   LEU  49          2HB       LEU  49   4.356   5.540 -11.855
  431    HG   LEU  49           HG       LEU  49   4.807   3.225 -10.350
  432   1HD1  LEU  49          1HD1      LEU  49   2.962   1.710 -10.901
  433   2HD1  LEU  49          2HD1      LEU  49   2.387   3.028  -9.863
  434   3HD1  LEU  49          3HD1      LEU  49   2.029   3.048 -11.603
  435   1HD2  LEU  49          1HD2      LEU  49   4.768   2.060 -12.533
  436   2HD2  LEU  49          2HD2      LEU  49   3.927   3.446 -13.263
  437   3HD2  LEU  49          3HD2      LEU  49   5.589   3.627 -12.652
  438    HA   PRO  50           HA       PRO  50   4.162   9.383  -8.123
  439   1HB   PRO  50          1HB       PRO  50   6.394  10.909  -8.389
  440   2HB   PRO  50          2HB       PRO  50   6.301   9.494  -7.306
  441   1HG   PRO  50          1HG       PRO  50   7.391   9.535 -10.140
  442   2HG   PRO  50          2HG       PRO  50   8.212   8.935  -8.666
  443   1HD   PRO  50          1HD       PRO  50   6.858   7.242 -10.310
  444   2HD   PRO  50          2HD       PRO  50   6.771   7.055  -8.534
  445    H    ASP  51           H        ASP  51   2.574   9.453  -9.848
  446    HA   ASP  51           HA       ASP  51   2.799  12.002 -11.324
  447   1HB   ASP  51          1HB       ASP  51   1.875   9.359 -12.562
  448   2HB   ASP  51          2HB       ASP  51   1.573  10.964 -13.252
  449    HD2  ASP  51           HD       ASP  51   5.243   9.286 -13.481
  450    H    GLY  52           H        GLY  52   0.344   9.385 -11.223
  451   1HA   GLY  52          1HA       GLY  52  -0.925  10.392  -8.854
  452   2HA   GLY  52          2HA       GLY  52  -1.835  10.878 -10.294
  453    H    SER  53           H        SER  53  -0.014   7.809 -10.038
  454    HA   SER  53           HA       SER  53  -2.558   6.269  -9.748
  455   1HB   SER  53          1HB       SER  53  -1.762   4.760 -11.439
  456   2HB   SER  53          2HB       SER  53  -2.011   6.402 -12.058
  457    HG   SER  53           HG       SER  53   0.294   6.691 -11.797
  458    H    VAL  54           H        VAL  54  -2.225   5.473  -7.638
  459    HA   VAL  54           HA       VAL  54   0.313   3.990  -7.142
  460    HB   VAL  54           HB       VAL  54  -0.012   5.622  -5.514
  461   1HG1  VAL  54          1HG1      VAL  54  -2.586   4.315  -4.604
  462   2HG1  VAL  54          2HG1      VAL  54  -1.827   5.797  -4.002
  463   3HG1  VAL  54          3HG1      VAL  54  -2.551   5.778  -5.616
  464   1HG2  VAL  54          1HG2      VAL  54  -0.634   2.866  -4.364
  465   2HG2  VAL  54          2HG2      VAL  54   0.968   3.435  -4.863
  466   3HG2  VAL  54          3HG2      VAL  54   0.126   4.228  -3.525
  467    H    GLU  55           H        GLU  55   0.214   1.992  -7.748
  468    HA   GLU  55           HA       GLU  55  -2.349   0.532  -7.927
  469   1HB   GLU  55          1HB       GLU  55  -0.797  -1.214  -8.961
  470   2HB   GLU  55          2HB       GLU  55  -1.218   0.234  -9.874
  471   1HG   GLU  55          1HG       GLU  55   0.932   1.207  -9.517
  472   2HG   GLU  55          2HG       GLU  55   1.368  -0.008  -8.304
  473    HE2  GLU  55           HE       GLU  55   2.271  -2.439 -10.620
  474    H    VAL  56           H        VAL  56  -3.014  -0.623  -6.253
  475    HA   VAL  56           HA       VAL  56  -1.025  -1.683  -4.297
  476    HB   VAL  56           HB       VAL  56  -3.958  -1.018  -3.896
  477   1HG1  VAL  56          1HG1      VAL  56  -1.778  -1.987  -1.991
  478   2HG1  VAL  56          2HG1      VAL  56  -3.387  -1.420  -1.491
  479   3HG1  VAL  56          3HG1      VAL  56  -3.233  -2.893  -2.450
  480   1HG2  VAL  56          1HG2      VAL  56  -1.378   0.371  -3.042
  481   2HG2  VAL  56          2HG2      VAL  56  -2.642   1.028  -4.103
  482   3HG2  VAL  56          3HG2      VAL  56  -2.981   0.737  -2.386
  483    H    VAL  57           H        VAL  57  -0.508  -3.662  -4.913
  484    HA   VAL  57           HA       VAL  57  -2.515  -5.718  -5.596
  485    HB   VAL  57           HB       VAL  57   0.493  -5.790  -5.040
  486   1HG1  VAL  57          1HG1      VAL  57  -1.453  -7.964  -5.860
  487   2HG1  VAL  57          2HG1      VAL  57   0.311  -8.132  -5.966
  488   3HG1  VAL  57          3HG1      VAL  57  -0.460  -7.936  -4.387
  489   1HG2  VAL  57          1HG2      VAL  57  -1.091  -6.093  -7.632
  490   2HG2  VAL  57          2HG2      VAL  57  -0.081  -4.698  -7.190
  491   3HG2  VAL  57          3HG2      VAL  57   0.666  -6.279  -7.458
  492    H    ALA  58           H        ALA  58  -3.514  -6.904  -3.989
  493    HA   ALA  58           HA       ALA  58  -2.380  -6.952  -1.242
  494   1HB   ALA  58          1HB       ALA  58  -4.578  -6.431  -0.314
  495   2HB   ALA  58          2HB       ALA  58  -4.027  -5.090  -1.346
  496   3HB   ALA  58          3HB       ALA  58  -5.249  -6.239  -1.934
  497    H    GLU  59           H        GLU  59  -2.335  -9.016  -0.579
  498    HA   GLU  59           HA       GLU  59  -3.863 -11.067  -2.032
  499   1HB   GLU  59          1HB       GLU  59  -1.362 -11.277  -0.367
  500   2HB   GLU  59          2HB       GLU  59  -2.137 -12.561  -1.312
  501   1HG   GLU  59          1HG       GLU  59  -1.893 -11.112  -3.369
  502   2HG   GLU  59          2HG       GLU  59  -0.924  -9.992  -2.406
  503    HE2  GLU  59           HE       GLU  59   0.586 -13.482  -3.730
  504    H    GLY  60           H        GLY  60  -5.797 -11.496  -0.933
  505   1HA   GLY  60          1HA       GLY  60  -5.680 -12.209   1.950
  506   2HA   GLY  60          2HA       GLY  60  -6.780 -10.919   1.431
  507    H    TYR  61           H        TYR  61  -7.614 -13.316   2.673
  508    HA   TYR  61           HA       TYR  61  -8.541 -15.262   0.767
  509   1HB   TYR  61          1HB       TYR  61  -8.998 -14.672   3.698
  510   2HB   TYR  61          2HB       TYR  61  -9.899 -15.930   2.877
  511    HD1  TYR  61           1HD      TYR  61  -6.544 -14.892   4.063
  512    HD2  TYR  61           2HD      TYR  61  -8.841 -18.046   2.209
  513    HE1  TYR  61           1HE      TYR  61  -4.771 -16.524   4.628
  514    HE2  TYR  61           2HE      TYR  61  -7.091 -19.676   2.836
  515    HH   TYR  61           HH       TYR  61  -5.120 -20.022   3.990
  516    H    GLU  62           H        GLU  62 -10.921 -14.047   2.997
  517    HA   GLU  62           HA       GLU  62 -12.333 -12.387   1.081
  518   1HB   GLU  62          1HB       GLU  62 -14.323 -13.718   0.954
  519   2HB   GLU  62          2HB       GLU  62 -12.918 -14.373   0.102
  520   1HG   GLU  62          1HG       GLU  62 -12.561 -15.930   2.103
  521   2HG   GLU  62          2HG       GLU  62 -14.172 -15.423   2.661
  522    HE2  GLU  62           HE       GLU  62 -15.823 -16.967  -0.102
  523    H    GLU  63           H        GLU  63 -12.987 -14.468   3.953
  524    HA   GLU  63           HA       GLU  63 -14.257 -12.882   5.718
  525   1HB   GLU  63          1HB       GLU  63 -11.835 -14.666   6.074
  526   2HB   GLU  63          2HB       GLU  63 -12.731 -13.968   7.424
  527   1HG   GLU  63          1HG       GLU  63 -14.016 -15.722   5.280
  528   2HG   GLU  63          2HG       GLU  63 -13.373 -16.320   6.809
  529    HE2  GLU  63           HE       GLU  63 -16.982 -14.636   6.729
  530    H    ALA  64           H        ALA  64 -10.777 -12.686   4.798
  531    HA   ALA  64           HA       ALA  64 -10.335 -10.233   6.399
  532   1HB   ALA  64          1HB       ALA  64  -7.993 -10.552   5.717
  533   2HB   ALA  64          2HB       ALA  64  -8.638 -12.051   6.415
  534   3HB   ALA  64          3HB       ALA  64  -8.462 -11.894   4.653
  535    H    LEU  65           H        LEU  65 -10.790 -11.191   2.977
  536    HA   LEU  65           HA       LEU  65  -9.647  -8.976   1.807
  537   1HB   LEU  65          1HB       LEU  65 -10.475 -10.797   0.501
  538   2HB   LEU  65          2HB       LEU  65 -12.158 -10.301   0.844
  539    HG   LEU  65           HG       LEU  65 -11.979  -8.299  -0.337
  540   1HD1  LEU  65          1HD1      LEU  65  -9.910  -7.609  -1.548
  541   2HD1  LEU  65          2HD1      LEU  65  -9.719  -7.458   0.189
  542   3HD1  LEU  65          3HD1      LEU  65  -8.986  -8.839  -0.663
  543   1HD2  LEU  65          1HD2      LEU  65 -11.510  -9.094  -2.580
  544   2HD2  LEU  65          2HD2      LEU  65 -10.470 -10.382  -1.931
  545   3HD2  LEU  65          3HD2      LEU  65 -12.230 -10.423  -1.636
  546    H    SER  66           H        SER  66 -13.151  -9.338   2.532
  547    HA   SER  66           HA       SER  66 -14.194  -6.845   2.206
  548   1HB   SER  66          1HB       SER  66 -15.768  -7.483   4.062
  549   2HB   SER  66          2HB       SER  66 -15.539  -8.735   2.829
  550    HG   SER  66           HG       SER  66 -14.137  -9.812   4.218
  551    H    LYS  67           H        LYS  67 -12.352  -7.894   5.089
  552    HA   LYS  67           HA       LYS  67 -12.799  -5.512   6.600
  553   1HB   LYS  67          1HB       LYS  67 -10.619  -7.643   6.786
  554   2HB   LYS  67          2HB       LYS  67 -10.937  -6.426   8.020
  555   1HG   LYS  67          1HG       LYS  67 -12.780  -8.639   7.076
  556   2HG   LYS  67          2HG       LYS  67 -11.948  -8.551   8.629
  557   1HD   LYS  67          1HD       LYS  67 -14.260  -6.823   7.640
  558   2HD   LYS  67          2HD       LYS  67 -14.298  -8.077   8.878
  559   1HE   LYS  67          1HE       LYS  67 -12.774  -6.732  10.315
  560   2HE   LYS  67          2HE       LYS  67 -12.778  -5.438   9.097
  561   1HZ   LYS  67          1HZ       LYS  67 -14.443  -4.977  10.733
  562   2HZ   LYS  67          2HZ       LYS  67 -15.217  -6.443  10.412
  563    H    LEU  68           H        LEU  68 -10.350  -6.290   4.151
  564    HA   LEU  68           HA       LEU  68  -8.926  -3.750   4.546
  565   1HB   LEU  68          1HB       LEU  68  -7.586  -5.499   3.740
  566   2HB   LEU  68          2HB       LEU  68  -8.778  -6.006   2.543
  567    HG   LEU  68           HG       LEU  68  -8.380  -4.037   1.174
  568   1HD1  LEU  68          1HD1      LEU  68  -6.555  -2.479   1.643
  569   2HD1  LEU  68          2HD1      LEU  68  -7.768  -2.345   2.911
  570   3HD1  LEU  68          3HD1      LEU  68  -6.270  -3.239   3.227
  571   1HD2  LEU  68          1HD2      LEU  68  -6.096  -4.549   0.480
  572   2HD2  LEU  68          2HD2      LEU  68  -5.801  -5.405   2.010
  573   3HD2  LEU  68          3HD2      LEU  68  -6.996  -6.035   0.849
  574    H    LEU  69           H        LEU  69 -11.034  -5.162   1.974
  575    HA   LEU  69           HA       LEU  69 -11.084  -3.130   0.323
  576   1HB   LEU  69          1HB       LEU  69 -12.234  -5.528   0.425
  577   2HB   LEU  69          2HB       LEU  69 -13.682  -4.619   0.813
  578    HG   LEU  69           HG       LEU  69 -13.578  -5.190  -1.470
  579   1HD1  LEU  69          1HD1      LEU  69 -13.852  -3.017  -2.577
  580   2HD1  LEU  69          2HD1      LEU  69 -14.530  -2.948  -0.935
  581   3HD1  LEU  69          3HD1      LEU  69 -12.937  -2.225  -1.278
  582   1HD2  LEU  69          1HD2      LEU  69 -11.869  -4.532  -3.053
  583   2HD2  LEU  69          2HD2      LEU  69 -10.954  -3.682  -1.804
  584   3HD2  LEU  69          3HD2      LEU  69 -11.143  -5.450  -1.724
  585    H    GLU  70           H        GLU  70 -13.505  -3.629   2.921
  586    HA   GLU  70           HA       GLU  70 -15.005  -1.250   2.529
  587   1HB   GLU  70          1HB       GLU  70 -14.724  -3.130   4.914
  588   2HB   GLU  70          2HB       GLU  70 -15.928  -1.838   4.795
  589   1HG   GLU  70          1HG       GLU  70 -16.889  -2.855   2.778
  590   2HG   GLU  70          2HG       GLU  70 -15.715  -4.175   2.853
  591    HE2  GLU  70           HE       GLU  70 -17.186  -5.584   5.793
  592    H    ARG  71           H        ARG  71 -12.208  -1.982   4.651
  593    HA   ARG  71           HA       ARG  71 -11.922   0.326   6.219
  594   1HB   ARG  71          1HB       ARG  71 -10.186  -0.852   6.687
  595   2HB   ARG  71          2HB       ARG  71 -10.227  -1.747   5.200
  596   1HG   ARG  71          1HG       ARG  71  -8.111  -0.721   5.373
  597   2HG   ARG  71          2HG       ARG  71  -8.940   0.034   4.050
  598   1HD   ARG  71          1HD       ARG  71  -9.492   1.464   6.547
  599   2HD   ARG  71          2HD       ARG  71  -7.777   1.241   6.354
  600    HE   ARG  71           HE       ARG  71  -9.428   3.113   5.013
  601   1HH1  ARG  71          1HH1      ARG  71  -6.810   0.904   4.081
  602   2HH1  ARG  71          2HH1      ARG  71  -6.265   1.941   2.783
  603   1HH2  ARG  71          1HH2      ARG  71  -8.655   4.448   3.377
  604   2HH2  ARG  71          2HH2      ARG  71  -7.276   3.978   2.410
  605    H    ILE  72           H        ILE  72 -11.114  -0.059   2.772
  606    HA   ILE  72           HA       ILE  72 -10.203   2.680   2.568
  607    HB   ILE  72           HB       ILE  72 -10.948   0.870   0.259
  608   1HG1  ILE  72          1HG1      ILE  72  -8.099   1.252   1.253
  609   2HG1  ILE  72          2HG1      ILE  72  -9.094  -0.020   1.954
  610   1HG2  ILE  72          1HG2      ILE  72  -9.266   2.336  -0.932
  611   2HG2  ILE  72          2HG2      ILE  72 -10.645   3.261  -0.322
  612   3HG2  ILE  72          3HG2      ILE  72  -9.098   3.293   0.547
  613   1HD1  ILE  72          1HD1      ILE  72  -7.805  -0.934   0.134
  614   2HD1  ILE  72          2HD1      ILE  72  -9.546  -1.026  -0.192
  615   3HD1  ILE  72          3HD1      ILE  72  -8.550   0.200  -1.010
  616    H    LYS  73           H        LYS  73 -13.166   1.113   1.271
  617    HA   LYS  73           HA       LYS  73 -14.298   3.391   0.256
  618   1HB   LYS  73          1HB       LYS  73 -15.551   0.876   1.330
  619   2HB   LYS  73          2HB       LYS  73 -16.541   2.230   0.775
  620   1HG   LYS  73          1HG       LYS  73 -16.318   0.828  -1.089
  621   2HG   LYS  73          2HG       LYS  73 -15.318   2.247  -1.407
  622   1HD   LYS  73          1HD       LYS  73 -13.307   0.847  -0.642
  623   2HD   LYS  73          2HD       LYS  73 -14.413  -0.534  -0.575
  624   1HE   LYS  73          1HE       LYS  73 -13.760   1.202  -3.019
  625   2HE   LYS  73          2HE       LYS  73 -13.032  -0.369  -2.674
  626   1HZ   LYS  73          1HZ       LYS  73 -14.854  -0.675  -4.177
  627   2HZ   LYS  73          2HZ       LYS  73 -15.931   0.029  -3.083
  628    H    GLN  74           H        GLN  74 -14.822   2.109   3.566
  629    HA   GLN  74           HA       GLN  74 -16.525   4.206   4.513
  630   1HB   GLN  74          1HB       GLN  74 -14.777   2.191   5.979
  631   2HB   GLN  74          2HB       GLN  74 -16.007   3.212   6.739
  632   1HG   GLN  74          1HG       GLN  74 -17.781   2.185   5.433
  633   2HG   GLN  74          2HG       GLN  74 -16.624   1.211   4.516
  634   1HE2  GLN  74          1HE2      GLN  74 -18.476  -0.302   5.538
  635   2HE2  GLN  74          2HE2      GLN  74 -17.954  -1.122   6.995
  636    H    GLY  75           H        GLY  75 -13.008   3.577   4.767
  637   1HA   GLY  75          1HA       GLY  75 -12.505   6.259   5.999
  638   2HA   GLY  75          2HA       GLY  75 -11.500   4.829   6.108
  639    HA   PRO  76           HA       PRO  76 -11.166   6.313   1.489
  640   1HB   PRO  76          1HB       PRO  76 -11.653   9.001   0.991
  641   2HB   PRO  76          2HB       PRO  76 -12.906   7.725   0.928
  642   1HG   PRO  76          1HG       PRO  76 -12.214   9.551   3.247
  643   2HG   PRO  76          2HG       PRO  76 -13.830   9.258   2.530
  644   1HD   PRO  76          1HD       PRO  76 -13.056   7.937   4.726
  645   2HD   PRO  76          2HD       PRO  76 -13.906   7.050   3.421
  646    HA   PRO  77           HA       PRO  77  -7.092   7.948   2.189
  647   1HB   PRO  77          1HB       PRO  77  -6.279   8.886  -0.231
  648   2HB   PRO  77          2HB       PRO  77  -6.595   7.144   0.049
  649   1HG   PRO  77          1HG       PRO  77  -8.507   9.162  -1.138
  650   2HG   PRO  77          2HG       PRO  77  -8.025   7.576  -1.823
  651   1HD   PRO  77          1HD       PRO  77 -10.291   7.856  -0.390
  652   2HD   PRO  77          2HD       PRO  77  -9.279   6.402  -0.184
  653    H    ALA  78           H        ALA  78  -6.062   9.933   2.720
  654    HA   ALA  78           HA       ALA  78  -7.859  12.204   3.007
  655   1HB   ALA  78          1HB       ALA  78  -6.073  13.112   4.400
  656   2HB   ALA  78          2HB       ALA  78  -6.391  11.421   4.832
  657   3HB   ALA  78          3HB       ALA  78  -4.963  11.835   3.857
  658    H    ALA  79           H        ALA  79  -7.581  11.895   0.312
  659    HA   ALA  79           HA       ALA  79  -6.133  14.293  -0.583
  660   1HB   ALA  79          1HB       ALA  79  -4.837  13.042  -2.219
  661   2HB   ALA  79          2HB       ALA  79  -4.419  12.570  -0.558
  662   3HB   ALA  79          3HB       ALA  79  -5.443  11.507  -1.546
  663    H    GLU  80           H        GLU  80  -6.582  14.602  -2.933
  664    HA   GLU  80           HA       GLU  80  -9.380  14.109  -3.549
  665   1HB   GLU  80          1HB       GLU  80  -7.165  15.443  -5.162
  666   2HB   GLU  80          2HB       GLU  80  -8.885  15.421  -5.582
  667   1HG   GLU  80          1HG       GLU  80  -9.427  16.629  -3.494
  668   2HG   GLU  80          2HG       GLU  80  -7.714  16.638  -3.037
  669    HE2  GLU  80           HE       GLU  80  -8.926  18.999  -6.123
  670    H    VAL  81           H        VAL  81  -9.203  11.769  -3.462
  671    HA   VAL  81           HA       VAL  81  -7.976  10.238  -5.550
  672    HB   VAL  81           HB       VAL  81  -8.694   9.323  -3.440
  673   1HG1  VAL  81          1HG1      VAL  81 -11.582   9.449  -4.354
  674   2HG1  VAL  81          2HG1      VAL  81 -10.941   8.807  -2.841
  675   3HG1  VAL  81          3HG1      VAL  81 -10.873  10.549  -3.146
  676   1HG2  VAL  81          1HG2      VAL  81 -10.071   8.034  -5.835
  677   2HG2  VAL  81          2HG2      VAL  81  -8.372   7.832  -5.357
  678   3HG2  VAL  81          3HG2      VAL  81  -9.661   7.224  -4.310
  679    H    GLU  82           H        GLU  82  -8.412  10.057  -7.569
  680    HA   GLU  82           HA       GLU  82 -10.534  11.609  -8.839
  681   1HB   GLU  82          1HB       GLU  82  -8.253  11.531  -9.751
  682   2HB   GLU  82          2HB       GLU  82  -8.330   9.773  -9.892
  683   1HG   GLU  82          1HG       GLU  82 -10.247  10.032 -11.522
  684   2HG   GLU  82          2HG       GLU  82 -10.061  11.788 -11.394
  685    HE2  GLU  82           HE       GLU  82  -7.376   9.561 -13.470
  686    H    LYS  83           H        LYS  83  -9.437   8.187  -8.818
  687    HA   LYS  83           HA       LYS  83 -12.013   7.140  -8.223
  688   1HB   LYS  83          1HB       LYS  83 -12.562   6.022 -10.339
  689   2HB   LYS  83          2HB       LYS  83 -12.576   7.769 -10.543
  690   1HG   LYS  83          1HG       LYS  83 -10.136   7.511 -11.425
  691   2HG   LYS  83          2HG       LYS  83 -10.506   5.775 -11.509
  692   1HD   LYS  83          1HD       LYS  83 -12.473   6.308 -12.960
  693   2HD   LYS  83          2HD       LYS  83 -12.000   8.023 -12.915
  694   1HE   LYS  83          1HE       LYS  83  -9.782   7.417 -13.900
  695   2HE   LYS  83          2HE       LYS  83 -10.301   5.720 -13.988
  696   1HZ   LYS  83          1HZ       LYS  83 -10.712   6.782 -16.082
  697   2HZ   LYS  83          2HZ       LYS  83 -11.700   7.937 -15.346
  698    H    VAL  84           H        VAL  84 -11.670   5.158  -7.287
  699    HA   VAL  84           HA       VAL  84  -9.187   3.684  -7.966
  700    HB   VAL  84           HB       VAL  84  -9.406   4.039  -5.743
  701   1HG1  VAL  84          1HG1      VAL  84 -12.135   2.689  -5.685
  702   2HG1  VAL  84          2HG1      VAL  84 -11.169   3.206  -4.295
  703   3HG1  VAL  84          3HG1      VAL  84 -11.808   4.414  -5.413
  704   1HG2  VAL  84          1HG2      VAL  84 -10.156   1.148  -6.299
  705   2HG2  VAL  84          2HG2      VAL  84  -8.560   1.854  -6.602
  706   3HG2  VAL  84          3HG2      VAL  84  -9.196   1.765  -4.943
  707    H    ASP  85           H        ASP  85  -9.545   2.730  -9.939
  708    HA   ASP  85           HA       ASP  85 -12.080   1.322 -10.489
  709   1HB   ASP  85          1HB       ASP  85 -11.065   2.723 -12.234
  710   2HB   ASP  85          2HB       ASP  85  -9.578   1.767 -12.162
  711    HD2  ASP  85           HD       ASP  85 -10.885  -0.149 -14.734
  712    H    TYR  86           H        TYR  86 -11.598  -0.101  -8.551
  713    HA   TYR  86           HA       TYR  86  -9.281  -1.772  -8.744
  714   1HB   TYR  86          1HB       TYR  86  -9.697  -2.466  -6.654
  715   2HB   TYR  86          2HB       TYR  86 -10.692  -1.028  -6.606
  716    HD1  TYR  86           1HD      TYR  86 -13.193  -1.285  -6.592
  717    HD2  TYR  86           2HD      TYR  86 -10.551  -4.696  -6.571
  718    HE1  TYR  86           1HE      TYR  86 -15.014  -2.699  -5.677
  719    HE2  TYR  86           2HE      TYR  86 -12.372  -6.102  -5.671
  720    HH   TYR  86           HH       TYR  86 -14.550  -6.172  -4.931
  721    H    SER  87           H        SER  87  -9.154  -4.038  -9.035
  722    HA   SER  87           HA       SER  87 -11.467  -5.476 -10.112
  723   1HB   SER  87          1HB       SER  87  -9.016  -5.009 -11.869
  724   2HB   SER  87          2HB       SER  87 -10.407  -6.053 -12.228
  725    HG   SER  87           HG       SER  87 -11.590  -3.904 -11.795
  726    H    PHE  88           H        PHE  88 -11.305  -7.081  -8.637
  727    HA   PHE  88           HA       PHE  88  -8.893  -8.028  -7.557
  728   1HB   PHE  88          1HB       PHE  88 -10.260  -9.126  -6.171
  729   2HB   PHE  88          2HB       PHE  88 -11.550  -8.244  -6.925
  730    HD1  PHE  88           1HD      PHE  88 -12.958  -9.323  -8.726
  731    HD2  PHE  88           2HD      PHE  88  -9.972 -11.529  -6.533
  732    HE1  PHE  88           1HE      PHE  88 -13.934 -11.457  -9.534
  733    HE2  PHE  88           2HE      PHE  88 -10.941 -13.658  -7.367
  734    HZ   PHE  88           HZ       PHE  88 -12.926 -13.624  -8.854
  735    H    SER  89           H        SER  89  -7.707  -9.942  -7.906
  736    HA   SER  89           HA       SER  89  -8.097 -11.346 -10.499
  737   1HB   SER  89          1HB       SER  89  -5.461 -10.329  -9.395
  738   2HB   SER  89          2HB       SER  89  -5.749 -11.083 -10.970
  739    HG   SER  89           HG       SER  89  -7.187  -9.276 -11.386
  740    H    GLU  90           H        GLU  90  -6.117 -13.070 -10.459
  741    HA   GLU  90           HA       GLU  90  -6.317 -14.653  -7.950
  742   1HB   GLU  90          1HB       GLU  90  -5.806 -16.595  -9.183
  743   2HB   GLU  90          2HB       GLU  90  -7.170 -15.804  -9.969
  744   1HG   GLU  90          1HG       GLU  90  -4.261 -15.701 -10.921
  745   2HG   GLU  90          2HG       GLU  90  -5.510 -16.771 -11.547
  746    HE2  GLU  90           HE       GLU  90  -7.047 -14.365 -13.529
  747    H    TYR  91           H        TYR  91  -4.372 -15.429  -7.015
  748    HA   TYR  91           HA       TYR  91  -2.164 -13.634  -7.289
  749   1HB   TYR  91          1HB       TYR  91  -1.409 -14.605  -5.335
  750   2HB   TYR  91          2HB       TYR  91  -3.162 -14.684  -5.184
  751    HD1  TYR  91           1HD      TYR  91  -4.330 -16.954  -5.698
  752    HD2  TYR  91           2HD      TYR  91  -0.070 -16.549  -5.156
  753    HE1  TYR  91           1HE      TYR  91  -4.142 -19.385  -5.353
  754    HE2  TYR  91           2HE      TYR  91   0.116 -18.993  -4.818
  755    HH   TYR  91           HH       TYR  91  -1.018 -20.994  -4.652
  756    H    LYS  92           H        LYS  92  -0.097 -13.993  -7.967
  757    HA   LYS  92           HA       LYS  92   0.422 -16.268  -9.762
  758   1HB   LYS  92          1HB       LYS  92   1.151 -14.063 -10.470
  759   2HB   LYS  92          2HB       LYS  92   2.045 -13.823  -8.962
  760   1HG   LYS  92          1HG       LYS  92   3.574 -14.360 -10.747
  761   2HG   LYS  92          2HG       LYS  92   3.586 -15.678  -9.572
  762   1HD   LYS  92          1HD       LYS  92   2.132 -17.033 -11.051
  763   2HD   LYS  92          2HD       LYS  92   2.018 -15.675 -12.197
  764   1HE   LYS  92          1HE       LYS  92   4.467 -15.796 -12.577
  765   2HE   LYS  92          2HE       LYS  92   4.589 -17.123 -11.402
  766   1HZ   LYS  92          1HZ       LYS  92   4.437 -18.031 -13.599
  767   2HZ   LYS  92          2HZ       LYS  92   2.961 -17.254 -13.861
  768    H    GLY  93           H        GLY  93   1.905 -14.709  -6.881
  769   1HA   GLY  93          1HA       GLY  93   2.318 -17.248  -5.516
  770   2HA   GLY  93          2HA       GLY  93   3.796 -16.357  -5.957
  771    H    GLU  94           H        GLU  94   3.387 -16.640  -3.330
  772    HA   GLU  94           HA       GLU  94   1.957 -14.362  -2.170
  773   1HB   GLU  94          1HB       GLU  94   2.807 -15.237  -0.046
  774   2HB   GLU  94          2HB       GLU  94   1.680 -16.270  -0.927
  775   1HG   GLU  94          1HG       GLU  94   3.500 -17.737  -1.664
  776   2HG   GLU  94          2HG       GLU  94   4.695 -16.694  -0.876
  777    HE2  GLU  94           HE       GLU  94   4.252 -19.322   1.489
  778    H    PHE  95           H        PHE  95   2.859 -12.460  -2.237
  779    HA   PHE  95           HA       PHE  95   5.562 -11.923  -2.959
  780   1HB   PHE  95          1HB       PHE  95   3.325 -10.204  -1.844
  781   2HB   PHE  95          2HB       PHE  95   4.912  -9.585  -2.243
  782    HD1  PHE  95           1HD      PHE  95   4.014  -7.949  -3.762
  783    HD2  PHE  95           2HD      PHE  95   3.479 -12.161  -4.536
  784    HE1  PHE  95           1HE      PHE  95   3.147  -7.438  -6.020
  785    HE2  PHE  95           2HE      PHE  95   2.609 -11.644  -6.765
  786    HZ   PHE  95           HZ       PHE  95   2.438  -9.280  -7.529
  787    H    GLU  96           H        GLU  96   3.878 -12.027   0.162
  788    HA   GLU  96           HA       GLU  96   4.521 -11.898   2.307
  789   1HB   GLU  96          1HB       GLU  96   7.101 -13.124   1.221
  790   2HB   GLU  96          2HB       GLU  96   6.552 -13.146   2.904
  791   1HG   GLU  96          1HG       GLU  96   4.525 -14.425   2.205
  792   2HG   GLU  96          2HG       GLU  96   5.142 -14.462   0.548
  793    HE2  GLU  96           HE       GLU  96   7.117 -16.602   3.397
  794    H    ASP  97           H        ASP  97   4.458  -9.562   1.721
  795    HA   ASP  97           HA       ASP  97   5.704  -8.025   3.480
  796   1HB   ASP  97          1HB       ASP  97   7.971  -8.437   2.770
  797   2HB   ASP  97          2HB       ASP  97   7.564  -8.114   1.070
  798    HD2  ASP  97           HD       ASP  97   7.899  -5.029   3.723
  799    H    PHE  98           H        PHE  98   3.552  -7.172   3.184
  800    HA   PHE  98           HA       PHE  98   2.829  -5.831   0.689
  801   1HB   PHE  98          1HB       PHE  98   1.098  -6.787   2.100
  802   2HB   PHE  98          2HB       PHE  98   1.561  -5.758   3.439
  803    HD1  PHE  98           1HD      PHE  98  -0.163  -5.943   0.169
  804    HD2  PHE  98           2HD      PHE  98   0.922  -3.372   3.448
  805    HE1  PHE  98           1HE      PHE  98  -1.757  -4.216  -0.627
  806    HE2  PHE  98           2HE      PHE  98  -0.462  -1.559   2.481
  807    HZ   PHE  98           HZ       PHE  98  -1.837  -1.995   0.469
  808    H    GLU  99           H        GLU  99   4.699  -4.430   0.430
  809    HA   GLU  99           HA       GLU  99   4.926  -2.210   2.429
  810   1HB   GLU  99          1HB       GLU  99   6.723  -3.783   2.264
  811   2HB   GLU  99          2HB       GLU  99   6.993  -3.346   0.571
  812   1HG   GLU  99          1HG       GLU  99   7.544  -1.031   1.260
  813   2HG   GLU  99          2HG       GLU  99   7.093  -1.403   2.931
  814    HE2  GLU  99           HE       GLU  99  10.681  -2.527   1.464
  815    H    THR 100           H        THR 100   5.385  -0.130   1.712
  816    HA   THR 100           HA       THR 100   4.139   0.543  -0.841
  817    HB   THR 100           HB       THR 100   3.204   2.180   0.146
  818    HG1  THR 100           1HG      THR 100   4.426   3.790   1.333
  819   1HG2  THR 100          1HG2      THR 100   3.178   2.390   2.589
  820   2HG2  THR 100          2HG2      THR 100   3.101   0.698   2.083
  821   3HG2  THR 100          3HG2      THR 100   4.621   1.378   2.723
  822    H    TYR 101           H        TYR 101   5.257   1.005  -2.577
  823    HA   TYR 101           HA       TYR 101   8.093   1.939  -2.451
  824   1HB   TYR 101          1HB       TYR 101   7.962   0.068  -3.768
  825   2HB   TYR 101          2HB       TYR 101   6.403   0.455  -4.463
  826    HD1  TYR 101           1HD      TYR 101   6.328   2.604  -6.052
  827    HD2  TYR 101           2HD      TYR 101   9.755   0.141  -5.223
  828    HE1  TYR 101           1HE      TYR 101   7.425   3.452  -8.094
  829    HE2  TYR 101           2HE      TYR 101  10.851   0.972  -7.282
  830    HH   TYR 101           HH       TYR 101  10.689   2.374  -9.101
  Start of MODEL   11
    1   1H    GLY  -1          1H        GLY  -1   8.968  -7.634  12.475
    2   2H    GLY  -1          2H        GLY  -1   9.749  -7.585  13.930
    3   3H    GLY  -1          3H        GLY  -1  10.473  -8.300  12.634
    4   1HA   GLY  -1          1HA       GLY  -1   8.025  -9.228  13.957
    5   2HA   GLY  -1          2HA       GLY  -1   8.812 -10.011  12.577
    6    H    SER   0           H        SER   0  10.192 -11.635  13.080
    7    HA   SER   0           HA       SER   0  11.621 -12.993  14.122
    8   1HB   SER   0          1HB       SER   0  12.368 -10.694  15.973
    9   2HB   SER   0          2HB       SER   0  13.332 -12.118  15.571
   10    HG   SER   0           HG       SER   0  13.362 -11.396  13.406
   11    H    MET   1           H        MET   1  12.313 -13.790  16.515
   12    HA   MET   1           HA       MET   1   9.872 -14.803  17.621
   13   1HB   MET   1          1HB       MET   1  11.274 -16.069  19.112
   14   2HB   MET   1          2HB       MET   1  11.811 -16.171  17.436
   15   1HG   MET   1          1HG       MET   1  13.578 -14.380  18.057
   16   2HG   MET   1          2HG       MET   1  13.122 -14.694  19.734
   17   1HE   MET   1          1HE       MET   1  13.839 -16.998  16.517
   18   2HE   MET   1          2HE       MET   1  15.479 -17.507  16.974
   19   3HE   MET   1          3HE       MET   1  15.137 -15.789  16.678
   20    H    LYS   2           H        LYS   2   8.569 -13.399  18.605
   21    HA   LYS   2           HA       LYS   2   9.590 -11.769  20.905
   22   1HB   LYS   2          1HB       LYS   2   7.361 -11.215  18.910
   23   2HB   LYS   2          2HB       LYS   2   7.624 -10.286  20.392
   24   1HG   LYS   2          1HG       LYS   2   9.636 -10.580  18.115
   25   2HG   LYS   2          2HG       LYS   2   8.539  -9.214  18.355
   26   1HD   LYS   2          1HD       LYS   2   9.590  -8.876  20.646
   27   2HD   LYS   2          2HD       LYS   2  10.837 -10.047  20.178
   28   1HE   LYS   2          1HE       LYS   2  10.200  -7.448  18.710
   29   2HE   LYS   2          2HE       LYS   2  11.556  -7.709  19.821
   30   1HZ   LYS   2          1HZ       LYS   2  12.312  -8.030  17.593
   31   2HZ   LYS   2          2HZ       LYS   2  11.163  -9.239  17.328
   32    H    LYS   3           H        LYS   3   6.559 -13.197  19.601
   33    HA   LYS   3           HA       LYS   3   5.945 -14.256  22.323
   34   1HB   LYS   3          1HB       LYS   3   3.623 -14.263  21.714
   35   2HB   LYS   3          2HB       LYS   3   4.272 -12.633  21.737
   36   1HG   LYS   3          1HG       LYS   3   4.032 -14.175  19.122
   37   2HG   LYS   3          2HG       LYS   3   2.612 -13.458  19.850
   38   1HD   LYS   3          1HD       LYS   3   5.106 -11.869  19.114
   39   2HD   LYS   3          2HD       LYS   3   3.712 -12.083  18.065
   40   1HE   LYS   3          1HE       LYS   3   3.624 -10.717  20.798
   41   2HE   LYS   3          2HE       LYS   3   3.712  -9.910  19.230
   42   1HZ   LYS   3          1HZ       LYS   3   1.443 -10.021  19.896
   43   2HZ   LYS   3          2HZ       LYS   3   1.506 -11.704  20.019
   44    H    TRP   4           H        TRP   4   5.337 -16.392  22.487
   45    HA   TRP   4           HA       TRP   4   6.224 -18.147  20.282
   46   1HB   TRP   4          1HB       TRP   4   5.411 -18.790  23.132
   47   2HB   TRP   4          2HB       TRP   4   6.191 -19.877  21.978
   48    HD1  TRP   4           HD       TRP   4   6.989 -17.670  24.764
   49    HE1  TRP   4           1HE      TRP   4   9.505 -17.094  24.881
   50    HE3  TRP   4           3HE      TRP   4   8.433 -19.275  20.116
   51    HZ2  TRP   4           2HZ      TRP   4  11.800 -17.281  23.194
   52    HZ3  TRP   4           3HZ      TRP   4  10.788 -19.038  19.397
   53    HH2  TRP   4           HH       TRP   4  12.480 -18.057  20.926
   54    H    SER   5           H        SER   5   4.183 -17.039  19.247
   55    HA   SER   5           HA       SER   5   1.828 -18.849  19.592
   56   1HB   SER   5          1HB       SER   5   1.417 -16.631  20.598
   57   2HB   SER   5          2HB       SER   5   1.821 -15.851  19.055
   58    HG   SER   5           HG       SER   5   0.061 -16.926  18.126
   59    H    ASP   6           H        ASP   6   0.651 -19.264  17.654
   60    HA   ASP   6           HA       ASP   6   1.441 -18.228  15.113
   61   1HB   ASP   6          1HB       ASP   6   3.289 -19.852  15.422
   62   2HB   ASP   6          2HB       ASP   6   2.123 -21.132  15.789
   63    HD2  ASP   6           HD       ASP   6   1.220 -21.664  12.468
   64    H    THR   7           H        THR   7  -0.007 -18.976  13.432
   65    HA   THR   7           HA       THR   7  -2.398 -20.521  14.301
   66    HB   THR   7           HB       THR   7  -3.798 -18.907  13.039
   67    HG1  THR   7           1HG      THR   7  -2.851 -16.926  12.447
   68   1HG2  THR   7          1HG2      THR   7  -3.818 -17.106  14.665
   69   2HG2  THR   7          2HG2      THR   7  -3.501 -18.636  15.507
   70   3HG2  THR   7          3HG2      THR   7  -2.173 -17.493  15.198
   71    H    GLU   8           H        GLU   8  -3.725 -21.039  12.265
   72    HA   GLU   8           HA       GLU   8  -2.035 -21.567   9.886
   73   1HB   GLU   8          1HB       GLU   8  -3.058 -23.740   9.595
   74   2HB   GLU   8          2HB       GLU   8  -2.164 -23.658  11.122
   75   1HG   GLU   8          1HG       GLU   8  -4.289 -23.258  12.336
   76   2HG   GLU   8          2HG       GLU   8  -5.176 -23.343  10.802
   77    HE2  GLU   8           HE       GLU   8  -3.608 -26.755  12.379
   78    H    VAL   9           H        VAL   9  -3.213 -21.598   7.906
   79    HA   VAL   9           HA       VAL   9  -5.997 -20.775   7.826
   80    HB   VAL   9           HB       VAL   9  -4.764 -18.691   8.488
   81   1HG1  VAL   9          1HG1      VAL   9  -3.436 -18.831   5.755
   82   2HG1  VAL   9          2HG1      VAL   9  -3.313 -17.532   6.951
   83   3HG1  VAL   9          3HG1      VAL   9  -2.620 -19.120   7.308
   84   1HG2  VAL   9          1HG2      VAL   9  -6.101 -18.670   5.773
   85   2HG2  VAL   9          2HG2      VAL   9  -6.844 -18.455   7.375
   86   3HG2  VAL   9          3HG2      VAL   9  -5.735 -17.228   6.742
   87    H    PHE  10           H        PHE  10  -6.830 -21.130   5.721
   88    HA   PHE  10           HA       PHE  10  -5.391 -21.536   3.383
   89   1HB   PHE  10          1HB       PHE  10  -5.445 -24.087   3.233
   90   2HB   PHE  10          2HB       PHE  10  -4.215 -23.406   4.257
   91    HD1  PHE  10           1HD      PHE  10  -3.958 -24.142   6.487
   92    HD2  PHE  10           2HD      PHE  10  -7.646 -24.953   4.394
   93    HE1  PHE  10           1HE      PHE  10  -4.726 -25.540   8.370
   94    HE2  PHE  10           2HE      PHE  10  -8.413 -26.338   6.295
   95    HZ   PHE  10           HZ       PHE  10  -6.963 -26.624   8.296
   96    H    GLU  11           H        GLU  11  -7.999 -20.575   4.425
   97    HA   GLU  11           HA       GLU  11  -9.928 -22.286   3.012
   98   1HB   GLU  11          1HB       GLU  11 -11.616 -20.911   3.907
   99   2HB   GLU  11          2HB       GLU  11 -10.532 -21.402   5.198
  100   1HG   GLU  11          1HG       GLU  11 -10.437 -18.644   3.861
  101   2HG   GLU  11          2HG       GLU  11 -11.425 -19.043   5.254
  102    HE2  GLU  11           HE       GLU  11  -8.528 -17.473   6.641
  103    H    MET  12           H        MET  12  -8.037 -21.408   1.293
  104    HA   MET  12           HA       MET  12  -7.680 -20.574  -0.723
  105   1HB   MET  12          1HB       MET  12 -10.617 -19.831  -0.792
  106   2HB   MET  12          2HB       MET  12  -9.467 -19.712  -2.091
  107   1HG   MET  12          1HG       MET  12 -10.666 -21.738  -2.461
  108   2HG   MET  12          2HG       MET  12  -9.049 -22.201  -1.927
  109   1HE   MET  12          1HE       MET  12 -11.428 -24.206  -2.172
  110   2HE   MET  12          2HE       MET  12 -11.336 -25.110  -0.643
  111   3HE   MET  12          3HE       MET  12  -9.844 -24.697  -1.521
  112    H    LEU  13           H        LEU  13  -6.857 -18.827  -1.617
  113    HA   LEU  13           HA       LEU  13  -7.524 -16.143  -0.624
  114   1HB   LEU  13          1HB       LEU  13  -5.839 -15.993   0.798
  115   2HB   LEU  13          2HB       LEU  13  -5.488 -17.687   0.522
  116    HG   LEU  13           HG       LEU  13  -4.016 -16.730  -1.502
  117   1HD1  LEU  13          1HD1      LEU  13  -2.982 -14.591  -0.868
  118   2HD1  LEU  13          2HD1      LEU  13  -4.730 -14.331  -0.974
  119   3HD1  LEU  13          3HD1      LEU  13  -3.966 -14.512   0.607
  120   1HD2  LEU  13          1HD2      LEU  13  -2.106 -16.777   0.014
  121   2HD2  LEU  13          2HD2      LEU  13  -3.182 -16.655   1.418
  122   3HD2  LEU  13          3HD2      LEU  13  -3.221 -18.103   0.388
  123    H    LYS  14           H        LYS  14  -7.023 -14.525  -1.850
  124    HA   LYS  14           HA       LYS  14  -6.170 -15.054  -4.679
  125   1HB   LYS  14          1HB       LYS  14  -8.043 -13.831  -5.427
  126   2HB   LYS  14          2HB       LYS  14  -8.425 -15.288  -4.531
  127   1HG   LYS  14          1HG       LYS  14 -10.002 -13.761  -3.866
  128   2HG   LYS  14          2HG       LYS  14  -8.909 -13.869  -2.485
  129   1HD   LYS  14          1HD       LYS  14  -8.256 -11.738  -4.455
  130   2HD   LYS  14          2HD       LYS  14  -9.841 -11.579  -3.715
  131   1HE   LYS  14          1HE       LYS  14  -8.877 -11.623  -1.451
  132   2HE   LYS  14          2HE       LYS  14  -7.265 -11.851  -2.115
  133   1HZ   LYS  14          1HZ       LYS  14  -7.569  -9.555  -1.700
  134   2HZ   LYS  14          2HZ       LYS  14  -8.927  -9.507  -2.704
  135    H    ARG  15           H        ARG  15  -6.220 -12.771  -5.854
  136    HA   ARG  15           HA       ARG  15  -4.547 -10.826  -4.309
  137   1HB   ARG  15          1HB       ARG  15  -4.705 -11.632  -7.149
  138   2HB   ARG  15          2HB       ARG  15  -4.338  -9.949  -6.794
  139   1HG   ARG  15          1HG       ARG  15  -2.516 -10.489  -5.356
  140   2HG   ARG  15          2HG       ARG  15  -2.812 -12.233  -5.498
  141   1HD   ARG  15          1HD       ARG  15  -0.897 -11.307  -6.828
  142   2HD   ARG  15          2HD       ARG  15  -2.056 -12.233  -7.777
  143    HE   ARG  15           HE       ARG  15  -1.651  -9.273  -7.737
  144   1HH1  ARG  15          2HH1      ARG  15  -3.303 -12.047  -9.269
  145   2HH1  ARG  15          1HH1      ARG  15  -3.709 -11.148 -10.702
  146   1HH2  ARG  15          1HH2      ARG  15  -2.312  -8.106  -9.573
  147   2HH2  ARG  15          2HH2      ARG  15  -3.216  -8.890 -10.842
  148    H    MET  16           H        MET  16  -5.450  -8.874  -3.747
  149    HA   MET  16           HA       MET  16  -7.690  -7.683  -5.274
  150   1HB   MET  16          1HB       MET  16  -7.243  -7.349  -2.791
  151   2HB   MET  16          2HB       MET  16  -5.948  -6.253  -3.287
  152   1HG   MET  16          1HG       MET  16  -7.708  -4.930  -4.545
  153   2HG   MET  16          2HG       MET  16  -8.917  -6.102  -4.010
  154   1HE   MET  16          1HE       MET  16  -5.899  -4.364  -1.978
  155   2HE   MET  16          2HE       MET  16  -6.782  -2.890  -1.530
  156   3HE   MET  16          3HE       MET  16  -6.518  -3.292  -3.245
  157    H    TYR  17           H        TYR  17  -7.262  -5.628  -6.309
  158    HA   TYR  17           HA       TYR  17  -4.592  -4.707  -6.892
  159   1HB   TYR  17          1HB       TYR  17  -4.582  -6.462  -8.563
  160   2HB   TYR  17          2HB       TYR  17  -6.214  -6.062  -9.075
  161    HD1  TYR  17           1HD      TYR  17  -3.189  -3.838  -8.553
  162    HD2  TYR  17           2HD      TYR  17  -6.055  -5.478 -11.333
  163    HE1  TYR  17           1HE      TYR  17  -2.359  -2.326 -10.325
  164    HE2  TYR  17           2HE      TYR  17  -5.310  -3.870 -13.050
  165    HH   TYR  17           HH       TYR  17  -3.803  -2.220 -13.595
  166    H    ALA  18           H        ALA  18  -5.456  -2.981  -5.770
  167    HA   ALA  18           HA       ALA  18  -7.626  -1.438  -7.043
  168   1HB   ALA  18          1HB       ALA  18  -7.479  -0.038  -5.070
  169   2HB   ALA  18          2HB       ALA  18  -7.793  -1.746  -4.673
  170   3HB   ALA  18          3HB       ALA  18  -6.158  -1.061  -4.439
  171    H    ARG  19           H        ARG  19  -6.947  -0.387  -8.700
  172    HA   ARG  19           HA       ARG  19  -4.302   0.862  -8.875
  173   1HB   ARG  19          1HB       ARG  19  -5.803  -0.490 -10.684
  174   2HB   ARG  19          2HB       ARG  19  -6.387   1.130 -11.039
  175   1HG   ARG  19          1HG       ARG  19  -3.548   0.056 -11.149
  176   2HG   ARG  19          2HG       ARG  19  -4.575   0.607 -12.486
  177   1HD   ARG  19          1HD       ARG  19  -4.590   2.873 -11.103
  178   2HD   ARG  19          2HD       ARG  19  -3.110   2.243 -10.397
  179    HE   ARG  19           HE       ARG  19  -3.541   3.359 -13.010
  180   1HH1  ARG  19          1HH1      ARG  19  -1.620   0.759 -11.544
  181   2HH1  ARG  19          2HH1      ARG  19  -0.308   0.923 -12.680
  182   1HH2  ARG  19          1HH2      ARG  19  -1.848   3.536 -14.499
  183   2HH2  ARG  19          2HH2      ARG  19  -0.459   2.483 -14.397
  184    H    VAL  20           H        VAL  20  -4.416   2.638  -7.392
  185    HA   VAL  20           HA       VAL  20  -6.940   4.107  -7.194
  186    HB   VAL  20           HB       VAL  20  -4.466   4.571  -5.533
  187   1HG1  VAL  20          1HG1      VAL  20  -7.414   4.828  -4.857
  188   2HG1  VAL  20          2HG1      VAL  20  -6.034   5.374  -3.895
  189   3HG1  VAL  20          3HG1      VAL  20  -6.423   6.181  -5.426
  190   1HG2  VAL  20          1HG2      VAL  20  -6.577   2.397  -5.220
  191   2HG2  VAL  20          2HG2      VAL  20  -4.813   2.203  -5.287
  192   3HG2  VAL  20          3HG2      VAL  20  -5.562   2.964  -3.887
  193    H    TYR  21           H        TYR  21  -7.315   5.786  -8.459
  194    HA   TYR  21           HA       TYR  21  -5.114   7.432  -9.583
  195   1HB   TYR  21          1HB       TYR  21  -8.031   7.045 -10.289
  196   2HB   TYR  21          2HB       TYR  21  -6.977   8.178 -11.102
  197    HD1  TYR  21           1HD      TYR  21  -5.052   7.342 -12.506
  198    HD2  TYR  21           2HD      TYR  21  -7.892   4.634 -10.732
  199    HE1  TYR  21           1HE      TYR  21  -4.402   5.582 -14.123
  200    HE2  TYR  21           2HE      TYR  21  -7.340   2.928 -12.416
  201    HH   TYR  21           HH       TYR  21  -6.047   2.408 -14.270
  202    H    GLY  22           H        GLY  22  -4.968   9.594  -9.184
  203   1HA   GLY  22          1HA       GLY  22  -6.489  11.621  -9.050
  204   2HA   GLY  22          2HA       GLY  22  -6.995  10.970  -7.479
  205    H    LEU  23           H        LEU  23  -6.246  12.901  -6.483
  206    HA   LEU  23           HA       LEU  23  -3.410  13.523  -6.504
  207   1HB   LEU  23          1HB       LEU  23  -5.367  15.138  -6.285
  208   2HB   LEU  23          2HB       LEU  23  -5.495  14.586  -4.608
  209    HG   LEU  23           HG       LEU  23  -3.018  15.338  -4.367
  210   1HD1  LEU  23          1HD1      LEU  23  -2.254  17.049  -5.971
  211   2HD1  LEU  23          2HD1      LEU  23  -2.388  15.471  -6.744
  212   3HD1  LEU  23          3HD1      LEU  23  -3.642  16.699  -7.018
  213   1HD2  LEU  23          1HD2      LEU  23  -3.678  17.715  -4.124
  214   2HD2  LEU  23          2HD2      LEU  23  -5.173  17.383  -5.027
  215   3HD2  LEU  23          3HD2      LEU  23  -4.888  16.612  -3.451
  216    H    VAL  24           H        VAL  24  -4.647  10.871  -5.454
  217    HA   VAL  24           HA       VAL  24  -3.550  10.477  -2.819
  218    HB   VAL  24           HB       VAL  24  -3.429   8.088  -3.565
  219   1HG1  VAL  24          1HG1      VAL  24  -6.101   9.508  -3.983
  220   2HG1  VAL  24          2HG1      VAL  24  -5.877   7.789  -3.607
  221   3HG1  VAL  24          3HG1      VAL  24  -5.405   9.016  -2.427
  222   1HG2  VAL  24          1HG2      VAL  24  -4.879   9.011  -6.085
  223   2HG2  VAL  24          2HG2      VAL  24  -3.160   8.574  -6.061
  224   3HG2  VAL  24          3HG2      VAL  24  -4.392   7.376  -5.638
  225    H    GLN  25           H        GLN  25  -2.192  10.748  -6.073
  226    HA   GLN  25           HA       GLN  25   0.556  10.313  -5.199
  227   1HB   GLN  25          1HB       GLN  25  -0.805  10.875  -7.725
  228   2HB   GLN  25          2HB       GLN  25   0.502  12.026  -7.453
  229   1HG   GLN  25          1HG       GLN  25   1.465  10.181  -8.555
  230   2HG   GLN  25          2HG       GLN  25   2.052  10.142  -6.902
  231   1HE2  GLN  25          1HE2      GLN  25   2.502   7.920  -7.972
  232   2HE2  GLN  25          2HE2      GLN  25   1.305   6.654  -7.746
  233    H    GLY  26           H        GLY  26   1.733  11.736  -4.067
  234   1HA   GLY  26          1HA       GLY  26   2.503  13.789  -3.305
  235   2HA   GLY  26          2HA       GLY  26   1.105  14.613  -3.999
  236    H    VAL  27           H        VAL  27   0.703  11.664  -2.080
  237    HA   VAL  27           HA       VAL  27   0.543  12.966   0.469
  238    HB   VAL  27           HB       VAL  27  -1.888  12.762  -1.087
  239   1HG1  VAL  27          1HG1      VAL  27  -2.021  11.092   1.457
  240   2HG1  VAL  27          2HG1      VAL  27  -3.385  11.642   0.505
  241   3HG1  VAL  27          3HG1      VAL  27  -2.251  10.502  -0.216
  242   1HG2  VAL  27          1HG2      VAL  27  -1.452  13.555   1.818
  243   2HG2  VAL  27          2HG2      VAL  27  -1.212  14.621   0.418
  244   3HG2  VAL  27          3HG2      VAL  27  -2.824  14.008   0.786
  245    H    GLY  28           H        GLY  28   0.483  11.423   2.180
  246   1HA   GLY  28          1HA       GLY  28   2.180   9.254   1.738
  247   2HA   GLY  28          2HA       GLY  28   1.207   9.513   3.193
  248    H    PHE  29           H        PHE  29  -1.195   8.927   2.920
  249    HA   PHE  29           HA       PHE  29  -2.668   7.232   2.863
  250   1HB   PHE  29          1HB       PHE  29  -3.047   8.259   0.697
  251   2HB   PHE  29          2HB       PHE  29  -1.766   7.314  -0.045
  252    HD1  PHE  29           1HD      PHE  29  -2.791   5.981  -1.683
  253    HD2  PHE  29           2HD      PHE  29  -4.639   6.291   2.204
  254    HE1  PHE  29           1HE      PHE  29  -4.453   4.277  -2.332
  255    HE2  PHE  29           2HE      PHE  29  -6.328   4.612   1.530
  256    HZ   PHE  29           HZ       PHE  29  -6.264   3.627  -0.753
  257    H    ARG  30           H        ARG  30  -1.524   5.108   0.499
  258    HA   ARG  30           HA       ARG  30  -0.882   2.935   0.682
  259   1HB   ARG  30          1HB       ARG  30   1.492   4.664   1.427
  260   2HB   ARG  30          2HB       ARG  30   1.614   2.943   1.016
  261   1HG   ARG  30          1HG       ARG  30   0.677   3.289  -1.176
  262   2HG   ARG  30          2HG       ARG  30   0.314   4.986  -0.838
  263   1HD   ARG  30          1HD       ARG  30   3.148   3.874  -0.728
  264   2HD   ARG  30          2HD       ARG  30   2.409   4.505  -2.206
  265    HE   ARG  30           HE       ARG  30   1.993   6.437  -0.201
  266   1HH1  ARG  30          1HH1      ARG  30   4.764   5.044  -1.980
  267   2HH1  ARG  30          2HH1      ARG  30   5.731   6.476  -1.807
  268   1HH2  ARG  30          1HH2      ARG  30   3.247   8.312  -0.063
  269   2HH2  ARG  30          2HH2      ARG  30   4.863   8.358  -0.724
  270    H    LYS  31           H        LYS  31   1.151   3.964   3.394
  271    HA   LYS  31           HA       LYS  31   1.128   1.947   5.137
  272   1HB   LYS  31          1HB       LYS  31   2.168   4.177   5.394
  273   2HB   LYS  31          2HB       LYS  31   0.606   4.844   5.864
  274   1HG   LYS  31          1HG       LYS  31   0.528   3.306   7.819
  275   2HG   LYS  31          2HG       LYS  31   2.092   2.617   7.334
  276   1HD   LYS  31          1HD       LYS  31   3.170   4.814   7.638
  277   2HD   LYS  31          2HD       LYS  31   1.600   5.548   8.031
  278   1HE   LYS  31          1HE       LYS  31   1.391   4.032   9.999
  279   2HE   LYS  31          2HE       LYS  31   2.986   3.340   9.625
  280   1HZ   LYS  31          1HZ       LYS  31   3.226   5.070  11.248
  281   2HZ   LYS  31          2HZ       LYS  31   2.525   6.199  10.204
  282    H    PHE  32           H        PHE  32  -1.488   4.418   4.956
  283    HA   PHE  32           HA       PHE  32  -3.135   3.538   6.946
  284   1HB   PHE  32          1HB       PHE  32  -3.381   5.598   5.668
  285   2HB   PHE  32          2HB       PHE  32  -3.949   4.700   4.270
  286    HD1  PHE  32           1HD      PHE  32  -5.194   3.652   7.641
  287    HD2  PHE  32           2HD      PHE  32  -5.971   6.092   4.151
  288    HE1  PHE  32           1HE      PHE  32  -7.487   3.969   8.377
  289    HE2  PHE  32           2HE      PHE  32  -8.280   6.428   4.931
  290    HZ   PHE  32           HZ       PHE  32  -9.061   5.380   7.045
  291    H    VAL  33           H        VAL  33  -3.061   2.376   3.562
  292    HA   VAL  33           HA       VAL  33  -5.293   0.531   3.793
  293    HB   VAL  33           HB       VAL  33  -3.023   0.512   1.757
  294   1HG1  VAL  33          1HG1      VAL  33  -5.825  -0.682   1.774
  295   2HG1  VAL  33          2HG1      VAL  33  -4.789  -0.596   0.341
  296   3HG1  VAL  33          3HG1      VAL  33  -4.283  -1.569   1.725
  297   1HG2  VAL  33          1HG2      VAL  33  -5.704   1.939   1.638
  298   2HG2  VAL  33          2HG2      VAL  33  -4.098   2.709   1.708
  299   3HG2  VAL  33          3HG2      VAL  33  -4.561   1.760   0.293
  300    H    GLN  34           H        GLN  34  -1.838   0.434   4.384
  301    HA   GLN  34           HA       GLN  34  -1.645  -2.454   4.532
  302   1HB   GLN  34          1HB       GLN  34   0.188  -0.159   5.277
  303   2HB   GLN  34          2HB       GLN  34   0.490  -1.760   5.933
  304   1HG   GLN  34          1HG       GLN  34   1.825  -1.441   3.975
  305   2HG   GLN  34          2HG       GLN  34   0.622  -2.688   3.644
  306   1HE2  GLN  34          1HE2      GLN  34  -1.336  -2.025   2.438
  307   2HE2  GLN  34          2HE2      GLN  34  -1.194  -0.760   1.230
  308    H    ILE  35           H        ILE  35  -2.108   0.124   7.007
  309    HA   ILE  35           HA       ILE  35  -1.866  -1.252   9.261
  310    HB   ILE  35           HB       ILE  35  -3.803   0.888   8.474
  311   1HG1  ILE  35          1HG1      ILE  35  -1.286   1.193   8.913
  312   2HG1  ILE  35          2HG1      ILE  35  -2.403   2.299   9.715
  313   1HG2  ILE  35          1HG2      ILE  35  -4.409   1.221  10.885
  314   2HG2  ILE  35          2HG2      ILE  35  -5.173  -0.148  10.090
  315   3HG2  ILE  35          3HG2      ILE  35  -3.830  -0.433  11.207
  316   1HD1  ILE  35          1HD1      ILE  35  -0.571   1.472  11.198
  317   2HD1  ILE  35          2HD1      ILE  35  -2.185   1.132  11.830
  318   3HD1  ILE  35          3HD1      ILE  35  -1.236  -0.168  11.083
  319    H    HIS  36           H        HIS  36  -5.076  -1.475   7.566
  320    HA   HIS  36           HA       HIS  36  -6.022  -3.501   9.415
  321   1HB   HIS  36          1HB       HIS  36  -6.981  -2.330   6.820
  322   2HB   HIS  36          2HB       HIS  36  -7.587  -3.919   7.290
  323    HD2  HIS  36           2HD      HIS  36  -7.134  -0.905   9.832
  324    HE1  HIS  36           1HE      HIS  36 -11.169  -2.168   9.744
  325    HE2  HIS  36           2HE      HIS  36  -9.508  -0.588  10.874
  326    H    ALA  37           H        ALA  37  -4.784  -3.672   6.035
  327    HA   ALA  37           HA       ALA  37  -4.798  -6.350   5.567
  328   1HB   ALA  37          1HB       ALA  37  -3.228  -5.947   3.891
  329   2HB   ALA  37          2HB       ALA  37  -4.082  -4.429   4.096
  330   3HB   ALA  37          3HB       ALA  37  -2.458  -4.615   4.767
  331    H    ILE  38           H        ILE  38  -1.809  -4.790   6.695
  332    HA   ILE  38           HA       ILE  38  -0.257  -6.775   7.685
  333    HB   ILE  38           HB       ILE  38  -0.738  -3.916   8.457
  334   1HG1  ILE  38          1HG1      ILE  38   1.483  -3.606   7.598
  335   2HG1  ILE  38          2HG1      ILE  38   1.793  -5.345   7.554
  336   1HG2  ILE  38          1HG2      ILE  38   1.205  -3.943   9.956
  337   2HG2  ILE  38          2HG2      ILE  38  -0.209  -4.749  10.624
  338   3HG2  ILE  38          3HG2      ILE  38   1.141  -5.719   9.980
  339   1HD1  ILE  38          1HD1      ILE  38   1.410  -4.301   5.327
  340   2HD1  ILE  38          2HD1      ILE  38   0.279  -5.629   5.657
  341   3HD1  ILE  38          3HD1      ILE  38  -0.250  -3.948   5.768
  342    H    ARG  39           H        ARG  39  -2.763  -5.036   9.622
  343    HA   ARG  39           HA       ARG  39  -2.569  -6.331  12.006
  344   1HB   ARG  39          1HB       ARG  39  -4.682  -4.901  10.594
  345   2HB   ARG  39          2HB       ARG  39  -5.356  -6.080  11.679
  346   1HG   ARG  39          1HG       ARG  39  -3.159  -4.313  12.766
  347   2HG   ARG  39          2HG       ARG  39  -4.718  -3.570  12.400
  348   1HD   ARG  39          1HD       ARG  39  -4.635  -4.376  14.730
  349   2HD   ARG  39          2HD       ARG  39  -5.925  -5.109  13.755
  350    HE   ARG  39           HE       ARG  39  -3.452  -6.661  13.791
  351   1HH1  ARG  39          1HH1      ARG  39  -6.451  -6.100  15.606
  352   2HH1  ARG  39          2HH1      ARG  39  -6.532  -7.737  16.205
  353   1HH2  ARG  39          1HH2      ARG  39  -3.617  -8.801  14.497
  354   2HH2  ARG  39          2HH2      ARG  39  -4.879  -9.276  15.606
  355    H    LEU  40           H        LEU  40  -4.345  -7.409   9.136
  356    HA   LEU  40           HA       LEU  40  -5.176  -9.981  10.373
  357   1HB   LEU  40          1HB       LEU  40  -5.999  -8.669   7.782
  358   2HB   LEU  40          2HB       LEU  40  -6.728 -10.104   8.523
  359    HG   LEU  40           HG       LEU  40  -6.739  -7.289   9.724
  360   1HD1  LEU  40          1HD1      LEU  40  -9.083  -7.321   9.212
  361   2HD1  LEU  40          2HD1      LEU  40  -8.151  -7.603   7.725
  362   3HD1  LEU  40          3HD1      LEU  40  -8.963  -8.967   8.533
  363   1HD2  LEU  40          1HD2      LEU  40  -8.403  -8.292  11.321
  364   2HD2  LEU  40          2HD2      LEU  40  -7.940  -9.902  10.732
  365   3HD2  LEU  40          3HD2      LEU  40  -6.754  -8.871  11.568
  366    H    GLY  41           H        GLY  41  -2.330  -9.287   9.263
  367   1HA   GLY  41          1HA       GLY  41  -0.656 -10.492   8.325
  368   2HA   GLY  41          2HA       GLY  41  -1.695 -11.907   8.541
  369    H    ILE  42           H        ILE  42  -1.355  -9.058   6.359
  370    HA   ILE  42           HA       ILE  42  -1.970 -10.786   4.003
  371    HB   ILE  42           HB       ILE  42  -2.628  -7.890   4.574
  372   1HG1  ILE  42          1HG1      ILE  42  -4.179  -9.413   5.666
  373   2HG1  ILE  42          2HG1      ILE  42  -4.938  -8.506   4.350
  374   1HG2  ILE  42          1HG2      ILE  42  -3.860  -8.022   2.336
  375   2HG2  ILE  42          2HG2      ILE  42  -2.103  -7.876   2.280
  376   3HG2  ILE  42          3HG2      ILE  42  -2.864  -9.454   2.000
  377   1HD1  ILE  42          1HD1      ILE  42  -5.738 -10.778   4.304
  378   2HD1  ILE  42          2HD1      ILE  42  -4.710 -10.478   2.892
  379   3HD1  ILE  42          3HD1      ILE  42  -4.091 -11.430   4.265
  380    H    LYS  43           H        LYS  43  -0.746 -10.595   2.232
  381    HA   LYS  43           HA       LYS  43   1.814  -9.067   2.417
  382   1HB   LYS  43          1HB       LYS  43   1.214 -11.497   0.706
  383   2HB   LYS  43          2HB       LYS  43   2.750 -10.654   0.886
  384   1HG   LYS  43          1HG       LYS  43   2.720 -11.153   3.342
  385   2HG   LYS  43          2HG       LYS  43   1.250 -12.120   3.113
  386   1HD   LYS  43          1HD       LYS  43   2.454 -13.595   1.530
  387   2HD   LYS  43          2HD       LYS  43   3.946 -12.692   1.833
  388   1HE   LYS  43          1HE       LYS  43   2.337 -14.198   3.940
  389   2HE   LYS  43          2HE       LYS  43   3.827 -14.776   3.168
  390   1HZ   LYS  43          1HZ       LYS  43   3.592 -12.396   4.896
  391   2HZ   LYS  43          2HZ       LYS  43   5.005 -12.948   4.157
  392    H    GLY  44           H        GLY  44   2.568  -8.526  -0.006
  393   1HA   GLY  44          1HA       GLY  44   1.251  -8.214  -2.266
  394   2HA   GLY  44          2HA       GLY  44   0.278  -7.107  -1.280
  395    H    TYR  45           H        TYR  45   0.869  -5.184  -2.368
  396    HA   TYR  45           HA       TYR  45   3.210  -3.971  -1.409
  397   1HB   TYR  45          1HB       TYR  45   4.070  -5.597  -3.323
  398   2HB   TYR  45          2HB       TYR  45   3.469  -4.346  -4.367
  399    HD1  TYR  45           1HD      TYR  45   4.746  -2.379  -4.713
  400    HD2  TYR  45           2HD      TYR  45   5.903  -5.191  -1.681
  401    HE1  TYR  45           1HE      TYR  45   7.048  -1.432  -4.723
  402    HE2  TYR  45           2HE      TYR  45   8.191  -4.229  -1.654
  403    HH   TYR  45           HH       TYR  45   9.609  -2.655  -2.532
  404    H    ALA  46           H        ALA  46   3.025  -1.856  -1.584
  405    HA   ALA  46           HA       ALA  46   0.808  -0.656  -3.185
  406   1HB   ALA  46          1HB       ALA  46   0.748   1.023  -1.431
  407   2HB   ALA  46          2HB       ALA  46   0.526  -0.613  -0.798
  408   3HB   ALA  46          3HB       ALA  46   2.073   0.210  -0.580
  409    H    LYS  47           H        LYS  47   1.987  -0.197  -5.132
  410    HA   LYS  47           HA       LYS  47   4.560   1.215  -4.887
  411   1HB   LYS  47          1HB       LYS  47   4.579  -0.791  -6.124
  412   2HB   LYS  47          2HB       LYS  47   3.247  -0.256  -7.132
  413   1HG   LYS  47          1HG       LYS  47   4.684   1.521  -8.096
  414   2HG   LYS  47          2HG       LYS  47   5.969   1.111  -6.961
  415   1HD   LYS  47          1HD       LYS  47   4.923  -0.817  -9.066
  416   2HD   LYS  47          2HD       LYS  47   6.297   0.280  -9.295
  417   1HE   LYS  47          1HE       LYS  47   7.431  -0.777  -7.310
  418   2HE   LYS  47          2HE       LYS  47   6.123  -1.978  -7.251
  419   1HZ   LYS  47          1HZ       LYS  47   7.922  -2.830  -8.548
  420   2HZ   LYS  47          2HZ       LYS  47   7.826  -1.524  -9.611
  421    H    ASN  48           H        ASN  48   4.351   3.336  -4.702
  422    HA   ASN  48           HA       ASN  48   2.405   4.878  -6.186
  423   1HB   ASN  48          1HB       ASN  48   3.356   5.506  -3.961
  424   2HB   ASN  48          2HB       ASN  48   4.932   5.756  -4.714
  425   1HD2  ASN  48          2HD2      ASN  48   1.885   7.161  -3.939
  426   2HD2  ASN  48          1HD2      ASN  48   2.099   8.669  -4.798
  427    H    LEU  49           H        LEU  49   2.620   5.257  -8.419
  428    HA   LEU  49           HA       LEU  49   5.293   5.410  -9.661
  429   1HB   LEU  49          1HB       LEU  49   2.521   5.725 -10.817
  430   2HB   LEU  49          2HB       LEU  49   4.029   5.654 -11.717
  431    HG   LEU  49           HG       LEU  49   3.011   3.417  -9.930
  432   1HD1  LEU  49          1HD1      LEU  49   2.203   2.337 -11.973
  433   2HD1  LEU  49          2HD1      LEU  49   1.416   3.906 -11.774
  434   3HD1  LEU  49          3HD1      LEU  49   2.735   3.721 -12.951
  435   1HD2  LEU  49          1HD2      LEU  49   4.558   1.999 -11.270
  436   2HD2  LEU  49          2HD2      LEU  49   5.144   3.448 -12.108
  437   3HD2  LEU  49          3HD2      LEU  49   5.425   3.245 -10.365
  438    HA   PRO  50           HA       PRO  50   4.470   9.690  -8.197
  439   1HB   PRO  50          1HB       PRO  50   6.926  10.837  -8.503
  440   2HB   PRO  50          2HB       PRO  50   6.520   9.705  -7.176
  441   1HG   PRO  50          1HG       PRO  50   7.866   9.020  -9.812
  442   2HG   PRO  50          2HG       PRO  50   8.433   8.614  -8.163
  443   1HD   PRO  50          1HD       PRO  50   7.018   6.832  -9.615
  444   2HD   PRO  50          2HD       PRO  50   6.683   7.037  -7.866
  445    H    ASP  51           H        ASP  51   3.798  11.480  -9.282
  446    HA   ASP  51           HA       ASP  51   2.817  12.530 -10.983
  447   1HB   ASP  51          1HB       ASP  51   5.119  13.269 -11.565
  448   2HB   ASP  51          2HB       ASP  51   5.300  11.871 -12.632
  449    HD2  ASP  51           HD       ASP  51   4.230  13.979 -15.158
  450    H    GLY  52           H        GLY  52   1.619  10.368 -10.503
  451   1HA   GLY  52          1HA       GLY  52   0.480   9.321 -12.869
  452   2HA   GLY  52          2HA       GLY  52   1.675   8.176 -12.215
  453    H    SER  53           H        SER  53   0.342   6.661 -11.379
  454    HA   SER  53           HA       SER  53  -1.704   7.383  -9.315
  455   1HB   SER  53          1HB       SER  53  -2.918   5.359 -10.153
  456   2HB   SER  53          2HB       SER  53  -2.819   6.697 -11.311
  457    HG   SER  53           HG       SER  53  -1.119   5.623 -12.336
  458    H    VAL  54           H        VAL  54  -2.001   5.789  -7.632
  459    HA   VAL  54           HA       VAL  54   0.459   4.193  -7.090
  460    HB   VAL  54           HB       VAL  54   0.302   5.917  -5.576
  461   1HG1  VAL  54          1HG1      VAL  54  -2.455   5.055  -4.648
  462   2HG1  VAL  54          2HG1      VAL  54  -1.479   6.406  -4.063
  463   3HG1  VAL  54          3HG1      VAL  54  -2.144   6.455  -5.698
  464   1HG2  VAL  54          1HG2      VAL  54  -0.686   3.420  -4.138
  465   2HG2  VAL  54          2HG2      VAL  54   0.970   3.661  -4.719
  466   3HG2  VAL  54          3HG2      VAL  54   0.303   4.730  -3.474
  467    H    GLU  55           H        GLU  55   0.152   2.219  -7.779
  468    HA   GLU  55           HA       GLU  55  -2.473   0.935  -7.496
  469   1HB   GLU  55          1HB       GLU  55  -1.700  -0.791  -8.873
  470   2HB   GLU  55          2HB       GLU  55  -1.479   0.778  -9.632
  471   1HG   GLU  55          1HG       GLU  55   0.777  -0.818  -8.318
  472   2HG   GLU  55          2HG       GLU  55   0.338  -0.934 -10.019
  473    HE2  GLU  55           HE       GLU  55   3.114   1.393  -9.772
  474    H    VAL  56           H        VAL  56  -2.979  -0.585  -6.145
  475    HA   VAL  56           HA       VAL  56  -0.958  -1.581  -4.183
  476    HB   VAL  56           HB       VAL  56  -3.854  -0.772  -3.787
  477   1HG1  VAL  56          1HG1      VAL  56  -1.713  -1.762  -1.861
  478   2HG1  VAL  56          2HG1      VAL  56  -3.279  -1.093  -1.366
  479   3HG1  VAL  56          3HG1      VAL  56  -3.223  -2.608  -2.274
  480   1HG2  VAL  56          1HG2      VAL  56  -1.245   0.545  -2.899
  481   2HG2  VAL  56          2HG2      VAL  56  -2.403   1.211  -4.069
  482   3HG2  VAL  56          3HG2      VAL  56  -2.867   1.032  -2.372
  483    H    VAL  57           H        VAL  57  -0.693  -3.768  -4.423
  484    HA   VAL  57           HA       VAL  57  -3.130  -5.439  -4.893
  485    HB   VAL  57           HB       VAL  57  -1.648  -7.315  -5.282
  486   1HG1  VAL  57          1HG1      VAL  57  -1.001  -4.953  -7.094
  487   2HG1  VAL  57          2HG1      VAL  57  -0.848  -6.673  -7.502
  488   3HG1  VAL  57          3HG1      VAL  57  -2.446  -5.981  -7.194
  489   1HG2  VAL  57          1HG2      VAL  57   0.667  -5.334  -5.137
  490   2HG2  VAL  57          2HG2      VAL  57   0.347  -6.680  -4.016
  491   3HG2  VAL  57          3HG2      VAL  57   0.747  -7.011  -5.699
  492    H    ALA  58           H        ALA  58  -3.781  -6.842  -3.318
  493    HA   ALA  58           HA       ALA  58  -2.279  -7.002  -0.770
  494   1HB   ALA  58          1HB       ALA  58  -4.262  -6.504   0.532
  495   2HB   ALA  58          2HB       ALA  58  -3.953  -5.139  -0.560
  496   3HB   ALA  58          3HB       ALA  58  -5.244  -6.307  -0.927
  497    H    GLU  59           H        GLU  59  -2.183  -9.129  -0.205
  498    HA   GLU  59           HA       GLU  59  -3.620 -10.990  -1.975
  499   1HB   GLU  59          1HB       GLU  59  -1.041 -11.328  -0.435
  500   2HB   GLU  59          2HB       GLU  59  -1.771 -12.467  -1.584
  501   1HG   GLU  59          1HG       GLU  59  -1.695 -10.629  -3.320
  502   2HG   GLU  59          2HG       GLU  59  -0.763  -9.657  -2.183
  503    HE2  GLU  59           HE       GLU  59   2.045 -11.930  -2.326
  504    H    GLY  60           H        GLY  60  -5.599 -11.308  -0.708
  505   1HA   GLY  60          1HA       GLY  60  -5.184 -12.511   2.017
  506   2HA   GLY  60          2HA       GLY  60  -6.417 -11.297   1.622
  507    H    TYR  61           H        TYR  61  -6.860 -13.689   2.895
  508    HA   TYR  61           HA       TYR  61  -8.411 -15.425   1.172
  509   1HB   TYR  61          1HB       TYR  61  -8.254 -14.919   4.153
  510   2HB   TYR  61          2HB       TYR  61  -9.304 -16.136   3.432
  511    HD1  TYR  61           1HD      TYR  61  -5.762 -15.100   3.930
  512    HD2  TYR  61           2HD      TYR  61  -8.377 -18.314   2.766
  513    HE1  TYR  61           1HE      TYR  61  -3.849 -16.663   3.951
  514    HE2  TYR  61           2HE      TYR  61  -6.420 -19.762   2.427
  515    HH   TYR  61           HH       TYR  61  -4.124 -20.010   2.711
  516    H    GLU  62           H        GLU  62 -10.902 -15.459   1.674
  517    HA   GLU  62           HA       GLU  62 -11.699 -12.755   0.830
  518   1HB   GLU  62          1HB       GLU  62 -13.331 -15.294   0.988
  519   2HB   GLU  62          2HB       GLU  62 -13.810 -13.747   0.248
  520   1HG   GLU  62          1HG       GLU  62 -11.914 -13.957  -1.377
  521   2HG   GLU  62          2HG       GLU  62 -11.511 -15.540  -0.691
  522    HE2  GLU  62           HE       GLU  62 -14.967 -15.174  -2.821
  523    H    GLU  63           H        GLU  63 -11.867 -14.604   3.785
  524    HA   GLU  63           HA       GLU  63 -14.059 -13.097   4.957
  525   1HB   GLU  63          1HB       GLU  63 -11.727 -14.682   6.177
  526   2HB   GLU  63          2HB       GLU  63 -13.115 -14.028   7.057
  527   1HG   GLU  63          1HG       GLU  63 -14.631 -15.454   5.688
  528   2HG   GLU  63          2HG       GLU  63 -13.226 -16.149   4.864
  529    HE2  GLU  63           HE       GLU  63 -12.101 -17.893   7.770
  530    H    ALA  64           H        ALA  64 -10.474 -12.962   4.952
  531    HA   ALA  64           HA       ALA  64 -10.380 -10.418   6.349
  532   1HB   ALA  64          1HB       ALA  64  -7.959 -10.618   5.913
  533   2HB   ALA  64          2HB       ALA  64  -8.607 -12.134   6.566
  534   3HB   ALA  64          3HB       ALA  64  -8.257 -11.996   4.829
  535    H    LEU  65           H        LEU  65 -11.195 -11.210   3.076
  536    HA   LEU  65           HA       LEU  65  -9.821  -8.960   1.884
  537   1HB   LEU  65          1HB       LEU  65 -10.511 -10.800   0.500
  538   2HB   LEU  65          2HB       LEU  65 -12.227 -10.490   0.876
  539    HG   LEU  65           HG       LEU  65 -12.166  -8.365  -0.221
  540   1HD1  LEU  65          1HD1      LEU  65 -10.004  -7.722  -1.527
  541   2HD1  LEU  65          2HD1      LEU  65 -10.016  -7.392   0.205
  542   3HD1  LEU  65          3HD1      LEU  65  -9.163  -8.815  -0.405
  543   1HD2  LEU  65          1HD2      LEU  65 -11.637  -9.126  -2.521
  544   2HD2  LEU  65          2HD2      LEU  65 -10.793 -10.528  -1.832
  545   3HD2  LEU  65          3HD2      LEU  65 -12.533 -10.344  -1.577
  546    H    SER  66           H        SER  66 -13.297  -9.523   2.614
  547    HA   SER  66           HA       SER  66 -14.334  -7.048   2.264
  548   1HB   SER  66          1HB       SER  66 -16.050  -7.671   3.920
  549   2HB   SER  66          2HB       SER  66 -15.622  -9.049   2.891
  550    HG   SER  66           HG       SER  66 -14.230  -9.755   4.610
  551    H    LYS  67           H        LYS  67 -12.710  -8.072   5.284
  552    HA   LYS  67           HA       LYS  67 -12.976  -5.791   6.826
  553   1HB   LYS  67          1HB       LYS  67 -10.962  -8.000   6.609
  554   2HB   LYS  67          2HB       LYS  67 -10.454  -6.537   7.452
  555   1HG   LYS  67          1HG       LYS  67 -11.372  -8.078   9.059
  556   2HG   LYS  67          2HG       LYS  67 -12.387  -6.638   8.944
  557   1HD   LYS  67          1HD       LYS  67 -13.962  -7.985   7.442
  558   2HD   LYS  67          2HD       LYS  67 -12.904  -9.382   7.710
  559   1HE   LYS  67          1HE       LYS  67 -14.759  -9.556   9.239
  560   2HE   LYS  67          2HE       LYS  67 -13.324  -9.133  10.194
  561   1HZ   LYS  67          1HZ       LYS  67 -15.127  -7.728  10.850
  562   2HZ   LYS  67          2HZ       LYS  67 -15.342  -7.183   9.266
  563    H    LEU  68           H        LEU  68 -10.431  -6.371   4.341
  564    HA   LEU  68           HA       LEU  68  -9.197  -3.779   4.732
  565   1HB   LEU  68          1HB       LEU  68  -7.979  -5.819   4.260
  566   2HB   LEU  68          2HB       LEU  68  -8.818  -6.036   2.724
  567    HG   LEU  68           HG       LEU  68  -6.428  -5.237   2.755
  568   1HD1  LEU  68          1HD1      LEU  68  -6.618  -3.888   0.786
  569   2HD1  LEU  68          2HD1      LEU  68  -7.822  -5.187   0.734
  570   3HD1  LEU  68          3HD1      LEU  68  -8.319  -3.521   1.116
  571   1HD2  LEU  68          1HD2      LEU  68  -5.944  -2.891   2.959
  572   2HD2  LEU  68          2HD2      LEU  68  -7.623  -2.502   3.350
  573   3HD2  LEU  68          3HD2      LEU  68  -6.646  -3.471   4.481
  574    H    LEU  69           H        LEU  69 -11.174  -5.335   2.145
  575    HA   LEU  69           HA       LEU  69 -11.293  -3.445   0.316
  576   1HB   LEU  69          1HB       LEU  69 -12.277  -5.730   0.391
  577   2HB   LEU  69          2HB       LEU  69 -13.654  -5.113   1.273
  578    HG   LEU  69           HG       LEU  69 -13.832  -5.570  -1.177
  579   1HD1  LEU  69          1HD1      LEU  69 -15.378  -3.701  -1.624
  580   2HD1  LEU  69          2HD1      LEU  69 -15.581  -4.352   0.011
  581   3HD1  LEU  69          3HD1      LEU  69 -14.725  -2.818  -0.235
  582   1HD2  LEU  69          1HD2      LEU  69 -13.160  -3.913  -2.810
  583   2HD2  LEU  69          2HD2      LEU  69 -12.483  -2.870  -1.550
  584   3HD2  LEU  69          3HD2      LEU  69 -11.732  -4.445  -1.902
  585    H    GLU  70           H        GLU  70 -13.669  -3.778   2.998
  586    HA   GLU  70           HA       GLU  70 -15.119  -1.392   2.378
  587   1HB   GLU  70          1HB       GLU  70 -15.134  -3.245   4.801
  588   2HB   GLU  70          2HB       GLU  70 -16.316  -1.952   4.513
  589   1HG   GLU  70          1HG       GLU  70 -16.993  -3.004   2.387
  590   2HG   GLU  70          2HG       GLU  70 -15.845  -4.327   2.653
  591    HE2  GLU  70           HE       GLU  70 -17.724  -5.691   5.371
  592    H    ARG  71           H        ARG  71 -12.532  -2.151   4.695
  593    HA   ARG  71           HA       ARG  71 -12.237   0.141   6.237
  594   1HB   ARG  71          1HB       ARG  71 -10.585  -1.275   6.702
  595   2HB   ARG  71          2HB       ARG  71 -10.561  -1.926   5.081
  596   1HG   ARG  71          1HG       ARG  71  -8.435  -1.170   5.375
  597   2HG   ARG  71          2HG       ARG  71  -9.179  -0.025   4.298
  598   1HD   ARG  71          1HD       ARG  71  -9.598   1.382   6.516
  599   2HD   ARG  71          2HD       ARG  71  -8.441   0.276   7.226
  600    HE   ARG  71           HE       ARG  71  -6.697   1.195   5.942
  601   1HH1  ARG  71          1HH1      ARG  71  -9.820   2.570   4.965
  602   2HH1  ARG  71          2HH1      ARG  71  -9.131   3.647   3.796
  603   1HH2  ARG  71          1HH2      ARG  71  -5.839   2.510   4.216
  604   2HH2  ARG  71          2HH2      ARG  71  -6.891   3.601   3.361
  605    H    ILE  72           H        ILE  72 -11.388  -0.242   2.790
  606    HA   ILE  72           HA       ILE  72 -10.418   2.488   2.527
  607    HB   ILE  72           HB       ILE  72 -11.163   0.471   0.410
  608   1HG1  ILE  72          1HG1      ILE  72  -8.362   1.428   1.091
  609   2HG1  ILE  72          2HG1      ILE  72  -9.082   0.158   2.066
  610   1HG2  ILE  72          1HG2      ILE  72  -9.847   2.013  -1.095
  611   2HG2  ILE  72          2HG2      ILE  72 -11.357   2.720  -0.521
  612   3HG2  ILE  72          3HG2      ILE  72  -9.820   3.201   0.224
  613   1HD1  ILE  72          1HD1      ILE  72  -7.796  -0.844   0.261
  614   2HD1  ILE  72          2HD1      ILE  72  -9.519  -1.227   0.093
  615   3HD1  ILE  72          3HD1      ILE  72  -8.780   0.004  -0.956
  616    H    LYS  73           H        LYS  73 -13.382   0.978   1.163
  617    HA   LYS  73           HA       LYS  73 -14.432   3.305   0.180
  618   1HB   LYS  73          1HB       LYS  73 -15.817   0.809   1.142
  619   2HB   LYS  73          2HB       LYS  73 -16.698   2.187   0.475
  620   1HG   LYS  73          1HG       LYS  73 -16.340   0.676  -1.305
  621   2HG   LYS  73          2HG       LYS  73 -15.340   2.103  -1.603
  622   1HD   LYS  73          1HD       LYS  73 -13.340   0.863  -0.795
  623   2HD   LYS  73          2HD       LYS  73 -14.364  -0.549  -0.465
  624   1HE   LYS  73          1HE       LYS  73 -13.829   0.741  -3.186
  625   2HE   LYS  73          2HE       LYS  73 -13.019  -0.700  -2.554
  626   1HZ   LYS  73          1HZ       LYS  73 -14.820  -1.377  -3.954
  627   2HZ   LYS  73          2HZ       LYS  73 -15.932  -0.535  -3.004
  628    H    GLN  74           H        GLN  74 -14.830   2.047   3.496
  629    HA   GLN  74           HA       GLN  74 -16.597   4.116   4.427
  630   1HB   GLN  74          1HB       GLN  74 -16.516   1.832   5.377
  631   2HB   GLN  74          2HB       GLN  74 -14.849   2.094   5.902
  632   1HG   GLN  74          1HG       GLN  74 -16.472   2.328   7.748
  633   2HG   GLN  74          2HG       GLN  74 -15.512   3.786   7.491
  634   1HE2  GLN  74          1HE2      GLN  74 -18.476   2.536   5.811
  635   2HE2  GLN  74          2HE2      GLN  74 -19.446   3.956   6.143
  636    H    GLY  75           H        GLY  75 -13.076   3.482   4.664
  637   1HA   GLY  75          1HA       GLY  75 -12.574   6.165   5.895
  638   2HA   GLY  75          2HA       GLY  75 -11.547   4.747   5.953
  639    HA   PRO  76           HA       PRO  76 -11.324   6.286   1.361
  640   1HB   PRO  76          1HB       PRO  76 -11.783   8.994   0.917
  641   2HB   PRO  76          2HB       PRO  76 -13.038   7.726   0.808
  642   1HG   PRO  76          1HG       PRO  76 -12.384   9.493   3.180
  643   2HG   PRO  76          2HG       PRO  76 -13.991   9.201   2.444
  644   1HD   PRO  76          1HD       PRO  76 -13.217   7.837   4.621
  645   2HD   PRO  76          2HD       PRO  76 -14.051   6.972   3.290
  646    HA   PRO  77           HA       PRO  77  -7.189   7.611   2.073
  647   1HB   PRO  77          1HB       PRO  77  -6.381   8.765  -0.292
  648   2HB   PRO  77          2HB       PRO  77  -6.688   7.016  -0.128
  649   1HG   PRO  77          1HG       PRO  77  -8.607   9.091  -1.162
  650   2HG   PRO  77          2HG       PRO  77  -8.152   7.520  -1.913
  651   1HD   PRO  77          1HD       PRO  77 -10.400   7.740  -0.458
  652   2HD   PRO  77          2HD       PRO  77  -9.365   6.295  -0.264
  653    H    ALA  78           H        ALA  78  -5.841   9.458   2.508
  654    HA   ALA  78           HA       ALA  78  -7.333  11.857   3.198
  655   1HB   ALA  78          1HB       ALA  78  -5.255  12.499   4.316
  656   2HB   ALA  78          2HB       ALA  78  -5.679  10.823   4.710
  657   3HB   ALA  78          3HB       ALA  78  -4.392  11.156   3.531
  658    H    ALA  79           H        ALA  79  -7.368  11.528   0.397
  659    HA   ALA  79           HA       ALA  79  -6.067  13.983  -0.538
  660   1HB   ALA  79          1HB       ALA  79  -5.382  12.570  -2.610
  661   2HB   ALA  79          2HB       ALA  79  -4.318  12.622  -1.207
  662   3HB   ALA  79          3HB       ALA  79  -5.372  11.205  -1.478
  663    H    GLU  80           H        GLU  80  -6.882  14.458  -2.764
  664    HA   GLU  80           HA       GLU  80  -9.721  13.801  -3.110
  665   1HB   GLU  80          1HB       GLU  80  -7.780  15.553  -4.670
  666   2HB   GLU  80          2HB       GLU  80  -9.448  15.238  -5.164
  667   1HG   GLU  80          1HG       GLU  80  -9.340  17.347  -3.980
  668   2HG   GLU  80          2HG       GLU  80 -10.325  16.179  -3.092
  669    HE2  GLU  80           HE       GLU  80  -8.465  16.622  -0.222
  670    H    VAL  81           H        VAL  81  -9.439  11.522  -3.278
  671    HA   VAL  81           HA       VAL  81  -8.222  10.224  -5.531
  672    HB   VAL  81           HB       VAL  81  -8.837   9.124  -3.469
  673   1HG1  VAL  81          1HG1      VAL  81 -11.761   9.306  -4.308
  674   2HG1  VAL  81          2HG1      VAL  81 -11.098   8.465  -2.903
  675   3HG1  VAL  81          3HG1      VAL  81 -11.028  10.229  -2.977
  676   1HG2  VAL  81          1HG2      VAL  81 -10.263   7.960  -5.895
  677   2HG2  VAL  81          2HG2      VAL  81  -8.532   7.811  -5.513
  678   3HG2  VAL  81          3HG2      VAL  81  -9.739   7.070  -4.450
  679    H    GLU  82           H        GLU  82  -8.806  10.092  -7.556
  680    HA   GLU  82           HA       GLU  82 -11.070  11.714  -8.477
  681   1HB   GLU  82          1HB       GLU  82  -8.789  12.042  -9.365
  682   2HB   GLU  82          2HB       GLU  82  -8.762  10.377  -9.952
  683   1HG   GLU  82          1HG       GLU  82  -9.280  11.921 -11.780
  684   2HG   GLU  82          2HG       GLU  82 -10.680  10.891 -11.472
  685    HE2  GLU  82           HE       GLU  82 -10.858  14.815 -10.375
  686    H    LYS  83           H        LYS  83  -9.743   8.376  -8.926
  687    HA   LYS  83           HA       LYS  83 -12.406   7.268  -9.227
  688   1HB   LYS  83          1HB       LYS  83 -12.106   6.516 -11.575
  689   2HB   LYS  83          2HB       LYS  83 -12.367   8.250 -11.376
  690   1HG   LYS  83          1HG       LYS  83  -9.887   8.624 -11.610
  691   2HG   LYS  83          2HG       LYS  83  -9.687   6.901 -11.951
  692   1HD   LYS  83          1HD       LYS  83 -11.162   7.087 -13.908
  693   2HD   LYS  83          2HD       LYS  83 -11.379   8.822 -13.583
  694   1HE   LYS  83          1HE       LYS  83  -8.921   9.166 -13.816
  695   2HE   LYS  83          2HE       LYS  83  -8.715   7.435 -14.162
  696   1HZ   LYS  83          1HZ       LYS  83  -8.852   8.654 -16.208
  697   2HZ   LYS  83          2HZ       LYS  83 -10.379   9.245 -15.795
  698    H    VAL  84           H        VAL  84 -11.386   6.172  -7.457
  699    HA   VAL  84           HA       VAL  84  -9.292   4.233  -7.991
  700    HB   VAL  84           HB       VAL  84  -9.451   5.103  -5.827
  701   1HG1  VAL  84          1HG1      VAL  84 -12.168   3.794  -5.392
  702   2HG1  VAL  84          2HG1      VAL  84 -11.181   4.654  -4.209
  703   3HG1  VAL  84          3HG1      VAL  84 -11.878   5.537  -5.571
  704   1HG2  VAL  84          1HG2      VAL  84 -10.237   2.162  -5.724
  705   2HG2  VAL  84          2HG2      VAL  84  -8.652   2.761  -6.233
  706   3HG2  VAL  84          3HG2      VAL  84  -9.218   3.053  -4.577
  707    H    ASP  85           H        ASP  85  -9.907   3.140  -9.791
  708    HA   ASP  85           HA       ASP  85 -12.430   1.604  -9.852
  709   1HB   ASP  85          1HB       ASP  85 -11.824   2.979 -11.769
  710   2HB   ASP  85          2HB       ASP  85 -10.265   2.158 -11.914
  711    HD2  ASP  85           HD       ASP  85 -13.629   0.029 -12.825
  712    H    TYR  86           H        TYR  86 -11.721   0.129  -8.081
  713    HA   TYR  86           HA       TYR  86  -9.271  -1.278  -8.404
  714   1HB   TYR  86          1HB       TYR  86  -9.677  -2.305  -6.391
  715   2HB   TYR  86          2HB       TYR  86 -10.597  -0.827  -6.203
  716    HD1  TYR  86           1HD      TYR  86 -13.192  -1.016  -6.660
  717    HD2  TYR  86           2HD      TYR  86 -10.634  -4.465  -6.206
  718    HE1  TYR  86           1HE      TYR  86 -15.161  -2.416  -6.114
  719    HE2  TYR  86           2HE      TYR  86 -12.599  -5.853  -5.686
  720    HH   TYR  86           HH       TYR  86 -14.881  -5.914  -5.400
  721    H    SER  87           H        SER  87  -9.037  -3.662  -8.484
  722    HA   SER  87           HA       SER  87 -11.159  -5.105  -9.944
  723   1HB   SER  87          1HB       SER  87  -8.247  -4.959 -10.824
  724   2HB   SER  87          2HB       SER  87  -9.519  -5.955 -11.564
  725    HG   SER  87           HG       SER  87 -10.637  -3.853 -11.857
  726    H    PHE  88           H        PHE  88 -11.394  -7.115  -9.206
  727    HA   PHE  88           HA       PHE  88  -9.531  -8.274  -7.224
  728   1HB   PHE  88          1HB       PHE  88 -11.616  -8.730  -6.496
  729   2HB   PHE  88          2HB       PHE  88 -12.343  -8.634  -8.083
  730    HD1  PHE  88           1HD      PHE  88 -12.948 -10.615  -9.251
  731    HD2  PHE  88           2HD      PHE  88 -10.128 -10.849  -6.002
  732    HE1  PHE  88           1HE      PHE  88 -12.974 -13.089  -9.407
  733    HE2  PHE  88           2HE      PHE  88 -10.152 -13.330  -6.178
  734    HZ   PHE  88           HZ       PHE  88 -11.579 -14.449  -7.865
  735    H    SER  89           H        SER  89  -8.134  -9.932  -7.735
  736    HA   SER  89           HA       SER  89  -8.145 -11.079 -10.478
  737   1HB   SER  89          1HB       SER  89  -5.673 -10.104  -9.062
  738   2HB   SER  89          2HB       SER  89  -5.850 -10.623 -10.752
  739    HG   SER  89           HG       SER  89  -7.338  -8.807 -10.956
  740    H    GLU  90           H        GLU  90  -6.209 -12.755 -10.527
  741    HA   GLU  90           HA       GLU  90  -7.061 -14.844  -8.687
  742   1HB   GLU  90          1HB       GLU  90  -6.243 -16.335 -10.213
  743   2HB   GLU  90          2HB       GLU  90  -6.669 -14.995 -11.273
  744   1HG   GLU  90          1HG       GLU  90  -3.886 -15.800 -10.280
  745   2HG   GLU  90          2HG       GLU  90  -4.522 -15.988 -11.904
  746    HE2  GLU  90           HE       GLU  90  -2.298 -13.010 -11.626
  747    H    TYR  91           H        TYR  91  -5.613 -16.178  -7.451
  748    HA   TYR  91           HA       TYR  91  -3.622 -14.670  -6.030
  749   1HB   TYR  91          1HB       TYR  91  -4.133 -16.144  -4.509
  750   2HB   TYR  91          2HB       TYR  91  -5.044 -17.132  -5.654
  751    HD1  TYR  91           1HD      TYR  91  -1.681 -16.550  -4.139
  752    HD2  TYR  91           2HD      TYR  91  -4.152 -19.226  -6.449
  753    HE1  TYR  91           1HE      TYR  91   0.155 -18.215  -4.187
  754    HE2  TYR  91           2HE      TYR  91  -2.329 -20.892  -6.475
  755    HH   TYR  91           HH       TYR  91  -0.176 -21.394  -5.796
  756    H    LYS  92           H        LYS  92  -1.750 -14.128  -6.847
  757    HA   LYS  92           HA       LYS  92  -0.110 -15.978  -8.496
  758   1HB   LYS  92          1HB       LYS  92  -0.292 -13.795  -9.285
  759   2HB   LYS  92          2HB       LYS  92   0.177 -13.083  -7.722
  760   1HG   LYS  92          1HG       LYS  92   2.387 -13.715  -7.899
  761   2HG   LYS  92          2HG       LYS  92   2.051 -15.048  -9.013
  762   1HD   LYS  92          1HD       LYS  92   3.163 -13.155 -10.148
  763   2HD   LYS  92          2HD       LYS  92   1.575 -13.541 -10.838
  764   1HE   LYS  92          1HE       LYS  92   0.535 -11.632  -9.741
  765   2HE   LYS  92          2HE       LYS  92   2.000 -11.310  -8.801
  766   1HZ   LYS  92          1HZ       LYS  92   1.926  -9.852 -10.680
  767   2HZ   LYS  92          2HZ       LYS  92   1.858 -11.161 -11.745
  768    H    GLY  93           H        GLY  93   0.133 -13.900  -5.557
  769   1HA   GLY  93          1HA       GLY  93   0.948 -14.285  -3.482
  770   2HA   GLY  93          2HA       GLY  93   1.111 -16.002  -3.888
  771    H    GLU  94           H        GLU  94   2.694 -13.234  -5.523
  772    HA   GLU  94           HA       GLU  94   5.298 -14.505  -5.148
  773   1HB   GLU  94          1HB       GLU  94   6.137 -12.872  -6.666
  774   2HB   GLU  94          2HB       GLU  94   4.677 -13.636  -7.307
  775   1HG   GLU  94          1HG       GLU  94   3.362 -11.600  -6.588
  776   2HG   GLU  94          2HG       GLU  94   4.880 -10.861  -6.047
  777    HE2  GLU  94           HE       GLU  94   4.400  -9.472  -9.305
  778    H    PHE  95           H        PHE  95   3.550 -11.748  -3.630
  779    HA   PHE  95           HA       PHE  95   6.031 -10.467  -2.870
  780   1HB   PHE  95          1HB       PHE  95   3.117  -9.910  -2.255
  781   2HB   PHE  95          2HB       PHE  95   4.459  -8.980  -1.629
  782    HD1  PHE  95           1HD      PHE  95   2.344  -9.541  -4.554
  783    HD2  PHE  95           2HD      PHE  95   6.031  -7.778  -3.171
  784    HE1  PHE  95           1HE      PHE  95   2.545  -8.277  -6.676
  785    HE2  PHE  95           2HE      PHE  95   6.217  -6.509  -5.292
  786    HZ   PHE  95           HZ       PHE  95   4.480  -6.766  -7.053
  787    H    GLU  96           H        GLU  96   7.095 -10.669  -1.048
  788    HA   GLU  96           HA       GLU  96   6.046 -12.176   1.229
  789   1HB   GLU  96          1HB       GLU  96   8.360 -12.141   2.052
  790   2HB   GLU  96          2HB       GLU  96   8.165 -12.961   0.500
  791   1HG   GLU  96          1HG       GLU  96   9.035 -10.901  -0.666
  792   2HG   GLU  96          2HG       GLU  96   9.349 -10.182   0.923
  793    HE2  GLU  96           HE       GLU  96  12.009 -12.422   1.633
  794    H    ASP  97           H        ASP  97   5.106 -10.960   2.784
  795    HA   ASP  97           HA       ASP  97   4.396  -9.236   4.014
  796   1HB   ASP  97          1HB       ASP  97   6.744  -8.887   4.657
  797   2HB   ASP  97          2HB       ASP  97   6.978  -7.784   3.296
  798    HD2  ASP  97           HD       ASP  97   5.977  -5.098   5.161
  799    H    PHE  98           H        PHE  98   3.700  -6.840   3.821
  800    HA   PHE  98           HA       PHE  98   2.937  -6.174   1.020
  801   1HB   PHE  98          1HB       PHE  98   1.137  -6.951   2.510
  802   2HB   PHE  98          2HB       PHE  98   1.505  -5.669   3.627
  803    HD1  PHE  98           1HD      PHE  98   1.846  -4.122   0.449
  804    HD2  PHE  98           2HD      PHE  98  -1.101  -5.819   3.089
  805    HE1  PHE  98           1HE      PHE  98   0.083  -2.948  -0.777
  806    HE2  PHE  98           2HE      PHE  98  -2.888  -4.575   1.867
  807    HZ   PHE  98           HZ       PHE  98  -2.308  -3.216  -0.105
  808    H    GLU  99           H        GLU  99   4.859  -4.925   0.667
  809    HA   GLU  99           HA       GLU  99   5.415  -2.776   2.641
  810   1HB   GLU  99          1HB       GLU  99   7.155  -4.416   2.179
  811   2HB   GLU  99          2HB       GLU  99   7.208  -3.886   0.491
  812   1HG   GLU  99          1HG       GLU  99   7.859  -1.606   1.219
  813   2HG   GLU  99          2HG       GLU  99   7.645  -2.070   2.912
  814    HE2  GLU  99           HE       GLU  99  10.891  -3.336   0.795
  815    H    THR 100           H        THR 100   5.857  -0.693   1.988
  816    HA   THR 100           HA       THR 100   4.277   0.160  -0.338
  817    HB   THR 100           HB       THR 100   3.348   1.623   0.929
  818    HG1  THR 100           1HG      THR 100   4.447   3.026   2.337
  819   1HG2  THR 100          1HG2      THR 100   3.232   1.216   3.307
  820   2HG2  THR 100          2HG2      THR 100   3.411  -0.351   2.498
  821   3HG2  THR 100          3HG2      THR 100   4.798   0.396   3.314
  822    H    TYR 101           H        TYR 101   5.150   1.231  -2.026
  823    HA   TYR 101           HA       TYR 101   7.963   2.231  -1.901
  824   1HB   TYR 101          1HB       TYR 101   7.824   0.325  -3.168
  825   2HB   TYR 101          2HB       TYR 101   6.339   0.763  -3.959
  826    HD1  TYR 101           1HD      TYR 101   6.569   3.122  -5.427
  827    HD2  TYR 101           2HD      TYR 101   9.498   0.061  -4.704
  828    HE1  TYR 101           1HE      TYR 101   7.820   3.847  -7.430
  829    HE2  TYR 101           2HE      TYR 101  10.720   0.747  -6.739
  830    HH   TYR 101           HH       TYR 101  10.738   2.132  -8.580
  Start of MODEL   12
    1   1H    GLY  -1          1H        GLY  -1  -4.163 -41.392  19.393
    2   2H    GLY  -1          2H        GLY  -1  -2.544 -41.134  19.599
    3   3H    GLY  -1          3H        GLY  -1  -3.613 -39.941  19.964
    4   1HA   GLY  -1          1HA       GLY  -1  -3.116 -41.024  17.290
    5   2HA   GLY  -1          2HA       GLY  -1  -4.264 -39.729  17.685
    6    H    SER   0           H        SER   0  -2.508 -39.041  15.820
    7    HA   SER   0           HA       SER   0  -0.794 -37.038  17.118
    8   1HB   SER   0          1HB       SER   0   0.282 -39.081  15.115
    9   2HB   SER   0          2HB       SER   0   1.157 -37.664  15.727
   10    HG   SER   0           HG       SER   0   0.832 -38.596  17.856
   11    H    MET   1           H        MET   1  -0.315 -35.292  15.708
   12    HA   MET   1           HA       MET   1  -2.380 -34.858  13.681
   13   1HB   MET   1          1HB       MET   1  -0.157 -33.041  14.704
   14   2HB   MET   1          2HB       MET   1  -1.523 -32.561  13.689
   15   1HG   MET   1          1HG       MET   1  -1.605 -33.560  16.561
   16   2HG   MET   1          2HG       MET   1  -1.952 -31.935  15.987
   17   1HE   MET   1          1HE       MET   1  -4.073 -31.278  14.572
   18   2HE   MET   1          2HE       MET   1  -5.429 -32.377  14.228
   19   3HE   MET   1          3HE       MET   1  -3.882 -32.596  13.386
   20    H    LYS   2           H        LYS   2  -1.381 -36.739  12.469
   21    HA   LYS   2           HA       LYS   2   0.980 -36.166  10.839
   22   1HB   LYS   2          1HB       LYS   2  -1.137 -38.345  10.658
   23   2HB   LYS   2          2HB       LYS   2   0.392 -38.302   9.755
   24   1HG   LYS   2          1HG       LYS   2   1.670 -38.339  11.863
   25   2HG   LYS   2          2HG       LYS   2   0.171 -38.469  12.791
   26   1HD   LYS   2          1HD       LYS   2   1.054 -40.482  10.679
   27   2HD   LYS   2          2HD       LYS   2   1.382 -40.634  12.413
   28   1HE   LYS   2          1HE       LYS   2  -1.065 -40.600  12.886
   29   2HE   LYS   2          2HE       LYS   2  -1.394 -40.544  11.142
   30   1HZ   LYS   2          1HZ       LYS   2  -1.456 -42.803  11.887
   31   2HZ   LYS   2          2HZ       LYS   2   0.135 -42.702  12.441
   32    H    LYS   3           H        LYS   3   0.770 -36.327   8.444
   33    HA   LYS   3           HA       LYS   3   0.138 -35.593   6.440
   34   1HB   LYS   3          1HB       LYS   3  -2.716 -35.497   7.515
   35   2HB   LYS   3          2HB       LYS   3  -2.222 -35.129   5.877
   36   1HG   LYS   3          1HG       LYS   3  -3.056 -37.336   5.908
   37   2HG   LYS   3          2HG       LYS   3  -1.322 -37.409   5.574
   38   1HD   LYS   3          1HD       LYS   3  -0.854 -38.222   7.790
   39   2HD   LYS   3          2HD       LYS   3  -2.506 -37.847   8.351
   40   1HE   LYS   3          1HE       LYS   3  -3.404 -39.581   6.839
   41   2HE   LYS   3          2HE       LYS   3  -1.767 -39.919   6.235
   42   1HZ   LYS   3          1HZ       LYS   3  -2.319 -41.470   7.968
   43   2HZ   LYS   3          2HZ       LYS   3  -2.554 -40.208   9.065
   44    H    TRP   4           H        TRP   4   0.739 -33.686   5.673
   45    HA   TRP   4           HA       TRP   4  -0.396 -31.224   6.064
   46   1HB   TRP   4          1HB       TRP   4   0.399 -31.197   8.427
   47   2HB   TRP   4          2HB       TRP   4   2.005 -31.702   7.910
   48    HD1  TRP   4           HD       TRP   4  -0.225 -28.662   8.237
   49    HE1  TRP   4           1HE      TRP   4   1.170 -26.510   7.903
   50    HE3  TRP   4           3HE      TRP   4   4.162 -30.746   6.598
   51    HZ2  TRP   4           2HZ      TRP   4   3.802 -25.804   7.061
   52    HZ3  TRP   4           3HZ      TRP   4   6.076 -29.301   6.001
   53    HH2  TRP   4           HH       TRP   4   5.918 -26.834   6.243
   54    H    SER   5           H        SER   5   0.435 -29.767   4.652
   55    HA   SER   5           HA       SER   5   3.049 -30.346   3.334
   56   1HB   SER   5          1HB       SER   5   2.050 -29.541   1.236
   57   2HB   SER   5          2HB       SER   5   1.257 -31.012   1.829
   58    HG   SER   5           HG       SER   5  -0.405 -29.688   2.655
   59    H    ASP   6           H        ASP   6   4.185 -28.435   2.659
   60    HA   ASP   6           HA       ASP   6   3.917 -26.130   4.293
   61   1HB   ASP   6          1HB       ASP   6   6.049 -26.831   3.306
   62   2HB   ASP   6          2HB       ASP   6   5.416 -26.546   1.677
   63    HD2  ASP   6           HD       ASP   6   6.219 -23.353   4.086
   64    H    THR   7           H        THR   7   3.112 -26.749   0.857
   65    HA   THR   7           HA       THR   7   0.766 -25.117   0.986
   66    HB   THR   7           HB       THR   7   2.385 -23.289   0.677
   67    HG1  THR   7           1HG      THR   7   1.392 -22.449  -1.155
   68   1HG2  THR   7          1HG2      THR   7   3.693 -23.104  -1.373
   69   2HG2  THR   7          2HG2      THR   7   4.177 -24.562  -0.487
   70   3HG2  THR   7          3HG2      THR   7   3.134 -24.698  -1.922
   71    H    GLU   8           H        GLU   8  -0.371 -25.184  -1.159
   72    HA   GLU   8           HA       GLU   8   0.368 -27.227  -3.070
   73   1HB   GLU   8          1HB       GLU   8  -0.391 -28.595  -1.112
   74   2HB   GLU   8          2HB       GLU   8  -1.946 -27.748  -1.135
   75   1HG   GLU   8          1HG       GLU   8  -2.457 -28.699  -3.343
   76   2HG   GLU   8          2HG       GLU   8  -0.824 -29.383  -3.455
   77    HE2  GLU   8           HE       GLU   8  -3.572 -31.084  -0.981
   78    H    VAL   9           H        VAL   9  -1.183 -27.243  -4.852
   79    HA   VAL   9           HA       VAL   9  -2.364 -24.726  -5.407
   80    HB   VAL   9           HB       VAL   9  -1.488 -26.347  -7.072
   81   1HG1  VAL   9          1HG1      VAL   9  -4.086 -27.888  -6.621
   82   2HG1  VAL   9          2HG1      VAL   9  -2.855 -28.211  -7.854
   83   3HG1  VAL   9          3HG1      VAL   9  -2.468 -28.444  -6.141
   84   1HG2  VAL   9          1HG2      VAL   9  -4.384 -25.589  -7.620
   85   2HG2  VAL   9          2HG2      VAL   9  -2.997 -24.477  -7.720
   86   3HG2  VAL   9          3HG2      VAL   9  -3.097 -25.879  -8.800
   87    H    PHE  10           H        PHE  10  -4.568 -24.237  -5.708
   88    HA   PHE  10           HA       PHE  10  -6.727 -24.035  -5.196
   89   1HB   PHE  10          1HB       PHE  10  -7.013 -26.418  -5.797
   90   2HB   PHE  10          2HB       PHE  10  -6.710 -26.886  -4.128
   91    HD1  PHE  10           1HD      PHE  10  -8.966 -24.629  -6.135
   92    HD2  PHE  10           2HD      PHE  10  -8.549 -27.216  -2.705
   93    HE1  PHE  10           1HE      PHE  10 -11.380 -24.371  -5.637
   94    HE2  PHE  10           2HE      PHE  10 -10.965 -26.981  -2.240
   95    HZ   PHE  10           HZ       PHE  10 -12.387 -25.558  -3.699
   96    H    GLU  11           H        GLU  11  -5.197 -22.671  -3.796
   97    HA   GLU  11           HA       GLU  11  -6.166 -22.813  -0.989
   98   1HB   GLU  11          1HB       GLU  11  -4.584 -21.011  -0.528
   99   2HB   GLU  11          2HB       GLU  11  -3.812 -22.536  -0.942
  100   1HG   GLU  11          1HG       GLU  11  -4.168 -20.321  -3.006
  101   2HG   GLU  11          2HG       GLU  11  -2.815 -20.371  -1.883
  102    HE2  GLU  11           HE       GLU  11  -1.253 -23.141  -3.277
  103    H    MET  12           H        MET  12  -7.757 -21.461  -0.474
  104    HA   MET  12           HA       MET  12  -9.242 -20.107  -2.496
  105   1HB   MET  12          1HB       MET  12  -9.387 -20.065   0.541
  106   2HB   MET  12          2HB       MET  12 -10.467 -19.115  -0.485
  107   1HG   MET  12          1HG       MET  12 -11.605 -21.111   0.084
  108   2HG   MET  12          2HG       MET  12 -11.219 -21.170  -1.634
  109   1HE   MET  12          1HE       MET  12 -12.310 -23.617   0.035
  110   2HE   MET  12          2HE       MET  12 -11.270 -24.926  -0.570
  111   3HE   MET  12          3HE       MET  12 -11.900 -23.702  -1.699
  112    H    LEU  13           H        LEU  13  -6.890 -18.913  -0.069
  113    HA   LEU  13           HA       LEU  13  -7.458 -16.212  -0.319
  114   1HB   LEU  13          1HB       LEU  13  -5.345 -15.811   0.747
  115   2HB   LEU  13          2HB       LEU  13  -6.203 -17.153   1.486
  116    HG   LEU  13           HG       LEU  13  -4.540 -18.445  -0.348
  117   1HD1  LEU  13          1HD1      LEU  13  -2.318 -17.442  -0.067
  118   2HD1  LEU  13          2HD1      LEU  13  -3.394 -16.237  -0.798
  119   3HD1  LEU  13          3HD1      LEU  13  -2.994 -16.134   0.925
  120   1HD2  LEU  13          1HD2      LEU  13  -3.198 -19.019   1.671
  121   2HD2  LEU  13          2HD2      LEU  13  -4.045 -17.744   2.576
  122   3HD2  LEU  13          3HD2      LEU  13  -4.942 -19.144   1.948
  123    H    LYS  14           H        LYS  14  -7.123 -14.704  -1.715
  124    HA   LYS  14           HA       LYS  14  -5.608 -15.333  -4.213
  125   1HB   LYS  14          1HB       LYS  14  -7.366 -14.874  -5.477
  126   2HB   LYS  14          2HB       LYS  14  -8.184 -15.560  -4.087
  127   1HG   LYS  14          1HG       LYS  14  -7.908 -12.642  -4.893
  128   2HG   LYS  14          2HG       LYS  14  -9.365 -13.619  -4.923
  129   1HD   LYS  14          1HD       LYS  14  -7.969 -12.910  -2.316
  130   2HD   LYS  14          2HD       LYS  14  -9.082 -11.854  -3.161
  131   1HE   LYS  14          1HE       LYS  14 -10.335 -12.921  -1.487
  132   2HE   LYS  14          2HE       LYS  14 -10.856 -13.629  -3.027
  133   1HZ   LYS  14          1HZ       LYS  14 -10.491 -15.359  -1.422
  134   2HZ   LYS  14          2HZ       LYS  14  -8.891 -14.871  -1.201
  135    H    ARG  15           H        ARG  15  -5.118 -13.375  -5.622
  136    HA   ARG  15           HA       ARG  15  -4.355 -11.058  -3.954
  137   1HB   ARG  15          1HB       ARG  15  -2.866 -10.402  -5.488
  138   2HB   ARG  15          2HB       ARG  15  -2.708 -12.162  -5.390
  139   1HG   ARG  15          1HG       ARG  15  -4.155 -12.208  -7.534
  140   2HG   ARG  15          2HG       ARG  15  -3.906 -10.455  -7.619
  141   1HD   ARG  15          1HD       ARG  15  -1.725 -12.553  -7.502
  142   2HD   ARG  15          2HD       ARG  15  -2.229 -11.688  -8.973
  143    HE   ARG  15           HE       ARG  15  -1.646  -9.611  -7.396
  144   1HH1  ARG  15          2HH1      ARG  15   0.295 -12.532  -8.038
  145   2HH1  ARG  15          1HH1      ARG  15   1.787 -11.773  -7.557
  146   1HH2  ARG  15          1HH2      ARG  15   0.319  -8.665  -6.785
  147   2HH2  ARG  15          2HH2      ARG  15   1.804  -9.577  -6.866
  148    H    MET  16           H        MET  16  -5.647  -9.340  -3.804
  149    HA   MET  16           HA       MET  16  -7.423  -8.542  -6.022
  150   1HB   MET  16          1HB       MET  16  -8.146  -8.497  -3.742
  151   2HB   MET  16          2HB       MET  16  -6.979  -7.248  -3.315
  152   1HG   MET  16          1HG       MET  16  -9.077  -6.940  -5.521
  153   2HG   MET  16          2HG       MET  16  -9.460  -6.642  -3.839
  154   1HE   MET  16          1HE       MET  16  -7.837  -5.113  -2.338
  155   2HE   MET  16          2HE       MET  16  -7.257  -3.548  -2.936
  156   3HE   MET  16          3HE       MET  16  -6.291  -5.003  -3.223
  157    H    TYR  17           H        TYR  17  -7.153  -6.490  -6.961
  158    HA   TYR  17           HA       TYR  17  -4.479  -5.194  -6.867
  159   1HB   TYR  17          1HB       TYR  17  -4.289  -6.723  -8.713
  160   2HB   TYR  17          2HB       TYR  17  -5.898  -6.319  -9.300
  161    HD1  TYR  17           1HD      TYR  17  -6.032  -4.909 -11.170
  162    HD2  TYR  17           2HD      TYR  17  -2.679  -4.499  -8.492
  163    HE1  TYR  17           1HE      TYR  17  -5.046  -3.195 -12.658
  164    HE2  TYR  17           2HE      TYR  17  -1.622  -2.912 -10.062
  165    HH   TYR  17           HH       TYR  17  -1.830  -1.748 -12.036
  166    H    ALA  18           H        ALA  18  -5.142  -3.343  -5.929
  167    HA   ALA  18           HA       ALA  18  -7.442  -1.880  -7.125
  168   1HB   ALA  18          1HB       ALA  18  -7.236  -0.425  -5.153
  169   2HB   ALA  18          2HB       ALA  18  -7.686  -2.100  -4.789
  170   3HB   ALA  18          3HB       ALA  18  -6.013  -1.546  -4.494
  171    H    ARG  19           H        ARG  19  -6.810  -0.736  -8.755
  172    HA   ARG  19           HA       ARG  19  -4.224   0.643  -8.815
  173   1HB   ARG  19          1HB       ARG  19  -5.010  -0.621 -10.769
  174   2HB   ARG  19          2HB       ARG  19  -6.425   0.427 -10.903
  175   1HG   ARG  19          1HG       ARG  19  -4.655   1.039 -12.493
  176   2HG   ARG  19          2HG       ARG  19  -4.973   2.362 -11.351
  177   1HD   ARG  19          1HD       ARG  19  -3.021   1.916 -10.102
  178   2HD   ARG  19          2HD       ARG  19  -2.719   0.377 -10.940
  179    HE   ARG  19           HE       ARG  19  -2.575   1.945 -13.036
  180   1HH1  ARG  19          1HH1      ARG  19  -1.225   2.628  -9.816
  181   2HH1  ARG  19          2HH1      ARG  19  -0.002   3.708 -10.425
  182   1HH2  ARG  19          1HH2      ARG  19  -0.894   3.274 -13.821
  183   2HH2  ARG  19          2HH2      ARG  19   0.235   4.012 -12.717
  184    H    VAL  20           H        VAL  20  -4.469   2.295  -7.251
  185    HA   VAL  20           HA       VAL  20  -6.943   3.865  -7.201
  186    HB   VAL  20           HB       VAL  20  -4.529   4.088  -5.393
  187   1HG1  VAL  20          1HG1      VAL  20  -7.443   4.934  -5.064
  188   2HG1  VAL  20          2HG1      VAL  20  -6.155   5.139  -3.861
  189   3HG1  VAL  20          3HG1      VAL  20  -6.092   6.037  -5.385
  190   1HG2  VAL  20          1HG2      VAL  20  -7.042   2.405  -5.061
  191   2HG2  VAL  20          2HG2      VAL  20  -5.383   1.792  -5.236
  192   3HG2  VAL  20          3HG2      VAL  20  -5.834   2.710  -3.801
  193    H    TYR  21           H        TYR  21  -7.134   5.481  -8.541
  194    HA   TYR  21           HA       TYR  21  -4.839   7.142  -9.426
  195   1HB   TYR  21          1HB       TYR  21  -7.733   7.146 -10.348
  196   2HB   TYR  21          2HB       TYR  21  -6.424   8.055 -11.036
  197    HD1  TYR  21           1HD      TYR  21  -8.097   4.798 -10.898
  198    HD2  TYR  21           2HD      TYR  21  -4.548   6.845 -12.246
  199    HE1  TYR  21           1HE      TYR  21  -7.673   2.993 -12.513
  200    HE2  TYR  21           2HE      TYR  21  -4.115   5.015 -13.855
  201    HH   TYR  21           HH       TYR  21  -4.949   3.100 -14.843
  202    H    GLY  22           H        GLY  22  -4.771   9.350  -8.996
  203   1HA   GLY  22          1HA       GLY  22  -6.361  11.308  -8.537
  204   2HA   GLY  22          2HA       GLY  22  -6.686  10.458  -7.008
  205    H    LEU  23           H        LEU  23  -5.913  12.745  -6.389
  206    HA   LEU  23           HA       LEU  23  -2.993  12.974  -6.266
  207   1HB   LEU  23          1HB       LEU  23  -4.626  14.879  -6.622
  208   2HB   LEU  23          2HB       LEU  23  -5.022  14.743  -4.909
  209    HG   LEU  23           HG       LEU  23  -2.436  15.060  -4.522
  210   1HD1  LEU  23          1HD1      LEU  23  -1.275  16.284  -6.318
  211   2HD1  LEU  23          2HD1      LEU  23  -1.687  14.653  -6.854
  212   3HD1  LEU  23          3HD1      LEU  23  -2.655  16.037  -7.404
  213   1HD2  LEU  23          1HD2      LEU  23  -2.651  17.503  -4.702
  214   2HD2  LEU  23          2HD2      LEU  23  -4.099  17.313  -5.715
  215   3HD2  LEU  23          3HD2      LEU  23  -4.118  16.782  -4.019
  216    H    VAL  24           H        VAL  24  -4.374  10.641  -5.030
  217    HA   VAL  24           HA       VAL  24  -4.210  10.816  -2.178
  218    HB   VAL  24           HB       VAL  24  -4.292   8.437  -2.195
  219   1HG1  VAL  24          1HG1      VAL  24  -6.043   9.464  -4.472
  220   2HG1  VAL  24          2HG1      VAL  24  -6.371   8.112  -3.380
  221   3HG1  VAL  24          3HG1      VAL  24  -6.345   9.774  -2.754
  222   1HG2  VAL  24          1HG2      VAL  24  -3.795   8.554  -5.206
  223   2HG2  VAL  24          2HG2      VAL  24  -2.684   7.908  -3.975
  224   3HG2  VAL  24          3HG2      VAL  24  -4.232   7.109  -4.271
  225    H    GLN  25           H        GLN  25  -1.823  10.373  -4.716
  226    HA   GLN  25           HA       GLN  25   0.553   9.817  -3.343
  227   1HB   GLN  25          1HB       GLN  25  -0.273  11.292  -5.792
  228   2HB   GLN  25          2HB       GLN  25   1.216  11.858  -5.050
  229   1HG   GLN  25          1HG       GLN  25   1.852  10.258  -6.607
  230   2HG   GLN  25          2HG       GLN  25   2.137   9.580  -5.012
  231   1HE2  GLN  25          1HE2      GLN  25   2.254   7.810  -6.964
  232   2HE2  GLN  25          2HE2      GLN  25   0.835   6.801  -7.051
  233    H    GLY  26           H        GLY  26   1.693  10.911  -1.777
  234   1HA   GLY  26          1HA       GLY  26   2.637  12.762  -0.769
  235   2HA   GLY  26          2HA       GLY  26   1.414  13.821  -1.465
  236    H    VAL  27           H        VAL  27  -0.992  12.844  -0.593
  237    HA   VAL  27           HA       VAL  27  -0.929  13.668   2.169
  238    HB   VAL  27           HB       VAL  27  -3.320  13.489   2.139
  239   1HG1  VAL  27          1HG1      VAL  27  -2.407  14.612  -0.533
  240   2HG1  VAL  27          2HG1      VAL  27  -3.838  15.067   0.410
  241   3HG1  VAL  27          3HG1      VAL  27  -2.225  15.429   1.036
  242   1HG2  VAL  27          1HG2      VAL  27  -3.237  12.317  -0.651
  243   2HG2  VAL  27          2HG2      VAL  27  -3.468  11.309   0.796
  244   3HG2  VAL  27          3HG2      VAL  27  -4.635  12.563   0.418
  245    H    GLY  28           H        GLY  28  -2.582  12.344   3.670
  246   1HA   GLY  28          1HA       GLY  28  -1.150  10.090   4.626
  247   2HA   GLY  28          2HA       GLY  28  -2.739  10.655   5.157
  248    H    PHE  29           H        PHE  29  -1.047   8.650   2.783
  249    HA   PHE  29           HA       PHE  29  -3.177   6.683   2.808
  250   1HB   PHE  29          1HB       PHE  29  -3.813   8.384   1.011
  251   2HB   PHE  29          2HB       PHE  29  -2.328   7.963   0.179
  252    HD1  PHE  29           1HD      PHE  29  -5.251   6.146   1.780
  253    HD2  PHE  29           2HD      PHE  29  -2.560   6.404  -1.587
  254    HE1  PHE  29           1HE      PHE  29  -6.483   4.321   0.649
  255    HE2  PHE  29           2HE      PHE  29  -3.750   4.516  -2.667
  256    HZ   PHE  29           HZ       PHE  29  -5.724   3.488  -1.559
  257    H    ARG  30           H        ARG  30  -2.453   4.849   1.217
  258    HA   ARG  30           HA       ARG  30  -1.041   3.314   0.547
  259   1HB   ARG  30          1HB       ARG  30   0.224   5.285  -0.447
  260   2HB   ARG  30          2HB       ARG  30   1.368   5.157   0.905
  261   1HG   ARG  30          1HG       ARG  30   1.904   2.847   0.273
  262   2HG   ARG  30          2HG       ARG  30   0.588   2.868  -0.912
  263   1HD   ARG  30          1HD       ARG  30   2.406   3.163  -2.262
  264   2HD   ARG  30          2HD       ARG  30   1.797   4.802  -2.079
  265    HE   ARG  30           HE       ARG  30   4.339   3.642  -1.186
  266   1HH1  ARG  30          1HH1      ARG  30   2.213   6.479  -0.834
  267   2HH1  ARG  30          2HH1      ARG  30   3.553   7.559  -0.546
  268   1HH2  ARG  30          1HH2      ARG  30   6.011   5.055  -0.875
  269   2HH2  ARG  30          2HH2      ARG  30   5.729   6.738  -0.482
  270    H    LYS  31           H        LYS  31   1.015   4.977   3.013
  271    HA   LYS  31           HA       LYS  31   1.682   2.846   4.545
  272   1HB   LYS  31          1HB       LYS  31   2.433   5.146   4.871
  273   2HB   LYS  31          2HB       LYS  31   0.877   5.579   5.569
  274   1HG   LYS  31          1HG       LYS  31   2.566   5.203   7.302
  275   2HG   LYS  31          2HG       LYS  31   1.244   4.039   7.460
  276   1HD   LYS  31          1HD       LYS  31   2.609   2.272   6.453
  277   2HD   LYS  31          2HD       LYS  31   3.895   3.441   6.068
  278   1HE   LYS  31          1HE       LYS  31   4.246   3.829   8.493
  279   2HE   LYS  31          2HE       LYS  31   2.938   2.685   8.867
  280   1HZ   LYS  31          1HZ       LYS  31   5.041   1.556   8.968
  281   2HZ   LYS  31          2HZ       LYS  31   5.366   1.951   7.359
  282    H    PHE  32           H        PHE  32  -1.241   4.904   4.889
  283    HA   PHE  32           HA       PHE  32  -2.622   3.692   6.904
  284   1HB   PHE  32          1HB       PHE  32  -3.227   5.752   5.688
  285   2HB   PHE  32          2HB       PHE  32  -3.795   4.787   4.334
  286    HD1  PHE  32           1HD      PHE  32  -4.669   3.364   7.631
  287    HD2  PHE  32           2HD      PHE  32  -5.861   6.213   4.597
  288    HE1  PHE  32           1HE      PHE  32  -6.927   3.380   8.541
  289    HE2  PHE  32           2HE      PHE  32  -8.133   6.258   5.571
  290    HZ   PHE  32           HZ       PHE  32  -8.684   4.847   7.537
  291    H    VAL  33           H        VAL  33  -2.519   2.692   3.479
  292    HA   VAL  33           HA       VAL  33  -4.466   0.564   3.655
  293    HB   VAL  33           HB       VAL  33  -2.216   0.928   1.621
  294   1HG1  VAL  33          1HG1      VAL  33  -4.848  -0.575   1.463
  295   2HG1  VAL  33          2HG1      VAL  33  -3.718  -0.326   0.121
  296   3HG1  VAL  33          3HG1      VAL  33  -3.224  -1.306   1.506
  297   1HG2  VAL  33          1HG2      VAL  33  -5.086   1.937   1.466
  298   2HG2  VAL  33          2HG2      VAL  33  -3.657   2.973   1.698
  299   3HG2  VAL  33          3HG2      VAL  33  -3.850   2.057   0.201
  300    H    GLN  34           H        GLN  34  -1.075   0.876   4.388
  301    HA   GLN  34           HA       GLN  34  -0.411  -1.930   4.471
  302   1HB   GLN  34          1HB       GLN  34   1.125   0.349   4.516
  303   2HB   GLN  34          2HB       GLN  34   0.929   0.135   6.258
  304   1HG   GLN  34          1HG       GLN  34   2.828  -0.986   6.031
  305   2HG   GLN  34          2HG       GLN  34   1.730  -2.333   5.752
  306   1HE2  GLN  34          1HE2      GLN  34   0.938  -1.963   3.077
  307   2HE2  GLN  34          2HE2      GLN  34   2.345  -1.989   2.044
  308    H    ILE  35           H        ILE  35  -1.167   0.431   7.077
  309    HA   ILE  35           HA       ILE  35  -0.986  -1.216   9.222
  310    HB   ILE  35           HB       ILE  35  -3.244   0.797   8.827
  311   1HG1  ILE  35          1HG1      ILE  35  -1.177   1.951   8.388
  312   2HG1  ILE  35          2HG1      ILE  35  -1.821   2.440   9.942
  313   1HG2  ILE  35          1HG2      ILE  35  -3.128   1.032  11.318
  314   2HG2  ILE  35          2HG2      ILE  35  -3.703  -0.546  10.788
  315   3HG2  ILE  35          3HG2      ILE  35  -2.040  -0.372  11.368
  316   1HD1  ILE  35          1HD1      ILE  35   0.577   2.183  10.098
  317   2HD1  ILE  35          2HD1      ILE  35  -0.183   0.928  11.085
  318   3HD1  ILE  35          3HD1      ILE  35   0.502   0.520   9.493
  319    H    HIS  36           H        HIS  36  -4.071  -0.950   7.372
  320    HA   HIS  36           HA       HIS  36  -5.367  -2.890   9.075
  321   1HB   HIS  36          1HB       HIS  36  -6.072  -1.569   6.448
  322   2HB   HIS  36          2HB       HIS  36  -7.027  -2.912   7.088
  323    HD2  HIS  36           2HD      HIS  36  -5.677   0.294   9.085
  324    HE1  HIS  36           1HE      HIS  36  -9.810  -0.262   9.774
  325    HE2  HIS  36           2HE      HIS  36  -7.774   1.163  10.361
  326    H    ALA  37           H        ALA  37  -4.039  -3.107   5.728
  327    HA   ALA  37           HA       ALA  37  -4.325  -5.741   5.190
  328   1HB   ALA  37          1HB       ALA  37  -2.213  -5.565   3.912
  329   2HB   ALA  37          2HB       ALA  37  -3.307  -4.194   3.660
  330   3HB   ALA  37          3HB       ALA  37  -1.871  -4.019   4.673
  331    H    ILE  38           H        ILE  38  -1.266  -4.564   6.595
  332    HA   ILE  38           HA       ILE  38  -0.093  -6.846   7.475
  333    HB   ILE  38           HB       ILE  38   0.052  -3.967   8.224
  334   1HG1  ILE  38          1HG1      ILE  38   2.335  -4.235   7.444
  335   2HG1  ILE  38          2HG1      ILE  38   2.193  -5.996   7.424
  336   1HG2  ILE  38          1HG2      ILE  38   1.881  -4.333   9.797
  337   2HG2  ILE  38          2HG2      ILE  38   0.312  -4.807  10.436
  338   3HG2  ILE  38          3HG2      ILE  38   1.457  -6.058   9.882
  339   1HD1  ILE  38          1HD1      ILE  38   2.109  -4.837   5.206
  340   2HD1  ILE  38          2HD1      ILE  38   0.757  -5.951   5.497
  341   3HD1  ILE  38          3HD1      ILE  38   0.518  -4.199   5.622
  342    H    ARG  39           H        ARG  39  -2.518  -4.920   9.358
  343    HA   ARG  39           HA       ARG  39  -2.216  -6.486  11.754
  344   1HB   ARG  39          1HB       ARG  39  -3.048  -4.103  11.524
  345   2HB   ARG  39          2HB       ARG  39  -4.553  -4.710  10.818
  346   1HG   ARG  39          1HG       ARG  39  -3.506  -5.619  13.517
  347   2HG   ARG  39          2HG       ARG  39  -4.335  -4.062  13.321
  348   1HD   ARG  39          1HD       ARG  39  -6.340  -5.187  12.438
  349   2HD   ARG  39          2HD       ARG  39  -5.557  -6.766  12.669
  350    HE   ARG  39           HE       ARG  39  -5.541  -5.235  15.096
  351   1HH1  ARG  39          1HH1      ARG  39  -7.680  -7.218  13.070
  352   2HH1  ARG  39          2HH1      ARG  39  -8.713  -7.681  14.397
  353   1HH2  ARG  39          1HH2      ARG  39  -6.910  -5.845  16.822
  354   2HH2  ARG  39          2HH2      ARG  39  -8.274  -6.895  16.538
  355    H    LEU  40           H        LEU  40  -4.335  -6.715   8.919
  356    HA   LEU  40           HA       LEU  40  -5.565  -9.181  10.012
  357   1HB   LEU  40          1HB       LEU  40  -6.075  -7.651   7.461
  358   2HB   LEU  40          2HB       LEU  40  -7.043  -8.991   8.102
  359    HG   LEU  40           HG       LEU  40  -6.649  -6.286   9.493
  360   1HD1  LEU  40          1HD1      LEU  40  -8.982  -5.939   8.908
  361   2HD1  LEU  40          2HD1      LEU  40  -7.991  -6.174   7.450
  362   3HD1  LEU  40          3HD1      LEU  40  -9.010  -7.508   8.052
  363   1HD2  LEU  40          1HD2      LEU  40  -8.490  -7.093  10.972
  364   2HD2  LEU  40          2HD2      LEU  40  -8.345  -8.707  10.244
  365   3HD2  LEU  40          3HD2      LEU  40  -7.005  -8.018  11.186
  366    H    GLY  41           H        GLY  41  -2.606  -8.930   9.016
  367   1HA   GLY  41          1HA       GLY  41  -1.117 -10.338   8.064
  368   2HA   GLY  41          2HA       GLY  41  -2.329 -11.600   8.327
  369    H    ILE  42           H        ILE  42  -2.077  -8.773   6.109
  370    HA   ILE  42           HA       ILE  42  -2.636 -10.520   3.761
  371    HB   ILE  42           HB       ILE  42  -3.037  -7.579   4.295
  372   1HG1  ILE  42          1HG1      ILE  42  -4.757  -8.935   5.329
  373   2HG1  ILE  42          2HG1      ILE  42  -5.393  -7.968   3.988
  374   1HG2  ILE  42          1HG2      ILE  42  -4.178  -7.470   2.075
  375   2HG2  ILE  42          2HG2      ILE  42  -2.431  -7.668   2.005
  376   3HG2  ILE  42          3HG2      ILE  42  -3.485  -9.058   1.714
  377   1HD1  ILE  42          1HD1      ILE  42  -6.410 -10.143   3.923
  378   2HD1  ILE  42          2HD1      ILE  42  -5.338 -10.010   2.533
  379   3HD1  ILE  42          3HD1      ILE  42  -4.838 -10.954   3.966
  380    H    LYS  43           H        LYS  43  -1.193 -10.616   2.175
  381    HA   LYS  43           HA       LYS  43   1.437  -9.234   2.462
  382   1HB   LYS  43          1HB       LYS  43   0.630 -11.559   0.719
  383   2HB   LYS  43          2HB       LYS  43   2.238 -10.879   0.857
  384   1HG   LYS  43          1HG       LYS  43   0.727 -12.153   3.184
  385   2HG   LYS  43          2HG       LYS  43   1.897 -12.945   2.143
  386   1HD   LYS  43          1HD       LYS  43   3.464 -12.310   3.638
  387   2HD   LYS  43          2HD       LYS  43   3.324 -10.700   2.919
  388   1HE   LYS  43          1HE       LYS  43   1.522 -10.190   4.638
  389   2HE   LYS  43          2HE       LYS  43   1.878 -11.754   5.391
  390   1HZ   LYS  43          1HZ       LYS  43   3.775  -9.523   5.032
  391   2HZ   LYS  43          2HZ       LYS  43   4.109 -10.997   5.785
  392    H    GLY  44           H        GLY  44   2.377  -8.749  -0.004
  393   1HA   GLY  44          1HA       GLY  44   1.021  -8.338  -2.257
  394   2HA   GLY  44          2HA       GLY  44   0.312  -7.050  -1.270
  395    H    TYR  45           H        TYR  45   1.097  -5.313  -2.344
  396    HA   TYR  45           HA       TYR  45   3.482  -4.241  -1.447
  397   1HB   TYR  45          1HB       TYR  45   4.361  -5.898  -3.359
  398   2HB   TYR  45          2HB       TYR  45   3.842  -4.593  -4.396
  399    HD1  TYR  45           1HD      TYR  45   5.062  -2.447  -4.403
  400    HD2  TYR  45           2HD      TYR  45   6.208  -5.695  -1.812
  401    HE1  TYR  45           1HE      TYR  45   7.275  -1.389  -4.026
  402    HE2  TYR  45           2HE      TYR  45   8.395  -4.605  -1.408
  403    HH   TYR  45           HH       TYR  45   9.698  -2.743  -1.779
  404    H    ALA  46           H        ALA  46   3.398  -2.074  -1.714
  405    HA   ALA  46           HA       ALA  46   1.158  -0.910  -3.330
  406   1HB   ALA  46          1HB       ALA  46   1.215   0.876  -1.674
  407   2HB   ALA  46          2HB       ALA  46   0.855  -0.697  -0.970
  408   3HB   ALA  46          3HB       ALA  46   2.463   0.009  -0.762
  409    H    LYS  47           H        LYS  47   2.345  -0.542  -5.313
  410    HA   LYS  47           HA       LYS  47   4.847   0.936  -5.043
  411   1HB   LYS  47          1HB       LYS  47   5.098  -0.945  -6.274
  412   2HB   LYS  47          2HB       LYS  47   3.707  -0.608  -7.281
  413   1HG   LYS  47          1HG       LYS  47   4.856   1.327  -8.296
  414   2HG   LYS  47          2HG       LYS  47   6.234   1.111  -7.209
  415   1HD   LYS  47          1HD       LYS  47   5.303  -0.946  -9.263
  416   2HD   LYS  47          2HD       LYS  47   6.559   0.271  -9.547
  417   1HE   LYS  47          1HE       LYS  47   7.895  -0.666  -7.659
  418   2HE   LYS  47          2HE       LYS  47   6.689  -1.953  -7.456
  419   1HZ   LYS  47          1HZ       LYS  47   8.440  -2.729  -8.861
  420   2HZ   LYS  47          2HZ       LYS  47   8.161  -1.480  -9.963
  421    H    ASN  48           H        ASN  48   4.610   3.000  -4.746
  422    HA   ASN  48           HA       ASN  48   2.557   4.612  -5.946
  423   1HB   ASN  48          1HB       ASN  48   3.451   4.887  -3.668
  424   2HB   ASN  48          2HB       ASN  48   5.033   5.323  -4.293
  425   1HD2  ASN  48          2HD2      ASN  48   5.032   7.288  -5.820
  426   2HD2  ASN  48          1HD2      ASN  48   3.991   8.624  -5.365
  427    H    LEU  49           H        LEU  49   2.856   4.682  -8.239
  428    HA   LEU  49           HA       LEU  49   5.394   5.555  -9.372
  429   1HB   LEU  49          1HB       LEU  49   2.685   5.308 -10.708
  430   2HB   LEU  49          2HB       LEU  49   4.271   5.493 -11.441
  431    HG   LEU  49           HG       LEU  49   4.680   3.244  -9.893
  432   1HD1  LEU  49          1HD1      LEU  49   2.782   1.778 -10.035
  433   2HD1  LEU  49          2HD1      LEU  49   2.150   3.271  -9.356
  434   3HD1  LEU  49          3HD1      LEU  49   1.895   2.913 -11.072
  435   1HD2  LEU  49          1HD2      LEU  49   4.447   1.959 -11.995
  436   2HD2  LEU  49          2HD2      LEU  49   3.625   3.343 -12.750
  437   3HD2  LEU  49          3HD2      LEU  49   5.324   3.480 -12.246
  438    HA   PRO  50           HA       PRO  50   3.912   9.560  -7.962
  439   1HB   PRO  50          1HB       PRO  50   6.063  11.132  -8.442
  440   2HB   PRO  50          2HB       PRO  50   6.107   9.782  -7.279
  441   1HG   PRO  50          1HG       PRO  50   7.006   9.698 -10.179
  442   2HG   PRO  50          2HG       PRO  50   7.954   9.235  -8.733
  443   1HD   PRO  50          1HD       PRO  50   6.568   7.380 -10.174
  444   2HD   PRO  50          2HD       PRO  50   6.635   7.291  -8.388
  445    H    ASP  51           H        ASP  51   2.316   9.223  -9.808
  446    HA   ASP  51           HA       ASP  51   2.243  11.735 -11.307
  447   1HB   ASP  51          1HB       ASP  51   3.307  10.057 -12.872
  448   2HB   ASP  51          2HB       ASP  51   1.867   9.044 -12.708
  449    HD2  ASP  51           HD       ASP  51   0.448  10.706 -15.386
  450    H    GLY  52           H        GLY  52   0.975  10.961  -8.964
  451   1HA   GLY  52          1HA       GLY  52  -1.024  10.730  -7.933
  452   2HA   GLY  52          2HA       GLY  52  -1.768  11.359  -9.410
  453    H    SER  53           H        SER  53   0.107   8.357  -9.380
  454    HA   SER  53           HA       SER  53  -2.385   6.694  -9.513
  455   1HB   SER  53          1HB       SER  53  -0.092   6.688 -11.478
  456   2HB   SER  53          2HB       SER  53  -1.551   5.663 -11.482
  457    HG   SER  53           HG       SER  53  -2.666   7.826 -11.450
  458    H    VAL  54           H        VAL  54  -1.918   5.742  -7.451
  459    HA   VAL  54           HA       VAL  54   0.626   4.192  -7.221
  460    HB   VAL  54           HB       VAL  54   0.381   5.519  -5.320
  461   1HG1  VAL  54          1HG1      VAL  54  -2.433   4.490  -4.876
  462   2HG1  VAL  54          2HG1      VAL  54  -1.524   5.603  -3.846
  463   3HG1  VAL  54          3HG1      VAL  54  -2.029   6.121  -5.459
  464   1HG2  VAL  54          1HG2      VAL  54  -0.667   2.756  -4.558
  465   2HG2  VAL  54          2HG2      VAL  54   1.028   3.141  -4.908
  466   3HG2  VAL  54          3HG2      VAL  54   0.209   3.887  -3.526
  467    H    GLU  55           H        GLU  55   0.575   2.118  -7.791
  468    HA   GLU  55           HA       GLU  55  -2.005   0.704  -7.989
  469   1HB   GLU  55          1HB       GLU  55  -0.951  -0.929  -9.173
  470   2HB   GLU  55          2HB       GLU  55  -0.121   0.526  -9.697
  471   1HG   GLU  55          1HG       GLU  55   1.591  -1.054  -9.420
  472   2HG   GLU  55          2HG       GLU  55   1.689  -0.038  -7.980
  473    HE2  GLU  55           HE       GLU  55   1.552  -2.888  -5.980
  474    H    VAL  56           H        VAL  56  -2.678  -0.781  -6.456
  475    HA   VAL  56           HA       VAL  56  -0.722  -1.693  -4.382
  476    HB   VAL  56           HB       VAL  56  -3.699  -1.210  -4.129
  477   1HG1  VAL  56          1HG1      VAL  56  -1.590  -2.145  -2.141
  478   2HG1  VAL  56          2HG1      VAL  56  -3.263  -1.703  -1.727
  479   3HG1  VAL  56          3HG1      VAL  56  -2.958  -3.109  -2.746
  480   1HG2  VAL  56          1HG2      VAL  56  -1.294   0.291  -3.001
  481   2HG2  VAL  56          2HG2      VAL  56  -2.471   0.917  -4.177
  482   3HG2  VAL  56          3HG2      VAL  56  -2.984   0.558  -2.526
  483    H    VAL  57           H        VAL  57  -0.423  -3.903  -4.414
  484    HA   VAL  57           HA       VAL  57  -2.726  -5.604  -5.240
  485    HB   VAL  57           HB       VAL  57  -1.112  -7.499  -5.370
  486   1HG1  VAL  57          1HG1      VAL  57  -0.781  -5.247  -7.379
  487   2HG1  VAL  57          2HG1      VAL  57  -0.372  -6.942  -7.674
  488   3HG1  VAL  57          3HG1      VAL  57  -2.056  -6.491  -7.367
  489   1HG2  VAL  57          1HG2      VAL  57   1.012  -5.308  -5.477
  490   2HG2  VAL  57          2HG2      VAL  57   0.811  -6.540  -4.206
  491   3HG2  VAL  57          3HG2      VAL  57   1.259  -7.018  -5.843
  492    H    ALA  58           H        ALA  58  -3.496  -7.009  -3.704
  493    HA   ALA  58           HA       ALA  58  -2.283  -6.988  -1.005
  494   1HB   ALA  58          1HB       ALA  58  -4.379  -6.280   0.011
  495   2HB   ALA  58          2HB       ALA  58  -3.803  -5.026  -1.109
  496   3HB   ALA  58          3HB       ALA  58  -5.138  -6.105  -1.582
  497    H    GLU  59           H        GLU  59  -2.317  -9.016  -0.314
  498    HA   GLU  59           HA       GLU  59  -3.816 -11.010  -1.859
  499   1HB   GLU  59          1HB       GLU  59  -1.115 -11.101  -0.555
  500   2HB   GLU  59          2HB       GLU  59  -1.836 -12.347  -1.590
  501   1HG   GLU  59          1HG       GLU  59  -1.950 -10.692  -3.442
  502   2HG   GLU  59          2HG       GLU  59  -1.148  -9.484  -2.432
  503    HE2  GLU  59           HE       GLU  59   1.119 -11.645  -4.612
  504    H    GLY  60           H        GLY  60  -5.357 -12.169  -0.638
  505   1HA   GLY  60          1HA       GLY  60  -4.531 -13.799   1.480
  506   2HA   GLY  60          2HA       GLY  60  -5.290 -12.393   2.225
  507    H    TYR  61           H        TYR  61  -6.680 -14.204   3.011
  508    HA   TYR  61           HA       TYR  61  -8.660 -15.409   1.315
  509   1HB   TYR  61          1HB       TYR  61  -8.342 -14.870   4.279
  510   2HB   TYR  61          2HB       TYR  61  -9.780 -15.658   3.639
  511    HD1  TYR  61           1HD      TYR  61  -9.513 -17.872   2.374
  512    HD2  TYR  61           2HD      TYR  61  -6.383 -16.117   4.769
  513    HE1  TYR  61           1HE      TYR  61  -8.506 -20.116   2.718
  514    HE2  TYR  61           2HE      TYR  61  -5.375 -18.352   5.087
  515    HH   TYR  61           HH       TYR  61  -5.560 -20.612   4.680
  516    H    GLU  62           H        GLU  62 -11.060 -14.929   1.778
  517    HA   GLU  62           HA       GLU  62 -11.293 -12.207   0.742
  518   1HB   GLU  62          1HB       GLU  62 -13.504 -12.812   0.040
  519   2HB   GLU  62          2HB       GLU  62 -12.272 -13.945  -0.555
  520   1HG   GLU  62          1HG       GLU  62 -12.901 -15.571   1.223
  521   2HG   GLU  62          2HG       GLU  62 -14.125 -14.439   1.824
  522    HE2  GLU  62           HE       GLU  62 -15.928 -16.801  -0.205
  523    H    GLU  63           H        GLU  63 -12.010 -13.773   3.766
  524    HA   GLU  63           HA       GLU  63 -13.945 -11.799   4.667
  525   1HB   GLU  63          1HB       GLU  63 -12.044 -13.695   6.162
  526   2HB   GLU  63          2HB       GLU  63 -13.326 -12.716   6.891
  527   1HG   GLU  63          1HG       GLU  63 -15.006 -13.927   5.498
  528   2HG   GLU  63          2HG       GLU  63 -13.717 -14.953   4.850
  529    HE2  GLU  63           HE       GLU  63 -13.184 -16.632   7.951
  530    H    ALA  64           H        ALA  64 -10.394 -12.337   4.990
  531    HA   ALA  64           HA       ALA  64  -9.958  -9.769   6.209
  532   1HB   ALA  64          1HB       ALA  64  -7.583 -10.345   5.939
  533   2HB   ALA  64          2HB       ALA  64  -8.486 -11.724   6.585
  534   3HB   ALA  64          3HB       ALA  64  -8.018 -11.704   4.871
  535    H    LEU  65           H        LEU  65 -10.391 -10.759   2.848
  536    HA   LEU  65           HA       LEU  65  -9.027  -8.442   1.773
  537   1HB   LEU  65          1HB       LEU  65  -9.473 -10.381   0.369
  538   2HB   LEU  65          2HB       LEU  65 -11.227 -10.089   0.537
  539    HG   LEU  65           HG       LEU  65 -11.138  -8.046  -0.618
  540   1HD1  LEU  65          1HD1      LEU  65  -9.008  -7.203  -1.672
  541   2HD1  LEU  65          2HD1      LEU  65  -9.010  -7.015   0.074
  542   3HD1  LEU  65          3HD1      LEU  65  -8.091  -8.347  -0.678
  543   1HD2  LEU  65          1HD2      LEU  65 -10.430  -8.837  -2.801
  544   2HD2  LEU  65          2HD2      LEU  65  -9.313  -9.995  -2.038
  545   3HD2  LEU  65          3HD2      LEU  65 -11.075 -10.222  -1.885
  546    H    SER  66           H        SER  66 -12.545  -9.239   2.091
  547    HA   SER  66           HA       SER  66 -13.633  -6.793   1.595
  548   1HB   SER  66          1HB       SER  66 -15.581  -7.487   2.825
  549   2HB   SER  66          2HB       SER  66 -14.894  -8.879   1.975
  550    HG   SER  66           HG       SER  66 -13.861  -9.416   4.005
  551    H    LYS  67           H        LYS  67 -12.497  -7.779   4.876
  552    HA   LYS  67           HA       LYS  67 -13.133  -5.447   6.237
  553   1HB   LYS  67          1HB       LYS  67 -11.005  -7.542   6.551
  554   2HB   LYS  67          2HB       LYS  67 -10.797  -6.011   7.406
  555   1HG   LYS  67          1HG       LYS  67 -11.889  -7.423   8.928
  556   2HG   LYS  67          2HG       LYS  67 -13.069  -6.220   8.397
  557   1HD   LYS  67          1HD       LYS  67 -13.971  -7.972   6.773
  558   2HD   LYS  67          2HD       LYS  67 -12.836  -9.126   7.523
  559   1HE   LYS  67          1HE       LYS  67 -13.908  -8.741   9.727
  560   2HE   LYS  67          2HE       LYS  67 -15.059  -7.621   8.966
  561   1HZ   LYS  67          1HZ       LYS  67 -16.035  -9.792   9.098
  562   2HZ   LYS  67          2HZ       LYS  67 -14.773 -10.455   8.193
  563    H    LEU  68           H        LEU  68 -10.208  -6.005   4.239
  564    HA   LEU  68           HA       LEU  68  -9.038  -3.380   4.713
  565   1HB   LEU  68          1HB       LEU  68  -7.472  -5.029   4.215
  566   2HB   LEU  68          2HB       LEU  68  -8.477  -5.772   2.971
  567    HG   LEU  68           HG       LEU  68  -8.026  -3.949   1.407
  568   1HD1  LEU  68          1HD1      LEU  68  -6.287  -2.314   1.848
  569   2HD1  LEU  68          2HD1      LEU  68  -7.587  -2.079   3.013
  570   3HD1  LEU  68          3HD1      LEU  68  -6.095  -2.896   3.520
  571   1HD2  LEU  68          1HD2      LEU  68  -5.680  -4.515   0.996
  572   2HD2  LEU  68          2HD2      LEU  68  -5.546  -5.215   2.624
  573   3HD2  LEU  68          3HD2      LEU  68  -6.628  -5.951   1.422
  574    H    LEU  69           H        LEU  69 -10.580  -4.916   1.850
  575    HA   LEU  69           HA       LEU  69 -10.574  -2.935   0.129
  576   1HB   LEU  69          1HB       LEU  69 -11.471  -5.363   0.111
  577   2HB   LEU  69          2HB       LEU  69 -13.034  -4.681   0.534
  578    HG   LEU  69           HG       LEU  69 -12.813  -5.237  -1.757
  579   1HD1  LEU  69          1HD1      LEU  69 -13.601  -3.195  -2.819
  580   2HD1  LEU  69          2HD1      LEU  69 -14.199  -3.230  -1.145
  581   3HD1  LEU  69          3HD1      LEU  69 -12.806  -2.210  -1.578
  582   1HD2  LEU  69          1HD2      LEU  69 -11.293  -4.230  -3.345
  583   2HD2  LEU  69          2HD2      LEU  69 -10.578  -3.198  -2.098
  584   3HD2  LEU  69          3HD2      LEU  69 -10.366  -4.962  -2.023
  585    H    GLU  70           H        GLU  70 -13.163  -3.495   2.547
  586    HA   GLU  70           HA       GLU  70 -14.752  -1.192   1.998
  587   1HB   GLU  70          1HB       GLU  70 -14.557  -3.106   4.357
  588   2HB   GLU  70          2HB       GLU  70 -15.790  -1.839   4.222
  589   1HG   GLU  70          1HG       GLU  70 -16.646  -2.792   2.153
  590   2HG   GLU  70          2HG       GLU  70 -15.408  -4.053   2.160
  591    HE2  GLU  70           HE       GLU  70 -16.883  -5.827   4.865
  592    H    ARG  71           H        ARG  71 -12.105  -1.786   4.344
  593    HA   ARG  71           HA       ARG  71 -12.092   0.545   5.888
  594   1HB   ARG  71          1HB       ARG  71 -10.361  -0.503   6.641
  595   2HB   ARG  71          2HB       ARG  71 -10.328  -1.562   5.256
  596   1HG   ARG  71          1HG       ARG  71  -8.199  -0.767   5.319
  597   2HG   ARG  71          2HG       ARG  71  -8.923   0.195   4.053
  598   1HD   ARG  71          1HD       ARG  71  -9.367   1.951   5.962
  599   2HD   ARG  71          2HD       ARG  71  -8.311   0.964   6.931
  600    HE   ARG  71           HE       ARG  71  -6.443   1.460   5.612
  601   1HH1  ARG  71          1HH1      ARG  71  -9.337   3.158   4.429
  602   2HH1  ARG  71          2HH1      ARG  71  -8.456   4.098   3.266
  603   1HH2  ARG  71          1HH2      ARG  71  -5.341   2.572   3.933
  604   2HH2  ARG  71          2HH2      ARG  71  -6.191   3.732   2.945
  605    H    ILE  72           H        ILE  72 -10.953   0.133   2.583
  606    HA   ILE  72           HA       ILE  72 -10.082   2.891   2.232
  607    HB   ILE  72           HB       ILE  72 -10.744   0.765   0.188
  608   1HG1  ILE  72          1HG1      ILE  72  -7.985   1.843   0.875
  609   2HG1  ILE  72          2HG1      ILE  72  -8.688   0.565   1.858
  610   1HG2  ILE  72          1HG2      ILE  72  -9.520   2.251  -1.412
  611   2HG2  ILE  72          2HG2      ILE  72 -11.027   2.966  -0.840
  612   3HG2  ILE  72          3HG2      ILE  72  -9.476   3.512  -0.165
  613   1HD1  ILE  72          1HD1      ILE  72  -7.321  -0.433   0.135
  614   2HD1  ILE  72          2HD1      ILE  72  -9.023  -0.873  -0.090
  615   3HD1  ILE  72          3HD1      ILE  72  -8.276   0.353  -1.140
  616    H    LYS  73           H        LYS  73 -12.984   1.260   0.909
  617    HA   LYS  73           HA       LYS  73 -14.065   3.543  -0.128
  618   1HB   LYS  73          1HB       LYS  73 -15.371   0.982   0.749
  619   2HB   LYS  73          2HB       LYS  73 -16.316   2.336   0.121
  620   1HG   LYS  73          1HG       LYS  73 -15.880   1.010  -1.752
  621   2HG   LYS  73          2HG       LYS  73 -14.820   2.412  -1.913
  622   1HD   LYS  73          1HD       LYS  73 -12.929   0.991  -0.990
  623   2HD   LYS  73          2HD       LYS  73 -14.051  -0.382  -0.986
  624   1HE   LYS  73          1HE       LYS  73 -13.154   1.273  -3.403
  625   2HE   LYS  73          2HE       LYS  73 -12.480  -0.295  -2.936
  626   1HZ   LYS  73          1HZ       LYS  73 -14.148  -0.635  -4.597
  627   2HZ   LYS  73          2HZ       LYS  73 -15.318   0.117  -3.641
  628    H    GLN  74           H        GLN  74 -14.634   2.283   3.175
  629    HA   GLN  74           HA       GLN  74 -16.480   4.317   4.011
  630   1HB   GLN  74          1HB       GLN  74 -16.288   2.068   5.037
  631   2HB   GLN  74          2HB       GLN  74 -14.669   2.480   5.630
  632   1HG   GLN  74          1HG       GLN  74 -15.642   4.306   7.015
  633   2HG   GLN  74          2HG       GLN  74 -17.246   3.949   6.358
  634   1HE2  GLN  74          1HE2      GLN  74 -14.479   2.237   7.954
  635   2HE2  GLN  74          2HE2      GLN  74 -15.485   1.243   8.987
  636    H    GLY  75           H        GLY  75 -12.930   3.837   4.387
  637   1HA   GLY  75          1HA       GLY  75 -12.618   6.558   5.601
  638   2HA   GLY  75          2HA       GLY  75 -11.564   5.170   5.795
  639    HA   PRO  76           HA       PRO  76 -10.716   6.704   1.319
  640   1HB   PRO  76          1HB       PRO  76 -11.584   9.196   0.541
  641   2HB   PRO  76          2HB       PRO  76 -12.597   7.727   0.415
  642   1HG   PRO  76          1HG       PRO  76 -12.577   9.767   2.662
  643   2HG   PRO  76          2HG       PRO  76 -13.992   9.167   1.746
  644   1HD   PRO  76          1HD       PRO  76 -13.327   8.101   4.133
  645   2HD   PRO  76          2HD       PRO  76 -13.876   7.046   2.790
  646    HA   PRO  77           HA       PRO  77  -7.265   9.132   2.805
  647   1HB   PRO  77          1HB       PRO  77  -5.983   9.866   0.498
  648   2HB   PRO  77          2HB       PRO  77  -6.086   8.181   1.077
  649   1HG   PRO  77          1HG       PRO  77  -7.865   9.525  -0.963
  650   2HG   PRO  77          2HG       PRO  77  -7.000   7.958  -1.123
  651   1HD   PRO  77          1HD       PRO  77  -9.612   8.095  -0.389
  652   2HD   PRO  77          2HD       PRO  77  -8.514   6.879   0.327
  653    H    ALA  78           H        ALA  78  -6.287  11.340   2.698
  654    HA   ALA  78           HA       ALA  78  -8.437  13.310   2.660
  655   1HB   ALA  78          1HB       ALA  78  -6.828  14.707   3.852
  656   2HB   ALA  78          2HB       ALA  78  -6.900  13.090   4.573
  657   3HB   ALA  78          3HB       ALA  78  -5.531  13.532   3.531
  658    H    ALA  79           H        ALA  79  -7.856  12.451   0.013
  659    HA   ALA  79           HA       ALA  79  -7.116  15.038  -1.177
  660   1HB   ALA  79          1HB       ALA  79  -5.713  13.853  -2.870
  661   2HB   ALA  79          2HB       ALA  79  -4.999  13.958  -1.266
  662   3HB   ALA  79          3HB       ALA  79  -5.740  12.425  -1.814
  663    H    GLU  80           H        GLU  80  -7.558  14.917  -3.554
  664    HA   GLU  80           HA       GLU  80 -10.170  13.831  -4.153
  665   1HB   GLU  80          1HB       GLU  80  -8.040  15.144  -5.896
  666   2HB   GLU  80          2HB       GLU  80  -9.682  14.729  -6.422
  667   1HG   GLU  80          1HG       GLU  80 -10.618  16.220  -4.664
  668   2HG   GLU  80          2HG       GLU  80  -8.977  16.663  -4.166
  669    HE2  GLU  80           HE       GLU  80 -10.402  18.007  -7.735
  670    H    VAL  81           H        VAL  81  -9.840  11.594  -3.699
  671    HA   VAL  81           HA       VAL  81  -8.206   9.909  -5.388
  672    HB   VAL  81           HB       VAL  81  -8.847   9.305  -3.161
  673   1HG1  VAL  81          1HG1      VAL  81 -11.716   8.805  -4.002
  674   2HG1  VAL  81          2HG1      VAL  81 -10.974   8.606  -2.420
  675   3HG1  VAL  81          3HG1      VAL  81 -11.191  10.229  -3.080
  676   1HG2  VAL  81          1HG2      VAL  81 -10.022   7.378  -5.214
  677   2HG2  VAL  81          2HG2      VAL  81  -8.298   7.562  -4.846
  678   3HG2  VAL  81          3HG2      VAL  81  -9.411   6.964  -3.602
  679    H    GLU  82           H        GLU  82  -8.595  10.900  -7.324
  680    HA   GLU  82           HA       GLU  82 -10.719  11.431  -8.815
  681   1HB   GLU  82          1HB       GLU  82  -8.403  11.674  -9.501
  682   2HB   GLU  82          2HB       GLU  82  -8.215   9.925  -9.676
  683   1HG   GLU  82          1HG       GLU  82  -8.487  11.150 -11.830
  684   2HG   GLU  82          2HG       GLU  82  -9.675   9.873 -11.584
  685    HE2  GLU  82           HE       GLU  82 -10.891  13.763 -11.334
  686    H    LYS  83           H        LYS  83  -9.271   8.121  -8.943
  687    HA   LYS  83           HA       LYS  83 -11.921   6.898  -9.034
  688   1HB   LYS  83          1HB       LYS  83  -9.944   6.648 -11.353
  689   2HB   LYS  83          2HB       LYS  83 -11.348   5.601 -11.135
  690   1HG   LYS  83          1HG       LYS  83 -11.513   8.601 -11.541
  691   2HG   LYS  83          2HG       LYS  83 -11.607   7.392 -12.815
  692   1HD   LYS  83          1HD       LYS  83 -13.625   6.415 -11.827
  693   2HD   LYS  83          2HD       LYS  83 -13.551   7.554 -10.468
  694   1HE   LYS  83          1HE       LYS  83 -13.791   9.461 -12.019
  695   2HE   LYS  83          2HE       LYS  83 -13.856   8.342 -13.398
  696   1HZ   LYS  83          1HZ       LYS  83 -16.074   8.897 -12.727
  697   2HZ   LYS  83          2HZ       LYS  83 -15.790   8.316 -11.168
  698    H    VAL  84           H        VAL  84 -11.822   4.941  -8.145
  699    HA   VAL  84           HA       VAL  84  -9.188   3.515  -7.978
  700    HB   VAL  84           HB       VAL  84  -9.794   4.140  -5.934
  701   1HG1  VAL  84          1HG1      VAL  84 -12.561   2.948  -6.284
  702   2HG1  VAL  84          2HG1      VAL  84 -11.845   3.525  -4.765
  703   3HG1  VAL  84          3HG1      VAL  84 -12.134   4.663  -6.085
  704   1HG2  VAL  84          1HG2      VAL  84 -10.579   1.212  -6.108
  705   2HG2  VAL  84          2HG2      VAL  84  -8.926   1.814  -6.331
  706   3HG2  VAL  84          3HG2      VAL  84  -9.762   2.063  -4.785
  707    H    ASP  85           H        ASP  85  -9.411   2.541 -10.120
  708    HA   ASP  85           HA       ASP  85 -11.814   0.922 -10.686
  709   1HB   ASP  85          1HB       ASP  85 -10.848   2.359 -12.453
  710   2HB   ASP  85          2HB       ASP  85  -9.326   1.458 -12.345
  711    HD2  ASP  85           HD       ASP  85 -10.485  -0.647 -14.818
  712    H    TYR  86           H        TYR  86 -11.204  -0.332  -8.661
  713    HA   TYR  86           HA       TYR  86  -8.843  -1.938  -8.803
  714   1HB   TYR  86          1HB       TYR  86  -9.436  -2.860  -6.743
  715   2HB   TYR  86          2HB       TYR  86 -10.046  -1.214  -6.663
  716    HD1  TYR  86           1HD      TYR  86 -12.590  -0.878  -7.063
  717    HD2  TYR  86           2HD      TYR  86 -10.820  -4.767  -6.426
  718    HE1  TYR  86           1HE      TYR  86 -14.810  -1.800  -6.471
  719    HE2  TYR  86           2HE      TYR  86 -13.025  -5.663  -5.792
  720    HH   TYR  86           HH       TYR  86 -15.262  -5.211  -5.479
  721    H    SER  87           H        SER  87  -8.856  -4.325  -8.672
  722    HA   SER  87           HA       SER  87 -11.137  -5.714  -9.882
  723   1HB   SER  87          1HB       SER  87  -9.759  -5.014 -11.832
  724   2HB   SER  87          2HB       SER  87  -8.361  -5.860 -11.133
  725    HG   SER  87           HG       SER  87  -9.606  -7.791 -11.248
  726    H    PHE  88           H        PHE  88 -11.397  -7.619  -8.973
  727    HA   PHE  88           HA       PHE  88  -9.435  -8.754  -7.102
  728   1HB   PHE  88          1HB       PHE  88 -11.355  -9.195  -6.094
  729   2HB   PHE  88          2HB       PHE  88 -12.306  -8.779  -7.488
  730    HD1  PHE  88           1HD      PHE  88 -13.351 -10.377  -8.860
  731    HD2  PHE  88           2HD      PHE  88 -10.421 -11.636  -5.963
  732    HE1  PHE  88           1HE      PHE  88 -13.872 -12.748  -9.373
  733    HE2  PHE  88           2HE      PHE  88 -10.917 -14.020  -6.524
  734    HZ   PHE  88           HZ       PHE  88 -12.639 -14.569  -8.213
  735    H    SER  89           H        SER  89  -8.137 -10.506  -7.611
  736    HA   SER  89           HA       SER  89  -8.522 -11.877 -10.222
  737   1HB   SER  89          1HB       SER  89  -5.830 -11.125  -9.073
  738   2HB   SER  89          2HB       SER  89  -6.199 -11.760 -10.681
  739    HG   SER  89           HG       SER  89  -7.430  -9.803 -11.009
  740    H    GLU  90           H        GLU  90  -6.726 -13.812 -10.142
  741    HA   GLU  90           HA       GLU  90  -7.710 -15.539  -7.968
  742   1HB   GLU  90          1HB       GLU  90  -7.190 -17.323  -9.352
  743   2HB   GLU  90          2HB       GLU  90  -7.650 -16.065 -10.510
  744   1HG   GLU  90          1HG       GLU  90  -5.078 -15.567 -10.627
  745   2HG   GLU  90          2HG       GLU  90  -4.895 -17.124  -9.799
  746    HE2  GLU  90           HE       GLU  90  -6.227 -17.043 -13.631
  747    H    TYR  91           H        TYR  91  -6.232 -16.993  -6.836
  748    HA   TYR  91           HA       TYR  91  -3.840 -16.077  -5.762
  749   1HB   TYR  91          1HB       TYR  91  -4.992 -17.962  -4.862
  750   2HB   TYR  91          2HB       TYR  91  -4.806 -18.878  -6.348
  751    HD1  TYR  91           1HD      TYR  91  -2.689 -17.095  -3.779
  752    HD2  TYR  91           2HD      TYR  91  -2.994 -20.366  -6.573
  753    HE1  TYR  91           1HE      TYR  91  -0.317 -17.645  -3.400
  754    HE2  TYR  91           2HE      TYR  91  -0.628 -20.909  -6.207
  755    HH   TYR  91           HH       TYR  91   1.313 -20.378  -5.058
  756    H    LYS  92           H        LYS  92  -2.459 -15.099  -7.370
  757    HA   LYS  92           HA       LYS  92  -1.395 -16.809  -9.535
  758   1HB   LYS  92          1HB       LYS  92  -2.226 -14.435  -9.879
  759   2HB   LYS  92          2HB       LYS  92  -0.783 -13.922  -9.002
  760   1HG   LYS  92          1HG       LYS  92   0.152 -13.837 -11.037
  761   2HG   LYS  92          2HG       LYS  92   0.397 -15.570 -10.825
  762   1HD   LYS  92          1HD       LYS  92  -1.928 -14.206 -12.272
  763   2HD   LYS  92          2HD       LYS  92  -0.539 -14.996 -13.031
  764   1HE   LYS  92          1HE       LYS  92  -1.247 -17.173 -12.013
  765   2HE   LYS  92          2HE       LYS  92  -2.693 -16.368 -11.362
  766   1HZ   LYS  92          1HZ       LYS  92  -3.230 -17.367 -13.448
  767   2HZ   LYS  92          2HZ       LYS  92  -2.031 -16.473 -14.231
  768    H    GLY  93           H        GLY  93  -0.069 -14.677  -6.913
  769   1HA   GLY  93          1HA       GLY  93   2.056 -16.550  -6.283
  770   2HA   GLY  93          2HA       GLY  93   2.611 -15.152  -7.226
  771    H    GLU  94           H        GLU  94   2.830 -16.132  -4.283
  772    HA   GLU  94           HA       GLU  94   1.632 -13.997  -2.716
  773   1HB   GLU  94          1HB       GLU  94   2.730 -15.085  -0.828
  774   2HB   GLU  94          2HB       GLU  94   1.554 -16.066  -1.703
  775   1HG   GLU  94          1HG       GLU  94   3.308 -17.362  -2.786
  776   2HG   GLU  94          2HG       GLU  94   4.571 -16.370  -2.041
  777    HE2  GLU  94           HE       GLU  94   4.079 -17.735   1.189
  778    H    PHE  95           H        PHE  95   2.487 -12.064  -3.162
  779    HA   PHE  95           HA       PHE  95   5.364 -11.475  -3.221
  780   1HB   PHE  95          1HB       PHE  95   2.839  -9.777  -3.107
  781   2HB   PHE  95          2HB       PHE  95   4.473  -9.142  -3.074
  782    HD1  PHE  95           1HD      PHE  95   3.664  -7.699  -4.921
  783    HD2  PHE  95           2HD      PHE  95   4.160 -11.968  -5.400
  784    HE1  PHE  95           1HE      PHE  95   3.845  -7.417  -7.375
  785    HE2  PHE  95           2HE      PHE  95   4.306 -11.673  -7.831
  786    HZ   PHE  95           HZ       PHE  95   4.167  -9.405  -8.836
  787    H    GLU  96           H        GLU  96   5.581 -12.770  -1.195
  788    HA   GLU  96           HA       GLU  96   4.230 -12.084   1.142
  789   1HB   GLU  96          1HB       GLU  96   5.633 -13.796   2.215
  790   2HB   GLU  96          2HB       GLU  96   4.810 -14.308   0.740
  791   1HG   GLU  96          1HG       GLU  96   6.929 -14.073  -0.551
  792   2HG   GLU  96          2HG       GLU  96   7.773 -13.609   0.931
  793    HE2  GLU  96           HE       GLU  96   7.537 -16.871   2.328
  794    H    ASP  97           H        ASP  97   4.732  -9.818   1.064
  795    HA   ASP  97           HA       ASP  97   6.108  -8.735   3.184
  796   1HB   ASP  97          1HB       ASP  97   8.292  -9.311   2.299
  797   2HB   ASP  97          2HB       ASP  97   7.835  -8.784   0.670
  798    HD2  ASP  97           HD       ASP  97   8.571  -5.938   3.497
  799    H    PHE  98           H        PHE  98   4.094  -7.564   3.095
  800    HA   PHE  98           HA       PHE  98   3.417  -6.135   0.643
  801   1HB   PHE  98          1HB       PHE  98   1.783  -7.178   2.172
  802   2HB   PHE  98          2HB       PHE  98   2.089  -5.942   3.346
  803    HD1  PHE  98           1HD      PHE  98   2.301  -3.972   0.493
  804    HD2  PHE  98           2HD      PHE  98  -0.565  -6.431   2.567
  805    HE1  PHE  98           1HE      PHE  98   0.475  -2.839  -0.680
  806    HE2  PHE  98           2HE      PHE  98  -2.411  -5.206   1.440
  807    HZ   PHE  98           HZ       PHE  98  -1.896  -3.405  -0.169
  808    H    GLU  99           H        GLU  99   5.474  -4.898   0.558
  809    HA   GLU  99           HA       GLU  99   5.586  -2.641   2.514
  810   1HB   GLU  99          1HB       GLU  99   7.436  -4.123   2.487
  811   2HB   GLU  99          2HB       GLU  99   7.780  -3.745   0.792
  812   1HG   GLU  99          1HG       GLU  99   8.187  -1.391   1.366
  813   2HG   GLU  99          2HG       GLU  99   7.603  -1.647   3.015
  814    HE2  GLU  99           HE       GLU  99  11.200  -1.641   3.277
  815    H    THR 100           H        THR 100   6.108  -0.527   1.682
  816    HA   THR 100           HA       THR 100   4.719  -0.021  -0.847
  817    HB   THR 100           HB       THR 100   3.973   1.871  -0.021
  818    HG1  THR 100           1HG      THR 100   5.105   3.183   1.483
  819   1HG2  THR 100          1HG2      THR 100   3.401   1.732   2.333
  820   2HG2  THR 100          2HG2      THR 100   3.415   0.090   1.664
  821   3HG2  THR 100          3HG2      THR 100   4.773   0.672   2.661
  822    H    TYR 101           H        TYR 101   5.599   0.978  -2.580
  823    HA   TYR 101           HA       TYR 101   8.500   1.492  -2.744
  824   1HB   TYR 101          1HB       TYR 101   6.885   0.621  -4.607
  825   2HB   TYR 101          2HB       TYR 101   6.410   2.322  -4.738
  826    HD1  TYR 101           1HD      TYR 101   9.277  -0.028  -4.921
  827    HD2  TYR 101           2HD      TYR 101   7.505   3.632  -6.312
  828    HE1  TYR 101           1HE      TYR 101  11.107   0.218  -6.584
  829    HE2  TYR 101           2HE      TYR 101   9.328   3.892  -7.974
  830    HH   TYR 101           HH       TYR 101  11.260   2.987  -8.853
  Start of MODEL   13
    1   1H    GLY  -1          1H        GLY  -1  -4.365 -24.063  10.312
    2   2H    GLY  -1          2H        GLY  -1  -2.881 -24.302  10.999
    3   3H    GLY  -1          3H        GLY  -1  -4.199 -24.087  11.958
    4   1HA   GLY  -1          1HA       GLY  -1  -3.088 -22.076  10.125
    5   2HA   GLY  -1          2HA       GLY  -1  -4.462 -21.849  11.220
    6    H    SER   0           H        SER   0  -3.224 -20.043  12.130
    7    HA   SER   0           HA       SER   0  -0.671 -20.184  13.204
    8   1HB   SER   0          1HB       SER   0  -2.952 -18.427  14.200
    9   2HB   SER   0          2HB       SER   0  -1.208 -18.105  14.293
   10    HG   SER   0           HG       SER   0  -1.223 -18.184  11.964
   11    H    MET   1           H        MET   1  -3.696 -20.231  15.195
   12    HA   MET   1           HA       MET   1  -2.513 -22.399  16.854
   13   1HB   MET   1          1HB       MET   1  -3.976 -19.976  18.000
   14   2HB   MET   1          2HB       MET   1  -3.508 -21.437  18.872
   15   1HG   MET   1          1HG       MET   1  -1.867 -19.948  19.469
   16   2HG   MET   1          2HG       MET   1  -1.107 -20.984  18.267
   17   1HE   MET   1          1HE       MET   1  -3.483 -17.719  17.803
   18   2HE   MET   1          2HE       MET   1  -2.187 -16.507  17.832
   19   3HE   MET   1          3HE       MET   1  -2.471 -17.530  19.257
   20    H    LYS   2           H        LYS   2  -4.325 -22.285  14.544
   21    HA   LYS   2           HA       LYS   2  -6.884 -23.258  15.719
   22   1HB   LYS   2          1HB       LYS   2  -6.180 -22.500  12.867
   23   2HB   LYS   2          2HB       LYS   2  -7.780 -22.951  13.489
   24   1HG   LYS   2          1HG       LYS   2  -7.682 -20.975  15.039
   25   2HG   LYS   2          2HG       LYS   2  -6.171 -20.468  14.281
   26   1HD   LYS   2          1HD       LYS   2  -8.847 -20.821  12.863
   27   2HD   LYS   2          2HD       LYS   2  -8.180 -19.277  13.402
   28   1HE   LYS   2          1HE       LYS   2  -6.947 -21.093  11.273
   29   2HE   LYS   2          2HE       LYS   2  -7.856 -19.607  10.991
   30   1HZ   LYS   2          1HZ       LYS   2  -5.543 -19.094  10.954
   31   2HZ   LYS   2          2HZ       LYS   2  -5.327 -19.711  12.509
   32    H    LYS   3           H        LYS   3  -7.163 -25.437  15.740
   33    HA   LYS   3           HA       LYS   3  -5.119 -27.203  14.591
   34   1HB   LYS   3          1HB       LYS   3  -7.581 -27.763  16.293
   35   2HB   LYS   3          2HB       LYS   3  -6.314 -28.935  15.887
   36   1HG   LYS   3          1HG       LYS   3  -4.633 -27.592  17.078
   37   2HG   LYS   3          2HG       LYS   3  -5.857 -26.372  17.480
   38   1HD   LYS   3          1HD       LYS   3  -7.150 -28.078  18.734
   39   2HD   LYS   3          2HD       LYS   3  -5.885 -29.278  18.389
   40   1HE   LYS   3          1HE       LYS   3  -4.221 -27.837  19.567
   41   2HE   LYS   3          2HE       LYS   3  -5.501 -26.657  19.917
   42   1HZ   LYS   3          1HZ       LYS   3  -5.225 -28.101  21.787
   43   2HZ   LYS   3          2HZ       LYS   3  -5.561 -29.457  20.843
   44    H    TRP   4           H        TRP   4  -6.177 -29.360  13.771
   45    HA   TRP   4           HA       TRP   4  -7.430 -30.570  12.380
   46   1HB   TRP   4          1HB       TRP   4  -9.401 -29.256  13.221
   47   2HB   TRP   4          2HB       TRP   4  -9.264 -28.234  11.789
   48    HD1  TRP   4           HD       TRP   4  -9.775 -29.377   9.419
   49    HE1  TRP   4           1HE      TRP   4 -11.213 -31.424   8.767
   50    HE3  TRP   4           3HE      TRP   4 -10.172 -31.615  14.011
   51    HZ2  TRP   4           2HZ      TRP   4 -12.377 -33.691  10.059
   52    HZ3  TRP   4           3HZ      TRP   4 -11.462 -33.711  14.266
   53    HH2  TRP   4           HH       TRP   4 -12.575 -34.752  12.305
   54    H    SER   5           H        SER   5  -6.318 -31.135  10.629
   55    HA   SER   5           HA       SER   5  -5.079 -29.261   8.824
   56   1HB   SER   5          1HB       SER   5  -4.044 -31.401   9.257
   57   2HB   SER   5          2HB       SER   5  -5.489 -32.279   8.715
   58    HG   SER   5           HG       SER   5  -5.089 -31.725   6.669
   59    H    ASP   6           H        ASP   6  -5.862 -28.426   6.922
   60    HA   ASP   6           HA       ASP   6  -8.561 -28.818   6.094
   61   1HB   ASP   6          1HB       ASP   6  -8.044 -27.373   4.282
   62   2HB   ASP   6          2HB       ASP   6  -7.313 -26.714   5.749
   63    HD2  ASP   6           HD       ASP   6  -5.116 -26.889   2.611
   64    H    THR   7           H        THR   7  -5.424 -30.149   5.148
   65    HA   THR   7           HA       THR   7  -4.823 -32.068   4.173
   66    HB   THR   7           HB       THR   7  -7.741 -32.919   4.396
   67    HG1  THR   7           1HG      THR   7  -7.086 -33.643   6.404
   68   1HG2  THR   7          1HG2      THR   7  -6.742 -35.180   4.607
   69   2HG2  THR   7          2HG2      THR   7  -6.440 -34.465   3.020
   70   3HG2  THR   7          3HG2      THR   7  -5.141 -34.506   4.239
   71    H    GLU   8           H        GLU   8  -4.116 -31.200   2.304
   72    HA   GLU   8           HA       GLU   8  -3.898 -30.695   0.140
   73   1HB   GLU   8          1HB       GLU   8  -6.463 -32.274  -0.379
   74   2HB   GLU   8          2HB       GLU   8  -5.377 -31.614  -1.594
   75   1HG   GLU   8          1HG       GLU   8  -4.793 -33.836  -1.465
   76   2HG   GLU   8          2HG       GLU   8  -3.488 -32.953  -0.671
   77    HE2  GLU   8           HE       GLU   8  -3.942 -34.614   2.356
   78    H    VAL   9           H        VAL   9  -5.784 -29.761  -1.772
   79    HA   VAL   9           HA       VAL   9  -6.775 -27.888  -2.430
   80    HB   VAL   9           HB       VAL   9  -7.685 -27.343   0.424
   81   1HG1  VAL   9          1HG1      VAL   9  -8.678 -26.350  -2.281
   82   2HG1  VAL   9          2HG1      VAL   9  -9.405 -25.997  -0.701
   83   3HG1  VAL   9          3HG1      VAL   9  -7.794 -25.380  -1.085
   84   1HG2  VAL   9          1HG2      VAL   9  -9.042 -28.858  -1.852
   85   2HG2  VAL   9          2HG2      VAL   9  -8.520 -29.550  -0.300
   86   3HG2  VAL   9          3HG2      VAL   9  -9.824 -28.357  -0.338
   87    H    PHE  10           H        PHE  10  -4.877 -27.050  -3.094
   88    HA   PHE  10           HA       PHE  10  -3.165 -25.453  -1.296
   89   1HB   PHE  10          1HB       PHE  10  -1.638 -25.425  -3.205
   90   2HB   PHE  10          2HB       PHE  10  -2.065 -27.053  -2.699
   91    HD1  PHE  10           1HD      PHE  10  -3.379 -28.543  -4.150
   92    HD2  PHE  10           2HD      PHE  10  -2.409 -24.524  -5.389
   93    HE1  PHE  10           1HE      PHE  10  -4.023 -29.099  -6.476
   94    HE2  PHE  10           2HE      PHE  10  -3.006 -25.109  -7.725
   95    HZ   PHE  10           HZ       PHE  10  -3.851 -27.382  -8.264
   96    H    GLU  11           H        GLU  11  -5.565 -25.026  -3.847
   97    HA   GLU  11           HA       GLU  11  -4.830 -22.214  -4.278
   98   1HB   GLU  11          1HB       GLU  11  -6.560 -22.207  -5.953
   99   2HB   GLU  11          2HB       GLU  11  -5.298 -23.391  -6.271
  100   1HG   GLU  11          1HG       GLU  11  -7.927 -24.270  -5.000
  101   2HG   GLU  11          2HG       GLU  11  -7.785 -23.953  -6.720
  102    HE2  GLU  11           HE       GLU  11  -6.025 -27.248  -5.220
  103    H    MET  12           H        MET  12  -5.649 -20.679  -3.040
  104    HA   MET  12           HA       MET  12  -8.463 -20.655  -2.348
  105   1HB   MET  12          1HB       MET  12  -7.939 -20.156   0.119
  106   2HB   MET  12          2HB       MET  12  -8.073 -21.822  -0.411
  107   1HG   MET  12          1HG       MET  12  -5.301 -20.642  -0.373
  108   2HG   MET  12          2HG       MET  12  -6.097 -21.002   1.158
  109   1HE   MET  12          1HE       MET  12  -3.304 -22.256   0.101
  110   2HE   MET  12          2HE       MET  12  -3.514 -23.878   0.799
  111   3HE   MET  12          3HE       MET  12  -4.011 -22.442   1.722
  112    H    LEU  13           H        LEU  13  -5.960 -18.837  -0.574
  113    HA   LEU  13           HA       LEU  13  -7.388 -16.473  -0.983
  114   1HB   LEU  13          1HB       LEU  13  -5.702 -15.422   0.315
  115   2HB   LEU  13          2HB       LEU  13  -5.963 -17.050   0.914
  116    HG   LEU  13           HG       LEU  13  -3.845 -17.543  -0.726
  117   1HD1  LEU  13          1HD1      LEU  13  -2.232 -15.665  -0.506
  118   2HD1  LEU  13          2HD1      LEU  13  -3.649 -15.110  -1.406
  119   3HD1  LEU  13          3HD1      LEU  13  -3.466 -14.675   0.299
  120   1HD2  LEU  13          1HD2      LEU  13  -2.435 -17.335   1.290
  121   2HD2  LEU  13          2HD2      LEU  13  -3.721 -16.408   2.094
  122   3HD2  LEU  13          3HD2      LEU  13  -3.987 -18.111   1.647
  123    H    LYS  14           H        LYS  14  -7.162 -14.701  -2.261
  124    HA   LYS  14           HA       LYS  14  -5.427 -14.987  -4.680
  125   1HB   LYS  14          1HB       LYS  14  -7.230 -14.093  -5.965
  126   2HB   LYS  14          2HB       LYS  14  -7.723 -15.522  -5.072
  127   1HG   LYS  14          1HG       LYS  14  -9.491 -14.007  -4.995
  128   2HG   LYS  14          2HG       LYS  14  -8.807 -14.034  -3.357
  129   1HD   LYS  14          1HD       LYS  14  -7.825 -11.841  -3.670
  130   2HD   LYS  14          2HD       LYS  14  -8.132 -11.912  -5.421
  131   1HE   LYS  14          1HE       LYS  14 -10.624 -11.925  -4.808
  132   2HE   LYS  14          2HE       LYS  14 -10.108 -11.704  -3.126
  133   1HZ   LYS  14          1HZ       LYS  14 -10.540  -9.569  -4.168
  134   2HZ   LYS  14          2HZ       LYS  14  -9.334  -9.870  -5.310
  135    H    ARG  15           H        ARG  15  -5.402 -12.802  -5.927
  136    HA   ARG  15           HA       ARG  15  -4.545 -10.679  -4.044
  137   1HB   ARG  15          1HB       ARG  15  -3.188  -9.749  -5.584
  138   2HB   ARG  15          2HB       ARG  15  -2.890 -11.489  -5.522
  139   1HG   ARG  15          1HG       ARG  15  -4.130 -11.736  -7.656
  140   2HG   ARG  15          2HG       ARG  15  -4.402  -9.987  -7.721
  141   1HD   ARG  15          1HD       ARG  15  -2.197  -9.438  -8.062
  142   2HD   ARG  15          2HD       ARG  15  -1.568 -10.943  -7.364
  143    HE   ARG  15           HE       ARG  15  -2.920 -11.847  -9.543
  144   1HH1  ARG  15          2HH1      ARG  15  -0.334  -9.454  -9.098
  145   2HH1  ARG  15          1HH1      ARG  15   0.443  -9.834 -10.612
  146   1HH2  ARG  15          1HH2      ARG  15  -1.895 -12.346 -11.500
  147   2HH2  ARG  15          2HH2      ARG  15  -0.465 -11.479 -12.001
  148    H    MET  16           H        MET  16  -5.627  -8.858  -3.797
  149    HA   MET  16           HA       MET  16  -7.633  -7.775  -5.662
  150   1HB   MET  16          1HB       MET  16  -7.734  -7.263  -3.311
  151   2HB   MET  16          2HB       MET  16  -6.130  -6.523  -3.365
  152   1HG   MET  16          1HG       MET  16  -7.060  -4.812  -4.979
  153   2HG   MET  16          2HG       MET  16  -8.638  -5.602  -4.836
  154   1HE   MET  16          1HE       MET  16  -5.658  -4.476  -2.865
  155   2HE   MET  16          2HE       MET  16  -6.315  -3.632  -1.444
  156   3HE   MET  16          3HE       MET  16  -6.202  -2.805  -3.011
  157    H    TYR  17           H        TYR  17  -7.183  -5.980  -6.919
  158    HA   TYR  17           HA       TYR  17  -4.461  -4.951  -7.169
  159   1HB   TYR  17          1HB       TYR  17  -4.294  -6.569  -8.927
  160   2HB   TYR  17          2HB       TYR  17  -5.936  -6.245  -9.471
  161    HD1  TYR  17           1HD      TYR  17  -3.430  -3.552  -8.707
  162    HD2  TYR  17           2HD      TYR  17  -5.457  -5.822 -11.766
  163    HE1  TYR  17           1HE      TYR  17  -3.089  -1.706 -10.314
  164    HE2  TYR  17           2HE      TYR  17  -4.982  -4.031 -13.403
  165    HH   TYR  17           HH       TYR  17  -4.132  -1.914 -13.727
  166    H    ALA  18           H        ALA  18  -5.317  -3.234  -6.062
  167    HA   ALA  18           HA       ALA  18  -7.540  -1.733  -7.287
  168   1HB   ALA  18          1HB       ALA  18  -7.475  -0.396  -5.300
  169   2HB   ALA  18          2HB       ALA  18  -7.670  -2.124  -4.928
  170   3HB   ALA  18          3HB       ALA  18  -6.082  -1.323  -4.698
  171    H    ARG  19           H        ARG  19  -6.855  -0.599  -8.944
  172    HA   ARG  19           HA       ARG  19  -4.341   0.900  -8.858
  173   1HB   ARG  19          1HB       ARG  19  -5.153  -0.185 -10.972
  174   2HB   ARG  19          2HB       ARG  19  -6.516   0.935 -10.991
  175   1HG   ARG  19          1HG       ARG  19  -4.813   1.779 -12.451
  176   2HG   ARG  19          2HG       ARG  19  -4.857   2.844 -11.036
  177   1HD   ARG  19          1HD       ARG  19  -2.849   1.681 -10.118
  178   2HD   ARG  19          2HD       ARG  19  -2.898   0.559 -11.489
  179    HE   ARG  19           HE       ARG  19  -2.720   3.502 -11.905
  180   1HH1  ARG  19          1HH1      ARG  19  -1.012   0.379 -12.157
  181   2HH1  ARG  19          2HH1      ARG  19   0.333   1.073 -13.020
  182   1HH2  ARG  19          1HH2      ARG  19  -0.954   4.363 -12.975
  183   2HH2  ARG  19          2HH2      ARG  19   0.371   3.350 -13.498
  184    H    VAL  20           H        VAL  20  -4.488   2.557  -7.413
  185    HA   VAL  20           HA       VAL  20  -7.097   3.895  -6.980
  186    HB   VAL  20           HB       VAL  20  -4.586   4.269  -5.365
  187   1HG1  VAL  20          1HG1      VAL  20  -7.536   4.621  -4.685
  188   2HG1  VAL  20          2HG1      VAL  20  -6.149   4.991  -3.648
  189   3HG1  VAL  20          3HG1      VAL  20  -6.438   5.944  -5.104
  190   1HG2  VAL  20          1HG2      VAL  20  -6.774   2.176  -5.051
  191   2HG2  VAL  20          2HG2      VAL  20  -5.037   1.885  -5.299
  192   3HG2  VAL  20          3HG2      VAL  20  -5.601   2.596  -3.786
  193    H    TYR  21           H        TYR  21  -7.577   5.778  -7.866
  194    HA   TYR  21           HA       TYR  21  -5.447   7.445  -9.114
  195   1HB   TYR  21          1HB       TYR  21  -8.447   7.314  -9.557
  196   2HB   TYR  21          2HB       TYR  21  -7.391   8.434 -10.337
  197    HD1  TYR  21           1HD      TYR  21  -6.064   7.777 -12.255
  198    HD2  TYR  21           2HD      TYR  21  -8.176   4.793  -9.970
  199    HE1  TYR  21           1HE      TYR  21  -5.590   6.083 -14.002
  200    HE2  TYR  21           2HE      TYR  21  -7.655   3.103 -11.681
  201    HH   TYR  21           HH       TYR  21  -6.691   2.689 -13.734
  202    H    GLY  22           H        GLY  22  -5.398   9.679  -8.883
  203   1HA   GLY  22          1HA       GLY  22  -6.652  11.699  -8.223
  204   2HA   GLY  22          2HA       GLY  22  -6.963  10.924  -6.662
  205    H    LEU  23           H        LEU  23  -5.936  12.689  -5.609
  206    HA   LEU  23           HA       LEU  23  -3.097  13.152  -6.008
  207   1HB   LEU  23          1HB       LEU  23  -4.904  14.825  -5.330
  208   2HB   LEU  23          2HB       LEU  23  -4.799  14.109  -3.715
  209    HG   LEU  23           HG       LEU  23  -2.272  14.716  -3.821
  210   1HD1  LEU  23          1HD1      LEU  23  -1.710  16.582  -5.365
  211   2HD1  LEU  23          2HD1      LEU  23  -2.005  15.069  -6.224
  212   3HD1  LEU  23          3HD1      LEU  23  -3.252  16.334  -6.207
  213   1HD2  LEU  23          1HD2      LEU  23  -2.707  17.038  -3.175
  214   2HD2  LEU  23          2HD2      LEU  23  -4.317  16.967  -3.923
  215   3HD2  LEU  23          3HD2      LEU  23  -3.949  15.969  -2.499
  216    H    VAL  24           H        VAL  24  -4.300  10.440  -5.074
  217    HA   VAL  24           HA       VAL  24  -3.129   9.871  -2.508
  218    HB   VAL  24           HB       VAL  24  -3.351   7.511  -3.212
  219   1HG1  VAL  24          1HG1      VAL  24  -5.818   9.211  -3.748
  220   2HG1  VAL  24          2HG1      VAL  24  -5.798   7.494  -3.306
  221   3HG1  VAL  24          3HG1      VAL  24  -5.225   8.704  -2.153
  222   1HG2  VAL  24          1HG2      VAL  24  -4.539   8.579  -5.815
  223   2HG2  VAL  24          2HG2      VAL  24  -2.922   7.859  -5.681
  224   3HG2  VAL  24          3HG2      VAL  24  -4.356   6.897  -5.304
  225    H    GLN  25           H        GLN  25  -1.760  10.337  -5.682
  226    HA   GLN  25           HA       GLN  25   0.821   9.136  -5.103
  227   1HB   GLN  25          1HB       GLN  25  -0.455  10.432  -7.353
  228   2HB   GLN  25          2HB       GLN  25   1.025  11.304  -6.962
  229   1HG   GLN  25          1HG       GLN  25   1.606   9.608  -8.488
  230   2HG   GLN  25          2HG       GLN  25   2.282   9.136  -6.932
  231   1HE2  GLN  25          1HE2      GLN  25   2.171   7.206  -8.760
  232   2HE2  GLN  25          2HE2      GLN  25   0.837   6.102  -8.528
  233    H    GLY  26           H        GLY  26   2.586  10.125  -4.142
  234   1HA   GLY  26          1HA       GLY  26   3.866  11.752  -3.153
  235   2HA   GLY  26          2HA       GLY  26   2.655  12.974  -3.551
  236    H    VAL  27           H        VAL  27   0.454  12.512  -2.304
  237    HA   VAL  27           HA       VAL  27   0.895  12.780   0.523
  238    HB   VAL  27           HB       VAL  27  -1.666  12.156  -0.995
  239   1HG1  VAL  27          1HG1      VAL  27  -1.198  13.378   1.762
  240   2HG1  VAL  27          2HG1      VAL  27  -2.755  13.388   0.916
  241   3HG1  VAL  27          3HG1      VAL  27  -2.042  11.854   1.398
  242   1HG2  VAL  27          1HG2      VAL  27  -0.461  14.862  -0.269
  243   2HG2  VAL  27          2HG2      VAL  27  -0.639  14.213  -1.913
  244   3HG2  VAL  27          3HG2      VAL  27  -2.072  14.603  -0.967
  245    H    GLY  28           H        GLY  28   0.047  11.278   2.182
  246   1HA   GLY  28          1HA       GLY  28   1.219   8.770   2.030
  247   2HA   GLY  28          2HA       GLY  28   0.025   9.259   3.236
  248    H    PHE  29           H        PHE  29  -2.134   8.602   2.986
  249    HA   PHE  29           HA       PHE  29  -3.847   7.259   2.548
  250   1HB   PHE  29          1HB       PHE  29  -3.989   8.599   0.550
  251   2HB   PHE  29          2HB       PHE  29  -2.878   7.543  -0.313
  252    HD1  PHE  29           1HD      PHE  29  -6.343   7.999   0.814
  253    HD2  PHE  29           2HD      PHE  29  -3.551   5.209  -0.930
  254    HE1  PHE  29           1HE      PHE  29  -8.226   6.593   0.012
  255    HE2  PHE  29           2HE      PHE  29  -5.430   3.726  -1.551
  256    HZ   PHE  29           HZ       PHE  29  -7.768   4.486  -1.213
  257    H    ARG  30           H        ARG  30  -1.345   5.951   0.392
  258    HA   ARG  30           HA       ARG  30  -1.488   3.266   0.426
  259   1HB   ARG  30          1HB       ARG  30   0.893   5.080   0.994
  260   2HB   ARG  30          2HB       ARG  30   1.047   3.375   0.553
  261   1HG   ARG  30          1HG       ARG  30   0.174   3.717  -1.612
  262   2HG   ARG  30          2HG       ARG  30  -0.405   5.354  -1.274
  263   1HD   ARG  30          1HD       ARG  30   2.530   4.571  -1.124
  264   2HD   ARG  30          2HD       ARG  30   1.753   5.225  -2.580
  265    HE   ARG  30           HE       ARG  30   1.069   7.074  -0.701
  266   1HH1  ARG  30          1HH1      ARG  30   4.215   5.721  -1.684
  267   2HH1  ARG  30          2HH1      ARG  30   5.065   7.222  -1.467
  268   1HH2  ARG  30          1HH2      ARG  30   2.182   9.056  -0.541
  269   2HH2  ARG  30          2HH2      ARG  30   3.908   9.128  -0.773
  270    H    LYS  31           H        LYS  31  -0.423   5.282   3.198
  271    HA   LYS  31           HA       LYS  31   0.586   3.036   4.674
  272   1HB   LYS  31          1HB       LYS  31   1.085   5.711   4.757
  273   2HB   LYS  31          2HB       LYS  31  -0.075   5.612   6.083
  274   1HG   LYS  31          1HG       LYS  31   2.496   3.980   5.797
  275   2HG   LYS  31          2HG       LYS  31   2.302   5.436   6.777
  276   1HD   LYS  31          1HD       LYS  31   0.563   4.272   8.147
  277   2HD   LYS  31          2HD       LYS  31   0.873   2.784   7.222
  278   1HE   LYS  31          1HE       LYS  31   3.232   2.797   7.934
  279   2HE   LYS  31          2HE       LYS  31   2.955   4.287   8.862
  280   1HZ   LYS  31          1HZ       LYS  31   2.755   2.395  10.306
  281   2HZ   LYS  31          2HZ       LYS  31   1.507   1.763   9.357
  282    H    PHE  32           H        PHE  32  -2.367   5.134   4.939
  283    HA   PHE  32           HA       PHE  32  -3.651   3.883   7.007
  284   1HB   PHE  32          1HB       PHE  32  -4.378   5.908   5.847
  285   2HB   PHE  32          2HB       PHE  32  -4.943   4.954   4.484
  286    HD1  PHE  32           1HD      PHE  32  -7.044   6.357   4.911
  287    HD2  PHE  32           2HD      PHE  32  -5.711   3.305   7.680
  288    HE1  PHE  32           1HE      PHE  32  -9.299   6.217   5.904
  289    HE2  PHE  32           2HE      PHE  32  -7.950   3.181   8.624
  290    HZ   PHE  32           HZ       PHE  32  -9.750   4.691   7.804
  291    H    VAL  33           H        VAL  33  -3.653   2.958   3.548
  292    HA   VAL  33           HA       VAL  33  -5.375   0.644   3.741
  293    HB   VAL  33           HB       VAL  33  -3.127   1.273   1.766
  294   1HG1  VAL  33          1HG1      VAL  33  -5.416  -0.738   1.638
  295   2HG1  VAL  33          2HG1      VAL  33  -4.393  -0.281   0.266
  296   3HG1  VAL  33          3HG1      VAL  33  -3.673  -1.102   1.657
  297   1HG2  VAL  33          1HG2      VAL  33  -6.115   1.728   1.462
  298   2HG2  VAL  33          2HG2      VAL  33  -4.922   3.017   1.728
  299   3HG2  VAL  33          3HG2      VAL  33  -4.866   2.050   0.249
  300    H    GLN  34           H        GLN  34  -1.982   1.228   4.388
  301    HA   GLN  34           HA       GLN  34  -1.306  -1.540   4.565
  302   1HB   GLN  34          1HB       GLN  34   0.215   0.726   4.314
  303   2HB   GLN  34          2HB       GLN  34   0.345   0.517   6.061
  304   1HG   GLN  34          1HG       GLN  34   2.196  -0.550   4.807
  305   2HG   GLN  34          2HG       GLN  34   1.262  -1.726   5.737
  306   1HE2  GLN  34          1HE2      GLN  34   1.194  -0.140   2.492
  307   2HE2  GLN  34          2HE2      GLN  34   0.802  -1.600   1.595
  308    H    ILE  35           H        ILE  35  -1.989   0.873   7.160
  309    HA   ILE  35           HA       ILE  35  -1.675  -0.700   9.364
  310    HB   ILE  35           HB       ILE  35  -4.084   1.097   8.799
  311   1HG1  ILE  35          1HG1      ILE  35  -1.983   2.345   8.602
  312   2HG1  ILE  35          2HG1      ILE  35  -2.943   2.852   9.984
  313   1HG2  ILE  35          1HG2      ILE  35  -4.216   1.306  11.309
  314   2HG2  ILE  35          2HG2      ILE  35  -4.686  -0.270  10.686
  315   3HG2  ILE  35          3HG2      ILE  35  -3.095  -0.066  11.429
  316   1HD1  ILE  35          1HD1      ILE  35  -0.601   2.768  10.579
  317   2HD1  ILE  35          2HD1      ILE  35  -1.463   1.528  11.496
  318   3HD1  ILE  35          3HD1      ILE  35  -0.476   1.069  10.087
  319    H    HIS  36           H        HIS  36  -4.707  -0.765   7.406
  320    HA   HIS  36           HA       HIS  36  -5.905  -2.798   9.073
  321   1HB   HIS  36          1HB       HIS  36  -6.567  -1.619   6.362
  322   2HB   HIS  36          2HB       HIS  36  -7.435  -3.019   7.003
  323    HD2  HIS  36           2HD      HIS  36  -6.547   0.378   8.950
  324    HE1  HIS  36           1HE      HIS  36 -10.670  -0.499   9.272
  325    HE2  HIS  36           2HE      HIS  36  -8.823   1.120   9.974
  326    H    ALA  37           H        ALA  37  -4.373  -2.933   5.806
  327    HA   ALA  37           HA       ALA  37  -4.471  -5.597   5.326
  328   1HB   ALA  37          1HB       ALA  37  -2.430  -5.303   4.010
  329   2HB   ALA  37          2HB       ALA  37  -3.544  -3.946   3.791
  330   3HB   ALA  37          3HB       ALA  37  -2.102  -3.767   4.809
  331    H    ILE  38           H        ILE  38  -1.965  -4.002   7.264
  332    HA   ILE  38           HA       ILE  38  -0.421  -6.377   7.858
  333    HB   ILE  38           HB       ILE  38  -0.428  -3.445   8.569
  334   1HG1  ILE  38          1HG1      ILE  38   1.901  -3.585   7.935
  335   2HG1  ILE  38          2HG1      ILE  38   1.871  -5.354   7.944
  336   1HG2  ILE  38          1HG2      ILE  38   1.260  -3.659  10.293
  337   2HG2  ILE  38          2HG2      ILE  38  -0.312  -4.270  10.805
  338   3HG2  ILE  38          3HG2      ILE  38   0.982  -5.417  10.362
  339   1HD1  ILE  38          1HD1      ILE  38   1.809  -4.262   5.664
  340   2HD1  ILE  38          2HD1      ILE  38   0.500  -5.418   5.939
  341   3HD1  ILE  38          3HD1      ILE  38   0.180  -3.682   6.049
  342    H    ARG  39           H        ARG  39  -2.834  -4.446   9.686
  343    HA   ARG  39           HA       ARG  39  -2.947  -5.870  11.989
  344   1HB   ARG  39          1HB       ARG  39  -4.089  -3.814  11.396
  345   2HB   ARG  39          2HB       ARG  39  -5.355  -4.726  10.567
  346   1HG   ARG  39          1HG       ARG  39  -4.608  -5.359  13.425
  347   2HG   ARG  39          2HG       ARG  39  -5.520  -3.884  13.062
  348   1HD   ARG  39          1HD       ARG  39  -7.306  -5.135  12.009
  349   2HD   ARG  39          2HD       ARG  39  -6.417  -6.658  12.218
  350    HE   ARG  39           HE       ARG  39  -6.798  -5.243  14.714
  351   1HH1  ARG  39          1HH1      ARG  39  -8.425  -7.430  12.435
  352   2HH1  ARG  39          2HH1      ARG  39  -9.444  -8.143  13.658
  353   1HH2  ARG  39          1HH2      ARG  39  -8.148  -6.178  16.299
  354   2HH2  ARG  39          2HH2      ARG  39  -9.291  -7.421  15.865
  355    H    LEU  40           H        LEU  40  -4.464  -6.648   8.890
  356    HA   LEU  40           HA       LEU  40  -5.798  -9.080   9.873
  357   1HB   LEU  40          1HB       LEU  40  -5.799  -7.645   7.222
  358   2HB   LEU  40          2HB       LEU  40  -6.826  -9.029   7.620
  359    HG   LEU  40           HG       LEU  40  -6.875  -6.462   9.287
  360   1HD1  LEU  40          1HD1      LEU  40  -8.779  -5.773   7.990
  361   2HD1  LEU  40          2HD1      LEU  40  -7.360  -5.937   6.942
  362   3HD1  LEU  40          3HD1      LEU  40  -8.611  -7.200   6.924
  363   1HD2  LEU  40          1HD2      LEU  40  -9.112  -7.290   9.915
  364   2HD2  LEU  40          2HD2      LEU  40  -8.840  -8.767   8.963
  365   3HD2  LEU  40          3HD2      LEU  40  -7.851  -8.428  10.399
  366    H    GLY  41           H        GLY  41  -2.645  -8.557   8.883
  367   1HA   GLY  41          1HA       GLY  41  -1.006  -9.973   8.197
  368   2HA   GLY  41          2HA       GLY  41  -2.119 -11.317   8.487
  369    H    ILE  42           H        ILE  42  -1.710  -8.612   6.157
  370    HA   ILE  42           HA       ILE  42  -2.385 -10.405   3.871
  371    HB   ILE  42           HB       ILE  42  -2.788  -7.446   4.322
  372   1HG1  ILE  42          1HG1      ILE  42  -4.405  -8.822   5.552
  373   2HG1  ILE  42          2HG1      ILE  42  -5.142  -7.841   4.275
  374   1HG2  ILE  42          1HG2      ILE  42  -4.056  -7.394   2.239
  375   2HG2  ILE  42          2HG2      ILE  42  -2.351  -7.743   1.967
  376   3HG2  ILE  42          3HG2      ILE  42  -3.538  -9.046   1.869
  377   1HD1  ILE  42          1HD1      ILE  42  -6.117 -10.101   4.441
  378   2HD1  ILE  42          2HD1      ILE  42  -5.410  -9.768   2.855
  379   3HD1  ILE  42          3HD1      ILE  42  -4.555 -10.820   4.016
  380    H    LYS  43           H        LYS  43  -1.124 -10.290   2.076
  381    HA   LYS  43           HA       LYS  43   1.610  -9.104   2.372
  382   1HB   LYS  43          1HB       LYS  43   0.747 -11.201   0.394
  383   2HB   LYS  43          2HB       LYS  43   2.361 -10.653   0.824
  384   1HG   LYS  43          1HG       LYS  43   1.972 -11.453   3.170
  385   2HG   LYS  43          2HG       LYS  43   0.442 -12.171   2.659
  386   1HD   LYS  43          1HD       LYS  43   1.408 -13.935   1.646
  387   2HD   LYS  43          2HD       LYS  43   2.690 -12.976   0.906
  388   1HE   LYS  43          1HE       LYS  43   2.647 -13.798   3.843
  389   2HE   LYS  43          2HE       LYS  43   3.529 -14.661   2.566
  390   1HZ   LYS  43          1HZ       LYS  43   4.959 -13.073   3.690
  391   2HZ   LYS  43          2HZ       LYS  43   3.991 -11.806   3.142
  392    H    GLY  44           H        GLY  44   2.512  -8.294   0.124
  393   1HA   GLY  44          1HA       GLY  44   1.310  -7.935  -2.224
  394   2HA   GLY  44          2HA       GLY  44   0.416  -6.728  -1.271
  395    H    TYR  45           H        TYR  45   1.098  -4.932  -2.278
  396    HA   TYR  45           HA       TYR  45   3.308  -3.697  -1.157
  397   1HB   TYR  45          1HB       TYR  45   4.329  -5.172  -3.211
  398   2HB   TYR  45          2HB       TYR  45   3.931  -3.697  -4.049
  399    HD1  TYR  45           1HD      TYR  45   5.261  -1.684  -3.717
  400    HD2  TYR  45           2HD      TYR  45   5.960  -5.216  -1.342
  401    HE1  TYR  45           1HE      TYR  45   7.467  -0.792  -3.000
  402    HE2  TYR  45           2HE      TYR  45   8.128  -4.285  -0.603
  403    HH   TYR  45           HH       TYR  45   9.462  -2.393  -0.508
  404    H    ALA  46           H        ALA  46   3.062  -1.505  -1.366
  405    HA   ALA  46           HA       ALA  46   0.744  -0.520  -2.969
  406   1HB   ALA  46          1HB       ALA  46   0.754   1.396  -1.491
  407   2HB   ALA  46          2HB       ALA  46   0.675  -0.118  -0.571
  408   3HB   ALA  46          3HB       ALA  46   2.180   0.801  -0.645
  409    H    LYS  47           H        LYS  47   1.874  -0.581  -4.988
  410    HA   LYS  47           HA       LYS  47   4.435   0.780  -5.148
  411   1HB   LYS  47          1HB       LYS  47   4.332  -1.460  -5.938
  412   2HB   LYS  47          2HB       LYS  47   2.989  -1.041  -7.011
  413   1HG   LYS  47          1HG       LYS  47   4.425   0.284  -8.433
  414   2HG   LYS  47          2HG       LYS  47   5.680   0.353  -7.190
  415   1HD   LYS  47          1HD       LYS  47   6.387  -1.084  -8.962
  416   2HD   LYS  47          2HD       LYS  47   6.182  -2.037  -7.493
  417   1HE   LYS  47          1HE       LYS  47   3.992  -1.861  -9.616
  418   2HE   LYS  47          2HE       LYS  47   5.346  -2.997  -9.757
  419   1HZ   LYS  47          1HZ       LYS  47   3.566  -4.099  -8.664
  420   2HZ   LYS  47          2HZ       LYS  47   3.519  -2.936  -7.447
  421    H    ASN  48           H        ASN  48   4.067   2.921  -5.176
  422    HA   ASN  48           HA       ASN  48   2.214   4.150  -6.993
  423   1HB   ASN  48          1HB       ASN  48   3.060   6.175  -5.820
  424   2HB   ASN  48          2HB       ASN  48   2.226   4.994  -4.817
  425   1HD2  ASN  48          2HD2      ASN  48   3.541   3.572  -3.391
  426   2HD2  ASN  48          1HD2      ASN  48   5.069   4.200  -2.802
  427    H    LEU  49           H        LEU  49   2.969   3.832  -9.032
  428    HA   LEU  49           HA       LEU  49   5.618   4.478  -9.973
  429   1HB   LEU  49          1HB       LEU  49   2.975   4.320 -11.474
  430   2HB   LEU  49          2HB       LEU  49   4.602   4.342 -12.145
  431    HG   LEU  49           HG       LEU  49   4.762   2.183 -10.409
  432   1HD1  LEU  49          1HD1      LEU  49   2.753   0.811 -10.740
  433   2HD1  LEU  49          2HD1      LEU  49   2.265   2.318  -9.963
  434   3HD1  LEU  49          3HD1      LEU  49   1.992   2.096 -11.695
  435   1HD2  LEU  49          1HD2      LEU  49   4.594   0.781 -12.419
  436   2HD2  LEU  49          2HD2      LEU  49   3.867   2.127 -13.321
  437   3HD2  LEU  49          3HD2      LEU  49   5.546   2.240 -12.746
  438    HA   PRO  50           HA       PRO  50   4.267   8.613  -8.896
  439   1HB   PRO  50          1HB       PRO  50   6.590   9.981  -8.865
  440   2HB   PRO  50          2HB       PRO  50   6.304   8.584  -7.795
  441   1HG   PRO  50          1HG       PRO  50   7.721   8.536 -10.484
  442   2HG   PRO  50          2HG       PRO  50   8.349   7.949  -8.915
  443   1HD   PRO  50          1HD       PRO  50   7.099   6.262 -10.676
  444   2HD   PRO  50          2HD       PRO  50   6.873   6.107  -8.913
  445    H    ASP  51           H        ASP  51   3.157   8.305 -11.147
  446    HA   ASP  51           HA       ASP  51   3.344  10.776 -12.620
  447   1HB   ASP  51          1HB       ASP  51   3.870   9.754 -14.807
  448   2HB   ASP  51          2HB       ASP  51   5.220   9.600 -13.694
  449    HD2  ASP  51           HD       ASP  51   3.791   6.358 -15.395
  450    H    GLY  52           H        GLY  52   1.334   9.500 -11.020
  451   1HA   GLY  52          1HA       GLY  52  -0.961   9.917 -12.275
  452   2HA   GLY  52          2HA       GLY  52  -0.604   8.296 -12.899
  453    H    SER  53           H        SER  53  -0.997   6.553 -11.670
  454    HA   SER  53           HA       SER  53  -2.428   6.991  -9.088
  455   1HB   SER  53          1HB       SER  53  -3.752   4.949 -10.023
  456   2HB   SER  53          2HB       SER  53  -4.051   6.558 -10.706
  457    HG   SER  53           HG       SER  53  -2.861   6.056 -12.467
  458    H    VAL  54           H        VAL  54  -2.259   5.455  -7.495
  459    HA   VAL  54           HA       VAL  54   0.198   3.850  -7.607
  460    HB   VAL  54           HB       VAL  54   0.078   5.238  -5.712
  461   1HG1  VAL  54          1HG1      VAL  54  -2.495   3.918  -4.796
  462   2HG1  VAL  54          2HG1      VAL  54  -1.588   5.206  -3.991
  463   3HG1  VAL  54          3HG1      VAL  54  -2.408   5.545  -5.518
  464   1HG2  VAL  54          1HG2      VAL  54  -0.632   2.415  -4.766
  465   2HG2  VAL  54          2HG2      VAL  54   0.941   2.884  -5.406
  466   3HG2  VAL  54          3HG2      VAL  54   0.347   3.615  -3.914
  467    H    GLU  55           H        GLU  55   0.288   1.772  -7.916
  468    HA   GLU  55           HA       GLU  55  -2.191   0.210  -8.130
  469   1HB   GLU  55          1HB       GLU  55  -0.591   0.073  -9.925
  470   2HB   GLU  55          2HB       GLU  55   0.752  -0.253  -8.832
  471   1HG   GLU  55          1HG       GLU  55  -1.419  -2.252  -8.593
  472   2HG   GLU  55          2HG       GLU  55  -0.753  -2.129 -10.228
  473    HE2  GLU  55           HE       GLU  55   2.075  -3.884  -9.504
  474    H    VAL  56           H        VAL  56  -2.906  -0.750  -6.300
  475    HA   VAL  56           HA       VAL  56  -0.957  -1.693  -4.230
  476    HB   VAL  56           HB       VAL  56  -3.904  -1.066  -3.917
  477   1HG1  VAL  56          1HG1      VAL  56  -1.668  -1.643  -1.915
  478   2HG1  VAL  56          2HG1      VAL  56  -3.327  -1.181  -1.500
  479   3HG1  VAL  56          3HG1      VAL  56  -3.025  -2.727  -2.297
  480   1HG2  VAL  56          1HG2      VAL  56  -1.452   0.595  -3.169
  481   2HG2  VAL  56          2HG2      VAL  56  -2.698   1.035  -4.359
  482   3HG2  VAL  56          3HG2      VAL  56  -3.114   0.934  -2.644
  483    H    VAL  57           H        VAL  57  -0.709  -3.873  -4.142
  484    HA   VAL  57           HA       VAL  57  -2.878  -5.608  -5.246
  485    HB   VAL  57           HB       VAL  57  -1.013  -7.189  -5.831
  486   1HG1  VAL  57          1HG1      VAL  57  -1.147  -4.489  -7.216
  487   2HG1  VAL  57          2HG1      VAL  57  -0.443  -5.962  -7.910
  488   3HG1  VAL  57          3HG1      VAL  57  -2.170  -5.901  -7.525
  489   1HG2  VAL  57          1HG2      VAL  57   0.776  -4.730  -5.487
  490   2HG2  VAL  57          2HG2      VAL  57   0.822  -6.166  -4.445
  491   3HG2  VAL  57          3HG2      VAL  57   1.229  -6.299  -6.160
  492    H    ALA  58           H        ALA  58  -3.716  -5.376  -3.026
  493    HA   ALA  58           HA       ALA  58  -2.313  -6.627  -0.852
  494   1HB   ALA  58          1HB       ALA  58  -4.402  -6.251   0.376
  495   2HB   ALA  58          2HB       ALA  58  -4.016  -4.817  -0.597
  496   3HB   ALA  58          3HB       ALA  58  -5.276  -5.957  -1.127
  497    H    GLU  59           H        GLU  59  -2.286  -8.809  -0.317
  498    HA   GLU  59           HA       GLU  59  -3.841 -10.648  -2.016
  499   1HB   GLU  59          1HB       GLU  59  -1.263 -11.153  -0.581
  500   2HB   GLU  59          2HB       GLU  59  -2.093 -12.193  -1.749
  501   1HG   GLU  59          1HG       GLU  59  -1.903 -10.253  -3.420
  502   2HG   GLU  59          2HG       GLU  59  -0.853  -9.469  -2.236
  503    HE2  GLU  59           HE       GLU  59   0.628 -12.239  -4.651
  504    H    GLY  60           H        GLY  60  -5.705 -11.444  -0.841
  505   1HA   GLY  60          1HA       GLY  60  -5.077 -12.956   1.600
  506   2HA   GLY  60          2HA       GLY  60  -6.163 -11.569   1.819
  507    H    TYR  61           H        TYR  61  -7.032 -13.907   2.565
  508    HA   TYR  61           HA       TYR  61  -8.754 -15.256   0.699
  509   1HB   TYR  61          1HB       TYR  61  -8.685 -14.883   3.713
  510   2HB   TYR  61          2HB       TYR  61  -9.870 -15.904   2.911
  511    HD1  TYR  61           1HD      TYR  61  -9.291 -18.132   2.141
  512    HD2  TYR  61           2HD      TYR  61  -6.326 -15.513   3.859
  513    HE1  TYR  61           1HE      TYR  61  -7.811 -20.072   2.560
  514    HE2  TYR  61           2HE      TYR  61  -4.850 -17.453   4.268
  515    HH   TYR  61           HH       TYR  61  -4.584 -19.720   4.083
  516    H    GLU  62           H        GLU  62 -11.208 -15.118   1.217
  517    HA   GLU  62           HA       GLU  62 -11.985 -12.334   0.715
  518   1HB   GLU  62          1HB       GLU  62 -13.611 -14.883   0.682
  519   2HB   GLU  62          2HB       GLU  62 -14.180 -13.255   0.256
  520   1HG   GLU  62          1HG       GLU  62 -13.724 -14.374  -1.808
  521   2HG   GLU  62          2HG       GLU  62 -12.487 -13.134  -1.575
  522    HE2  GLU  62           HE       GLU  62 -11.513 -17.075  -1.585
  523    H    GLU  63           H        GLU  63 -11.778 -14.399   3.434
  524    HA   GLU  63           HA       GLU  63 -13.920 -13.254   5.014
  525   1HB   GLU  63          1HB       GLU  63 -11.347 -14.733   5.775
  526   2HB   GLU  63          2HB       GLU  63 -12.739 -14.441   6.830
  527   1HG   GLU  63          1HG       GLU  63 -14.153 -15.846   5.318
  528   2HG   GLU  63          2HG       GLU  63 -12.734 -16.164   4.305
  529    HE2  GLU  63           HE       GLU  63 -13.135 -18.050   7.847
  530    H    ALA  64           H        ALA  64 -10.584 -12.446   4.191
  531    HA   ALA  64           HA       ALA  64 -10.659 -10.076   6.014
  532   1HB   ALA  64          1HB       ALA  64  -8.219 -10.163   5.875
  533   2HB   ALA  64          2HB       ALA  64  -8.852 -11.717   6.453
  534   3HB   ALA  64          3HB       ALA  64  -8.307 -11.554   4.770
  535    H    LEU  65           H        LEU  65 -11.278 -10.888   2.767
  536    HA   LEU  65           HA       LEU  65  -9.798  -8.730   1.501
  537   1HB   LEU  65          1HB       LEU  65 -10.588 -10.686   0.237
  538   2HB   LEU  65          2HB       LEU  65 -12.268 -10.168   0.550
  539    HG   LEU  65           HG       LEU  65 -11.632  -7.977  -0.564
  540   1HD1  LEU  65          1HD1      LEU  65  -9.732  -8.155  -2.213
  541   2HD1  LEU  65          2HD1      LEU  65  -9.150  -8.152  -0.547
  542   3HD1  LEU  65          3HD1      LEU  65  -9.235  -9.676  -1.449
  543   1HD2  LEU  65          1HD2      LEU  65 -11.938  -8.974  -2.799
  544   2HD2  LEU  65          2HD2      LEU  65 -11.640 -10.582  -2.076
  545   3HD2  LEU  65          3HD2      LEU  65 -13.041  -9.625  -1.568
  546    H    SER  66           H        SER  66 -13.309  -9.174   2.002
  547    HA   SER  66           HA       SER  66 -14.299  -6.674   1.665
  548   1HB   SER  66          1HB       SER  66 -16.083  -7.318   3.238
  549   2HB   SER  66          2HB       SER  66 -15.651  -8.636   2.136
  550    HG   SER  66           HG       SER  66 -14.418  -9.559   3.801
  551    H    LYS  67           H        LYS  67 -12.860  -7.787   4.773
  552    HA   LYS  67           HA       LYS  67 -13.178  -5.465   6.276
  553   1HB   LYS  67          1HB       LYS  67 -11.049  -7.615   6.224
  554   2HB   LYS  67          2HB       LYS  67 -10.940  -6.243   7.330
  555   1HG   LYS  67          1HG       LYS  67 -11.945  -8.165   8.410
  556   2HG   LYS  67          2HG       LYS  67 -13.043  -6.777   8.385
  557   1HD   LYS  67          1HD       LYS  67 -14.392  -7.768   6.644
  558   2HD   LYS  67          2HD       LYS  67 -13.181  -9.036   6.357
  559   1HE   LYS  67          1HE       LYS  67 -13.591  -9.919   8.654
  560   2HE   LYS  67          2HE       LYS  67 -14.820  -8.658   8.902
  561   1HZ   LYS  67          1HZ       LYS  67 -15.877 -10.665   8.169
  562   2HZ   LYS  67          2HZ       LYS  67 -14.945 -10.687   6.762
  563    H    LEU  68           H        LEU  68 -10.425  -6.257   4.088
  564    HA   LEU  68           HA       LEU  68  -9.059  -3.740   4.498
  565   1HB   LEU  68          1HB       LEU  68  -7.976  -5.912   4.168
  566   2HB   LEU  68          2HB       LEU  68  -8.688  -6.080   2.573
  567    HG   LEU  68           HG       LEU  68  -6.238  -5.486   2.849
  568   1HD1  LEU  68          1HD1      LEU  68  -6.099  -4.239   0.819
  569   2HD1  LEU  68          2HD1      LEU  68  -7.369  -5.469   0.681
  570   3HD1  LEU  68          3HD1      LEU  68  -7.798  -3.756   0.912
  571   1HD2  LEU  68          1HD2      LEU  68  -5.578  -3.166   2.941
  572   2HD2  LEU  68          2HD2      LEU  68  -7.236  -2.629   3.175
  573   3HD2  LEU  68          3HD2      LEU  68  -6.442  -3.607   4.429
  574    H    LEU  69           H        LEU  69 -11.571  -4.877   2.312
  575    HA   LEU  69           HA       LEU  69 -11.077  -2.770   0.359
  576   1HB   LEU  69          1HB       LEU  69 -12.865  -5.154   0.642
  577   2HB   LEU  69          2HB       LEU  69 -13.537  -3.838  -0.292
  578    HG   LEU  69           HG       LEU  69 -12.356  -5.572  -1.615
  579   1HD1  LEU  69          1HD1      LEU  69 -11.187  -4.025  -3.119
  580   2HD1  LEU  69          2HD1      LEU  69 -12.691  -3.308  -2.521
  581   3HD1  LEU  69          3HD1      LEU  69 -11.134  -2.781  -1.863
  582   1HD2  LEU  69          1HD2      LEU  69  -9.994  -5.783  -1.643
  583   2HD2  LEU  69          2HD2      LEU  69  -9.760  -4.431  -0.510
  584   3HD2  LEU  69          3HD2      LEU  69 -10.483  -5.950   0.036
  585    H    GLU  70           H        GLU  70 -13.842  -3.590   2.455
  586    HA   GLU  70           HA       GLU  70 -15.388  -1.322   2.251
  587   1HB   GLU  70          1HB       GLU  70 -14.854  -3.138   4.630
  588   2HB   GLU  70          2HB       GLU  70 -16.129  -1.914   4.603
  589   1HG   GLU  70          1HG       GLU  70 -17.214  -2.953   2.698
  590   2HG   GLU  70          2HG       GLU  70 -15.950  -4.177   2.563
  591    HE2  GLU  70           HE       GLU  70 -16.972  -5.790   5.622
  592    H    ARG  71           H        ARG  71 -12.670  -1.863   4.514
  593    HA   ARG  71           HA       ARG  71 -12.201   0.423   5.915
  594   1HB   ARG  71          1HB       ARG  71 -10.604  -1.196   6.035
  595   2HB   ARG  71          2HB       ARG  71 -10.527  -1.427   4.298
  596   1HG   ARG  71          1HG       ARG  71  -8.473  -0.530   5.247
  597   2HG   ARG  71          2HG       ARG  71  -9.126   0.431   3.943
  598   1HD   ARG  71          1HD       ARG  71 -10.011   1.326   6.635
  599   2HD   ARG  71          2HD       ARG  71  -8.271   1.369   6.420
  600    HE   ARG  71           HE       ARG  71 -10.211   3.141   5.284
  601   1HH1  ARG  71          1HH1      ARG  71  -7.157   1.592   4.369
  602   2HH1  ARG  71          2HH1      ARG  71  -6.737   2.837   3.217
  603   1HH2  ARG  71          1HH2      ARG  71  -9.638   4.754   3.785
  604   2HH2  ARG  71          2HH2      ARG  71  -8.162   4.618   2.865
  605    H    ILE  72           H        ILE  72 -11.524   0.142   2.370
  606    HA   ILE  72           HA       ILE  72 -10.445   2.804   2.390
  607    HB   ILE  72           HB       ILE  72 -10.992   1.059  -0.022
  608   1HG1  ILE  72          1HG1      ILE  72  -8.357   1.323   1.493
  609   2HG1  ILE  72          2HG1      ILE  72  -9.485   0.020   1.823
  610   1HG2  ILE  72          1HG2      ILE  72  -9.185   2.475  -1.022
  611   2HG2  ILE  72          2HG2      ILE  72 -10.547   3.470  -0.498
  612   3HG2  ILE  72          3HG2      ILE  72  -9.080   3.387   0.498
  613   1HD1  ILE  72          1HD1      ILE  72  -7.911  -0.846   0.271
  614   2HD1  ILE  72          2HD1      ILE  72  -9.475  -0.693  -0.542
  615   3HD1  ILE  72          3HD1      ILE  72  -8.187   0.487  -0.868
  616    H    LYS  73           H        LYS  73 -13.010   1.600   0.214
  617    HA   LYS  73           HA       LYS  73 -14.143   3.944  -0.489
  618   1HB   LYS  73          1HB       LYS  73 -16.227   2.633  -0.833
  619   2HB   LYS  73          2HB       LYS  73 -14.730   1.998  -1.501
  620   1HG   LYS  73          1HG       LYS  73 -14.668   0.498   0.723
  621   2HG   LYS  73          2HG       LYS  73 -16.376   0.937   0.792
  622   1HD   LYS  73          1HD       LYS  73 -16.283  -1.099  -0.389
  623   2HD   LYS  73          2HD       LYS  73 -16.504   0.143  -1.640
  624   1HE   LYS  73          1HE       LYS  73 -13.924   0.021  -1.984
  625   2HE   LYS  73          2HE       LYS  73 -13.949  -1.376  -0.913
  626   1HZ   LYS  73          1HZ       LYS  73 -14.162  -2.086  -3.181
  627   2HZ   LYS  73          2HZ       LYS  73 -15.575  -1.183  -3.365
  628    H    GLN  74           H        GLN  74 -14.943   2.109   2.498
  629    HA   GLN  74           HA       GLN  74 -16.479   4.444   3.541
  630   1HB   GLN  74          1HB       GLN  74 -17.541   2.133   3.347
  631   2HB   GLN  74          2HB       GLN  74 -16.480   1.633   4.673
  632   1HG   GLN  74          1HG       GLN  74 -17.449   3.490   6.076
  633   2HG   GLN  74          2HG       GLN  74 -18.504   3.916   4.722
  634   1HE2  GLN  74          1HE2      GLN  74 -19.843   3.468   6.937
  635   2HE2  GLN  74          2HE2      GLN  74 -20.588   1.883   6.964
  636    H    GLY  75           H        GLY  75 -13.739   4.900   3.459
  637   1HA   GLY  75          1HA       GLY  75 -13.556   5.490   6.310
  638   2HA   GLY  75          2HA       GLY  75 -12.154   4.635   5.647
  639    HA   PRO  76           HA       PRO  76 -12.432   9.318   4.646
  640   1HB   PRO  76          1HB       PRO  76 -10.977  10.549   6.612
  641   2HB   PRO  76          2HB       PRO  76 -12.709  10.137   6.764
  642   1HG   PRO  76          1HG       PRO  76 -10.349   8.516   7.767
  643   2HG   PRO  76          2HG       PRO  76 -11.810   9.010   8.671
  644   1HD   PRO  76          1HD       PRO  76 -11.633   6.552   7.522
  645   2HD   PRO  76          2HD       PRO  76 -13.169   7.472   7.487
  646    HA   PRO  77           HA       PRO  77  -8.414   8.188   2.864
  647   1HB   PRO  77          1HB       PRO  77  -8.429   9.683   0.601
  648   2HB   PRO  77          2HB       PRO  77  -9.540   8.303   0.836
  649   1HG   PRO  77          1HG       PRO  77 -10.170  11.224   1.382
  650   2HG   PRO  77          2HG       PRO  77 -11.108  10.100   0.353
  651   1HD   PRO  77          1HD       PRO  77 -11.814  10.484   2.866
  652   2HD   PRO  77          2HD       PRO  77 -11.828   8.832   2.163
  653    H    ALA  78           H        ALA  78  -6.339   9.067   2.930
  654    HA   ALA  78           HA       ALA  78  -5.911  11.485   4.442
  655   1HB   ALA  78          1HB       ALA  78  -3.531  10.960   4.078
  656   2HB   ALA  78          2HB       ALA  78  -4.429   9.520   4.601
  657   3HB   ALA  78          3HB       ALA  78  -3.988   9.722   2.889
  658    H    ALA  79           H        ALA  79  -6.315  10.789   1.052
  659    HA   ALA  79           HA       ALA  79  -5.245  13.451   0.233
  660   1HB   ALA  79          1HB       ALA  79  -4.438  12.381  -1.771
  661   2HB   ALA  79          2HB       ALA  79  -3.790  11.458  -0.394
  662   3HB   ALA  79          3HB       ALA  79  -5.172  10.832  -1.311
  663    H    GLU  80           H        GLU  80  -6.110  14.044  -1.946
  664    HA   GLU  80           HA       GLU  80  -9.011  13.680  -2.133
  665   1HB   GLU  80          1HB       GLU  80  -7.886  15.849  -2.599
  666   2HB   GLU  80          2HB       GLU  80  -7.066  15.125  -3.989
  667   1HG   GLU  80          1HG       GLU  80  -9.272  14.692  -5.057
  668   2HG   GLU  80          2HG       GLU  80 -10.094  15.351  -3.637
  669    HE2  GLU  80           HE       GLU  80  -9.263  18.698  -4.407
  670    H    VAL  81           H        VAL  81  -8.699  11.327  -2.188
  671    HA   VAL  81           HA       VAL  81  -7.847   9.958  -4.568
  672    HB   VAL  81           HB       VAL  81  -8.064   8.864  -2.443
  673   1HG1  VAL  81          1HG1      VAL  81 -11.098   9.204  -2.548
  674   2HG1  VAL  81          2HG1      VAL  81 -10.155   8.244  -1.411
  675   3HG1  VAL  81          3HG1      VAL  81  -9.957  10.004  -1.467
  676   1HG2  VAL  81          1HG2      VAL  81 -10.027   7.701  -4.467
  677   2HG2  VAL  81          2HG2      VAL  81  -8.260   7.521  -4.503
  678   3HG2  VAL  81          3HG2      VAL  81  -9.192   6.813  -3.177
  679    H    GLU  82           H        GLU  82  -8.673   9.920  -6.470
  680    HA   GLU  82           HA       GLU  82 -11.101  11.402  -7.130
  681   1HB   GLU  82          1HB       GLU  82  -9.122  11.662  -8.496
  682   2HB   GLU  82          2HB       GLU  82  -8.987   9.922  -8.749
  683   1HG   GLU  82          1HG       GLU  82  -9.894  11.038 -10.724
  684   2HG   GLU  82          2HG       GLU  82 -11.068   9.899 -10.061
  685    HE2  GLU  82           HE       GLU  82 -13.404  12.370  -9.226
  686    H    LYS  83           H        LYS  83  -9.821   8.083  -7.703
  687    HA   LYS  83           HA       LYS  83 -12.185   6.809  -6.760
  688   1HB   LYS  83          1HB       LYS  83 -13.031   5.837  -8.881
  689   2HB   LYS  83          2HB       LYS  83 -13.240   7.581  -8.820
  690   1HG   LYS  83          1HG       LYS  83 -12.419   7.535 -10.880
  691   2HG   LYS  83          2HG       LYS  83 -10.834   7.471 -10.095
  692   1HD   LYS  83          1HD       LYS  83 -10.914   4.968 -10.222
  693   2HD   LYS  83          2HD       LYS  83 -12.463   5.073 -11.076
  694   1HE   LYS  83          1HE       LYS  83  -9.894   6.411 -12.017
  695   2HE   LYS  83          2HE       LYS  83 -10.417   4.790 -12.532
  696   1HZ   LYS  83          1HZ       LYS  83 -11.156   6.388 -14.130
  697   2HZ   LYS  83          2HZ       LYS  83 -12.009   7.239 -12.947
  698    H    VAL  84           H        VAL  84 -11.945   4.621  -6.577
  699    HA   VAL  84           HA       VAL  84  -9.311   3.456  -7.319
  700    HB   VAL  84           HB       VAL  84  -9.504   3.520  -5.091
  701   1HG1  VAL  84          1HG1      VAL  84 -12.306   2.374  -5.197
  702   2HG1  VAL  84          2HG1      VAL  84 -11.322   2.597  -3.737
  703   3HG1  VAL  84          3HG1      VAL  84 -11.822   4.004  -4.675
  704   1HG2  VAL  84          1HG2      VAL  84 -10.385   0.696  -5.761
  705   2HG2  VAL  84          2HG2      VAL  84  -8.782   1.353  -6.148
  706   3HG2  VAL  84          3HG2      VAL  84  -9.315   1.233  -4.456
  707    H    ASP  85           H        ASP  85  -9.624   2.621  -9.402
  708    HA   ASP  85           HA       ASP  85 -12.053   1.053 -10.027
  709   1HB   ASP  85          1HB       ASP  85 -11.258   2.682 -11.647
  710   2HB   ASP  85          2HB       ASP  85  -9.672   1.900 -11.705
  711    HD2  ASP  85           HD       ASP  85 -10.918   0.228 -14.484
  712    H    TYR  86           H        TYR  86 -11.449  -0.558  -8.315
  713    HA   TYR  86           HA       TYR  86  -8.973  -1.960  -8.735
  714   1HB   TYR  86          1HB       TYR  86  -9.368  -3.130  -6.749
  715   2HB   TYR  86          2HB       TYR  86 -10.042  -1.538  -6.450
  716    HD1  TYR  86           1HD      TYR  86 -10.661  -5.122  -6.533
  717    HD2  TYR  86           2HD      TYR  86 -12.617  -1.274  -6.665
  718    HE1  TYR  86           1HE      TYR  86 -12.781  -6.169  -5.826
  719    HE2  TYR  86           2HE      TYR  86 -14.737  -2.331  -5.961
  720    HH   TYR  86           HH       TYR  86 -15.807  -4.295  -5.424
  721    H    SER  87           H        SER  87  -8.783  -4.273  -8.795
  722    HA   SER  87           HA       SER  87 -10.900  -5.705 -10.297
  723   1HB   SER  87          1HB       SER  87  -7.954  -5.550 -11.078
  724   2HB   SER  87          2HB       SER  87  -9.184  -6.577 -11.844
  725    HG   SER  87           HG       SER  87 -10.338  -4.531 -12.226
  726    H    PHE  88           H        PHE  88 -11.312  -7.547  -9.253
  727    HA   PHE  88           HA       PHE  88  -9.389  -8.839  -7.440
  728   1HB   PHE  88          1HB       PHE  88 -11.413  -9.409  -6.647
  729   2HB   PHE  88          2HB       PHE  88 -12.230  -9.102  -8.161
  730    HD1  PHE  88           1HD      PHE  88  -9.609 -11.588  -7.040
  731    HD2  PHE  88           2HD      PHE  88 -13.431 -10.977  -8.922
  732    HE1  PHE  88           1HE      PHE  88  -9.770 -14.020  -7.491
  733    HE2  PHE  88           2HE      PHE  88 -13.618 -13.412  -9.322
  734    HZ   PHE  88           HZ       PHE  88 -11.793 -14.942  -8.605
  735    H    SER  89           H        SER  89  -7.743 -10.041  -8.220
  736    HA   SER  89           HA       SER  89  -8.162 -11.612 -10.721
  737   1HB   SER  89          1HB       SER  89  -5.480 -10.532  -9.893
  738   2HB   SER  89          2HB       SER  89  -5.970 -11.208 -11.447
  739    HG   SER  89           HG       SER  89  -7.454  -9.359 -11.564
  740    H    GLU  90           H        GLU  90  -6.393 -13.397 -10.777
  741    HA   GLU  90           HA       GLU  90  -6.243 -14.760  -8.146
  742   1HB   GLU  90          1HB       GLU  90  -5.739 -15.635 -11.005
  743   2HB   GLU  90          2HB       GLU  90  -5.127 -16.570  -9.635
  744   1HG   GLU  90          1HG       GLU  90  -8.054 -15.811  -9.985
  745   2HG   GLU  90          2HG       GLU  90  -7.346 -17.360 -10.473
  746    HE2  GLU  90           HE       GLU  90  -6.892 -18.503  -7.146
  747    H    TYR  91           H        TYR  91  -4.338 -15.213  -7.149
  748    HA   TYR  91           HA       TYR  91  -2.317 -13.237  -7.309
  749   1HB   TYR  91          1HB       TYR  91  -1.432 -14.388  -5.414
  750   2HB   TYR  91          2HB       TYR  91  -3.183 -14.465  -5.276
  751    HD1  TYR  91           1HD      TYR  91  -4.398 -16.664  -5.827
  752    HD2  TYR  91           2HD      TYR  91  -0.096 -16.379  -5.661
  753    HE1  TYR  91           1HE      TYR  91  -4.236 -19.111  -5.961
  754    HE2  TYR  91           2HE      TYR  91   0.067 -18.837  -5.838
  755    HH   TYR  91           HH       TYR  91  -1.084 -20.825  -6.024
  756    H    LYS  92           H        LYS  92  -0.300 -13.256  -8.088
  757    HA   LYS  92           HA       LYS  92   0.519 -15.289 -10.034
  758   1HB   LYS  92          1HB       LYS  92   0.970 -12.973 -10.530
  759   2HB   LYS  92          2HB       LYS  92   1.755 -12.720  -8.964
  760   1HG   LYS  92          1HG       LYS  92   3.385 -12.834 -10.745
  761   2HG   LYS  92          2HG       LYS  92   3.621 -14.185  -9.634
  762   1HD   LYS  92          1HD       LYS  92   2.490 -15.708 -11.229
  763   2HD   LYS  92          2HD       LYS  92   2.151 -14.339 -12.311
  764   1HE   LYS  92          1HE       LYS  92   4.602 -13.956 -12.566
  765   2HE   LYS  92          2HE       LYS  92   4.919 -15.330 -11.486
  766   1HZ   LYS  92          1HZ       LYS  92   5.030 -16.074 -13.740
  767   2HZ   LYS  92          2HZ       LYS  92   3.455 -15.545 -14.039
  768    H    GLY  93           H        GLY  93   1.570 -13.996  -6.852
  769   1HA   GLY  93          1HA       GLY  93   2.480 -16.541  -5.873
  770   2HA   GLY  93          2HA       GLY  93   3.820 -15.442  -6.292
  771    H    GLU  94           H        GLU  94   3.704 -16.023  -3.722
  772    HA   GLU  94           HA       GLU  94   2.125 -14.068  -2.201
  773   1HB   GLU  94          1HB       GLU  94   3.217 -15.081  -0.257
  774   2HB   GLU  94          2HB       GLU  94   2.151 -16.132  -1.191
  775   1HG   GLU  94          1HG       GLU  94   4.033 -17.299  -2.194
  776   2HG   GLU  94          2HG       GLU  94   5.192 -16.216  -1.405
  777    HE2  GLU  94           HE       GLU  94   4.775 -17.651   1.782
  778    H    PHE  95           H        PHE  95   2.833 -12.060  -2.400
  779    HA   PHE  95           HA       PHE  95   5.515 -11.206  -2.908
  780   1HB   PHE  95          1HB       PHE  95   3.008  -9.856  -1.857
  781   2HB   PHE  95          2HB       PHE  95   4.541  -9.022  -1.950
  782    HD1  PHE  95           1HD      PHE  95   2.779 -11.334  -4.409
  783    HD2  PHE  95           2HD      PHE  95   4.519  -7.458  -3.662
  784    HE1  PHE  95           1HE      PHE  95   2.207 -10.638  -6.696
  785    HE2  PHE  95           2HE      PHE  95   3.898  -6.750  -5.951
  786    HZ   PHE  95           HZ       PHE  95   2.736  -8.334  -7.472
  787    H    GLU  96           H        GLU  96   7.204 -10.864  -1.486
  788    HA   GLU  96           HA       GLU  96   7.050 -11.791   1.173
  789   1HB   GLU  96          1HB       GLU  96   9.191 -10.125  -0.206
  790   2HB   GLU  96          2HB       GLU  96   9.359 -10.974   1.342
  791   1HG   GLU  96          1HG       GLU  96   8.811 -13.130   0.151
  792   2HG   GLU  96          2HG       GLU  96   8.852 -12.254  -1.385
  793    HE2  GLU  96           HE       GLU  96  12.363 -11.701  -1.248
  794    H    ASP  97           H        ASP  97   5.525 -10.684   2.374
  795    HA   ASP  97           HA       ASP  97   4.736  -9.162   3.834
  796   1HB   ASP  97          1HB       ASP  97   7.063  -7.301   3.210
  797   2HB   ASP  97          2HB       ASP  97   5.989  -7.273   4.603
  798    HD2  ASP  97           HD       ASP  97   9.138  -9.728   4.621
  799    H    PHE  98           H        PHE  98   4.338  -6.468   3.752
  800    HA   PHE  98           HA       PHE  98   3.354  -5.800   1.039
  801   1HB   PHE  98          1HB       PHE  98   1.601  -6.926   2.440
  802   2HB   PHE  98          2HB       PHE  98   1.669  -5.589   3.555
  803    HD1  PHE  98           1HD      PHE  98   2.046  -3.790   0.625
  804    HD2  PHE  98           2HD      PHE  98  -0.825  -6.242   2.679
  805    HE1  PHE  98           1HE      PHE  98   0.232  -2.577  -0.490
  806    HE2  PHE  98           2HE      PHE  98  -2.664  -4.971   1.594
  807    HZ   PHE  98           HZ       PHE  98  -2.140  -3.129   0.024
  808    H    GLU  99           H        GLU  99   5.120  -4.303   0.974
  809    HA   GLU  99           HA       GLU  99   4.995  -2.041   2.936
  810   1HB   GLU  99          1HB       GLU  99   6.893  -3.392   3.124
  811   2HB   GLU  99          2HB       GLU  99   7.297  -3.217   1.421
  812   1HG   GLU  99          1HG       GLU  99   7.678  -0.792   1.752
  813   2HG   GLU  99          2HG       GLU  99   7.110  -0.918   3.426
  814    HE2  GLU  99           HE       GLU  99  10.723  -2.514   2.341
  815    H    THR 100           H        THR 100   5.667   0.088   2.035
  816    HA   THR 100           HA       THR 100   4.268   0.540  -0.500
  817    HB   THR 100           HB       THR 100   3.671   2.575   0.283
  818    HG1  THR 100           1HG      THR 100   4.822   3.674   1.938
  819   1HG2  THR 100          1HG2      THR 100   2.865   2.318   2.559
  820   2HG2  THR 100          2HG2      THR 100   2.847   0.716   1.797
  821   3HG2  THR 100          3HG2      THR 100   4.123   1.145   2.951
  822    H    TYR 101           H        TYR 101   5.125   1.505  -2.294
  823    HA   TYR 101           HA       TYR 101   8.011   1.418  -2.619
  824   1HB   TYR 101          1HB       TYR 101   6.268   0.658  -4.199
  825   2HB   TYR 101          2HB       TYR 101   5.776   2.341  -4.431
  826    HD1  TYR 101           1HD      TYR 101   8.025  -0.329  -5.425
  827    HD2  TYR 101           2HD      TYR 101   7.058   3.837  -5.813
  828    HE1  TYR 101           1HE      TYR 101   9.535  -0.170  -7.384
  829    HE2  TYR 101           2HE      TYR 101   8.549   4.005  -7.796
  830    HH   TYR 101           HH       TYR 101  10.080   2.904  -9.138
  Start of MODEL   14
    1   1H    GLY  -1          1H        GLY  -1  14.649 -35.303  18.904
    2   2H    GLY  -1          2H        GLY  -1  14.278 -35.317  17.295
    3   3H    GLY  -1          3H        GLY  -1  13.982 -33.970  18.191
    4   1HA   GLY  -1          1HA       GLY  -1  12.664 -36.565  18.505
    5   2HA   GLY  -1          2HA       GLY  -1  12.362 -35.135  19.511
    6    H    SER   0           H        SER   0  10.286 -36.365  18.176
    7    HA   SER   0           HA       SER   0   8.545 -36.074  16.806
    8   1HB   SER   0          1HB       SER   0   8.498 -33.916  18.056
    9   2HB   SER   0          2HB       SER   0   9.392 -33.146  16.729
   10    HG   SER   0           HG       SER   0   7.670 -33.759  15.353
   11    H    MET   1           H        MET   1  10.871 -37.030  15.532
   12    HA   MET   1           HA       MET   1  11.114 -35.666  12.922
   13   1HB   MET   1          1HB       MET   1  12.531 -38.079  14.119
   14   2HB   MET   1          2HB       MET   1  12.913 -37.309  12.566
   15   1HG   MET   1          1HG       MET   1  13.331 -35.161  13.804
   16   2HG   MET   1          2HG       MET   1  13.128 -36.040  15.323
   17   1HE   MET   1          1HE       MET   1  14.646 -37.981  16.132
   18   2HE   MET   1          2HE       MET   1  16.213 -38.406  15.406
   19   3HE   MET   1          3HE       MET   1  14.708 -38.878  14.592
   20    H    LYS   2           H        LYS   2   8.729 -36.162  12.621
   21    HA   LYS   2           HA       LYS   2   8.275 -38.949  11.639
   22   1HB   LYS   2          1HB       LYS   2   6.037 -38.815  12.504
   23   2HB   LYS   2          2HB       LYS   2   7.218 -38.524  13.784
   24   1HG   LYS   2          1HG       LYS   2   6.770 -36.029  13.538
   25   2HG   LYS   2          2HG       LYS   2   5.549 -36.427  12.319
   26   1HD   LYS   2          1HD       LYS   2   4.356 -36.087  14.311
   27   2HD   LYS   2          2HD       LYS   2   4.377 -37.842  14.073
   28   1HE   LYS   2          1HE       LYS   2   6.245 -38.010  15.746
   29   2HE   LYS   2          2HE       LYS   2   6.212 -36.245  15.929
   30   1HZ   LYS   2          1HZ       LYS   2   4.905 -37.244  17.647
   31   2HZ   LYS   2          2HZ       LYS   2   3.915 -38.001  16.507
   32    H    LYS   3           H        LYS   3   6.944 -39.245   9.870
   33    HA   LYS   3           HA       LYS   3   5.929 -36.886   8.371
   34   1HB   LYS   3          1HB       LYS   3   7.603 -39.190   7.290
   35   2HB   LYS   3          2HB       LYS   3   6.623 -38.139   6.263
   36   1HG   LYS   3          1HG       LYS   3   8.850 -37.078   8.054
   37   2HG   LYS   3          2HG       LYS   3   9.069 -37.598   6.379
   38   1HD   LYS   3          1HD       LYS   3   7.352 -35.932   5.637
   39   2HD   LYS   3          2HD       LYS   3   7.207 -35.367   7.308
   40   1HE   LYS   3          1HE       LYS   3   8.652 -33.862   6.097
   41   2HE   LYS   3          2HE       LYS   3   9.617 -34.736   7.301
   42   1HZ   LYS   3          1HZ       LYS   3  10.760 -34.728   5.203
   43   2HZ   LYS   3          2HZ       LYS   3   9.461 -35.500   4.451
   44    H    TRP   4           H        TRP   4   4.085 -37.531   9.535
   45    HA   TRP   4           HA       TRP   4   2.285 -39.029   8.027
   46   1HB   TRP   4          1HB       TRP   4   2.858 -40.251  10.797
   47   2HB   TRP   4          2HB       TRP   4   1.521 -40.707   9.746
   48    HD1  TRP   4           HD       TRP   4   2.064 -42.264   7.660
   49    HE1  TRP   4           1HE      TRP   4   3.971 -43.955   7.222
   50    HE3  TRP   4           3HE      TRP   4   5.416 -40.679  11.190
   51    HZ2  TRP   4           2HZ      TRP   4   6.571 -44.528   8.255
   52    HZ3  TRP   4           3HZ      TRP   4   7.606 -41.810  11.429
   53    HH2  TRP   4           HH       TRP   4   8.188 -43.740   9.977
   54    H    SER   5           H        SER   5   2.232 -36.576   8.406
   55    HA   SER   5           HA       SER   5   0.219 -35.984  10.534
   56   1HB   SER   5          1HB       SER   5   1.564 -33.945  11.027
   57   2HB   SER   5          2HB       SER   5   2.300 -35.478  11.518
   58    HG   SER   5           HG       SER   5   3.653 -35.384   9.749
   59    H    ASP   6           H        ASP   6   2.107 -34.081   8.210
   60    HA   ASP   6           HA       ASP   6   1.619 -32.449   6.773
   61   1HB   ASP   6          1HB       ASP   6   0.805 -34.277   5.376
   62   2HB   ASP   6          2HB       ASP   6  -0.813 -34.126   6.073
   63    HD2  ASP   6           HD       ASP   6  -1.674 -31.401   4.077
   64    H    THR   7           H        THR   7   1.395 -31.108   8.697
   65    HA   THR   7           HA       THR   7  -1.308 -30.156   9.390
   66    HB   THR   7           HB       THR   7   0.044 -28.519  10.775
   67    HG1  THR   7           1HG      THR   7   2.253 -29.033  10.983
   68   1HG2  THR   7          1HG2      THR   7   0.752 -30.206  12.425
   69   2HG2  THR   7          2HG2      THR   7  -0.839 -30.594  11.746
   70   3HG2  THR   7          3HG2      THR   7   0.600 -31.487  11.208
   71    H    GLU   8           H        GLU   8  -1.342 -29.984   6.819
   72    HA   GLU   8           HA       GLU   8  -1.223 -27.140   6.157
   73   1HB   GLU   8          1HB       GLU   8   1.098 -27.922   5.696
   74   2HB   GLU   8          2HB       GLU   8   0.461 -29.153   4.597
   75   1HG   GLU   8          1HG       GLU   8  -0.554 -27.314   3.205
   76   2HG   GLU   8          2HG       GLU   8   0.152 -26.125   4.310
   77    HE2  GLU   8           HE       GLU   8   3.480 -26.776   3.194
   78    H    VAL   9           H        VAL   9  -3.465 -27.383   5.992
   79    HA   VAL   9           HA       VAL   9  -4.350 -28.268   3.391
   80    HB   VAL   9           HB       VAL   9  -4.501 -30.385   4.626
   81   1HG1  VAL   9          1HG1      VAL   9  -6.469 -29.004   6.501
   82   2HG1  VAL   9          2HG1      VAL   9  -6.026 -30.718   6.487
   83   3HG1  VAL   9          3HG1      VAL   9  -4.818 -29.505   6.935
   84   1HG2  VAL   9          1HG2      VAL   9  -7.271 -29.239   4.117
   85   2HG2  VAL   9          2HG2      VAL   9  -6.162 -29.838   2.863
   86   3HG2  VAL   9          3HG2      VAL   9  -6.788 -30.944   4.099
   87    H    PHE  10           H        PHE  10  -5.981 -27.007   2.696
   88    HA   PHE  10           HA       PHE  10  -7.709 -25.636   2.579
   89   1HB   PHE  10          1HB       PHE  10  -8.653 -27.073   4.400
   90   2HB   PHE  10          2HB       PHE  10  -8.146 -25.863   5.570
   91    HD1  PHE  10           1HD      PHE  10 -10.234 -26.408   2.507
   92    HD2  PHE  10           2HD      PHE  10  -9.600 -23.989   6.024
   93    HE1  PHE  10           1HE      PHE  10 -12.299 -25.131   2.007
   94    HE2  PHE  10           2HE      PHE  10 -11.651 -22.706   5.505
   95    HZ   PHE  10           HZ       PHE  10 -13.003 -23.269   3.496
   96    H    GLU  11           H        GLU  11  -5.235 -24.431   2.539
   97    HA   GLU  11           HA       GLU  11  -6.008 -21.743   3.571
   98   1HB   GLU  11          1HB       GLU  11  -3.659 -21.215   3.869
   99   2HB   GLU  11          2HB       GLU  11  -4.361 -22.331   5.032
  100   1HG   GLU  11          1HG       GLU  11  -2.629 -23.223   2.681
  101   2HG   GLU  11          2HG       GLU  11  -2.015 -22.851   4.295
  102    HE2  GLU  11           HE       GLU  11  -3.922 -25.561   5.774
  103    H    MET  12           H        MET  12  -6.229 -20.279   1.969
  104    HA   MET  12           HA       MET  12  -4.396 -19.954  -0.188
  105   1HB   MET  12          1HB       MET  12  -6.726 -21.679  -0.692
  106   2HB   MET  12          2HB       MET  12  -6.798 -20.247  -1.686
  107   1HG   MET  12          1HG       MET  12  -4.505 -20.607  -2.506
  108   2HG   MET  12          2HG       MET  12  -4.404 -22.109  -1.585
  109   1HE   MET  12          1HE       MET  12  -7.769 -21.041  -3.651
  110   2HE   MET  12          2HE       MET  12  -7.113 -21.400  -5.260
  111   3HE   MET  12          3HE       MET  12  -6.358 -20.140  -4.256
  112    H    LEU  13           H        LEU  13  -5.134 -18.243  -1.651
  113    HA   LEU  13           HA       LEU  13  -7.457 -16.743  -1.366
  114   1HB   LEU  13          1HB       LEU  13  -6.702 -14.661  -0.443
  115   2HB   LEU  13          2HB       LEU  13  -6.880 -15.938   0.733
  116    HG   LEU  13           HG       LEU  13  -5.126 -14.480   1.313
  117   1HD1  LEU  13          1HD1      LEU  13  -3.343 -15.947   1.811
  118   2HD1  LEU  13          2HD1      LEU  13  -4.842 -16.882   1.888
  119   3HD1  LEU  13          3HD1      LEU  13  -3.755 -17.048   0.485
  120   1HD2  LEU  13          1HD2      LEU  13  -3.167 -14.040   0.086
  121   2HD2  LEU  13          2HD2      LEU  13  -3.589 -15.194  -1.194
  122   3HD2  LEU  13          3HD2      LEU  13  -4.560 -13.717  -0.974
  123    H    LYS  14           H        LYS  14  -7.339 -14.685  -2.627
  124    HA   LYS  14           HA       LYS  14  -5.377 -14.986  -4.837
  125   1HB   LYS  14          1HB       LYS  14  -6.865 -14.477  -6.399
  126   2HB   LYS  14          2HB       LYS  14  -7.798 -15.479  -5.305
  127   1HG   LYS  14          1HG       LYS  14  -7.856 -12.424  -5.527
  128   2HG   LYS  14          2HG       LYS  14  -9.051 -13.542  -6.167
  129   1HD   LYS  14          1HD       LYS  14  -8.379 -13.149  -3.220
  130   2HD   LYS  14          2HD       LYS  14  -9.714 -12.388  -4.063
  131   1HE   LYS  14          1HE       LYS  14  -9.393 -15.415  -3.701
  132   2HE   LYS  14          2HE       LYS  14 -10.459 -14.365  -2.772
  133   1HZ   LYS  14          1HZ       LYS  14 -11.708 -15.359  -4.518
  134   2HZ   LYS  14          2HZ       LYS  14 -10.683 -14.699  -5.685
  135    H    ARG  15           H        ARG  15  -4.862 -12.959  -6.100
  136    HA   ARG  15           HA       ARG  15  -4.136 -10.888  -4.172
  137   1HB   ARG  15          1HB       ARG  15  -2.632 -10.003  -5.692
  138   2HB   ARG  15          2HB       ARG  15  -2.461 -11.758  -5.734
  139   1HG   ARG  15          1HG       ARG  15  -3.888 -11.743  -7.827
  140   2HG   ARG  15          2HG       ARG  15  -3.821  -9.970  -7.798
  141   1HD   ARG  15          1HD       ARG  15  -1.541  -9.850  -8.176
  142   2HD   ARG  15          2HD       ARG  15  -1.245 -11.540  -7.753
  143    HE   ARG  15           HE       ARG  15  -2.843 -11.945  -9.820
  144   1HH1  ARG  15          2HH1      ARG  15  -0.102  -9.678  -9.619
  145   2HH1  ARG  15          1HH1      ARG  15   0.286  -9.836 -11.311
  146   1HH2  ARG  15          1HH2      ARG  15  -2.307 -12.144 -11.993
  147   2HH2  ARG  15          2HH2      ARG  15  -0.981 -11.236 -12.675
  148    H    MET  16           H        MET  16  -5.462  -9.325  -3.709
  149    HA   MET  16           HA       MET  16  -7.539  -8.434  -5.592
  150   1HB   MET  16          1HB       MET  16  -8.261  -7.077  -3.737
  151   2HB   MET  16          2HB       MET  16  -8.364  -8.818  -3.506
  152   1HG   MET  16          1HG       MET  16  -6.801  -8.842  -1.818
  153   2HG   MET  16          2HG       MET  16  -5.928  -7.461  -2.454
  154   1HE   MET  16          1HE       MET  16  -6.445  -4.958  -2.132
  155   2HE   MET  16          2HE       MET  16  -7.768  -4.355  -1.139
  156   3HE   MET  16          3HE       MET  16  -8.110  -5.086  -2.710
  157    H    TYR  17           H        TYR  17  -6.730  -7.194  -7.146
  158    HA   TYR  17           HA       TYR  17  -4.613  -5.208  -6.681
  159   1HB   TYR  17          1HB       TYR  17  -4.207  -6.367  -8.620
  160   2HB   TYR  17          2HB       TYR  17  -5.906  -6.529  -9.020
  161    HD1  TYR  17           1HD      TYR  17  -3.887  -3.400  -8.336
  162    HD2  TYR  17           2HD      TYR  17  -6.139  -5.730 -11.191
  163    HE1  TYR  17           1HE      TYR  17  -3.825  -1.519  -9.949
  164    HE2  TYR  17           2HE      TYR  17  -6.012  -3.869 -12.810
  165    HH   TYR  17           HH       TYR  17  -5.289  -1.720 -13.202
  166    H    ALA  18           H        ALA  18  -5.277  -3.400  -5.738
  167    HA   ALA  18           HA       ALA  18  -7.850  -2.136  -6.550
  168   1HB   ALA  18          1HB       ALA  18  -7.794  -1.007  -4.409
  169   2HB   ALA  18          2HB       ALA  18  -7.835  -2.779  -4.233
  170   3HB   ALA  18          3HB       ALA  18  -6.309  -1.892  -3.967
  171    H    ARG  19           H        ARG  19  -7.465  -0.761  -8.029
  172    HA   ARG  19           HA       ARG  19  -5.041   0.887  -8.220
  173   1HB   ARG  19          1HB       ARG  19  -6.304  -0.486 -10.078
  174   2HB   ARG  19          2HB       ARG  19  -7.391   0.885 -10.113
  175   1HG   ARG  19          1HG       ARG  19  -4.425   0.756 -10.775
  176   2HG   ARG  19          2HG       ARG  19  -5.786   1.224 -11.804
  177   1HD   ARG  19          1HD       ARG  19  -6.056   3.171 -10.049
  178   2HD   ARG  19          2HD       ARG  19  -4.385   2.786  -9.627
  179    HE   ARG  19           HE       ARG  19  -4.535   2.967 -12.441
  180   1HH1  ARG  19          1HH1      ARG  19  -4.893   5.187  -9.676
  181   2HH1  ARG  19          2HH1      ARG  19  -4.623   6.607 -10.649
  182   1HH2  ARG  19          1HH2      ARG  19  -4.219   4.844 -13.682
  183   2HH2  ARG  19          2HH2      ARG  19  -4.242   6.417 -12.929
  184    H    VAL  20           H        VAL  20  -5.097   2.861  -7.159
  185    HA   VAL  20           HA       VAL  20  -7.747   4.051  -6.490
  186    HB   VAL  20           HB       VAL  20  -5.098   4.750  -5.230
  187   1HG1  VAL  20          1HG1      VAL  20  -7.922   4.808  -4.104
  188   2HG1  VAL  20          2HG1      VAL  20  -6.465   5.584  -3.455
  189   3HG1  VAL  20          3HG1      VAL  20  -7.209   6.184  -4.954
  190   1HG2  VAL  20          1HG2      VAL  20  -6.977   2.494  -4.429
  191   2HG2  VAL  20          2HG2      VAL  20  -5.254   2.358  -4.850
  192   3HG2  VAL  20          3HG2      VAL  20  -5.735   3.195  -3.372
  193    H    TYR  21           H        TYR  21  -8.356   5.740  -7.732
  194    HA   TYR  21           HA       TYR  21  -6.319   7.275  -9.279
  195   1HB   TYR  21          1HB       TYR  21  -9.310   7.066  -9.685
  196   2HB   TYR  21          2HB       TYR  21  -8.215   8.002 -10.628
  197    HD1  TYR  21           1HD      TYR  21  -8.639   4.389  -9.517
  198    HD2  TYR  21           2HD      TYR  21  -7.430   7.109 -12.649
  199    HE1  TYR  21           1HE      TYR  21  -8.583   2.529 -11.106
  200    HE2  TYR  21           2HE      TYR  21  -7.359   5.220 -14.235
  201    HH   TYR  21           HH       TYR  21  -7.650   2.948 -14.538
  202    H    GLY  22           H        GLY  22  -6.361   9.542  -9.327
  203   1HA   GLY  22          1HA       GLY  22  -7.817  11.552  -8.724
  204   2HA   GLY  22          2HA       GLY  22  -7.724  10.900  -7.072
  205    H    LEU  23           H        LEU  23  -6.721  12.841  -6.388
  206    HA   LEU  23           HA       LEU  23  -3.887  13.190  -7.166
  207   1HB   LEU  23          1HB       LEU  23  -5.497  15.118  -6.765
  208   2HB   LEU  23          2HB       LEU  23  -5.400  14.718  -5.050
  209    HG   LEU  23           HG       LEU  23  -2.812  15.008  -5.345
  210   1HD1  LEU  23          1HD1      LEU  23  -2.176  16.534  -7.207
  211   2HD1  LEU  23          2HD1      LEU  23  -2.676  14.948  -7.799
  212   3HD1  LEU  23          3HD1      LEU  23  -3.789  16.327  -7.916
  213   1HD2  LEU  23          1HD2      LEU  23  -3.000  17.455  -5.123
  214   2HD2  LEU  23          2HD2      LEU  23  -4.679  17.384  -5.704
  215   3HD2  LEU  23          3HD2      LEU  23  -4.232  16.620  -4.163
  216    H    VAL  24           H        VAL  24  -5.238  10.820  -5.805
  217    HA   VAL  24           HA       VAL  24  -4.640  10.587  -3.105
  218    HB   VAL  24           HB       VAL  24  -4.918   8.174  -3.519
  219   1HG1  VAL  24          1HG1      VAL  24  -6.895   9.810  -5.175
  220   2HG1  VAL  24          2HG1      VAL  24  -7.212   8.348  -4.236
  221   3HG1  VAL  24          3HG1      VAL  24  -6.828   9.874  -3.411
  222   1HG2  VAL  24          1HG2      VAL  24  -5.150   8.880  -6.494
  223   2HG2  VAL  24          2HG2      VAL  24  -3.761   8.064  -5.782
  224   3HG2  VAL  24          3HG2      VAL  24  -5.343   7.295  -5.733
  225    H    GLN  25           H        GLN  25  -2.561   9.967  -5.904
  226    HA   GLN  25           HA       GLN  25  -0.238   9.186  -4.298
  227   1HB   GLN  25          1HB       GLN  25  -0.519   8.322  -6.493
  228   2HB   GLN  25          2HB       GLN  25  -0.598   9.952  -7.207
  229   1HG   GLN  25          1HG       GLN  25   1.699  10.343  -6.816
  230   2HG   GLN  25          2HG       GLN  25   1.816   9.089  -5.588
  231   1HE2  GLN  25          1HE2      GLN  25   2.067   6.916  -6.201
  232   2HE2  GLN  25          2HE2      GLN  25   2.499   6.433  -7.836
  233    H    GLY  26           H        GLY  26  -0.489  10.859  -2.830
  234   1HA   GLY  26          1HA       GLY  26   1.111  13.215  -3.261
  235   2HA   GLY  26          2HA       GLY  26  -0.626  13.605  -3.201
  236    H    VAL  27           H        VAL  27  -1.820  12.427  -1.324
  237    HA   VAL  27           HA       VAL  27  -0.403  13.125   1.153
  238    HB   VAL  27           HB       VAL  27  -2.596  12.999   2.204
  239   1HG1  VAL  27          1HG1      VAL  27  -2.722  14.518  -0.436
  240   2HG1  VAL  27          2HG1      VAL  27  -3.684  14.832   1.020
  241   3HG1  VAL  27          3HG1      VAL  27  -1.930  15.075   1.050
  242   1HG2  VAL  27          1HG2      VAL  27  -3.632  12.054  -0.505
  243   2HG2  VAL  27          2HG2      VAL  27  -3.678  11.141   1.006
  244   3HG2  VAL  27          3HG2      VAL  27  -4.644  12.605   0.843
  245    H    GLY  28           H        GLY  28   0.679  10.887  -0.055
  246   1HA   GLY  28          1HA       GLY  28   1.483   8.829   0.439
  247   2HA   GLY  28          2HA       GLY  28   0.935   9.100   2.095
  248    H    PHE  29           H        PHE  29  -1.149   8.327   2.702
  249    HA   PHE  29           HA       PHE  29  -2.752   6.867   2.955
  250   1HB   PHE  29          1HB       PHE  29  -3.560   7.958   0.880
  251   2HB   PHE  29          2HB       PHE  29  -2.910   6.606  -0.050
  252    HD1  PHE  29           1HD      PHE  29  -4.350   4.729  -0.458
  253    HD2  PHE  29           2HD      PHE  29  -5.213   7.403   2.817
  254    HE1  PHE  29           1HE      PHE  29  -6.618   3.761  -0.256
  255    HE2  PHE  29           2HE      PHE  29  -7.449   6.397   3.049
  256    HZ   PHE  29           HZ       PHE  29  -8.188   4.611   1.477
  257    H    ARG  30           H        ARG  30  -0.306   5.678   0.648
  258    HA   ARG  30           HA       ARG  30  -0.631   2.991   0.633
  259   1HB   ARG  30          1HB       ARG  30   1.766   2.797   0.329
  260   2HB   ARG  30          2HB       ARG  30   1.137   4.203  -0.528
  261   1HG   ARG  30          1HG       ARG  30   1.914   5.604   1.514
  262   2HG   ARG  30          2HG       ARG  30   2.770   4.139   2.044
  263   1HD   ARG  30          1HD       ARG  30   4.027   4.135  -0.118
  264   2HD   ARG  30          2HD       ARG  30   3.226   5.657  -0.542
  265    HE   ARG  30           HE       ARG  30   4.410   5.939   2.017
  266   1HH1  ARG  30          1HH1      ARG  30   5.440   5.543  -1.374
  267   2HH1  ARG  30          2HH1      ARG  30   6.823   6.575  -1.195
  268   1HH2  ARG  30          1HH2      ARG  30   6.294   7.225   2.242
  269   2HH2  ARG  30          2HH2      ARG  30   7.332   7.503   0.868
  270    H    LYS  31           H        LYS  31   0.665   4.854   3.392
  271    HA   LYS  31           HA       LYS  31   1.602   2.511   4.750
  272   1HB   LYS  31          1HB       LYS  31   2.536   4.881   4.955
  273   2HB   LYS  31          2HB       LYS  31   1.083   5.324   5.833
  274   1HG   LYS  31          1HG       LYS  31   3.011   4.855   7.322
  275   2HG   LYS  31          2HG       LYS  31   1.609   3.838   7.661
  276   1HD   LYS  31          1HD       LYS  31   3.769   2.626   7.778
  277   2HD   LYS  31          2HD       LYS  31   2.650   1.910   6.619
  278   1HE   LYS  31          1HE       LYS  31   3.889   3.014   4.746
  279   2HE   LYS  31          2HE       LYS  31   4.965   3.790   5.925
  280   1HZ   LYS  31          1HZ       LYS  31   5.977   1.800   5.089
  281   2HZ   LYS  31          2HZ       LYS  31   4.673   0.868   5.621
  282    H    PHE  32           H        PHE  32  -1.124   4.770   5.287
  283    HA   PHE  32           HA       PHE  32  -2.497   3.535   7.303
  284   1HB   PHE  32          1HB       PHE  32  -3.087   5.644   6.246
  285   2HB   PHE  32          2HB       PHE  32  -3.654   4.806   4.816
  286    HD1  PHE  32           1HD      PHE  32  -4.628   3.192   7.994
  287    HD2  PHE  32           2HD      PHE  32  -5.732   6.133   5.024
  288    HE1  PHE  32           1HE      PHE  32  -6.940   3.099   8.764
  289    HE2  PHE  32           2HE      PHE  32  -8.052   6.067   5.846
  290    HZ   PHE  32           HZ       PHE  32  -8.678   4.552   7.719
  291    H    VAL  33           H        VAL  33  -2.540   2.632   3.832
  292    HA   VAL  33           HA       VAL  33  -4.556   0.554   4.064
  293    HB   VAL  33           HB       VAL  33  -2.322   0.882   2.002
  294   1HG1  VAL  33          1HG1      VAL  33  -4.842  -0.834   1.950
  295   2HG1  VAL  33          2HG1      VAL  33  -3.754  -0.573   0.577
  296   3HG1  VAL  33          3HG1      VAL  33  -3.171  -1.439   2.001
  297   1HG2  VAL  33          1HG2      VAL  33  -5.275   1.605   1.751
  298   2HG2  VAL  33          2HG2      VAL  33  -3.977   2.787   2.014
  299   3HG2  VAL  33          3HG2      VAL  33  -4.009   1.832   0.531
  300    H    GLN  34           H        GLN  34  -1.081   0.702   4.520
  301    HA   GLN  34           HA       GLN  34  -0.755  -2.159   4.796
  302   1HB   GLN  34          1HB       GLN  34   1.042   0.210   4.981
  303   2HB   GLN  34          2HB       GLN  34   1.475  -1.192   5.967
  304   1HG   GLN  34          1HG       GLN  34   2.567  -1.319   3.819
  305   2HG   GLN  34          2HG       GLN  34   1.404  -2.641   3.971
  306   1HE2  GLN  34          1HE2      GLN  34  -0.711  -2.401   2.847
  307   2HE2  GLN  34          2HE2      GLN  34  -0.794  -1.405   1.409
  308    H    ILE  35           H        ILE  35  -1.016   0.458   7.297
  309    HA   ILE  35           HA       ILE  35  -0.706  -1.126   9.509
  310    HB   ILE  35           HB       ILE  35  -2.954   0.912   9.181
  311   1HG1  ILE  35          1HG1      ILE  35  -0.916   2.041   8.627
  312   2HG1  ILE  35          2HG1      ILE  35  -1.428   2.537  10.229
  313   1HG2  ILE  35          1HG2      ILE  35  -2.692   1.187  11.668
  314   2HG2  ILE  35          2HG2      ILE  35  -3.341  -0.378  11.188
  315   3HG2  ILE  35          3HG2      ILE  35  -1.645  -0.248  11.674
  316   1HD1  ILE  35          1HD1      ILE  35   0.975   2.218  10.185
  317   2HD1  ILE  35          2HD1      ILE  35   0.257   0.982  11.234
  318   3HD1  ILE  35          3HD1      ILE  35   0.804   0.559   9.591
  319    H    HIS  36           H        HIS  36  -3.872  -0.870   7.805
  320    HA   HIS  36           HA       HIS  36  -5.094  -2.792   9.593
  321   1HB   HIS  36          1HB       HIS  36  -5.914  -1.545   6.967
  322   2HB   HIS  36          2HB       HIS  36  -6.830  -2.871   7.695
  323    HD2  HIS  36           2HD      HIS  36  -5.393   0.220   9.777
  324    HE1  HIS  36           1HE      HIS  36  -9.612   0.110  10.042
  325    HE2  HIS  36           2HE      HIS  36  -7.505   1.299  10.857
  326    H    ALA  37           H        ALA  37  -3.860  -3.047   6.199
  327    HA   ALA  37           HA       ALA  37  -4.203  -5.682   5.692
  328   1HB   ALA  37          1HB       ALA  37  -2.191  -5.543   4.299
  329   2HB   ALA  37          2HB       ALA  37  -3.163  -4.076   4.161
  330   3HB   ALA  37          3HB       ALA  37  -1.678  -4.099   5.138
  331    H    ILE  38           H        ILE  38  -1.479  -4.343   7.561
  332    HA   ILE  38           HA       ILE  38  -0.122  -6.852   8.026
  333    HB   ILE  38           HB       ILE  38   0.248  -3.936   8.701
  334   1HG1  ILE  38          1HG1      ILE  38   2.568  -4.421   8.002
  335   2HG1  ILE  38          2HG1      ILE  38   2.176  -6.134   7.826
  336   1HG2  ILE  38          1HG2      ILE  38   2.045  -4.327  10.278
  337   2HG2  ILE  38          2HG2      ILE  38   0.465  -4.746  10.928
  338   3HG2  ILE  38          3HG2      ILE  38   1.577  -6.039  10.398
  339   1HD1  ILE  38          1HD1      ILE  38   2.259  -4.865   5.700
  340   2HD1  ILE  38          2HD1      ILE  38   0.665  -5.613   5.945
  341   3HD1  ILE  38          3HD1      ILE  38   0.903  -3.872   6.212
  342    H    ARG  39           H        ARG  39  -2.403  -4.795   9.874
  343    HA   ARG  39           HA       ARG  39  -2.188  -6.386  12.269
  344   1HB   ARG  39          1HB       ARG  39  -2.913  -3.956  12.012
  345   2HB   ARG  39          2HB       ARG  39  -4.449  -4.516  11.336
  346   1HG   ARG  39          1HG       ARG  39  -3.431  -5.493  14.016
  347   2HG   ARG  39          2HG       ARG  39  -4.120  -3.864  13.856
  348   1HD   ARG  39          1HD       ARG  39  -6.238  -4.743  13.046
  349   2HD   ARG  39          2HD       ARG  39  -5.606  -6.400  13.093
  350    HE   ARG  39           HE       ARG  39  -5.354  -5.122  15.655
  351   1HH1  ARG  39          1HH1      ARG  39  -7.728  -6.681  13.533
  352   2HH1  ARG  39          2HH1      ARG  39  -8.728  -7.245  14.846
  353   1HH2  ARG  39          1HH2      ARG  39  -6.678  -5.863  17.378
  354   2HH2  ARG  39          2HH2      ARG  39  -8.131  -6.767  17.041
  355    H    LEU  40           H        LEU  40  -4.137  -6.604   9.342
  356    HA   LEU  40           HA       LEU  40  -5.641  -8.920  10.449
  357   1HB   LEU  40          1HB       LEU  40  -6.063  -7.289   7.945
  358   2HB   LEU  40          2HB       LEU  40  -7.123  -8.563   8.562
  359    HG   LEU  40           HG       LEU  40  -6.518  -5.936  10.024
  360   1HD1  LEU  40          1HD1      LEU  40  -8.819  -5.375   9.453
  361   2HD1  LEU  40          2HD1      LEU  40  -7.879  -5.688   7.975
  362   3HD1  LEU  40          3HD1      LEU  40  -8.988  -6.933   8.608
  363   1HD2  LEU  40          1HD2      LEU  40  -8.421  -6.645  11.478
  364   2HD2  LEU  40          2HD2      LEU  40  -8.406  -8.239  10.694
  365   3HD2  LEU  40          3HD2      LEU  40  -7.015  -7.699  11.659
  366    H    GLY  41           H        GLY  41  -2.686  -8.834   9.353
  367   1HA   GLY  41          1HA       GLY  41  -1.324 -10.351   8.380
  368   2HA   GLY  41          2HA       GLY  41  -2.619 -11.519   8.669
  369    H    ILE  42           H        ILE  42  -1.870  -8.832   6.398
  370    HA   ILE  42           HA       ILE  42  -2.693 -10.509   4.066
  371    HB   ILE  42           HB       ILE  42  -2.797  -7.540   4.561
  372   1HG1  ILE  42          1HG1      ILE  42  -4.669  -8.745   5.585
  373   2HG1  ILE  42          2HG1      ILE  42  -5.152  -7.637   4.294
  374   1HG2  ILE  42          1HG2      ILE  42  -3.918  -7.408   2.294
  375   2HG2  ILE  42          2HG2      ILE  42  -2.175  -7.672   2.293
  376   3HG2  ILE  42          3HG2      ILE  42  -3.257  -9.026   1.980
  377   1HD1  ILE  42          1HD1      ILE  42  -6.439  -9.626   4.104
  378   2HD1  ILE  42          2HD1      ILE  42  -5.346  -9.572   2.725
  379   3HD1  ILE  42          3HD1      ILE  42  -4.997 -10.668   4.091
  380    H    LYS  43           H        LYS  43  -1.332 -10.490   2.305
  381    HA   LYS  43           HA       LYS  43   1.411  -9.318   2.609
  382   1HB   LYS  43          1HB       LYS  43   0.681 -11.567   0.808
  383   2HB   LYS  43          2HB       LYS  43   2.265 -10.949   1.315
  384   1HG   LYS  43          1HG       LYS  43   1.588 -11.560   3.722
  385   2HG   LYS  43          2HG       LYS  43   0.292 -12.519   2.992
  386   1HD   LYS  43          1HD       LYS  43   3.303 -12.895   2.686
  387   2HD   LYS  43          2HD       LYS  43   2.138 -13.956   3.487
  388   1HE   LYS  43          1HE       LYS  43   2.530 -15.026   1.413
  389   2HE   LYS  43          2HE       LYS  43   0.985 -14.180   1.181
  390   1HZ   LYS  43          1HZ       LYS  43   2.295 -13.612  -0.674
  391   2HZ   LYS  43          2HZ       LYS  43   3.632 -13.214   0.284
  392    H    GLY  44           H        GLY  44   2.312  -8.639   0.323
  393   1HA   GLY  44          1HA       GLY  44   0.875  -8.261  -1.963
  394   2HA   GLY  44          2HA       GLY  44   0.278  -6.960  -0.905
  395    H    TYR  45           H        TYR  45   1.045  -5.432  -2.368
  396    HA   TYR  45           HA       TYR  45   3.415  -4.305  -1.340
  397   1HB   TYR  45          1HB       TYR  45   4.339  -5.919  -3.144
  398   2HB   TYR  45          2HB       TYR  45   3.653  -4.779  -4.293
  399    HD1  TYR  45           1HD      TYR  45   6.420  -5.557  -2.128
  400    HD2  TYR  45           2HD      TYR  45   4.489  -2.346  -4.260
  401    HE1  TYR  45           1HE      TYR  45   8.324  -4.050  -1.608
  402    HE2  TYR  45           2HE      TYR  45   6.195  -0.792  -3.456
  403    HH   TYR  45           HH       TYR  45   8.111  -0.520  -2.116
  404    H    ALA  46           H        ALA  46   3.322  -2.126  -1.578
  405    HA   ALA  46           HA       ALA  46   0.911  -0.969  -2.915
  406   1HB   ALA  46          1HB       ALA  46   1.236   0.837  -1.262
  407   2HB   ALA  46          2HB       ALA  46   0.878  -0.761  -0.586
  408   3HB   ALA  46          3HB       ALA  46   2.530  -0.128  -0.523
  409    H    LYS  47           H        LYS  47   1.802  -0.517  -5.034
  410    HA   LYS  47           HA       LYS  47   4.451   0.737  -5.167
  411   1HB   LYS  47          1HB       LYS  47   4.287  -0.973  -6.638
  412   2HB   LYS  47          2HB       LYS  47   2.646  -0.646  -7.075
  413   1HG   LYS  47          1HG       LYS  47   4.488   1.547  -7.846
  414   2HG   LYS  47          2HG       LYS  47   4.930  -0.020  -8.545
  415   1HD   LYS  47          1HD       LYS  47   2.801  -0.274  -9.607
  416   2HD   LYS  47          2HD       LYS  47   2.144   1.146  -8.767
  417   1HE   LYS  47          1HE       LYS  47   3.780   2.607  -9.914
  418   2HE   LYS  47          2HE       LYS  47   4.413   1.197 -10.796
  419   1HZ   LYS  47          1HZ       LYS  47   2.776   2.323 -12.125
  420   2HZ   LYS  47          2HZ       LYS  47   1.604   2.092 -10.932
  421    H    ASN  48           H        ASN  48   3.863   2.622  -4.030
  422    HA   ASN  48           HA       ASN  48   2.182   4.570  -5.512
  423   1HB   ASN  48          1HB       ASN  48   1.655   4.083  -3.122
  424   2HB   ASN  48          2HB       ASN  48   3.239   4.691  -2.666
  425   1HD2  ASN  48          2HD2      ASN  48   1.379   5.999  -1.378
  426   2HD2  ASN  48          1HD2      ASN  48   0.963   7.529  -2.103
  427    H    LEU  49           H        LEU  49   4.262   4.213  -6.973
  428    HA   LEU  49           HA       LEU  49   6.679   5.658  -6.381
  429   1HB   LEU  49          1HB       LEU  49   5.312   4.684  -8.893
  430   2HB   LEU  49          2HB       LEU  49   6.892   5.474  -8.932
  431    HG   LEU  49           HG       LEU  49   6.373   2.983  -7.282
  432   1HD1  LEU  49          1HD1      LEU  49   6.382   1.722  -9.120
  433   2HD1  LEU  49          2HD1      LEU  49   6.275   3.155 -10.132
  434   3HD1  LEU  49          3HD1      LEU  49   7.861   2.479  -9.739
  435   1HD2  LEU  49          1HD2      LEU  49   8.811   2.716  -7.420
  436   2HD2  LEU  49          2HD2      LEU  49   8.942   4.175  -8.425
  437   3HD2  LEU  49          3HD2      LEU  49   8.437   4.302  -6.730
  438    HA   PRO  50           HA       PRO  50   4.082   9.309  -6.837
  439   1HB   PRO  50          1HB       PRO  50   5.530  11.183  -5.615
  440   2HB   PRO  50          2HB       PRO  50   4.955   9.726  -4.763
  441   1HG   PRO  50          1HG       PRO  50   7.691  10.084  -6.045
  442   2HG   PRO  50          2HG       PRO  50   7.343   9.656  -4.341
  443   1HD   PRO  50          1HD       PRO  50   7.792   7.729  -6.228
  444   2HD   PRO  50          2HD       PRO  50   6.572   7.511  -4.944
  445    H    ASP  51           H        ASP  51   4.635   8.768  -9.244
  446    HA   ASP  51           HA       ASP  51   4.773  11.217 -10.611
  447   1HB   ASP  51          1HB       ASP  51   7.253  11.011 -10.274
  448   2HB   ASP  51          2HB       ASP  51   7.207   9.418 -11.035
  449    HD2  ASP  51           HD       ASP  51   8.128  11.180 -13.894
  450    H    GLY  52           H        GLY  52   2.790   9.443 -10.503
  451   1HA   GLY  52          1HA       GLY  52   2.135   8.787 -13.107
  452   2HA   GLY  52          2HA       GLY  52   2.902   7.324 -12.460
  453    H    SER  53           H        SER  53   1.618   5.952 -11.346
  454    HA   SER  53           HA       SER  53  -0.947   6.913 -10.136
  455   1HB   SER  53          1HB       SER  53  -0.453   4.373 -11.726
  456   2HB   SER  53          2HB       SER  53  -1.961   4.861 -10.938
  457    HG   SER  53           HG       SER  53  -1.728   6.841 -12.271
  458    H    VAL  54           H        VAL  54  -1.757   5.570  -8.420
  459    HA   VAL  54           HA       VAL  54   0.279   3.919  -7.014
  460    HB   VAL  54           HB       VAL  54  -0.033   5.789  -5.818
  461   1HG1  VAL  54          1HG1      VAL  54  -3.055   5.466  -5.813
  462   2HG1  VAL  54          2HG1      VAL  54  -2.106   6.691  -4.958
  463   3HG1  VAL  54          3HG1      VAL  54  -2.156   6.685  -6.729
  464   1HG2  VAL  54          1HG2      VAL  54  -1.828   3.747  -4.447
  465   2HG2  VAL  54          2HG2      VAL  54  -0.067   3.592  -4.593
  466   3HG2  VAL  54          3HG2      VAL  54  -0.777   4.951  -3.693
  467    H    GLU  55           H        GLU  55  -0.205   1.988  -7.987
  468    HA   GLU  55           HA       GLU  55  -2.882   0.804  -7.489
  469   1HB   GLU  55          1HB       GLU  55  -1.999  -1.141  -8.686
  470   2HB   GLU  55          2HB       GLU  55  -2.243   0.345  -9.622
  471   1HG   GLU  55          1HG       GLU  55   0.119   0.765  -9.720
  472   2HG   GLU  55          2HG       GLU  55   0.463  -0.561  -8.579
  473    HE2  GLU  55           HE       GLU  55  -0.690  -1.496 -12.372
  474    H    VAL  56           H        VAL  56  -3.233  -0.601  -5.877
  475    HA   VAL  56           HA       VAL  56  -0.966  -1.604  -4.205
  476    HB   VAL  56           HB       VAL  56  -3.930  -1.330  -3.574
  477   1HG1  VAL  56          1HG1      VAL  56  -1.556  -2.198  -1.876
  478   2HG1  VAL  56          2HG1      VAL  56  -3.206  -1.923  -1.272
  479   3HG1  VAL  56          3HG1      VAL  56  -2.897  -3.242  -2.400
  480   1HG2  VAL  56          1HG2      VAL  56  -1.515   0.267  -2.608
  481   2HG2  VAL  56          2HG2      VAL  56  -2.839   0.881  -3.621
  482   3HG2  VAL  56          3HG2      VAL  56  -3.159   0.398  -1.951
  483    H    VAL  57           H        VAL  57  -0.586  -3.776  -4.240
  484    HA   VAL  57           HA       VAL  57  -2.643  -5.601  -5.439
  485    HB   VAL  57           HB       VAL  57   0.384  -5.881  -5.612
  486   1HG1  VAL  57          1HG1      VAL  57  -1.915  -7.450  -6.884
  487   2HG1  VAL  57          2HG1      VAL  57  -0.190  -7.697  -7.212
  488   3HG1  VAL  57          3HG1      VAL  57  -0.838  -8.053  -5.608
  489   1HG2  VAL  57          1HG2      VAL  57  -1.636  -5.050  -7.742
  490   2HG2  VAL  57          2HG2      VAL  57  -0.337  -4.037  -7.076
  491   3HG2  VAL  57          3HG2      VAL  57   0.066  -5.460  -8.038
  492    H    ALA  58           H        ALA  58  -3.495  -5.622  -3.271
  493    HA   ALA  58           HA       ALA  58  -1.916  -6.848  -1.097
  494   1HB   ALA  58          1HB       ALA  58  -4.027  -6.554   0.161
  495   2HB   ALA  58          2HB       ALA  58  -3.540  -5.032  -0.625
  496   3HB   ALA  58          3HB       ALA  58  -4.811  -6.020  -1.321
  497    H    GLU  59           H        GLU  59  -2.619  -8.937  -0.177
  498    HA   GLU  59           HA       GLU  59  -4.214 -10.623  -2.014
  499   1HB   GLU  59          1HB       GLU  59  -1.899 -11.412  -0.253
  500   2HB   GLU  59          2HB       GLU  59  -2.774 -12.396  -1.437
  501   1HG   GLU  59          1HG       GLU  59  -2.090 -10.721  -3.211
  502   2HG   GLU  59          2HG       GLU  59  -1.012 -10.024  -2.006
  503    HE2  GLU  59           HE       GLU  59  -0.041 -13.371  -3.982
  504    H    GLY  60           H        GLY  60  -6.272 -11.115  -1.023
  505   1HA   GLY  60          1HA       GLY  60  -6.203 -12.286   1.701
  506   2HA   GLY  60          2HA       GLY  60  -7.178 -10.840   1.474
  507    H    TYR  61           H        TYR  61  -7.856 -13.604   2.213
  508    HA   TYR  61           HA       TYR  61  -9.038 -15.220   0.340
  509   1HB   TYR  61          1HB       TYR  61  -9.494 -14.613   3.260
  510   2HB   TYR  61          2HB       TYR  61 -10.575 -15.732   2.459
  511    HD1  TYR  61           1HD      TYR  61 -10.049 -18.025   2.266
  512    HD2  TYR  61           2HD      TYR  61  -6.975 -15.190   3.336
  513    HE1  TYR  61           1HE      TYR  61  -8.809 -19.807   3.443
  514    HE2  TYR  61           2HE      TYR  61  -5.728 -16.984   4.488
  515    HH   TYR  61           HH       TYR  61  -5.691 -19.199   5.102
  516    H    GLU  62           H        GLU  62 -11.213 -13.624   2.628
  517    HA   GLU  62           HA       GLU  62 -13.167 -12.727   0.594
  518   1HB   GLU  62          1HB       GLU  62 -13.477 -15.106   2.458
  519   2HB   GLU  62          2HB       GLU  62 -14.847 -14.199   1.773
  520   1HG   GLU  62          1HG       GLU  62 -14.010 -14.755  -0.525
  521   2HG   GLU  62          2HG       GLU  62 -12.739 -15.752   0.211
  522    HE2  GLU  62           HE       GLU  62 -16.580 -17.036   0.222
  523    H    GLU  63           H        GLU  63 -13.527 -13.840   4.022
  524    HA   GLU  63           HA       GLU  63 -14.381 -11.575   5.255
  525   1HB   GLU  63          1HB       GLU  63 -12.398 -13.659   6.207
  526   2HB   GLU  63          2HB       GLU  63 -13.140 -12.416   7.227
  527   1HG   GLU  63          1HG       GLU  63 -15.383 -13.287   6.687
  528   2HG   GLU  63          2HG       GLU  63 -14.671 -14.502   5.614
  529    HE2  GLU  63           HE       GLU  63 -13.973 -14.912   9.607
  530    H    ALA  64           H        ALA  64 -10.976 -12.579   4.608
  531    HA   ALA  64           HA       ALA  64  -9.759 -10.175   5.587
  532   1HB   ALA  64          1HB       ALA  64  -7.705 -11.240   4.848
  533   2HB   ALA  64          2HB       ALA  64  -8.731 -12.457   5.608
  534   3HB   ALA  64          3HB       ALA  64  -8.614 -12.382   3.838
  535    H    LEU  65           H        LEU  65 -11.130 -11.127   2.511
  536    HA   LEU  65           HA       LEU  65  -9.736  -9.177   0.861
  537   1HB   LEU  65          1HB       LEU  65 -10.717 -11.132  -0.108
  538   2HB   LEU  65          2HB       LEU  65 -12.329 -10.675   0.455
  539    HG   LEU  65           HG       LEU  65 -12.448  -8.813  -0.996
  540   1HD1  LEU  65          1HD1      LEU  65 -10.611  -8.398  -2.684
  541   2HD1  LEU  65          2HD1      LEU  65 -10.167  -7.996  -1.022
  542   3HD1  LEU  65          3HD1      LEU  65  -9.580  -9.512  -1.744
  543   1HD2  LEU  65          1HD2      LEU  65 -12.363 -10.023  -3.141
  544   2HD2  LEU  65          2HD2      LEU  65 -11.307 -11.255  -2.408
  545   3HD2  LEU  65          3HD2      LEU  65 -12.984 -11.075  -1.843
  546    H    SER  66           H        SER  66 -13.158  -9.348   1.862
  547    HA   SER  66           HA       SER  66 -14.011  -6.787   1.531
  548   1HB   SER  66          1HB       SER  66 -15.731  -7.286   3.179
  549   2HB   SER  66          2HB       SER  66 -15.441  -8.657   2.092
  550    HG   SER  66           HG       SER  66 -14.109  -9.548   3.766
  551    H    LYS  67           H        LYS  67 -12.097  -7.931   4.365
  552    HA   LYS  67           HA       LYS  67 -12.538  -5.571   5.905
  553   1HB   LYS  67          1HB       LYS  67 -10.913  -8.015   6.148
  554   2HB   LYS  67          2HB       LYS  67 -10.063  -6.574   6.690
  555   1HG   LYS  67          1HG       LYS  67 -11.262  -7.483   8.577
  556   2HG   LYS  67          2HG       LYS  67 -11.989  -5.941   8.106
  557   1HD   LYS  67          1HD       LYS  67 -13.731  -7.380   6.794
  558   2HD   LYS  67          2HD       LYS  67 -13.010  -8.770   7.614
  559   1HE   LYS  67          1HE       LYS  67 -14.959  -8.087   8.858
  560   2HE   LYS  67          2HE       LYS  67 -13.530  -7.667   9.825
  561   1HZ   LYS  67          1HZ       LYS  67 -15.039  -5.811   9.777
  562   2HZ   LYS  67          2HZ       LYS  67 -14.970  -5.754   8.090
  563    H    LEU  68           H        LEU  68  -9.798  -6.375   3.654
  564    HA   LEU  68           HA       LEU  68  -8.586  -3.816   4.236
  565   1HB   LEU  68          1HB       LEU  68  -7.409  -5.928   3.652
  566   2HB   LEU  68          2HB       LEU  68  -7.986  -5.778   1.988
  567    HG   LEU  68           HG       LEU  68  -5.589  -5.078   2.764
  568   1HD1  LEU  68          1HD1      LEU  68  -5.423  -3.356   0.970
  569   2HD1  LEU  68          2HD1      LEU  68  -6.235  -4.846   0.492
  570   3HD1  LEU  68          3HD1      LEU  68  -7.190  -3.376   0.826
  571   1HD2  LEU  68          1HD2      LEU  68  -5.232  -2.781   3.283
  572   2HD2  LEU  68          2HD2      LEU  68  -6.949  -2.397   3.159
  573   3HD2  LEU  68          3HD2      LEU  68  -6.357  -3.428   4.495
  574    H    LEU  69           H        LEU  69 -11.086  -4.934   2.086
  575    HA   LEU  69           HA       LEU  69 -10.846  -2.705   0.268
  576   1HB   LEU  69          1HB       LEU  69 -12.665  -5.046   0.721
  577   2HB   LEU  69          2HB       LEU  69 -13.510  -3.635   0.128
  578    HG   LEU  69           HG       LEU  69 -12.794  -5.261  -1.605
  579   1HD1  LEU  69          1HD1      LEU  69 -12.064  -3.575  -3.226
  580   2HD1  LEU  69          2HD1      LEU  69 -13.291  -2.887  -2.145
  581   3HD1  LEU  69          3HD1      LEU  69 -11.571  -2.485  -1.917
  582   1HD2  LEU  69          1HD2      LEU  69 -10.512  -5.438  -2.319
  583   2HD2  LEU  69          2HD2      LEU  69  -9.995  -4.191  -1.171
  584   3HD2  LEU  69          3HD2      LEU  69 -10.546  -5.766  -0.573
  585    H    GLU  70           H        GLU  70 -13.130  -3.528   2.927
  586    HA   GLU  70           HA       GLU  70 -14.512  -1.080   2.735
  587   1HB   GLU  70          1HB       GLU  70 -15.774  -1.785   4.572
  588   2HB   GLU  70          2HB       GLU  70 -15.333  -3.249   3.686
  589   1HG   GLU  70          1HG       GLU  70 -13.423  -3.537   5.343
  590   2HG   GLU  70          2HG       GLU  70 -14.123  -2.223   6.295
  591    HE2  GLU  70           HE       GLU  70 -16.853  -4.143   7.398
  592    H    ARG  71           H        ARG  71 -11.688  -2.021   4.660
  593    HA   ARG  71           HA       ARG  71 -11.083   0.181   6.225
  594   1HB   ARG  71          1HB       ARG  71  -9.458  -1.449   6.244
  595   2HB   ARG  71          2HB       ARG  71  -9.593  -1.737   4.516
  596   1HG   ARG  71          1HG       ARG  71  -7.413  -0.943   4.983
  597   2HG   ARG  71          2HG       ARG  71  -8.270   0.182   3.959
  598   1HD   ARG  71          1HD       ARG  71  -8.704   1.526   6.187
  599   2HD   ARG  71          2HD       ARG  71  -7.511   0.454   6.876
  600    HE   ARG  71           HE       ARG  71  -5.807   1.464   5.705
  601   1HH1  ARG  71          1HH1      ARG  71  -8.945   2.595   4.524
  602   2HH1  ARG  71          2HH1      ARG  71  -8.274   3.809   3.477
  603   1HH2  ARG  71          1HH2      ARG  71  -4.932   3.013   4.178
  604   2HH2  ARG  71          2HH2      ARG  71  -6.001   3.960   3.196
  605    H    ILE  72           H        ILE  72 -10.645  -0.068   2.650
  606    HA   ILE  72           HA       ILE  72  -9.826   2.707   2.402
  607    HB   ILE  72           HB       ILE  72 -10.522   0.633   0.342
  608   1HG1  ILE  72          1HG1      ILE  72  -7.849   1.998   0.932
  609   2HG1  ILE  72          2HG1      ILE  72  -8.337   0.558   1.804
  610   1HG2  ILE  72          1HG2      ILE  72  -9.568   2.323  -1.287
  611   2HG2  ILE  72          2HG2      ILE  72 -11.119   2.791  -0.606
  612   3HG2  ILE  72          3HG2      ILE  72  -9.628   3.529   0.009
  613   1HD1  ILE  72          1HD1      ILE  72  -6.960  -0.078  -0.101
  614   2HD1  ILE  72          2HD1      ILE  72  -8.605  -0.728  -0.258
  615   3HD1  ILE  72          3HD1      ILE  72  -8.105   0.672  -1.227
  616    H    LYS  73           H        LYS  73 -12.837   1.022   1.424
  617    HA   LYS  73           HA       LYS  73 -13.996   3.269   0.389
  618   1HB   LYS  73          1HB       LYS  73 -15.238   0.761   1.471
  619   2HB   LYS  73          2HB       LYS  73 -16.216   2.100   0.861
  620   1HG   LYS  73          1HG       LYS  73 -15.921   0.664  -0.972
  621   2HG   LYS  73          2HG       LYS  73 -14.921   2.087  -1.276
  622   1HD   LYS  73          1HD       LYS  73 -12.921   0.702  -0.461
  623   2HD   LYS  73          2HD       LYS  73 -14.008  -0.701  -0.448
  624   1HE   LYS  73          1HE       LYS  73 -13.282   1.101  -2.811
  625   2HE   LYS  73          2HE       LYS  73 -12.594  -0.488  -2.489
  626   1HZ   LYS  73          1HZ       LYS  73 -14.366  -0.718  -4.059
  627   2HZ   LYS  73          2HZ       LYS  73 -15.468  -0.019  -2.992
  628    H    GLN  74           H        GLN  74 -14.178   2.190   3.799
  629    HA   GLN  74           HA       GLN  74 -15.853   4.418   4.662
  630   1HB   GLN  74          1HB       GLN  74 -14.186   2.411   6.234
  631   2HB   GLN  74          2HB       GLN  74 -15.302   3.582   6.937
  632   1HG   GLN  74          1HG       GLN  74 -16.040   1.289   5.062
  633   2HG   GLN  74          2HG       GLN  74 -16.352   1.378   6.798
  634   1HE2  GLN  74          1HE2      GLN  74 -17.481   3.727   7.343
  635   2HE2  GLN  74          2HE2      GLN  74 -18.912   4.008   6.373
  636    H    GLY  75           H        GLY  75 -12.345   3.685   4.594
  637   1HA   GLY  75          1HA       GLY  75 -11.734   6.411   5.701
  638   2HA   GLY  75          2HA       GLY  75 -10.734   4.971   5.814
  639    HA   PRO  76           HA       PRO  76 -10.459   6.175   1.192
  640   1HB   PRO  76          1HB       PRO  76 -11.572   8.518   0.260
  641   2HB   PRO  76          2HB       PRO  76 -12.514   7.015   0.479
  642   1HG   PRO  76          1HG       PRO  76 -12.228   9.334   2.420
  643   2HG   PRO  76          2HG       PRO  76 -13.745   8.601   1.814
  644   1HD   PRO  76          1HD       PRO  76 -12.692   7.842   4.184
  645   2HD   PRO  76          2HD       PRO  76 -13.383   6.625   3.059
  646    HA   PRO  77           HA       PRO  77  -7.018   9.006   1.675
  647   1HB   PRO  77          1HB       PRO  77  -6.230   9.509  -0.894
  648   2HB   PRO  77          2HB       PRO  77  -6.038   7.919  -0.126
  649   1HG   PRO  77          1HG       PRO  77  -8.173   8.784  -2.023
  650   2HG   PRO  77          2HG       PRO  77  -7.296   7.234  -1.983
  651   1HD   PRO  77          1HD       PRO  77  -9.836   7.683  -0.942
  652   2HD   PRO  77          2HD       PRO  77  -8.746   6.404  -0.358
  653    H    ALA  78           H        ALA  78  -7.034  11.131   2.200
  654    HA   ALA  78           HA       ALA  78  -9.197  12.860   1.300
  655   1HB   ALA  78          1HB       ALA  78  -8.287  14.404   2.978
  656   2HB   ALA  78          2HB       ALA  78  -8.546  12.783   3.653
  657   3HB   ALA  78          3HB       ALA  78  -6.902  13.318   3.242
  658    H    ALA  79           H        ALA  79  -8.179  12.560  -1.016
  659    HA   ALA  79           HA       ALA  79  -6.782  15.042  -1.690
  660   1HB   ALA  79          1HB       ALA  79  -5.014  13.777  -2.934
  661   2HB   ALA  79          2HB       ALA  79  -4.839  13.880  -1.176
  662   3HB   ALA  79          3HB       ALA  79  -5.423  12.367  -1.927
  663    H    GLU  80           H        GLU  80  -8.988  15.068  -2.635
  664    HA   GLU  80           HA       GLU  80 -10.665  14.473  -4.077
  665   1HB   GLU  80          1HB       GLU  80  -9.125  16.305  -5.032
  666   2HB   GLU  80          2HB       GLU  80  -8.521  15.092  -6.158
  667   1HG   GLU  80          1HG       GLU  80 -11.421  16.021  -5.841
  668   2HG   GLU  80          2HG       GLU  80 -10.307  16.506  -7.120
  669    HE2  GLU  80           HE       GLU  80 -12.094  12.883  -7.243
  670    H    VAL  81           H        VAL  81 -10.628  12.188  -3.410
  671    HA   VAL  81           HA       VAL  81  -9.282  10.273  -5.059
  672    HB   VAL  81           HB       VAL  81  -9.836   9.861  -2.776
  673   1HG1  VAL  81          1HG1      VAL  81 -12.764   9.464  -3.375
  674   2HG1  VAL  81          2HG1      VAL  81 -11.920   9.359  -1.844
  675   3HG1  VAL  81          3HG1      VAL  81 -12.100  10.936  -2.617
  676   1HG2  VAL  81          1HG2      VAL  81 -11.269   7.924  -4.669
  677   2HG2  VAL  81          2HG2      VAL  81  -9.522   7.967  -4.384
  678   3HG2  VAL  81          3HG2      VAL  81 -10.626   7.510  -3.076
  679    H    GLU  82           H        GLU  82  -9.748  10.885  -7.151
  680    HA   GLU  82           HA       GLU  82 -12.065  11.358  -8.378
  681   1HB   GLU  82          1HB       GLU  82  -9.932  11.483  -9.469
  682   2HB   GLU  82          2HB       GLU  82  -9.771   9.723  -9.480
  683   1HG   GLU  82          1HG       GLU  82 -10.462  10.593 -11.682
  684   2HG   GLU  82          2HG       GLU  82 -11.696   9.529 -11.005
  685    HE2  GLU  82           HE       GLU  82 -12.455  13.539 -11.088
  686    H    LYS  83           H        LYS  83 -10.658   8.045  -8.073
  687    HA   LYS  83           HA       LYS  83 -13.082   6.875  -7.190
  688   1HB   LYS  83          1HB       LYS  83 -13.532   5.343  -9.088
  689   2HB   LYS  83          2HB       LYS  83 -13.878   7.022  -9.478
  690   1HG   LYS  83          1HG       LYS  83 -11.616   7.141 -10.655
  691   2HG   LYS  83          2HG       LYS  83 -11.418   5.416 -10.315
  692   1HD   LYS  83          1HD       LYS  83 -12.170   5.569 -12.531
  693   2HD   LYS  83          2HD       LYS  83 -13.545   4.972 -11.586
  694   1HE   LYS  83          1HE       LYS  83 -14.554   7.241 -11.609
  695   2HE   LYS  83          2HE       LYS  83 -13.119   7.881 -12.440
  696   1HZ   LYS  83          1HZ       LYS  83 -14.819   7.397 -14.036
  697   2HZ   LYS  83          2HZ       LYS  83 -14.862   5.779 -13.557
  698    H    VAL  84           H        VAL  84 -12.543   4.980  -6.072
  699    HA   VAL  84           HA       VAL  84  -9.963   3.658  -6.738
  700    HB   VAL  84           HB       VAL  84 -10.103   4.020  -4.533
  701   1HG1  VAL  84          1HG1      VAL  84 -12.904   2.869  -4.472
  702   2HG1  VAL  84          2HG1      VAL  84 -11.891   3.186  -3.043
  703   3HG1  VAL  84          3HG1      VAL  84 -12.382   4.523  -4.085
  704   1HG2  VAL  84          1HG2      VAL  84 -10.911   1.105  -4.843
  705   2HG2  VAL  84          2HG2      VAL  84  -9.339   1.764  -5.338
  706   3HG2  VAL  84          3HG2      VAL  84  -9.835   1.827  -3.640
  707    H    ASP  85           H        ASP  85 -10.557   2.919  -8.829
  708    HA   ASP  85           HA       ASP  85 -12.899   1.150  -9.131
  709   1HB   ASP  85          1HB       ASP  85 -12.530   2.842 -10.820
  710   2HB   ASP  85          2HB       ASP  85 -10.884   2.269 -11.103
  711    HD2  ASP  85           HD       ASP  85 -13.868  -0.263 -12.233
  712    H    TYR  86           H        TYR  86 -11.927  -0.392  -7.555
  713    HA   TYR  86           HA       TYR  86  -9.443  -1.640  -8.186
  714   1HB   TYR  86          1HB       TYR  86  -9.835  -3.093  -6.352
  715   2HB   TYR  86          2HB       TYR  86 -10.453  -1.512  -5.886
  716    HD1  TYR  86           1HD      TYR  86 -11.164  -5.048  -6.366
  717    HD2  TYR  86           2HD      TYR  86 -13.008  -1.169  -5.922
  718    HE1  TYR  86           1HE      TYR  86 -13.282  -6.126  -5.685
  719    HE2  TYR  86           2HE      TYR  86 -15.145  -2.261  -5.314
  720    HH   TYR  86           HH       TYR  86 -16.197  -4.235  -4.808
  721    H    SER  87           H        SER  87  -9.162  -3.988  -8.646
  722    HA   SER  87           HA       SER  87 -11.340  -5.369 -10.037
  723   1HB   SER  87          1HB       SER  87  -8.753  -4.657 -11.483
  724   2HB   SER  87          2HB       SER  87 -10.071  -5.689 -12.085
  725    HG   SER  87           HG       SER  87 -11.327  -3.585 -11.494
  726    H    PHE  88           H        PHE  88 -11.200  -6.970  -8.510
  727    HA   PHE  88           HA       PHE  88  -8.830  -7.991  -7.430
  728   1HB   PHE  88          1HB       PHE  88 -10.213  -9.220  -6.169
  729   2HB   PHE  88          2HB       PHE  88 -11.442  -8.170  -6.799
  730    HD1  PHE  88           1HD      PHE  88 -10.128 -11.573  -6.741
  731    HD2  PHE  88           2HD      PHE  88 -12.943  -8.962  -8.693
  732    HE1  PHE  88           1HE      PHE  88 -11.229 -13.541  -7.785
  733    HE2  PHE  88           2HE      PHE  88 -14.055 -10.930  -9.719
  734    HZ   PHE  88           HZ       PHE  88 -13.184 -13.218  -9.285
  735    H    SER  89           H        SER  89  -7.519  -9.818  -7.963
  736    HA   SER  89           HA       SER  89  -8.002 -11.060 -10.627
  737   1HB   SER  89          1HB       SER  89  -5.290 -10.156  -9.677
  738   2HB   SER  89          2HB       SER  89  -5.796 -10.618 -11.305
  739    HG   SER  89           HG       SER  89  -7.243  -8.724 -11.151
  740    H    GLU  90           H        GLU  90  -6.188 -12.831 -10.965
  741    HA   GLU  90           HA       GLU  90  -6.420 -14.776  -8.803
  742   1HB   GLU  90          1HB       GLU  90  -7.077 -15.428 -11.009
  743   2HB   GLU  90          2HB       GLU  90  -5.669 -14.659 -11.749
  744   1HG   GLU  90          1HG       GLU  90  -5.455 -16.981 -11.819
  745   2HG   GLU  90          2HG       GLU  90  -4.162 -16.295 -10.828
  746    HE2  GLU  90           HE       GLU  90  -7.118 -18.415  -8.944
  747    H    TYR  91           H        TYR  91  -4.696 -14.951  -7.341
  748    HA   TYR  91           HA       TYR  91  -2.409 -13.494  -7.425
  749   1HB   TYR  91          1HB       TYR  91  -1.607 -14.722  -5.665
  750   2HB   TYR  91          2HB       TYR  91  -3.342 -14.610  -5.489
  751    HD1  TYR  91           1HD      TYR  91  -0.537 -16.781  -5.330
  752    HD2  TYR  91           2HD      TYR  91  -4.742 -16.736  -6.308
  753    HE1  TYR  91           1HE      TYR  91  -0.685 -19.194  -4.831
  754    HE2  TYR  91           2HE      TYR  91  -4.870 -19.151  -5.851
  755    HH   TYR  91           HH       TYR  91  -3.755 -21.029  -5.103
  756    H    LYS  92           H        LYS  92  -0.654 -13.473  -8.651
  757    HA   LYS  92           HA       LYS  92   0.147 -15.567 -10.463
  758   1HB   LYS  92          1HB       LYS  92   0.692 -13.234 -10.893
  759   2HB   LYS  92          2HB       LYS  92   1.542 -13.101  -9.349
  760   1HG   LYS  92          1HG       LYS  92   3.120 -13.270 -11.167
  761   2HG   LYS  92          2HG       LYS  92   3.267 -14.679 -10.115
  762   1HD   LYS  92          1HD       LYS  92   2.058 -16.076 -11.731
  763   2HD   LYS  92          2HD       LYS  92   1.638 -14.652 -12.701
  764   1HE   LYS  92          1HE       LYS  92   3.469 -15.900 -13.743
  765   2HE   LYS  92          2HE       LYS  92   4.019 -14.290 -13.243
  766   1HZ   LYS  92          1HZ       LYS  92   5.619 -15.933 -12.577
  767   2HZ   LYS  92          2HZ       LYS  92   4.460 -16.734 -11.645
  768    H    GLY  93           H        GLY  93   1.241 -14.380  -7.250
  769   1HA   GLY  93          1HA       GLY  93   1.915 -17.017  -6.338
  770   2HA   GLY  93          2HA       GLY  93   3.362 -16.057  -6.721
  771    H    GLU  94           H        GLU  94   3.865 -16.134  -4.439
  772    HA   GLU  94           HA       GLU  94   2.166 -14.677  -2.538
  773   1HB   GLU  94          1HB       GLU  94   3.936 -15.303  -0.938
  774   2HB   GLU  94          2HB       GLU  94   2.965 -16.607  -1.618
  775   1HG   GLU  94          1HG       GLU  94   4.785 -17.329  -3.047
  776   2HG   GLU  94          2HG       GLU  94   5.767 -15.925  -2.595
  777    HE2  GLU  94           HE       GLU  94   7.200 -18.362  -0.498
  778    H    PHE  95           H        PHE  95   2.249 -12.529  -2.775
  779    HA   PHE  95           HA       PHE  95   4.676 -11.032  -3.480
  780   1HB   PHE  95          1HB       PHE  95   1.868 -10.247  -2.616
  781   2HB   PHE  95          2HB       PHE  95   3.177  -9.116  -2.835
  782    HD1  PHE  95           1HD      PHE  95   3.219  -7.902  -4.793
  783    HD2  PHE  95           2HD      PHE  95   1.624 -11.911  -4.868
  784    HE1  PHE  95           1HE      PHE  95   2.867  -7.724  -7.232
  785    HE2  PHE  95           2HE      PHE  95   1.296 -11.734  -7.306
  786    HZ   PHE  95           HZ       PHE  95   1.938  -9.647  -8.504
  787    H    GLU  96           H        GLU  96   5.858 -12.186  -1.702
  788    HA   GLU  96           HA       GLU  96   5.357 -12.317   0.930
  789   1HB   GLU  96          1HB       GLU  96   8.013 -11.711  -0.416
  790   2HB   GLU  96          2HB       GLU  96   7.843 -12.231   1.270
  791   1HG   GLU  96          1HG       GLU  96   6.710 -14.317   0.511
  792   2HG   GLU  96          2HG       GLU  96   6.946 -13.830  -1.173
  793    HE2  GLU  96           HE       GLU  96  10.184 -14.947   1.015
  794    H    ASP  97           H        ASP  97   5.318 -11.074   2.731
  795    HA   ASP  97           HA       ASP  97   5.259  -9.255   4.096
  796   1HB   ASP  97          1HB       ASP  97   7.219  -7.843   2.247
  797   2HB   ASP  97          2HB       ASP  97   6.821  -7.451   3.915
  798    HD2  ASP  97           HD       ASP  97   9.557 -10.251   3.157
  799    H    PHE  98           H        PHE  98   5.016  -6.532   3.577
  800    HA   PHE  98           HA       PHE  98   3.532  -6.169   1.096
  801   1HB   PHE  98          1HB       PHE  98   1.854  -7.074   2.697
  802   2HB   PHE  98          2HB       PHE  98   2.091  -5.671   3.709
  803    HD1  PHE  98           1HD      PHE  98   2.304  -4.093   0.624
  804    HD2  PHE  98           2HD      PHE  98  -0.499  -6.303   3.036
  805    HE1  PHE  98           1HE      PHE  98   0.458  -3.073  -0.606
  806    HE2  PHE  98           2HE      PHE  98  -2.377  -5.161   1.854
  807    HZ   PHE  98           HZ       PHE  98  -1.895  -3.592   0.009
  808    H    GLU  99           H        GLU  99   5.413  -4.852   0.736
  809    HA   GLU  99           HA       GLU  99   5.774  -2.541   2.591
  810   1HB   GLU  99          1HB       GLU  99   7.598  -4.082   2.410
  811   2HB   GLU  99          2HB       GLU  99   7.725  -3.799   0.674
  812   1HG   GLU  99          1HG       GLU  99   8.323  -1.439   1.080
  813   2HG   GLU  99          2HG       GLU  99   7.980  -1.624   2.807
  814    HE2  GLU  99           HE       GLU  99  11.389  -3.145   1.183
  815    H    THR 100           H        THR 100   6.375  -0.500   1.625
  816    HA   THR 100           HA       THR 100   4.702   0.074  -0.712
  817    HB   THR 100           HB       THR 100   3.918   1.826   0.353
  818    HG1  THR 100           1HG      THR 100   5.097   3.102   1.820
  819   1HG2  THR 100          1HG2      THR 100   3.521   1.432   2.677
  820   2HG2  THR 100          2HG2      THR 100   3.746  -0.174   1.961
  821   3HG2  THR 100          3HG2      THR 100   5.052   0.569   2.888
  822    H    TYR 101           H        TYR 101   5.473   1.075  -2.518
  823    HA   TYR 101           HA       TYR 101   8.248   2.182  -2.606
  824   1HB   TYR 101          1HB       TYR 101   6.081   2.165  -4.733
  825   2HB   TYR 101          2HB       TYR 101   7.690   2.824  -4.922
  826    HD1  TYR 101           1HD      TYR 101   6.177   0.578  -6.562
  827    HD2  TYR 101           2HD      TYR 101   9.344   0.604  -3.650
  828    HE1  TYR 101           1HE      TYR 101   6.860  -1.685  -7.281
  829    HE2  TYR 101           2HE      TYR 101  10.108  -1.594  -4.458
  830    HH   TYR 101           HH       TYR 101   9.622  -3.402  -5.767
  Start of MODEL   15
    1   1H    GLY  -1          1H        GLY  -1 -14.487 -52.715   2.017
    2   2H    GLY  -1          2H        GLY  -1 -13.815 -51.204   2.044
    3   3H    GLY  -1          3H        GLY  -1 -15.017 -51.583   3.099
    4   1HA   GLY  -1          1HA       GLY  -1 -15.292 -51.429   0.184
    5   2HA   GLY  -1          2HA       GLY  -1 -16.588 -51.818   1.331
    6    H    SER   0           H        SER   0 -17.533 -49.893   0.078
    7    HA   SER   0           HA       SER   0 -16.575 -47.248   0.508
    8   1HB   SER   0          1HB       SER   0 -19.403 -48.233  -0.070
    9   2HB   SER   0          2HB       SER   0 -18.791 -46.584  -0.312
   10    HG   SER   0           HG       SER   0 -17.269 -47.488  -1.792
   11    H    MET   1           H        MET   1 -16.928 -45.810   2.147
   12    HA   MET   1           HA       MET   1 -18.847 -46.490   4.338
   13   1HB   MET   1          1HB       MET   1 -16.005 -45.414   4.620
   14   2HB   MET   1          2HB       MET   1 -17.233 -45.419   5.901
   15   1HG   MET   1          1HG       MET   1 -17.390 -47.893   5.715
   16   2HG   MET   1          2HG       MET   1 -16.153 -47.866   4.455
   17   1HE   MET   1          1HE       MET   1 -16.310 -45.926   8.018
   18   2HE   MET   1          2HE       MET   1 -15.445 -47.159   8.957
   19   3HE   MET   1          3HE       MET   1 -17.001 -47.559   8.195
   20    H    LYS   2           H        LYS   2 -16.700 -43.699   3.761
   21    HA   LYS   2           HA       LYS   2 -19.095 -41.935   3.417
   22   1HB   LYS   2          1HB       LYS   2 -16.443 -41.303   4.761
   23   2HB   LYS   2          2HB       LYS   2 -17.846 -40.232   4.643
   24   1HG   LYS   2          1HG       LYS   2 -17.728 -42.850   6.211
   25   2HG   LYS   2          2HG       LYS   2 -17.615 -41.218   6.872
   26   1HD   LYS   2          1HD       LYS   2 -19.903 -40.705   6.109
   27   2HD   LYS   2          2HD       LYS   2 -20.058 -42.336   5.424
   28   1HE   LYS   2          1HE       LYS   2 -19.715 -43.338   7.650
   29   2HE   LYS   2          2HE       LYS   2 -19.553 -41.718   8.364
   30   1HZ   LYS   2          1HZ       LYS   2 -21.800 -42.476   8.611
   31   2HZ   LYS   2          2HZ       LYS   2 -21.966 -42.647   6.939
   32    H    LYS   3           H        LYS   3 -18.169 -39.694   2.560
   33    HA   LYS   3           HA       LYS   3 -16.196 -40.064   0.408
   34   1HB   LYS   3          1HB       LYS   3 -17.693 -39.128  -1.268
   35   2HB   LYS   3          2HB       LYS   3 -18.272 -40.690  -0.698
   36   1HG   LYS   3          1HG       LYS   3 -19.370 -38.120   0.504
   37   2HG   LYS   3          2HG       LYS   3 -19.908 -38.690  -1.077
   38   1HD   LYS   3          1HD       LYS   3 -20.612 -40.858  -0.071
   39   2HD   LYS   3          2HD       LYS   3 -20.123 -40.270   1.524
   40   1HE   LYS   3          1HE       LYS   3 -22.507 -39.994   1.298
   41   2HE   LYS   3          2HE       LYS   3 -21.733 -38.399   1.353
   42   1HZ   LYS   3          1HZ       LYS   3 -23.331 -38.443  -0.419
   43   2HZ   LYS   3          2HZ       LYS   3 -22.546 -39.752  -1.147
   44    H    TRP   4           H        TRP   4 -15.636 -38.048  -0.610
   45    HA   TRP   4           HA       TRP   4 -14.905 -35.920  -0.635
   46   1HB   TRP   4          1HB       TRP   4 -16.768 -35.123   1.598
   47   2HB   TRP   4          2HB       TRP   4 -15.983 -34.118   0.394
   48    HD1  TRP   4           HD       TRP   4 -16.806 -35.141  -2.288
   49    HE1  TRP   4           1HE      TRP   4 -19.256 -35.375  -3.079
   50    HE3  TRP   4           3HE      TRP   4 -19.145 -35.288   2.266
   51    HZ2  TRP   4           2HZ      TRP   4 -21.847 -35.617  -1.901
   52    HZ3  TRP   4           3HZ      TRP   4 -21.602 -35.522   2.396
   53    HH2  TRP   4           HH       TRP   4 -22.962 -35.706   0.325
   54    H    SER   5           H        SER   5 -13.221 -37.536   0.336
   55    HA   SER   5           HA       SER   5 -12.493 -37.189   3.125
   56   1HB   SER   5          1HB       SER   5 -12.124 -39.298   1.955
   57   2HB   SER   5          2HB       SER   5 -11.057 -38.500   0.782
   58    HG   SER   5           HG       SER   5  -9.683 -37.974   2.519
   59    H    ASP   6           H        ASP   6 -12.567 -34.780   2.823
   60    HA   ASP   6           HA       ASP   6 -11.582 -32.815   3.013
   61   1HB   ASP   6          1HB       ASP   6  -9.945 -34.114   4.347
   62   2HB   ASP   6          2HB       ASP   6  -8.953 -34.339   2.902
   63    HD2  ASP   6           HD       ASP   6  -7.179 -31.562   3.933
   64    H    THR   7           H        THR   7 -10.210 -31.150   1.955
   65    HA   THR   7           HA       THR   7  -9.558 -29.924   0.200
   66    HB   THR   7           HB       THR   7  -8.725 -32.553  -1.095
   67    HG1  THR   7           1HG      THR   7  -6.811 -32.177   0.036
   68   1HG2  THR   7          1HG2      THR   7  -6.957 -31.145  -2.099
   69   2HG2  THR   7          2HG2      THR   7  -8.560 -30.601  -2.614
   70   3HG2  THR   7          3HG2      THR   7  -7.678 -29.697  -1.364
   71    H    GLU   8           H        GLU   8 -11.771 -29.325  -0.084
   72    HA   GLU   8           HA       GLU   8 -12.826 -30.039  -2.772
   73   1HB   GLU   8          1HB       GLU   8 -14.078 -31.250  -0.941
   74   2HB   GLU   8          2HB       GLU   8 -14.543 -29.677  -0.278
   75   1HG   GLU   8          1HG       GLU   8 -15.645 -29.133  -2.478
   76   2HG   GLU   8          2HG       GLU   8 -15.183 -30.734  -3.075
   77    HE2  GLU   8           HE       GLU   8 -17.552 -32.432  -1.059
   78    H    VAL   9           H        VAL   9 -11.349 -28.108  -3.049
   79    HA   VAL   9           HA       VAL   9 -12.883 -25.647  -3.039
   80    HB   VAL   9           HB       VAL   9 -12.029 -25.633  -0.742
   81   1HG1  VAL   9          1HG1      VAL   9  -9.227 -25.824  -1.935
   82   2HG1  VAL   9          2HG1      VAL   9  -9.633 -25.563  -0.231
   83   3HG1  VAL   9          3HG1      VAL   9 -10.045 -27.097  -1.005
   84   1HG2  VAL   9          1HG2      VAL   9 -10.417 -23.653  -2.389
   85   2HG2  VAL   9          2HG2      VAL   9 -12.153 -23.490  -2.035
   86   3HG2  VAL   9          3HG2      VAL   9 -10.968 -23.481  -0.717
   87    H    PHE  10           H        PHE  10 -11.956 -24.075  -4.421
   88    HA   PHE  10           HA       PHE  10 -10.267 -25.250  -6.513
   89   1HB   PHE  10          1HB       PHE  10 -11.669 -22.557  -6.408
   90   2HB   PHE  10          2HB       PHE  10 -10.916 -23.306  -7.809
   91    HD1  PHE  10           1HD      PHE  10 -11.960 -25.350  -8.848
   92    HD2  PHE  10           2HD      PHE  10 -13.869 -23.217  -5.617
   93    HE1  PHE  10           1HE      PHE  10 -14.093 -26.513  -9.333
   94    HE2  PHE  10           2HE      PHE  10 -15.986 -24.411  -6.087
   95    HZ   PHE  10           HZ       PHE  10 -16.109 -26.050  -7.951
   96    H    GLU  11           H        GLU  11 -10.250 -22.014  -4.878
   97    HA   GLU  11           HA       GLU  11  -7.281 -22.111  -4.783
   98   1HB   GLU  11          1HB       GLU  11  -7.186 -19.794  -5.187
   99   2HB   GLU  11          2HB       GLU  11  -8.015 -20.589  -6.524
  100   1HG   GLU  11          1HG       GLU  11  -9.374 -19.011  -4.281
  101   2HG   GLU  11          2HG       GLU  11  -8.970 -18.396  -5.881
  102    HE2  GLU  11           HE       GLU  11 -12.299 -20.539  -5.383
  103    H    MET  12           H        MET  12  -6.352 -21.241  -2.942
  104    HA   MET  12           HA       MET  12  -7.965 -21.188  -0.503
  105   1HB   MET  12          1HB       MET  12  -5.009 -20.603  -0.965
  106   2HB   MET  12          2HB       MET  12  -5.825 -20.655   0.603
  107   1HG   MET  12          1HG       MET  12  -6.439 -23.009   0.243
  108   2HG   MET  12          2HG       MET  12  -5.715 -22.976  -1.366
  109   1HE   MET  12          1HE       MET  12  -4.067 -21.407   1.989
  110   2HE   MET  12          2HE       MET  12  -3.329 -22.906   2.587
  111   3HE   MET  12          3HE       MET  12  -5.098 -22.787   2.452
  112    H    LEU  13           H        LEU  13  -5.575 -18.748  -1.654
  113    HA   LEU  13           HA       LEU  13  -7.601 -16.597  -1.313
  114   1HB   LEU  13          1HB       LEU  13  -6.190 -15.299   0.001
  115   2HB   LEU  13          2HB       LEU  13  -6.122 -16.911   0.692
  116    HG   LEU  13           HG       LEU  13  -3.930 -17.043  -0.935
  117   1HD1  LEU  13          1HD1      LEU  13  -2.713 -14.872  -0.725
  118   2HD1  LEU  13          2HD1      LEU  13  -4.166 -14.670  -1.708
  119   3HD1  LEU  13          3HD1      LEU  13  -4.160 -14.124  -0.023
  120   1HD2  LEU  13          1HD2      LEU  13  -2.617 -16.493   1.094
  121   2HD2  LEU  13          2HD2      LEU  13  -4.082 -15.839   1.854
  122   3HD2  LEU  13          3HD2      LEU  13  -3.981 -17.570   1.449
  123    H    LYS  14           H        LYS  14  -7.168 -14.719  -2.548
  124    HA   LYS  14           HA       LYS  14  -5.446 -15.178  -4.950
  125   1HB   LYS  14          1HB       LYS  14  -7.209 -14.021  -6.192
  126   2HB   LYS  14          2HB       LYS  14  -7.655 -15.564  -5.503
  127   1HG   LYS  14          1HG       LYS  14  -9.439 -13.995  -5.362
  128   2HG   LYS  14          2HG       LYS  14  -8.909 -14.501  -3.744
  129   1HD   LYS  14          1HD       LYS  14  -7.792 -12.297  -3.442
  130   2HD   LYS  14          2HD       LYS  14  -8.216 -11.855  -5.107
  131   1HE   LYS  14          1HE       LYS  14  -9.743 -10.819  -3.532
  132   2HE   LYS  14          2HE       LYS  14 -10.637 -12.032  -4.464
  133   1HZ   LYS  14          1HZ       LYS  14 -11.141 -12.277  -2.129
  134   2HZ   LYS  14          2HZ       LYS  14  -9.509 -12.545  -1.776
  135    H    ARG  15           H        ARG  15  -5.352 -12.929  -6.205
  136    HA   ARG  15           HA       ARG  15  -4.139 -11.003  -4.312
  137   1HB   ARG  15          1HB       ARG  15  -2.949  -9.997  -5.997
  138   2HB   ARG  15          2HB       ARG  15  -2.661 -11.737  -5.945
  139   1HG   ARG  15          1HG       ARG  15  -4.124 -12.025  -7.886
  140   2HG   ARG  15          2HG       ARG  15  -4.431 -10.278  -7.970
  141   1HD   ARG  15          1HD       ARG  15  -2.216  -9.774  -8.573
  142   2HD   ARG  15          2HD       ARG  15  -1.608 -11.368  -8.089
  143    HE   ARG  15           HE       ARG  15  -3.307 -12.163  -9.931
  144   1HH1  ARG  15          2HH1      ARG  15  -1.011  -9.464 -10.246
  145   2HH1  ARG  15          1HH1      ARG  15  -0.720  -9.784 -11.936
  146   1HH2  ARG  15          1HH2      ARG  15  -2.892 -12.579 -12.068
  147   2HH2  ARG  15          2HH2      ARG  15  -1.811 -11.567 -12.993
  148    H    MET  16           H        MET  16  -5.204  -9.162  -3.779
  149    HA   MET  16           HA       MET  16  -7.477  -8.212  -5.416
  150   1HB   MET  16          1HB       MET  16  -7.952  -6.795  -3.617
  151   2HB   MET  16          2HB       MET  16  -8.062  -8.519  -3.260
  152   1HG   MET  16          1HG       MET  16  -6.241  -8.497  -1.806
  153   2HG   MET  16          2HG       MET  16  -5.606  -6.986  -2.447
  154   1HE   MET  16          1HE       MET  16  -6.194  -4.467  -1.326
  155   2HE   MET  16          2HE       MET  16  -7.908  -4.244  -1.023
  156   3HE   MET  16          3HE       MET  16  -7.372  -4.861  -2.595
  157    H    TYR  17           H        TYR  17  -6.589  -7.201  -7.132
  158    HA   TYR  17           HA       TYR  17  -4.393  -5.253  -6.877
  159   1HB   TYR  17          1HB       TYR  17  -4.170  -6.700  -8.705
  160   2HB   TYR  17          2HB       TYR  17  -5.862  -6.564  -9.146
  161    HD1  TYR  17           1HD      TYR  17  -3.133  -3.992  -8.565
  162    HD2  TYR  17           2HD      TYR  17  -6.132  -5.578 -11.232
  163    HE1  TYR  17           1HE      TYR  17  -2.438  -2.386 -10.311
  164    HE2  TYR  17           2HE      TYR  17  -5.493  -3.909 -12.936
  165    HH   TYR  17           HH       TYR  17  -3.976  -2.300 -13.548
  166    H    ALA  18           H        ALA  18  -4.986  -3.322  -6.103
  167    HA   ALA  18           HA       ALA  18  -7.531  -2.081  -7.017
  168   1HB   ALA  18          1HB       ALA  18  -7.590  -0.953  -4.845
  169   2HB   ALA  18          2HB       ALA  18  -7.690  -2.724  -4.693
  170   3HB   ALA  18          3HB       ALA  18  -6.166  -1.890  -4.326
  171    H    ARG  19           H        ARG  19  -7.024  -0.690  -8.472
  172    HA   ARG  19           HA       ARG  19  -4.652   1.044  -8.297
  173   1HB   ARG  19          1HB       ARG  19  -6.641   0.316 -10.420
  174   2HB   ARG  19          2HB       ARG  19  -6.069   1.979 -10.425
  175   1HG   ARG  19          1HG       ARG  19  -4.258  -0.416 -10.594
  176   2HG   ARG  19          2HG       ARG  19  -4.728   0.672 -11.908
  177   1HD   ARG  19          1HD       ARG  19  -3.829   2.452  -9.964
  178   2HD   ARG  19          2HD       ARG  19  -2.750   1.074  -9.739
  179    HE   ARG  19           HE       ARG  19  -2.679   3.078 -11.731
  180   1HH1  ARG  19          1HH1      ARG  19  -2.262  -0.445 -11.553
  181   2HH1  ARG  19          2HH1      ARG  19  -1.051  -0.487 -12.805
  182   1HH2  ARG  19          1HH2      ARG  19  -1.136   3.002 -13.396
  183   2HH2  ARG  19          2HH2      ARG  19  -0.413   1.485 -13.868
  184    H    VAL  20           H        VAL  20  -4.949   2.504  -6.648
  185    HA   VAL  20           HA       VAL  20  -7.504   3.908  -6.254
  186    HB   VAL  20           HB       VAL  20  -4.825   4.404  -4.958
  187   1HG1  VAL  20          1HG1      VAL  20  -7.656   5.023  -4.005
  188   2HG1  VAL  20          2HG1      VAL  20  -6.142   5.453  -3.184
  189   3HG1  VAL  20          3HG1      VAL  20  -6.561   6.211  -4.728
  190   1HG2  VAL  20          1HG2      VAL  20  -7.068   2.609  -3.954
  191   2HG2  VAL  20          2HG2      VAL  20  -5.488   2.043  -4.539
  192   3HG2  VAL  20          3HG2      VAL  20  -5.581   3.030  -3.081
  193    H    TYR  21           H        TYR  21  -7.967   5.277  -7.954
  194    HA   TYR  21           HA       TYR  21  -5.789   6.853  -9.210
  195   1HB   TYR  21          1HB       TYR  21  -8.718   6.546  -9.959
  196   2HB   TYR  21          2HB       TYR  21  -7.570   7.510 -10.815
  197    HD1  TYR  21           1HD      TYR  21  -5.427   6.374 -11.747
  198    HD2  TYR  21           2HD      TYR  21  -8.980   4.218 -10.600
  199    HE1  TYR  21           1HE      TYR  21  -4.723   4.447 -13.132
  200    HE2  TYR  21           2HE      TYR  21  -8.350   2.375 -12.098
  201    HH   TYR  21           HH       TYR  21  -6.798   1.560 -13.577
  202    H    GLY  22           H        GLY  22  -5.889   9.105  -9.517
  203   1HA   GLY  22          1HA       GLY  22  -7.390  11.080  -9.380
  204   2HA   GLY  22          2HA       GLY  22  -7.626  10.683  -7.666
  205    H    LEU  23           H        LEU  23  -6.831  12.742  -7.098
  206    HA   LEU  23           HA       LEU  23  -4.024  13.418  -7.599
  207   1HB   LEU  23          1HB       LEU  23  -5.969  15.029  -7.481
  208   2HB   LEU  23          2HB       LEU  23  -5.985  14.747  -5.736
  209    HG   LEU  23           HG       LEU  23  -3.547  15.560  -5.723
  210   1HD1  LEU  23          1HD1      LEU  23  -2.856  16.978  -7.649
  211   2HD1  LEU  23          2HD1      LEU  23  -2.904  15.262  -8.053
  212   3HD1  LEU  23          3HD1      LEU  23  -4.219  16.335  -8.588
  213   1HD2  LEU  23          1HD2      LEU  23  -4.195  17.923  -5.851
  214   2HD2  LEU  23          2HD2      LEU  23  -5.654  17.494  -6.769
  215   3HD2  LEU  23          3HD2      LEU  23  -5.480  16.982  -5.076
  216    H    VAL  24           H        VAL  24  -4.718  10.846  -6.255
  217    HA   VAL  24           HA       VAL  24  -4.140  11.129  -3.442
  218    HB   VAL  24           HB       VAL  24  -4.259   8.722  -3.393
  219   1HG1  VAL  24          1HG1      VAL  24  -6.427   9.888  -5.195
  220   2HG1  VAL  24          2HG1      VAL  24  -6.567   8.472  -4.149
  221   3HG1  VAL  24          3HG1      VAL  24  -6.350  10.081  -3.433
  222   1HG2  VAL  24          1HG2      VAL  24  -4.495   8.811  -6.442
  223   2HG2  VAL  24          2HG2      VAL  24  -3.097   8.201  -5.527
  224   3HG2  VAL  24          3HG2      VAL  24  -4.665   7.402  -5.382
  225    H    GLN  25           H        GLN  25  -2.109  11.287  -6.125
  226    HA   GLN  25           HA       GLN  25   0.306  10.377  -4.712
  227   1HB   GLN  25          1HB       GLN  25  -0.400  11.258  -7.433
  228   2HB   GLN  25          2HB       GLN  25   1.046  12.056  -6.809
  229   1HG   GLN  25          1HG       GLN  25   1.667  10.024  -7.915
  230   2HG   GLN  25          2HG       GLN  25   2.048   9.904  -6.199
  231   1HE2  GLN  25          1HE2      GLN  25   2.207   7.602  -6.845
  232   2HE2  GLN  25          2HE2      GLN  25   0.768   6.601  -6.968
  233    H    GLY  26           H        GLY  26   2.038  12.072  -4.316
  234   1HA   GLY  26          1HA       GLY  26   2.705  14.055  -3.321
  235   2HA   GLY  26          2HA       GLY  26   1.082  14.732  -3.501
  236    H    VAL  27           H        VAL  27  -0.648  13.276  -2.185
  237    HA   VAL  27           HA       VAL  27   0.247  13.096   0.592
  238    HB   VAL  27           HB       VAL  27  -1.957  12.535   1.176
  239   1HG1  VAL  27          1HG1      VAL  27  -2.162  14.606  -1.055
  240   2HG1  VAL  27          2HG1      VAL  27  -3.176  14.468   0.386
  241   3HG1  VAL  27          3HG1      VAL  27  -1.474  14.917   0.556
  242   1HG2  VAL  27          1HG2      VAL  27  -2.727  12.284  -1.756
  243   2HG2  VAL  27          2HG2      VAL  27  -2.555  10.918  -0.626
  244   3HG2  VAL  27          3HG2      VAL  27  -3.790  12.135  -0.337
  245    H    GLY  28           H        GLY  28   0.138  11.096   1.839
  246   1HA   GLY  28          1HA       GLY  28   1.732   9.116   0.546
  247   2HA   GLY  28          2HA       GLY  28   1.138   9.076   2.207
  248    H    PHE  29           H        PHE  29  -1.052   8.269   2.587
  249    HA   PHE  29           HA       PHE  29  -2.326   6.431   2.646
  250   1HB   PHE  29          1HB       PHE  29  -3.498   7.985   1.056
  251   2HB   PHE  29          2HB       PHE  29  -2.844   7.047  -0.282
  252    HD1  PHE  29           1HD      PHE  29  -4.852   6.774   2.874
  253    HD2  PHE  29           2HD      PHE  29  -4.115   5.131  -1.040
  254    HE1  PHE  29           1HE      PHE  29  -6.974   5.494   3.010
  255    HE2  PHE  29           2HE      PHE  29  -6.208   3.811  -0.875
  256    HZ   PHE  29           HZ       PHE  29  -7.646   4.017   1.141
  257    H    ARG  30           H        ARG  30   0.031   5.565   2.691
  258    HA   ARG  30           HA       ARG  30   0.101   3.102   1.037
  259   1HB   ARG  30          1HB       ARG  30   2.569   3.395   0.795
  260   2HB   ARG  30          2HB       ARG  30   1.583   4.537  -0.115
  261   1HG   ARG  30          1HG       ARG  30   1.964   6.272   1.629
  262   2HG   ARG  30          2HG       ARG  30   3.039   5.163   2.491
  263   1HD   ARG  30          1HD       ARG  30   3.440   5.987  -0.422
  264   2HD   ARG  30          2HD       ARG  30   4.072   6.940   0.914
  265    HE   ARG  30           HE       ARG  30   5.165   4.495  -0.160
  266   1HH1  ARG  30          1HH1      ARG  30   4.927   6.397   2.834
  267   2HH1  ARG  30          2HH1      ARG  30   6.501   5.900   3.405
  268   1HH2  ARG  30          1HH2      ARG  30   7.195   3.896   0.577
  269   2HH2  ARG  30          2HH2      ARG  30   7.793   4.429   2.131
  270    H    LYS  31           H        LYS  31   1.189   4.908   3.929
  271    HA   LYS  31           HA       LYS  31   1.904   2.513   5.354
  272   1HB   LYS  31          1HB       LYS  31   2.874   4.762   5.796
  273   2HB   LYS  31          2HB       LYS  31   1.332   5.279   6.469
  274   1HG   LYS  31          1HG       LYS  31   1.416   3.693   8.246
  275   2HG   LYS  31          2HG       LYS  31   2.702   2.750   7.487
  276   1HD   LYS  31          1HD       LYS  31   3.116   5.596   8.493
  277   2HD   LYS  31          2HD       LYS  31   3.373   4.139   9.472
  278   1HE   LYS  31          1HE       LYS  31   4.997   3.291   7.752
  279   2HE   LYS  31          2HE       LYS  31   4.864   4.845   6.903
  280   1HZ   LYS  31          1HZ       LYS  31   6.715   4.889   8.404
  281   2HZ   LYS  31          2HZ       LYS  31   5.699   4.584   9.718
  282    H    PHE  32           H        PHE  32  -0.858   4.819   5.482
  283    HA   PHE  32           HA       PHE  32  -2.373   3.598   7.395
  284   1HB   PHE  32          1HB       PHE  32  -2.936   5.718   6.216
  285   2HB   PHE  32          2HB       PHE  32  -3.479   4.789   4.831
  286    HD1  PHE  32           1HD      PHE  32  -5.613   6.142   5.050
  287    HD2  PHE  32           2HD      PHE  32  -4.444   3.222   8.040
  288    HE1  PHE  32           1HE      PHE  32  -7.891   6.113   5.963
  289    HE2  PHE  32           2HE      PHE  32  -6.703   3.225   8.921
  290    HZ   PHE  32           HZ       PHE  32  -8.457   4.668   7.904
  291    H    VAL  33           H        VAL  33  -2.275   2.751   3.930
  292    HA   VAL  33           HA       VAL  33  -4.220   0.623   4.035
  293    HB   VAL  33           HB       VAL  33  -1.965   1.170   2.049
  294   1HG1  VAL  33          1HG1      VAL  33  -4.495  -0.525   1.789
  295   2HG1  VAL  33          2HG1      VAL  33  -3.360  -0.158   0.475
  296   3HG1  VAL  33          3HG1      VAL  33  -2.834  -1.143   1.843
  297   1HG2  VAL  33          1HG2      VAL  33  -4.913   1.958   1.920
  298   2HG2  VAL  33          2HG2      VAL  33  -3.572   3.086   2.196
  299   3HG2  VAL  33          3HG2      VAL  33  -3.695   2.231   0.658
  300    H    GLN  34           H        GLN  34  -0.780   0.856   4.754
  301    HA   GLN  34           HA       GLN  34  -0.285  -1.982   4.721
  302   1HB   GLN  34          1HB       GLN  34   1.389  -0.363   4.159
  303   2HB   GLN  34          2HB       GLN  34   1.435   0.280   5.787
  304   1HG   GLN  34          1HG       GLN  34   1.974  -2.630   5.068
  305   2HG   GLN  34          2HG       GLN  34   3.233  -1.400   5.065
  306   1HE2  GLN  34          1HE2      GLN  34   1.197  -0.506   7.521
  307   2HE2  GLN  34          2HE2      GLN  34   1.900  -1.401   8.848
  308    H    ILE  35           H        ILE  35  -0.896   0.365   7.390
  309    HA   ILE  35           HA       ILE  35  -0.769  -1.388   9.499
  310    HB   ILE  35           HB       ILE  35  -2.966   0.686   9.058
  311   1HG1  ILE  35          1HG1      ILE  35  -0.853   1.814   8.858
  312   2HG1  ILE  35          2HG1      ILE  35  -1.648   2.250  10.357
  313   1HG2  ILE  35          1HG2      ILE  35  -3.090   0.801  11.539
  314   2HG2  ILE  35          2HG2      ILE  35  -3.624  -0.746  10.896
  315   3HG2  ILE  35          3HG2      ILE  35  -2.021  -0.614  11.637
  316   1HD1  ILE  35          1HD1      ILE  35   0.728   1.968  10.725
  317   2HD1  ILE  35          2HD1      ILE  35  -0.132   0.695  11.600
  318   3HD1  ILE  35          3HD1      ILE  35   0.697   0.325  10.068
  319    H    HIS  36           H        HIS  36  -3.765  -0.923   7.556
  320    HA   HIS  36           HA       HIS  36  -5.138  -2.906   9.144
  321   1HB   HIS  36          1HB       HIS  36  -5.865  -1.333   6.676
  322   2HB   HIS  36          2HB       HIS  36  -6.885  -2.636   7.308
  323    HD2  HIS  36           2HD      HIS  36  -5.345   0.742   8.788
  324    HE1  HIS  36           1HE      HIS  36  -8.855  -0.288  10.900
  325    HE2  HIS  36           2HE      HIS  36  -7.007   1.456  10.661
  326    H    ALA  37           H        ALA  37  -3.735  -2.947   5.827
  327    HA   ALA  37           HA       ALA  37  -4.083  -5.534   5.087
  328   1HB   ALA  37          1HB       ALA  37  -1.902  -5.384   3.957
  329   2HB   ALA  37          2HB       ALA  37  -2.850  -3.902   3.789
  330   3HB   ALA  37          3HB       ALA  37  -1.493  -3.974   4.927
  331    H    ILE  38           H        ILE  38  -1.491  -4.412   7.321
  332    HA   ILE  38           HA       ILE  38  -0.451  -7.068   7.807
  333    HB   ILE  38           HB       ILE  38   0.215  -4.237   8.567
  334   1HG1  ILE  38          1HG1      ILE  38   2.494  -5.052   8.065
  335   2HG1  ILE  38          2HG1      ILE  38   1.899  -6.706   7.917
  336   1HG2  ILE  38          1HG2      ILE  38   1.780  -4.848  10.318
  337   2HG2  ILE  38          2HG2      ILE  38   0.100  -5.042  10.807
  338   3HG2  ILE  38          3HG2      ILE  38   1.076  -6.480  10.393
  339   1HD1  ILE  38          1HD1      ILE  38   2.249  -5.544   5.722
  340   2HD1  ILE  38          2HD1      ILE  38   0.589  -6.120   5.932
  341   3HD1  ILE  38          3HD1      ILE  38   0.968  -4.401   6.152
  342    H    ARG  39           H        ARG  39  -2.760  -4.962   9.484
  343    HA   ARG  39           HA       ARG  39  -2.873  -6.585  11.858
  344   1HB   ARG  39          1HB       ARG  39  -3.621  -4.143  11.479
  345   2HB   ARG  39          2HB       ARG  39  -5.057  -4.781  10.664
  346   1HG   ARG  39          1HG       ARG  39  -4.280  -5.688  13.444
  347   2HG   ARG  39          2HG       ARG  39  -5.021  -4.094  13.195
  348   1HD   ARG  39          1HD       ARG  39  -6.986  -5.066  12.156
  349   2HD   ARG  39          2HD       ARG  39  -6.292  -6.696  12.276
  350    HE   ARG  39           HE       ARG  39  -6.360  -5.497  14.861
  351   1HH1  ARG  39          1HH1      ARG  39  -8.542  -6.865  12.423
  352   2HH1  ARG  39          2HH1      ARG  39  -9.662  -7.509  13.596
  353   1HH2  ARG  39          1HH2      ARG  39  -7.837  -6.355  16.399
  354   2HH2  ARG  39          2HH2      ARG  39  -9.263  -7.206  15.865
  355    H    LEU  40           H        LEU  40  -4.488  -6.734   8.705
  356    HA   LEU  40           HA       LEU  40  -5.890  -9.220   9.556
  357   1HB   LEU  40          1HB       LEU  40  -6.124  -7.556   7.049
  358   2HB   LEU  40          2HB       LEU  40  -7.120  -8.959   7.473
  359    HG   LEU  40           HG       LEU  40  -6.985  -6.341   9.055
  360   1HD1  LEU  40          1HD1      LEU  40  -9.257  -6.024   8.249
  361   2HD1  LEU  40          2HD1      LEU  40  -8.117  -6.148   6.894
  362   3HD1  LEU  40          3HD1      LEU  40  -9.153  -7.537   7.308
  363   1HD2  LEU  40          1HD2      LEU  40  -8.967  -7.297  10.267
  364   2HD2  LEU  40          2HD2      LEU  40  -8.643  -8.865   9.500
  365   3HD2  LEU  40          3HD2      LEU  40  -7.466  -8.148  10.624
  366    H    GLY  41           H        GLY  41  -2.831  -8.900   8.909
  367   1HA   GLY  41          1HA       GLY  41  -1.235 -10.274   8.063
  368   2HA   GLY  41          2HA       GLY  41  -2.453 -11.543   8.228
  369    H    ILE  42           H        ILE  42  -1.932  -8.751   6.022
  370    HA   ILE  42           HA       ILE  42  -2.552 -10.440   3.657
  371    HB   ILE  42           HB       ILE  42  -2.603  -7.475   4.211
  372   1HG1  ILE  42          1HG1      ILE  42  -4.537  -8.775   5.074
  373   2HG1  ILE  42          2HG1      ILE  42  -4.955  -7.559   3.865
  374   1HG2  ILE  42          1HG2      ILE  42  -3.576  -7.194   1.932
  375   2HG2  ILE  42          2HG2      ILE  42  -1.843  -7.512   2.004
  376   3HG2  ILE  42          3HG2      ILE  42  -2.961  -8.818   1.548
  377   1HD1  ILE  42          1HD1      ILE  42  -6.229  -9.599   3.509
  378   2HD1  ILE  42          2HD1      ILE  42  -5.150  -9.312   2.138
  379   3HD1  ILE  42          3HD1      ILE  42  -4.752 -10.556   3.349
  380    H    LYS  43           H        LYS  43  -1.154 -10.555   1.960
  381    HA   LYS  43           HA       LYS  43   1.613  -9.506   2.318
  382   1HB   LYS  43          1HB       LYS  43   0.680 -11.735   0.501
  383   2HB   LYS  43          2HB       LYS  43   2.333 -11.154   0.733
  384   1HG   LYS  43          1HG       LYS  43   2.211 -11.737   3.127
  385   2HG   LYS  43          2HG       LYS  43   0.610 -12.451   2.868
  386   1HD   LYS  43          1HD       LYS  43   1.470 -14.172   1.447
  387   2HD   LYS  43          2HD       LYS  43   3.021 -13.341   1.226
  388   1HE   LYS  43          1HE       LYS  43   3.233 -15.236   2.843
  389   2HE   LYS  43          2HE       LYS  43   3.614 -13.657   3.557
  390   1HZ   LYS  43          1HZ       LYS  43   2.034 -14.137   5.062
  391   2HZ   LYS  43          2HZ       LYS  43   1.287 -15.335   4.090
  392    H    GLY  44           H        GLY  44   2.581  -8.911   0.043
  393   1HA   GLY  44          1HA       GLY  44   1.667  -8.538  -2.364
  394   2HA   GLY  44          2HA       GLY  44   0.506  -7.509  -1.563
  395    H    TYR  45           H        TYR  45   1.052  -5.494  -2.354
  396    HA   TYR  45           HA       TYR  45   3.192  -4.250  -1.010
  397   1HB   TYR  45          1HB       TYR  45   4.148  -5.458  -3.285
  398   2HB   TYR  45          2HB       TYR  45   3.675  -3.911  -3.941
  399    HD1  TYR  45           1HD      TYR  45   5.992  -5.729  -1.752
  400    HD2  TYR  45           2HD      TYR  45   4.938  -1.869  -3.364
  401    HE1  TYR  45           1HE      TYR  45   8.192  -4.830  -1.047
  402    HE2  TYR  45           2HE      TYR  45   7.167  -1.007  -2.680
  403    HH   TYR  45           HH       TYR  45   9.047  -1.374  -1.435
  404    H    ALA  46           H        ALA  46   3.025  -2.057  -0.958
  405    HA   ALA  46           HA       ALA  46   0.740  -0.726  -2.337
  406   1HB   ALA  46          1HB       ALA  46   1.132   1.045  -0.610
  407   2HB   ALA  46          2HB       ALA  46   0.697  -0.523   0.073
  408   3HB   ALA  46          3HB       ALA  46   2.365   0.020   0.129
  409    H    LYS  47           H        LYS  47   1.803  -0.435  -4.400
  410    HA   LYS  47           HA       LYS  47   4.384   0.927  -4.400
  411   1HB   LYS  47          1HB       LYS  47   4.290  -1.045  -5.628
  412   2HB   LYS  47          2HB       LYS  47   2.866  -0.489  -6.504
  413   1HG   LYS  47          1HG       LYS  47   4.183   1.315  -7.571
  414   2HG   LYS  47          2HG       LYS  47   5.598   0.876  -6.605
  415   1HD   LYS  47          1HD       LYS  47   4.264  -0.876  -8.720
  416   2HD   LYS  47          2HD       LYS  47   5.724   0.103  -8.936
  417   1HE   LYS  47          1HE       LYS  47   6.800  -1.234  -7.054
  418   2HE   LYS  47          2HE       LYS  47   5.397  -2.325  -7.122
  419   1HZ   LYS  47          1HZ       LYS  47   7.107  -3.174  -8.530
  420   2HZ   LYS  47          2HZ       LYS  47   7.144  -1.743  -9.424
  421    H    ASN  48           H        ASN  48   4.053   3.072  -4.004
  422    HA   ASN  48           HA       ASN  48   2.049   4.642  -5.315
  423   1HB   ASN  48          1HB       ASN  48   3.201   5.263  -3.184
  424   2HB   ASN  48          2HB       ASN  48   4.699   5.517  -4.086
  425   1HD2  ASN  48          2HD2      ASN  48   1.685   6.906  -3.093
  426   2HD2  ASN  48          1HD2      ASN  48   1.798   8.392  -4.006
  427    H    LEU  49           H        LEU  49   2.021   4.949  -7.531
  428    HA   LEU  49           HA       LEU  49   4.511   4.945  -9.101
  429   1HB   LEU  49          1HB       LEU  49   1.616   5.210  -9.913
  430   2HB   LEU  49          2HB       LEU  49   2.988   5.030 -10.991
  431    HG   LEU  49           HG       LEU  49   2.252   2.948  -8.889
  432   1HD1  LEU  49          1HD1      LEU  49   1.102   1.742 -10.674
  433   2HD1  LEU  49          2HD1      LEU  49   0.343   3.314 -10.399
  434   3HD1  LEU  49          3HD1      LEU  49   1.403   3.080 -11.808
  435   1HD2  LEU  49          1HD2      LEU  49   3.524   1.427 -10.386
  436   2HD2  LEU  49          2HD2      LEU  49   3.956   2.808 -11.414
  437   3HD2  LEU  49          3HD2      LEU  49   4.546   2.719  -9.739
  438    HA   PRO  50           HA       PRO  50   3.953   9.350  -7.845
  439   1HB   PRO  50          1HB       PRO  50   6.368  10.404  -8.619
  440   2HB   PRO  50          2HB       PRO  50   6.111   9.451  -7.126
  441   1HG   PRO  50          1HG       PRO  50   7.088   8.424  -9.809
  442   2HG   PRO  50          2HG       PRO  50   7.846   8.179  -8.205
  443   1HD   PRO  50          1HD       PRO  50   6.245   6.292  -9.238
  444   2HD   PRO  50          2HD       PRO  50   6.085   6.741  -7.510
  445    H    ASP  51           H        ASP  51   3.253  11.150  -8.925
  446    HA   ASP  51           HA       ASP  51   2.046  12.146 -10.515
  447   1HB   ASP  51          1HB       ASP  51   4.292  12.775 -11.375
  448   2HB   ASP  51          2HB       ASP  51   4.291  11.353 -12.425
  449    HD2  ASP  51           HD       ASP  51   1.673  14.371 -13.240
  450    H    GLY  52           H        GLY  52   0.780  10.078  -9.864
  451   1HA   GLY  52          1HA       GLY  52  -0.562   9.022 -12.141
  452   2HA   GLY  52          2HA       GLY  52   0.607   7.834 -11.524
  453    H    SER  53           H        SER  53  -0.438   6.403 -10.311
  454    HA   SER  53           HA       SER  53  -2.561   7.206  -8.362
  455   1HB   SER  53          1HB       SER  53  -3.483   4.889  -8.977
  456   2HB   SER  53          2HB       SER  53  -3.677   6.203 -10.152
  457    HG   SER  53           HG       SER  53  -1.937   5.373 -11.299
  458    H    VAL  54           H        VAL  54  -2.574   5.960  -6.378
  459    HA   VAL  54           HA       VAL  54  -0.042   4.549  -5.827
  460    HB   VAL  54           HB       VAL  54  -0.660   6.058  -4.173
  461   1HG1  VAL  54          1HG1      VAL  54  -3.104   4.402  -3.457
  462   2HG1  VAL  54          2HG1      VAL  54  -2.516   5.888  -2.695
  463   3HG1  VAL  54          3HG1      VAL  54  -3.171   5.953  -4.335
  464   1HG2  VAL  54          1HG2      VAL  54  -0.946   3.189  -3.191
  465   2HG2  VAL  54          2HG2      VAL  54   0.581   4.004  -3.579
  466   3HG2  VAL  54          3HG2      VAL  54  -0.413   4.587  -2.237
  467    H    GLU  55           H        GLU  55   0.075   2.721  -6.799
  468    HA   GLU  55           HA       GLU  55  -2.255   1.039  -7.331
  469   1HB   GLU  55          1HB       GLU  55  -0.624   1.372  -9.066
  470   2HB   GLU  55          2HB       GLU  55   0.715   0.911  -8.028
  471   1HG   GLU  55          1HG       GLU  55  -1.352  -1.220  -8.303
  472   2HG   GLU  55          2HG       GLU  55  -0.568  -0.745  -9.809
  473    HE2  GLU  55           HE       GLU  55   1.659  -2.563  -6.965
  474    H    VAL  56           H        VAL  56  -2.900  -0.528  -5.998
  475    HA   VAL  56           HA       VAL  56  -1.005  -1.677  -3.984
  476    HB   VAL  56           HB       VAL  56  -3.993  -1.198  -3.994
  477   1HG1  VAL  56          1HG1      VAL  56  -2.357  -2.952  -2.149
  478   2HG1  VAL  56          2HG1      VAL  56  -3.970  -2.336  -1.744
  479   3HG1  VAL  56          3HG1      VAL  56  -3.766  -3.434  -3.114
  480   1HG2  VAL  56          1HG2      VAL  56  -1.769  -0.406  -2.068
  481   2HG2  VAL  56          2HG2      VAL  56  -2.499   0.668  -3.278
  482   3HG2  VAL  56          3HG2      VAL  56  -3.485   0.041  -1.949
  483    H    VAL  57           H        VAL  57  -0.380  -3.719  -4.431
  484    HA   VAL  57           HA       VAL  57  -2.400  -5.572  -5.635
  485    HB   VAL  57           HB       VAL  57   0.627  -5.783  -5.922
  486   1HG1  VAL  57          1HG1      VAL  57  -1.658  -7.617  -6.822
  487   2HG1  VAL  57          2HG1      VAL  57   0.032  -7.788  -7.322
  488   3HG1  VAL  57          3HG1      VAL  57  -0.411  -8.034  -5.633
  489   1HG2  VAL  57          1HG2      VAL  57  -1.525  -5.508  -8.060
  490   2HG2  VAL  57          2HG2      VAL  57  -0.502  -4.165  -7.524
  491   3HG2  VAL  57          3HG2      VAL  57   0.227  -5.571  -8.315
  492    H    ALA  58           H        ALA  58  -3.187  -5.485  -3.469
  493    HA   ALA  58           HA       ALA  58  -1.620  -6.774  -1.311
  494   1HB   ALA  58          1HB       ALA  58  -3.987  -6.534  -0.213
  495   2HB   ALA  58          2HB       ALA  58  -3.027  -5.062  -0.475
  496   3HB   ALA  58          3HB       ALA  58  -4.319  -5.476  -1.593
  497    H    GLU  59           H        GLU  59  -2.272  -8.840  -0.513
  498    HA   GLU  59           HA       GLU  59  -3.935 -10.462  -2.326
  499   1HB   GLU  59          1HB       GLU  59  -1.464 -11.239  -0.776
  500   2HB   GLU  59          2HB       GLU  59  -2.359 -12.218  -1.951
  501   1HG   GLU  59          1HG       GLU  59  -1.858 -10.462  -3.694
  502   2HG   GLU  59          2HG       GLU  59  -0.860  -9.623  -2.505
  503    HE2  GLU  59           HE       GLU  59   0.652 -12.630  -4.579
  504    H    GLY  60           H        GLY  60  -5.956 -10.904  -1.162
  505   1HA   GLY  60          1HA       GLY  60  -5.596 -12.214   1.510
  506   2HA   GLY  60          2HA       GLY  60  -6.783 -10.933   1.247
  507    H    TYR  61           H        TYR  61  -7.445 -13.420   2.198
  508    HA   TYR  61           HA       TYR  61  -8.948 -14.931   0.238
  509   1HB   TYR  61          1HB       TYR  61  -9.118 -14.476   3.236
  510   2HB   TYR  61          2HB       TYR  61 -10.208 -15.541   2.366
  511    HD1  TYR  61           1HD      TYR  61  -6.744 -15.130   3.594
  512    HD2  TYR  61           2HD      TYR  61  -9.536 -17.727   1.579
  513    HE1  TYR  61           1HE      TYR  61  -5.297 -17.078   4.090
  514    HE2  TYR  61           2HE      TYR  61  -8.089 -19.667   2.075
  515    HH   TYR  61           HH       TYR  61  -6.128 -20.396   3.024
  516    H    GLU  62           H        GLU  62 -11.482 -14.831   0.739
  517    HA   GLU  62           HA       GLU  62 -12.323 -12.100   0.103
  518   1HB   GLU  62          1HB       GLU  62 -14.532 -13.020  -0.220
  519   2HB   GLU  62          2HB       GLU  62 -13.279 -13.788  -1.215
  520   1HG   GLU  62          1HG       GLU  62 -13.222 -15.717   0.410
  521   2HG   GLU  62          2HG       GLU  62 -14.517 -14.934   1.333
  522    HE2  GLU  62           HE       GLU  62 -15.316 -16.583  -2.309
  523    H    GLU  63           H        GLU  63 -12.331 -14.184   2.949
  524    HA   GLU  63           HA       GLU  63 -14.191 -12.539   4.429
  525   1HB   GLU  63          1HB       GLU  63 -13.488 -13.907   6.317
  526   2HB   GLU  63          2HB       GLU  63 -13.864 -14.901   4.911
  527   1HG   GLU  63          1HG       GLU  63 -11.975 -15.878   5.920
  528   2HG   GLU  63          2HG       GLU  63 -11.403 -15.127   4.436
  529    HE2  GLU  63           HE       GLU  63  -8.807 -13.992   6.461
  530    H    ALA  64           H        ALA  64 -10.856 -12.223   3.532
  531    HA   ALA  64           HA       ALA  64 -10.524  -9.976   5.466
  532   1HB   ALA  64          1HB       ALA  64  -8.169 -10.092   4.907
  533   2HB   ALA  64          2HB       ALA  64  -8.718 -11.708   5.382
  534   3HB   ALA  64          3HB       ALA  64  -8.477 -11.324   3.661
  535    H    LEU  65           H        LEU  65 -11.541 -10.613   2.226
  536    HA   LEU  65           HA       LEU  65 -10.260  -8.357   0.974
  537   1HB   LEU  65          1HB       LEU  65 -11.086 -10.342  -0.255
  538   2HB   LEU  65          2HB       LEU  65 -12.755  -9.839   0.108
  539    HG   LEU  65           HG       LEU  65 -12.250  -7.692  -1.087
  540   1HD1  LEU  65          1HD1      LEU  65 -10.264  -7.806  -2.689
  541   2HD1  LEU  65          2HD1      LEU  65  -9.796  -7.657  -0.998
  542   3HD1  LEU  65          3HD1      LEU  65  -9.694  -9.233  -1.790
  543   1HD2  LEU  65          1HD2      LEU  65 -12.333  -8.771  -3.331
  544   2HD2  LEU  65          2HD2      LEU  65 -11.889 -10.314  -2.566
  545   3HD2  LEU  65          3HD2      LEU  65 -13.431  -9.535  -2.147
  546    H    SER  66           H        SER  66 -13.751  -8.874   1.573
  547    HA   SER  66           HA       SER  66 -14.708  -6.340   1.488
  548   1HB   SER  66          1HB       SER  66 -16.467  -7.100   3.075
  549   2HB   SER  66          2HB       SER  66 -16.139  -8.255   1.769
  550    HG   SER  66           HG       SER  66 -14.888  -9.462   3.229
  551    H    LYS  67           H        LYS  67 -12.883  -7.666   4.258
  552    HA   LYS  67           HA       LYS  67 -13.490  -5.520   6.073
  553   1HB   LYS  67          1HB       LYS  67 -11.463  -7.762   5.956
  554   2HB   LYS  67          2HB       LYS  67 -11.327  -6.481   7.166
  555   1HG   LYS  67          1HG       LYS  67 -12.522  -8.492   7.984
  556   2HG   LYS  67          2HG       LYS  67 -13.407  -6.966   8.156
  557   1HD   LYS  67          1HD       LYS  67 -14.869  -7.516   6.295
  558   2HD   LYS  67          2HD       LYS  67 -13.877  -8.919   5.866
  559   1HE   LYS  67          1HE       LYS  67 -15.952  -9.568   7.013
  560   2HE   LYS  67          2HE       LYS  67 -14.521 -10.058   7.940
  561   1HZ   LYS  67          1HZ       LYS  67 -16.147  -9.019   9.378
  562   2HZ   LYS  67          2HZ       LYS  67 -16.030  -7.581   8.499
  563    H    LEU  68           H        LEU  68 -10.531  -6.206   4.071
  564    HA   LEU  68           HA       LEU  68  -9.353  -3.664   4.781
  565   1HB   LEU  68          1HB       LEU  68  -8.133  -5.758   4.355
  566   2HB   LEU  68          2HB       LEU  68  -8.611  -5.737   2.664
  567    HG   LEU  68           HG       LEU  68  -6.262  -5.009   3.479
  568   1HD1  LEU  68          1HD1      LEU  68  -5.955  -3.459   1.586
  569   2HD1  LEU  68          2HD1      LEU  68  -6.858  -4.923   1.193
  570   3HD1  LEU  68          3HD1      LEU  68  -7.719  -3.374   1.380
  571   1HD2  LEU  68          1HD2      LEU  68  -5.847  -2.691   3.859
  572   2HD2  LEU  68          2HD2      LEU  68  -7.549  -2.271   3.694
  573   3HD2  LEU  68          3HD2      LEU  68  -7.015  -3.262   5.078
  574    H    LEU  69           H        LEU  69 -11.679  -4.704   2.401
  575    HA   LEU  69           HA       LEU  69 -11.204  -2.467   0.617
  576   1HB   LEU  69          1HB       LEU  69 -13.129  -4.768   0.821
  577   2HB   LEU  69          2HB       LEU  69 -13.733  -3.354   0.002
  578    HG   LEU  69           HG       LEU  69 -12.727  -5.141  -1.461
  579   1HD1  LEU  69          1HD1      LEU  69 -11.695  -3.556  -3.000
  580   2HD1  LEU  69          2HD1      LEU  69 -13.130  -2.854  -2.241
  581   3HD1  LEU  69          3HD1      LEU  69 -11.505  -2.365  -1.700
  582   1HD2  LEU  69          1HD2      LEU  69 -10.299  -5.163  -1.807
  583   2HD2  LEU  69          2HD2      LEU  69 -10.066  -4.059  -0.442
  584   3HD2  LEU  69          3HD2      LEU  69 -10.691  -5.692  -0.167
  585    H    GLU  70           H        GLU  70 -13.874  -3.288   2.945
  586    HA   GLU  70           HA       GLU  70 -15.076  -0.758   2.614
  587   1HB   GLU  70          1HB       GLU  70 -16.553  -1.315   4.324
  588   2HB   GLU  70          2HB       GLU  70 -16.158  -2.818   3.477
  589   1HG   GLU  70          1HG       GLU  70 -14.462  -3.262   5.345
  590   2HG   GLU  70          2HG       GLU  70 -15.160  -1.889   6.206
  591    HE2  GLU  70           HE       GLU  70 -16.803  -5.236   6.964
  592    H    ARG  71           H        ARG  71 -12.522  -1.786   4.846
  593    HA   ARG  71           HA       ARG  71 -12.022   0.444   6.422
  594   1HB   ARG  71          1HB       ARG  71 -10.538  -1.281   6.738
  595   2HB   ARG  71          2HB       ARG  71 -10.471  -1.656   5.020
  596   1HG   ARG  71          1HG       ARG  71  -8.329  -1.006   5.725
  597   2HG   ARG  71          2HG       ARG  71  -8.940   0.133   4.558
  598   1HD   ARG  71          1HD       ARG  71  -9.535   1.665   6.593
  599   2HD   ARG  71          2HD       ARG  71  -8.716   0.487   7.570
  600    HE   ARG  71           HE       ARG  71  -6.650   1.115   6.673
  601   1HH1  ARG  71          1HH1      ARG  71  -9.273   2.748   4.892
  602   2HH1  ARG  71          2HH1      ARG  71  -8.186   3.590   3.831
  603   1HH2  ARG  71          1HH2      ARG  71  -5.263   2.145   5.204
  604   2HH2  ARG  71          2HH2      ARG  71  -5.893   3.185   3.948
  605    H    ILE  72           H        ILE  72 -11.134   0.046   2.956
  606    HA   ILE  72           HA       ILE  72  -9.970   2.704   2.756
  607    HB   ILE  72           HB       ILE  72 -10.755   0.628   0.706
  608   1HG1  ILE  72          1HG1      ILE  72  -7.955   1.662   1.322
  609   2HG1  ILE  72          2HG1      ILE  72  -8.677   0.440   2.352
  610   1HG2  ILE  72          1HG2      ILE  72  -9.464   2.089  -0.916
  611   2HG2  ILE  72          2HG2      ILE  72 -11.048   2.698  -0.437
  612   3HG2  ILE  72          3HG2      ILE  72  -9.591   3.396   0.283
  613   1HD1  ILE  72          1HD1      ILE  72  -7.414  -0.703   0.641
  614   2HD1  ILE  72          2HD1      ILE  72  -9.141  -1.003   0.370
  615   3HD1  ILE  72          3HD1      ILE  72  -8.272   0.159  -0.651
  616    H    LYS  73           H        LYS  73 -13.022   1.322   1.469
  617    HA   LYS  73           HA       LYS  73 -13.959   3.643   0.365
  618   1HB   LYS  73          1HB       LYS  73 -15.436   1.269   1.467
  619   2HB   LYS  73          2HB       LYS  73 -16.274   2.647   0.749
  620   1HG   LYS  73          1HG       LYS  73 -15.983   1.051  -0.978
  621   2HG   LYS  73          2HG       LYS  73 -14.927   2.422  -1.329
  622   1HD   LYS  73          1HD       LYS  73 -12.981   1.085  -0.457
  623   2HD   LYS  73          2HD       LYS  73 -14.090  -0.287  -0.209
  624   1HE   LYS  73          1HE       LYS  73 -13.498   1.089  -2.865
  625   2HE   LYS  73          2HE       LYS  73 -12.662  -0.349  -2.267
  626   1HZ   LYS  73          1HZ       LYS  73 -14.467  -1.030  -3.677
  627   2HZ   LYS  73          2HZ       LYS  73 -15.586  -0.236  -2.691
  628    H    GLN  74           H        GLN  74 -14.463   2.554   3.736
  629    HA   GLN  74           HA       GLN  74 -15.950   4.839   4.638
  630   1HB   GLN  74          1HB       GLN  74 -16.071   2.622   5.657
  631   2HB   GLN  74          2HB       GLN  74 -14.379   2.707   6.153
  632   1HG   GLN  74          1HG       GLN  74 -16.422   4.793   7.019
  633   2HG   GLN  74          2HG       GLN  74 -16.259   3.254   7.873
  634   1HE2  GLN  74          1HE2      GLN  74 -15.467   6.326   8.328
  635   2HE2  GLN  74          2HE2      GLN  74 -13.912   6.156   9.112
  636    H    GLY  75           H        GLY  75 -12.482   3.919   4.683
  637   1HA   GLY  75          1HA       GLY  75 -11.702   6.533   5.923
  638   2HA   GLY  75          2HA       GLY  75 -10.824   5.019   5.974
  639    HA   PRO  76           HA       PRO  76 -10.414   6.500   1.397
  640   1HB   PRO  76          1HB       PRO  76 -10.988   9.165   0.802
  641   2HB   PRO  76          2HB       PRO  76 -12.219   7.866   0.827
  642   1HG   PRO  76          1HG       PRO  76 -11.480   9.778   3.060
  643   2HG   PRO  76          2HG       PRO  76 -13.111   9.469   2.385
  644   1HD   PRO  76          1HD       PRO  76 -12.308   8.200   4.599
  645   2HD   PRO  76          2HD       PRO  76 -13.167   7.283   3.315
  646    HA   PRO  77           HA       PRO  77  -6.405   8.464   1.900
  647   1HB   PRO  77          1HB       PRO  77  -5.836   9.552  -0.557
  648   2HB   PRO  77          2HB       PRO  77  -5.898   7.791  -0.291
  649   1HG   PRO  77          1HG       PRO  77  -8.107   9.549  -1.332
  650   2HG   PRO  77          2HG       PRO  77  -7.481   8.028  -2.055
  651   1HD   PRO  77          1HD       PRO  77  -9.687   8.011  -0.536
  652   2HD   PRO  77          2HD       PRO  77  -8.488   6.711  -0.357
  653    H    ALA  78           H        ALA  78  -5.322  10.569   1.975
  654    HA   ALA  78           HA       ALA  78  -7.149  12.662   2.821
  655   1HB   ALA  78          1HB       ALA  78  -5.120  13.753   3.611
  656   2HB   ALA  78          2HB       ALA  78  -5.078  12.038   4.057
  657   3HB   ALA  78          3HB       ALA  78  -4.109  12.623   2.684
  658    H    ALA  79           H        ALA  79  -7.289  12.101  -0.070
  659    HA   ALA  79           HA       ALA  79  -6.698  14.775  -1.138
  660   1HB   ALA  79          1HB       ALA  79  -5.615  13.742  -3.137
  661   2HB   ALA  79          2HB       ALA  79  -4.649  13.746  -1.662
  662   3HB   ALA  79          3HB       ALA  79  -5.471  12.245  -2.183
  663    H    GLU  80           H        GLU  80  -7.507  14.803  -3.452
  664    HA   GLU  80           HA       GLU  80 -10.233  13.860  -3.622
  665   1HB   GLU  80          1HB       GLU  80  -9.485  16.024  -4.490
  666   2HB   GLU  80          2HB       GLU  80  -8.426  15.223  -5.660
  667   1HG   GLU  80          1HG       GLU  80 -10.417  14.204  -6.755
  668   2HG   GLU  80          2HG       GLU  80 -11.465  14.943  -5.533
  669    HE2  GLU  80           HE       GLU  80  -9.715  17.274  -8.379
  670    H    VAL  81           H        VAL  81 -10.014  11.587  -3.440
  671    HA   VAL  81           HA       VAL  81  -8.749   9.968  -5.454
  672    HB   VAL  81           HB       VAL  81  -9.294   9.189  -3.231
  673   1HG1  VAL  81          1HG1      VAL  81 -12.221   9.058  -3.996
  674   2HG1  VAL  81          2HG1      VAL  81 -11.471   8.554  -2.482
  675   3HG1  VAL  81          3HG1      VAL  81 -11.529  10.274  -2.897
  676   1HG2  VAL  81          1HG2      VAL  81 -10.671   7.616  -5.444
  677   2HG2  VAL  81          2HG2      VAL  81  -8.945   7.565  -5.019
  678   3HG2  VAL  81          3HG2      VAL  81 -10.155   6.963  -3.877
  679    H    GLU  82           H        GLU  82  -9.309   9.663  -7.454
  680    HA   GLU  82           HA       GLU  82 -11.707  10.860  -8.623
  681   1HB   GLU  82          1HB       GLU  82  -9.568  10.974  -9.773
  682   2HB   GLU  82          2HB       GLU  82  -9.402   9.211  -9.762
  683   1HG   GLU  82          1HG       GLU  82 -11.456   9.054 -11.208
  684   2HG   GLU  82          2HG       GLU  82 -11.566  10.821 -11.199
  685    HE2  GLU  82           HE       GLU  82  -8.631   8.971 -13.328
  686    H    LYS  83           H        LYS  83 -10.230   7.578  -8.426
  687    HA   LYS  83           HA       LYS  83 -12.628   6.407  -7.432
  688   1HB   LYS  83          1HB       LYS  83 -13.173   4.900  -9.306
  689   2HB   LYS  83          2HB       LYS  83 -13.473   6.585  -9.714
  690   1HG   LYS  83          1HG       LYS  83 -11.212   6.595 -10.930
  691   2HG   LYS  83          2HG       LYS  83 -11.136   4.861 -10.594
  692   1HD   LYS  83          1HD       LYS  83 -11.914   4.984 -12.770
  693   2HD   LYS  83          2HD       LYS  83 -13.347   4.598 -11.803
  694   1HE   LYS  83          1HE       LYS  83 -14.051   6.989 -11.924
  695   2HE   LYS  83          2HE       LYS  83 -12.565   7.378 -12.817
  696   1HZ   LYS  83          1HZ       LYS  83 -14.331   7.034 -14.369
  697   2HZ   LYS  83          2HZ       LYS  83 -14.607   5.476 -13.777
  698    H    VAL  84           H        VAL  84 -11.965   4.679  -6.183
  699    HA   VAL  84           HA       VAL  84  -9.478   3.260  -6.932
  700    HB   VAL  84           HB       VAL  84  -9.572   3.649  -4.706
  701   1HG1  VAL  84          1HG1      VAL  84 -12.336   2.391  -4.562
  702   2HG1  VAL  84          2HG1      VAL  84 -11.311   2.794  -3.173
  703   3HG1  VAL  84          3HG1      VAL  84 -11.901   4.080  -4.231
  704   1HG2  VAL  84          1HG2      VAL  84 -10.317   0.727  -5.123
  705   2HG2  VAL  84          2HG2      VAL  84  -8.736   1.453  -5.475
  706   3HG2  VAL  84          3HG2      VAL  84  -9.346   1.411  -3.810
  707    H    ASP  85           H        ASP  85 -10.046   2.488  -8.949
  708    HA   ASP  85           HA       ASP  85 -12.513   0.907  -9.313
  709   1HB   ASP  85          1HB       ASP  85 -11.897   2.534 -11.016
  710   2HB   ASP  85          2HB       ASP  85 -10.303   1.791 -11.193
  711    HD2  ASP  85           HD       ASP  85 -11.507  -0.258 -13.685
  712    H    TYR  86           H        TYR  86 -11.759  -0.697  -7.678
  713    HA   TYR  86           HA       TYR  86  -9.311  -2.072  -8.248
  714   1HB   TYR  86          1HB       TYR  86  -9.439  -2.941  -6.202
  715   2HB   TYR  86          2HB       TYR  86 -10.611  -1.668  -5.935
  716    HD1  TYR  86           1HD      TYR  86 -13.147  -2.377  -6.272
  717    HD2  TYR  86           2HD      TYR  86  -9.906  -5.188  -5.810
  718    HE1  TYR  86           1HE      TYR  86 -14.741  -4.093  -5.454
  719    HE2  TYR  86           2HE      TYR  86 -11.484  -6.861  -4.918
  720    HH   TYR  86           HH       TYR  86 -13.674  -7.360  -4.439
  721    H    SER  87           H        SER  87  -9.032  -4.305  -8.720
  722    HA   SER  87           HA       SER  87 -11.288  -5.816  -9.841
  723   1HB   SER  87          1HB       SER  87  -8.948  -4.914 -11.566
  724   2HB   SER  87          2HB       SER  87 -10.191  -6.109 -12.015
  725    HG   SER  87           HG       SER  87 -11.635  -4.185 -11.311
  726    H    PHE  88           H        PHE  88 -10.933  -7.377  -8.366
  727    HA   PHE  88           HA       PHE  88  -8.480  -8.449  -7.530
  728   1HB   PHE  88          1HB       PHE  88  -9.854  -9.942  -6.346
  729   2HB   PHE  88          2HB       PHE  88 -10.838  -8.526  -6.511
  730    HD1  PHE  88           1HD      PHE  88 -12.795  -8.483  -8.083
  731    HD2  PHE  88           2HD      PHE  88 -10.415 -12.038  -7.513
  732    HE1  PHE  88           1HE      PHE  88 -14.519  -9.831  -9.243
  733    HE2  PHE  88           2HE      PHE  88 -12.162 -13.383  -8.648
  734    HZ   PHE  88           HZ       PHE  88 -14.205 -12.279  -9.533
  735    H    SER  89           H        SER  89  -7.686 -10.660  -7.964
  736    HA   SER  89           HA       SER  89  -8.585 -12.235 -10.061
  737   1HB   SER  89          1HB       SER  89  -5.835 -11.098 -10.769
  738   2HB   SER  89          2HB       SER  89  -6.897 -12.072 -11.801
  739    HG   SER  89           HG       SER  89  -8.317 -10.098 -11.624
  740    H    GLU  90           H        GLU  90  -6.748 -13.982 -10.676
  741    HA   GLU  90           HA       GLU  90  -6.263 -15.125  -8.047
  742   1HB   GLU  90          1HB       GLU  90  -5.891 -17.149  -9.097
  743   2HB   GLU  90          2HB       GLU  90  -7.085 -16.366 -10.121
  744   1HG   GLU  90          1HG       GLU  90  -5.578 -17.332 -11.629
  745   2HG   GLU  90          2HG       GLU  90  -5.112 -15.625 -11.619
  746    HE2  GLU  90           HE       GLU  90  -1.859 -16.502 -10.841
  747    H    TYR  91           H        TYR  91  -4.223 -15.733  -7.165
  748    HA   TYR  91           HA       TYR  91  -2.384 -13.592  -7.357
  749   1HB   TYR  91          1HB       TYR  91  -1.300 -14.679  -5.531
  750   2HB   TYR  91          2HB       TYR  91  -3.040 -14.861  -5.306
  751    HD1  TYR  91           1HD      TYR  91   0.140 -16.594  -5.755
  752    HD2  TYR  91           2HD      TYR  91  -4.141 -17.111  -5.773
  753    HE1  TYR  91           1HE      TYR  91   0.429 -19.051  -5.685
  754    HE2  TYR  91           2HE      TYR  91  -3.851 -19.556  -5.731
  755    HH   TYR  91           HH       TYR  91  -2.354 -21.307  -5.682
  756    H    LYS  92           H        LYS  92  -0.522 -13.325  -8.327
  757    HA   LYS  92           HA       LYS  92   0.450 -15.146 -10.344
  758   1HB   LYS  92          1HB       LYS  92   0.681 -12.705 -10.528
  759   2HB   LYS  92          2HB       LYS  92   1.620 -12.657  -9.041
  760   1HG   LYS  92          1HG       LYS  92   3.097 -12.469 -10.948
  761   2HG   LYS  92          2HG       LYS  92   3.436 -13.954 -10.067
  762   1HD   LYS  92          1HD       LYS  92   3.537 -14.287 -12.485
  763   2HD   LYS  92          2HD       LYS  92   2.258 -15.283 -11.784
  764   1HE   LYS  92          1HE       LYS  92   0.541 -13.714 -12.575
  765   2HE   LYS  92          2HE       LYS  92   1.791 -12.560 -13.094
  766   1HZ   LYS  92          1HZ       LYS  92   1.027 -13.831 -14.962
  767   2HZ   LYS  92          2HZ       LYS  92   1.506 -15.272 -14.221
  768    H    GLY  93           H        GLY  93   1.598 -14.050  -7.104
  769   1HA   GLY  93          1HA       GLY  93   2.676 -16.635  -6.408
  770   2HA   GLY  93          2HA       GLY  93   3.925 -15.410  -6.755
  771    H    GLU  94           H        GLU  94   4.081 -16.158  -4.287
  772    HA   GLU  94           HA       GLU  94   2.472 -14.495  -2.469
  773   1HB   GLU  94          1HB       GLU  94   3.820 -15.564  -0.723
  774   2HB   GLU  94          2HB       GLU  94   2.741 -16.616  -1.641
  775   1HG   GLU  94          1HG       GLU  94   4.566 -17.577  -2.899
  776   2HG   GLU  94          2HG       GLU  94   5.736 -16.451  -2.184
  777    HE2  GLU  94           HE       GLU  94   5.841 -18.100   0.920
  778    H    PHE  95           H        PHE  95   3.054 -12.426  -2.396
  779    HA   PHE  95           HA       PHE  95   5.612 -11.440  -3.252
  780   1HB   PHE  95          1HB       PHE  95   3.176 -10.198  -1.983
  781   2HB   PHE  95          2HB       PHE  95   4.624  -9.284  -2.342
  782    HD1  PHE  95           1HD      PHE  95   3.148 -11.918  -4.638
  783    HD2  PHE  95           2HD      PHE  95   3.829  -7.718  -3.893
  784    HE1  PHE  95           1HE      PHE  95   2.290 -11.382  -6.869
  785    HE2  PHE  95           2HE      PHE  95   2.887  -7.188  -6.111
  786    HZ   PHE  95           HZ       PHE  95   2.154  -9.019  -7.627
  787    H    GLU  96           H        GLU  96   4.485 -12.556  -0.166
  788    HA   GLU  96           HA       GLU  96   5.400 -12.714   1.856
  789   1HB   GLU  96          1HB       GLU  96   8.025 -11.855   0.582
  790   2HB   GLU  96          2HB       GLU  96   7.788 -12.632   2.152
  791   1HG   GLU  96          1HG       GLU  96   6.716 -14.584   0.989
  792   2HG   GLU  96          2HG       GLU  96   7.107 -13.837  -0.567
  793    HE2  GLU  96           HE       GLU  96  10.574 -14.408  -0.318
  794    H    ASP  97           H        ASP  97   4.242 -11.251   2.927
  795    HA   ASP  97           HA       ASP  97   3.683  -9.491   4.142
  796   1HB   ASP  97          1HB       ASP  97   5.997  -9.376   4.984
  797   2HB   ASP  97          2HB       ASP  97   6.451  -8.312   3.643
  798    HD2  ASP  97           HD       ASP  97   5.693  -5.592   5.603
  799    H    PHE  98           H        PHE  98   2.911  -7.309   3.939
  800    HA   PHE  98           HA       PHE  98   2.590  -6.399   1.116
  801   1HB   PHE  98          1HB       PHE  98   0.531  -6.993   2.269
  802   2HB   PHE  98          2HB       PHE  98   0.921  -5.937   3.612
  803    HD1  PHE  98           1HD      PHE  98   0.105  -6.058   0.011
  804    HD2  PHE  98           2HD      PHE  98   0.531  -3.548   3.445
  805    HE1  PHE  98           1HE      PHE  98  -0.745  -4.150  -1.306
  806    HE2  PHE  98           2HE      PHE  98  -0.465  -1.643   2.190
  807    HZ   PHE  98           HZ       PHE  98  -1.159  -1.957  -0.178
  808    H    GLU  99           H        GLU  99   4.609  -5.261   0.982
  809    HA   GLU  99           HA       GLU  99   5.100  -3.218   3.101
  810   1HB   GLU  99          1HB       GLU  99   6.711  -4.985   2.818
  811   2HB   GLU  99          2HB       GLU  99   7.041  -4.457   1.166
  812   1HG   GLU  99          1HG       GLU  99   7.807  -2.258   2.005
  813   2HG   GLU  99          2HG       GLU  99   7.279  -2.675   3.643
  814    HE2  GLU  99           HE       GLU  99  10.827  -3.172   3.688
  815    H    THR 100           H        THR 100   6.008  -1.141   2.405
  816    HA   THR 100           HA       THR 100   4.480  -0.183   0.087
  817    HB   THR 100           HB       THR 100   4.060   1.696   1.205
  818    HG1  THR 100           1HG      THR 100   5.404   2.485   2.914
  819   1HG2  THR 100          1HG2      THR 100   3.499   1.202   3.508
  820   2HG2  THR 100          2HG2      THR 100   3.247  -0.276   2.547
  821   3HG2  THR 100          3HG2      THR 100   4.680  -0.105   3.589
  822    H    TYR 101           H        TYR 101   5.241   1.056  -1.536
  823    HA   TYR 101           HA       TYR 101   8.122   1.141  -2.065
  824   1HB   TYR 101          1HB       TYR 101   6.320   0.654  -3.731
  825   2HB   TYR 101          2HB       TYR 101   5.755   2.322  -3.523
  826    HD1  TYR 101           1HD      TYR 101   6.809   4.118  -4.679
  827    HD2  TYR 101           2HD      TYR 101   8.240   0.086  -5.029
  828    HE1  TYR 101           1HE      TYR 101   8.360   4.834  -6.490
  829    HE2  TYR 101           2HE      TYR 101   9.818   0.791  -6.813
  830    HH   TYR 101           HH       TYR 101  10.672   2.562  -8.020
  Start of MODEL   16
    1   1H    GLY  -1          1H        GLY  -1   0.587 -42.082  17.213
    2   2H    GLY  -1          2H        GLY  -1   2.123 -42.597  16.895
    3   3H    GLY  -1          3H        GLY  -1   1.868 -41.071  17.460
    4   1HA   GLY  -1          1HA       GLY  -1   1.023 -42.109  14.851
    5   2HA   GLY  -1          2HA       GLY  -1   0.651 -40.493  15.478
    6    H    SER   0           H        SER   0   2.736 -42.103  13.459
    7    HA   SER   0           HA       SER   0   4.769 -39.925  13.610
    8   1HB   SER   0          1HB       SER   0   5.364 -42.901  13.305
    9   2HB   SER   0          2HB       SER   0   6.550 -41.579  13.286
   10    HG   SER   0           HG       SER   0   5.828 -41.079  15.436
   11    H    MET   1           H        MET   1   2.477 -40.031  11.918
   12    HA   MET   1           HA       MET   1   3.304 -41.131   9.330
   13   1HB   MET   1          1HB       MET   1   0.839 -39.534  10.136
   14   2HB   MET   1          2HB       MET   1   1.110 -40.348   8.585
   15   1HG   MET   1          1HG       MET   1   1.441 -42.508   9.921
   16   2HG   MET   1          2HG       MET   1   0.809 -41.624  11.318
   17   1HE   MET   1          1HE       MET   1  -0.632 -44.321  10.628
   18   2HE   MET   1          2HE       MET   1  -2.302 -43.727  10.790
   19   3HE   MET   1          3HE       MET   1  -1.040 -43.131  11.890
   20    H    LYS   2           H        LYS   2   5.263 -39.441   9.996
   21    HA   LYS   2           HA       LYS   2   4.775 -36.781   8.811
   22   1HB   LYS   2          1HB       LYS   2   6.067 -37.100  10.915
   23   2HB   LYS   2          2HB       LYS   2   7.299 -37.987  10.005
   24   1HG   LYS   2          1HG       LYS   2   7.671 -35.946   8.598
   25   2HG   LYS   2          2HG       LYS   2   6.415 -35.097   9.519
   26   1HD   LYS   2          1HD       LYS   2   7.731 -35.266  11.570
   27   2HD   LYS   2          2HD       LYS   2   8.902 -36.332  10.775
   28   1HE   LYS   2          1HE       LYS   2   9.870 -34.127  10.912
   29   2HE   LYS   2          2HE       LYS   2   9.519 -34.487   9.211
   30   1HZ   LYS   2          1HZ       LYS   2   8.752 -32.291   9.724
   31   2HZ   LYS   2          2HZ       LYS   2   7.764 -32.878  10.960
   32    H    LYS   3           H        LYS   3   4.135 -38.013   6.802
   33    HA   LYS   3           HA       LYS   3   6.386 -39.070   5.188
   34   1HB   LYS   3          1HB       LYS   3   3.405 -38.961   4.575
   35   2HB   LYS   3          2HB       LYS   3   4.679 -39.795   3.662
   36   1HG   LYS   3          1HG       LYS   3   5.128 -41.227   5.657
   37   2HG   LYS   3          2HG       LYS   3   3.781 -40.434   6.506
   38   1HD   LYS   3          1HD       LYS   3   2.215 -41.173   4.725
   39   2HD   LYS   3          2HD       LYS   3   3.563 -41.929   3.859
   40   1HE   LYS   3          1HE       LYS   3   2.410 -43.671   5.028
   41   2HE   LYS   3          2HE       LYS   3   3.958 -43.417   5.856
   42   1HZ   LYS   3          1HZ       LYS   3   2.187 -43.544   7.459
   43   2HZ   LYS   3          2HZ       LYS   3   1.401 -42.232   6.745
   44    H    TRP   4           H        TRP   4   3.611 -36.856   4.582
   45    HA   TRP   4           HA       TRP   4   5.311 -34.999   3.018
   46   1HB   TRP   4          1HB       TRP   4   3.416 -34.982   1.369
   47   2HB   TRP   4          2HB       TRP   4   4.410 -36.433   1.402
   48    HD1  TRP   4           HD       TRP   4   0.963 -35.278   2.733
   49    HE1  TRP   4           1HE      TRP   4  -0.628 -37.308   2.795
   50    HE3  TRP   4           3HE      TRP   4   4.211 -38.938   1.207
   51    HZ2  TRP   4           2HZ      TRP   4  -0.504 -40.113   2.287
   52    HZ3  TRP   4           3HZ      TRP   4   3.440 -41.280   1.017
   53    HH2  TRP   4           HH       TRP   4   1.094 -41.883   1.565
   54    H    SER   5           H        SER   5   4.383 -32.907   2.902
   55    HA   SER   5           HA       SER   5   2.905 -32.003   5.196
   56   1HB   SER   5          1HB       SER   5   3.498 -30.554   2.578
   57   2HB   SER   5          2HB       SER   5   2.989 -29.808   4.107
   58    HG   SER   5           HG       SER   5   4.910 -30.693   5.044
   59    H    ASP   6           H        ASP   6   0.794 -31.075   5.262
   60    HA   ASP   6           HA       ASP   6  -1.215 -32.525   3.938
   61   1HB   ASP   6          1HB       ASP   6  -1.545 -31.504   6.130
   62   2HB   ASP   6          2HB       ASP   6  -1.324 -29.885   5.445
   63    HD2  ASP   6           HD       ASP   6  -4.723 -29.628   4.957
   64    H    THR   7           H        THR   7  -2.016 -32.311   1.911
   65    HA   THR   7           HA       THR   7  -1.302 -30.043   0.219
   66    HB   THR   7           HB       THR   7  -2.659 -31.307  -1.475
   67    HG1  THR   7           1HG      THR   7  -3.251 -33.435  -0.858
   68   1HG2  THR   7          1HG2      THR   7  -1.042 -33.138  -1.719
   69   2HG2  THR   7          2HG2      THR   7  -0.209 -31.655  -1.223
   70   3HG2  THR   7          3HG2      THR   7  -0.514 -32.942  -0.036
   71    H    GLU   8           H        GLU   8  -2.585 -28.347  -0.312
   72    HA   GLU   8           HA       GLU   8  -5.398 -28.201   0.620
   73   1HB   GLU   8          1HB       GLU   8  -3.191 -26.208   1.310
   74   2HB   GLU   8          2HB       GLU   8  -4.917 -25.990   1.640
   75   1HG   GLU   8          1HG       GLU   8  -4.894 -28.018   3.086
   76   2HG   GLU   8          2HG       GLU   8  -3.142 -28.154   2.845
   77    HE2  GLU   8           HE       GLU   8  -2.518 -25.087   4.646
   78    H    VAL   9           H        VAL   9  -6.355 -26.067  -0.192
   79    HA   VAL   9           HA       VAL   9  -6.068 -25.966  -3.029
   80    HB   VAL   9           HB       VAL   9  -7.481 -24.057  -1.116
   81   1HG1  VAL   9          1HG1      VAL   9  -7.740 -24.419  -4.133
   82   2HG1  VAL   9          2HG1      VAL   9  -8.785 -23.400  -3.125
   83   3HG1  VAL   9          3HG1      VAL   9  -7.077 -22.987  -3.309
   84   1HG2  VAL   9          1HG2      VAL   9  -8.477 -26.439  -2.746
   85   2HG2  VAL   9          2HG2      VAL   9  -8.375 -26.354  -0.974
   86   3HG2  VAL   9          3HG2      VAL   9  -9.510 -25.313  -1.843
   87    H    PHE  10           H        PHE  10  -4.441 -25.105  -4.088
   88    HA   PHE  10           HA       PHE  10  -2.324 -23.669  -3.032
   89   1HB   PHE  10          1HB       PHE  10  -3.211 -23.527  -5.929
   90   2HB   PHE  10          2HB       PHE  10  -1.570 -23.432  -5.295
   91    HD1  PHE  10           1HD      PHE  10  -0.955 -25.624  -3.725
   92    HD2  PHE  10           2HD      PHE  10  -3.847 -25.552  -6.930
   93    HE1  PHE  10           1HE      PHE  10  -0.955 -28.101  -3.793
   94    HE2  PHE  10           2HE      PHE  10  -3.822 -28.024  -7.002
   95    HZ   PHE  10           HZ       PHE  10  -2.382 -29.306  -5.432
   96    H    GLU  11           H        GLU  11  -5.172 -22.443  -4.772
   97    HA   GLU  11           HA       GLU  11  -4.432 -19.620  -4.313
   98   1HB   GLU  11          1HB       GLU  11  -6.436 -19.122  -5.636
   99   2HB   GLU  11          2HB       GLU  11  -5.255 -20.096  -6.504
  100   1HG   GLU  11          1HG       GLU  11  -7.610 -21.429  -5.128
  101   2HG   GLU  11          2HG       GLU  11  -7.766 -20.672  -6.714
  102    HE2  GLU  11           HE       GLU  11  -5.911 -23.075  -8.433
  103    H    MET  12           H        MET  12  -4.582 -20.756  -1.919
  104    HA   MET  12           HA       MET  12  -7.145 -20.839  -0.717
  105   1HB   MET  12          1HB       MET  12  -4.437 -21.220   0.117
  106   2HB   MET  12          2HB       MET  12  -5.090 -19.990   1.177
  107   1HG   MET  12          1HG       MET  12  -7.041 -21.460   1.665
  108   2HG   MET  12          2HG       MET  12  -6.366 -22.693   0.595
  109   1HE   MET  12          1HE       MET  12  -7.304 -23.199   3.614
  110   2HE   MET  12          2HE       MET  12  -5.998 -24.272   4.164
  111   3HE   MET  12          3HE       MET  12  -6.682 -24.470   2.535
  112    H    LEU  13           H        LEU  13  -4.680 -18.220  -0.717
  113    HA   LEU  13           HA       LEU  13  -6.839 -16.243  -0.192
  114   1HB   LEU  13          1HB       LEU  13  -5.256 -14.785   0.714
  115   2HB   LEU  13          2HB       LEU  13  -5.020 -16.372   1.424
  116    HG   LEU  13           HG       LEU  13  -3.059 -16.606  -0.304
  117   1HD1  LEU  13          1HD1      LEU  13  -1.991 -14.351  -0.730
  118   2HD1  LEU  13          2HD1      LEU  13  -3.480 -14.552  -1.659
  119   3HD1  LEU  13          3HD1      LEU  13  -3.485 -13.575  -0.178
  120   1HD2  LEU  13          1HD2      LEU  13  -1.594 -15.411   1.356
  121   2HD2  LEU  13          2HD2      LEU  13  -3.051 -14.704   2.088
  122   3HD2  LEU  13          3HD2      LEU  13  -2.792 -16.461   2.127
  123    H    LYS  14           H        LYS  14  -6.761 -14.264  -1.376
  124    HA   LYS  14           HA       LYS  14  -6.186 -14.807  -4.256
  125   1HB   LYS  14          1HB       LYS  14  -8.487 -15.088  -3.581
  126   2HB   LYS  14          2HB       LYS  14  -8.532 -13.508  -2.795
  127   1HG   LYS  14          1HG       LYS  14  -7.825 -13.740  -5.719
  128   2HG   LYS  14          2HG       LYS  14  -9.515 -13.899  -5.238
  129   1HD   LYS  14          1HD       LYS  14  -7.849 -11.454  -4.494
  130   2HD   LYS  14          2HD       LYS  14  -8.810 -11.589  -5.955
  131   1HE   LYS  14          1HE       LYS  14 -10.818 -12.037  -4.396
  132   2HE   LYS  14          2HE       LYS  14  -9.741 -11.600  -3.055
  133   1HZ   LYS  14          1HZ       LYS  14 -10.899  -9.655  -3.859
  134   2HZ   LYS  14          2HZ       LYS  14 -10.194  -9.848  -5.382
  135    H    ARG  15           H        ARG  15  -5.465 -13.091  -5.543
  136    HA   ARG  15           HA       ARG  15  -4.205 -10.855  -4.136
  137   1HB   ARG  15          1HB       ARG  15  -4.164 -11.538  -7.075
  138   2HB   ARG  15          2HB       ARG  15  -3.226 -10.279  -6.246
  139   1HG   ARG  15          1HG       ARG  15  -2.364 -12.145  -4.686
  140   2HG   ARG  15          2HG       ARG  15  -3.134 -13.266  -5.808
  141   1HD   ARG  15          1HD       ARG  15  -0.889 -13.166  -6.494
  142   2HD   ARG  15          2HD       ARG  15  -1.762 -12.148  -7.670
  143    HE   ARG  15           HE       ARG  15  -0.626 -10.789  -5.307
  144   1HH1  ARG  15          2HH1      ARG  15  -0.005 -11.663  -8.703
  145   2HH1  ARG  15          1HH1      ARG  15   1.496 -10.773  -8.761
  146   1HH2  ARG  15          1HH2      ARG  15   1.329  -9.698  -5.407
  147   2HH2  ARG  15          2HH2      ARG  15   2.213  -9.576  -6.907
  148    H    MET  16           H        MET  16  -5.470  -9.239  -3.522
  149    HA   MET  16           HA       MET  16  -7.630  -8.228  -5.290
  150   1HB   MET  16          1HB       MET  16  -8.011  -6.707  -3.479
  151   2HB   MET  16          2HB       MET  16  -8.410  -8.393  -3.163
  152   1HG   MET  16          1HG       MET  16  -6.686  -8.653  -1.604
  153   2HG   MET  16          2HG       MET  16  -5.812  -7.248  -2.185
  154   1HE   MET  16          1HE       MET  16  -6.596  -4.825  -2.080
  155   2HE   MET  16          2HE       MET  16  -7.565  -4.191  -0.735
  156   3HE   MET  16          3HE       MET  16  -8.359  -4.878  -2.164
  157    H    TYR  17           H        TYR  17  -6.530  -7.254  -6.957
  158    HA   TYR  17           HA       TYR  17  -4.381  -5.302  -6.535
  159   1HB   TYR  17          1HB       TYR  17  -4.390  -6.601  -8.568
  160   2HB   TYR  17          2HB       TYR  17  -6.025  -6.096  -8.959
  161    HD1  TYR  17           1HD      TYR  17  -6.507  -3.865  -9.868
  162    HD2  TYR  17           2HD      TYR  17  -2.497  -5.056  -8.851
  163    HE1  TYR  17           1HE      TYR  17  -5.611  -2.137 -11.392
  164    HE2  TYR  17           2HE      TYR  17  -1.594  -3.250 -10.290
  165    HH   TYR  17           HH       TYR  17  -2.092  -1.694 -11.900
  166    H    ALA  18           H        ALA  18  -4.701  -3.118  -6.213
  167    HA   ALA  18           HA       ALA  18  -7.389  -1.972  -6.694
  168   1HB   ALA  18          1HB       ALA  18  -7.426  -0.907  -4.520
  169   2HB   ALA  18          2HB       ALA  18  -7.498  -2.679  -4.411
  170   3HB   ALA  18          3HB       ALA  18  -5.977  -1.826  -4.034
  171    H    ARG  19           H        ARG  19  -6.914  -0.645  -8.170
  172    HA   ARG  19           HA       ARG  19  -4.548   1.092  -8.132
  173   1HB   ARG  19          1HB       ARG  19  -5.150  -0.207 -10.131
  174   2HB   ARG  19          2HB       ARG  19  -6.698   0.643 -10.236
  175   1HG   ARG  19          1HG       ARG  19  -5.219   1.608 -11.799
  176   2HG   ARG  19          2HG       ARG  19  -5.379   2.800 -10.491
  177   1HD   ARG  19          1HD       ARG  19  -3.223   2.155  -9.583
  178   2HD   ARG  19          2HD       ARG  19  -3.132   0.776 -10.690
  179    HE   ARG  19           HE       ARG  19  -3.240   3.632 -11.586
  180   1HH1  ARG  19          1HH1      ARG  19  -1.589   0.467 -11.855
  181   2HH1  ARG  19          2HH1      ARG  19  -0.676   0.962 -13.253
  182   1HH2  ARG  19          1HH2      ARG  19  -2.007   4.223 -13.343
  183   2HH2  ARG  19          2HH2      ARG  19  -0.936   3.090 -14.137
  184    H    VAL  20           H        VAL  20  -4.929   2.812  -6.724
  185    HA   VAL  20           HA       VAL  20  -7.562   4.166  -6.868
  186    HB   VAL  20           HB       VAL  20  -6.789   3.709  -4.661
  187   1HG1  VAL  20          1HG1      VAL  20  -4.498   5.610  -5.276
  188   2HG1  VAL  20          2HG1      VAL  20  -4.950   5.026  -3.681
  189   3HG1  VAL  20          3HG1      VAL  20  -4.365   3.870  -4.903
  190   1HG2  VAL  20          1HG2      VAL  20  -6.807   6.688  -5.310
  191   2HG2  VAL  20          2HG2      VAL  20  -8.240   5.660  -5.152
  192   3HG2  VAL  20          3HG2      VAL  20  -7.195   5.941  -3.749
  193    H    TYR  21           H        TYR  21  -7.935   5.818  -8.071
  194    HA   TYR  21           HA       TYR  21  -5.728   7.366  -9.336
  195   1HB   TYR  21          1HB       TYR  21  -8.674   7.089  -9.988
  196   2HB   TYR  21          2HB       TYR  21  -7.639   8.240 -10.737
  197    HD1  TYR  21           1HD      TYR  21  -5.647   7.476 -12.087
  198    HD2  TYR  21           2HD      TYR  21  -8.552   4.682 -10.559
  199    HE1  TYR  21           1HE      TYR  21  -4.744   5.713 -13.574
  200    HE2  TYR  21           2HE      TYR  21  -7.676   2.943 -12.075
  201    HH   TYR  21           HH       TYR  21  -6.216   2.461 -13.803
  202    H    GLY  22           H        GLY  22  -5.789   9.626  -9.327
  203   1HA   GLY  22          1HA       GLY  22  -7.173  11.621  -8.882
  204   2HA   GLY  22          2HA       GLY  22  -7.449  10.991  -7.242
  205    H    LEU  23           H        LEU  23  -6.544  13.100  -6.661
  206    HA   LEU  23           HA       LEU  23  -3.601  13.352  -6.939
  207   1HB   LEU  23          1HB       LEU  23  -5.057  15.290  -7.421
  208   2HB   LEU  23          2HB       LEU  23  -5.596  15.267  -5.744
  209    HG   LEU  23           HG       LEU  23  -3.111  15.538  -5.103
  210   1HD1  LEU  23          1HD1      LEU  23  -1.655  16.566  -6.829
  211   2HD1  LEU  23          2HD1      LEU  23  -2.020  14.876  -7.191
  212   3HD1  LEU  23          3HD1      LEU  23  -2.865  16.174  -8.068
  213   1HD2  LEU  23          1HD2      LEU  23  -3.161  17.968  -5.532
  214   2HD2  LEU  23          2HD2      LEU  23  -4.435  17.737  -6.749
  215   3HD2  LEU  23          3HD2      LEU  23  -4.763  17.389  -5.039
  216    H    VAL  24           H        VAL  24  -4.182  11.094  -5.746
  217    HA   VAL  24           HA       VAL  24  -3.704  11.580  -2.858
  218    HB   VAL  24           HB       VAL  24  -4.419   9.407  -2.398
  219   1HG1  VAL  24          1HG1      VAL  24  -6.251  10.281  -4.663
  220   2HG1  VAL  24          2HG1      VAL  24  -6.680   9.305  -3.243
  221   3HG1  VAL  24          3HG1      VAL  24  -6.276  11.018  -3.058
  222   1HG2  VAL  24          1HG2      VAL  24  -4.436   8.774  -5.375
  223   2HG2  VAL  24          2HG2      VAL  24  -3.273   8.147  -4.178
  224   3HG2  VAL  24          3HG2      VAL  24  -4.977   7.709  -4.057
  225    H    GLN  25           H        GLN  25  -1.861  11.437  -5.521
  226    HA   GLN  25           HA       GLN  25   0.318   9.841  -4.374
  227   1HB   GLN  25          1HB       GLN  25  -0.153   9.920  -6.789
  228   2HB   GLN  25          2HB       GLN  25   0.236  11.646  -6.828
  229   1HG   GLN  25          1HG       GLN  25   2.526  11.255  -6.449
  230   2HG   GLN  25          2HG       GLN  25   2.237   9.688  -5.674
  231   1HE2  GLN  25          1HE2      GLN  25   2.856   7.980  -6.850
  232   2HE2  GLN  25          2HE2      GLN  25   2.653   7.789  -8.576
  233    H    GLY  26           H        GLY  26   2.340  10.855  -3.718
  234   1HA   GLY  26          1HA       GLY  26   3.640  12.544  -2.803
  235   2HA   GLY  26          2HA       GLY  26   2.337  13.716  -3.023
  236    H    VAL  27           H        VAL  27   0.202  12.759  -1.736
  237    HA   VAL  27           HA       VAL  27   0.856  12.742   1.091
  238    HB   VAL  27           HB       VAL  27  -1.560  12.518   1.437
  239   1HG1  VAL  27          1HG1      VAL  27  -0.955  14.565  -0.727
  240   2HG1  VAL  27          2HG1      VAL  27  -2.285  14.600   0.443
  241   3HG1  VAL  27          3HG1      VAL  27  -0.614  14.752   1.012
  242   1HG2  VAL  27          1HG2      VAL  27  -1.753  12.278  -1.593
  243   2HG2  VAL  27          2HG2      VAL  27  -2.193  11.027  -0.400
  244   3HG2  VAL  27          3HG2      VAL  27  -3.098  12.552  -0.483
  245    H    GLY  28           H        GLY  28  -0.551  10.949   2.391
  246   1HA   GLY  28          1HA       GLY  28   1.120   8.689   2.298
  247   2HA   GLY  28          2HA       GLY  28  -0.322   8.879   3.297
  248    H    PHE  29           H        PHE  29  -2.294   7.975   2.597
  249    HA   PHE  29           HA       PHE  29  -3.582   6.339   1.867
  250   1HB   PHE  29          1HB       PHE  29  -3.855   7.400  -0.171
  251   2HB   PHE  29          2HB       PHE  29  -2.230   7.051  -0.728
  252    HD1  PHE  29           1HD      PHE  29  -1.752   5.166  -2.061
  253    HD2  PHE  29           2HD      PHE  29  -5.391   5.237   0.235
  254    HE1  PHE  29           1HE      PHE  29  -2.424   3.000  -3.035
  255    HE2  PHE  29           2HE      PHE  29  -6.148   3.164  -0.870
  256    HZ   PHE  29           HZ       PHE  29  -4.668   2.022  -2.502
  257    H    ARG  30           H        ARG  30  -0.492   5.568   0.271
  258    HA   ARG  30           HA       ARG  30  -0.566   2.835   0.251
  259   1HB   ARG  30          1HB       ARG  30   1.835   2.956  -0.033
  260   2HB   ARG  30          2HB       ARG  30   1.058   4.310  -0.856
  261   1HG   ARG  30          1HG       ARG  30   1.590   5.702   1.279
  262   2HG   ARG  30          2HG       ARG  30   2.637   4.355   1.761
  263   1HD   ARG  30          1HD       ARG  30   3.945   4.599  -0.284
  264   2HD   ARG  30          2HD       ARG  30   2.804   5.841  -0.880
  265    HE   ARG  30           HE       ARG  30   3.640   6.868   1.502
  266   1HH1  ARG  30          1HH1      ARG  30   5.387   5.759  -1.415
  267   2HH1  ARG  30          2HH1      ARG  30   6.552   7.050  -1.334
  268   1HH2  ARG  30          1HH2      ARG  30   5.156   8.560   1.543
  269   2HH2  ARG  30          2HH2      ARG  30   6.429   8.644   0.353
  270    H    LYS  31           H        LYS  31   0.144   4.901   3.010
  271    HA   LYS  31           HA       LYS  31   1.212   2.814   4.697
  272   1HB   LYS  31          1HB       LYS  31   1.843   5.256   4.754
  273   2HB   LYS  31          2HB       LYS  31   0.251   5.595   5.441
  274   1HG   LYS  31          1HG       LYS  31   0.767   3.978   7.314
  275   2HG   LYS  31          2HG       LYS  31   2.402   3.798   6.662
  276   1HD   LYS  31          1HD       LYS  31   1.140   6.417   7.608
  277   2HD   LYS  31          2HD       LYS  31   2.212   5.387   8.571
  278   1HE   LYS  31          1HE       LYS  31   4.010   5.693   6.833
  279   2HE   LYS  31          2HE       LYS  31   2.959   6.861   6.003
  280   1HZ   LYS  31          1HZ       LYS  31   4.407   8.016   7.503
  281   2HZ   LYS  31          2HZ       LYS  31   3.809   7.134   8.812
  282    H    PHE  32           H        PHE  32  -1.791   4.789   4.549
  283    HA   PHE  32           HA       PHE  32  -3.093   3.785   6.727
  284   1HB   PHE  32          1HB       PHE  32  -3.795   5.697   5.388
  285   2HB   PHE  32          2HB       PHE  32  -4.356   4.626   4.109
  286    HD1  PHE  32           1HD      PHE  32  -6.452   5.954   4.313
  287    HD2  PHE  32           2HD      PHE  32  -5.115   3.391   7.515
  288    HE1  PHE  32           1HE      PHE  32  -8.660   6.166   5.431
  289    HE2  PHE  32           2HE      PHE  32  -7.308   3.520   8.551
  290    HZ   PHE  32           HZ       PHE  32  -9.115   4.901   7.526
  291    H    VAL  33           H        VAL  33  -3.289   2.536   3.358
  292    HA   VAL  33           HA       VAL  33  -4.980   0.275   3.976
  293    HB   VAL  33           HB       VAL  33  -4.258  -0.632   1.803
  294   1HG1  VAL  33          1HG1      VAL  33  -4.890   2.342   1.619
  295   2HG1  VAL  33          2HG1      VAL  33  -5.195   1.091   0.392
  296   3HG1  VAL  33          3HG1      VAL  33  -6.066   1.045   1.930
  297   1HG2  VAL  33          1HG2      VAL  33  -2.357   1.740   1.655
  298   2HG2  VAL  33          2HG2      VAL  33  -1.899   0.032   1.738
  299   3HG2  VAL  33          3HG2      VAL  33  -2.757   0.656   0.321
  300    H    GLN  34           H        GLN  34  -1.622   0.934   4.501
  301    HA   GLN  34           HA       GLN  34  -0.769  -1.806   4.655
  302   1HB   GLN  34          1HB       GLN  34   0.559   0.616   4.509
  303   2HB   GLN  34          2HB       GLN  34   0.738   0.275   6.226
  304   1HG   GLN  34          1HG       GLN  34   2.633  -0.501   4.831
  305   2HG   GLN  34          2HG       GLN  34   1.864  -1.800   5.741
  306   1HE2  GLN  34          1HE2      GLN  34   1.070  -0.156   2.582
  307   2HE2  GLN  34          2HE2      GLN  34   0.994  -1.657   1.672
  308    H    ILE  35           H        ILE  35  -1.440   0.650   7.222
  309    HA   ILE  35           HA       ILE  35  -1.304  -0.912   9.450
  310    HB   ILE  35           HB       ILE  35  -3.583   1.012   8.798
  311   1HG1  ILE  35          1HG1      ILE  35  -1.496   2.192   8.563
  312   2HG1  ILE  35          2HG1      ILE  35  -2.334   2.712  10.017
  313   1HG2  ILE  35          1HG2      ILE  35  -3.749   1.286  11.292
  314   2HG2  ILE  35          2HG2      ILE  35  -4.268  -0.288  10.700
  315   3HG2  ILE  35          3HG2      ILE  35  -2.683  -0.125  11.469
  316   1HD1  ILE  35          1HD1      ILE  35   0.032   2.506  10.465
  317   2HD1  ILE  35          2HD1      ILE  35  -0.824   1.259  11.388
  318   3HD1  ILE  35          3HD1      ILE  35   0.057   0.828   9.899
  319    H    HIS  36           H        HIS  36  -4.234  -0.778   7.383
  320    HA   HIS  36           HA       HIS  36  -5.663  -2.709   8.983
  321   1HB   HIS  36          1HB       HIS  36  -6.099  -1.490   6.239
  322   2HB   HIS  36          2HB       HIS  36  -7.138  -2.770   6.883
  323    HD2  HIS  36           2HD      HIS  36  -5.968   0.768   8.398
  324    HE1  HIS  36           1HE      HIS  36 -10.014  -0.005   9.352
  325    HE2  HIS  36           2HE      HIS  36  -8.097   1.663   9.602
  326    H    ALA  37           H        ALA  37  -4.054  -2.955   5.755
  327    HA   ALA  37           HA       ALA  37  -4.278  -5.596   5.276
  328   1HB   ALA  37          1HB       ALA  37  -2.016  -5.408   4.144
  329   2HB   ALA  37          2HB       ALA  37  -3.197  -4.164   3.705
  330   3HB   ALA  37          3HB       ALA  37  -1.870  -3.804   4.827
  331    H    ILE  38           H        ILE  38  -1.314  -4.356   6.805
  332    HA   ILE  38           HA       ILE  38  -0.130  -6.586   7.789
  333    HB   ILE  38           HB       ILE  38  -0.227  -3.716   8.619
  334   1HG1  ILE  38          1HG1      ILE  38   2.157  -3.861   8.073
  335   2HG1  ILE  38          2HG1      ILE  38   2.067  -5.619   7.927
  336   1HG2  ILE  38          1HG2      ILE  38   1.444  -4.031  10.360
  337   2HG2  ILE  38          2HG2      ILE  38  -0.148  -4.622  10.815
  338   3HG2  ILE  38          3HG2      ILE  38   1.123  -5.783  10.346
  339   1HD1  ILE  38          1HD1      ILE  38   2.161  -4.414   5.765
  340   2HD1  ILE  38          2HD1      ILE  38   0.716  -5.429   5.890
  341   3HD1  ILE  38          3HD1      ILE  38   0.595  -3.674   6.100
  342    H    ARG  39           H        ARG  39  -2.542  -4.632   9.644
  343    HA   ARG  39           HA       ARG  39  -2.681  -6.103  11.913
  344   1HB   ARG  39          1HB       ARG  39  -3.655  -3.945  11.424
  345   2HB   ARG  39          2HB       ARG  39  -5.034  -4.711  10.621
  346   1HG   ARG  39          1HG       ARG  39  -4.196  -5.417  13.453
  347   2HG   ARG  39          2HG       ARG  39  -5.047  -3.902  13.115
  348   1HD   ARG  39          1HD       ARG  39  -6.935  -5.080  12.141
  349   2HD   ARG  39          2HD       ARG  39  -6.123  -6.642  12.393
  350    HE   ARG  39           HE       ARG  39  -6.320  -5.110  14.832
  351   1HH1  ARG  39          1HH1      ARG  39  -8.200  -7.236  12.702
  352   2HH1  ARG  39          2HH1      ARG  39  -9.241  -7.806  13.981
  353   1HH2  ARG  39          1HH2      ARG  39  -7.687  -5.856  16.497
  354   2HH2  ARG  39          2HH2      ARG  39  -8.953  -7.006  16.151
  355    H    LEU  40           H        LEU  40  -4.468  -6.615   8.899
  356    HA   LEU  40           HA       LEU  40  -5.867  -9.028   9.854
  357   1HB   LEU  40          1HB       LEU  40  -6.018  -7.472   7.277
  358   2HB   LEU  40          2HB       LEU  40  -7.104  -8.786   7.750
  359    HG   LEU  40           HG       LEU  40  -6.787  -6.198   9.362
  360   1HD1  LEU  40          1HD1      LEU  40  -8.902  -5.540   8.342
  361   2HD1  LEU  40          2HD1      LEU  40  -7.617  -5.727   7.131
  362   3HD1  LEU  40          3HD1      LEU  40  -8.857  -6.993   7.305
  363   1HD2  LEU  40          1HD2      LEU  40  -8.928  -6.897  10.373
  364   2HD2  LEU  40          2HD2      LEU  40  -8.847  -8.437   9.487
  365   3HD2  LEU  40          3HD2      LEU  40  -7.638  -8.048  10.732
  366    H    GLY  41           H        GLY  41  -2.777  -8.843   9.000
  367   1HA   GLY  41          1HA       GLY  41  -1.279 -10.306   8.144
  368   2HA   GLY  41          2HA       GLY  41  -2.525 -11.548   8.338
  369    H    ILE  42           H        ILE  42  -2.251  -8.686   6.188
  370    HA   ILE  42           HA       ILE  42  -2.811 -10.334   3.783
  371    HB   ILE  42           HB       ILE  42  -2.809  -7.374   4.351
  372   1HG1  ILE  42          1HG1      ILE  42  -4.661  -8.357   5.486
  373   2HG1  ILE  42          2HG1      ILE  42  -5.234  -7.437   4.082
  374   1HG2  ILE  42          1HG2      ILE  42  -3.885  -6.961   2.227
  375   2HG2  ILE  42          2HG2      ILE  42  -2.310  -7.711   1.989
  376   3HG2  ILE  42          3HG2      ILE  42  -3.782  -8.673   1.796
  377   1HD1  ILE  42          1HD1      ILE  42  -6.493  -9.504   4.361
  378   2HD1  ILE  42          2HD1      ILE  42  -5.585  -9.495   2.846
  379   3HD1  ILE  42          3HD1      ILE  42  -5.017 -10.470   4.228
  380    H    LYS  43           H        LYS  43  -1.387 -10.335   2.085
  381    HA   LYS  43           HA       LYS  43   1.400  -9.336   2.579
  382   1HB   LYS  43          1HB       LYS  43   0.565 -11.442   0.587
  383   2HB   LYS  43          2HB       LYS  43   2.187 -10.968   1.086
  384   1HG   LYS  43          1HG       LYS  43   1.732 -11.792   3.381
  385   2HG   LYS  43          2HG       LYS  43   0.134 -12.363   2.839
  386   1HD   LYS  43          1HD       LYS  43   1.213 -13.856   1.178
  387   2HD   LYS  43          2HD       LYS  43   2.806 -13.240   1.658
  388   1HE   LYS  43          1HE       LYS  43   2.435 -15.394   2.721
  389   2HE   LYS  43          2HE       LYS  43   2.454 -14.127   3.959
  390   1HZ   LYS  43          1HZ       LYS  43   0.060 -14.222   4.014
  391   2HZ   LYS  43          2HZ       LYS  43   0.056 -15.423   2.826
  392    H    GLY  44           H        GLY  44   2.482  -8.618   0.358
  393   1HA   GLY  44          1HA       GLY  44   1.308  -8.148  -2.006
  394   2HA   GLY  44          2HA       GLY  44   0.527  -6.883  -1.029
  395    H    TYR  45           H        TYR  45   1.374  -5.249  -2.269
  396    HA   TYR  45           HA       TYR  45   3.661  -4.086  -1.120
  397   1HB   TYR  45          1HB       TYR  45   4.731  -5.720  -2.795
  398   2HB   TYR  45          2HB       TYR  45   4.037  -4.692  -4.035
  399    HD1  TYR  45           1HD      TYR  45   6.353  -4.810  -1.118
  400    HD2  TYR  45           2HD      TYR  45   5.271  -2.800  -4.765
  401    HE1  TYR  45           1HE      TYR  45   8.591  -3.732  -1.187
  402    HE2  TYR  45           2HE      TYR  45   7.505  -1.732  -4.842
  403    HH   TYR  45           HH       TYR  45   9.597  -1.596  -3.864
  404    H    ALA  46           H        ALA  46   3.535  -1.908  -1.416
  405    HA   ALA  46           HA       ALA  46   1.172  -0.861  -2.920
  406   1HB   ALA  46          1HB       ALA  46   1.198   0.944  -1.261
  407   2HB   ALA  46          2HB       ALA  46   0.941  -0.663  -0.572
  408   3HB   ALA  46          3HB       ALA  46   2.505   0.131  -0.395
  409    H    LYS  47           H        LYS  47   2.176  -0.410  -4.944
  410    HA   LYS  47           HA       LYS  47   4.664   1.149  -4.926
  411   1HB   LYS  47          1HB       LYS  47   4.657  -1.012  -5.938
  412   2HB   LYS  47          2HB       LYS  47   3.331  -0.552  -6.996
  413   1HG   LYS  47          1HG       LYS  47   4.848   1.233  -7.988
  414   2HG   LYS  47          2HG       LYS  47   6.146   0.639  -6.945
  415   1HD   LYS  47          1HD       LYS  47   4.702  -1.084  -8.994
  416   2HD   LYS  47          2HD       LYS  47   6.183  -0.170  -9.328
  417   1HE   LYS  47          1HE       LYS  47   7.375  -1.400  -7.529
  418   2HE   LYS  47          2HE       LYS  47   5.920  -2.375  -7.230
  419   1HZ   LYS  47          1HZ       LYS  47   7.367  -3.529  -8.729
  420   2HZ   LYS  47          2HZ       LYS  47   7.283  -2.258  -9.838
  421    H    ASN  48           H        ASN  48   4.046   3.274  -4.684
  422    HA   ASN  48           HA       ASN  48   2.180   4.503  -6.478
  423   1HB   ASN  48          1HB       ASN  48   3.349   6.560  -5.444
  424   2HB   ASN  48          2HB       ASN  48   2.318   5.526  -4.440
  425   1HD2  ASN  48          2HD2      ASN  48   5.841   5.735  -5.346
  426   2HD2  ASN  48          1HD2      ASN  48   6.390   5.341  -3.727
  427    H    LEU  49           H        LEU  49   2.610   4.847  -8.620
  428    HA   LEU  49           HA       LEU  49   5.368   4.795  -9.592
  429   1HB   LEU  49          1HB       LEU  49   2.775   4.973 -11.144
  430   2HB   LEU  49          2HB       LEU  49   4.397   4.606 -11.729
  431    HG   LEU  49           HG       LEU  49   4.081   2.692  -9.751
  432   1HD1  LEU  49          1HD1      LEU  49   1.880   1.741  -9.941
  433   2HD1  LEU  49          2HD1      LEU  49   1.666   3.407  -9.474
  434   3HD1  LEU  49          3HD1      LEU  49   1.379   2.930 -11.160
  435   1HD2  LEU  49          1HD2      LEU  49   3.686   1.083 -11.563
  436   2HD2  LEU  49          2HD2      LEU  49   3.307   2.414 -12.680
  437   3HD2  LEU  49          3HD2      LEU  49   4.944   2.252 -12.001
  438    HA   PRO  50           HA       PRO  50   4.829   9.147  -8.682
  439   1HB   PRO  50          1HB       PRO  50   7.300  10.151  -9.192
  440   2HB   PRO  50          2HB       PRO  50   6.903   9.100  -7.800
  441   1HG   PRO  50          1HG       PRO  50   8.091   8.235 -10.455
  442   2HG   PRO  50          2HG       PRO  50   8.685   7.846  -8.811
  443   1HD   PRO  50          1HD       PRO  50   7.102   6.122 -10.172
  444   2HD   PRO  50          2HD       PRO  50   6.877   6.373  -8.414
  445    H    ASP  51           H        ASP  51   4.209  10.967  -9.689
  446    HA   ASP  51           HA       ASP  51   3.361  12.280 -11.259
  447   1HB   ASP  51          1HB       ASP  51   5.722  12.579 -11.998
  448   2HB   ASP  51          2HB       ASP  51   5.514  11.267 -13.164
  449    HD2  ASP  51           HD       ASP  51   4.373  13.510 -15.512
  450    H    GLY  52           H        GLY  52   1.782  10.344 -10.779
  451   1HA   GLY  52          1HA       GLY  52   0.200  10.005 -13.058
  452   2HA   GLY  52          2HA       GLY  52   1.137   8.511 -12.846
  453    H    SER  53           H        SER  53  -0.159   7.069 -11.894
  454    HA   SER  53           HA       SER  53  -1.822   7.795  -9.512
  455   1HB   SER  53          1HB       SER  53  -3.330   5.952 -10.251
  456   2HB   SER  53          2HB       SER  53  -3.279   7.351 -11.338
  457    HG   SER  53           HG       SER  53  -1.878   6.204 -12.677
  458    H    VAL  54           H        VAL  54  -2.161   5.948  -8.024
  459    HA   VAL  54           HA       VAL  54   0.356   4.389  -7.737
  460    HB   VAL  54           HB       VAL  54   0.168   4.683  -5.385
  461   1HG1  VAL  54          1HG1      VAL  54  -0.361   7.386  -6.712
  462   2HG1  VAL  54          2HG1      VAL  54   0.589   7.070  -5.252
  463   3HG1  VAL  54          3HG1      VAL  54   1.165   6.493  -6.829
  464   1HG2  VAL  54          1HG2      VAL  54  -2.419   6.183  -5.881
  465   2HG2  VAL  54          2HG2      VAL  54  -2.189   4.687  -4.928
  466   3HG2  VAL  54          3HG2      VAL  54  -1.507   6.209  -4.361
  467    H    GLU  55           H        GLU  55   0.220   2.220  -7.814
  468    HA   GLU  55           HA       GLU  55  -2.438   0.963  -7.503
  469   1HB   GLU  55          1HB       GLU  55  -1.689  -0.797  -8.778
  470   2HB   GLU  55          2HB       GLU  55  -1.050   0.657  -9.556
  471   1HG   GLU  55          1HG       GLU  55   1.167   0.176  -8.402
  472   2HG   GLU  55          2HG       GLU  55   0.471  -1.342  -7.820
  473    HE2  GLU  55           HE       GLU  55   1.187  -0.962 -11.798
  474    H    VAL  56           H        VAL  56  -2.849  -0.612  -5.976
  475    HA   VAL  56           HA       VAL  56  -0.650  -1.495  -4.152
  476    HB   VAL  56           HB       VAL  56  -3.642  -1.436  -3.669
  477   1HG1  VAL  56          1HG1      VAL  56  -1.273  -2.049  -1.853
  478   2HG1  VAL  56          2HG1      VAL  56  -2.970  -1.924  -1.333
  479   3HG1  VAL  56          3HG1      VAL  56  -2.478  -3.224  -2.423
  480   1HG2  VAL  56          1HG2      VAL  56  -1.398   0.386  -2.688
  481   2HG2  VAL  56          2HG2      VAL  56  -2.778   0.843  -3.714
  482   3HG2  VAL  56          3HG2      VAL  56  -3.047   0.356  -2.033
  483    H    VAL  57           H        VAL  57  -0.226  -3.691  -4.145
  484    HA   VAL  57           HA       VAL  57  -2.118  -5.503  -5.599
  485    HB   VAL  57           HB       VAL  57   0.880  -5.951  -5.368
  486   1HG1  VAL  57          1HG1      VAL  57  -1.300  -7.057  -7.212
  487   2HG1  VAL  57          2HG1      VAL  57   0.412  -7.515  -7.232
  488   3HG1  VAL  57          3HG1      VAL  57  -0.597  -7.923  -5.833
  489   1HG2  VAL  57          1HG2      VAL  57  -0.639  -4.583  -7.622
  490   2HG2  VAL  57          2HG2      VAL  57   0.689  -3.903  -6.663
  491   3HG2  VAL  57          3HG2      VAL  57   1.000  -5.243  -7.770
  492    H    ALA  58           H        ALA  58  -3.111  -5.286  -3.430
  493    HA   ALA  58           HA       ALA  58  -1.814  -6.573  -1.148
  494   1HB   ALA  58          1HB       ALA  58  -4.138  -6.236  -0.158
  495   2HB   ALA  58          2HB       ALA  58  -3.324  -4.749  -0.698
  496   3HB   ALA  58          3HB       ALA  58  -4.578  -5.476  -1.700
  497    H    GLU  59           H        GLU  59  -2.388  -8.571  -0.324
  498    HA   GLU  59           HA       GLU  59  -3.891 -10.387  -2.098
  499   1HB   GLU  59          1HB       GLU  59  -1.386 -10.910  -0.514
  500   2HB   GLU  59          2HB       GLU  59  -2.171 -11.982  -1.686
  501   1HG   GLU  59          1HG       GLU  59  -1.723 -10.294  -3.474
  502   2HG   GLU  59          2HG       GLU  59  -0.924  -9.271  -2.280
  503    HE2  GLU  59           HE       GLU  59   1.399 -12.358  -2.102
  504    H    GLY  60           H        GLY  60  -5.794 -11.068  -0.875
  505   1HA   GLY  60          1HA       GLY  60  -5.383 -11.744   2.024
  506   2HA   GLY  60          2HA       GLY  60  -6.706 -10.731   1.425
  507    H    TYR  61           H        TYR  61  -6.627 -13.281   2.910
  508    HA   TYR  61           HA       TYR  61  -8.138 -15.198   1.376
  509   1HB   TYR  61          1HB       TYR  61  -7.812 -14.496   4.301
  510   2HB   TYR  61          2HB       TYR  61  -8.967 -15.704   3.765
  511    HD1  TYR  61           1HD      TYR  61  -5.391 -15.003   4.283
  512    HD2  TYR  61           2HD      TYR  61  -8.254 -17.844   2.742
  513    HE1  TYR  61           1HE      TYR  61  -3.717 -16.809   4.490
  514    HE2  TYR  61           2HE      TYR  61  -6.622 -19.663   3.088
  515    HH   TYR  61           HH       TYR  61  -4.453 -20.212   3.676
  516    H    GLU  62           H        GLU  62 -10.513 -15.505   2.034
  517    HA   GLU  62           HA       GLU  62 -11.805 -13.074   1.016
  518   1HB   GLU  62          1HB       GLU  62 -13.027 -15.781   1.624
  519   2HB   GLU  62          2HB       GLU  62 -13.687 -14.469   0.637
  520   1HG   GLU  62          1HG       GLU  62 -12.896 -16.117  -0.912
  521   2HG   GLU  62          2HG       GLU  62 -11.759 -14.764  -0.974
  522    HE2  GLU  62           HE       GLU  62  -9.356 -17.316  -0.880
  523    H    GLU  63           H        GLU  63 -11.660 -14.936   4.007
  524    HA   GLU  63           HA       GLU  63 -13.845 -13.539   5.309
  525   1HB   GLU  63          1HB       GLU  63 -11.519 -15.229   6.346
  526   2HB   GLU  63          2HB       GLU  63 -12.909 -14.690   7.303
  527   1HG   GLU  63          1HG       GLU  63 -14.435 -15.944   5.786
  528   2HG   GLU  63          2HG       GLU  63 -13.037 -16.560   4.891
  529    HE2  GLU  63           HE       GLU  63 -11.923 -18.550   7.672
  530    H    ALA  64           H        ALA  64 -10.664 -12.629   4.374
  531    HA   ALA  64           HA       ALA  64 -10.789 -10.299   6.242
  532   1HB   ALA  64          1HB       ALA  64  -8.348 -10.223   6.021
  533   2HB   ALA  64          2HB       ALA  64  -8.860 -11.798   6.659
  534   3HB   ALA  64          3HB       ALA  64  -8.380 -11.646   4.954
  535    H    LEU  65           H        LEU  65 -11.642 -11.123   3.105
  536    HA   LEU  65           HA       LEU  65 -10.138  -9.103   1.675
  537   1HB   LEU  65          1HB       LEU  65 -10.962 -11.084   0.590
  538   2HB   LEU  65          2HB       LEU  65 -12.642 -10.616   0.940
  539    HG   LEU  65           HG       LEU  65 -12.283  -8.585  -0.473
  540   1HD1  LEU  65          1HD1      LEU  65 -10.354  -8.530  -2.004
  541   2HD1  LEU  65          2HD1      LEU  65  -9.780  -8.399  -0.345
  542   3HD1  LEU  65          3HD1      LEU  65  -9.632  -9.944  -1.201
  543   1HD2  LEU  65          1HD2      LEU  65 -12.391  -9.824  -2.564
  544   2HD2  LEU  65          2HD2      LEU  65 -11.702 -11.262  -1.754
  545   3HD2  LEU  65          3HD2      LEU  65 -13.304 -10.648  -1.283
  546    H    SER  66           H        SER  66 -13.664  -9.294   2.198
  547    HA   SER  66           HA       SER  66 -14.468  -6.710   1.867
  548   1HB   SER  66          1HB       SER  66 -16.301  -7.267   3.448
  549   2HB   SER  66          2HB       SER  66 -15.999  -8.527   2.242
  550    HG   SER  66           HG       SER  66 -14.860  -9.692   3.814
  551    H    LYS  67           H        LYS  67 -13.075  -8.007   4.900
  552    HA   LYS  67           HA       LYS  67 -13.509  -5.863   6.599
  553   1HB   LYS  67          1HB       LYS  67 -11.262  -7.897   6.442
  554   2HB   LYS  67          2HB       LYS  67 -11.312  -6.652   7.691
  555   1HG   LYS  67          1HG       LYS  67 -12.244  -8.702   8.535
  556   2HG   LYS  67          2HG       LYS  67 -13.461  -7.417   8.517
  557   1HD   LYS  67          1HD       LYS  67 -14.541  -8.381   6.565
  558   2HD   LYS  67          2HD       LYS  67 -13.226  -9.565   6.369
  559   1HE   LYS  67          1HE       LYS  67 -13.864 -10.505   8.634
  560   2HE   LYS  67          2HE       LYS  67 -15.226  -9.364   8.668
  561   1HZ   LYS  67          1HZ       LYS  67 -15.974 -11.443   7.783
  562   2HZ   LYS  67          2HZ       LYS  67 -14.814 -11.386   6.557
  563    H    LEU  68           H        LEU  68 -10.703  -6.329   4.379
  564    HA   LEU  68           HA       LEU  68  -9.592  -3.701   4.993
  565   1HB   LEU  68          1HB       LEU  68  -8.044  -5.380   4.384
  566   2HB   LEU  68          2HB       LEU  68  -8.958  -5.833   2.940
  567    HG   LEU  68           HG       LEU  68  -8.361  -3.796   1.799
  568   1HD1  LEU  68          1HD1      LEU  68  -6.781  -2.144   2.799
  569   2HD1  LEU  68          2HD1      LEU  68  -8.340  -2.108   3.605
  570   3HD1  LEU  68          3HD1      LEU  68  -6.982  -2.939   4.377
  571   1HD2  LEU  68          1HD2      LEU  68  -5.964  -4.113   1.607
  572   2HD2  LEU  68          2HD2      LEU  68  -5.884  -4.861   3.216
  573   3HD2  LEU  68          3HD2      LEU  68  -6.714  -5.698   1.895
  574    H    LEU  69           H        LEU  69 -11.254  -5.149   2.120
  575    HA   LEU  69           HA       LEU  69 -11.156  -3.006   0.558
  576   1HB   LEU  69          1HB       LEU  69 -13.045  -5.265   0.792
  577   2HB   LEU  69          2HB       LEU  69 -13.768  -3.894  -0.027
  578    HG   LEU  69           HG       LEU  69 -12.802  -5.468  -1.584
  579   1HD1  LEU  69          1HD1      LEU  69 -11.582  -3.933  -3.001
  580   2HD1  LEU  69          2HD1      LEU  69 -12.891  -3.061  -2.188
  581   3HD1  LEU  69          3HD1      LEU  69 -11.212  -2.867  -1.640
  582   1HD2  LEU  69          1HD2      LEU  69 -10.413  -5.835  -1.778
  583   2HD2  LEU  69          2HD2      LEU  69 -10.093  -4.806  -0.361
  584   3HD2  LEU  69          3HD2      LEU  69 -10.982  -6.331  -0.175
  585    H    GLU  70           H        GLU  70 -13.967  -3.597   2.713
  586    HA   GLU  70           HA       GLU  70 -15.464  -1.320   2.144
  587   1HB   GLU  70          1HB       GLU  70 -15.262  -3.050   4.642
  588   2HB   GLU  70          2HB       GLU  70 -16.452  -1.747   4.451
  589   1HG   GLU  70          1HG       GLU  70 -17.304  -2.823   2.377
  590   2HG   GLU  70          2HG       GLU  70 -16.181  -4.170   2.628
  591    HE2  GLU  70           HE       GLU  70 -19.405  -3.698   5.078
  592    H    ARG  71           H        ARG  71 -12.876  -1.677   4.602
  593    HA   ARG  71           HA       ARG  71 -12.852   0.826   5.871
  594   1HB   ARG  71          1HB       ARG  71 -11.177  -0.249   6.723
  595   2HB   ARG  71          2HB       ARG  71 -10.981  -1.308   5.362
  596   1HG   ARG  71          1HG       ARG  71  -8.937  -0.149   5.717
  597   2HG   ARG  71          2HG       ARG  71  -9.577   0.412   4.203
  598   1HD   ARG  71          1HD       ARG  71 -10.587   2.072   6.401
  599   2HD   ARG  71          2HD       ARG  71  -8.860   1.897   6.541
  600    HE   ARG  71           HE       ARG  71 -10.352   3.478   4.660
  601   1HH1  ARG  71          1HH1      ARG  71  -7.356   1.567   4.728
  602   2HH1  ARG  71          2HH1      ARG  71  -6.609   2.504   3.452
  603   1HH2  ARG  71          1HH2      ARG  71  -9.358   4.660   3.018
  604   2HH2  ARG  71          2HH2      ARG  71  -7.742   4.259   2.483
  605    H    ILE  72           H        ILE  72 -11.571   0.008   2.641
  606    HA   ILE  72           HA       ILE  72 -10.573   2.691   2.255
  607    HB   ILE  72           HB       ILE  72 -10.893   0.658   0.051
  608   1HG1  ILE  72          1HG1      ILE  72  -8.514   1.000   1.965
  609   2HG1  ILE  72          2HG1      ILE  72  -9.647  -0.348   2.033
  610   1HG2  ILE  72          1HG2      ILE  72  -9.027   1.927  -0.943
  611   2HG2  ILE  72          2HG2      ILE  72 -10.277   3.084  -0.477
  612   3HG2  ILE  72          3HG2      ILE  72  -8.838   2.881   0.538
  613   1HD1  ILE  72          1HD1      ILE  72  -7.753  -1.143   0.884
  614   2HD1  ILE  72          2HD1      ILE  72  -9.052  -0.967  -0.308
  615   3HD1  ILE  72          3HD1      ILE  72  -7.733   0.230  -0.229
  616    H    LYS  73           H        LYS  73 -13.269   0.950   0.609
  617    HA   LYS  73           HA       LYS  73 -14.350   3.051  -0.765
  618   1HB   LYS  73          1HB       LYS  73 -15.741   0.753   0.622
  619   2HB   LYS  73          2HB       LYS  73 -16.602   1.976  -0.304
  620   1HG   LYS  73          1HG       LYS  73 -16.313   0.294  -1.821
  621   2HG   LYS  73          2HG       LYS  73 -15.102   1.483  -2.300
  622   1HD   LYS  73          1HD       LYS  73 -14.296  -0.728  -0.436
  623   2HD   LYS  73          2HD       LYS  73 -14.672  -1.196  -2.081
  624   1HE   LYS  73          1HE       LYS  73 -12.679   1.044  -1.554
  625   2HE   LYS  73          2HE       LYS  73 -12.208  -0.661  -1.582
  626   1HZ   LYS  73          1HZ       LYS  73 -11.959   0.257  -3.752
  627   2HZ   LYS  73          2HZ       LYS  73 -13.588   0.697  -3.805
  628    H    GLN  74           H        GLN  74 -15.008   2.286   2.699
  629    HA   GLN  74           HA       GLN  74 -16.930   4.397   3.045
  630   1HB   GLN  74          1HB       GLN  74 -17.004   2.352   4.337
  631   2HB   GLN  74          2HB       GLN  74 -15.426   2.672   5.063
  632   1HG   GLN  74          1HG       GLN  74 -17.783   4.588   5.361
  633   2HG   GLN  74          2HG       GLN  74 -17.564   3.202   6.430
  634   1HE2  GLN  74          1HE2      GLN  74 -15.224   2.996   7.380
  635   2HE2  GLN  74          2HE2      GLN  74 -14.560   4.488   8.015
  636    H    GLY  75           H        GLY  75 -13.566   3.950   4.221
  637   1HA   GLY  75          1HA       GLY  75 -13.384   6.747   5.132
  638   2HA   GLY  75          2HA       GLY  75 -12.273   5.423   5.422
  639    HA   PRO  76           HA       PRO  76 -11.196   7.140   1.047
  640   1HB   PRO  76          1HB       PRO  76 -11.378   9.868   0.724
  641   2HB   PRO  76          2HB       PRO  76 -12.718   8.744   0.353
  642   1HG   PRO  76          1HG       PRO  76 -12.293  10.285   2.929
  643   2HG   PRO  76          2HG       PRO  76 -13.775  10.213   1.928
  644   1HD   PRO  76          1HD       PRO  76 -13.487   8.616   4.072
  645   2HD   PRO  76          2HD       PRO  76 -14.204   7.982   2.554
  646    HA   PRO  77           HA       PRO  77  -7.721   7.416   3.304
  647   1HB   PRO  77          1HB       PRO  77  -5.712   7.122   1.514
  648   2HB   PRO  77          2HB       PRO  77  -7.116   6.027   1.549
  649   1HG   PRO  77          1HG       PRO  77  -6.812   8.487  -0.200
  650   2HG   PRO  77          2HG       PRO  77  -7.106   6.816  -0.758
  651   1HD   PRO  77          1HD       PRO  77  -9.182   8.519  -0.341
  652   2HD   PRO  77          2HD       PRO  77  -9.276   6.798   0.147
  653    H    ALA  78           H        ALA  78  -8.511  10.110   3.385
  654    HA   ALA  78           HA       ALA  78  -7.742  12.089   4.179
  655   1HB   ALA  78          1HB       ALA  78  -5.588  12.243   5.247
  656   2HB   ALA  78          2HB       ALA  78  -6.398  10.727   5.675
  657   3HB   ALA  78          3HB       ALA  78  -5.057  10.720   4.512
  658    H    ALA  79           H        ALA  79  -7.820  11.589   1.311
  659    HA   ALA  79           HA       ALA  79  -5.812  13.468   0.220
  660   1HB   ALA  79          1HB       ALA  79  -5.117  11.767  -1.341
  661   2HB   ALA  79          2HB       ALA  79  -4.800  11.165   0.304
  662   3HB   ALA  79          3HB       ALA  79  -6.195  10.564  -0.616
  663    H    GLU  80           H        GLU  80  -6.347  13.922  -2.069
  664    HA   GLU  80           HA       GLU  80  -9.262  14.059  -2.480
  665   1HB   GLU  80          1HB       GLU  80  -6.924  15.254  -4.005
  666   2HB   GLU  80          2HB       GLU  80  -8.630  15.473  -4.418
  667   1HG   GLU  80          1HG       GLU  80  -8.011  17.402  -3.197
  668   2HG   GLU  80          2HG       GLU  80  -9.008  16.431  -2.109
  669    HE2  GLU  80           HE       GLU  80  -4.985  16.718  -1.427
  670    H    VAL  81           H        VAL  81  -9.426  11.743  -2.607
  671    HA   VAL  81           HA       VAL  81  -8.458  10.258  -4.879
  672    HB   VAL  81           HB       VAL  81  -9.073   9.275  -2.708
  673   1HG1  VAL  81          1HG1      VAL  81 -11.986   9.742  -3.465
  674   2HG1  VAL  81          2HG1      VAL  81 -11.368   8.875  -2.052
  675   3HG1  VAL  81          3HG1      VAL  81 -11.114  10.621  -2.191
  676   1HG2  VAL  81          1HG2      VAL  81 -10.762   8.178  -5.001
  677   2HG2  VAL  81          2HG2      VAL  81  -9.014   7.926  -4.797
  678   3HG2  VAL  81          3HG2      VAL  81 -10.151   7.280  -3.598
  679    H    GLU  82           H        GLU  82  -9.224   9.880  -6.775
  680    HA   GLU  82           HA       GLU  82 -11.525  11.457  -7.755
  681   1HB   GLU  82          1HB       GLU  82  -9.360  11.711  -8.830
  682   2HB   GLU  82          2HB       GLU  82  -9.271   9.975  -9.166
  683   1HG   GLU  82          1HG       GLU  82 -11.342  10.190 -10.587
  684   2HG   GLU  82          2HG       GLU  82 -11.342  11.933 -10.268
  685    HE2  GLU  82           HE       GLU  82  -8.613  12.587 -12.382
  686    H    LYS  83           H        LYS  83 -10.107   8.137  -8.066
  687    HA   LYS  83           HA       LYS  83 -12.623   6.857  -7.488
  688   1HB   LYS  83          1HB       LYS  83 -12.991   5.811  -9.705
  689   2HB   LYS  83          2HB       LYS  83 -13.208   7.558  -9.764
  690   1HG   LYS  83          1HG       LYS  83 -10.850   7.767 -10.661
  691   2HG   LYS  83          2HG       LYS  83 -10.776   5.993 -10.730
  692   1HD   LYS  83          1HD       LYS  83 -12.706   5.979 -12.274
  693   2HD   LYS  83          2HD       LYS  83 -12.739   7.759 -12.229
  694   1HE   LYS  83          1HE       LYS  83 -10.387   7.803 -13.082
  695   2HE   LYS  83          2HE       LYS  83 -10.393   6.028 -13.159
  696   1HZ   LYS  83          1HZ       LYS  83 -10.954   6.907 -15.298
  697   2HZ   LYS  83          2HZ       LYS  83 -12.269   7.747 -14.653
  698    H    VAL  84           H        VAL  84 -12.178   4.806  -6.691
  699    HA   VAL  84           HA       VAL  84  -9.557   3.597  -7.384
  700    HB   VAL  84           HB       VAL  84  -9.762   3.845  -5.166
  701   1HG1  VAL  84          1HG1      VAL  84 -12.449   2.428  -5.208
  702   2HG1  VAL  84          2HG1      VAL  84 -11.503   2.830  -3.757
  703   3HG1  VAL  84          3HG1      VAL  84 -12.130   4.125  -4.782
  704   1HG2  VAL  84          1HG2      VAL  84 -10.354   0.925  -5.726
  705   2HG2  VAL  84          2HG2      VAL  84  -8.797   1.720  -6.046
  706   3HG2  VAL  84          3HG2      VAL  84  -9.410   1.604  -4.387
  707    H    ASP  85           H        ASP  85  -9.767   2.710  -9.369
  708    HA   ASP  85           HA       ASP  85 -12.054   0.974 -10.060
  709   1HB   ASP  85          1HB       ASP  85 -11.239   2.584 -11.708
  710   2HB   ASP  85          2HB       ASP  85  -9.606   1.919 -11.586
  711    HD2  ASP  85           HD       ASP  85 -10.260  -0.262 -14.162
  712    H    TYR  86           H        TYR  86 -11.408  -0.432  -8.159
  713    HA   TYR  86           HA       TYR  86  -8.878  -1.795  -8.344
  714   1HB   TYR  86          1HB       TYR  86  -9.422  -2.904  -6.365
  715   2HB   TYR  86          2HB       TYR  86 -10.143  -1.322  -6.188
  716    HD1  TYR  86           1HD      TYR  86 -12.646  -1.113  -6.220
  717    HD2  TYR  86           2HD      TYR  86 -10.693  -4.955  -6.487
  718    HE1  TYR  86           1HE      TYR  86 -14.731  -2.232  -5.482
  719    HE2  TYR  86           2HE      TYR  86 -12.776  -6.062  -5.777
  720    HH   TYR  86           HH       TYR  86 -14.961  -5.788  -5.107
  721    H    SER  87           H        SER  87  -8.707  -4.202  -8.427
  722    HA   SER  87           HA       SER  87 -10.821  -5.544  -9.987
  723   1HB   SER  87          1HB       SER  87  -9.245  -4.724 -11.674
  724   2HB   SER  87          2HB       SER  87  -7.900  -5.528 -10.827
  725    HG   SER  87           HG       SER  87  -8.997  -7.515 -11.185
  726    H    PHE  88           H        PHE  88 -11.270  -7.396  -9.172
  727    HA   PHE  88           HA       PHE  88  -9.641  -8.778  -7.168
  728   1HB   PHE  88          1HB       PHE  88 -11.734  -9.418  -6.662
  729   2HB   PHE  88          2HB       PHE  88 -12.389  -8.767  -8.130
  730    HD1  PHE  88           1HD      PHE  88 -13.003 -10.123 -10.000
  731    HD2  PHE  88           2HD      PHE  88 -10.941 -11.846  -6.645
  732    HE1  PHE  88           1HE      PHE  88 -13.350 -12.392 -10.950
  733    HE2  PHE  88           2HE      PHE  88 -11.258 -14.112  -7.602
  734    HZ   PHE  88           HZ       PHE  88 -12.458 -14.387  -9.763
  735    H    SER  89           H        SER  89  -8.129 -10.329  -7.664
  736    HA   SER  89           HA       SER  89  -7.939 -11.349 -10.457
  737   1HB   SER  89          1HB       SER  89  -5.584 -10.502  -8.748
  738   2HB   SER  89          2HB       SER  89  -5.574 -11.017 -10.440
  739    HG   SER  89           HG       SER  89  -6.921  -9.178 -10.873
  740    H    GLU  90           H        GLU  90  -5.640 -13.033  -9.920
  741    HA   GLU  90           HA       GLU  90  -6.794 -15.118  -8.192
  742   1HB   GLU  90          1HB       GLU  90  -7.037 -15.655 -10.508
  743   2HB   GLU  90          2HB       GLU  90  -5.433 -15.013 -10.927
  744   1HG   GLU  90          1HG       GLU  90  -4.302 -16.776  -9.818
  745   2HG   GLU  90          2HG       GLU  90  -5.825 -17.297  -9.052
  746    HE2  GLU  90           HE       GLU  90  -5.087 -18.160 -12.985
  747    H    TYR  91           H        TYR  91  -5.309 -16.266  -6.949
  748    HA   TYR  91           HA       TYR  91  -2.865 -15.409  -5.991
  749   1HB   TYR  91          1HB       TYR  91  -4.167 -17.171  -5.030
  750   2HB   TYR  91          2HB       TYR  91  -3.932 -18.181  -6.451
  751    HD1  TYR  91           1HD      TYR  91  -2.360 -19.903  -6.222
  752    HD2  TYR  91           2HD      TYR  91  -1.779 -16.250  -4.002
  753    HE1  TYR  91           1HE      TYR  91  -0.146 -20.706  -5.483
  754    HE2  TYR  91           2HE      TYR  91   0.441 -17.049  -3.275
  755    HH   TYR  91           HH       TYR  91   2.046 -18.749  -3.422
  756    H    LYS  92           H        LYS  92  -1.720 -14.501  -7.849
  757    HA   LYS  92           HA       LYS  92  -0.624 -16.356  -9.858
  758   1HB   LYS  92          1HB       LYS  92  -1.658 -14.311 -10.613
  759   2HB   LYS  92          2HB       LYS  92  -0.621 -13.344  -9.567
  760   1HG   LYS  92          1HG       LYS  92   0.149 -13.205 -11.847
  761   2HG   LYS  92          2HG       LYS  92   1.376 -14.031 -10.879
  762   1HD   LYS  92          1HD       LYS  92   0.616 -16.219 -11.764
  763   2HD   LYS  92          2HD       LYS  92  -0.698 -15.412 -12.648
  764   1HE   LYS  92          1HE       LYS  92   0.997 -14.137 -13.959
  765   2HE   LYS  92          2HE       LYS  92   2.294 -14.972 -13.077
  766   1HZ   LYS  92          1HZ       LYS  92   1.858 -16.103 -15.137
  767   2HZ   LYS  92          2HZ       LYS  92   0.251 -16.367 -14.687
  768    H    GLY  93           H        GLY  93   0.628 -13.850  -7.568
  769   1HA   GLY  93          1HA       GLY  93   3.143 -15.391  -7.223
  770   2HA   GLY  93          2HA       GLY  93   3.201 -13.700  -7.755
  771    H    GLU  94           H        GLU  94   3.811 -15.359  -5.170
  772    HA   GLU  94           HA       GLU  94   2.277 -13.910  -3.120
  773   1HB   GLU  94          1HB       GLU  94   3.631 -15.251  -1.554
  774   2HB   GLU  94          2HB       GLU  94   2.514 -16.124  -2.595
  775   1HG   GLU  94          1HG       GLU  94   4.363 -16.851  -4.062
  776   2HG   GLU  94          2HG       GLU  94   5.526 -15.989  -3.041
  777    HE2  GLU  94           HE       GLU  94   5.587 -18.483  -0.624
  778    H    PHE  95           H        PHE  95   2.899 -11.729  -3.400
  779    HA   PHE  95           HA       PHE  95   5.692 -10.878  -3.205
  780   1HB   PHE  95          1HB       PHE  95   3.028  -9.457  -2.811
  781   2HB   PHE  95          2HB       PHE  95   4.602  -8.705  -2.676
  782    HD1  PHE  95           1HD      PHE  95   5.018 -10.881  -5.420
  783    HD2  PHE  95           2HD      PHE  95   3.095  -7.192  -4.249
  784    HE1  PHE  95           1HE      PHE  95   5.164 -10.062  -7.736
  785    HE2  PHE  95           2HE      PHE  95   3.244  -6.385  -6.585
  786    HZ   PHE  95           HZ       PHE  95   4.279  -7.816  -8.334
  787    H    GLU  96           H        GLU  96   6.416 -12.119  -1.381
  788    HA   GLU  96           HA       GLU  96   5.032 -12.350   0.993
  789   1HB   GLU  96          1HB       GLU  96   7.061 -13.339   1.840
  790   2HB   GLU  96          2HB       GLU  96   6.831 -13.775   0.150
  791   1HG   GLU  96          1HG       GLU  96   9.074 -13.301   0.201
  792   2HG   GLU  96          2HG       GLU  96   8.429 -11.789  -0.420
  793    HE2  GLU  96           HE       GLU  96   9.880 -10.012   2.196
  794    H    ASP  97           H        ASP  97   5.123 -11.306   2.966
  795    HA   ASP  97           HA       ASP  97   5.044  -9.524   4.366
  796   1HB   ASP  97          1HB       ASP  97   7.260  -8.129   2.821
  797   2HB   ASP  97          2HB       ASP  97   6.700  -7.822   4.461
  798    HD2  ASP  97           HD       ASP  97   8.167 -11.186   5.303
  799    H    PHE  98           H        PHE  98   4.923  -6.814   3.992
  800    HA   PHE  98           HA       PHE  98   3.757  -6.266   1.364
  801   1HB   PHE  98          1HB       PHE  98   1.947  -7.179   2.885
  802   2HB   PHE  98          2HB       PHE  98   2.113  -5.733   3.848
  803    HD1  PHE  98           1HD      PHE  98   2.587  -4.164   0.872
  804    HD2  PHE  98           2HD      PHE  98  -0.435  -6.512   2.849
  805    HE1  PHE  98           1HE      PHE  98   0.847  -2.979  -0.385
  806    HE2  PHE  98           2HE      PHE  98  -2.189  -5.256   1.621
  807    HZ   PHE  98           HZ       PHE  98  -1.548  -3.454   0.053
  808    H    GLU  99           H        GLU  99   5.418  -4.762   0.999
  809    HA   GLU  99           HA       GLU  99   5.722  -2.539   2.973
  810   1HB   GLU  99          1HB       GLU  99   7.633  -3.999   2.586
  811   2HB   GLU  99          2HB       GLU  99   7.674  -3.495   0.895
  812   1HG   GLU  99          1HG       GLU  99   8.107  -1.172   1.553
  813   2HG   GLU  99          2HG       GLU  99   7.795  -1.548   3.248
  814    HE2  GLU  99           HE       GLU  99  11.278  -2.757   1.480
  815    H    THR 100           H        THR 100   6.043  -0.419   2.185
  816    HA   THR 100           HA       THR 100   4.613   0.214  -0.297
  817    HB   THR 100           HB       THR 100   3.879   2.065   0.675
  818    HG1  THR 100           1HG      THR 100   5.065   3.185   2.350
  819   1HG2  THR 100          1HG2      THR 100   3.297   1.712   2.990
  820   2HG2  THR 100          2HG2      THR 100   3.377   0.117   2.215
  821   3HG2  THR 100          3HG2      THR 100   4.697   0.668   3.264
  822    H    TYR 101           H        TYR 101   5.497   1.385  -2.009
  823    HA   TYR 101           HA       TYR 101   8.468   1.766  -1.962
  824   1HB   TYR 101          1HB       TYR 101   7.907   0.159  -3.446
  825   2HB   TYR 101          2HB       TYR 101   6.415   0.888  -3.939
  826    HD1  TYR 101           1HD      TYR 101   6.520   3.025  -5.443
  827    HD2  TYR 101           2HD      TYR 101   9.598   0.060  -5.000
  828    HE1  TYR 101           1HE      TYR 101   7.526   3.736  -7.605
  829    HE2  TYR 101           2HE      TYR 101  10.546   0.701  -7.186
  830    HH   TYR 101           HH       TYR 101  10.425   2.145  -8.970
  Start of MODEL   17
    1   1H    GLY  -1          1H        GLY  -1   2.467 -52.286 -15.841
    2   2H    GLY  -1          2H        GLY  -1   1.991 -52.682 -14.308
    3   3H    GLY  -1          3H        GLY  -1   0.947 -51.901 -15.309
    4   1HA   GLY  -1          1HA       GLY  -1   3.436 -50.817 -14.217
    5   2HA   GLY  -1          2HA       GLY  -1   2.370 -49.967 -15.355
    6    H    SER   0           H        SER   0   2.929 -48.736 -13.001
    7    HA   SER   0           HA       SER   0   0.361 -48.701 -11.536
    8   1HB   SER   0          1HB       SER   0   3.061 -49.250 -10.212
    9   2HB   SER   0          2HB       SER   0   1.531 -48.947  -9.362
   10    HG   SER   0           HG       SER   0   0.722 -50.803 -10.596
   11    H    MET   1           H        MET   1   0.956 -46.804 -13.255
   12    HA   MET   1           HA       MET   1   2.607 -44.681 -12.074
   13   1HB   MET   1          1HB       MET   1   1.015 -44.907 -14.657
   14   2HB   MET   1          2HB       MET   1   1.964 -43.483 -14.188
   15   1HG   MET   1          1HG       MET   1   3.998 -44.826 -14.033
   16   2HG   MET   1          2HG       MET   1   3.102 -46.287 -14.468
   17   1HE   MET   1          1HE       MET   1   5.820 -45.364 -15.873
   18   2HE   MET   1          2HE       MET   1   5.385 -45.867 -17.524
   19   3HE   MET   1          3HE       MET   1   4.899 -46.864 -16.135
   20    H    LYS   2           H        LYS   2   0.863 -45.134 -10.197
   21    HA   LYS   2           HA       LYS   2  -1.273 -43.070 -10.412
   22   1HB   LYS   2          1HB       LYS   2  -2.148 -43.956  -8.351
   23   2HB   LYS   2          2HB       LYS   2  -2.109 -45.174  -9.632
   24   1HG   LYS   2          1HG       LYS   2  -0.085 -46.188  -8.581
   25   2HG   LYS   2          2HG       LYS   2  -0.152 -44.959  -7.296
   26   1HD   LYS   2          1HD       LYS   2  -2.448 -45.697  -6.723
   27   2HD   LYS   2          2HD       LYS   2  -2.344 -46.989  -7.930
   28   1HE   LYS   2          1HE       LYS   2  -0.520 -46.666  -5.494
   29   2HE   LYS   2          2HE       LYS   2  -1.921 -47.752  -5.591
   30   1HZ   LYS   2          1HZ       LYS   2   0.061 -48.967  -6.113
   31   2HZ   LYS   2          2HZ       LYS   2   0.397 -47.935  -7.406
   32    H    LYS   3           H        LYS   3  -1.201 -41.267  -9.129
   33    HA   LYS   3           HA       LYS   3   0.848 -40.707  -7.169
   34   1HB   LYS   3          1HB       LYS   3   1.990 -38.979  -8.639
   35   2HB   LYS   3          2HB       LYS   3   2.371 -40.668  -8.948
   36   1HG   LYS   3          1HG       LYS   3   0.790 -40.663 -10.911
   37   2HG   LYS   3          2HG       LYS   3   0.445 -38.964 -10.587
   38   1HD   LYS   3          1HD       LYS   3   2.033 -39.050 -12.359
   39   2HD   LYS   3          2HD       LYS   3   2.857 -38.429 -10.927
   40   1HE   LYS   3          1HE       LYS   3   4.290 -39.989 -12.144
   41   2HE   LYS   3          2HE       LYS   3   3.903 -40.670 -10.562
   42   1HZ   LYS   3          1HZ       LYS   3   3.619 -42.341 -12.236
   43   2HZ   LYS   3          2HZ       LYS   3   2.488 -41.391 -13.053
   44    H    TRP   4           H        TRP   4  -1.479 -40.474  -6.453
   45    HA   TRP   4           HA       TRP   4  -2.996 -38.234  -7.520
   46   1HB   TRP   4          1HB       TRP   4  -3.565 -40.027  -5.148
   47   2HB   TRP   4          2HB       TRP   4  -4.723 -39.026  -6.029
   48    HD1  TRP   4           HD       TRP   4  -4.064 -39.901  -8.984
   49    HE1  TRP   4           1HE      TRP   4  -4.654 -42.271  -9.821
   50    HE3  TRP   4           3HE      TRP   4  -4.295 -42.346  -4.485
   51    HZ2  TRP   4           2HZ      TRP   4  -5.185 -44.843  -8.698
   52    HZ3  TRP   4           3HZ      TRP   4  -4.838 -44.757  -4.409
   53    HH2  TRP   4           HH       TRP   4  -5.308 -46.010  -6.500
   54    H    SER   5           H        SER   5  -0.798 -37.040  -6.771
   55    HA   SER   5           HA       SER   5  -1.423 -35.539  -4.264
   56   1HB   SER   5          1HB       SER   5   1.278 -36.564  -5.216
   57   2HB   SER   5          2HB       SER   5   0.990 -35.514  -3.811
   58    HG   SER   5           HG       SER   5  -0.406 -37.227  -3.026
   59    H    ASP   6           H        ASP   6  -1.274 -33.326  -4.574
   60    HA   ASP   6           HA       ASP   6  -1.184 -31.341  -5.563
   61   1HB   ASP   6          1HB       ASP   6   1.273 -31.924  -5.616
   62   2HB   ASP   6          2HB       ASP   6   1.060 -32.460  -7.284
   63    HD2  ASP   6           HD       ASP   6   2.213 -29.222  -7.946
   64    H    THR   7           H        THR   7  -1.238 -30.252  -7.940
   65    HA   THR   7           HA       THR   7  -2.167 -30.008  -9.950
   66    HB   THR   7           HB       THR   7  -2.651 -33.010 -10.114
   67    HG1  THR   7           1HG      THR   7  -0.627 -32.996 -11.119
   68   1HG2  THR   7          1HG2      THR   7  -2.496 -32.613 -12.529
   69   2HG2  THR   7          2HG2      THR   7  -3.861 -31.732 -11.826
   70   3HG2  THR   7          3HG2      THR   7  -2.368 -30.864 -12.251
   71    H    GLU   8           H        GLU   8  -3.990 -32.152  -7.792
   72    HA   GLU   8           HA       GLU   8  -6.624 -31.480  -8.628
   73   1HB   GLU   8          1HB       GLU   8  -5.255 -32.770  -6.253
   74   2HB   GLU   8          2HB       GLU   8  -6.942 -32.371  -6.054
   75   1HG   GLU   8          1HG       GLU   8  -5.872 -34.040  -8.351
   76   2HG   GLU   8          2HG       GLU   8  -6.587 -34.680  -6.864
   77    HE2  GLU   8           HE       GLU   8  -9.146 -34.422  -9.560
   78    H    VAL   9           H        VAL   9  -8.023 -30.763  -6.419
   79    HA   VAL   9           HA       VAL   9  -7.662 -27.923  -6.216
   80    HB   VAL   9           HB       VAL   9  -9.447 -29.846  -4.664
   81   1HG1  VAL   9          1HG1      VAL   9  -9.594 -26.816  -5.006
   82   2HG1  VAL   9          2HG1      VAL   9 -10.825 -27.828  -4.224
   83   3HG1  VAL   9          3HG1      VAL   9  -9.221 -27.678  -3.496
   84   1HG2  VAL   9          1HG2      VAL   9  -9.996 -28.170  -7.158
   85   2HG2  VAL   9          2HG2      VAL   9  -9.924 -29.944  -7.090
   86   3HG2  VAL   9          3HG2      VAL   9 -11.214 -29.084  -6.246
   87    H    PHE  10           H        PHE  10  -6.805 -26.783  -4.521
   88    HA   PHE  10           HA       PHE  10  -6.297 -27.593  -1.937
   89   1HB   PHE  10          1HB       PHE  10  -3.840 -27.742  -1.826
   90   2HB   PHE  10          2HB       PHE  10  -4.515 -29.091  -2.723
   91    HD1  PHE  10           1HD      PHE  10  -2.411 -26.060  -2.932
   92    HD2  PHE  10           2HD      PHE  10  -4.072 -29.382  -5.109
   93    HE1  PHE  10           1HE      PHE  10  -1.059 -25.439  -4.917
   94    HE2  PHE  10           2HE      PHE  10  -2.793 -28.697  -7.125
   95    HZ   PHE  10           HZ       PHE  10  -1.285 -26.729  -7.032
   96    H    GLU  11           H        GLU  11  -4.980 -25.650  -4.577
   97    HA   GLU  11           HA       GLU  11  -4.078 -23.421  -3.309
   98   1HB   GLU  11          1HB       GLU  11  -4.447 -22.221  -5.371
   99   2HB   GLU  11          2HB       GLU  11  -3.747 -23.815  -5.655
  100   1HG   GLU  11          1HG       GLU  11  -6.661 -23.032  -6.082
  101   2HG   GLU  11          2HG       GLU  11  -5.435 -23.218  -7.334
  102    HE2  GLU  11           HE       GLU  11  -5.373 -26.791  -7.069
  103    H    MET  12           H        MET  12  -4.846 -21.767  -2.284
  104    HA   MET  12           HA       MET  12  -7.656 -20.868  -2.433
  105   1HB   MET  12          1HB       MET  12  -6.254 -21.784   0.126
  106   2HB   MET  12          2HB       MET  12  -7.671 -20.730   0.122
  107   1HG   MET  12          1HG       MET  12  -7.618 -23.542  -1.000
  108   2HG   MET  12          2HG       MET  12  -8.274 -23.046   0.557
  109   1HE   MET  12          1HE       MET  12  -9.775 -24.742  -1.759
  110   2HE   MET  12          2HE       MET  12 -11.410 -24.066  -1.569
  111   3HE   MET  12          3HE       MET  12 -10.423 -24.423  -0.131
  112    H    LEU  13           H        LEU  13  -7.968 -18.843  -1.343
  113    HA   LEU  13           HA       LEU  13  -7.664 -16.783  -0.830
  114   1HB   LEU  13          1HB       LEU  13  -6.203 -16.227   0.736
  115   2HB   LEU  13          2HB       LEU  13  -5.950 -17.954   0.732
  116    HG   LEU  13           HG       LEU  13  -3.970 -17.302  -0.993
  117   1HD1  LEU  13          1HD1      LEU  13  -2.981 -15.164  -0.453
  118   2HD1  LEU  13          2HD1      LEU  13  -4.656 -14.840  -0.929
  119   3HD1  LEU  13          3HD1      LEU  13  -4.214 -14.842   0.787
  120   1HD2  LEU  13          1HD2      LEU  13  -2.467 -17.224   0.956
  121   2HD2  LEU  13          2HD2      LEU  13  -3.852 -16.919   2.027
  122   3HD2  LEU  13          3HD2      LEU  13  -3.710 -18.470   1.167
  123    H    LYS  14           H        LYS  14  -7.419 -14.894  -1.864
  124    HA   LYS  14           HA       LYS  14  -6.126 -15.091  -4.546
  125   1HB   LYS  14          1HB       LYS  14  -8.048 -14.778  -5.557
  126   2HB   LYS  14          2HB       LYS  14  -8.705 -15.461  -4.100
  127   1HG   LYS  14          1HG       LYS  14  -8.542 -12.520  -4.871
  128   2HG   LYS  14          2HG       LYS  14  -9.974 -13.533  -4.877
  129   1HD   LYS  14          1HD       LYS  14  -8.437 -12.916  -2.317
  130   2HD   LYS  14          2HD       LYS  14  -9.657 -11.870  -3.004
  131   1HE   LYS  14          1HE       LYS  14 -10.756 -13.138  -1.339
  132   2HE   LYS  14          2HE       LYS  14 -11.289 -13.836  -2.882
  133   1HZ   LYS  14          1HZ       LYS  14 -10.673 -15.589  -1.398
  134   2HZ   LYS  14          2HZ       LYS  14  -9.127 -14.938  -1.196
  135    H    ARG  15           H        ARG  15  -5.830 -12.992  -5.728
  136    HA   ARG  15           HA       ARG  15  -4.928 -10.893  -3.863
  137   1HB   ARG  15          1HB       ARG  15  -3.563 -10.034  -5.429
  138   2HB   ARG  15          2HB       ARG  15  -3.393 -11.785  -5.515
  139   1HG   ARG  15          1HG       ARG  15  -4.933 -11.712  -7.539
  140   2HG   ARG  15          2HG       ARG  15  -4.845  -9.940  -7.457
  141   1HD   ARG  15          1HD       ARG  15  -2.455  -9.936  -7.798
  142   2HD   ARG  15          2HD       ARG  15  -2.376 -11.688  -7.653
  143    HE   ARG  15           HE       ARG  15  -3.128 -12.008  -9.771
  144   1HH1  ARG  15          2HH1      ARG  15  -3.565  -8.571  -8.969
  145   2HH1  ARG  15          1HH1      ARG  15  -3.899  -8.102 -10.615
  146   1HH2  ARG  15          1HH2      ARG  15  -3.495 -11.357 -11.936
  147   2HH2  ARG  15          2HH2      ARG  15  -3.863  -9.692 -12.304
  148    H    MET  16           H        MET  16  -6.118  -9.240  -3.402
  149    HA   MET  16           HA       MET  16  -8.010  -7.889  -5.195
  150   1HB   MET  16          1HB       MET  16  -7.820  -7.689  -2.638
  151   2HB   MET  16          2HB       MET  16  -6.432  -6.646  -2.958
  152   1HG   MET  16          1HG       MET  16  -8.006  -5.219  -4.384
  153   2HG   MET  16          2HG       MET  16  -9.320  -6.258  -3.831
  154   1HE   MET  16          1HE       MET  16  -6.154  -4.482  -2.194
  155   2HE   MET  16          2HE       MET  16  -6.988  -3.099  -1.448
  156   3HE   MET  16          3HE       MET  16  -7.011  -3.317  -3.214
  157    H    TYR  17           H        TYR  17  -7.442  -5.998  -6.196
  158    HA   TYR  17           HA       TYR  17  -4.718  -5.059  -6.509
  159   1HB   TYR  17          1HB       TYR  17  -4.336  -6.710  -8.088
  160   2HB   TYR  17          2HB       TYR  17  -6.008  -6.745  -8.620
  161    HD1  TYR  17           1HD      TYR  17  -5.908  -6.450 -10.949
  162    HD2  TYR  17           2HD      TYR  17  -3.648  -3.809  -8.401
  163    HE1  TYR  17           1HE      TYR  17  -5.496  -4.948 -12.869
  164    HE2  TYR  17           2HE      TYR  17  -3.203  -2.329 -10.336
  165    HH   TYR  17           HH       TYR  17  -3.649  -1.896 -12.566
  166    H    ALA  18           H        ALA  18  -5.205  -3.011  -6.118
  167    HA   ALA  18           HA       ALA  18  -7.579  -1.776  -7.433
  168   1HB   ALA  18          1HB       ALA  18  -7.633  -0.250  -5.508
  169   2HB   ALA  18          2HB       ALA  18  -7.947  -1.941  -5.061
  170   3HB   ALA  18          3HB       ALA  18  -6.357  -1.207  -4.723
  171    H    ARG  19           H        ARG  19  -6.987  -0.517  -8.967
  172    HA   ARG  19           HA       ARG  19  -4.338   0.741  -9.047
  173   1HB   ARG  19          1HB       ARG  19  -5.762  -0.575 -10.940
  174   2HB   ARG  19          2HB       ARG  19  -6.343   1.051 -11.272
  175   1HG   ARG  19          1HG       ARG  19  -3.502  -0.019 -11.364
  176   2HG   ARG  19          2HG       ARG  19  -4.491   0.659 -12.668
  177   1HD   ARG  19          1HD       ARG  19  -4.501   2.824 -11.190
  178   2HD   ARG  19          2HD       ARG  19  -3.112   2.112 -10.375
  179    HE   ARG  19           HE       ARG  19  -3.296   3.217 -13.066
  180   1HH1  ARG  19          1HH1      ARG  19  -1.432   0.939 -11.084
  181   2HH1  ARG  19          2HH1      ARG  19   0.040   1.154 -11.996
  182   1HH2  ARG  19          1HH2      ARG  19  -1.355   3.515 -14.228
  183   2HH2  ARG  19          2HH2      ARG  19   0.082   2.622 -13.798
  184    H    VAL  20           H        VAL  20  -4.498   2.477  -7.560
  185    HA   VAL  20           HA       VAL  20  -7.042   3.944  -7.348
  186    HB   VAL  20           HB       VAL  20  -4.535   4.187  -5.715
  187   1HG1  VAL  20          1HG1      VAL  20  -7.372   4.890  -4.895
  188   2HG1  VAL  20          2HG1      VAL  20  -5.830   5.308  -4.109
  189   3HG1  VAL  20          3HG1      VAL  20  -6.287   6.086  -5.621
  190   1HG2  VAL  20          1HG2      VAL  20  -6.981   2.445  -5.251
  191   2HG2  VAL  20          2HG2      VAL  20  -5.311   1.890  -5.493
  192   3HG2  VAL  20          3HG2      VAL  20  -5.740   2.783  -4.032
  193    H    TYR  21           H        TYR  21  -7.369   5.600  -8.724
  194    HA   TYR  21           HA       TYR  21  -5.123   7.371  -9.543
  195   1HB   TYR  21          1HB       TYR  21  -7.986   7.187 -10.543
  196   2HB   TYR  21          2HB       TYR  21  -6.779   8.274 -11.129
  197    HD1  TYR  21           1HD      TYR  21  -4.810   7.417 -12.421
  198    HD2  TYR  21           2HD      TYR  21  -7.949   4.766 -11.107
  199    HE1  TYR  21           1HE      TYR  21  -3.967   5.645 -13.931
  200    HE2  TYR  21           2HE      TYR  21  -7.141   3.032 -12.641
  201    HH   TYR  21           HH       TYR  21  -5.618   2.491 -14.297
  202    H    GLY  22           H        GLY  22  -5.107   9.564  -9.107
  203   1HA   GLY  22          1HA       GLY  22  -6.964  11.378  -8.622
  204   2HA   GLY  22          2HA       GLY  22  -6.913  10.589  -7.027
  205    H    LEU  23           H        LEU  23  -6.361  12.853  -6.444
  206    HA   LEU  23           HA       LEU  23  -3.547  13.567  -6.756
  207   1HB   LEU  23          1HB       LEU  23  -5.537  15.164  -6.544
  208   2HB   LEU  23          2HB       LEU  23  -5.525  14.768  -4.821
  209    HG   LEU  23           HG       LEU  23  -3.011  15.547  -4.901
  210   1HD1  LEU  23          1HD1      LEU  23  -2.515  17.182  -6.687
  211   2HD1  LEU  23          2HD1      LEU  23  -2.735  15.565  -7.362
  212   3HD1  LEU  23          3HD1      LEU  23  -4.035  16.767  -7.502
  213   1HD2  LEU  23          1HD2      LEU  23  -3.672  17.905  -4.663
  214   2HD2  LEU  23          2HD2      LEU  23  -5.258  17.543  -5.376
  215   3HD2  LEU  23          3HD2      LEU  23  -4.792  16.833  -3.813
  216    H    VAL  24           H        VAL  24  -4.675  10.989  -5.444
  217    HA   VAL  24           HA       VAL  24  -3.904  10.956  -2.711
  218    HB   VAL  24           HB       VAL  24  -3.983   8.525  -2.949
  219   1HG1  VAL  24          1HG1      VAL  24  -6.275   9.993  -4.333
  220   2HG1  VAL  24          2HG1      VAL  24  -6.353   8.352  -3.675
  221   3HG1  VAL  24          3HG1      VAL  24  -6.080   9.722  -2.591
  222   1HG2  VAL  24          1HG2      VAL  24  -4.422   9.012  -5.929
  223   2HG2  VAL  24          2HG2      VAL  24  -2.975   8.285  -5.192
  224   3HG2  VAL  24          3HG2      VAL  24  -4.537   7.467  -5.072
  225    H    GLN  25           H        GLN  25  -1.986  11.133  -5.547
  226    HA   GLN  25           HA       GLN  25   0.297   9.671  -4.617
  227   1HB   GLN  25          1HB       GLN  25  -0.666  10.453  -7.055
  228   2HB   GLN  25          2HB       GLN  25   0.552  11.693  -6.794
  229   1HG   GLN  25          1HG       GLN  25   1.649   9.912  -7.891
  230   2HG   GLN  25          2HG       GLN  25   2.174   9.758  -6.217
  231   1HE2  GLN  25          1HE2      GLN  25   2.510   7.597  -7.768
  232   2HE2  GLN  25          2HE2      GLN  25   1.304   6.355  -7.500
  233    H    GLY  26           H        GLY  26  -0.572  11.764  -2.809
  234   1HA   GLY  26          1HA       GLY  26   2.012  12.802  -2.088
  235   2HA   GLY  26          2HA       GLY  26   0.920  14.084  -2.661
  236    H    VAL  27           H        VAL  27  -0.442  11.257  -1.028
  237    HA   VAL  27           HA       VAL  27  -0.208  12.453   1.631
  238    HB   VAL  27           HB       VAL  27  -2.542  12.125   2.200
  239   1HG1  VAL  27          1HG1      VAL  27  -2.364  13.931  -0.248
  240   2HG1  VAL  27          2HG1      VAL  27  -3.534  14.020   1.074
  241   3HG1  VAL  27          3HG1      VAL  27  -1.830  14.370   1.393
  242   1HG2  VAL  27          1HG2      VAL  27  -3.090  11.614  -0.742
  243   2HG2  VAL  27          2HG2      VAL  27  -3.164  10.371   0.526
  244   3HG2  VAL  27          3HG2      VAL  27  -4.288  11.731   0.568
  245    H    GLY  28           H        GLY  28  -1.047  10.765   3.273
  246   1HA   GLY  28          1HA       GLY  28   0.703   8.544   2.820
  247   2HA   GLY  28          2HA       GLY  28  -0.211   8.923   4.279
  248    H    PHE  29           H        PHE  29  -1.828   8.345   1.134
  249    HA   PHE  29           HA       PHE  29  -3.274   6.069   2.216
  250   1HB   PHE  29          1HB       PHE  29  -4.268   7.798   0.710
  251   2HB   PHE  29          2HB       PHE  29  -3.235   7.217  -0.591
  252    HD1  PHE  29           1HD      PHE  29  -4.428   4.378   1.361
  253    HD2  PHE  29           2HD      PHE  29  -5.618   7.243  -1.645
  254    HE1  PHE  29           1HE      PHE  29  -5.954   2.722   0.370
  255    HE2  PHE  29           2HE      PHE  29  -7.388   5.671  -2.402
  256    HZ   PHE  29           HZ       PHE  29  -7.377   3.332  -1.565
  257    H    ARG  30           H        ARG  30  -0.663   5.495   2.376
  258    HA   ARG  30           HA       ARG  30  -0.110   3.262   0.513
  259   1HB   ARG  30          1HB       ARG  30   1.741   5.582   1.220
  260   2HB   ARG  30          2HB       ARG  30   2.326   4.045   0.577
  261   1HG   ARG  30          1HG       ARG  30   1.703   4.518  -1.546
  262   2HG   ARG  30          2HG       ARG  30   0.143   5.156  -1.057
  263   1HD   ARG  30          1HD       ARG  30   1.261   6.939  -2.073
  264   2HD   ARG  30          2HD       ARG  30   1.199   7.282  -0.340
  265    HE   ARG  30           HE       ARG  30   3.648   5.920  -1.050
  266   1HH1  ARG  30          1HH1      ARG  30   2.078   9.112  -1.246
  267   2HH1  ARG  30          2HH1      ARG  30   3.577   9.963  -1.508
  268   1HH2  ARG  30          1HH2      ARG  30   5.600   7.058  -1.407
  269   2HH2  ARG  30          2HH2      ARG  30   5.586   8.795  -1.586
  270    H    LYS  31           H        LYS  31   0.701   5.140   3.462
  271    HA   LYS  31           HA       LYS  31   1.647   2.860   4.943
  272   1HB   LYS  31          1HB       LYS  31   2.262   5.297   5.315
  273   2HB   LYS  31          2HB       LYS  31   0.674   5.516   6.048
  274   1HG   LYS  31          1HG       LYS  31   1.194   3.683   7.683
  275   2HG   LYS  31          2HG       LYS  31   2.804   3.517   6.969
  276   1HD   LYS  31          1HD       LYS  31   1.731   6.042   8.302
  277   2HD   LYS  31          2HD       LYS  31   2.738   4.818   9.093
  278   1HE   LYS  31          1HE       LYS  31   4.561   5.229   7.459
  279   2HE   LYS  31          2HE       LYS  31   3.582   6.499   6.690
  280   1HZ   LYS  31          1HZ       LYS  31   5.034   7.501   8.273
  281   2HZ   LYS  31          2HZ       LYS  31   4.406   6.551   9.521
  282    H    PHE  32           H        PHE  32  -1.368   4.828   4.801
  283    HA   PHE  32           HA       PHE  32  -2.791   3.636   6.795
  284   1HB   PHE  32          1HB       PHE  32  -3.475   5.585   5.436
  285   2HB   PHE  32          2HB       PHE  32  -3.958   4.505   4.129
  286    HD1  PHE  32           1HD      PHE  32  -6.023   6.053   4.480
  287    HD2  PHE  32           2HD      PHE  32  -4.872   2.997   7.318
  288    HE1  PHE  32           1HE      PHE  32  -8.211   6.227   5.604
  289    HE2  PHE  32           2HE      PHE  32  -7.062   3.100   8.333
  290    HZ   PHE  32           HZ       PHE  32  -8.748   4.781   7.555
  291    H    VAL  33           H        VAL  33  -2.847   2.546   3.350
  292    HA   VAL  33           HA       VAL  33  -4.552   0.294   3.884
  293    HB   VAL  33           HB       VAL  33  -4.401   1.469   1.702
  294   1HG1  VAL  33          1HG1      VAL  33  -1.742   0.028   1.329
  295   2HG1  VAL  33          2HG1      VAL  33  -2.614   0.984   0.121
  296   3HG1  VAL  33          3HG1      VAL  33  -1.949   1.780   1.549
  297   1HG2  VAL  33          1HG2      VAL  33  -3.787  -1.504   1.504
  298   2HG2  VAL  33          2HG2      VAL  33  -5.366  -0.807   1.930
  299   3HG2  VAL  33          3HG2      VAL  33  -4.670  -0.499   0.334
  300    H    GLN  34           H        GLN  34  -1.086   0.774   3.920
  301    HA   GLN  34           HA       GLN  34  -0.318  -1.944   4.195
  302   1HB   GLN  34          1HB       GLN  34   1.310  -0.219   3.510
  303   2HB   GLN  34          2HB       GLN  34   0.930   0.779   4.873
  304   1HG   GLN  34          1HG       GLN  34   3.079  -0.184   5.198
  305   2HG   GLN  34          2HG       GLN  34   1.971  -0.730   6.455
  306   1HE2  GLN  34          1HE2      GLN  34   1.500  -2.096   3.273
  307   2HE2  GLN  34          2HE2      GLN  34   2.289  -3.622   3.583
  308    H    ILE  35           H        ILE  35  -1.565   0.424   6.588
  309    HA   ILE  35           HA       ILE  35  -0.803  -1.304   8.814
  310    HB   ILE  35           HB       ILE  35  -2.924   0.884   8.662
  311   1HG1  ILE  35          1HG1      ILE  35  -0.814   1.971   8.488
  312   2HG1  ILE  35          2HG1      ILE  35  -1.373   2.169  10.136
  313   1HG2  ILE  35          1HG2      ILE  35  -2.884   0.743  11.177
  314   2HG2  ILE  35          2HG2      ILE  35  -3.581  -0.667  10.395
  315   3HG2  ILE  35          3HG2      ILE  35  -1.933  -0.750  11.033
  316   1HD1  ILE  35          1HD1      ILE  35   0.995   1.714  10.142
  317   2HD1  ILE  35          2HD1      ILE  35   0.170   0.309  10.842
  318   3HD1  ILE  35          3HD1      ILE  35   0.791   0.250   9.172
  319    H    HIS  36           H        HIS  36  -3.902  -0.887   7.018
  320    HA   HIS  36           HA       HIS  36  -5.204  -2.803   8.751
  321   1HB   HIS  36          1HB       HIS  36  -5.923  -1.515   6.103
  322   2HB   HIS  36          2HB       HIS  36  -6.916  -2.783   6.832
  323    HD2  HIS  36           2HD      HIS  36  -5.340   0.276   8.870
  324    HE1  HIS  36           1HE      HIS  36  -9.543   0.256   9.278
  325    HE2  HIS  36           2HE      HIS  36  -7.383   1.397  10.018
  326    H    ALA  37           H        ALA  37  -3.734  -3.100   5.487
  327    HA   ALA  37           HA       ALA  37  -4.063  -5.750   4.989
  328   1HB   ALA  37          1HB       ALA  37  -1.807  -5.663   3.924
  329   2HB   ALA  37          2HB       ALA  37  -2.885  -4.325   3.480
  330   3HB   ALA  37          3HB       ALA  37  -1.568  -4.065   4.644
  331    H    ILE  38           H        ILE  38  -1.416  -4.380   7.029
  332    HA   ILE  38           HA       ILE  38  -0.301  -6.984   7.650
  333    HB   ILE  38           HB       ILE  38   0.292  -4.109   8.232
  334   1HG1  ILE  38          1HG1      ILE  38   2.584  -4.831   7.782
  335   2HG1  ILE  38          2HG1      ILE  38   2.094  -6.530   7.799
  336   1HG2  ILE  38          1HG2      ILE  38   1.808  -4.511  10.068
  337   2HG2  ILE  38          2HG2      ILE  38   0.134  -4.791  10.531
  338   3HG2  ILE  38          3HG2      ILE  38   1.214  -6.181  10.221
  339   1HD1  ILE  38          1HD1      ILE  38   2.398  -5.554   5.530
  340   2HD1  ILE  38          2HD1      ILE  38   0.775  -6.229   5.756
  341   3HD1  ILE  38          3HD1      ILE  38   1.016  -4.478   5.817
  342    H    ARG  39           H        ARG  39  -2.508  -4.778   9.304
  343    HA   ARG  39           HA       ARG  39  -2.690  -5.848  11.773
  344   1HB   ARG  39          1HB       ARG  39  -3.857  -3.909  10.688
  345   2HB   ARG  39          2HB       ARG  39  -5.130  -5.019  10.180
  346   1HG   ARG  39          1HG       ARG  39  -4.190  -4.631  13.059
  347   2HG   ARG  39          2HG       ARG  39  -5.421  -3.622  12.278
  348   1HD   ARG  39          1HD       ARG  39  -6.780  -5.643  11.803
  349   2HD   ARG  39          2HD       ARG  39  -5.602  -6.608  12.732
  350    HE   ARG  39           HE       ARG  39  -6.536  -4.371  14.266
  351   1HH1  ARG  39          1HH1      ARG  39  -7.513  -7.590  13.158
  352   2HH1  ARG  39          2HH1      ARG  39  -8.609  -7.866  14.487
  353   1HH2  ARG  39          1HH2      ARG  39  -7.975  -4.729  16.014
  354   2HH2  ARG  39          2HH2      ARG  39  -8.872  -6.220  16.127
  355    H    LEU  40           H        LEU  40  -4.301  -6.984   8.795
  356    HA   LEU  40           HA       LEU  40  -5.197  -9.528  10.082
  357   1HB   LEU  40          1HB       LEU  40  -6.049  -8.242   7.488
  358   2HB   LEU  40          2HB       LEU  40  -6.738  -9.699   8.226
  359    HG   LEU  40           HG       LEU  40  -6.830  -6.890   9.418
  360   1HD1  LEU  40          1HD1      LEU  40  -9.223  -7.078   8.944
  361   2HD1  LEU  40          2HD1      LEU  40  -8.262  -7.216   7.453
  362   3HD1  LEU  40          3HD1      LEU  40  -8.968  -8.673   8.196
  363   1HD2  LEU  40          1HD2      LEU  40  -8.433  -7.924  11.046
  364   2HD2  LEU  40          2HD2      LEU  40  -8.003  -9.529  10.423
  365   3HD2  LEU  40          3HD2      LEU  40  -6.791  -8.531  11.257
  366    H    GLY  41           H        GLY  41  -2.350  -8.900   9.030
  367   1HA   GLY  41          1HA       GLY  41  -0.687 -10.051   8.010
  368   2HA   GLY  41          2HA       GLY  41  -1.660 -11.487   8.358
  369    H    ILE  42           H        ILE  42  -1.586  -8.749   6.028
  370    HA   ILE  42           HA       ILE  42  -2.261 -10.593   3.783
  371    HB   ILE  42           HB       ILE  42  -2.833  -7.656   4.224
  372   1HG1  ILE  42          1HG1      ILE  42  -4.317  -9.109   5.521
  373   2HG1  ILE  42          2HG1      ILE  42  -5.161  -8.224   4.241
  374   1HG2  ILE  42          1HG2      ILE  42  -4.225  -7.840   2.148
  375   2HG2  ILE  42          2HG2      ILE  42  -2.474  -7.812   1.906
  376   3HG2  ILE  42          3HG2      ILE  42  -3.357  -9.342   1.794
  377   1HD1  ILE  42          1HD1      ILE  42  -5.996 -10.504   4.403
  378   2HD1  ILE  42          2HD1      ILE  42  -5.193 -10.241   2.846
  379   3HD1  ILE  42          3HD1      ILE  42  -4.380 -11.171   4.132
  380    H    LYS  43           H        LYS  43  -0.986 -10.586   2.061
  381    HA   LYS  43           HA       LYS  43   1.577  -9.068   2.177
  382   1HB   LYS  43          1HB       LYS  43   0.998 -11.356   0.331
  383   2HB   LYS  43          2HB       LYS  43   2.544 -10.711   0.894
  384   1HG   LYS  43          1HG       LYS  43   0.516 -12.287   2.543
  385   2HG   LYS  43          2HG       LYS  43   2.086 -12.825   1.976
  386   1HD   LYS  43          1HD       LYS  43   3.159 -10.966   3.343
  387   2HD   LYS  43          2HD       LYS  43   1.582 -10.618   4.043
  388   1HE   LYS  43          1HE       LYS  43   2.901 -13.352   4.161
  389   2HE   LYS  43          2HE       LYS  43   3.000 -12.118   5.437
  390   1HZ   LYS  43          1HZ       LYS  43   0.535 -13.435   4.491
  391   2HZ   LYS  43          2HZ       LYS  43   0.614 -12.216   5.656
  392    H    GLY  44           H        GLY  44   2.362  -8.279  -0.100
  393   1HA   GLY  44          1HA       GLY  44   0.982  -7.945  -2.403
  394   2HA   GLY  44          2HA       GLY  44   0.088  -6.857  -1.329
  395    H    TYR  45           H        TYR  45   0.670  -4.869  -2.110
  396    HA   TYR  45           HA       TYR  45   3.061  -3.773  -1.161
  397   1HB   TYR  45          1HB       TYR  45   3.831  -5.118  -3.380
  398   2HB   TYR  45          2HB       TYR  45   3.208  -3.688  -4.155
  399    HD1  TYR  45           1HD      TYR  45   4.252  -1.481  -3.717
  400    HD2  TYR  45           2HD      TYR  45   5.937  -5.148  -2.218
  401    HE1  TYR  45           1HE      TYR  45   6.302  -0.273  -3.103
  402    HE2  TYR  45           2HE      TYR  45   8.084  -3.980  -1.812
  403    HH   TYR  45           HH       TYR  45   9.064  -1.915  -1.462
  404    H    ALA  46           H        ALA  46   2.983  -1.498  -1.255
  405    HA   ALA  46           HA       ALA  46   0.629  -0.233  -2.606
  406   1HB   ALA  46          1HB       ALA  46   1.030   1.625  -1.045
  407   2HB   ALA  46          2HB       ALA  46   0.597   0.104  -0.262
  408   3HB   ALA  46          3HB       ALA  46   2.271   0.662  -0.234
  409    H    LYS  47           H        LYS  47   1.774  -0.191  -4.717
  410    HA   LYS  47           HA       LYS  47   4.413   1.116  -4.806
  411   1HB   LYS  47          1HB       LYS  47   4.483  -0.848  -5.921
  412   2HB   LYS  47          2HB       LYS  47   2.853  -0.697  -6.543
  413   1HG   LYS  47          1HG       LYS  47   3.524   0.680  -8.339
  414   2HG   LYS  47          2HG       LYS  47   5.016   1.164  -7.531
  415   1HD   LYS  47          1HD       LYS  47   5.552  -0.327  -9.340
  416   2HD   LYS  47          2HD       LYS  47   5.896  -1.161  -7.818
  417   1HE   LYS  47          1HE       LYS  47   3.753  -2.404  -8.006
  418   2HE   LYS  47          2HE       LYS  47   3.360  -1.511  -9.493
  419   1HZ   LYS  47          1HZ       LYS  47   4.332  -3.602 -10.067
  420   2HZ   LYS  47          2HZ       LYS  47   5.731  -3.239  -9.191
  421    H    ASN  48           H        ASN  48   3.707   3.166  -4.228
  422    HA   ASN  48           HA       ASN  48   2.151   4.877  -5.840
  423   1HB   ASN  48          1HB       ASN  48   2.875   5.364  -3.552
  424   2HB   ASN  48          2HB       ASN  48   4.559   5.465  -4.067
  425   1HD2  ASN  48          2HD2      ASN  48   5.091   7.173  -5.734
  426   2HD2  ASN  48          1HD2      ASN  48   4.236   8.701  -5.605
  427    H    LEU  49           H        LEU  49   2.592   4.649  -8.082
  428    HA   LEU  49           HA       LEU  49   5.249   4.895  -9.232
  429   1HB   LEU  49          1HB       LEU  49   2.462   5.068 -10.404
  430   2HB   LEU  49          2HB       LEU  49   3.948   5.013 -11.346
  431    HG   LEU  49           HG       LEU  49   3.168   2.805  -9.397
  432   1HD1  LEU  49          1HD1      LEU  49   2.178   1.601 -11.220
  433   2HD1  LEU  49          2HD1      LEU  49   1.360   3.159 -11.065
  434   3HD1  LEU  49          3HD1      LEU  49   2.547   2.913 -12.367
  435   1HD2  LEU  49          1HD2      LEU  49   4.651   1.443 -10.882
  436   2HD2  LEU  49          2HD2      LEU  49   5.060   2.909 -11.791
  437   3HD2  LEU  49          3HD2      LEU  49   5.529   2.756 -10.083
  438    HA   PRO  50           HA       PRO  50   4.555   9.173  -7.995
  439   1HB   PRO  50          1HB       PRO  50   6.975  10.319  -8.486
  440   2HB   PRO  50          2HB       PRO  50   6.701   9.131  -7.174
  441   1HG   PRO  50          1HG       PRO  50   7.779   8.568  -9.956
  442   2HG   PRO  50          2HG       PRO  50   8.500   8.081  -8.392
  443   1HD   PRO  50          1HD       PRO  50   6.907   6.393  -9.824
  444   2HD   PRO  50          2HD       PRO  50   6.820   6.444  -8.040
  445    H    ASP  51           H        ASP  51   4.029  11.151  -8.915
  446    HA   ASP  51           HA       ASP  51   2.943  12.360 -10.456
  447   1HB   ASP  51          1HB       ASP  51   5.221  12.922 -11.214
  448   2HB   ASP  51          2HB       ASP  51   5.213  11.551 -12.329
  449    HD2  ASP  51           HD       ASP  51   3.954  13.584 -14.799
  450    H    GLY  52           H        GLY  52   1.701  10.127  -9.933
  451   1HA   GLY  52          1HA       GLY  52   0.215   9.431 -12.274
  452   2HA   GLY  52          2HA       GLY  52   1.366   8.149 -11.843
  453    H    SER  53           H        SER  53   0.208   6.614 -10.859
  454    HA   SER  53           HA       SER  53  -1.908   7.271  -8.845
  455   1HB   SER  53          1HB       SER  53  -3.020   5.199  -9.856
  456   2HB   SER  53          2HB       SER  53  -2.991   6.664 -10.857
  457    HG   SER  53           HG       SER  53  -1.280   5.806 -12.005
  458    H    VAL  54           H        VAL  54  -2.169   5.742  -7.135
  459    HA   VAL  54           HA       VAL  54   0.271   4.174  -6.604
  460    HB   VAL  54           HB       VAL  54  -0.302   5.641  -4.866
  461   1HG1  VAL  54          1HG1      VAL  54  -2.863   4.118  -4.331
  462   2HG1  VAL  54          2HG1      VAL  54  -2.243   5.548  -3.498
  463   3HG1  VAL  54          3HG1      VAL  54  -2.815   5.698  -5.165
  464   1HG2  VAL  54          1HG2      VAL  54  -0.832   2.740  -4.071
  465   2HG2  VAL  54          2HG2      VAL  54   0.760   3.479  -4.313
  466   3HG2  VAL  54          3HG2      VAL  54  -0.289   4.040  -3.005
  467    H    GLU  55           H        GLU  55   0.433   2.218  -7.167
  468    HA   GLU  55           HA       GLU  55  -1.907   0.654  -7.994
  469   1HB   GLU  55          1HB       GLU  55   0.177   1.058  -9.375
  470   2HB   GLU  55          2HB       GLU  55   1.096   0.090  -8.232
  471   1HG   GLU  55          1HG       GLU  55  -1.304  -0.897  -9.843
  472   2HG   GLU  55          2HG       GLU  55   0.390  -1.131 -10.291
  473    HE2  GLU  55           HE       GLU  55  -1.277  -3.355  -7.358
  474    H    VAL  56           H        VAL  56  -2.863  -0.298  -6.232
  475    HA   VAL  56           HA       VAL  56  -1.172  -1.388  -4.042
  476    HB   VAL  56           HB       VAL  56  -4.139  -0.820  -4.189
  477   1HG1  VAL  56          1HG1      VAL  56  -2.401  -1.787  -1.877
  478   2HG1  VAL  56          2HG1      VAL  56  -4.098  -1.271  -1.755
  479   3HG1  VAL  56          3HG1      VAL  56  -3.691  -2.721  -2.670
  480   1HG2  VAL  56          1HG2      VAL  56  -1.843   0.588  -2.755
  481   2HG2  VAL  56          2HG2      VAL  56  -2.800   1.237  -4.105
  482   3HG2  VAL  56          3HG2      VAL  56  -3.566   0.957  -2.536
  483    H    VAL  57           H        VAL  57  -0.933  -3.513  -3.757
  484    HA   VAL  57           HA       VAL  57  -2.835  -5.460  -4.994
  485    HB   VAL  57           HB       VAL  57   0.101  -5.939  -4.319
  486   1HG1  VAL  57          1HG1      VAL  57  -1.967  -7.670  -5.749
  487   2HG1  VAL  57          2HG1      VAL  57  -0.248  -8.063  -5.561
  488   3HG1  VAL  57          3HG1      VAL  57  -1.279  -7.971  -4.137
  489   1HG2  VAL  57          1HG2      VAL  57  -1.191  -5.476  -7.036
  490   2HG2  VAL  57          2HG2      VAL  57   0.079  -4.496  -6.256
  491   3HG2  VAL  57          3HG2      VAL  57   0.438  -6.140  -6.790
  492    H    ALA  58           H        ALA  58  -3.592  -7.059  -3.485
  493    HA   ALA  58           HA       ALA  58  -2.433  -7.134  -0.807
  494   1HB   ALA  58          1HB       ALA  58  -4.426  -6.512   0.395
  495   2HB   ALA  58          2HB       ALA  58  -3.994  -5.185  -0.696
  496   3HB   ALA  58          3HB       ALA  58  -5.332  -6.283  -1.097
  497    H    GLU  59           H        GLU  59  -2.399  -9.283  -0.344
  498    HA   GLU  59           HA       GLU  59  -4.091 -11.137  -1.877
  499   1HB   GLU  59          1HB       GLU  59  -1.419 -11.549  -0.546
  500   2HB   GLU  59          2HB       GLU  59  -2.346 -12.738  -1.480
  501   1HG   GLU  59          1HG       GLU  59  -2.321 -11.093  -3.416
  502   2HG   GLU  59          2HG       GLU  59  -1.157 -10.132  -2.498
  503    HE2  GLU  59           HE       GLU  59   0.204 -12.990  -4.746
  504    H    GLY  60           H        GLY  60  -5.905 -11.817  -0.630
  505   1HA   GLY  60          1HA       GLY  60  -5.310 -13.010   2.042
  506   2HA   GLY  60          2HA       GLY  60  -6.532 -11.732   1.906
  507    H    TYR  61           H        TYR  61  -7.296 -13.999   2.958
  508    HA   TYR  61           HA       TYR  61  -8.947 -15.506   1.086
  509   1HB   TYR  61          1HB       TYR  61  -8.779 -15.115   4.089
  510   2HB   TYR  61          2HB       TYR  61 -10.102 -15.998   3.352
  511    HD1  TYR  61           1HD      TYR  61  -6.481 -16.043   4.109
  512    HD2  TYR  61           2HD      TYR  61  -9.768 -18.204   2.341
  513    HE1  TYR  61           1HE      TYR  61  -5.099 -18.099   4.043
  514    HE2  TYR  61           2HE      TYR  61  -8.406 -20.269   2.334
  515    HH   TYR  61           HH       TYR  61  -6.337 -21.201   2.748
  516    H    GLU  62           H        GLU  62 -11.457 -15.245   1.759
  517    HA   GLU  62           HA       GLU  62 -12.142 -12.478   1.044
  518   1HB   GLU  62          1HB       GLU  62 -13.894 -14.884   1.623
  519   2HB   GLU  62          2HB       GLU  62 -14.452 -13.303   1.032
  520   1HG   GLU  62          1HG       GLU  62 -13.114 -13.581  -1.032
  521   2HG   GLU  62          2HG       GLU  62 -12.577 -15.182  -0.481
  522    HE2  GLU  62           HE       GLU  62 -15.776 -16.662  -0.947
  523    H    GLU  63           H        GLU  63 -11.988 -14.443   3.962
  524    HA   GLU  63           HA       GLU  63 -13.821 -12.827   5.483
  525   1HB   GLU  63          1HB       GLU  63 -13.042 -14.169   7.355
  526   2HB   GLU  63          2HB       GLU  63 -13.375 -15.196   5.961
  527   1HG   GLU  63          1HG       GLU  63 -11.414 -16.041   6.978
  528   2HG   GLU  63          2HG       GLU  63 -10.914 -15.291   5.468
  529    HE2  GLU  63           HE       GLU  63  -8.427 -13.691   7.256
  530    H    ALA  64           H        ALA  64 -10.557 -12.348   4.446
  531    HA   ALA  64           HA       ALA  64 -10.439  -9.902   6.186
  532   1HB   ALA  64          1HB       ALA  64  -7.989 -10.089   5.922
  533   2HB   ALA  64          2HB       ALA  64  -8.670 -11.509   6.736
  534   3HB   ALA  64          3HB       ALA  64  -8.204 -11.610   5.022
  535    H    LEU  65           H        LEU  65 -11.156 -10.920   3.006
  536    HA   LEU  65           HA       LEU  65  -9.696  -8.824   1.624
  537   1HB   LEU  65          1HB       LEU  65 -10.529 -10.755   0.393
  538   2HB   LEU  65          2HB       LEU  65 -12.202 -10.290   0.800
  539    HG   LEU  65           HG       LEU  65 -11.936  -8.185  -0.412
  540   1HD1  LEU  65          1HD1      LEU  65  -9.974  -7.908  -1.947
  541   2HD1  LEU  65          2HD1      LEU  65  -9.513  -7.730  -0.256
  542   3HD1  LEU  65          3HD1      LEU  65  -9.154  -9.247  -1.113
  543   1HD2  LEU  65          1HD2      LEU  65 -11.848  -9.202  -2.654
  544   2HD2  LEU  65          2HD2      LEU  65 -11.158 -10.676  -1.928
  545   3HD2  LEU  65          3HD2      LEU  65 -12.805 -10.170  -1.503
  546    H    SER  66           H        SER  66 -13.156  -9.269   2.388
  547    HA   SER  66           HA       SER  66 -14.215  -6.823   1.966
  548   1HB   SER  66          1HB       SER  66 -15.802  -7.436   3.880
  549   2HB   SER  66          2HB       SER  66 -15.578  -8.680   2.638
  550    HG   SER  66           HG       SER  66 -14.145  -9.746   4.014
  551    H    LYS  67           H        LYS  67 -12.390  -7.691   4.930
  552    HA   LYS  67           HA       LYS  67 -12.853  -5.190   6.264
  553   1HB   LYS  67          1HB       LYS  67 -10.802  -7.428   6.591
  554   2HB   LYS  67          2HB       LYS  67 -10.701  -5.919   7.504
  555   1HG   LYS  67          1HG       LYS  67 -11.928  -7.116   9.000
  556   2HG   LYS  67          2HG       LYS  67 -13.245  -6.393   8.079
  557   1HD   LYS  67          1HD       LYS  67 -13.055  -8.629   6.629
  558   2HD   LYS  67          2HD       LYS  67 -12.097  -9.186   8.009
  559   1HE   LYS  67          1HE       LYS  67 -14.383  -9.933   8.283
  560   2HE   LYS  67          2HE       LYS  67 -14.061  -8.686   9.505
  561   1HZ   LYS  67          1HZ       LYS  67 -16.154  -8.243   8.438
  562   2HZ   LYS  67          2HZ       LYS  67 -15.407  -8.164   6.925
  563    H    LEU  68           H        LEU  68 -10.127  -6.324   4.202
  564    HA   LEU  68           HA       LEU  68  -8.674  -3.838   4.461
  565   1HB   LEU  68          1HB       LEU  68  -7.717  -6.121   4.147
  566   2HB   LEU  68          2HB       LEU  68  -8.415  -6.205   2.535
  567    HG   LEU  68           HG       LEU  68  -5.919  -5.689   2.917
  568   1HD1  LEU  68          1HD1      LEU  68  -5.724  -4.364   0.888
  569   2HD1  LEU  68          2HD1      LEU  68  -6.911  -5.673   0.712
  570   3HD1  LEU  68          3HD1      LEU  68  -7.451  -3.995   0.919
  571   1HD2  LEU  68          1HD2      LEU  68  -5.214  -3.409   3.102
  572   2HD2  LEU  68          2HD2      LEU  68  -6.870  -2.809   3.140
  573   3HD2  LEU  68          3HD2      LEU  68  -6.252  -3.780   4.495
  574    H    LEU  69           H        LEU  69 -11.293  -4.968   2.422
  575    HA   LEU  69           HA       LEU  69 -10.763  -3.147   0.265
  576   1HB   LEU  69          1HB       LEU  69 -11.877  -5.509   0.220
  577   2HB   LEU  69          2HB       LEU  69 -13.235  -4.810   1.050
  578    HG   LEU  69           HG       LEU  69 -13.665  -5.156  -1.192
  579   1HD1  LEU  69          1HD1      LEU  69 -14.636  -3.057  -1.844
  580   2HD1  LEU  69          2HD1      LEU  69 -14.662  -3.114  -0.074
  581   3HD1  LEU  69          3HD1      LEU  69 -13.436  -2.139  -0.919
  582   1HD2  LEU  69          1HD2      LEU  69 -12.574  -3.979  -3.076
  583   2HD2  LEU  69          2HD2      LEU  69 -11.416  -3.243  -1.955
  584   3HD2  LEU  69          3HD2      LEU  69 -11.441  -5.008  -2.186
  585    H    GLU  70           H        GLU  70 -13.344  -3.556   2.718
  586    HA   GLU  70           HA       GLU  70 -14.609  -1.071   2.175
  587   1HB   GLU  70          1HB       GLU  70 -14.842  -3.031   4.492
  588   2HB   GLU  70          2HB       GLU  70 -15.913  -1.643   4.248
  589   1HG   GLU  70          1HG       GLU  70 -16.679  -2.500   2.106
  590   2HG   GLU  70          2HG       GLU  70 -15.532  -3.844   2.170
  591    HE2  GLU  70           HE       GLU  70 -18.695  -3.922   4.732
  592    H    ARG  71           H        ARG  71 -12.014  -1.955   4.405
  593    HA   ARG  71           HA       ARG  71 -11.499   0.201   6.042
  594   1HB   ARG  71          1HB       ARG  71  -9.787  -1.268   5.964
  595   2HB   ARG  71          2HB       ARG  71  -9.946  -1.545   4.241
  596   1HG   ARG  71          1HG       ARG  71  -7.799  -0.579   4.820
  597   2HG   ARG  71          2HG       ARG  71  -8.688   0.334   3.632
  598   1HD   ARG  71          1HD       ARG  71  -9.269   1.351   6.317
  599   2HD   ARG  71          2HD       ARG  71  -7.541   1.261   6.074
  600    HE   ARG  71           HE       ARG  71  -9.327   3.186   4.999
  601   1HH1  ARG  71          1HH1      ARG  71  -6.586   1.274   3.806
  602   2HH1  ARG  71          2HH1      ARG  71  -6.172   2.443   2.572
  603   1HH2  ARG  71          1HH2      ARG  71  -8.734   4.694   3.419
  604   2HH2  ARG  71          2HH2      ARG  71  -7.400   4.373   2.335
  605    H    ILE  72           H        ILE  72 -11.123   0.176   2.463
  606    HA   ILE  72           HA       ILE  72 -10.178   2.900   2.492
  607    HB   ILE  72           HB       ILE  72 -11.020   1.279   0.076
  608   1HG1  ILE  72          1HG1      ILE  72  -8.210   1.500   1.260
  609   2HG1  ILE  72          2HG1      ILE  72  -9.250   0.097   1.516
  610   1HG2  ILE  72          1HG2      ILE  72  -9.520   2.839  -1.096
  611   2HG2  ILE  72          2HG2      ILE  72 -10.693   3.778  -0.181
  612   3HG2  ILE  72          3HG2      ILE  72  -9.050   3.586   0.451
  613   1HD1  ILE  72          1HD1      ILE  72  -7.755  -0.415  -0.265
  614   2HD1  ILE  72          2HD1      ILE  72  -9.399  -0.289  -0.918
  615   3HD1  ILE  72          3HD1      ILE  72  -8.227   1.025  -1.178
  616    H    LYS  73           H        LYS  73 -13.145   1.458   1.074
  617    HA   LYS  73           HA       LYS  73 -14.361   3.790   0.340
  618   1HB   LYS  73          1HB       LYS  73 -15.578   1.185   1.242
  619   2HB   LYS  73          2HB       LYS  73 -16.544   2.550   0.674
  620   1HG   LYS  73          1HG       LYS  73 -16.196   1.061  -1.144
  621   2HG   LYS  73          2HG       LYS  73 -15.361   2.581  -1.481
  622   1HD   LYS  73          1HD       LYS  73 -13.204   1.574  -0.933
  623   2HD   LYS  73          2HD       LYS  73 -13.994   0.070  -0.412
  624   1HE   LYS  73          1HE       LYS  73 -13.917   1.258  -3.231
  625   2HE   LYS  73          2HE       LYS  73 -12.921  -0.083  -2.637
  626   1HZ   LYS  73          1HZ       LYS  73 -14.787  -0.979  -3.799
  627   2HZ   LYS  73          2HZ       LYS  73 -15.869  -0.174  -2.782
  628    H    GLN  74           H        GLN  74 -14.754   2.128   3.504
  629    HA   GLN  74           HA       GLN  74 -16.530   4.042   4.651
  630   1HB   GLN  74          1HB       GLN  74 -16.415   1.677   5.350
  631   2HB   GLN  74          2HB       GLN  74 -14.760   1.919   5.931
  632   1HG   GLN  74          1HG       GLN  74 -16.306   1.878   7.784
  633   2HG   GLN  74          2HG       GLN  74 -15.536   3.456   7.674
  634   1HE2  GLN  74          1HE2      GLN  74 -16.822   5.272   6.799
  635   2HE2  GLN  74          2HE2      GLN  74 -18.568   5.226   6.955
  636    H    GLY  75           H        GLY  75 -12.984   3.535   4.845
  637   1HA   GLY  75          1HA       GLY  75 -12.623   6.089   6.380
  638   2HA   GLY  75          2HA       GLY  75 -11.572   4.681   6.403
  639    HA   PRO  76           HA       PRO  76 -11.060   6.493   1.983
  640   1HB   PRO  76          1HB       PRO  76 -11.953   9.036   1.406
  641   2HB   PRO  76          2HB       PRO  76 -13.006   7.592   1.355
  642   1HG   PRO  76          1HG       PRO  76 -12.644   9.551   3.645
  643   2HG   PRO  76          2HG       PRO  76 -14.181   9.026   2.889
  644   1HD   PRO  76          1HD       PRO  76 -13.268   7.853   5.145
  645   2HD   PRO  76          2HD       PRO  76 -14.002   6.864   3.844
  646    HA   PRO  77           HA       PRO  77  -7.378   8.782   2.907
  647   1HB   PRO  77          1HB       PRO  77  -6.464   9.577   0.470
  648   2HB   PRO  77          2HB       PRO  77  -6.640   7.849   0.907
  649   1HG   PRO  77          1HG       PRO  77  -8.663   9.556  -0.588
  650   2HG   PRO  77          2HG       PRO  77  -7.949   8.015  -1.139
  651   1HD   PRO  77          1HD       PRO  77 -10.320   8.047   0.138
  652   2HD   PRO  77          2HD       PRO  77  -9.123   6.782   0.530
  653    H    ALA  78           H        ALA  78  -6.387  10.938   2.907
  654    HA   ALA  78           HA       ALA  78  -8.342  13.131   2.838
  655   1HB   ALA  78          1HB       ALA  78  -6.610  14.375   4.027
  656   2HB   ALA  78          2HB       ALA  78  -6.912  12.812   4.802
  657   3HB   ALA  78          3HB       ALA  78  -5.462  13.032   3.802
  658    H    ALA  79           H        ALA  79  -7.788  12.093   0.247
  659    HA   ALA  79           HA       ALA  79  -6.733  14.521  -1.033
  660   1HB   ALA  79          1HB       ALA  79  -5.513  13.081  -2.687
  661   2HB   ALA  79          2HB       ALA  79  -4.775  13.243  -1.090
  662   3HB   ALA  79          3HB       ALA  79  -5.664  11.752  -1.509
  663    H    GLU  80           H        GLU  80  -7.401  14.576  -3.314
  664    HA   GLU  80           HA       GLU  80 -10.126  13.677  -3.698
  665   1HB   GLU  80          1HB       GLU  80  -8.183  15.153  -5.535
  666   2HB   GLU  80          2HB       GLU  80  -9.876  14.811  -5.891
  667   1HG   GLU  80          1HG       GLU  80  -9.771  17.057  -5.099
  668   2HG   GLU  80          2HG       GLU  80 -10.574  16.078  -3.865
  669    HE2  GLU  80           HE       GLU  80  -8.473  17.767  -1.654
  670    H    VAL  81           H        VAL  81  -9.809  11.410  -3.513
  671    HA   VAL  81           HA       VAL  81  -8.371   9.856  -5.449
  672    HB   VAL  81           HB       VAL  81  -8.836   9.097  -3.241
  673   1HG1  VAL  81          1HG1      VAL  81 -11.788   8.756  -3.887
  674   2HG1  VAL  81          2HG1      VAL  81 -10.930   8.312  -2.415
  675   3HG1  VAL  81          3HG1      VAL  81 -11.112  10.017  -2.835
  676   1HG2  VAL  81          1HG2      VAL  81 -10.181   7.339  -5.338
  677   2HG2  VAL  81          2HG2      VAL  81  -8.434   7.476  -5.056
  678   3HG2  VAL  81          3HG2      VAL  81  -9.483   6.797  -3.800
  679    H    GLU  82           H        GLU  82  -8.908  10.929  -7.347
  680    HA   GLU  82           HA       GLU  82 -11.181  11.417  -8.664
  681   1HB   GLU  82          1HB       GLU  82  -8.952  11.762  -9.566
  682   2HB   GLU  82          2HB       GLU  82  -8.722  10.020  -9.787
  683   1HG   GLU  82          1HG       GLU  82 -10.673  10.027 -11.398
  684   2HG   GLU  82          2HG       GLU  82 -10.799  11.778 -11.174
  685    HE2  GLU  82           HE       GLU  82  -7.753  10.168 -13.330
  686    H    LYS  83           H        LYS  83  -9.616   8.142  -8.898
  687    HA   LYS  83           HA       LYS  83 -12.138   6.847  -8.460
  688   1HB   LYS  83          1HB       LYS  83 -12.364   5.709 -10.631
  689   2HB   LYS  83          2HB       LYS  83 -12.601   7.447 -10.766
  690   1HG   LYS  83          1HG       LYS  83 -10.188   7.625 -11.599
  691   2HG   LYS  83          2HG       LYS  83 -10.128   5.857 -11.570
  692   1HD   LYS  83          1HD       LYS  83 -10.576   6.425 -13.790
  693   2HD   LYS  83          2HD       LYS  83 -12.108   5.824 -13.137
  694   1HE   LYS  83          1HE       LYS  83 -12.887   8.193 -12.866
  695   2HE   LYS  83          2HE       LYS  83 -11.322   8.762 -13.486
  696   1HZ   LYS  83          1HZ       LYS  83 -12.888   8.689 -15.271
  697   2HZ   LYS  83          2HZ       LYS  83 -13.174   7.045 -15.007
  698    H    VAL  84           H        VAL  84 -11.692   4.947  -7.448
  699    HA   VAL  84           HA       VAL  84  -9.129   3.577  -8.050
  700    HB   VAL  84           HB       VAL  84  -9.421   3.737  -5.833
  701   1HG1  VAL  84          1HG1      VAL  84 -12.261   2.675  -6.062
  702   2HG1  VAL  84          2HG1      VAL  84 -11.350   2.888  -4.554
  703   3HG1  VAL  84          3HG1      VAL  84 -11.749   4.296  -5.539
  704   1HG2  VAL  84          1HG2      VAL  84 -10.370   0.938  -6.507
  705   2HG2  VAL  84          2HG2      VAL  84  -8.721   1.527  -6.817
  706   3HG2  VAL  84          3HG2      VAL  84  -9.346   1.448  -5.154
  707    H    ASP  85           H        ASP  85  -9.387   2.827 -10.120
  708    HA   ASP  85           HA       ASP  85 -11.808   1.332 -10.908
  709   1HB   ASP  85          1HB       ASP  85 -10.809   2.935 -12.472
  710   2HB   ASP  85          2HB       ASP  85  -9.267   2.071 -12.404
  711    HD2  ASP  85           HD       ASP  85 -10.238   0.081 -15.049
  712    H    TYR  86           H        TYR  86 -11.299  -0.170  -9.040
  713    HA   TYR  86           HA       TYR  86  -8.894  -1.718  -9.227
  714   1HB   TYR  86          1HB       TYR  86  -9.562  -2.866  -7.294
  715   2HB   TYR  86          2HB       TYR  86 -10.048  -1.203  -7.068
  716    HD1  TYR  86           1HD      TYR  86 -11.063  -4.684  -7.180
  717    HD2  TYR  86           2HD      TYR  86 -12.548  -0.633  -7.269
  718    HE1  TYR  86           1HE      TYR  86 -13.234  -5.458  -6.285
  719    HE2  TYR  86           2HE      TYR  86 -14.727  -1.418  -6.391
  720    HH   TYR  86           HH       TYR  86 -15.964  -3.226  -5.664
  721    H    SER  87           H        SER  87  -8.819  -4.057  -9.282
  722    HA   SER  87           HA       SER  87 -10.923  -5.442 -10.812
  723   1HB   SER  87          1HB       SER  87  -8.022  -5.320 -11.720
  724   2HB   SER  87          2HB       SER  87  -9.307  -6.337 -12.409
  725    HG   SER  87           HG       SER  87 -10.434  -4.206 -12.667
  726    H    PHE  88           H        PHE  88 -11.387  -6.689  -9.114
  727    HA   PHE  88           HA       PHE  88  -9.654  -8.159  -7.396
  728   1HB   PHE  88          1HB       PHE  88 -11.970  -7.922  -6.880
  729   2HB   PHE  88          2HB       PHE  88 -12.463  -8.522  -8.453
  730    HD1  PHE  88           1HD      PHE  88 -11.333  -9.507  -5.079
  731    HD2  PHE  88           2HD      PHE  88 -12.501 -10.910  -8.988
  732    HE1  PHE  88           1HE      PHE  88 -11.881 -11.731  -4.130
  733    HE2  PHE  88           2HE      PHE  88 -12.933 -13.161  -8.050
  734    HZ   PHE  88           HZ       PHE  88 -12.649 -13.569  -5.614
  735    H    SER  89           H        SER  89  -8.323  -9.839  -7.851
  736    HA   SER  89           HA       SER  89  -8.703 -11.459 -10.323
  737   1HB   SER  89          1HB       SER  89  -6.103 -10.286  -9.328
  738   2HB   SER  89          2HB       SER  89  -6.348 -11.253 -10.799
  739    HG   SER  89           HG       SER  89  -7.881  -9.525 -11.383
  740    H    GLU  90           H        GLU  90  -6.425 -13.101  -9.923
  741    HA   GLU  90           HA       GLU  90  -6.741 -14.212  -7.201
  742   1HB   GLU  90          1HB       GLU  90  -6.925 -16.413  -7.912
  743   2HB   GLU  90          2HB       GLU  90  -8.041 -15.516  -8.933
  744   1HG   GLU  90          1HG       GLU  90  -6.976 -16.999 -10.411
  745   2HG   GLU  90          2HG       GLU  90  -6.153 -15.462 -10.705
  746    HE2  GLU  90           HE       GLU  90  -3.086 -16.854  -9.961
  747    H    TYR  91           H        TYR  91  -4.922 -15.223  -6.325
  748    HA   TYR  91           HA       TYR  91  -2.705 -13.685  -6.579
  749   1HB   TYR  91          1HB       TYR  91  -1.787 -14.906  -4.905
  750   2HB   TYR  91          2HB       TYR  91  -3.513 -15.138  -4.673
  751    HD1  TYR  91           1HD      TYR  91  -0.345 -16.754  -4.907
  752    HD2  TYR  91           2HD      TYR  91  -4.530 -17.355  -5.768
  753    HE1  TYR  91           1HE      TYR  91   0.061 -19.176  -5.189
  754    HE2  TYR  91           2HE      TYR  91  -4.129 -19.777  -6.024
  755    HH   TYR  91           HH       TYR  91  -2.555 -21.471  -6.042
  756    H    LYS  92           H        LYS  92  -1.008 -13.561  -7.953
  757    HA   LYS  92           HA       LYS  92  -0.496 -15.596  -9.985
  758   1HB   LYS  92          1HB       LYS  92  -0.182 -13.234 -10.438
  759   2HB   LYS  92          2HB       LYS  92   1.100 -13.139  -9.209
  760   1HG   LYS  92          1HG       LYS  92   2.516 -14.657 -10.462
  761   2HG   LYS  92          2HG       LYS  92   1.170 -15.160 -11.494
  762   1HD   LYS  92          1HD       LYS  92   2.588 -13.737 -12.754
  763   2HD   LYS  92          2HD       LYS  92   1.038 -12.917 -12.481
  764   1HE   LYS  92          1HE       LYS  92   2.064 -11.543 -10.688
  765   2HE   LYS  92          2HE       LYS  92   3.597 -12.424 -10.873
  766   1HZ   LYS  92          1HZ       LYS  92   3.685 -10.389 -12.112
  767   2HZ   LYS  92          2HZ       LYS  92   2.341 -10.846 -13.028
  768    H    GLY  93           H        GLY  93   1.032 -14.413  -6.944
  769   1HA   GLY  93          1HA       GLY  93   2.130 -17.020  -6.341
  770   2HA   GLY  93          2HA       GLY  93   3.358 -15.802  -6.766
  771    H    GLU  94           H        GLU  94   3.620 -16.679  -4.371
  772    HA   GLU  94           HA       GLU  94   2.086 -15.217  -2.331
  773   1HB   GLU  94          1HB       GLU  94   3.528 -16.503  -0.784
  774   2HB   GLU  94          2HB       GLU  94   2.420 -17.430  -1.791
  775   1HG   GLU  94          1HG       GLU  94   4.172 -18.206  -3.243
  776   2HG   GLU  94          2HG       GLU  94   5.368 -17.137  -2.492
  777    HE2  GLU  94           HE       GLU  94   4.170 -19.914   0.143
  778    H    PHE  95           H        PHE  95   2.590 -13.080  -2.519
  779    HA   PHE  95           HA       PHE  95   5.063 -11.924  -3.134
  780   1HB   PHE  95          1HB       PHE  95   2.574 -11.007  -1.693
  781   2HB   PHE  95          2HB       PHE  95   4.009 -10.009  -1.639
  782    HD1  PHE  95           1HD      PHE  95   4.058  -8.252  -3.143
  783    HD2  PHE  95           2HD      PHE  95   2.307 -11.980  -4.400
  784    HE1  PHE  95           1HE      PHE  95   3.271  -7.178  -5.227
  785    HE2  PHE  95           2HE      PHE  95   1.626 -10.937  -6.534
  786    HZ   PHE  95           HZ       PHE  95   2.112  -8.534  -6.959
  787    H    GLU  96           H        GLU  96   3.634 -12.436   0.117
  788    HA   GLU  96           HA       GLU  96   4.477 -12.362   2.197
  789   1HB   GLU  96          1HB       GLU  96   6.754 -13.860   0.852
  790   2HB   GLU  96          2HB       GLU  96   6.449 -13.784   2.601
  791   1HG   GLU  96          1HG       GLU  96   4.183 -14.774   2.234
  792   2HG   GLU  96          2HG       GLU  96   4.550 -14.918   0.510
  793    HE2  GLU  96           HE       GLU  96   6.368 -17.391   3.171
  794    H    ASP  97           H        ASP  97   4.550 -10.049   1.597
  795    HA   ASP  97           HA       ASP  97   6.011  -8.579   3.210
  796   1HB   ASP  97          1HB       ASP  97   8.202  -9.142   2.346
  797   2HB   ASP  97          2HB       ASP  97   7.697  -8.772   0.682
  798    HD2  ASP  97           HD       ASP  97   8.423  -5.768   3.342
  799    H    PHE  98           H        PHE  98   4.088  -7.414   3.129
  800    HA   PHE  98           HA       PHE  98   3.426  -5.878   0.687
  801   1HB   PHE  98          1HB       PHE  98   1.759  -6.970   2.259
  802   2HB   PHE  98          2HB       PHE  98   2.085  -5.686   3.381
  803    HD1  PHE  98           1HD      PHE  98   2.271  -3.422   1.108
  804    HD2  PHE  98           2HD      PHE  98  -0.535  -6.552   2.076
  805    HE1  PHE  98           1HE      PHE  98   0.426  -2.082   0.183
  806    HE2  PHE  98           2HE      PHE  98  -2.364  -5.208   1.108
  807    HZ   PHE  98           HZ       PHE  98  -1.886  -2.972   0.147
  808    H    GLU  99           H        GLU  99   5.321  -4.595   0.489
  809    HA   GLU  99           HA       GLU  99   5.748  -2.593   2.671
  810   1HB   GLU  99          1HB       GLU  99   7.594  -3.961   2.235
  811   2HB   GLU  99          2HB       GLU  99   7.611  -3.557   0.524
  812   1HG   GLU  99          1HG       GLU  99   8.112  -1.189   1.084
  813   2HG   GLU  99          2HG       GLU  99   7.942  -1.550   2.806
  814    HE2  GLU  99           HE       GLU  99  11.073  -3.239   2.934
  815    H    THR 100           H        THR 100   6.219  -0.382   1.900
  816    HA   THR 100           HA       THR 100   4.401   0.399  -0.283
  817    HB   THR 100           HB       THR 100   3.827   2.202   0.980
  818    HG1  THR 100           1HG      THR 100   5.106   2.968   2.724
  819   1HG2  THR 100          1HG2      THR 100   3.344   1.419   3.217
  820   2HG2  THR 100          2HG2      THR 100   3.274   0.000   2.139
  821   3HG2  THR 100          3HG2      THR 100   4.683   0.271   3.192
  822    H    TYR 101           H        TYR 101   5.000   1.788  -1.927
  823    HA   TYR 101           HA       TYR 101   7.597   3.284  -1.691
  824   1HB   TYR 101          1HB       TYR 101   5.555   3.321  -3.897
  825   2HB   TYR 101          2HB       TYR 101   7.070   4.199  -3.874
  826    HD1  TYR 101           1HD      TYR 101   8.502   1.446  -2.697
  827    HD2  TYR 101           2HD      TYR 101   6.120   2.509  -6.129
  828    HE1  TYR 101           1HE      TYR 101   9.726  -0.212  -4.058
  829    HE2  TYR 101           2HE      TYR 101   7.408   0.901  -7.506
  830    HH   TYR 101           HH       TYR 101   8.970  -0.785  -7.509
  Start of MODEL   18
    1   1H    GLY  -1          1H        GLY  -1 -15.282 -43.492  23.718
    2   2H    GLY  -1          2H        GLY  -1 -13.952 -44.247  23.089
    3   3H    GLY  -1          3H        GLY  -1 -13.833 -42.700  23.629
    4   1HA   GLY  -1          1HA       GLY  -1 -15.427 -43.598  21.345
    5   2HA   GLY  -1          2HA       GLY  -1 -15.312 -41.923  21.924
    6    H    SER   0           H        SER   0 -14.673 -42.508  19.300
    7    HA   SER   0           HA       SER   0 -11.759 -41.970  19.155
    8   1HB   SER   0          1HB       SER   0 -13.187 -44.168  17.594
    9   2HB   SER   0          2HB       SER   0 -11.503 -43.647  17.377
   10    HG   SER   0           HG       SER   0 -11.184 -44.225  19.606
   11    H    MET   1           H        MET   1 -11.905 -39.952  18.359
   12    HA   MET   1           HA       MET   1 -14.084 -39.199  16.533
   13   1HB   MET   1          1HB       MET   1 -11.955 -37.508  17.913
   14   2HB   MET   1          2HB       MET   1 -13.350 -36.930  16.986
   15   1HG   MET   1          1HG       MET   1 -14.039 -36.733  19.196
   16   2HG   MET   1          2HG       MET   1 -14.825 -38.210  18.638
   17   1HE   MET   1          1HE       MET   1 -14.995 -37.696  21.586
   18   2HE   MET   1          2HE       MET   1 -14.366 -39.185  22.330
   19   3HE   MET   1          3HE       MET   1 -15.409 -39.285  20.892
   20    H    LYS   2           H        LYS   2 -12.854 -40.841  15.049
   21    HA   LYS   2           HA       LYS   2 -10.676 -39.566  13.482
   22   1HB   LYS   2          1HB       LYS   2 -11.931 -42.311  13.226
   23   2HB   LYS   2          2HB       LYS   2 -10.438 -41.741  12.450
   24   1HG   LYS   2          1HG       LYS   2  -9.498 -41.379  14.794
   25   2HG   LYS   2          2HG       LYS   2 -10.905 -42.262  15.409
   26   1HD   LYS   2          1HD       LYS   2  -8.770 -43.307  13.503
   27   2HD   LYS   2          2HD       LYS   2  -9.009 -43.756  15.199
   28   1HE   LYS   2          1HE       LYS   2 -11.298 -44.658  14.560
   29   2HE   LYS   2          2HE       LYS   2 -10.871 -44.361  12.858
   30   1HZ   LYS   2          1HZ       LYS   2 -10.319 -46.598  13.412
   31   2HZ   LYS   2          2HZ       LYS   2  -9.302 -46.084  14.660
   32    H    LYS   3           H        LYS   3 -11.088 -40.412  10.988
   33    HA   LYS   3           HA       LYS   3 -12.023 -39.832   9.030
   34   1HB   LYS   3          1HB       LYS   3 -14.631 -40.438  10.494
   35   2HB   LYS   3          2HB       LYS   3 -14.504 -40.009   8.797
   36   1HG   LYS   3          1HG       LYS   3 -14.636 -42.324   8.792
   37   2HG   LYS   3          2HG       LYS   3 -12.970 -41.922   8.390
   38   1HD   LYS   3          1HD       LYS   3 -13.072 -43.857   9.826
   39   2HD   LYS   3          2HD       LYS   3 -12.275 -42.554  10.703
   40   1HE   LYS   3          1HE       LYS   3 -14.336 -42.129  11.997
   41   2HE   LYS   3          2HE       LYS   3 -15.236 -43.277  10.985
   42   1HZ   LYS   3          1HZ       LYS   3 -14.561 -44.345  13.004
   43   2HZ   LYS   3          2HZ       LYS   3 -12.937 -44.040  12.664
   44    H    TRP   4           H        TRP   4 -11.052 -37.741   9.364
   45    HA   TRP   4           HA       TRP   4 -12.996 -35.531   9.716
   46   1HB   TRP   4          1HB       TRP   4 -11.160 -35.755  11.463
   47   2HB   TRP   4          2HB       TRP   4  -9.988 -35.460  10.177
   48    HD1  TRP   4           HD       TRP   4  -9.477 -32.951   9.733
   49    HE1  TRP   4           1HE      TRP   4 -10.514 -30.686  10.432
   50    HE3  TRP   4           3HE      TRP   4 -13.670 -34.665  12.105
   51    HZ2  TRP   4           2HZ      TRP   4 -12.846 -29.763  11.820
   52    HZ3  TRP   4           3HZ      TRP   4 -15.290 -33.090  13.070
   53    HH2  TRP   4           HH       TRP   4 -14.892 -30.629  12.953
   54    H    SER   5           H        SER   5 -12.555 -33.726   8.386
   55    HA   SER   5           HA       SER   5 -11.194 -34.287   5.778
   56   1HB   SER   5          1HB       SER   5 -13.838 -32.841   6.225
   57   2HB   SER   5          2HB       SER   5 -13.019 -33.091   4.670
   58    HG   SER   5           HG       SER   5 -13.189 -35.380   5.129
   59    H    ASP   6           H        ASP   6 -10.003 -32.592   4.916
   60    HA   ASP   6           HA       ASP   6 -10.270 -29.901   5.763
   61   1HB   ASP   6          1HB       ASP   6  -8.865 -31.199   7.657
   62   2HB   ASP   6          2HB       ASP   6  -7.554 -31.031   6.492
   63    HD2  ASP   6           HD       ASP   6  -8.984 -27.873   8.575
   64    H    THR   7           H        THR   7  -8.033 -28.759   4.889
   65    HA   THR   7           HA       THR   7  -7.191 -27.961   2.938
   66    HB   THR   7           HB       THR   7  -5.399 -29.417   2.062
   67    HG1  THR   7           1HG      THR   7  -5.163 -31.477   2.972
   68   1HG2  THR   7          1HG2      THR   7  -4.138 -29.618   4.122
   69   2HG2  THR   7          2HG2      THR   7  -5.095 -28.125   4.177
   70   3HG2  THR   7          3HG2      THR   7  -5.615 -29.557   5.098
   71    H    GLU   8           H        GLU   8  -9.697 -28.270   2.259
   72    HA   GLU   8           HA       GLU   8  -9.736 -29.678  -0.382
   73   1HB   GLU   8          1HB       GLU   8 -11.164 -30.652   1.390
   74   2HB   GLU   8          2HB       GLU   8 -12.041 -29.121   1.525
   75   1HG   GLU   8          1HG       GLU   8 -12.755 -29.322  -0.847
   76   2HG   GLU   8          2HG       GLU   8 -11.798 -30.803  -1.020
   77    HE2  GLU   8           HE       GLU   8 -14.038 -32.730   0.975
   78    H    VAL   9           H        VAL   9  -8.651 -27.696  -1.137
   79    HA   VAL   9           HA       VAL   9 -10.558 -25.894  -2.304
   80    HB   VAL   9           HB       VAL   9 -10.315 -24.827  -0.079
   81   1HG1  VAL   9          1HG1      VAL   9  -7.364 -24.444  -0.746
   82   2HG1  VAL   9          2HG1      VAL   9  -8.238 -23.857   0.679
   83   3HG1  VAL   9          3HG1      VAL   9  -7.990 -25.594   0.456
   84   1HG2  VAL   9          1HG2      VAL   9  -8.955 -23.230  -2.268
   85   2HG2  VAL   9          2HG2      VAL   9 -10.708 -23.449  -2.097
   86   3HG2  VAL   9          3HG2      VAL   9  -9.793 -22.584  -0.847
   87    H    PHE  10           H        PHE  10  -9.681 -24.941  -4.173
   88    HA   PHE  10           HA       PHE  10  -7.210 -26.122  -5.157
   89   1HB   PHE  10          1HB       PHE  10  -8.914 -23.963  -6.442
   90   2HB   PHE  10          2HB       PHE  10  -7.731 -25.004  -7.224
   91    HD1  PHE  10           1HD      PHE  10  -8.274 -27.695  -6.612
   92    HD2  PHE  10           2HD      PHE  10 -11.120 -24.476  -7.039
   93    HE1  PHE  10           1HE      PHE  10 -10.070 -29.335  -7.079
   94    HE2  PHE  10           2HE      PHE  10 -12.900 -26.122  -7.524
   95    HZ   PHE  10           HZ       PHE  10 -12.387 -28.553  -7.531
   96    H    GLU  11           H        GLU  11  -8.334 -22.751  -4.600
   97    HA   GLU  11           HA       GLU  11  -5.513 -21.893  -4.164
   98   1HB   GLU  11          1HB       GLU  11  -6.001 -19.783  -5.063
   99   2HB   GLU  11          2HB       GLU  11  -6.341 -21.036  -6.256
  100   1HG   GLU  11          1HG       GLU  11  -8.407 -19.445  -4.662
  101   2HG   GLU  11          2HG       GLU  11  -7.929 -19.194  -6.332
  102    HE2  GLU  11           HE       GLU  11 -10.635 -22.003  -5.463
  103    H    MET  12           H        MET  12  -5.145 -21.420  -2.083
  104    HA   MET  12           HA       MET  12  -7.246 -21.302  -0.150
  105   1HB   MET  12          1HB       MET  12  -4.285 -20.612   0.013
  106   2HB   MET  12          2HB       MET  12  -5.385 -20.596   1.399
  107   1HG   MET  12          1HG       MET  12  -5.964 -22.950   1.016
  108   2HG   MET  12          2HG       MET  12  -4.857 -23.021  -0.362
  109   1HE   MET  12          1HE       MET  12  -4.966 -25.031   2.177
  110   2HE   MET  12          2HE       MET  12  -3.220 -25.297   2.384
  111   3HE   MET  12          3HE       MET  12  -3.920 -25.226   0.749
  112    H    LEU  13           H        LEU  13  -4.959 -18.708  -1.220
  113    HA   LEU  13           HA       LEU  13  -7.112 -16.714  -0.839
  114   1HB   LEU  13          1HB       LEU  13  -5.704 -15.297   0.489
  115   2HB   LEU  13          2HB       LEU  13  -5.917 -16.859   1.267
  116    HG   LEU  13           HG       LEU  13  -3.542 -17.261  -0.105
  117   1HD1  LEU  13          1HD1      LEU  13  -2.167 -15.246   0.209
  118   2HD1  LEU  13          2HD1      LEU  13  -3.538 -14.844  -0.841
  119   3HD1  LEU  13          3HD1      LEU  13  -3.555 -14.361   0.866
  120   1HD2  LEU  13          1HD2      LEU  13  -2.460 -16.872   2.091
  121   2HD2  LEU  13          2HD2      LEU  13  -3.938 -16.071   2.670
  122   3HD2  LEU  13          3HD2      LEU  13  -3.962 -17.798   2.244
  123    H    LYS  14           H        LYS  14  -6.933 -14.900  -2.030
  124    HA   LYS  14           HA       LYS  14  -5.129 -15.096  -4.407
  125   1HB   LYS  14          1HB       LYS  14  -7.004 -14.464  -5.761
  126   2HB   LYS  14          2HB       LYS  14  -7.360 -15.901  -4.800
  127   1HG   LYS  14          1HG       LYS  14  -9.271 -14.775  -4.416
  128   2HG   LYS  14          2HG       LYS  14  -8.329 -14.040  -3.105
  129   1HD   LYS  14          1HD       LYS  14  -7.761 -12.193  -4.879
  130   2HD   LYS  14          2HD       LYS  14  -9.113 -12.877  -5.777
  131   1HE   LYS  14          1HE       LYS  14  -9.174 -11.811  -2.914
  132   2HE   LYS  14          2HE       LYS  14  -9.798 -10.972  -4.347
  133   1HZ   LYS  14          1HZ       LYS  14 -11.599 -12.119  -3.264
  134   2HZ   LYS  14          2HZ       LYS  14 -10.793 -13.595  -3.413
  135    H    ARG  15           H        ARG  15  -5.022 -13.096  -5.681
  136    HA   ARG  15           HA       ARG  15  -4.533 -10.768  -3.938
  137   1HB   ARG  15          1HB       ARG  15  -3.069  -9.885  -5.387
  138   2HB   ARG  15          2HB       ARG  15  -2.754 -11.623  -5.416
  139   1HG   ARG  15          1HG       ARG  15  -4.080 -11.718  -7.562
  140   2HG   ARG  15          2HG       ARG  15  -4.196  -9.949  -7.524
  141   1HD   ARG  15          1HD       ARG  15  -1.898  -9.609  -7.845
  142   2HD   ARG  15          2HD       ARG  15  -1.481 -11.250  -7.381
  143    HE   ARG  15           HE       ARG  15  -1.981 -12.063  -9.456
  144   1HH1  ARG  15          2HH1      ARG  15  -3.220  -8.729  -9.286
  145   2HH1  ARG  15          1HH1      ARG  15  -3.717  -8.714 -10.958
  146   1HH2  ARG  15          1HH2      ARG  15  -2.613 -12.010 -11.618
  147   2HH2  ARG  15          2HH2      ARG  15  -3.328 -10.572 -12.304
  148    H    MET  16           H        MET  16  -5.963  -9.217  -3.737
  149    HA   MET  16           HA       MET  16  -7.719  -8.394  -5.966
  150   1HB   MET  16          1HB       MET  16  -8.503  -8.513  -3.740
  151   2HB   MET  16          2HB       MET  16  -7.384  -7.277  -3.164
  152   1HG   MET  16          1HG       MET  16  -9.394  -6.811  -5.417
  153   2HG   MET  16          2HG       MET  16  -9.846  -6.655  -3.736
  154   1HE   MET  16          1HE       MET  16  -7.995  -5.275  -2.100
  155   2HE   MET  16          2HE       MET  16  -7.589  -3.609  -2.565
  156   3HE   MET  16          3HE       MET  16  -6.544  -4.943  -3.079
  157    H    TYR  17           H        TYR  17  -7.467  -6.325  -6.847
  158    HA   TYR  17           HA       TYR  17  -4.861  -4.922  -6.513
  159   1HB   TYR  17          1HB       TYR  17  -4.567  -6.466  -8.371
  160   2HB   TYR  17          2HB       TYR  17  -6.072  -5.938  -9.113
  161    HD1  TYR  17           1HD      TYR  17  -6.163  -3.924 -10.477
  162    HD2  TYR  17           2HD      TYR  17  -2.588  -4.910  -8.272
  163    HE1  TYR  17           1HE      TYR  17  -4.921  -2.192 -11.722
  164    HE2  TYR  17           2HE      TYR  17  -1.334  -3.212  -9.558
  165    HH   TYR  17           HH       TYR  17  -1.414  -1.665 -11.261
  166    H    ALA  18           H        ALA  18  -5.566  -3.048  -5.667
  167    HA   ALA  18           HA       ALA  18  -7.951  -1.740  -6.894
  168   1HB   ALA  18          1HB       ALA  18  -7.930  -0.329  -4.880
  169   2HB   ALA  18          2HB       ALA  18  -8.311  -2.035  -4.599
  170   3HB   ALA  18          3HB       ALA  18  -6.690  -1.407  -4.185
  171    H    ARG  19           H        ARG  19  -7.312  -0.569  -8.509
  172    HA   ARG  19           HA       ARG  19  -4.919   1.108  -8.371
  173   1HB   ARG  19          1HB       ARG  19  -5.910  -0.177 -10.459
  174   2HB   ARG  19          2HB       ARG  19  -6.891   1.270 -10.622
  175   1HG   ARG  19          1HG       ARG  19  -3.898   0.893 -10.835
  176   2HG   ARG  19          2HG       ARG  19  -5.016   1.660 -11.963
  177   1HD   ARG  19          1HD       ARG  19  -5.314   3.458 -10.118
  178   2HD   ARG  19          2HD       ARG  19  -3.873   2.799  -9.374
  179    HE   ARG  19           HE       ARG  19  -4.181   4.210 -11.964
  180   1HH1  ARG  19          1HH1      ARG  19  -1.900   2.599  -9.754
  181   2HH1  ARG  19          2HH1      ARG  19  -0.503   3.380 -10.446
  182   1HH2  ARG  19          1HH2      ARG  19  -2.323   5.207 -12.851
  183   2HH2  ARG  19          2HH2      ARG  19  -0.738   4.823 -12.230
  184    H    VAL  20           H        VAL  20  -5.294   2.681  -6.838
  185    HA   VAL  20           HA       VAL  20  -7.909   4.003  -6.571
  186    HB   VAL  20           HB       VAL  20  -5.302   4.555  -5.132
  187   1HG1  VAL  20          1HG1      VAL  20  -8.195   5.209  -4.416
  188   2HG1  VAL  20          2HG1      VAL  20  -6.758   5.611  -3.458
  189   3HG1  VAL  20          3HG1      VAL  20  -7.013   6.369  -5.039
  190   1HG2  VAL  20          1HG2      VAL  20  -7.606   2.742  -4.310
  191   2HG2  VAL  20          2HG2      VAL  20  -5.955   2.218  -4.707
  192   3HG2  VAL  20          3HG2      VAL  20  -6.245   3.216  -3.279
  193    H    TYR  21           H        TYR  21  -8.360   5.399  -8.252
  194    HA   TYR  21           HA       TYR  21  -6.201   6.727  -9.719
  195   1HB   TYR  21          1HB       TYR  21  -9.205   7.186  -9.870
  196   2HB   TYR  21          2HB       TYR  21  -8.016   7.914 -10.905
  197    HD1  TYR  21           1HD      TYR  21  -7.139   4.461 -10.422
  198    HD2  TYR  21           2HD      TYR  21  -9.778   7.099 -12.559
  199    HE1  TYR  21           1HE      TYR  21  -7.436   2.747 -12.182
  200    HE2  TYR  21           2HE      TYR  21 -10.139   5.356 -14.268
  201    HH   TYR  21           HH       TYR  21  -9.567   3.246 -15.005
  202    H    GLY  22           H        GLY  22  -5.773   8.969  -9.816
  203   1HA   GLY  22          1HA       GLY  22  -6.751  11.159  -9.584
  204   2HA   GLY  22          2HA       GLY  22  -7.264  10.762  -7.939
  205    H    LEU  23           H        LEU  23  -6.249  12.585  -7.134
  206    HA   LEU  23           HA       LEU  23  -3.363  12.946  -7.454
  207   1HB   LEU  23          1HB       LEU  23  -5.167  14.751  -7.467
  208   2HB   LEU  23          2HB       LEU  23  -5.245  14.538  -5.716
  209    HG   LEU  23           HG       LEU  23  -2.682  15.049  -5.743
  210   1HD1  LEU  23          1HD1      LEU  23  -1.932  16.409  -7.687
  211   2HD1  LEU  23          2HD1      LEU  23  -2.219  14.725  -8.133
  212   3HD1  LEU  23          3HD1      LEU  23  -3.414  15.970  -8.555
  213   1HD2  LEU  23          1HD2      LEU  23  -3.089  17.473  -5.833
  214   2HD2  LEU  23          2HD2      LEU  23  -4.655  17.192  -6.627
  215   3HD2  LEU  23          3HD2      LEU  23  -4.386  16.644  -4.957
  216    H    VAL  24           H        VAL  24  -4.427  10.524  -6.081
  217    HA   VAL  24           HA       VAL  24  -4.064  10.845  -3.245
  218    HB   VAL  24           HB       VAL  24  -4.406   8.443  -3.160
  219   1HG1  VAL  24          1HG1      VAL  24  -6.317   9.755  -5.149
  220   2HG1  VAL  24          2HG1      VAL  24  -6.668   8.432  -4.024
  221   3HG1  VAL  24          3HG1      VAL  24  -6.326  10.052  -3.401
  222   1HG2  VAL  24          1HG2      VAL  24  -4.460   8.513  -6.219
  223   2HG2  VAL  24          2HG2      VAL  24  -3.154   7.818  -5.237
  224   3HG2  VAL  24          3HG2      VAL  24  -4.789   7.131  -5.167
  225    H    GLN  25           H        GLN  25  -1.754  10.599  -5.734
  226    HA   GLN  25           HA       GLN  25   0.427   9.558  -4.102
  227   1HB   GLN  25          1HB       GLN  25   0.072  10.611  -6.805
  228   2HB   GLN  25          2HB       GLN  25   1.416  11.404  -5.994
  229   1HG   GLN  25          1HG       GLN  25   2.311   9.543  -7.066
  230   2HG   GLN  25          2HG       GLN  25   2.341   9.154  -5.351
  231   1HE2  GLN  25          1HE2      GLN  25   2.415   7.410  -7.749
  232   2HE2  GLN  25          2HE2      GLN  25   1.070   6.304  -7.658
  233    H    GLY  26           H        GLY  26   2.221  11.060  -3.417
  234   1HA   GLY  26          1HA       GLY  26   3.005  12.924  -2.320
  235   2HA   GLY  26          2HA       GLY  26   1.521  13.803  -2.706
  236    H    VAL  27           H        VAL  27  -0.525  12.737  -1.551
  237    HA   VAL  27           HA       VAL  27  -0.068  12.807   1.293
  238    HB   VAL  27           HB       VAL  27  -2.429  12.265   1.525
  239   1HG1  VAL  27          1HG1      VAL  27  -1.950  14.385  -0.615
  240   2HG1  VAL  27          2HG1      VAL  27  -3.317  14.293   0.507
  241   3HG1  VAL  27          3HG1      VAL  27  -1.689  14.604   1.130
  242   1HG2  VAL  27          1HG2      VAL  27  -2.600  12.146  -1.515
  243   2HG2  VAL  27          2HG2      VAL  27  -2.760  10.743  -0.429
  244   3HG2  VAL  27          3HG2      VAL  27  -3.933  12.054  -0.346
  245    H    GLY  28           H        GLY  28  -0.119  11.141   2.796
  246   1HA   GLY  28          1HA       GLY  28   1.363   8.874   1.820
  247   2HA   GLY  28          2HA       GLY  28   1.033   9.314   3.497
  248    H    PHE  29           H        PHE  29  -1.108   8.358   0.740
  249    HA   PHE  29           HA       PHE  29  -2.621   6.592   2.538
  250   1HB   PHE  29          1HB       PHE  29  -3.606   8.228   0.857
  251   2HB   PHE  29          2HB       PHE  29  -3.084   7.135  -0.416
  252    HD1  PHE  29           1HD      PHE  29  -4.665   5.431  -1.086
  253    HD2  PHE  29           2HD      PHE  29  -5.003   7.254   2.806
  254    HE1  PHE  29           1HE      PHE  29  -6.947   4.498  -0.841
  255    HE2  PHE  29           2HE      PHE  29  -7.280   6.351   3.034
  256    HZ   PHE  29           HZ       PHE  29  -8.275   4.976   1.211
  257    H    ARG  30           H        ARG  30  -0.198   5.623   2.477
  258    HA   ARG  30           HA       ARG  30  -0.329   3.141   0.831
  259   1HB   ARG  30          1HB       ARG  30   2.230   4.677   1.382
  260   2HB   ARG  30          2HB       ARG  30   2.015   3.225   0.422
  261   1HG   ARG  30          1HG       ARG  30   1.919   4.607  -1.351
  262   2HG   ARG  30          2HG       ARG  30   0.267   4.876  -0.880
  263   1HD   ARG  30          1HD       ARG  30   0.924   7.063  -0.982
  264   2HD   ARG  30          2HD       ARG  30   1.440   6.791   0.677
  265    HE   ARG  30           HE       ARG  30   3.057   7.079  -1.776
  266   1HH1  ARG  30          1HH1      ARG  30   3.244   6.376   1.714
  267   2HH1  ARG  30          2HH1      ARG  30   4.988   6.295   1.696
  268   1HH2  ARG  30          1HH2      ARG  30   5.290   6.963  -1.749
  269   2HH2  ARG  30          2HH2      ARG  30   6.155   6.639  -0.270
  270    H    LYS  31           H        LYS  31   1.467   4.808   3.462
  271    HA   LYS  31           HA       LYS  31   2.044   2.834   5.195
  272   1HB   LYS  31          1HB       LYS  31   2.508   5.246   5.473
  273   2HB   LYS  31          2HB       LYS  31   0.829   5.508   5.917
  274   1HG   LYS  31          1HG       LYS  31   2.051   5.438   7.934
  275   2HG   LYS  31          2HG       LYS  31   1.167   3.909   7.876
  276   1HD   LYS  31          1HD       LYS  31   3.234   2.763   7.056
  277   2HD   LYS  31          2HD       LYS  31   4.107   4.302   7.118
  278   1HE   LYS  31          1HE       LYS  31   2.814   2.907   9.508
  279   2HE   LYS  31          2HE       LYS  31   4.529   2.805   9.071
  280   1HZ   LYS  31          1HZ       LYS  31   4.253   4.512  10.698
  281   2HZ   LYS  31          2HZ       LYS  31   3.154   5.335   9.718
  282    H    PHE  32           H        PHE  32  -1.065   4.629   5.144
  283    HA   PHE  32           HA       PHE  32  -2.410   3.387   7.164
  284   1HB   PHE  32          1HB       PHE  32  -3.115   5.384   5.930
  285   2HB   PHE  32          2HB       PHE  32  -3.582   4.398   4.553
  286    HD1  PHE  32           1HD      PHE  32  -4.552   2.732   7.666
  287    HD2  PHE  32           2HD      PHE  32  -5.656   5.877   4.910
  288    HE1  PHE  32           1HE      PHE  32  -6.785   2.768   8.611
  289    HE2  PHE  32           2HE      PHE  32  -7.884   5.987   5.971
  290    HZ   PHE  32           HZ       PHE  32  -8.472   4.432   7.822
  291    H    VAL  33           H        VAL  33  -2.594   2.430   3.676
  292    HA   VAL  33           HA       VAL  33  -4.227   0.126   4.240
  293    HB   VAL  33           HB       VAL  33  -4.368   1.288   2.107
  294   1HG1  VAL  33          1HG1      VAL  33  -1.530   0.318   1.624
  295   2HG1  VAL  33          2HG1      VAL  33  -2.617   0.934   0.365
  296   3HG1  VAL  33          3HG1      VAL  33  -2.126   1.992   1.689
  297   1HG2  VAL  33          1HG2      VAL  33  -3.406  -1.569   1.700
  298   2HG2  VAL  33          2HG2      VAL  33  -5.004  -1.096   2.323
  299   3HG2  VAL  33          3HG2      VAL  33  -4.521  -0.636   0.685
  300    H    GLN  34           H        GLN  34  -0.795   0.695   4.440
  301    HA   GLN  34           HA       GLN  34  -0.069  -2.113   4.441
  302   1HB   GLN  34          1HB       GLN  34   1.473  -0.428   3.782
  303   2HB   GLN  34          2HB       GLN  34   1.523   0.299   5.363
  304   1HG   GLN  34          1HG       GLN  34   2.200  -2.623   4.794
  305   2HG   GLN  34          2HG       GLN  34   3.398  -1.325   4.712
  306   1HE2  GLN  34          1HE2      GLN  34   1.395  -0.393   7.142
  307   2HE2  GLN  34          2HE2      GLN  34   2.116  -1.220   8.504
  308    H    ILE  35           H        ILE  35  -0.649   0.283   7.108
  309    HA   ILE  35           HA       ILE  35  -0.519  -1.468   9.220
  310    HB   ILE  35           HB       ILE  35  -2.551   0.750   8.854
  311   1HG1  ILE  35          1HG1      ILE  35  -0.226   1.564   8.723
  312   2HG1  ILE  35          2HG1      ILE  35  -1.081   2.141  10.145
  313   1HG2  ILE  35          1HG2      ILE  35  -2.601   0.760  11.376
  314   2HG2  ILE  35          2HG2      ILE  35  -3.397  -0.618  10.620
  315   3HG2  ILE  35          3HG2      ILE  35  -1.789  -0.820  11.335
  316   1HD1  ILE  35          1HD1      ILE  35   1.201   1.551  10.704
  317   2HD1  ILE  35          2HD1      ILE  35   0.100   0.453  11.544
  318   3HD1  ILE  35          3HD1      ILE  35   0.987  -0.097  10.101
  319    H    HIS  36           H        HIS  36  -3.484  -0.927   7.276
  320    HA   HIS  36           HA       HIS  36  -4.959  -2.891   8.796
  321   1HB   HIS  36          1HB       HIS  36  -5.462  -1.214   6.356
  322   2HB   HIS  36          2HB       HIS  36  -6.495  -2.601   6.698
  323    HD2  HIS  36           2HD      HIS  36  -5.137   0.380   9.020
  324    HE1  HIS  36           1HE      HIS  36  -9.142  -0.520  10.036
  325    HE2  HIS  36           2HE      HIS  36  -7.147   0.983  10.569
  326    H    ALA  37           H        ALA  37  -2.991  -3.047   5.913
  327    HA   ALA  37           HA       ALA  37  -3.765  -5.707   5.107
  328   1HB   ALA  37          1HB       ALA  37  -1.434  -5.722   4.022
  329   2HB   ALA  37          2HB       ALA  37  -2.427  -4.328   3.551
  330   3HB   ALA  37          3HB       ALA  37  -1.132  -4.157   4.745
  331    H    ILE  38           H        ILE  38  -0.812  -4.677   6.838
  332    HA   ILE  38           HA       ILE  38  -0.007  -7.045   7.890
  333    HB   ILE  38           HB       ILE  38   0.322  -4.189   8.635
  334   1HG1  ILE  38          1HG1      ILE  38   2.671  -4.768   8.294
  335   2HG1  ILE  38          2HG1      ILE  38   2.286  -6.485   8.192
  336   1HG2  ILE  38          1HG2      ILE  38   1.796  -4.699  10.517
  337   2HG2  ILE  38          2HG2      ILE  38   0.106  -5.034  10.881
  338   3HG2  ILE  38          3HG2      ILE  38   1.221  -6.379  10.522
  339   1HD1  ILE  38          1HD1      ILE  38   2.701  -5.421   5.972
  340   2HD1  ILE  38          2HD1      ILE  38   1.089  -6.136   6.065
  341   3HD1  ILE  38          3HD1      ILE  38   1.299  -4.381   6.213
  342    H    ARG  39           H        ARG  39  -2.578  -4.984   9.285
  343    HA   ARG  39           HA       ARG  39  -2.899  -6.582  11.699
  344   1HB   ARG  39          1HB       ARG  39  -4.805  -4.703  10.237
  345   2HB   ARG  39          2HB       ARG  39  -5.163  -5.424  11.801
  346   1HG   ARG  39          1HG       ARG  39  -2.564  -3.946  11.694
  347   2HG   ARG  39          2HG       ARG  39  -4.012  -2.964  11.432
  348   1HD   ARG  39          1HD       ARG  39  -3.424  -2.960  13.764
  349   2HD   ARG  39          2HD       ARG  39  -4.992  -3.762  13.528
  350    HE   ARG  39           HE       ARG  39  -3.102  -5.808  13.462
  351   1HH1  ARG  39          1HH1      ARG  39  -4.095  -3.367  15.837
  352   2HH1  ARG  39          2HH1      ARG  39  -3.635  -4.340  17.210
  353   1HH2  ARG  39          1HH2      ARG  39  -2.515  -7.074  15.260
  354   2HH2  ARG  39          2HH2      ARG  39  -2.734  -6.463  16.879
  355    H    LEU  40           H        LEU  40  -4.583  -6.572   8.548
  356    HA   LEU  40           HA       LEU  40  -6.144  -8.919   9.361
  357   1HB   LEU  40          1HB       LEU  40  -6.054  -7.355   6.782
  358   2HB   LEU  40          2HB       LEU  40  -7.242  -8.596   7.201
  359    HG   LEU  40           HG       LEU  40  -6.839  -5.995   8.777
  360   1HD1  LEU  40          1HD1      LEU  40  -8.973  -5.341   7.762
  361   2HD1  LEU  40          2HD1      LEU  40  -7.693  -5.572   6.551
  362   3HD1  LEU  40          3HD1      LEU  40  -8.941  -6.824   6.767
  363   1HD2  LEU  40          1HD2      LEU  40  -9.016  -6.604   9.805
  364   2HD2  LEU  40          2HD2      LEU  40  -8.928  -8.195   9.018
  365   3HD2  LEU  40          3HD2      LEU  40  -7.733  -7.723  10.249
  366    H    GLY  41           H        GLY  41  -3.018  -8.935   8.727
  367   1HA   GLY  41          1HA       GLY  41  -1.555 -10.500   7.996
  368   2HA   GLY  41          2HA       GLY  41  -2.895 -11.658   8.053
  369    H    ILE  42           H        ILE  42  -1.954  -8.828   6.042
  370    HA   ILE  42           HA       ILE  42  -2.524 -10.372   3.553
  371    HB   ILE  42           HB       ILE  42  -2.787  -7.453   4.218
  372   1HG1  ILE  42          1HG1      ILE  42  -4.630  -8.724   5.145
  373   2HG1  ILE  42          2HG1      ILE  42  -5.155  -7.661   3.836
  374   1HG2  ILE  42          1HG2      ILE  42  -3.783  -7.137   1.988
  375   2HG2  ILE  42          2HG2      ILE  42  -2.059  -7.488   1.973
  376   3HG2  ILE  42          3HG2      ILE  42  -3.219  -8.767   1.556
  377   1HD1  ILE  42          1HD1      ILE  42  -6.295  -9.801   3.694
  378   2HD1  ILE  42          2HD1      ILE  42  -5.237  -9.583   2.291
  379   3HD1  ILE  42          3HD1      ILE  42  -4.758 -10.672   3.622
  380    H    LYS  43           H        LYS  43  -1.062 -10.359   2.009
  381    HA   LYS  43           HA       LYS  43   1.508  -8.885   2.371
  382   1HB   LYS  43          1HB       LYS  43   1.126 -11.286   0.594
  383   2HB   LYS  43          2HB       LYS  43   2.609 -10.545   1.198
  384   1HG   LYS  43          1HG       LYS  43   1.813 -11.139   3.561
  385   2HG   LYS  43          2HG       LYS  43   0.561 -12.138   2.795
  386   1HD   LYS  43          1HD       LYS  43   2.407 -13.367   1.569
  387   2HD   LYS  43          2HD       LYS  43   3.574 -12.475   2.571
  388   1HE   LYS  43          1HE       LYS  43   1.394 -14.324   3.631
  389   2HE   LYS  43          2HE       LYS  43   3.118 -14.715   3.487
  390   1HZ   LYS  43          1HZ       LYS  43   1.949 -12.631   5.213
  391   2HZ   LYS  43          2HZ       LYS  43   3.598 -12.957   5.046
  392    H    GLY  44           H        GLY  44   2.481  -8.209   0.153
  393   1HA   GLY  44          1HA       GLY  44   1.462  -7.957  -2.284
  394   2HA   GLY  44          2HA       GLY  44   0.285  -6.977  -1.429
  395    H    TYR  45           H        TYR  45   0.679  -4.924  -2.001
  396    HA   TYR  45           HA       TYR  45   2.959  -3.601  -1.018
  397   1HB   TYR  45          1HB       TYR  45   3.296  -4.724  -3.658
  398   2HB   TYR  45          2HB       TYR  45   3.274  -2.986  -3.809
  399    HD1  TYR  45           1HD      TYR  45   4.772  -1.640  -2.080
  400    HD2  TYR  45           2HD      TYR  45   5.431  -5.633  -3.534
  401    HE1  TYR  45           1HE      TYR  45   7.223  -1.358  -1.765
  402    HE2  TYR  45           2HE      TYR  45   7.877  -5.305  -3.328
  403    HH   TYR  45           HH       TYR  45   9.553  -3.984  -2.416
  404    H    ALA  46           H        ALA  46   2.670  -1.384  -0.991
  405    HA   ALA  46           HA       ALA  46   0.371  -0.168  -2.433
  406   1HB   ALA  46          1HB       ALA  46   0.902   1.811  -1.022
  407   2HB   ALA  46          2HB       ALA  46   0.413   0.383  -0.111
  408   3HB   ALA  46          3HB       ALA  46   2.122   0.845  -0.171
  409    H    LYS  47           H        LYS  47   1.329  -0.244  -4.551
  410    HA   LYS  47           HA       LYS  47   4.008   0.898  -4.880
  411   1HB   LYS  47          1HB       LYS  47   3.552  -1.269  -5.785
  412   2HB   LYS  47          2HB       LYS  47   2.164  -0.639  -6.678
  413   1HG   LYS  47          1HG       LYS  47   3.611   0.606  -8.183
  414   2HG   LYS  47          2HG       LYS  47   4.976   0.447  -7.078
  415   1HD   LYS  47          1HD       LYS  47   5.432  -0.988  -8.864
  416   2HD   LYS  47          2HD       LYS  47   4.985  -2.051  -7.531
  417   1HE   LYS  47          1HE       LYS  47   3.015  -1.167  -9.690
  418   2HE   LYS  47          2HE       LYS  47   4.066  -2.579  -9.876
  419   1HZ   LYS  47          1HZ       LYS  47   1.991  -3.302  -8.999
  420   2HZ   LYS  47          2HZ       LYS  47   2.141  -2.286  -7.662
  421    H    ASN  48           H        ASN  48   3.563   3.070  -4.470
  422    HA   ASN  48           HA       ASN  48   1.757   4.560  -6.149
  423   1HB   ASN  48          1HB       ASN  48   2.399   6.358  -4.675
  424   2HB   ASN  48          2HB       ASN  48   1.761   4.986  -3.789
  425   1HD2  ASN  48          2HD2      ASN  48   3.442   3.517  -2.702
  426   2HD2  ASN  48          1HD2      ASN  48   4.874   4.311  -2.086
  427    H    LEU  49           H        LEU  49   2.797   4.125  -8.147
  428    HA   LEU  49           HA       LEU  49   5.441   4.717  -8.876
  429   1HB   LEU  49          1HB       LEU  49   2.884   4.920 -10.478
  430   2HB   LEU  49          2HB       LEU  49   4.509   4.814 -11.162
  431    HG   LEU  49           HG       LEU  49   3.328   2.655  -9.352
  432   1HD1  LEU  49          1HD1      LEU  49   2.648   1.460 -11.249
  433   2HD1  LEU  49          2HD1      LEU  49   1.882   3.044 -11.343
  434   3HD1  LEU  49          3HD1      LEU  49   3.283   2.681 -12.381
  435   1HD2  LEU  49          1HD2      LEU  49   5.000   1.209 -10.433
  436   2HD2  LEU  49          2HD2      LEU  49   5.609   2.588 -11.371
  437   3HD2  LEU  49          3HD2      LEU  49   5.789   2.559  -9.603
  438    HA   PRO  50           HA       PRO  50   4.575   8.990  -7.864
  439   1HB   PRO  50          1HB       PRO  50   7.050  10.018  -7.568
  440   2HB   PRO  50          2HB       PRO  50   6.454   8.668  -6.568
  441   1HG   PRO  50          1HG       PRO  50   8.112   8.427  -9.103
  442   2HG   PRO  50          2HG       PRO  50   8.502   7.758  -7.488
  443   1HD   PRO  50          1HD       PRO  50   7.210   6.256  -9.372
  444   2HD   PRO  50          2HD       PRO  50   6.776   6.147  -7.642
  445    H    ASP  51           H        ASP  51   4.040   8.469 -10.555
  446    HA   ASP  51           HA       ASP  51   4.110  11.189 -11.474
  447   1HB   ASP  51          1HB       ASP  51   6.207  10.218 -12.511
  448   2HB   ASP  51          2HB       ASP  51   5.204   9.007 -13.318
  449    HD2  ASP  51           HD       ASP  51   4.861  12.921 -14.454
  450    H    GLY  52           H        GLY  52   2.109   9.693 -10.305
  451   1HA   GLY  52          1HA       GLY  52  -0.053   9.802 -12.055
  452   2HA   GLY  52          2HA       GLY  52   0.546   8.127 -12.070
  453    H    SER  53           H        SER  53  -0.902   7.073 -10.847
  454    HA   SER  53           HA       SER  53  -1.626   8.067  -8.119
  455   1HB   SER  53          1HB       SER  53  -3.398   6.355  -9.870
  456   2HB   SER  53          2HB       SER  53  -3.785   7.280  -8.400
  457    HG   SER  53           HG       SER  53  -3.417   9.183  -9.550
  458    H    VAL  54           H        VAL  54  -2.501   6.109  -6.747
  459    HA   VAL  54           HA       VAL  54  -0.266   4.202  -6.740
  460    HB   VAL  54           HB       VAL  54  -0.643   5.470  -4.732
  461   1HG1  VAL  54          1HG1      VAL  54  -3.195   3.885  -4.243
  462   2HG1  VAL  54          2HG1      VAL  54  -2.504   5.186  -3.264
  463   3HG1  VAL  54          3HG1      VAL  54  -3.190   5.550  -4.854
  464   1HG2  VAL  54          1HG2      VAL  54  -1.234   2.506  -4.293
  465   2HG2  VAL  54          2HG2      VAL  54   0.363   3.181  -4.626
  466   3HG2  VAL  54          3HG2      VAL  54  -0.491   3.628  -3.142
  467    H    GLU  55           H        GLU  55  -0.381   2.290  -7.555
  468    HA   GLU  55           HA       GLU  55  -2.934   0.800  -7.614
  469   1HB   GLU  55          1HB       GLU  55  -1.573  -0.915  -8.780
  470   2HB   GLU  55          2HB       GLU  55  -1.977   0.577  -9.617
  471   1HG   GLU  55          1HG       GLU  55   0.347   1.428  -9.187
  472   2HG   GLU  55          2HG       GLU  55   0.746  -0.151  -8.484
  473    HE2  GLU  55           HE       GLU  55   0.749  -1.769 -11.611
  474    H    VAL  56           H        VAL  56  -3.442  -0.118  -5.737
  475    HA   VAL  56           HA       VAL  56  -1.397  -1.270  -3.941
  476    HB   VAL  56           HB       VAL  56  -4.420  -1.014  -3.739
  477   1HG1  VAL  56          1HG1      VAL  56  -2.379  -2.196  -1.829
  478   2HG1  VAL  56          2HG1      VAL  56  -4.029  -1.739  -1.350
  479   3HG1  VAL  56          3HG1      VAL  56  -3.783  -3.018  -2.538
  480   1HG2  VAL  56          1HG2      VAL  56  -2.148   0.413  -2.286
  481   2HG2  VAL  56          2HG2      VAL  56  -3.254   1.138  -3.475
  482   3HG2  VAL  56          3HG2      VAL  56  -3.877   0.582  -1.917
  483    H    VAL  57           H        VAL  57  -1.089  -3.446  -3.763
  484    HA   VAL  57           HA       VAL  57  -2.996  -5.312  -5.045
  485    HB   VAL  57           HB       VAL  57  -0.994  -5.270  -6.439
  486   1HG1  VAL  57          1HG1      VAL  57   0.597  -6.220  -4.029
  487   2HG1  VAL  57          2HG1      VAL  57   1.175  -6.005  -5.688
  488   3HG1  VAL  57          3HG1      VAL  57   0.702  -4.591  -4.743
  489   1HG2  VAL  57          1HG2      VAL  57  -1.169  -7.845  -4.817
  490   2HG2  VAL  57          2HG2      VAL  57  -2.259  -7.378  -6.144
  491   3HG2  VAL  57          3HG2      VAL  57  -0.539  -7.659  -6.465
  492    H    ALA  58           H        ALA  58  -3.676  -6.893  -3.634
  493    HA   ALA  58           HA       ALA  58  -2.505  -7.011  -0.899
  494   1HB   ALA  58          1HB       ALA  58  -4.766  -6.577   0.022
  495   2HB   ALA  58          2HB       ALA  58  -4.109  -5.159  -0.830
  496   3HB   ALA  58          3HB       ALA  58  -5.344  -6.182  -1.599
  497    H    GLU  59           H        GLU  59  -2.332  -9.119  -0.480
  498    HA   GLU  59           HA       GLU  59  -4.012 -11.040  -1.918
  499   1HB   GLU  59          1HB       GLU  59  -1.391 -11.498  -0.485
  500   2HB   GLU  59          2HB       GLU  59  -2.306 -12.651  -1.482
  501   1HG   GLU  59          1HG       GLU  59  -2.186 -10.829  -3.330
  502   2HG   GLU  59          2HG       GLU  59  -0.938 -10.084  -2.345
  503    HE2  GLU  59           HE       GLU  59   0.933 -13.335  -2.847
  504    H    GLY  60           H        GLY  60  -5.798 -11.779  -0.798
  505   1HA   GLY  60          1HA       GLY  60  -5.424 -12.900   1.888
  506   2HA   GLY  60          2HA       GLY  60  -6.517 -11.504   1.782
  507    H    TYR  61           H        TYR  61  -7.157 -14.202   2.541
  508    HA   TYR  61           HA       TYR  61  -8.742 -15.635   0.810
  509   1HB   TYR  61          1HB       TYR  61  -9.082 -14.802   3.696
  510   2HB   TYR  61          2HB       TYR  61 -10.101 -16.017   2.929
  511    HD1  TYR  61           1HD      TYR  61  -9.150 -18.208   2.231
  512    HD2  TYR  61           2HD      TYR  61  -6.815 -15.304   4.405
  513    HE1  TYR  61           1HE      TYR  61  -7.496 -19.960   2.804
  514    HE2  TYR  61           2HE      TYR  61  -5.184 -17.062   5.001
  515    HH   TYR  61           HH       TYR  61  -4.588 -19.277   4.781
  516    H    GLU  62           H        GLU  62 -11.269 -15.561   0.838
  517    HA   GLU  62           HA       GLU  62 -12.125 -12.882  -0.045
  518   1HB   GLU  62          1HB       GLU  62 -13.762 -15.420   0.275
  519   2HB   GLU  62          2HB       GLU  62 -14.221 -13.922  -0.569
  520   1HG   GLU  62          1HG       GLU  62 -12.327 -14.302  -2.175
  521   2HG   GLU  62          2HG       GLU  62 -11.993 -15.857  -1.398
  522    HE2  GLU  62           HE       GLU  62 -15.220 -15.418  -3.812
  523    H    GLU  63           H        GLU  63 -12.978 -15.194   2.569
  524    HA   GLU  63           HA       GLU  63 -14.770 -13.846   4.047
  525   1HB   GLU  63          1HB       GLU  63 -12.345 -15.427   4.932
  526   2HB   GLU  63          2HB       GLU  63 -13.641 -14.899   6.019
  527   1HG   GLU  63          1HG       GLU  63 -15.312 -16.110   4.685
  528   2HG   GLU  63          2HG       GLU  63 -14.063 -16.648   3.551
  529    HE2  GLU  63           HE       GLU  63 -12.660 -18.986   5.788
  530    H    ALA  64           H        ALA  64 -11.229 -13.231   4.016
  531    HA   ALA  64           HA       ALA  64 -11.469 -10.897   5.838
  532   1HB   ALA  64          1HB       ALA  64  -9.031 -11.065   5.921
  533   2HB   ALA  64          2HB       ALA  64  -9.760 -12.642   6.274
  534   3HB   ALA  64          3HB       ALA  64  -9.048 -12.331   4.675
  535    H    LEU  65           H        LEU  65 -11.863 -11.295   2.486
  536    HA   LEU  65           HA       LEU  65 -10.057  -9.208   1.628
  537   1HB   LEU  65          1HB       LEU  65 -10.885 -10.887   0.052
  538   2HB   LEU  65          2HB       LEU  65 -12.539 -10.266   0.259
  539    HG   LEU  65           HG       LEU  65 -11.789  -8.072  -0.584
  540   1HD1  LEU  65          1HD1      LEU  65  -9.568  -7.969  -1.783
  541   2HD1  LEU  65          2HD1      LEU  65  -9.338  -8.101  -0.050
  542   3HD1  LEU  65          3HD1      LEU  65  -9.130  -9.533  -1.083
  543   1HD2  LEU  65          1HD2      LEU  65 -11.512  -8.791  -2.918
  544   2HD2  LEU  65          2HD2      LEU  65 -11.136 -10.427  -2.323
  545   3HD2  LEU  65          3HD2      LEU  65 -12.756  -9.743  -2.061
  546    H    SER  66           H        SER  66 -13.615  -9.293   1.899
  547    HA   SER  66           HA       SER  66 -14.362  -6.694   1.743
  548   1HB   SER  66          1HB       SER  66 -16.185  -7.280   3.358
  549   2HB   SER  66          2HB       SER  66 -15.948  -8.488   2.080
  550    HG   SER  66           HG       SER  66 -14.771  -9.743   3.569
  551    H    LYS  67           H        LYS  67 -13.146  -8.191   4.759
  552    HA   LYS  67           HA       LYS  67 -13.327  -6.045   6.495
  553   1HB   LYS  67          1HB       LYS  67 -11.494  -8.435   6.331
  554   2HB   LYS  67          2HB       LYS  67 -11.223  -7.201   7.562
  555   1HG   LYS  67          1HG       LYS  67 -12.585  -8.980   8.459
  556   2HG   LYS  67          2HG       LYS  67 -13.482  -7.456   8.440
  557   1HD   LYS  67          1HD       LYS  67 -14.783  -8.170   6.505
  558   2HD   LYS  67          2HD       LYS  67 -13.725  -9.577   6.278
  559   1HE   LYS  67          1HE       LYS  67 -15.810 -10.298   7.268
  560   2HE   LYS  67          2HE       LYS  67 -14.517 -10.488   8.468
  561   1HZ   LYS  67          1HZ       LYS  67 -16.409  -9.432   9.479
  562   2HZ   LYS  67          2HZ       LYS  67 -16.338  -8.163   8.368
  563    H    LEU  68           H        LEU  68 -10.667  -6.667   4.156
  564    HA   LEU  68           HA       LEU  68  -9.191  -4.259   4.937
  565   1HB   LEU  68          1HB       LEU  68  -7.880  -6.006   4.024
  566   2HB   LEU  68          2HB       LEU  68  -8.983  -6.256   2.669
  567    HG   LEU  68           HG       LEU  68  -8.351  -4.147   1.643
  568   1HD1  LEU  68          1HD1      LEU  68  -6.451  -2.835   2.494
  569   2HD1  LEU  68          2HD1      LEU  68  -7.815  -2.734   3.602
  570   3HD1  LEU  68          3HD1      LEU  68  -6.442  -3.792   3.991
  571   1HD2  LEU  68          1HD2      LEU  68  -6.061  -4.696   1.054
  572   2HD2  LEU  68          2HD2      LEU  68  -5.913  -5.748   2.477
  573   3HD2  LEU  68          3HD2      LEU  68  -7.038  -6.176   1.166
  574    H    LEU  69           H        LEU  69 -11.118  -5.255   2.075
  575    HA   LEU  69           HA       LEU  69 -10.927  -3.000   0.683
  576   1HB   LEU  69          1HB       LEU  69 -12.916  -5.164   0.812
  577   2HB   LEU  69          2HB       LEU  69 -13.551  -3.721   0.059
  578    HG   LEU  69           HG       LEU  69 -12.565  -5.358  -1.514
  579   1HD1  LEU  69          1HD1      LEU  69 -11.307  -3.773  -2.896
  580   2HD1  LEU  69          2HD1      LEU  69 -12.739  -3.010  -2.189
  581   3HD1  LEU  69          3HD1      LEU  69 -11.131  -2.663  -1.525
  582   1HD2  LEU  69          1HD2      LEU  69 -10.241  -5.739  -1.712
  583   2HD2  LEU  69          2HD2      LEU  69  -9.818  -4.553  -0.473
  584   3HD2  LEU  69          3HD2      LEU  69 -10.648  -6.055  -0.017
  585    H    GLU  70           H        GLU  70 -13.601  -3.573   2.997
  586    HA   GLU  70           HA       GLU  70 -15.009  -1.201   2.686
  587   1HB   GLU  70          1HB       GLU  70 -16.139  -1.755   4.701
  588   2HB   GLU  70          2HB       GLU  70 -15.785  -3.244   3.818
  589   1HG   GLU  70          1HG       GLU  70 -13.731  -3.489   5.372
  590   2HG   GLU  70          2HG       GLU  70 -14.423  -2.177   6.329
  591    HE2  GLU  70           HE       GLU  70 -16.595  -4.281   7.976
  592    H    ARG  71           H        ARG  71 -12.316  -1.890   4.935
  593    HA   ARG  71           HA       ARG  71 -11.951   0.490   6.343
  594   1HB   ARG  71          1HB       ARG  71 -10.379  -0.827   7.041
  595   2HB   ARG  71          2HB       ARG  71 -10.376  -1.809   5.618
  596   1HG   ARG  71          1HG       ARG  71  -8.199  -0.948   5.872
  597   2HG   ARG  71          2HG       ARG  71  -8.850  -0.127   4.496
  598   1HD   ARG  71          1HD       ARG  71  -9.508   1.338   6.952
  599   2HD   ARG  71          2HD       ARG  71  -7.802   0.990   6.898
  600    HE   ARG  71           HE       ARG  71  -9.187   2.985   5.460
  601   1HH1  ARG  71          1HH1      ARG  71  -6.657   0.585   4.756
  602   2HH1  ARG  71          2HH1      ARG  71  -5.938   1.573   3.504
  603   1HH2  ARG  71          1HH2      ARG  71  -8.173   4.256   3.884
  604   2HH2  ARG  71          2HH2      ARG  71  -6.768   3.655   3.036
  605    H    ILE  72           H        ILE  72 -10.632  -0.206   3.110
  606    HA   ILE  72           HA       ILE  72  -9.431   2.235   2.767
  607    HB   ILE  72           HB       ILE  72 -10.428   0.534   0.515
  608   1HG1  ILE  72          1HG1      ILE  72  -7.605   0.564   1.669
  609   2HG1  ILE  72          2HG1      ILE  72  -8.814  -0.480   2.397
  610   1HG2  ILE  72          1HG2      ILE  72  -8.520   1.620  -0.694
  611   2HG2  ILE  72          2HG2      ILE  72  -9.705   2.826  -0.184
  612   3HG2  ILE  72          3HG2      ILE  72  -8.199   2.613   0.732
  613   1HD1  ILE  72          1HD1      ILE  72  -7.676  -1.769   0.737
  614   2HD1  ILE  72          2HD1      ILE  72  -9.351  -1.504   0.234
  615   3HD1  ILE  72          3HD1      ILE  72  -8.047  -0.574  -0.526
  616    H    LYS  73           H        LYS  73 -12.394   1.436   0.860
  617    HA   LYS  73           HA       LYS  73 -13.057   3.939   0.064
  618   1HB   LYS  73          1HB       LYS  73 -15.353   3.072  -0.211
  619   2HB   LYS  73          2HB       LYS  73 -14.021   2.138  -0.876
  620   1HG   LYS  73          1HG       LYS  73 -14.228   0.690   1.345
  621   2HG   LYS  73          2HG       LYS  73 -15.806   1.473   1.460
  622   1HD   LYS  73          1HD       LYS  73 -16.167  -0.551   0.305
  623   2HD   LYS  73          2HD       LYS  73 -16.180   0.705  -0.952
  624   1HE   LYS  73          1HE       LYS  73 -13.693   0.040  -1.397
  625   2HE   LYS  73          2HE       LYS  73 -13.975  -1.311  -0.306
  626   1HZ   LYS  73          1HZ       LYS  73 -14.437  -1.991  -2.539
  627   2HZ   LYS  73          2HZ       LYS  73 -15.618  -0.798  -2.696
  628    H    GLN  74           H        GLN  74 -14.052   2.427   3.165
  629    HA   GLN  74           HA       GLN  74 -15.738   4.544   4.073
  630   1HB   GLN  74          1HB       GLN  74 -15.743   2.225   4.935
  631   2HB   GLN  74          2HB       GLN  74 -14.173   2.522   5.720
  632   1HG   GLN  74          1HG       GLN  74 -15.224   4.331   7.077
  633   2HG   GLN  74          2HG       GLN  74 -16.780   3.996   6.302
  634   1HE2  GLN  74          1HE2      GLN  74 -17.315   1.453   6.375
  635   2HE2  GLN  74          2HE2      GLN  74 -17.108   0.733   7.958
  636    H    GLY  75           H        GLY  75 -12.233   3.968   4.386
  637   1HA   GLY  75          1HA       GLY  75 -11.832   6.540   5.878
  638   2HA   GLY  75          2HA       GLY  75 -10.799   5.119   5.909
  639    HA   PRO  76           HA       PRO  76 -10.298   6.867   1.442
  640   1HB   PRO  76          1HB       PRO  76 -11.221   9.428   0.874
  641   2HB   PRO  76          2HB       PRO  76 -12.240   7.962   0.798
  642   1HG   PRO  76          1HG       PRO  76 -11.920   9.911   3.101
  643   2HG   PRO  76          2HG       PRO  76 -13.445   9.371   2.331
  644   1HD   PRO  76          1HD       PRO  76 -12.561   8.195   4.576
  645   2HD   PRO  76          2HD       PRO  76 -13.232   7.204   3.242
  646    HA   PRO  77           HA       PRO  77  -6.613   9.233   2.269
  647   1HB   PRO  77          1HB       PRO  77  -5.899  10.307  -0.152
  648   2HB   PRO  77          2HB       PRO  77  -5.914   8.553   0.123
  649   1HG   PRO  77          1HG       PRO  77  -8.103  10.205  -1.118
  650   2HG   PRO  77          2HG       PRO  77  -7.347   8.703  -1.754
  651   1HD   PRO  77          1HD       PRO  77  -9.668   8.612  -0.410
  652   2HD   PRO  77          2HD       PRO  77  -8.433   7.362  -0.160
  653    H    ALA  78           H        ALA  78  -5.604  11.427   2.159
  654    HA   ALA  78           HA       ALA  78  -7.567  13.583   2.531
  655   1HB   ALA  78          1HB       ALA  78  -5.650  14.834   3.390
  656   2HB   ALA  78          2HB       ALA  78  -5.754  13.246   4.168
  657   3HB   ALA  78          3HB       ALA  78  -4.548  13.529   2.894
  658    H    ALA  79           H        ALA  79  -7.116  12.418  -0.206
  659    HA   ALA  79           HA       ALA  79  -6.371  14.926  -1.614
  660   1HB   ALA  79          1HB       ALA  79  -5.574  13.468  -3.468
  661   2HB   ALA  79          2HB       ALA  79  -4.556  13.450  -2.024
  662   3HB   ALA  79          3HB       ALA  79  -5.670  12.091  -2.349
  663    H    GLU  80           H        GLU  80  -7.374  14.923  -3.795
  664    HA   GLU  80           HA       GLU  80 -10.179  14.136  -3.754
  665   1HB   GLU  80          1HB       GLU  80 -10.242  15.173  -5.994
  666   2HB   GLU  80          2HB       GLU  80  -9.714  16.234  -4.687
  667   1HG   GLU  80          1HG       GLU  80  -7.354  16.018  -5.408
  668   2HG   GLU  80          2HG       GLU  80  -7.844  14.962  -6.741
  669    HE2  GLU  80           HE       GLU  80  -9.517  17.649  -8.439
  670    H    VAL  81           H        VAL  81  -9.945  11.875  -3.474
  671    HA   VAL  81           HA       VAL  81  -8.678  10.192  -5.387
  672    HB   VAL  81           HB       VAL  81  -9.117   9.505  -3.152
  673   1HG1  VAL  81          1HG1      VAL  81 -12.107   9.357  -3.696
  674   2HG1  VAL  81          2HG1      VAL  81 -11.250   8.859  -2.244
  675   3HG1  VAL  81          3HG1      VAL  81 -11.309  10.570  -2.675
  676   1HG2  VAL  81          1HG2      VAL  81 -10.697   7.753  -5.085
  677   2HG2  VAL  81          2HG2      VAL  81  -8.928   7.819  -4.977
  678   3HG2  VAL  81          3HG2      VAL  81  -9.877   7.233  -3.598
  679    H    GLU  82           H        GLU  82  -9.145  10.663  -7.401
  680    HA   GLU  82           HA       GLU  82 -11.391  11.355  -8.696
  681   1HB   GLU  82          1HB       GLU  82  -9.137  11.220  -9.583
  682   2HB   GLU  82          2HB       GLU  82  -9.250   9.466  -9.680
  683   1HG   GLU  82          1HG       GLU  82 -11.154   9.718 -11.304
  684   2HG   GLU  82          2HG       GLU  82 -10.969  11.477 -11.201
  685    HE2  GLU  82           HE       GLU  82  -7.773  11.385 -12.865
  686    H    LYS  83           H        LYS  83 -10.334   7.932  -8.292
  687    HA   LYS  83           HA       LYS  83 -12.780   6.923  -7.415
  688   1HB   LYS  83          1HB       LYS  83 -13.537   5.551  -9.339
  689   2HB   LYS  83          2HB       LYS  83 -13.785   7.270  -9.581
  690   1HG   LYS  83          1HG       LYS  83 -11.644   7.308 -10.970
  691   2HG   LYS  83          2HG       LYS  83 -11.558   5.549 -10.767
  692   1HD   LYS  83          1HD       LYS  83 -12.486   5.934 -12.884
  693   2HD   LYS  83          2HD       LYS  83 -13.798   5.338 -11.852
  694   1HE   LYS  83          1HE       LYS  83 -14.642   7.675 -11.602
  695   2HE   LYS  83          2HE       LYS  83 -13.268   8.273 -12.554
  696   1HZ   LYS  83          1HZ       LYS  83 -15.166   8.007 -13.968
  697   2HZ   LYS  83          2HZ       LYS  83 -15.277   6.369 -13.575
  698    H    VAL  84           H        VAL  84 -12.367   4.952  -6.449
  699    HA   VAL  84           HA       VAL  84  -9.887   3.527  -7.175
  700    HB   VAL  84           HB       VAL  84 -10.164   3.766  -4.912
  701   1HG1  VAL  84          1HG1      VAL  84 -12.845   2.340  -5.027
  702   2HG1  VAL  84          2HG1      VAL  84 -11.962   2.854  -3.578
  703   3HG1  VAL  84          3HG1      VAL  84 -12.598   4.070  -4.692
  704   1HG2  VAL  84          1HG2      VAL  84 -10.824   0.878  -5.618
  705   2HG2  VAL  84          2HG2      VAL  84  -9.227   1.634  -5.780
  706   3HG2  VAL  84          3HG2      VAL  84  -9.974   1.459  -4.178
  707    H    ASP  85           H        ASP  85 -10.217   2.850  -9.224
  708    HA   ASP  85           HA       ASP  85 -12.572   1.203  -9.906
  709   1HB   ASP  85          1HB       ASP  85 -11.791   2.951 -11.446
  710   2HB   ASP  85          2HB       ASP  85 -10.211   2.163 -11.556
  711    HD2  ASP  85           HD       ASP  85 -11.291  -0.043 -13.992
  712    H    TYR  86           H        TYR  86 -11.952  -0.453  -8.278
  713    HA   TYR  86           HA       TYR  86  -9.378  -1.692  -8.526
  714   1HB   TYR  86          1HB       TYR  86  -9.873  -2.897  -6.625
  715   2HB   TYR  86          2HB       TYR  86 -10.787  -1.423  -6.380
  716    HD1  TYR  86           1HD      TYR  86 -10.858  -5.032  -6.528
  717    HD2  TYR  86           2HD      TYR  86 -13.358  -1.545  -7.008
  718    HE1  TYR  86           1HE      TYR  86 -12.860  -6.404  -6.087
  719    HE2  TYR  86           2HE      TYR  86 -15.362  -2.930  -6.575
  720    HH   TYR  86           HH       TYR  86 -16.167  -5.029  -6.069
  721    H    SER  87           H        SER  87  -9.215  -4.122  -8.499
  722    HA   SER  87           HA       SER  87 -11.026  -5.513 -10.363
  723   1HB   SER  87          1HB       SER  87  -8.004  -5.396 -10.748
  724   2HB   SER  87          2HB       SER  87  -9.171  -6.295 -11.734
  725    HG   SER  87           HG       SER  87 -10.156  -4.168 -12.126
  726    H    PHE  88           H        PHE  88 -11.496  -7.421  -9.549
  727    HA   PHE  88           HA       PHE  88  -9.919  -8.764  -7.451
  728   1HB   PHE  88          1HB       PHE  88 -12.149  -9.119  -7.067
  729   2HB   PHE  88          2HB       PHE  88 -12.590  -9.033  -8.758
  730    HD1  PHE  88           1HD      PHE  88 -12.573 -10.989 -10.205
  731    HD2  PHE  88           2HD      PHE  88 -11.368 -11.271  -6.085
  732    HE1  PHE  88           1HE      PHE  88 -12.662 -13.463 -10.354
  733    HE2  PHE  88           2HE      PHE  88 -11.460 -13.759  -6.235
  734    HZ   PHE  88           HZ       PHE  88 -12.089 -14.849  -8.371
  735    H    SER  89           H        SER  89  -8.297 -10.180  -7.949
  736    HA   SER  89           HA       SER  89  -8.182 -11.415 -10.657
  737   1HB   SER  89          1HB       SER  89  -5.837 -10.182  -9.199
  738   2HB   SER  89          2HB       SER  89  -5.864 -10.867 -10.837
  739    HG   SER  89           HG       SER  89  -7.537  -9.206 -11.237
  740    H    GLU  90           H        GLU  90  -5.755 -12.805 -10.213
  741    HA   GLU  90           HA       GLU  90  -6.223 -14.484  -7.822
  742   1HB   GLU  90          1HB       GLU  90  -5.806 -16.481  -9.033
  743   2HB   GLU  90          2HB       GLU  90  -7.189 -15.651  -9.749
  744   1HG   GLU  90          1HG       GLU  90  -4.344 -15.689 -10.883
  745   2HG   GLU  90          2HG       GLU  90  -5.689 -16.692 -11.408
  746    HE2  GLU  90           HE       GLU  90  -5.381 -12.965 -12.799
  747    H    TYR  91           H        TYR  91  -4.405 -14.950  -6.672
  748    HA   TYR  91           HA       TYR  91  -2.298 -13.270  -6.893
  749   1HB   TYR  91          1HB       TYR  91  -1.339 -14.339  -5.107
  750   2HB   TYR  91          2HB       TYR  91  -3.067 -14.524  -4.901
  751    HD1  TYR  91           1HD      TYR  91  -4.076 -16.854  -5.806
  752    HD2  TYR  91           2HD      TYR  91   0.077 -16.175  -4.836
  753    HE1  TYR  91           1HE      TYR  91  -3.728 -19.285  -5.567
  754    HE2  TYR  91           2HE      TYR  91   0.407 -18.607  -4.565
  755    HH   TYR  91           HH       TYR  91  -0.567 -20.698  -4.653
  756    H    LYS  92           H        LYS  92  -0.295 -13.211  -7.762
  757    HA   LYS  92           HA       LYS  92   0.413 -15.162  -9.817
  758   1HB   LYS  92          1HB       LYS  92   0.778 -12.800 -10.242
  759   2HB   LYS  92          2HB       LYS  92   1.768 -12.643  -8.784
  760   1HG   LYS  92          1HG       LYS  92   3.159 -12.722 -10.784
  761   2HG   LYS  92          2HG       LYS  92   3.495 -14.112  -9.748
  762   1HD   LYS  92          1HD       LYS  92   2.119 -15.561 -11.214
  763   2HD   LYS  92          2HD       LYS  92   1.686 -14.154 -12.212
  764   1HE   LYS  92          1HE       LYS  92   4.083 -13.862 -12.806
  765   2HE   LYS  92          2HE       LYS  92   4.507 -15.248 -11.775
  766   1HZ   LYS  92          1HZ       LYS  92   4.270 -15.985 -14.030
  767   2HZ   LYS  92          2HZ       LYS  92   2.678 -15.426 -14.084
  768    H    GLY  93           H        GLY  93   1.662 -14.031  -6.622
  769   1HA   GLY  93          1HA       GLY  93   2.794 -16.600  -5.978
  770   2HA   GLY  93          2HA       GLY  93   4.021 -15.404  -6.448
  771    H    GLU  94           H        GLU  94   4.540 -16.019  -4.117
  772    HA   GLU  94           HA       GLU  94   2.950 -14.701  -2.024
  773   1HB   GLU  94          1HB       GLU  94   4.629 -15.665  -0.512
  774   2HB   GLU  94          2HB       GLU  94   3.624 -16.812  -1.400
  775   1HG   GLU  94          1HG       GLU  94   5.411 -17.434  -2.874
  776   2HG   GLU  94          2HG       GLU  94   6.458 -16.132  -2.292
  777    HE2  GLU  94           HE       GLU  94   5.894 -19.406   0.042
  778    H    PHE  95           H        PHE  95   3.136 -12.530  -2.335
  779    HA   PHE  95           HA       PHE  95   5.560 -11.022  -2.590
  780   1HB   PHE  95          1HB       PHE  95   2.799 -10.499  -1.441
  781   2HB   PHE  95          2HB       PHE  95   4.083  -9.317  -1.308
  782    HD1  PHE  95           1HD      PHE  95   2.211 -11.336  -3.860
  783    HD2  PHE  95           2HD      PHE  95   4.579  -7.824  -3.088
  784    HE1  PHE  95           1HE      PHE  95   1.527 -10.402  -6.047
  785    HE2  PHE  95           2HE      PHE  95   3.893  -6.885  -5.279
  786    HZ   PHE  95           HZ       PHE  95   2.360  -8.168  -6.758
  787    H    GLU  96           H        GLU  96   7.097 -10.556  -1.051
  788    HA   GLU  96           HA       GLU  96   7.003 -11.887   1.487
  789   1HB   GLU  96          1HB       GLU  96   9.233 -10.837   1.828
  790   2HB   GLU  96          2HB       GLU  96   9.084 -11.874   0.407
  791   1HG   GLU  96          1HG       GLU  96   9.020  -9.971  -1.097
  792   2HG   GLU  96          2HG       GLU  96   8.919  -8.830   0.249
  793    HE2  GLU  96           HE       GLU  96  12.452 -10.639  -0.595
  794    H    ASP  97           H        ASP  97   4.990 -10.839   2.072
  795    HA   ASP  97           HA       ASP  97   3.786  -9.578   3.462
  796   1HB   ASP  97          1HB       ASP  97   5.771  -9.566   4.969
  797   2HB   ASP  97          2HB       ASP  97   6.322  -8.059   4.216
  798    HD2  ASP  97           HD       ASP  97   2.862  -7.798   6.321
  799    H    PHE  98           H        PHE  98   2.895  -7.320   3.732
  800    HA   PHE  98           HA       PHE  98   2.836  -5.974   1.138
  801   1HB   PHE  98          1HB       PHE  98   0.820  -6.488   2.514
  802   2HB   PHE  98          2HB       PHE  98   1.359  -5.307   3.694
  803    HD1  PHE  98           1HD      PHE  98   1.932  -2.859   2.608
  804    HD2  PHE  98           2HD      PHE  98  -0.694  -5.811   0.865
  805    HE1  PHE  98           1HE      PHE  98   0.641  -1.077   1.557
  806    HE2  PHE  98           2HE      PHE  98  -1.983  -3.997  -0.209
  807    HZ   PHE  98           HZ       PHE  98  -1.298  -1.623   0.102
  808    H    GLU  99           H        GLU  99   4.634  -4.711   0.755
  809    HA   GLU  99           HA       GLU  99   5.522  -2.812   2.888
  810   1HB   GLU  99          1HB       GLU  99   7.099  -4.417   1.997
  811   2HB   GLU  99          2HB       GLU  99   6.922  -3.728   0.390
  812   1HG   GLU  99          1HG       GLU  99   7.881  -1.600   1.150
  813   2HG   GLU  99          2HG       GLU  99   7.789  -2.119   2.839
  814    HE2  GLU  99           HE       GLU  99  10.584  -4.338   2.438
  815    H    THR 100           H        THR 100   6.211  -0.618   1.888
  816    HA   THR 100           HA       THR 100   4.271   0.310  -0.157
  817    HB   THR 100           HB       THR 100   3.950   2.141   1.014
  818    HG1  THR 100           1HG      THR 100   5.448   2.994   2.525
  819   1HG2  THR 100          1HG2      THR 100   3.678   1.592   3.359
  820   2HG2  THR 100          2HG2      THR 100   3.395   0.107   2.419
  821   3HG2  THR 100          3HG2      THR 100   4.929   0.349   3.288
  822    H    TYR 101           H        TYR 101   5.041   1.408  -2.046
  823    HA   TYR 101           HA       TYR 101   7.929   1.701  -2.480
  824   1HB   TYR 101          1HB       TYR 101   5.452   2.481  -4.004
  825   2HB   TYR 101          2HB       TYR 101   6.982   3.243  -4.380
  826    HD1  TYR 101           1HD      TYR 101   8.142   2.353  -6.181
  827    HD2  TYR 101           2HD      TYR 101   5.711  -0.258  -3.774
  828    HE1  TYR 101           1HE      TYR 101   8.803   0.434  -7.594
  829    HE2  TYR 101           2HE      TYR 101   6.395  -2.187  -5.171
  830    HH   TYR 101           HH       TYR 101   7.653  -2.898  -6.961
  Start of MODEL   19
    1   1H    GLY  -1          1H        GLY  -1 -42.428 -39.827 -11.187
    2   2H    GLY  -1          2H        GLY  -1 -41.481 -38.879 -12.155
    3   3H    GLY  -1          3H        GLY  -1 -40.984 -40.394 -11.756
    4   1HA   GLY  -1          1HA       GLY  -1 -41.356 -38.189  -9.862
    5   2HA   GLY  -1          2HA       GLY  -1 -40.754 -39.812  -9.477
    6    H    SER   0           H        SER   0 -39.127 -37.918  -8.660
    7    HA   SER   0           HA       SER   0 -36.751 -38.140 -10.353
    8   1HB   SER   0          1HB       SER   0 -36.349 -35.662 -10.296
    9   2HB   SER   0          2HB       SER   0 -37.692 -36.150 -11.339
   10    HG   SER   0           HG       SER   0 -39.126 -35.561  -9.690
   11    H    MET   1           H        MET   1 -36.807 -39.553  -8.296
   12    HA   MET   1           HA       MET   1 -36.238 -38.191  -5.771
   13   1HB   MET   1          1HB       MET   1 -36.234 -41.136  -6.564
   14   2HB   MET   1          2HB       MET   1 -35.959 -40.507  -4.939
   15   1HG   MET   1          1HG       MET   1 -38.194 -41.225  -5.012
   16   2HG   MET   1          2HG       MET   1 -38.187 -39.466  -4.917
   17   1HE   MET   1          1HE       MET   1 -37.716 -41.681  -8.270
   18   2HE   MET   1          2HE       MET   1 -39.430 -41.925  -8.654
   19   3HE   MET   1          3HE       MET   1 -38.753 -42.619  -7.165
   20    H    LYS   2           H        LYS   2 -34.413 -37.053  -7.117
   21    HA   LYS   2           HA       LYS   2 -31.839 -38.531  -6.672
   22   1HB   LYS   2          1HB       LYS   2 -32.516 -36.424  -8.757
   23   2HB   LYS   2          2HB       LYS   2 -30.899 -37.001  -8.358
   24   1HG   LYS   2          1HG       LYS   2 -31.303 -38.369 -10.141
   25   2HG   LYS   2          2HG       LYS   2 -31.854 -39.390  -8.820
   26   1HD   LYS   2          1HD       LYS   2 -33.617 -39.668 -10.229
   27   2HD   LYS   2          2HD       LYS   2 -34.225 -38.235  -9.404
   28   1HE   LYS   2          1HE       LYS   2 -32.727 -38.271 -12.068
   29   2HE   LYS   2          2HE       LYS   2 -34.481 -38.124 -11.866
   30   1HZ   LYS   2          1HZ       LYS   2 -33.567 -35.957 -12.129
   31   2HZ   LYS   2          2HZ       LYS   2 -32.537 -36.174 -10.811
   32    H    LYS   3           H        LYS   3 -30.953 -37.784  -4.837
   33    HA   LYS   3           HA       LYS   3 -30.810 -34.851  -4.360
   34   1HB   LYS   3          1HB       LYS   3 -31.368 -37.014  -2.290
   35   2HB   LYS   3          2HB       LYS   3 -31.006 -35.312  -1.943
   36   1HG   LYS   3          1HG       LYS   3 -33.020 -34.670  -3.327
   37   2HG   LYS   3          2HG       LYS   3 -33.449 -36.386  -3.427
   38   1HD   LYS   3          1HD       LYS   3 -33.160 -34.760  -0.858
   39   2HD   LYS   3          2HD       LYS   3 -34.683 -35.182  -1.658
   40   1HE   LYS   3          1HE       LYS   3 -34.155 -37.614  -1.335
   41   2HE   LYS   3          2HE       LYS   3 -32.698 -37.153  -0.428
   42   1HZ   LYS   3          1HZ       LYS   3 -34.493 -37.508   1.093
   43   2HZ   LYS   3          2HZ       LYS   3 -35.421 -36.319   0.331
   44    H    TRP   4           H        TRP   4 -28.738 -34.273  -4.230
   45    HA   TRP   4           HA       TRP   4 -26.661 -35.471  -2.916
   46   1HB   TRP   4          1HB       TRP   4 -25.248 -36.349  -4.808
   47   2HB   TRP   4          2HB       TRP   4 -26.603 -37.387  -4.432
   48    HD1  TRP   4           HD       TRP   4 -28.586 -37.530  -6.246
   49    HE1  TRP   4           1HE      TRP   4 -28.664 -37.045  -8.780
   50    HE3  TRP   4           3HE      TRP   4 -24.253 -34.836  -6.717
   51    HZ2  TRP   4           2HZ      TRP   4 -27.086 -35.679 -10.723
   52    HZ3  TRP   4           3HZ      TRP   4 -23.563 -33.973  -8.930
   53    HH2  TRP   4           HH       TRP   4 -24.972 -34.377 -10.935
   54    H    SER   5           H        SER   5 -25.389 -33.811  -2.549
   55    HA   SER   5           HA       SER   5 -25.000 -31.691  -4.616
   56   1HB   SER   5          1HB       SER   5 -26.825 -31.088  -3.081
   57   2HB   SER   5          2HB       SER   5 -25.742 -31.311  -1.691
   58    HG   SER   5           HG       SER   5 -24.467 -29.631  -2.493
   59    H    ASP   6           H        ASP   6 -23.000 -30.570  -4.414
   60    HA   ASP   6           HA       ASP   6 -21.245 -30.887  -2.207
   61   1HB   ASP   6          1HB       ASP   6 -20.793 -33.094  -3.287
   62   2HB   ASP   6          2HB       ASP   6 -20.432 -32.270  -4.812
   63    HD2  ASP   6           HD       ASP   6 -17.185 -31.484  -3.863
   64    H    THR   7           H        THR   7 -19.518 -29.384  -2.329
   65    HA   THR   7           HA       THR   7 -19.276 -27.722  -4.779
   66    HB   THR   7           HB       THR   7 -19.030 -25.723  -3.326
   67    HG1  THR   7           1HG      THR   7 -19.777 -25.890  -1.183
   68   1HG2  THR   7          1HG2      THR   7 -21.390 -25.338  -2.915
   69   2HG2  THR   7          2HG2      THR   7 -21.212 -26.249  -4.427
   70   3HG2  THR   7          3HG2      THR   7 -21.736 -27.077  -2.945
   71    H    GLU   8           H        GLU   8 -17.231 -26.612  -4.891
   72    HA   GLU   8           HA       GLU   8 -15.020 -27.634  -3.224
   73   1HB   GLU   8          1HB       GLU   8 -15.078 -27.824  -6.273
   74   2HB   GLU   8          2HB       GLU   8 -13.689 -28.170  -5.229
   75   1HG   GLU   8          1HG       GLU   8 -15.026 -29.994  -4.124
   76   2HG   GLU   8          2HG       GLU   8 -16.313 -29.712  -5.313
   77    HE2  GLU   8           HE       GLU   8 -12.814 -31.382  -6.535
   78    H    VAL   9           H        VAL   9 -12.933 -26.438  -4.099
   79    HA   VAL   9           HA       VAL   9 -13.472 -23.683  -4.965
   80    HB   VAL   9           HB       VAL   9 -13.858 -23.597  -2.563
   81   1HG1  VAL   9          1HG1      VAL   9 -11.025 -24.651  -2.149
   82   2HG1  VAL   9          2HG1      VAL   9 -12.185 -24.141  -0.907
   83   3HG1  VAL   9          3HG1      VAL   9 -12.508 -25.590  -1.864
   84   1HG2  VAL   9          1HG2      VAL   9 -11.139 -22.379  -3.205
   85   2HG2  VAL   9          2HG2      VAL   9 -12.710 -21.684  -3.666
   86   3HG2  VAL   9          3HG2      VAL   9 -12.279 -21.856  -1.955
   87    H    PHE  10           H        PHE  10 -11.692 -22.724  -5.903
   88    HA   PHE  10           HA       PHE  10  -9.618 -24.585  -6.795
   89   1HB   PHE  10          1HB       PHE  10 -10.131 -21.681  -7.539
   90   2HB   PHE  10          2HB       PHE  10  -9.039 -22.799  -8.349
   91    HD1  PHE  10           1HD      PHE  10 -12.512 -21.689  -7.955
   92    HD2  PHE  10           2HD      PHE  10  -9.988 -24.764  -9.630
   93    HE1  PHE  10           1HE      PHE  10 -14.375 -22.438  -9.401
   94    HE2  PHE  10           2HE      PHE  10 -11.858 -25.497 -11.083
   95    HZ   PHE  10           HZ       PHE  10 -14.049 -24.327 -10.981
   96    H    GLU  11           H        GLU  11  -9.472 -21.179  -5.583
   97    HA   GLU  11           HA       GLU  11  -7.049 -21.879  -4.008
   98   1HB   GLU  11          1HB       GLU  11  -6.149 -19.749  -4.401
   99   2HB   GLU  11          2HB       GLU  11  -6.431 -20.559  -5.944
  100   1HG   GLU  11          1HG       GLU  11  -8.171 -18.351  -4.742
  101   2HG   GLU  11          2HG       GLU  11  -6.937 -18.140  -5.980
  102    HE2  GLU  11           HE       GLU  11  -8.835 -19.572  -8.570
  103    H    MET  12           H        MET  12  -7.067 -21.247  -1.928
  104    HA   MET  12           HA       MET  12  -9.529 -20.266  -0.721
  105   1HB   MET  12          1HB       MET  12  -6.768 -20.752   0.486
  106   2HB   MET  12          2HB       MET  12  -8.263 -20.396   1.371
  107   1HG   MET  12          1HG       MET  12  -7.797 -22.859  -0.348
  108   2HG   MET  12          2HG       MET  12  -7.726 -22.772   1.412
  109   1HE   MET  12          1HE       MET  12  -9.367 -25.017   0.332
  110   2HE   MET  12          2HE       MET  12 -10.921 -24.847   1.183
  111   3HE   MET  12          3HE       MET  12  -9.397 -24.561   2.054
  112    H    LEU  13           H        LEU  13  -6.161 -18.979  -0.953
  113    HA   LEU  13           HA       LEU  13  -7.235 -16.265  -0.416
  114   1HB   LEU  13          1HB       LEU  13  -5.310 -15.767   0.800
  115   2HB   LEU  13          2HB       LEU  13  -5.855 -17.345   1.328
  116    HG   LEU  13           HG       LEU  13  -4.008 -18.148  -0.485
  117   1HD1  LEU  13          1HD1      LEU  13  -2.061 -16.613  -0.385
  118   2HD1  LEU  13          2HD1      LEU  13  -3.423 -15.764  -1.134
  119   3HD1  LEU  13          3HD1      LEU  13  -3.002 -15.442   0.555
  120   1HD2  LEU  13          1HD2      LEU  13  -2.418 -18.230   1.447
  121   2HD2  LEU  13          2HD2      LEU  13  -3.490 -17.136   2.346
  122   3HD2  LEU  13          3HD2      LEU  13  -4.051 -18.759   1.883
  123    H    LYS  14           H        LYS  14  -6.878 -14.685  -1.740
  124    HA   LYS  14           HA       LYS  14  -5.357 -15.209  -4.268
  125   1HB   LYS  14          1HB       LYS  14  -7.190 -14.305  -5.483
  126   2HB   LYS  14          2HB       LYS  14  -7.668 -15.668  -4.485
  127   1HG   LYS  14          1HG       LYS  14  -9.390 -14.102  -4.378
  128   2HG   LYS  14          2HG       LYS  14  -8.607 -14.058  -2.787
  129   1HD   LYS  14          1HD       LYS  14  -7.569 -11.914  -3.316
  130   2HD   LYS  14          2HD       LYS  14  -8.031 -12.092  -5.027
  131   1HE   LYS  14          1HE       LYS  14 -10.448 -11.946  -4.227
  132   2HE   LYS  14          2HE       LYS  14  -9.786 -11.653  -2.606
  133   1HZ   LYS  14          1HZ       LYS  14 -10.196  -9.556  -3.743
  134   2HZ   LYS  14          2HZ       LYS  14  -9.104  -9.993  -4.954
  135    H    ARG  15           H        ARG  15  -5.374 -13.011  -5.610
  136    HA   ARG  15           HA       ARG  15  -4.329 -10.845  -3.872
  137   1HB   ARG  15          1HB       ARG  15  -3.121  -9.997  -5.611
  138   2HB   ARG  15          2HB       ARG  15  -2.845 -11.741  -5.526
  139   1HG   ARG  15          1HG       ARG  15  -4.335 -12.063  -7.464
  140   2HG   ARG  15          2HG       ARG  15  -4.624 -10.319  -7.574
  141   1HD   ARG  15          1HD       ARG  15  -2.458  -9.791  -8.193
  142   2HD   ARG  15          2HD       ARG  15  -1.786 -11.326  -7.607
  143    HE   ARG  15           HE       ARG  15  -3.539 -12.124  -9.546
  144   1HH1  ARG  15          2HH1      ARG  15  -0.762  -9.911  -9.565
  145   2HH1  ARG  15          1HH1      ARG  15  -0.224 -10.419 -11.146
  146   1HH2  ARG  15          1HH2      ARG  15  -2.826 -12.787 -11.570
  147   2HH2  ARG  15          2HH2      ARG  15  -1.431 -12.046 -12.316
  148    H    MET  16           H        MET  16  -5.269  -8.917  -3.664
  149    HA   MET  16           HA       MET  16  -7.465  -7.940  -5.385
  150   1HB   MET  16          1HB       MET  16  -7.353  -7.416  -3.022
  151   2HB   MET  16          2HB       MET  16  -5.858  -6.504  -3.295
  152   1HG   MET  16          1HG       MET  16  -7.120  -4.944  -4.762
  153   2HG   MET  16          2HG       MET  16  -8.564  -5.958  -4.594
  154   1HE   MET  16          1HE       MET  16  -5.755  -4.413  -2.641
  155   2HE   MET  16          2HE       MET  16  -6.522  -3.602  -1.256
  156   3HE   MET  16          3HE       MET  16  -6.582  -2.867  -2.877
  157    H    TYR  17           H        TYR  17  -7.157  -6.126  -6.683
  158    HA   TYR  17           HA       TYR  17  -4.472  -5.143  -7.348
  159   1HB   TYR  17          1HB       TYR  17  -4.523  -6.833  -9.000
  160   2HB   TYR  17          2HB       TYR  17  -6.246  -6.634  -9.284
  161    HD1  TYR  17           1HD      TYR  17  -3.525  -4.004  -9.273
  162    HD2  TYR  17           2HD      TYR  17  -6.450  -6.192 -11.571
  163    HE1  TYR  17           1HE      TYR  17  -3.217  -2.448 -11.185
  164    HE2  TYR  17           2HE      TYR  17  -6.155  -4.617 -13.449
  165    HH   TYR  17           HH       TYR  17  -5.056  -2.738 -14.223
  166    H    ALA  18           H        ALA  18  -5.088  -3.318  -6.300
  167    HA   ALA  18           HA       ALA  18  -7.435  -1.817  -7.344
  168   1HB   ALA  18          1HB       ALA  18  -7.199  -0.469  -5.350
  169   2HB   ALA  18          2HB       ALA  18  -7.507  -2.190  -5.002
  170   3HB   ALA  18          3HB       ALA  18  -5.863  -1.522  -4.802
  171    H    ARG  19           H        ARG  19  -6.778  -0.823  -9.068
  172    HA   ARG  19           HA       ARG  19  -4.247   0.672  -9.217
  173   1HB   ARG  19          1HB       ARG  19  -5.520  -0.641 -11.131
  174   2HB   ARG  19          2HB       ARG  19  -6.412   0.867 -11.299
  175   1HG   ARG  19          1HG       ARG  19  -3.433   0.330 -11.617
  176   2HG   ARG  19          2HG       ARG  19  -4.585   0.969 -12.800
  177   1HD   ARG  19          1HD       ARG  19  -4.826   2.972 -11.190
  178   2HD   ARG  19          2HD       ARG  19  -3.394   2.389 -10.377
  179    HE   ARG  19           HE       ARG  19  -3.628   3.307 -13.216
  180   1HH1  ARG  19          1HH1      ARG  19  -1.455   2.500 -10.498
  181   2HH1  ARG  19          2HH1      ARG  19  -0.088   3.304 -11.220
  182   1HH2  ARG  19          1HH2      ARG  19  -1.782   4.227 -14.174
  183   2HH2  ARG  19          2HH2      ARG  19  -0.249   4.198 -13.345
  184    H    VAL  20           H        VAL  20  -4.375   2.352  -7.722
  185    HA   VAL  20           HA       VAL  20  -6.972   3.745  -7.387
  186    HB   VAL  20           HB       VAL  20  -4.536   3.915  -5.613
  187   1HG1  VAL  20          1HG1      VAL  20  -7.466   4.580  -5.142
  188   2HG1  VAL  20          2HG1      VAL  20  -6.137   4.790  -3.988
  189   3HG1  VAL  20          3HG1      VAL  20  -6.196   5.783  -5.447
  190   1HG2  VAL  20          1HG2      VAL  20  -6.760   1.895  -5.783
  191   2HG2  VAL  20          2HG2      VAL  20  -5.058   1.682  -5.345
  192   3HG2  VAL  20          3HG2      VAL  20  -6.196   2.391  -4.188
  193    H    TYR  21           H        TYR  21  -7.325   5.573  -8.347
  194    HA   TYR  21           HA       TYR  21  -5.130   7.209  -9.483
  195   1HB   TYR  21          1HB       TYR  21  -8.123   7.048  -9.976
  196   2HB   TYR  21          2HB       TYR  21  -7.053   8.172 -10.790
  197    HD1  TYR  21           1HD      TYR  21  -7.924   4.574 -10.392
  198    HD2  TYR  21           2HD      TYR  21  -5.602   7.443 -12.613
  199    HE1  TYR  21           1HE      TYR  21  -7.554   2.892 -12.159
  200    HE2  TYR  21           2HE      TYR  21  -5.097   5.711 -14.306
  201    HH   TYR  21           HH       TYR  21  -5.531   3.568 -15.044
  202    H    GLY  22           H        GLY  22  -4.994   9.415  -9.095
  203   1HA   GLY  22          1HA       GLY  22  -6.440  11.389  -8.586
  204   2HA   GLY  22          2HA       GLY  22  -6.790  10.603  -7.033
  205    H    LEU  23           H        LEU  23  -5.975  12.557  -6.049
  206    HA   LEU  23           HA       LEU  23  -3.081  13.034  -6.211
  207   1HB   LEU  23          1HB       LEU  23  -4.918  14.809  -6.138
  208   2HB   LEU  23          2HB       LEU  23  -5.049  14.432  -4.414
  209    HG   LEU  23           HG       LEU  23  -2.523  14.993  -4.276
  210   1HD1  LEU  23          1HD1      LEU  23  -1.651  16.466  -6.069
  211   2HD1  LEU  23          2HD1      LEU  23  -1.918  14.828  -6.666
  212   3HD1  LEU  23          3HD1      LEU  23  -3.081  16.113  -7.058
  213   1HD2  LEU  23          1HD2      LEU  23  -2.949  17.411  -4.234
  214   2HD2  LEU  23          2HD2      LEU  23  -4.436  17.182  -5.176
  215   3HD2  LEU  23          3HD2      LEU  23  -4.316  16.531  -3.527
  216    H    VAL  24           H        VAL  24  -4.348  10.514  -5.075
  217    HA   VAL  24           HA       VAL  24  -3.846  10.404  -2.256
  218    HB   VAL  24           HB       VAL  24  -3.862   7.988  -2.567
  219   1HG1  VAL  24          1HG1      VAL  24  -6.067   9.393  -4.129
  220   2HG1  VAL  24          2HG1      VAL  24  -6.160   7.774  -3.410
  221   3HG1  VAL  24          3HG1      VAL  24  -5.998   9.191  -2.368
  222   1HG2  VAL  24          1HG2      VAL  24  -4.138   8.518  -5.556
  223   2HG2  VAL  24          2HG2      VAL  24  -2.693   7.863  -4.754
  224   3HG2  VAL  24          3HG2      VAL  24  -4.210   6.950  -4.727
  225    H    GLN  25           H        GLN  25  -1.719  10.354  -5.018
  226    HA   GLN  25           HA       GLN  25   0.585   9.195  -3.916
  227   1HB   GLN  25          1HB       GLN  25  -0.125  10.631  -6.284
  228   2HB   GLN  25          2HB       GLN  25   1.225  11.500  -5.558
  229   1HG   GLN  25          1HG       GLN  25   2.185   9.909  -6.943
  230   2HG   GLN  25          2HG       GLN  25   2.431   9.282  -5.329
  231   1HE2  GLN  25          1HE2      GLN  25   2.502   7.718  -7.811
  232   2HE2  GLN  25          2HE2      GLN  25   1.166   6.585  -7.769
  233    H    GLY  26           H        GLY  26   2.085   9.835  -2.463
  234   1HA   GLY  26          1HA       GLY  26   3.311  11.189  -1.082
  235   2HA   GLY  26          2HA       GLY  26   2.439  12.610  -1.666
  236    H    VAL  27           H        VAL  27  -0.153  12.146  -1.069
  237    HA   VAL  27           HA       VAL  27  -0.260  12.690   1.747
  238    HB   VAL  27           HB       VAL  27  -2.504  12.251  -0.254
  239   1HG1  VAL  27          1HG1      VAL  27  -2.396  13.739   2.424
  240   2HG1  VAL  27          2HG1      VAL  27  -3.762  13.786   1.297
  241   3HG1  VAL  27          3HG1      VAL  27  -3.339  12.273   2.099
  242   1HG2  VAL  27          1HG2      VAL  27  -1.078  14.828   0.475
  243   2HG2  VAL  27          2HG2      VAL  27  -1.060  14.015  -1.110
  244   3HG2  VAL  27          3HG2      VAL  27  -2.563  14.699  -0.493
  245    H    GLY  28           H        GLY  28   0.687  10.623   2.463
  246   1HA   GLY  28          1HA       GLY  28   0.575   8.559   3.432
  247   2HA   GLY  28          2HA       GLY  28  -1.113   8.964   3.781
  248    H    PHE  29           H        PHE  29  -2.561   7.635   2.931
  249    HA   PHE  29           HA       PHE  29  -3.644   6.076   1.814
  250   1HB   PHE  29          1HB       PHE  29  -3.748   7.699   0.105
  251   2HB   PHE  29          2HB       PHE  29  -2.141   7.305  -0.496
  252    HD1  PHE  29           1HD      PHE  29  -1.813   5.592  -2.110
  253    HD2  PHE  29           2HD      PHE  29  -5.532   5.773   0.059
  254    HE1  PHE  29           1HE      PHE  29  -2.531   3.468  -3.154
  255    HE2  PHE  29           2HE      PHE  29  -6.267   3.675  -1.027
  256    HZ   PHE  29           HZ       PHE  29  -4.715   2.458  -2.532
  257    H    ARG  30           H        ARG  30  -0.448   5.822   0.177
  258    HA   ARG  30           HA       ARG  30  -0.531   3.030  -0.202
  259   1HB   ARG  30          1HB       ARG  30   1.830   3.253  -0.750
  260   2HB   ARG  30          2HB       ARG  30   0.881   4.575  -1.431
  261   1HG   ARG  30          1HG       ARG  30   1.718   5.793   0.854
  262   2HG   ARG  30          2HG       ARG  30   2.992   4.577   0.706
  263   1HD   ARG  30          1HD       ARG  30   3.305   5.328  -1.689
  264   2HD   ARG  30          2HD       ARG  30   2.144   6.629  -1.400
  265    HE   ARG  30           HE       ARG  30   4.922   6.463  -0.592
  266   1HH1  ARG  30          1HH1      ARG  30   1.800   7.958   0.306
  267   2HH1  ARG  30          2HH1      ARG  30   2.551   9.394   0.952
  268   1HH2  ARG  30          1HH2      ARG  30   5.861   8.316   0.355
  269   2HH2  ARG  30          2HH2      ARG  30   4.858   9.572   1.037
  270    H    LYS  31           H        LYS  31   0.557   4.989   2.539
  271    HA   LYS  31           HA       LYS  31   1.525   2.745   4.062
  272   1HB   LYS  31          1HB       LYS  31   1.869   5.481   4.208
  273   2HB   LYS  31          2HB       LYS  31   0.747   5.206   5.539
  274   1HG   LYS  31          1HG       LYS  31   3.422   3.807   5.075
  275   2HG   LYS  31          2HG       LYS  31   3.123   5.126   6.213
  276   1HD   LYS  31          1HD       LYS  31   1.543   3.684   7.482
  277   2HD   LYS  31          2HD       LYS  31   1.889   2.339   6.370
  278   1HE   LYS  31          1HE       LYS  31   4.296   2.452   6.975
  279   2HE   LYS  31          2HE       LYS  31   3.942   3.761   8.122
  280   1HZ   LYS  31          1HZ       LYS  31   3.969   1.665   9.268
  281   2HZ   LYS  31          2HZ       LYS  31   2.724   1.079   8.288
  282    H    PHE  32           H        PHE  32  -1.447   4.798   4.063
  283    HA   PHE  32           HA       PHE  32  -2.767   3.786   6.202
  284   1HB   PHE  32          1HB       PHE  32  -3.395   5.700   4.751
  285   2HB   PHE  32          2HB       PHE  32  -4.042   4.565   3.566
  286    HD1  PHE  32           1HD      PHE  32  -5.973   6.222   3.831
  287    HD2  PHE  32           2HD      PHE  32  -4.870   3.388   6.906
  288    HE1  PHE  32           1HE      PHE  32  -8.127   6.590   4.982
  289    HE2  PHE  32           2HE      PHE  32  -7.034   3.694   7.968
  290    HZ   PHE  32           HZ       PHE  32  -8.671   5.347   7.058
  291    H    VAL  33           H        VAL  33  -2.952   2.478   2.845
  292    HA   VAL  33           HA       VAL  33  -4.791   0.343   3.479
  293    HB   VAL  33           HB       VAL  33  -2.810   0.652   1.171
  294   1HG1  VAL  33          1HG1      VAL  33  -5.189  -1.236   1.530
  295   2HG1  VAL  33          2HG1      VAL  33  -4.312  -0.993   0.011
  296   3HG1  VAL  33          3HG1      VAL  33  -3.483  -1.710   1.393
  297   1HG2  VAL  33          1HG2      VAL  33  -5.813   1.181   1.254
  298   2HG2  VAL  33          2HG2      VAL  33  -4.570   2.453   1.247
  299   3HG2  VAL  33          3HG2      VAL  33  -4.745   1.371  -0.142
  300    H    GLN  34           H        GLN  34  -1.313   0.743   3.777
  301    HA   GLN  34           HA       GLN  34  -0.714  -2.080   4.067
  302   1HB   GLN  34          1HB       GLN  34   0.818  -0.516   3.098
  303   2HB   GLN  34          2HB       GLN  34   0.991   0.378   4.585
  304   1HG   GLN  34          1HG       GLN  34   1.661  -2.567   4.158
  305   2HG   GLN  34          2HG       GLN  34   2.823  -1.234   4.054
  306   1HE2  GLN  34          1HE2      GLN  34   1.073  -0.059   6.433
  307   2HE2  GLN  34          2HE2      GLN  34   1.731  -0.878   7.832
  308    H    ILE  35           H        ILE  35  -1.088   0.650   6.422
  309    HA   ILE  35           HA       ILE  35  -0.893  -0.745   8.773
  310    HB   ILE  35           HB       ILE  35  -2.936   1.388   8.073
  311   1HG1  ILE  35          1HG1      ILE  35  -0.589   2.141   7.814
  312   2HG1  ILE  35          2HG1      ILE  35  -1.484   2.987   9.068
  313   1HG2  ILE  35          1HG2      ILE  35  -2.985   1.830  10.554
  314   2HG2  ILE  35          2HG2      ILE  35  -3.788   0.347  10.048
  315   3HG2  ILE  35          3HG2      ILE  35  -2.183   0.262  10.788
  316   1HD1  ILE  35          1HD1      ILE  35   0.763   2.541   9.819
  317   2HD1  ILE  35          2HD1      ILE  35  -0.349   1.592  10.805
  318   3HD1  ILE  35          3HD1      ILE  35   0.589   0.803   9.514
  319    H    HIS  36           H        HIS  36  -3.926  -0.473   6.860
  320    HA   HIS  36           HA       HIS  36  -5.392  -2.150   8.699
  321   1HB   HIS  36          1HB       HIS  36  -5.954  -0.986   5.973
  322   2HB   HIS  36          2HB       HIS  36  -7.002  -2.235   6.658
  323    HD2  HIS  36           2HD      HIS  36  -5.552   1.103   8.349
  324    HE1  HIS  36           1HE      HIS  36  -9.660   0.638   9.241
  325    HE2  HIS  36           2HE      HIS  36  -7.603   2.103   9.612
  326    H    ALA  37           H        ALA  37  -3.876  -2.775   5.481
  327    HA   ALA  37           HA       ALA  37  -4.410  -5.409   5.194
  328   1HB   ALA  37          1HB       ALA  37  -2.230  -5.626   4.049
  329   2HB   ALA  37          2HB       ALA  37  -3.082  -4.142   3.587
  330   3HB   ALA  37          3HB       ALA  37  -1.711  -4.088   4.715
  331    H    ILE  38           H        ILE  38  -1.746  -4.082   7.157
  332    HA   ILE  38           HA       ILE  38  -0.743  -6.650   8.031
  333    HB   ILE  38           HB       ILE  38  -0.111  -3.739   8.400
  334   1HG1  ILE  38          1HG1      ILE  38   2.178  -4.581   8.110
  335   2HG1  ILE  38          2HG1      ILE  38   1.612  -6.250   8.230
  336   1HG2  ILE  38          1HG2      ILE  38   1.343  -4.043  10.309
  337   2HG2  ILE  38          2HG2      ILE  38  -0.357  -4.224  10.738
  338   3HG2  ILE  38          3HG2      ILE  38   0.678  -5.670  10.585
  339   1HD1  ILE  38          1HD1      ILE  38   2.033  -5.542   5.892
  340   2HD1  ILE  38          2HD1      ILE  38   0.345  -6.006   6.111
  341   3HD1  ILE  38          3HD1      ILE  38   0.783  -4.291   6.036
  342    H    ARG  39           H        ARG  39  -2.829  -4.162   9.550
  343    HA   ARG  39           HA       ARG  39  -3.303  -5.304  11.961
  344   1HB   ARG  39          1HB       ARG  39  -4.107  -3.165  11.097
  345   2HB   ARG  39          2HB       ARG  39  -5.398  -4.013  10.220
  346   1HG   ARG  39          1HG       ARG  39  -6.328  -4.827  12.270
  347   2HG   ARG  39          2HG       ARG  39  -4.944  -4.196  13.204
  348   1HD   ARG  39          1HD       ARG  39  -5.502  -1.905  12.626
  349   2HD   ARG  39          2HD       ARG  39  -6.796  -2.417  11.543
  350    HE   ARG  39           HE       ARG  39  -6.844  -2.183  14.452
  351   1HH1  ARG  39          1HH1      ARG  39  -8.409  -3.783  11.692
  352   2HH1  ARG  39          2HH1      ARG  39  -9.954  -3.921  12.490
  353   1HH2  ARG  39          1HH2      ARG  39  -8.873  -2.377  15.484
  354   2HH2  ARG  39          2HH2      ARG  39 -10.215  -3.127  14.660
  355    H    LEU  40           H        LEU  40  -4.721  -6.161   8.838
  356    HA   LEU  40           HA       LEU  40  -6.455  -8.290   9.905
  357   1HB   LEU  40          1HB       LEU  40  -6.115  -7.061   7.171
  358   2HB   LEU  40          2HB       LEU  40  -7.365  -8.233   7.607
  359    HG   LEU  40           HG       LEU  40  -7.074  -5.540   9.045
  360   1HD1  LEU  40          1HD1      LEU  40  -8.900  -4.789   7.603
  361   2HD1  LEU  40          2HD1      LEU  40  -7.435  -5.166   6.678
  362   3HD1  LEU  40          3HD1      LEU  40  -8.783  -6.323   6.686
  363   1HD2  LEU  40          1HD2      LEU  40  -9.420  -5.989   9.682
  364   2HD2  LEU  40          2HD2      LEU  40  -9.308  -7.600   8.936
  365   3HD2  LEU  40          3HD2      LEU  40  -8.316  -7.188  10.349
  366    H    GLY  41           H        GLY  41  -3.223  -8.240   8.908
  367   1HA   GLY  41          1HA       GLY  41  -1.776  -9.920   8.410
  368   2HA   GLY  41          2HA       GLY  41  -3.073 -11.092   8.676
  369    H    ILE  42           H        ILE  42  -2.311  -8.493   6.308
  370    HA   ILE  42           HA       ILE  42  -2.833 -10.340   4.028
  371    HB   ILE  42           HB       ILE  42  -3.492  -7.414   4.407
  372   1HG1  ILE  42          1HG1      ILE  42  -5.128  -8.876   5.433
  373   2HG1  ILE  42          2HG1      ILE  42  -5.773  -7.988   4.038
  374   1HG2  ILE  42          1HG2      ILE  42  -4.608  -7.656   2.114
  375   2HG2  ILE  42          2HG2      ILE  42  -2.864  -7.403   2.195
  376   3HG2  ILE  42          3HG2      ILE  42  -3.517  -9.032   1.895
  377   1HD1  ILE  42          1HD1      ILE  42  -6.634 -10.242   4.016
  378   2HD1  ILE  42          2HD1      ILE  42  -5.537 -10.033   2.645
  379   3HD1  ILE  42          3HD1      ILE  42  -5.003 -10.924   4.100
  380    H    LYS  43           H        LYS  43  -1.406 -10.311   2.422
  381    HA   LYS  43           HA       LYS  43   1.209  -8.919   2.799
  382   1HB   LYS  43          1HB       LYS  43   0.442 -11.015   0.739
  383   2HB   LYS  43          2HB       LYS  43   2.059 -10.487   1.222
  384   1HG   LYS  43          1HG       LYS  43   1.760 -11.505   3.437
  385   2HG   LYS  43          2HG       LYS  43   0.116 -12.011   2.992
  386   1HD   LYS  43          1HD       LYS  43   1.037 -13.346   1.098
  387   2HD   LYS  43          2HD       LYS  43   2.669 -12.858   1.561
  388   1HE   LYS  43          1HE       LYS  43   2.249 -15.086   2.411
  389   2HE   LYS  43          2HE       LYS  43   2.351 -13.967   3.783
  390   1HZ   LYS  43          1HZ       LYS  43  -0.112 -13.928   3.748
  391   2HZ   LYS  43          2HZ       LYS  43   0.441 -15.516   3.892
  392    H    GLY  44           H        GLY  44   2.151  -8.279   0.324
  393   1HA   GLY  44          1HA       GLY  44   0.784  -7.932  -1.886
  394   2HA   GLY  44          2HA       GLY  44   0.008  -6.652  -0.941
  395    H    TYR  45           H        TYR  45   0.704  -4.896  -2.064
  396    HA   TYR  45           HA       TYR  45   3.152  -3.816  -1.305
  397   1HB   TYR  45          1HB       TYR  45   3.788  -5.522  -3.288
  398   2HB   TYR  45          2HB       TYR  45   3.201  -4.218  -4.285
  399    HD1  TYR  45           1HD      TYR  45   5.927  -5.485  -2.244
  400    HD2  TYR  45           2HD      TYR  45   4.387  -1.993  -4.234
  401    HE1  TYR  45           1HE      TYR  45   8.138  -4.380  -2.044
  402    HE2  TYR  45           2HE      TYR  45   6.506  -0.816  -3.838
  403    HH   TYR  45           HH       TYR  45   8.652  -0.956  -2.862
  404    H    ALA  46           H        ALA  46   3.154  -1.588  -1.717
  405    HA   ALA  46           HA       ALA  46   0.876  -0.431  -3.286
  406   1HB   ALA  46          1HB       ALA  46   1.174   1.530  -1.960
  407   2HB   ALA  46          2HB       ALA  46   0.814   0.115  -0.975
  408   3HB   ALA  46          3HB       ALA  46   2.464   0.750  -1.020
  409    H    LYS  47           H        LYS  47   2.030  -0.603  -5.342
  410    HA   LYS  47           HA       LYS  47   4.750   0.467  -5.578
  411   1HB   LYS  47          1HB       LYS  47   4.299  -1.633  -6.564
  412   2HB   LYS  47          2HB       LYS  47   2.845  -1.016  -7.343
  413   1HG   LYS  47          1HG       LYS  47   4.053   0.091  -9.032
  414   2HG   LYS  47          2HG       LYS  47   5.541   0.086  -8.074
  415   1HD   LYS  47          1HD       LYS  47   5.728  -1.495  -9.902
  416   2HD   LYS  47          2HD       LYS  47   5.749  -2.351  -8.355
  417   1HE   LYS  47          1HE       LYS  47   3.361  -2.976  -8.659
  418   2HE   LYS  47          2HE       LYS  47   3.311  -2.061 -10.182
  419   1HZ   LYS  47          1HZ       LYS  47   3.721  -4.360 -10.645
  420   2HZ   LYS  47          2HZ       LYS  47   5.113  -4.345  -9.688
  421    H    ASN  48           H        ASN  48   4.163   2.506  -4.970
  422    HA   ASN  48           HA       ASN  48   2.513   4.325  -6.507
  423   1HB   ASN  48          1HB       ASN  48   2.826   4.172  -3.991
  424   2HB   ASN  48          2HB       ASN  48   4.466   4.769  -4.197
  425   1HD2  ASN  48          2HD2      ASN  48   1.176   5.609  -3.789
  426   2HD2  ASN  48          1HD2      ASN  48   1.331   7.329  -4.052
  427    H    LEU  49           H        LEU  49   3.756   3.937  -8.608
  428    HA   LEU  49           HA       LEU  49   6.463   4.775  -8.699
  429   1HB   LEU  49          1HB       LEU  49   5.147   4.504 -11.316
  430   2HB   LEU  49          2HB       LEU  49   6.624   3.876 -10.637
  431    HG   LEU  49           HG       LEU  49   5.053   2.245  -9.304
  432   1HD1  LEU  49          1HD1      LEU  49   3.036   1.610 -10.618
  433   2HD1  LEU  49          2HD1      LEU  49   2.858   3.288 -10.113
  434   3HD1  LEU  49          3HD1      LEU  49   3.350   2.916 -11.770
  435   1HD2  LEU  49          1HD2      LEU  49   5.202   0.664 -11.227
  436   2HD2  LEU  49          2HD2      LEU  49   5.639   2.025 -12.282
  437   3HD2  LEU  49          3HD2      LEU  49   6.711   1.549 -10.948
  438    HA   PRO  50           HA       PRO  50   5.227   8.553 -11.199
  439   1HB   PRO  50          1HB       PRO  50   2.772   9.098 -12.156
  440   2HB   PRO  50          2HB       PRO  50   3.636   7.643 -12.718
  441   1HG   PRO  50          1HG       PRO  50   1.610   7.795 -10.458
  442   2HG   PRO  50          2HG       PRO  50   1.530   6.759 -11.916
  443   1HD   PRO  50          1HD       PRO  50   2.608   5.877  -9.547
  444   2HD   PRO  50          2HD       PRO  50   3.236   5.385 -11.143
  445    H    ASP  51           H        ASP  51   3.589  10.685 -11.100
  446    HA   ASP  51           HA       ASP  51   3.311  11.387  -8.222
  447   1HB   ASP  51          1HB       ASP  51   3.397  13.148 -10.694
  448   2HB   ASP  51          2HB       ASP  51   3.381  13.679  -9.005
  449    HD2  ASP  51           HD       ASP  51   6.793  12.382 -10.708
  450    H    GLY  52           H        GLY  52   1.284   9.660  -8.980
  451   1HA   GLY  52          1HA       GLY  52  -1.050  11.201  -8.502
  452   2HA   GLY  52          2HA       GLY  52  -0.971  10.845 -10.233
  453    H    SER  53           H        SER  53  -0.595   8.494 -10.810
  454    HA   SER  53           HA       SER  53  -2.704   7.017  -9.402
  455   1HB   SER  53          1HB       SER  53  -1.388   6.478 -12.082
  456   2HB   SER  53          2HB       SER  53  -2.902   5.782 -11.447
  457    HG   SER  53           HG       SER  53  -3.708   7.946 -11.378
  458    H    VAL  54           H        VAL  54  -2.151   5.567  -7.888
  459    HA   VAL  54           HA       VAL  54   0.466   4.141  -8.032
  460    HB   VAL  54           HB       VAL  54   0.409   5.312  -6.061
  461   1HG1  VAL  54          1HG1      VAL  54  -2.412   4.370  -5.484
  462   2HG1  VAL  54          2HG1      VAL  54  -1.399   5.375  -4.429
  463   3HG1  VAL  54          3HG1      VAL  54  -1.966   6.018  -5.966
  464   1HG2  VAL  54          1HG2      VAL  54  -0.710   2.621  -5.201
  465   2HG2  VAL  54          2HG2      VAL  54   0.938   2.843  -5.789
  466   3HG2  VAL  54          3HG2      VAL  54   0.405   3.655  -4.306
  467    H    GLU  55           H        GLU  55   0.535   2.017  -8.356
  468    HA   GLU  55           HA       GLU  55  -1.981   0.506  -8.598
  469   1HB   GLU  55          1HB       GLU  55  -0.265   0.469 -10.356
  470   2HB   GLU  55          2HB       GLU  55   0.896  -0.280  -9.265
  471   1HG   GLU  55          1HG       GLU  55  -1.855  -1.498  -9.720
  472   2HG   GLU  55          2HG       GLU  55  -0.600  -1.689 -10.952
  473    HE2  GLU  55           HE       GLU  55  -0.333  -4.696  -9.097
  474    H    VAL  56           H        VAL  56  -2.700  -0.616  -6.844
  475    HA   VAL  56           HA       VAL  56  -0.775  -1.491  -4.741
  476    HB   VAL  56           HB       VAL  56  -3.728  -0.877  -4.483
  477   1HG1  VAL  56          1HG1      VAL  56  -1.573  -1.494  -2.416
  478   2HG1  VAL  56          2HG1      VAL  56  -3.208  -0.916  -2.045
  479   3HG1  VAL  56          3HG1      VAL  56  -2.994  -2.494  -2.797
  480   1HG2  VAL  56          1HG2      VAL  56  -1.282   0.777  -3.728
  481   2HG2  VAL  56          2HG2      VAL  56  -2.553   1.213  -4.901
  482   3HG2  VAL  56          3HG2      VAL  56  -2.935   1.099  -3.179
  483    H    VAL  57           H        VAL  57  -0.914  -3.588  -4.011
  484    HA   VAL  57           HA       VAL  57  -3.108  -5.331  -4.949
  485    HB   VAL  57           HB       VAL  57  -1.510  -7.227  -5.144
  486   1HG1  VAL  57          1HG1      VAL  57  -0.894  -4.926  -7.038
  487   2HG1  VAL  57          2HG1      VAL  57  -0.620  -6.650  -7.356
  488   3HG1  VAL  57          3HG1      VAL  57  -2.272  -6.039  -7.174
  489   1HG2  VAL  57          1HG2      VAL  57   0.661  -5.081  -4.979
  490   2HG2  VAL  57          2HG2      VAL  57   0.374  -6.405  -3.828
  491   3HG2  VAL  57          3HG2      VAL  57   0.911  -6.759  -5.472
  492    H    ALA  58           H        ALA  58  -3.732  -6.868  -3.387
  493    HA   ALA  58           HA       ALA  58  -2.458  -6.774  -0.733
  494   1HB   ALA  58          1HB       ALA  58  -4.450  -6.156   0.426
  495   2HB   ALA  58          2HB       ALA  58  -4.110  -4.900  -0.773
  496   3HB   ALA  58          3HB       ALA  58  -5.395  -6.099  -1.064
  497    H    GLU  59           H        GLU  59  -2.248  -8.838  -0.192
  498    HA   GLU  59           HA       GLU  59  -3.786 -10.839  -1.700
  499   1HB   GLU  59          1HB       GLU  59  -0.955 -10.493  -0.991
  500   2HB   GLU  59          2HB       GLU  59  -1.574 -12.147  -0.824
  501   1HG   GLU  59          1HG       GLU  59  -2.492 -12.076  -3.096
  502   2HG   GLU  59          2HG       GLU  59  -1.825 -10.441  -3.323
  503    HE2  GLU  59           HE       GLU  59   0.517 -12.708  -4.860
  504    H    GLY  60           H        GLY  60  -5.398 -11.832  -0.468
  505   1HA   GLY  60          1HA       GLY  60  -4.441 -13.616   1.510
  506   2HA   GLY  60          2HA       GLY  60  -5.301 -12.309   2.326
  507    H    TYR  61           H        TYR  61  -6.566 -14.149   2.998
  508    HA   TYR  61           HA       TYR  61  -8.392 -15.534   1.273
  509   1HB   TYR  61          1HB       TYR  61  -8.207 -14.945   4.242
  510   2HB   TYR  61          2HB       TYR  61  -9.439 -16.008   3.560
  511    HD1  TYR  61           1HD      TYR  61  -5.858 -15.575   4.401
  512    HD2  TYR  61           2HD      TYR  61  -8.846 -18.301   2.899
  513    HE1  TYR  61           1HE      TYR  61  -4.373 -17.483   4.911
  514    HE2  TYR  61           2HE      TYR  61  -7.370 -20.215   3.475
  515    HH   TYR  61           HH       TYR  61  -5.305 -20.873   4.238
  516    H    GLU  62           H        GLU  62 -10.820 -15.258   1.629
  517    HA   GLU  62           HA       GLU  62 -11.349 -12.479   0.869
  518   1HB   GLU  62          1HB       GLU  62 -13.229 -14.836   0.940
  519   2HB   GLU  62          2HB       GLU  62 -13.523 -13.236   0.215
  520   1HG   GLU  62          1HG       GLU  62 -11.647 -13.616  -1.385
  521   2HG   GLU  62          2HG       GLU  62 -11.386 -15.229  -0.702
  522    HE2  GLU  62           HE       GLU  62 -14.752 -14.575  -2.897
  523    H    GLU  63           H        GLU  63 -11.578 -14.320   3.771
  524    HA   GLU  63           HA       GLU  63 -13.825 -12.907   4.937
  525   1HB   GLU  63          1HB       GLU  63 -11.521 -14.548   6.133
  526   2HB   GLU  63          2HB       GLU  63 -12.927 -13.938   7.023
  527   1HG   GLU  63          1HG       GLU  63 -14.418 -15.261   5.502
  528   2HG   GLU  63          2HG       GLU  63 -12.985 -15.919   4.696
  529    HE2  GLU  63           HE       GLU  63 -13.969 -17.182   8.423
  530    H    ALA  64           H        ALA  64 -10.245 -12.615   5.014
  531    HA   ALA  64           HA       ALA  64 -10.409 -10.041   6.461
  532   1HB   ALA  64          1HB       ALA  64  -7.939 -10.172   6.312
  533   2HB   ALA  64          2HB       ALA  64  -8.634 -11.643   7.019
  534   3HB   ALA  64          3HB       ALA  64  -8.078 -11.649   5.333
  535    H    LEU  65           H        LEU  65 -10.797 -10.999   3.169
  536    HA   LEU  65           HA       LEU  65  -9.446  -8.719   1.965
  537   1HB   LEU  65          1HB       LEU  65 -10.044 -10.738   0.680
  538   2HB   LEU  65          2HB       LEU  65 -11.767 -10.319   0.921
  539    HG   LEU  65           HG       LEU  65 -11.101  -8.034  -0.072
  540   1HD1  LEU  65          1HD1      LEU  65  -9.250  -8.203  -1.763
  541   2HD1  LEU  65          2HD1      LEU  65  -8.625  -8.356  -0.117
  542   3HD1  LEU  65          3HD1      LEU  65  -8.822  -9.801  -1.122
  543   1HD2  LEU  65          1HD2      LEU  65 -11.509  -8.954  -2.340
  544   2HD2  LEU  65          2HD2      LEU  65 -11.362 -10.589  -1.622
  545   3HD2  LEU  65          3HD2      LEU  65 -12.639  -9.493  -1.078
  546    H    SER  66           H        SER  66 -12.901  -9.467   2.482
  547    HA   SER  66           HA       SER  66 -14.126  -7.112   1.999
  548   1HB   SER  66          1HB       SER  66 -15.840  -7.772   3.646
  549   2HB   SER  66          2HB       SER  66 -15.299  -9.157   2.679
  550    HG   SER  66           HG       SER  66 -13.966  -9.766   4.441
  551    H    LYS  67           H        LYS  67 -12.449  -7.815   5.072
  552    HA   LYS  67           HA       LYS  67 -13.085  -5.342   6.376
  553   1HB   LYS  67          1HB       LYS  67 -11.113  -7.605   6.784
  554   2HB   LYS  67          2HB       LYS  67 -10.910  -6.098   7.678
  555   1HG   LYS  67          1HG       LYS  67 -12.136  -7.666   9.010
  556   2HG   LYS  67          2HG       LYS  67 -13.131  -6.248   8.647
  557   1HD   LYS  67          1HD       LYS  67 -14.413  -7.491   6.994
  558   2HD   LYS  67          2HD       LYS  67 -13.286  -8.861   7.105
  559   1HE   LYS  67          1HE       LYS  67 -13.949  -9.238   9.456
  560   2HE   LYS  67          2HE       LYS  67 -15.062  -7.855   9.370
  561   1HZ   LYS  67          1HZ       LYS  67 -16.260  -9.876   8.947
  562   2HZ   LYS  67          2HZ       LYS  67 -15.265 -10.231   7.631
  563    H    LEU  68           H        LEU  68 -10.279  -6.340   4.356
  564    HA   LEU  68           HA       LEU  68  -8.892  -3.812   4.667
  565   1HB   LEU  68          1HB       LEU  68  -7.822  -6.016   4.383
  566   2HB   LEU  68          2HB       LEU  68  -8.530  -6.201   2.789
  567    HG   LEU  68           HG       LEU  68  -6.077  -5.575   3.101
  568   1HD1  LEU  68          1HD1      LEU  68  -5.958  -4.308   1.031
  569   2HD1  LEU  68          2HD1      LEU  68  -7.089  -5.671   0.914
  570   3HD1  LEU  68          3HD1      LEU  68  -7.700  -4.010   1.069
  571   1HD2  LEU  68          1HD2      LEU  68  -5.415  -3.296   3.220
  572   2HD2  LEU  68          2HD2      LEU  68  -7.075  -2.710   3.236
  573   3HD2  LEU  68          3HD2      LEU  68  -6.451  -3.625   4.625
  574    H    LEU  69           H        LEU  69 -11.464  -5.023   2.579
  575    HA   LEU  69           HA       LEU  69 -10.917  -3.163   0.459
  576   1HB   LEU  69          1HB       LEU  69 -11.938  -5.632   0.501
  577   2HB   LEU  69          2HB       LEU  69 -13.440  -4.825   0.910
  578    HG   LEU  69           HG       LEU  69 -13.329  -5.376  -1.352
  579   1HD1  LEU  69          1HD1      LEU  69 -13.820  -3.270  -2.448
  580   2HD1  LEU  69          2HD1      LEU  69 -14.373  -3.165  -0.759
  581   3HD1  LEU  69          3HD1      LEU  69 -12.858  -2.369  -1.262
  582   1HD2  LEU  69          1HD2      LEU  69 -11.674  -4.569  -2.966
  583   2HD2  LEU  69          2HD2      LEU  69 -10.811  -3.690  -1.699
  584   3HD2  LEU  69          3HD2      LEU  69 -10.876  -5.468  -1.662
  585    H    GLU  70           H        GLU  70 -13.539  -3.675   2.856
  586    HA   GLU  70           HA       GLU  70 -15.028  -1.400   2.219
  587   1HB   GLU  70          1HB       GLU  70 -16.324  -1.878   4.124
  588   2HB   GLU  70          2HB       GLU  70 -15.743  -3.414   3.502
  589   1HG   GLU  70          1HG       GLU  70 -15.500  -3.634   5.816
  590   2HG   GLU  70          2HG       GLU  70 -13.868  -3.287   5.247
  591    HE2  GLU  70           HE       GLU  70 -13.733  -0.957   7.813
  592    H    ARG  71           H        ARG  71 -12.346  -1.796   4.487
  593    HA   ARG  71           HA       ARG  71 -11.873   0.464   5.884
  594   1HB   ARG  71          1HB       ARG  71 -10.162  -1.009   5.913
  595   2HB   ARG  71          2HB       ARG  71 -10.259  -1.337   4.194
  596   1HG   ARG  71          1HG       ARG  71  -8.144  -0.327   4.828
  597   2HG   ARG  71          2HG       ARG  71  -8.994   0.551   3.584
  598   1HD   ARG  71          1HD       ARG  71  -9.667   1.620   6.232
  599   2HD   ARG  71          2HD       ARG  71  -7.932   1.564   6.011
  600    HE   ARG  71           HE       ARG  71  -9.749   3.402   4.830
  601   1HH1  ARG  71          1HH1      ARG  71  -6.867   1.556   3.846
  602   2HH1  ARG  71          2HH1      ARG  71  -6.432   2.710   2.605
  603   1HH2  ARG  71          1HH2      ARG  71  -9.136   4.863   3.250
  604   2HH2  ARG  71          2HH2      ARG  71  -7.716   4.596   2.258
  605    H    ILE  72           H        ILE  72 -11.509   0.291   2.301
  606    HA   ILE  72           HA       ILE  72 -10.390   2.941   2.293
  607    HB   ILE  72           HB       ILE  72 -11.261   1.335  -0.114
  608   1HG1  ILE  72          1HG1      ILE  72  -8.422   1.451   0.992
  609   2HG1  ILE  72          2HG1      ILE  72  -9.530   0.196   1.536
  610   1HG2  ILE  72          1HG2      ILE  72  -9.525   2.753  -1.242
  611   2HG2  ILE  72          2HG2      ILE  72 -10.773   3.767  -0.500
  612   3HG2  ILE  72          3HG2      ILE  72  -9.201   3.571   0.293
  613   1HD1  ILE  72          1HD1      ILE  72  -8.250  -0.687  -0.280
  614   2HD1  ILE  72          2HD1      ILE  72  -9.965  -0.571  -0.723
  615   3HD1  ILE  72          3HD1      ILE  72  -8.798   0.607  -1.367
  616    H    LYS  73           H        LYS  73 -13.311   1.890   0.438
  617    HA   LYS  73           HA       LYS  73 -14.431   4.331   0.102
  618   1HB   LYS  73          1HB       LYS  73 -16.616   3.155  -0.010
  619   2HB   LYS  73          2HB       LYS  73 -15.283   2.539  -0.970
  620   1HG   LYS  73          1HG       LYS  73 -14.970   0.852   1.128
  621   2HG   LYS  73          2HG       LYS  73 -16.649   1.312   1.421
  622   1HD   LYS  73          1HD       LYS  73 -16.666  -0.651   0.089
  623   2HD   LYS  73          2HD       LYS  73 -17.082   0.680  -1.016
  624   1HE   LYS  73          1HE       LYS  73 -14.623   0.673  -1.776
  625   2HE   LYS  73          2HE       LYS  73 -14.368  -0.700  -0.705
  626   1HZ   LYS  73          1HZ       LYS  73 -14.863  -1.448  -2.928
  627   2HZ   LYS  73          2HZ       LYS  73 -16.360  -0.671  -2.889
  628    H    GLN  74           H        GLN  74 -14.886   2.295   3.031
  629    HA   GLN  74           HA       GLN  74 -16.761   3.976   4.344
  630   1HB   GLN  74          1HB       GLN  74 -16.320   1.604   4.863
  631   2HB   GLN  74          2HB       GLN  74 -14.756   2.029   5.573
  632   1HG   GLN  74          1HG       GLN  74 -17.443   3.101   6.544
  633   2HG   GLN  74          2HG       GLN  74 -16.666   1.651   7.183
  634   1HE2  GLN  74          1HE2      GLN  74 -17.052   4.909   7.781
  635   2HE2  GLN  74          2HE2      GLN  74 -15.629   5.170   8.769
  636    H    GLY  75           H        GLY  75 -13.217   3.645   4.843
  637   1HA   GLY  75          1HA       GLY  75 -13.076   6.347   6.142
  638   2HA   GLY  75          2HA       GLY  75 -12.055   4.960   6.486
  639    HA   PRO  76           HA       PRO  76 -10.865   6.309   2.010
  640   1HB   PRO  76          1HB       PRO  76 -11.526   8.833   1.135
  641   2HB   PRO  76          2HB       PRO  76 -12.643   7.441   1.037
  642   1HG   PRO  76          1HG       PRO  76 -12.497   9.551   3.212
  643   2HG   PRO  76          2HG       PRO  76 -13.941   9.042   2.281
  644   1HD   PRO  76          1HD       PRO  76 -13.425   8.010   4.717
  645   2HD   PRO  76          2HD       PRO  76 -14.019   6.947   3.402
  646    HA   PRO  77           HA       PRO  77  -7.221   8.479   3.354
  647   1HB   PRO  77          1HB       PRO  77  -5.983   9.197   1.031
  648   2HB   PRO  77          2HB       PRO  77  -6.165   7.489   1.521
  649   1HG   PRO  77          1HG       PRO  77  -7.953   9.067  -0.357
  650   2HG   PRO  77          2HG       PRO  77  -7.197   7.479  -0.669
  651   1HD   PRO  77          1HD       PRO  77  -9.750   7.700   0.215
  652   2HD   PRO  77          2HD       PRO  77  -8.703   6.387   0.810
  653    H    ALA  78           H        ALA  78  -6.346  10.652   3.538
  654    HA   ALA  78           HA       ALA  78  -8.355  12.736   3.257
  655   1HB   ALA  78          1HB       ALA  78  -6.741  14.087   4.503
  656   2HB   ALA  78          2HB       ALA  78  -6.927  12.496   5.261
  657   3HB   ALA  78          3HB       ALA  78  -5.489  12.843   4.274
  658    H    ALA  79           H        ALA  79  -7.507  11.689   0.669
  659    HA   ALA  79           HA       ALA  79  -6.152  14.037  -0.562
  660   1HB   ALA  79          1HB       ALA  79  -5.084  12.419  -2.027
  661   2HB   ALA  79          2HB       ALA  79  -4.671  12.050  -0.335
  662   3HB   ALA  79          3HB       ALA  79  -5.885  11.076  -1.177
  663    H    GLU  80           H        GLU  80  -6.694  14.124  -2.900
  664    HA   GLU  80           HA       GLU  80  -9.544  13.625  -3.386
  665   1HB   GLU  80          1HB       GLU  80  -7.381  14.859  -5.147
  666   2HB   GLU  80          2HB       GLU  80  -9.117  14.807  -5.506
  667   1HG   GLU  80          1HG       GLU  80  -9.583  16.127  -3.457
  668   2HG   GLU  80          2HG       GLU  80  -7.844  16.241  -3.130
  669    HE2  GLU  80           HE       GLU  80  -7.245  18.392  -5.914
  670    H    VAL  81           H        VAL  81  -9.184  11.284  -3.066
  671    HA   VAL  81           HA       VAL  81  -8.135   9.641  -5.195
  672    HB   VAL  81           HB       VAL  81  -8.567   8.835  -2.947
  673   1HG1  VAL  81          1HG1      VAL  81 -11.549   8.878  -3.508
  674   2HG1  VAL  81          2HG1      VAL  81 -10.717   8.319  -2.061
  675   3HG1  VAL  81          3HG1      VAL  81 -10.717  10.042  -2.456
  676   1HG2  VAL  81          1HG2      VAL  81 -10.219   7.395  -5.070
  677   2HG2  VAL  81          2HG2      VAL  81  -8.461   7.264  -4.855
  678   3HG2  VAL  81          3HG2      VAL  81  -9.556   6.673  -3.591
  679    H    GLU  82           H        GLU  82  -8.729   9.609  -7.173
  680    HA   GLU  82           HA       GLU  82 -10.978  11.296  -7.933
  681   1HB   GLU  82          1HB       GLU  82  -8.684  11.680  -8.720
  682   2HB   GLU  82          2HB       GLU  82  -8.658  10.096  -9.505
  683   1HG   GLU  82          1HG       GLU  82  -9.080  11.829 -11.155
  684   2HG   GLU  82          2HG       GLU  82 -10.545  10.856 -10.996
  685    HE2  GLU  82           HE       GLU  82 -12.481  13.522  -9.879
  686    H    LYS  83           H        LYS  83  -9.799   7.974  -8.673
  687    HA   LYS  83           HA       LYS  83 -12.490   7.038  -9.127
  688   1HB   LYS  83          1HB       LYS  83 -12.210   6.419 -11.513
  689   2HB   LYS  83          2HB       LYS  83 -12.424   8.140 -11.189
  690   1HG   LYS  83          1HG       LYS  83 -10.018   8.557 -11.522
  691   2HG   LYS  83          2HG       LYS  83  -9.719   6.828 -11.717
  692   1HD   LYS  83          1HD       LYS  83  -9.724   7.830 -13.877
  693   2HD   LYS  83          2HD       LYS  83 -11.135   6.771 -13.734
  694   1HE   LYS  83          1HE       LYS  83 -12.593   8.744 -13.359
  695   2HE   LYS  83          2HE       LYS  83 -11.172   9.811 -13.399
  696   1HZ   LYS  83          1HZ       LYS  83 -12.213   9.766 -15.545
  697   2HZ   LYS  83          2HZ       LYS  83 -12.005   8.094 -15.650
  698    H    VAL  84           H        VAL  84 -11.474   5.861  -7.416
  699    HA   VAL  84           HA       VAL  84  -9.429   3.915  -7.959
  700    HB   VAL  84           HB       VAL  84  -9.645   4.783  -5.791
  701   1HG1  VAL  84          1HG1      VAL  84 -12.397   3.520  -5.459
  702   2HG1  VAL  84          2HG1      VAL  84 -11.429   4.323  -4.220
  703   3HG1  VAL  84          3HG1      VAL  84 -12.049   5.256  -5.585
  704   1HG2  VAL  84          1HG2      VAL  84 -10.462   1.852  -5.666
  705   2HG2  VAL  84          2HG2      VAL  84  -8.872   2.426  -6.186
  706   3HG2  VAL  84          3HG2      VAL  84  -9.433   2.750  -4.533
  707    H    ASP  85           H        ASP  85 -10.014   2.790  -9.786
  708    HA   ASP  85           HA       ASP  85 -12.484   1.163  -9.810
  709   1HB   ASP  85          1HB       ASP  85 -11.999   2.530 -11.744
  710   2HB   ASP  85          2HB       ASP  85 -10.385   1.827 -11.901
  711    HD2  ASP  85           HD       ASP  85 -13.552  -0.614 -12.720
  712    H    TYR  86           H        TYR  86 -11.695  -0.317  -8.065
  713    HA   TYR  86           HA       TYR  86  -9.216  -1.701  -8.554
  714   1HB   TYR  86          1HB       TYR  86  -9.429  -2.684  -6.488
  715   2HB   TYR  86          2HB       TYR  86 -10.253  -1.152  -6.249
  716    HD1  TYR  86           1HD      TYR  86 -10.514  -4.816  -6.306
  717    HD2  TYR  86           2HD      TYR  86 -12.801  -1.159  -6.116
  718    HE1  TYR  86           1HE      TYR  86 -12.481  -6.085  -5.524
  719    HE2  TYR  86           2HE      TYR  86 -14.752  -2.432  -5.272
  720    HH   TYR  86           HH       TYR  86 -15.578  -4.496  -4.677
  721    H    SER  87           H        SER  87  -9.070  -4.112  -8.544
  722    HA   SER  87           HA       SER  87 -11.383  -5.567  -9.619
  723   1HB   SER  87          1HB       SER  87  -8.675  -5.515 -11.021
  724   2HB   SER  87          2HB       SER  87 -10.082  -6.495 -11.479
  725    HG   SER  87           HG       SER  87 -11.178  -4.352 -11.626
  726    H    PHE  88           H        PHE  88 -11.431  -7.636  -8.905
  727    HA   PHE  88           HA       PHE  88  -9.293  -8.658  -7.149
  728   1HB   PHE  88          1HB       PHE  88 -11.121  -9.289  -6.082
  729   2HB   PHE  88          2HB       PHE  88 -12.170  -8.920  -7.418
  730    HD1  PHE  88           1HD      PHE  88  -9.643 -11.576  -6.514
  731    HD2  PHE  88           2HD      PHE  88 -13.456 -10.675  -8.300
  732    HE1  PHE  88           1HE      PHE  88 -10.037 -13.997  -6.887
  733    HE2  PHE  88           2HE      PHE  88 -13.849 -13.092  -8.668
  734    HZ   PHE  88           HZ       PHE  88 -12.147 -14.759  -7.956
  735    H    SER  89           H        SER  89  -7.832 -10.210  -7.844
  736    HA   SER  89           HA       SER  89  -8.487 -11.800 -10.278
  737   1HB   SER  89          1HB       SER  89  -5.723 -10.773  -9.695
  738   2HB   SER  89          2HB       SER  89  -6.334 -11.534 -11.167
  739    HG   SER  89           HG       SER  89  -7.796  -9.681 -11.302
  740    H    GLU  90           H        GLU  90  -6.753 -13.630 -10.443
  741    HA   GLU  90           HA       GLU  90  -6.535 -15.057  -7.857
  742   1HB   GLU  90          1HB       GLU  90  -6.051 -15.895 -10.751
  743   2HB   GLU  90          2HB       GLU  90  -5.696 -16.900  -9.340
  744   1HG   GLU  90          1HG       GLU  90  -7.828 -17.562 -10.169
  745   2HG   GLU  90          2HG       GLU  90  -8.054 -16.753  -8.608
  746    HE2  GLU  90           HE       GLU  90  -9.280 -14.840 -12.001
  747    H    TYR  91           H        TYR  91  -4.543 -15.490  -6.907
  748    HA   TYR  91           HA       TYR  91  -2.528 -13.548  -7.353
  749   1HB   TYR  91          1HB       TYR  91  -1.531 -14.471  -5.437
  750   2HB   TYR  91          2HB       TYR  91  -3.264 -14.624  -5.171
  751    HD1  TYR  91           1HD      TYR  91  -4.359 -16.954  -5.564
  752    HD2  TYR  91           2HD      TYR  91  -0.088 -16.354  -5.420
  753    HE1  TYR  91           1HE      TYR  91  -4.016 -19.395  -5.482
  754    HE2  TYR  91           2HE      TYR  91   0.246 -18.798  -5.293
  755    HH   TYR  91           HH       TYR  91  -0.756 -20.866  -5.252
  756    H    LYS  92           H        LYS  92  -0.555 -13.634  -8.235
  757    HA   LYS  92           HA       LYS  92   0.069 -15.751 -10.163
  758   1HB   LYS  92          1HB       LYS  92   0.426 -13.432 -10.705
  759   2HB   LYS  92          2HB       LYS  92   1.558 -13.240  -9.351
  760   1HG   LYS  92          1HG       LYS  92   3.151 -14.752 -10.361
  761   2HG   LYS  92          2HG       LYS  92   1.943 -15.361 -11.504
  762   1HD   LYS  92          1HD       LYS  92   3.427 -13.920 -12.680
  763   2HD   LYS  92          2HD       LYS  92   1.823 -13.168 -12.601
  764   1HE   LYS  92          1HE       LYS  92   2.609 -11.690 -10.748
  765   2HE   LYS  92          2HE       LYS  92   4.203 -12.474 -10.800
  766   1HZ   LYS  92          1HZ       LYS  92   4.239 -10.465 -12.090
  767   2HZ   LYS  92          2HZ       LYS  92   3.003 -11.044 -13.085
  768    H    GLY  93           H        GLY  93   1.510 -14.333  -7.178
  769   1HA   GLY  93          1HA       GLY  93   2.462 -16.914  -6.242
  770   2HA   GLY  93          2HA       GLY  93   3.742 -15.770  -6.710
  771    H    GLU  94           H        GLU  94   3.961 -16.268  -4.225
  772    HA   GLU  94           HA       GLU  94   2.256 -14.700  -2.456
  773   1HB   GLU  94          1HB       GLU  94   3.770 -15.418  -0.695
  774   2HB   GLU  94          2HB       GLU  94   2.967 -16.724  -1.570
  775   1HG   GLU  94          1HG       GLU  94   5.026 -17.211  -2.832
  776   2HG   GLU  94          2HG       GLU  94   5.880 -15.912  -1.980
  777    HE2  GLU  94           HE       GLU  94   5.860 -17.680   1.127
  778    H    PHE  95           H        PHE  95   2.382 -12.585  -2.772
  779    HA   PHE  95           HA       PHE  95   4.865 -11.122  -3.270
  780   1HB   PHE  95          1HB       PHE  95   2.103 -10.131  -2.472
  781   2HB   PHE  95          2HB       PHE  95   3.418  -9.187  -3.134
  782    HD1  PHE  95           1HD      PHE  95   0.777  -8.921  -4.244
  783    HD2  PHE  95           2HD      PHE  95   3.863 -11.762  -5.282
  784    HE1  PHE  95           1HE      PHE  95  -0.245  -9.237  -6.472
  785    HE2  PHE  95           2HE      PHE  95   2.792 -12.126  -7.459
  786    HZ   PHE  95           HZ       PHE  95   0.740 -10.872  -8.076
  787    H    GLU  96           H        GLU  96   5.844 -12.261  -1.303
  788    HA   GLU  96           HA       GLU  96   4.912 -12.211   1.224
  789   1HB   GLU  96          1HB       GLU  96   7.815 -12.000   0.345
  790   2HB   GLU  96          2HB       GLU  96   7.280 -12.415   1.984
  791   1HG   GLU  96          1HG       GLU  96   6.007 -14.352   1.080
  792   2HG   GLU  96          2HG       GLU  96   6.648 -14.009  -0.535
  793    HE2  GLU  96           HE       GLU  96   9.953 -14.997   0.298
  794    H    ASP  97           H        ASP  97   4.516 -10.810   2.779
  795    HA   ASP  97           HA       ASP  97   4.383  -8.975   4.058
  796   1HB   ASP  97          1HB       ASP  97   6.996  -8.018   2.815
  797   2HB   ASP  97          2HB       ASP  97   6.186  -7.340   4.221
  798    HD2  ASP  97           HD       ASP  97   8.170 -10.845   4.584
  799    H    PHE  98           H        PHE  98   4.230  -6.399   3.817
  800    HA   PHE  98           HA       PHE  98   3.133  -5.763   1.109
  801   1HB   PHE  98          1HB       PHE  98   1.434  -6.366   2.895
  802   2HB   PHE  98          2HB       PHE  98   1.863  -4.871   3.699
  803    HD1  PHE  98           1HD      PHE  98   2.148  -3.040   1.169
  804    HD2  PHE  98           2HD      PHE  98  -0.788  -5.970   2.375
  805    HE1  PHE  98           1HE      PHE  98   0.446  -1.891  -0.153
  806    HE2  PHE  98           2HE      PHE  98  -2.512  -4.742   1.096
  807    HZ   PHE  98           HZ       PHE  98  -1.891  -2.723  -0.214
  808    H    GLU  99           H        GLU  99   5.084  -4.664   0.574
  809    HA   GLU  99           HA       GLU  99   5.797  -2.344   2.316
  810   1HB   GLU  99          1HB       GLU  99   7.491  -3.974   2.066
  811   2HB   GLU  99          2HB       GLU  99   7.457  -3.836   0.306
  812   1HG   GLU  99          1HG       GLU  99   8.171  -1.486   0.439
  813   2HG   GLU  99          2HG       GLU  99   7.992  -1.492   2.198
  814    HE2  GLU  99           HE       GLU  99  11.031  -3.231   2.703
  815    H    THR 100           H        THR 100   6.321  -0.346   1.291
  816    HA   THR 100           HA       THR 100   4.624   0.229  -1.051
  817    HB   THR 100           HB       THR 100   4.124   2.211  -0.054
  818    HG1  THR 100           1HG      THR 100   5.402   3.218   1.474
  819   1HG2  THR 100          1HG2      THR 100   3.542   1.751   2.255
  820   2HG2  THR 100          2HG2      THR 100   3.424   0.203   1.381
  821   3HG2  THR 100          3HG2      THR 100   4.822   0.550   2.422
  822    H    TYR 101           H        TYR 101   5.389   1.500  -2.789
  823    HA   TYR 101           HA       TYR 101   8.189   2.572  -2.710
  824   1HB   TYR 101          1HB       TYR 101   5.958   3.069  -4.691
  825   2HB   TYR 101          2HB       TYR 101   7.561   3.763  -4.759
  826    HD1  TYR 101           1HD      TYR 101   8.497   0.646  -3.807
  827    HD2  TYR 101           2HD      TYR 101   6.511   2.499  -7.146
  828    HE1  TYR 101           1HE      TYR 101   9.612  -0.933  -5.339
  829    HE2  TYR 101           2HE      TYR 101   7.795   1.062  -8.693
  830    HH   TYR 101           HH       TYR 101   9.279  -0.688  -8.897
  Start of MODEL   20
    1   1H    GLY  -1          1H        GLY  -1 -18.557 -41.469  17.838
    2   2H    GLY  -1          2H        GLY  -1 -18.952 -39.864  17.852
    3   3H    GLY  -1          3H        GLY  -1 -19.500 -40.831  16.640
    4   1HA   GLY  -1          1HA       GLY  -1 -16.692 -40.168  17.152
    5   2HA   GLY  -1          2HA       GLY  -1 -17.293 -41.190  15.831
    6    H    SER   0           H        SER   0 -15.790 -39.196  14.988
    7    HA   SER   0           HA       SER   0 -17.585 -37.444  13.499
    8   1HB   SER   0          1HB       SER   0 -17.390 -36.155  15.581
    9   2HB   SER   0          2HB       SER   0 -15.621 -36.293  15.537
   10    HG   SER   0           HG       SER   0 -15.667 -35.125  13.589
   11    H    MET   1           H        MET   1 -16.379 -39.286  12.252
   12    HA   MET   1           HA       MET   1 -13.579 -38.728  11.600
   13   1HB   MET   1          1HB       MET   1 -15.510 -40.732  10.363
   14   2HB   MET   1          2HB       MET   1 -13.745 -40.689  10.198
   15   1HG   MET   1          1HG       MET   1 -15.367 -41.287  12.697
   16   2HG   MET   1          2HG       MET   1 -14.351 -42.395  11.779
   17   1HE   MET   1          1HE       MET   1 -14.370 -41.902  15.000
   18   2HE   MET   1          2HE       MET   1 -12.627 -42.079  15.303
   19   3HE   MET   1          3HE       MET   1 -13.443 -43.167  14.157
   20    H    LYS   2           H        LYS   2 -14.268 -36.458  11.015
   21    HA   LYS   2           HA       LYS   2 -15.611 -36.038   8.475
   22   1HB   LYS   2          1HB       LYS   2 -13.966 -34.180  10.222
   23   2HB   LYS   2          2HB       LYS   2 -14.942 -33.695   8.817
   24   1HG   LYS   2          1HG       LYS   2 -16.947 -34.746   9.970
   25   2HG   LYS   2          2HG       LYS   2 -15.955 -34.919  11.422
   26   1HD   LYS   2          1HD       LYS   2 -16.648 -32.286  10.033
   27   2HD   LYS   2          2HD       LYS   2 -17.437 -32.960  11.460
   28   1HE   LYS   2          1HE       LYS   2 -15.978 -31.353  12.328
   29   2HE   LYS   2          2HE       LYS   2 -15.166 -32.896  12.641
   30   1HZ   LYS   2          1HZ       LYS   2 -13.611 -31.331  11.724
   31   2HZ   LYS   2          2HZ       LYS   2 -14.562 -31.140  10.341
   32    H    LYS   3           H        LYS   3 -14.643 -36.676   6.624
   33    HA   LYS   3           HA       LYS   3 -11.721 -36.201   6.193
   34   1HB   LYS   3          1HB       LYS   3 -13.523 -38.456   5.238
   35   2HB   LYS   3          2HB       LYS   3 -11.873 -38.174   4.653
   36   1HG   LYS   3          1HG       LYS   3 -10.996 -38.541   6.946
   37   2HG   LYS   3          2HG       LYS   3 -12.651 -38.745   7.544
   38   1HD   LYS   3          1HD       LYS   3 -11.827 -40.927   7.312
   39   2HD   LYS   3          2HD       LYS   3 -12.924 -40.690   5.943
   40   1HE   LYS   3          1HE       LYS   3 -10.938 -40.282   4.463
   41   2HE   LYS   3          2HE       LYS   3  -9.871 -40.514   5.867
   42   1HZ   LYS   3          1HZ       LYS   3 -10.068 -42.569   4.677
   43   2HZ   LYS   3          2HZ       LYS   3 -11.746 -42.565   4.871
   44    H    TRP   4           H        TRP   4 -11.170 -35.779   3.991
   45    HA   TRP   4           HA       TRP   4 -11.300 -34.964   1.928
   46   1HB   TRP   4          1HB       TRP   4 -14.306 -35.329   1.987
   47   2HB   TRP   4          2HB       TRP   4 -13.322 -34.892   0.604
   48    HD1  TRP   4           HD       TRP   4 -11.485 -36.705  -0.227
   49    HE1  TRP   4           1HE      TRP   4 -11.475 -39.289  -0.167
   50    HE3  TRP   4           3HE      TRP   4 -15.242 -37.489   3.179
   51    HZ2  TRP   4           2HZ      TRP   4 -12.798 -41.375   1.253
   52    HZ3  TRP   4           3HZ      TRP   4 -15.788 -39.785   3.909
   53    HH2  TRP   4           HH       TRP   4 -14.559 -41.732   2.980
   54    H    SER   5           H        SER   5 -11.424 -32.964   0.921
   55    HA   SER   5           HA       SER   5 -11.688 -30.760   2.819
   56   1HB   SER   5          1HB       SER   5 -10.421 -29.515   1.195
   57   2HB   SER   5          2HB       SER   5  -9.706 -31.124   1.319
   58    HG   SER   5           HG       SER   5 -10.907 -31.675  -0.589
   59    H    ASP   6           H        ASP   6 -12.321 -28.580   1.414
   60    HA   ASP   6           HA       ASP   6 -15.122 -28.729   0.735
   61   1HB   ASP   6          1HB       ASP   6 -14.201 -26.773   1.864
   62   2HB   ASP   6          2HB       ASP   6 -13.048 -26.512   0.550
   63    HD2  ASP   6           HD       ASP   6 -15.335 -24.259  -0.742
   64    H    THR   7           H        THR   7 -14.697 -30.462  -0.847
   65    HA   THR   7           HA       THR   7 -14.586 -31.336  -2.887
   66    HB   THR   7           HB       THR   7 -14.457 -28.510  -4.034
   67    HG1  THR   7           1HG      THR   7 -16.687 -28.833  -4.217
   68   1HG2  THR   7          1HG2      THR   7 -15.388 -29.605  -6.039
   69   2HG2  THR   7          2HG2      THR   7 -13.783 -30.249  -5.659
   70   3HG2  THR   7          3HG2      THR   7 -15.236 -31.192  -5.258
   71    H    GLU   8           H        GLU   8 -12.428 -28.527  -3.418
   72    HA   GLU   8           HA       GLU   8  -9.974 -29.823  -2.947
   73   1HB   GLU   8          1HB       GLU   8 -11.147 -30.493  -5.539
   74   2HB   GLU   8          2HB       GLU   8  -9.696 -29.530  -5.784
   75   1HG   GLU   8          1HG       GLU   8  -8.361 -31.032  -4.417
   76   2HG   GLU   8          2HG       GLU   8  -9.786 -32.003  -4.016
   77    HE2  GLU   8           HE       GLU   8  -7.804 -32.796  -7.334
   78    H    VAL   9           H        VAL   9  -9.228 -27.981  -2.078
   79    HA   VAL   9           HA       VAL   9  -9.514 -25.402  -3.541
   80    HB   VAL   9           HB       VAL   9  -8.974 -24.368  -1.366
   81   1HG1  VAL   9          1HG1      VAL   9 -11.352 -26.264  -1.272
   82   2HG1  VAL   9          2HG1      VAL   9 -11.157 -24.760  -0.351
   83   3HG1  VAL   9          3HG1      VAL   9 -11.309 -24.703  -2.116
   84   1HG2  VAL   9          1HG2      VAL   9  -9.244 -27.166  -0.172
   85   2HG2  VAL   9          2HG2      VAL   9  -7.730 -26.241  -0.290
   86   3HG2  VAL   9          3HG2      VAL   9  -9.060 -25.639   0.706
   87    H    PHE  10           H        PHE  10  -7.764 -24.167  -4.022
   88    HA   PHE  10           HA       PHE  10  -5.032 -25.311  -3.613
   89   1HB   PHE  10          1HB       PHE  10  -6.080 -24.116  -6.206
   90   2HB   PHE  10          2HB       PHE  10  -4.520 -24.875  -5.922
   91    HD1  PHE  10           1HD      PHE  10  -4.538 -27.410  -5.248
   92    HD2  PHE  10           2HD      PHE  10  -7.924 -25.387  -6.999
   93    HE1  PHE  10           1HE      PHE  10  -5.466 -29.589  -5.991
   94    HE2  PHE  10           2HE      PHE  10  -8.840 -27.564  -7.736
   95    HZ   PHE  10           HZ       PHE  10  -7.591 -29.661  -7.279
   96    H    GLU  11           H        GLU  11  -6.922 -22.505  -4.752
   97    HA   GLU  11           HA       GLU  11  -4.808 -20.602  -4.130
   98   1HB   GLU  11          1HB       GLU  11  -6.453 -18.908  -4.806
   99   2HB   GLU  11          2HB       GLU  11  -5.997 -20.070  -6.045
  100   1HG   GLU  11          1HG       GLU  11  -8.593 -20.362  -4.467
  101   2HG   GLU  11          2HG       GLU  11  -8.436 -19.347  -5.895
  102    HE2  GLU  11           HE       GLU  11  -8.828 -23.280  -6.340
  103    H    MET  12           H        MET  12  -4.357 -20.442  -2.025
  104    HA   MET  12           HA       MET  12  -6.129 -20.644   0.160
  105   1HB   MET  12          1HB       MET  12  -3.517 -19.086  -0.092
  106   2HB   MET  12          2HB       MET  12  -4.314 -19.517   1.424
  107   1HG   MET  12          1HG       MET  12  -3.200 -21.476  -0.633
  108   2HG   MET  12          2HG       MET  12  -2.456 -21.037   0.901
  109   1HE   MET  12          1HE       MET  12  -3.278 -24.060  -0.356
  110   2HE   MET  12          2HE       MET  12  -3.533 -24.823   1.230
  111   3HE   MET  12          3HE       MET  12  -2.177 -23.697   0.997
  112    H    LEU  13           H        LEU  13  -5.240 -17.836  -1.826
  113    HA   LEU  13           HA       LEU  13  -7.489 -16.286  -0.706
  114   1HB   LEU  13          1HB       LEU  13  -6.015 -14.314  -0.463
  115   2HB   LEU  13          2HB       LEU  13  -5.656 -15.626   0.663
  116    HG   LEU  13           HG       LEU  13  -3.686 -16.277  -0.698
  117   1HD1  LEU  13          1HD1      LEU  13  -2.818 -14.492  -2.274
  118   2HD1  LEU  13          2HD1      LEU  13  -4.202 -15.387  -2.906
  119   3HD1  LEU  13          3HD1      LEU  13  -4.433 -13.755  -2.239
  120   1HD2  LEU  13          1HD2      LEU  13  -2.315 -14.453   0.136
  121   2HD2  LEU  13          2HD2      LEU  13  -3.708 -13.366   0.182
  122   3HD2  LEU  13          3HD2      LEU  13  -3.623 -14.737   1.296
  123    H    LYS  14           H        LYS  14  -7.434 -14.055  -2.043
  124    HA   LYS  14           HA       LYS  14  -6.841 -14.665  -4.915
  125   1HB   LYS  14          1HB       LYS  14  -8.801 -13.690  -5.574
  126   2HB   LYS  14          2HB       LYS  14  -9.212 -14.675  -4.176
  127   1HG   LYS  14          1HG       LYS  14 -10.340 -12.842  -3.553
  128   2HG   LYS  14          2HG       LYS  14  -8.772 -12.317  -2.909
  129   1HD   LYS  14          1HD       LYS  14  -8.410 -11.045  -5.060
  130   2HD   LYS  14          2HD       LYS  14 -10.000 -11.586  -5.617
  131   1HE   LYS  14          1HE       LYS  14 -11.031 -10.477  -3.631
  132   2HE   LYS  14          2HE       LYS  14  -9.414  -9.922  -3.128
  133   1HZ   LYS  14          1HZ       LYS  14 -10.525  -8.205  -4.365
  134   2HZ   LYS  14          2HZ       LYS  14 -10.631  -9.215  -5.713
  135    H    ARG  15           H        ARG  15  -6.392 -12.745  -6.232
  136    HA   ARG  15           HA       ARG  15  -4.613 -10.821  -4.826
  137   1HB   ARG  15          1HB       ARG  15  -4.879 -11.695  -7.690
  138   2HB   ARG  15          2HB       ARG  15  -4.147 -10.141  -7.265
  139   1HG   ARG  15          1HG       ARG  15  -2.567 -11.253  -5.741
  140   2HG   ARG  15          2HG       ARG  15  -3.239 -12.827  -6.183
  141   1HD   ARG  15          1HD       ARG  15  -1.156 -12.369  -7.329
  142   2HD   ARG  15          2HD       ARG  15  -2.474 -12.447  -8.518
  143    HE   ARG  15           HE       ARG  15  -2.526  -9.920  -8.377
  144   1HH1  ARG  15          2HH1      ARG  15   0.561 -11.691  -8.003
  145   2HH1  ARG  15          1HH1      ARG  15   1.494 -10.367  -8.640
  146   1HH2  ARG  15          1HH2      ARG  15  -1.267  -8.242  -9.176
  147   2HH2  ARG  15          2HH2      ARG  15   0.465  -8.409  -9.297
  148    H    MET  16           H        MET  16  -5.757  -9.097  -4.006
  149    HA   MET  16           HA       MET  16  -7.803  -7.720  -5.648
  150   1HB   MET  16          1HB       MET  16  -7.673  -6.125  -3.798
  151   2HB   MET  16          2HB       MET  16  -8.441  -7.669  -3.437
  152   1HG   MET  16          1HG       MET  16  -6.520  -8.409  -2.170
  153   2HG   MET  16          2HG       MET  16  -5.607  -6.986  -2.673
  154   1HE   MET  16          1HE       MET  16  -6.326  -4.596  -2.312
  155   2HE   MET  16          2HE       MET  16  -7.056  -4.041  -0.799
  156   3HE   MET  16          3HE       MET  16  -8.089  -4.579  -2.134
  157    H    TYR  17           H        TYR  17  -6.708  -6.942  -7.415
  158    HA   TYR  17           HA       TYR  17  -4.209  -5.372  -7.067
  159   1HB   TYR  17          1HB       TYR  17  -4.219  -6.997  -8.893
  160   2HB   TYR  17          2HB       TYR  17  -5.696  -6.305  -9.553
  161    HD1  TYR  17           1HD      TYR  17  -2.284  -5.140  -8.450
  162    HD2  TYR  17           2HD      TYR  17  -5.416  -4.807 -11.389
  163    HE1  TYR  17           1HE      TYR  17  -0.992  -3.401  -9.636
  164    HE2  TYR  17           2HE      TYR  17  -4.156  -3.028 -12.536
  165    HH   TYR  17           HH       TYR  17  -2.141  -1.907 -12.683
  166    H    ALA  18           H        ALA  18  -4.959  -3.561  -5.991
  167    HA   ALA  18           HA       ALA  18  -7.317  -2.193  -7.132
  168   1HB   ALA  18          1HB       ALA  18  -7.415  -1.008  -5.025
  169   2HB   ALA  18          2HB       ALA  18  -7.481  -2.777  -4.830
  170   3HB   ALA  18          3HB       ALA  18  -5.974  -1.899  -4.456
  171    H    ARG  19           H        ARG  19  -6.820  -0.915  -8.666
  172    HA   ARG  19           HA       ARG  19  -4.443   0.806  -8.652
  173   1HB   ARG  19          1HB       ARG  19  -6.641   0.187 -10.648
  174   2HB   ARG  19          2HB       ARG  19  -5.632   1.616 -10.862
  175   1HG   ARG  19          1HG       ARG  19  -4.464  -1.125 -10.466
  176   2HG   ARG  19          2HG       ARG  19  -4.814  -0.456 -12.067
  177   1HD   ARG  19          1HD       ARG  19  -3.258   1.386 -10.302
  178   2HD   ARG  19          2HD       ARG  19  -2.456  -0.143 -10.666
  179    HE   ARG  19           HE       ARG  19  -3.339   0.784 -13.115
  180   1HH1  ARG  19          1HH1      ARG  19  -1.285   2.062 -10.519
  181   2HH1  ARG  19          2HH1      ARG  19  -0.345   3.080 -11.570
  182   1HH2  ARG  19          1HH2      ARG  19  -2.052   2.079 -14.519
  183   2HH2  ARG  19          2HH2      ARG  19  -0.758   3.051 -13.869
  184    H    VAL  20           H        VAL  20  -4.546   2.425  -7.239
  185    HA   VAL  20           HA       VAL  20  -7.137   3.812  -6.763
  186    HB   VAL  20           HB       VAL  20  -4.590   4.014  -5.138
  187   1HG1  VAL  20          1HG1      VAL  20  -7.495   4.674  -4.486
  188   2HG1  VAL  20          2HG1      VAL  20  -6.088   4.965  -3.460
  189   3HG1  VAL  20          3HG1      VAL  20  -6.286   5.883  -4.953
  190   1HG2  VAL  20          1HG2      VAL  20  -6.970   2.133  -4.887
  191   2HG2  VAL  20          2HG2      VAL  20  -5.250   1.715  -4.978
  192   3HG2  VAL  20          3HG2      VAL  20  -5.899   2.506  -3.539
  193    H    TYR  21           H        TYR  21  -7.448   5.468  -8.156
  194    HA   TYR  21           HA       TYR  21  -5.120   7.036  -9.151
  195   1HB   TYR  21          1HB       TYR  21  -7.997   6.818 -10.060
  196   2HB   TYR  21          2HB       TYR  21  -6.796   7.811 -10.825
  197    HD1  TYR  21           1HD      TYR  21  -8.317   5.987 -12.432
  198    HD2  TYR  21           2HD      TYR  21  -4.722   5.150 -10.197
  199    HE1  TYR  21           1HE      TYR  21  -7.795   4.106 -13.954
  200    HE2  TYR  21           2HE      TYR  21  -4.142   3.400 -11.784
  201    HH   TYR  21           HH       TYR  21  -4.881   2.072 -13.521
  202    H    GLY  22           H        GLY  22  -4.855   9.144  -8.816
  203   1HA   GLY  22          1HA       GLY  22  -6.471  11.192  -8.790
  204   2HA   GLY  22          2HA       GLY  22  -6.786  10.608  -7.137
  205    H    LEU  23           H        LEU  23  -6.000  12.546  -6.275
  206    HA   LEU  23           HA       LEU  23  -3.207  13.298  -6.646
  207   1HB   LEU  23          1HB       LEU  23  -5.240  14.818  -6.322
  208   2HB   LEU  23          2HB       LEU  23  -5.163  14.364  -4.615
  209    HG   LEU  23           HG       LEU  23  -2.699  15.254  -4.722
  210   1HD1  LEU  23          1HD1      LEU  23  -2.302  16.959  -6.465
  211   2HD1  LEU  23          2HD1      LEU  23  -2.474  15.355  -7.188
  212   3HD1  LEU  23          3HD1      LEU  23  -3.820  16.510  -7.266
  213   1HD2  LEU  23          1HD2      LEU  23  -3.460  17.561  -4.370
  214   2HD2  LEU  23          2HD2      LEU  23  -5.016  17.181  -5.137
  215   3HD2  LEU  23          3HD2      LEU  23  -4.575  16.421  -3.592
  216    H    VAL  24           H        VAL  24  -4.056  10.619  -5.444
  217    HA   VAL  24           HA       VAL  24  -3.339  10.705  -2.626
  218    HB   VAL  24           HB       VAL  24  -3.702   8.245  -2.798
  219   1HG1  VAL  24          1HG1      VAL  24  -5.921   9.991  -3.941
  220   2HG1  VAL  24          2HG1      VAL  24  -6.122   8.343  -3.312
  221   3HG1  VAL  24          3HG1      VAL  24  -5.601   9.643  -2.231
  222   1HG2  VAL  24          1HG2      VAL  24  -4.629   8.708  -5.656
  223   2HG2  VAL  24          2HG2      VAL  24  -2.988   8.155  -5.282
  224   3HG2  VAL  24          3HG2      VAL  24  -4.384   7.185  -4.788
  225    H    GLN  25           H        GLN  25  -1.206  11.698  -4.295
  226    HA   GLN  25           HA       GLN  25   0.746   9.513  -4.478
  227   1HB   GLN  25          1HB       GLN  25   0.136  11.568  -6.157
  228   2HB   GLN  25          2HB       GLN  25   1.560  12.209  -5.325
  229   1HG   GLN  25          1HG       GLN  25   2.270  10.979  -7.250
  230   2HG   GLN  25          2HG       GLN  25   2.762  10.069  -5.817
  231   1HE2  GLN  25          1HE2      GLN  25   2.538   7.879  -6.272
  232   2HE2  GLN  25          2HE2      GLN  25   1.262   7.185  -7.265
  233    H    GLY  26           H        GLY  26   1.640   9.066  -2.598
  234   1HA   GLY  26          1HA       GLY  26   2.732   9.234  -0.584
  235   2HA   GLY  26          2HA       GLY  26   3.588  10.590  -1.334
  236    H    VAL  27           H        VAL  27   0.157  10.171  -0.296
  237    HA   VAL  27           HA       VAL  27   0.482  12.161   1.852
  238    HB   VAL  27           HB       VAL  27   0.077  13.647   0.090
  239   1HG1  VAL  27          1HG1      VAL  27  -2.162  11.852  -0.891
  240   2HG1  VAL  27          2HG1      VAL  27  -1.965  13.554  -1.363
  241   3HG1  VAL  27          3HG1      VAL  27  -0.710  12.375  -1.740
  242   1HG2  VAL  27          1HG2      VAL  27  -2.591  13.209   1.480
  243   2HG2  VAL  27          2HG2      VAL  27  -1.192  14.056   2.162
  244   3HG2  VAL  27          3HG2      VAL  27  -2.009  14.701   0.732
  245    H    GLY  28           H        GLY  28   0.074  10.611   3.321
  246   1HA   GLY  28          1HA       GLY  28  -1.236   9.540   4.833
  247   2HA   GLY  28          2HA       GLY  28  -2.669  10.094   3.958
  248    H    PHE  29           H        PHE  29  -2.983   8.986   1.831
  249    HA   PHE  29           HA       PHE  29  -4.089   6.636   1.894
  250   1HB   PHE  29          1HB       PHE  29  -4.170   8.005  -0.067
  251   2HB   PHE  29          2HB       PHE  29  -2.435   7.894  -0.314
  252    HD1  PHE  29           1HD      PHE  29  -5.415   5.599  -0.017
  253    HD2  PHE  29           2HD      PHE  29  -1.622   6.395  -1.919
  254    HE1  PHE  29           1HE      PHE  29  -5.539   3.421  -1.194
  255    HE2  PHE  29           2HE      PHE  29  -1.762   4.219  -3.081
  256    HZ   PHE  29           HZ       PHE  29  -3.737   2.774  -2.781
  257    H    ARG  30           H        ARG  30  -0.710   6.666   0.603
  258    HA   ARG  30           HA       ARG  30  -0.615   3.882   0.349
  259   1HB   ARG  30          1HB       ARG  30   1.739   4.142  -0.145
  260   2HB   ARG  30          2HB       ARG  30   0.740   5.360  -0.930
  261   1HG   ARG  30          1HG       ARG  30   2.391   6.737  -0.240
  262   2HG   ARG  30          2HG       ARG  30   1.408   6.827   1.225
  263   1HD   ARG  30          1HD       ARG  30   2.873   4.933   2.159
  264   2HD   ARG  30          2HD       ARG  30   3.870   5.113   0.699
  265    HE   ARG  30           HE       ARG  30   3.566   7.665   1.868
  266   1HH1  ARG  30          1HH1      ARG  30   5.188   4.568   2.562
  267   2HH1  ARG  30          2HH1      ARG  30   6.366   5.296   3.619
  268   1HH2  ARG  30          1HH2      ARG  30   5.155   8.594   3.216
  269   2HH2  ARG  30          2HH2      ARG  30   6.370   7.595   3.968
  270    H    LYS  31           H        LYS  31   0.132   5.888   3.154
  271    HA   LYS  31           HA       LYS  31   1.294   3.719   4.670
  272   1HB   LYS  31          1HB       LYS  31   1.537   6.398   4.818
  273   2HB   LYS  31          2HB       LYS  31   0.237   6.196   5.992
  274   1HG   LYS  31          1HG       LYS  31   2.958   4.792   6.038
  275   2HG   LYS  31          2HG       LYS  31   2.514   6.232   6.958
  276   1HD   LYS  31          1HD       LYS  31   0.672   4.852   8.068
  277   2HD   LYS  31          2HD       LYS  31   1.360   3.432   7.260
  278   1HE   LYS  31          1HE       LYS  31   2.239   3.489   9.491
  279   2HE   LYS  31          2HE       LYS  31   3.557   3.895   8.378
  280   1HZ   LYS  31          1HZ       LYS  31   3.532   5.437  10.209
  281   2HZ   LYS  31          2HZ       LYS  31   1.955   5.909   9.830
  282    H    PHE  32           H        PHE  32  -1.895   5.454   4.511
  283    HA   PHE  32           HA       PHE  32  -3.185   4.227   6.565
  284   1HB   PHE  32          1HB       PHE  32  -4.074   6.022   5.134
  285   2HB   PHE  32          2HB       PHE  32  -4.409   4.854   3.864
  286    HD1  PHE  32           1HD      PHE  32  -6.692   5.951   3.971
  287    HD2  PHE  32           2HD      PHE  32  -5.168   3.495   7.192
  288    HE1  PHE  32           1HE      PHE  32  -8.932   5.871   5.010
  289    HE2  PHE  32           2HE      PHE  32  -7.402   3.328   8.131
  290    HZ   PHE  32           HZ       PHE  32  -9.309   4.555   7.085
  291    H    VAL  33           H        VAL  33  -2.902   2.967   3.194
  292    HA   VAL  33           HA       VAL  33  -4.377   0.546   3.734
  293    HB   VAL  33           HB       VAL  33  -3.488  -0.299   1.612
  294   1HG1  VAL  33          1HG1      VAL  33  -4.501   2.568   1.410
  295   2HG1  VAL  33          2HG1      VAL  33  -4.535   1.339   0.129
  296   3HG1  VAL  33          3HG1      VAL  33  -5.493   1.106   1.596
  297   1HG2  VAL  33          1HG2      VAL  33  -1.949   2.306   1.386
  298   2HG2  VAL  33          2HG2      VAL  33  -1.217   0.714   1.655
  299   3HG2  VAL  33          3HG2      VAL  33  -2.088   1.046   0.151
  300    H    GLN  34           H        GLN  34  -1.097   1.488   4.413
  301    HA   GLN  34           HA       GLN  34  -0.016  -1.183   4.671
  302   1HB   GLN  34          1HB       GLN  34   1.335   1.096   4.547
  303   2HB   GLN  34          2HB       GLN  34   0.876   1.291   6.235
  304   1HG   GLN  34          1HG       GLN  34   3.000   0.438   6.328
  305   2HG   GLN  34          2HG       GLN  34   1.925  -0.872   6.821
  306   1HE2  GLN  34          1HE2      GLN  34   1.600  -0.598   3.459
  307   2HE2  GLN  34          2HE2      GLN  34   2.783  -1.814   3.026
  308    H    ILE  35           H        ILE  35  -1.092   1.153   7.190
  309    HA   ILE  35           HA       ILE  35  -1.019  -0.492   9.362
  310    HB   ILE  35           HB       ILE  35  -3.275   1.445   8.661
  311   1HG1  ILE  35          1HG1      ILE  35  -1.144   2.613   8.582
  312   2HG1  ILE  35          2HG1      ILE  35  -2.100   3.119   9.964
  313   1HG2  ILE  35          1HG2      ILE  35  -3.549   1.663  11.155
  314   2HG2  ILE  35          2HG2      ILE  35  -4.056   0.109  10.497
  315   3HG2  ILE  35          3HG2      ILE  35  -2.505   0.236  11.342
  316   1HD1  ILE  35          1HD1      ILE  35   0.212   2.907  10.618
  317   2HD1  ILE  35          2HD1      ILE  35  -0.712   1.646  11.444
  318   3HD1  ILE  35          3HD1      ILE  35   0.295   1.236  10.031
  319    H    HIS  36           H        HIS  36  -3.905  -0.372   7.209
  320    HA   HIS  36           HA       HIS  36  -5.189  -2.411   8.806
  321   1HB   HIS  36          1HB       HIS  36  -5.908  -1.043   6.218
  322   2HB   HIS  36          2HB       HIS  36  -6.804  -2.428   6.864
  323    HD2  HIS  36           2HD      HIS  36  -5.719   1.069   8.493
  324    HE1  HIS  36           1HE      HIS  36  -9.516  -0.136   9.911
  325    HE2  HIS  36           2HE      HIS  36  -7.734   1.691  10.024
  326    H    ALA  37           H        ALA  37  -3.582  -2.513   5.552
  327    HA   ALA  37           HA       ALA  37  -3.760  -5.165   4.977
  328   1HB   ALA  37          1HB       ALA  37  -1.468  -4.944   3.969
  329   2HB   ALA  37          2HB       ALA  37  -2.615  -3.668   3.525
  330   3HB   ALA  37          3HB       ALA  37  -1.345  -3.362   4.732
  331    H    ILE  38           H        ILE  38  -1.366  -3.696   7.191
  332    HA   ILE  38           HA       ILE  38  -0.024  -6.177   7.849
  333    HB   ILE  38           HB       ILE  38   0.269  -3.245   8.452
  334   1HG1  ILE  38          1HG1      ILE  38   2.620  -3.731   7.963
  335   2HG1  ILE  38          2HG1      ILE  38   2.311  -5.472   7.986
  336   1HG2  ILE  38          1HG2      ILE  38   1.868  -3.567  10.244
  337   2HG2  ILE  38          2HG2      ILE  38   0.219  -3.961  10.723
  338   3HG2  ILE  38          3HG2      ILE  38   1.384  -5.271  10.387
  339   1HD1  ILE  38          1HD1      ILE  38   2.546  -4.561   5.714
  340   2HD1  ILE  38          2HD1      ILE  38   0.954  -5.286   5.937
  341   3HD1  ILE  38          3HD1      ILE  38   1.135  -3.514   5.966
  342    H    ARG  39           H        ARG  39  -2.627  -4.250   9.347
  343    HA   ARG  39           HA       ARG  39  -2.642  -5.814  11.771
  344   1HB   ARG  39          1HB       ARG  39  -3.541  -3.470  11.422
  345   2HB   ARG  39          2HB       ARG  39  -4.870  -4.148  10.468
  346   1HG   ARG  39          1HG       ARG  39  -4.288  -5.178  13.242
  347   2HG   ARG  39          2HG       ARG  39  -5.045  -3.586  13.040
  348   1HD   ARG  39          1HD       ARG  39  -6.943  -4.538  11.842
  349   2HD   ARG  39          2HD       ARG  39  -6.181  -6.126  11.811
  350    HE   ARG  39           HE       ARG  39  -6.837  -6.575  13.917
  351   1HH1  ARG  39          1HH1      ARG  39  -7.222  -3.076  13.420
  352   2HH1  ARG  39          2HH1      ARG  39  -8.054  -2.832  14.935
  353   1HH2  ARG  39          1HH2      ARG  39  -7.920  -6.235  15.890
  354   2HH2  ARG  39          2HH2      ARG  39  -8.450  -4.637  16.347
  355    H    LEU  40           H        LEU  40  -4.352  -6.077   8.666
  356    HA   LEU  40           HA       LEU  40  -5.949  -8.309   9.677
  357   1HB   LEU  40          1HB       LEU  40  -5.899  -6.877   7.026
  358   2HB   LEU  40          2HB       LEU  40  -7.075  -8.112   7.491
  359    HG   LEU  40           HG       LEU  40  -6.680  -5.516   9.074
  360   1HD1  LEU  40          1HD1      LEU  40  -8.698  -4.738   7.954
  361   2HD1  LEU  40          2HD1      LEU  40  -7.397  -5.052   6.788
  362   3HD1  LEU  40          3HD1      LEU  40  -8.728  -6.223   6.967
  363   1HD2  LEU  40          1HD2      LEU  40  -8.938  -6.092   9.959
  364   2HD2  LEU  40          2HD2      LEU  40  -8.859  -7.652   9.114
  365   3HD2  LEU  40          3HD2      LEU  40  -7.728  -7.283  10.429
  366    H    GLY  41           H        GLY  41  -2.970  -8.021   7.906
  367   1HA   GLY  41          1HA       GLY  41  -1.526  -9.789   7.488
  368   2HA   GLY  41          2HA       GLY  41  -2.834 -10.959   7.695
  369    H    ILE  42           H        ILE  42  -1.878  -8.242   5.559
  370    HA   ILE  42           HA       ILE  42  -2.708  -9.773   3.133
  371    HB   ILE  42           HB       ILE  42  -2.611  -6.806   3.690
  372   1HG1  ILE  42          1HG1      ILE  42  -4.559  -7.858   4.696
  373   2HG1  ILE  42          2HG1      ILE  42  -4.949  -6.757   3.367
  374   1HG2  ILE  42          1HG2      ILE  42  -3.633  -6.530   1.411
  375   2HG2  ILE  42          2HG2      ILE  42  -1.930  -6.990   1.431
  376   3HG2  ILE  42          3HG2      ILE  42  -3.165  -8.204   1.078
  377   1HD1  ILE  42          1HD1      ILE  42  -6.378  -8.748   3.344
  378   2HD1  ILE  42          2HD1      ILE  42  -5.404  -8.603   1.875
  379   3HD1  ILE  42          3HD1      ILE  42  -4.961  -9.786   3.142
  380    H    LYS  43           H        LYS  43  -1.215  -9.995   1.593
  381    HA   LYS  43           HA       LYS  43   1.512  -8.821   1.960
  382   1HB   LYS  43          1HB       LYS  43   0.966 -11.162   0.193
  383   2HB   LYS  43          2HB       LYS  43   2.431 -10.706   1.066
  384   1HG   LYS  43          1HG       LYS  43  -0.092 -11.918   2.271
  385   2HG   LYS  43          2HG       LYS  43   1.425 -12.734   1.946
  386   1HD   LYS  43          1HD       LYS  43   2.596 -11.165   3.539
  387   2HD   LYS  43          2HD       LYS  43   1.037 -10.478   3.973
  388   1HE   LYS  43          1HE       LYS  43   1.784 -13.411   4.259
  389   2HE   LYS  43          2HE       LYS  43   1.776 -12.204   5.564
  390   1HZ   LYS  43          1HZ       LYS  43  -0.575 -13.120   4.036
  391   2HZ   LYS  43          2HZ       LYS  43  -0.585 -11.938   5.239
  392    H    GLY  44           H        GLY  44   2.590  -8.218  -0.123
  393   1HA   GLY  44          1HA       GLY  44   1.871  -8.081  -2.674
  394   2HA   GLY  44          2HA       GLY  44   0.669  -6.984  -2.017
  395    H    TYR  45           H        TYR  45   1.328  -4.979  -2.613
  396    HA   TYR  45           HA       TYR  45   3.381  -3.743  -1.199
  397   1HB   TYR  45          1HB       TYR  45   4.502  -4.993  -3.391
  398   2HB   TYR  45          2HB       TYR  45   4.113  -3.430  -4.066
  399    HD1  TYR  45           1HD      TYR  45   6.079  -5.242  -1.508
  400    HD2  TYR  45           2HD      TYR  45   5.449  -1.478  -3.518
  401    HE1  TYR  45           1HE      TYR  45   8.254  -4.425  -0.659
  402    HE2  TYR  45           2HE      TYR  45   7.641  -0.676  -2.660
  403    HH   TYR  45           HH       TYR  45   9.401  -1.084  -1.245
  404    H    ALA  46           H        ALA  46   3.044  -1.565  -1.208
  405    HA   ALA  46           HA       ALA  46   0.779  -0.472  -2.808
  406   1HB   ALA  46          1HB       ALA  46   0.797   1.351  -1.145
  407   2HB   ALA  46          2HB       ALA  46   0.600  -0.241  -0.389
  408   3HB   ALA  46          3HB       ALA  46   2.151   0.588  -0.303
  409    H    LYS  47           H        LYS  47   1.951  -0.221  -4.807
  410    HA   LYS  47           HA       LYS  47   4.544   1.060  -4.599
  411   1HB   LYS  47          1HB       LYS  47   4.467  -1.003  -5.681
  412   2HB   LYS  47          2HB       LYS  47   3.217  -0.443  -6.783
  413   1HG   LYS  47          1HG       LYS  47   4.753   0.935  -7.988
  414   2HG   LYS  47          2HG       LYS  47   5.893   0.967  -6.640
  415   1HD   LYS  47          1HD       LYS  47   6.833  -0.352  -8.365
  416   2HD   LYS  47          2HD       LYS  47   6.442  -1.430  -7.025
  417   1HE   LYS  47          1HE       LYS  47   4.598  -1.049  -9.432
  418   2HE   LYS  47          2HE       LYS  47   5.930  -2.216  -9.430
  419   1HZ   LYS  47          1HZ       LYS  47   3.954  -3.318  -8.734
  420   2HZ   LYS  47          2HZ       LYS  47   3.756  -2.255  -7.441
  421    H    ASN  48           H        ASN  48   4.131   3.155  -4.184
  422    HA   ASN  48           HA       ASN  48   2.218   4.722  -5.632
  423   1HB   ASN  48          1HB       ASN  48   2.805   4.824  -3.171
  424   2HB   ASN  48          2HB       ASN  48   4.300   5.636  -3.622
  425   1HD2  ASN  48          2HD2      ASN  48   0.792   5.883  -3.345
  426   2HD2  ASN  48          1HD2      ASN  48   0.654   7.596  -3.643
  427    H    LEU  49           H        LEU  49   3.216   4.271  -7.821
  428    HA   LEU  49           HA       LEU  49   5.641   5.453  -8.611
  429   1HB   LEU  49          1HB       LEU  49   3.235   5.069 -10.407
  430   2HB   LEU  49          2HB       LEU  49   4.951   5.100 -10.815
  431    HG   LEU  49           HG       LEU  49   4.803   2.999  -8.992
  432   1HD1  LEU  49          1HD1      LEU  49   2.870   1.686  -9.530
  433   2HD1  LEU  49          2HD1      LEU  49   2.225   3.295  -9.212
  434   3HD1  LEU  49          3HD1      LEU  49   2.409   2.743 -10.878
  435   1HD2  LEU  49          1HD2      LEU  49   5.038   1.531 -10.959
  436   2HD2  LEU  49          2HD2      LEU  49   4.561   2.872 -12.024
  437   3HD2  LEU  49          3HD2      LEU  49   6.071   2.969 -11.088
  438    HA   PRO  50           HA       PRO  50   3.963   9.526  -7.914
  439   1HB   PRO  50          1HB       PRO  50   6.094  11.122  -8.527
  440   2HB   PRO  50          2HB       PRO  50   6.067  10.003  -7.141
  441   1HG   PRO  50          1HG       PRO  50   7.229   9.458  -9.888
  442   2HG   PRO  50          2HG       PRO  50   8.040   9.269  -8.304
  443   1HD   PRO  50          1HD       PRO  50   6.853   7.160  -9.534
  444   2HD   PRO  50          2HD       PRO  50   6.707   7.366  -7.763
  445    H    ASP  51           H        ASP  51   2.397   9.057  -9.696
  446    HA   ASP  51           HA       ASP  51   2.465  11.113 -11.781
  447   1HB   ASP  51          1HB       ASP  51   2.308   9.428 -13.632
  448   2HB   ASP  51          2HB       ASP  51   3.863   9.432 -12.818
  449    HD2  ASP  51           HD       ASP  51   3.663   6.023 -12.448
  450    H    GLY  52           H        GLY  52   0.672  10.341  -9.476
  451   1HA   GLY  52          1HA       GLY  52  -1.571  10.609  -9.192
  452   2HA   GLY  52          2HA       GLY  52  -1.856  10.495 -10.929
  453    H    SER  53           H        SER  53  -0.606   7.971 -11.414
  454    HA   SER  53           HA       SER  53  -2.756   6.206 -10.428
  455   1HB   SER  53          1HB       SER  53  -0.756   5.906 -12.686
  456   2HB   SER  53          2HB       SER  53  -2.097   4.802 -12.295
  457    HG   SER  53           HG       SER  53  -3.518   6.585 -12.605
  458    H    VAL  54           H        VAL  54  -1.982   5.825  -8.331
  459    HA   VAL  54           HA       VAL  54   0.486   4.219  -8.011
  460    HB   VAL  54           HB       VAL  54   0.312   5.654  -6.245
  461   1HG1  VAL  54          1HG1      VAL  54  -2.585   4.950  -5.752
  462   2HG1  VAL  54          2HG1      VAL  54  -1.579   6.053  -4.802
  463   3HG1  VAL  54          3HG1      VAL  54  -1.995   6.474  -6.464
  464   1HG2  VAL  54          1HG2      VAL  54  -1.067   3.178  -5.104
  465   2HG2  VAL  54          2HG2      VAL  54   0.605   3.148  -5.662
  466   3HG2  VAL  54          3HG2      VAL  54   0.147   4.212  -4.330
  467    H    GLU  55           H        GLU  55   0.469   2.069  -8.218
  468    HA   GLU  55           HA       GLU  55  -2.099   0.620  -8.244
  469   1HB   GLU  55          1HB       GLU  55  -0.961  -1.165  -9.192
  470   2HB   GLU  55          2HB       GLU  55  -0.320   0.271  -9.996
  471   1HG   GLU  55          1HG       GLU  55   1.683   0.124  -8.460
  472   2HG   GLU  55          2HG       GLU  55   1.049  -1.427  -7.879
  473    HE2  GLU  55           HE       GLU  55   2.526  -1.177 -11.643
  474    H    VAL  56           H        VAL  56  -2.780  -0.590  -6.506
  475    HA   VAL  56           HA       VAL  56  -0.776  -1.354  -4.422
  476    HB   VAL  56           HB       VAL  56  -3.781  -1.107  -4.152
  477   1HG1  VAL  56          1HG1      VAL  56  -1.561  -1.730  -2.179
  478   2HG1  VAL  56          2HG1      VAL  56  -3.280  -1.538  -1.769
  479   3HG1  VAL  56          3HG1      VAL  56  -2.758  -2.908  -2.756
  480   1HG2  VAL  56          1HG2      VAL  56  -1.444   0.594  -3.160
  481   2HG2  VAL  56          2HG2      VAL  56  -2.747   1.110  -4.254
  482   3HG2  VAL  56          3HG2      VAL  56  -3.108   0.699  -2.558
  483    H    VAL  57           H        VAL  57   0.031  -3.149  -5.474
  484    HA   VAL  57           HA       VAL  57  -1.693  -5.411  -6.213
  485    HB   VAL  57           HB       VAL  57   1.263  -5.290  -5.440
  486   1HG1  VAL  57          1HG1      VAL  57  -0.491  -7.486  -6.622
  487   2HG1  VAL  57          2HG1      VAL  57   1.280  -7.537  -6.610
  488   3HG1  VAL  57          3HG1      VAL  57   0.386  -7.531  -5.080
  489   1HG2  VAL  57          1HG2      VAL  57   0.013  -5.488  -8.213
  490   2HG2  VAL  57          2HG2      VAL  57   0.792  -4.035  -7.549
  491   3HG2  VAL  57          3HG2      VAL  57   1.740  -5.500  -7.824
  492    H    ALA  58           H        ALA  58  -2.828  -6.506  -4.624
  493    HA   ALA  58           HA       ALA  58  -1.642  -6.822  -1.940
  494   1HB   ALA  58          1HB       ALA  58  -3.958  -6.139  -1.001
  495   2HB   ALA  58          2HB       ALA  58  -2.836  -4.854  -1.467
  496   3HB   ALA  58          3HB       ALA  58  -4.168  -5.281  -2.546
  497    H    GLU  59           H        GLU  59  -2.388  -8.643  -0.924
  498    HA   GLU  59           HA       GLU  59  -4.115 -10.404  -2.532
  499   1HB   GLU  59          1HB       GLU  59  -1.827 -11.043  -0.638
  500   2HB   GLU  59          2HB       GLU  59  -2.798 -12.206  -1.554
  501   1HG   GLU  59          1HG       GLU  59  -2.173 -10.912  -3.648
  502   2HG   GLU  59          2HG       GLU  59  -0.964 -10.072  -2.683
  503    HE2  GLU  59           HE       GLU  59  -0.221 -13.645  -4.202
  504    H    GLY  60           H        GLY  60  -6.083 -10.771  -1.681
  505   1HA   GLY  60          1HA       GLY  60  -6.968 -10.109   0.977
  506   2HA   GLY  60          2HA       GLY  60  -7.819 -10.949  -0.306
  507    H    TYR  61           H        TYR  61  -8.709 -12.402   0.929
  508    HA   TYR  61           HA       TYR  61  -7.644 -14.927   1.292
  509   1HB   TYR  61          1HB       TYR  61  -7.649 -13.141   3.702
  510   2HB   TYR  61          2HB       TYR  61  -8.257 -14.769   3.899
  511    HD1  TYR  61           1HD      TYR  61  -6.743 -16.724   2.938
  512    HD2  TYR  61           2HD      TYR  61  -5.332 -12.831   4.136
  513    HE1  TYR  61           1HE      TYR  61  -4.480 -17.663   3.338
  514    HE2  TYR  61           2HE      TYR  61  -3.071 -13.762   4.512
  515    HH   TYR  61           HH       TYR  61  -1.733 -15.624   4.412
  516    H    GLU  62           H        GLU  62  -9.941 -13.639   3.650
  517    HA   GLU  62           HA       GLU  62 -12.262 -14.147   1.985
  518   1HB   GLU  62          1HB       GLU  62 -11.062 -16.393   2.937
  519   2HB   GLU  62          2HB       GLU  62 -12.078 -16.027   4.323
  520   1HG   GLU  62          1HG       GLU  62 -12.954 -16.411   1.423
  521   2HG   GLU  62          2HG       GLU  62 -13.196 -17.558   2.745
  522    HE2  GLU  62           HE       GLU  62 -16.095 -15.117   2.021
  523    H    GLU  63           H        GLU  63 -11.372 -14.350   5.508
  524    HA   GLU  63           HA       GLU  63 -13.528 -12.529   6.261
  525   1HB   GLU  63          1HB       GLU  63 -11.199 -13.756   7.831
  526   2HB   GLU  63          2HB       GLU  63 -12.542 -12.812   8.492
  527   1HG   GLU  63          1HG       GLU  63 -14.131 -14.541   7.632
  528   2HG   GLU  63          2HG       GLU  63 -12.761 -15.485   7.031
  529    HE2  GLU  63           HE       GLU  63 -13.411 -15.271  11.034
  530    H    ALA  64           H        ALA  64  -9.905 -12.566   6.218
  531    HA   ALA  64           HA       ALA  64  -9.634  -9.772   6.696
  532   1HB   ALA  64          1HB       ALA  64  -7.298 -10.129   5.930
  533   2HB   ALA  64          2HB       ALA  64  -7.803 -11.335   7.131
  534   3HB   ALA  64          3HB       ALA  64  -7.730 -11.769   5.413
  535    H    LEU  65           H        LEU  65 -10.273 -11.665   3.751
  536    HA   LEU  65           HA       LEU  65  -9.738  -9.770   1.817
  537   1HB   LEU  65          1HB       LEU  65 -10.508 -11.905   1.228
  538   2HB   LEU  65          2HB       LEU  65 -12.081 -11.639   1.975
  539    HG   LEU  65           HG       LEU  65 -12.709 -10.047   0.335
  540   1HD1  LEU  65          1HD1      LEU  65 -11.291  -9.417  -1.559
  541   2HD1  LEU  65          2HD1      LEU  65 -10.492  -8.937  -0.066
  542   3HD1  LEU  65          3HD1      LEU  65  -9.948 -10.395  -0.914
  543   1HD2  LEU  65          1HD2      LEU  65 -12.657 -11.499  -1.650
  544   2HD2  LEU  65          2HD2      LEU  65 -11.314 -12.433  -0.943
  545   3HD2  LEU  65          3HD2      LEU  65 -12.918 -12.458  -0.169
  546    H    SER  66           H        SER  66 -13.104 -10.191   3.004
  547    HA   SER  66           HA       SER  66 -14.118  -7.759   2.293
  548   1HB   SER  66          1HB       SER  66 -14.935  -9.381   4.712
  549   2HB   SER  66          2HB       SER  66 -15.934  -8.228   3.790
  550    HG   SER  66           HG       SER  66 -15.653  -9.585   1.971
  551    H    LYS  67           H        LYS  67 -12.742  -8.505   5.566
  552    HA   LYS  67           HA       LYS  67 -13.317  -6.043   6.731
  553   1HB   LYS  67          1HB       LYS  67 -11.266  -8.156   7.249
  554   2HB   LYS  67          2HB       LYS  67 -11.015  -6.571   7.980
  555   1HG   LYS  67          1HG       LYS  67 -12.205  -7.987   9.524
  556   2HG   LYS  67          2HG       LYS  67 -13.179  -6.591   9.052
  557   1HD   LYS  67          1HD       LYS  67 -14.471  -8.054   7.477
  558   2HD   LYS  67          2HD       LYS  67 -13.492  -9.439   8.012
  559   1HE   LYS  67          1HE       LYS  67 -14.296  -9.128  10.327
  560   2HE   LYS  67          2HE       LYS  67 -15.269  -7.734   9.805
  561   1HZ   LYS  67          1HZ       LYS  67 -16.634  -9.688   9.828
  562   2HZ   LYS  67          2HZ       LYS  67 -15.609 -10.464   8.733
  563    H    LEU  68           H        LEU  68 -10.488  -6.851   4.594
  564    HA   LEU  68           HA       LEU  68  -9.388  -4.205   4.990
  565   1HB   LEU  68          1HB       LEU  68  -8.125  -6.354   4.655
  566   2HB   LEU  68          2HB       LEU  68  -8.624  -6.346   2.977
  567    HG   LEU  68           HG       LEU  68  -6.338  -5.306   4.117
  568   1HD1  LEU  68          1HD1      LEU  68  -5.848  -4.423   1.842
  569   2HD1  LEU  68          2HD1      LEU  68  -6.612  -6.024   1.795
  570   3HD1  LEU  68          3HD1      LEU  68  -7.579  -4.568   1.444
  571   1HD2  LEU  68          1HD2      LEU  68  -6.148  -2.966   3.777
  572   2HD2  LEU  68          2HD2      LEU  68  -7.831  -2.822   3.275
  573   3HD2  LEU  68          3HD2      LEU  68  -7.433  -3.265   4.951
  574    H    LEU  69           H        LEU  69 -10.936  -5.934   2.210
  575    HA   LEU  69           HA       LEU  69 -11.030  -3.960   0.366
  576   1HB   LEU  69          1HB       LEU  69 -12.735  -6.259   1.028
  577   2HB   LEU  69          2HB       LEU  69 -13.582  -5.045   0.114
  578    HG   LEU  69           HG       LEU  69 -12.472  -6.860  -1.207
  579   1HD1  LEU  69          1HD1      LEU  69 -11.761  -5.419  -3.027
  580   2HD1  LEU  69          2HD1      LEU  69 -13.157  -4.681  -2.220
  581   3HD1  LEU  69          3HD1      LEU  69 -11.520  -4.058  -1.922
  582   1HD2  LEU  69          1HD2      LEU  69 -10.137  -6.922  -1.583
  583   2HD2  LEU  69          2HD2      LEU  69  -9.862  -5.362  -0.798
  584   3HD2  LEU  69          3HD2      LEU  69 -10.284  -6.766   0.183
  585    H    GLU  70           H        GLU  70 -13.684  -4.484   2.720
  586    HA   GLU  70           HA       GLU  70 -15.227  -2.255   2.102
  587   1HB   GLU  70          1HB       GLU  70 -14.916  -3.838   4.691
  588   2HB   GLU  70          2HB       GLU  70 -16.207  -2.658   4.409
  589   1HG   GLU  70          1HG       GLU  70 -17.043  -3.931   2.501
  590   2HG   GLU  70          2HG       GLU  70 -15.761  -5.132   2.679
  591    HE2  GLU  70           HE       GLU  70 -17.139  -6.454   5.705
  592    H    ARG  71           H        ARG  71 -12.665  -2.562   4.609
  593    HA   ARG  71           HA       ARG  71 -12.524  -0.007   5.738
  594   1HB   ARG  71          1HB       ARG  71 -10.965  -1.310   6.624
  595   2HB   ARG  71          2HB       ARG  71 -10.643  -2.181   5.148
  596   1HG   ARG  71          1HG       ARG  71  -8.685  -1.027   5.844
  597   2HG   ARG  71          2HG       ARG  71  -9.203  -0.423   4.300
  598   1HD   ARG  71          1HD       ARG  71 -10.378   1.137   6.505
  599   2HD   ARG  71          2HD       ARG  71  -8.641   1.075   6.645
  600    HE   ARG  71           HE       ARG  71 -10.161   2.640   4.868
  601   1HH1  ARG  71          1HH1      ARG  71  -7.239   0.632   4.609
  602   2HH1  ARG  71          2HH1      ARG  71  -6.575   1.588   3.305
  603   1HH2  ARG  71          1HH2      ARG  71  -9.234   3.883   3.178
  604   2HH2  ARG  71          2HH2      ARG  71  -7.689   3.427   2.517
  605    H    ILE  72           H        ILE  72 -11.131  -1.014   2.563
  606    HA   ILE  72           HA       ILE  72 -10.147   1.662   2.109
  607    HB   ILE  72           HB       ILE  72 -10.414  -0.567   0.079
  608   1HG1  ILE  72          1HG1      ILE  72  -7.885   0.295   1.602
  609   2HG1  ILE  72          2HG1      ILE  72  -8.920  -0.973   2.232
  610   1HG2  ILE  72          1HG2      ILE  72  -8.587   0.740  -1.074
  611   2HG2  ILE  72          2HG2      ILE  72 -10.074   1.682  -0.921
  612   3HG2  ILE  72          3HG2      ILE  72  -8.715   1.982   0.181
  613   1HD1  ILE  72          1HD1      ILE  72  -7.114  -1.990   1.056
  614   2HD1  ILE  72          2HD1      ILE  72  -8.640  -2.314   0.206
  615   3HD1  ILE  72          3HD1      ILE  72  -7.494  -1.104  -0.430
  616    H    LYS  73           H        LYS  73 -12.832  -0.109   0.484
  617    HA   LYS  73           HA       LYS  73 -13.746   1.947  -1.064
  618   1HB   LYS  73          1HB       LYS  73 -15.341  -0.176   0.382
  619   2HB   LYS  73          2HB       LYS  73 -16.081   1.047  -0.645
  620   1HG   LYS  73          1HG       LYS  73 -15.852  -0.711  -2.069
  621   2HG   LYS  73          2HG       LYS  73 -14.517   0.346  -2.539
  622   1HD   LYS  73          1HD       LYS  73 -14.038  -1.842  -0.546
  623   2HD   LYS  73          2HD       LYS  73 -14.321  -2.334  -2.194
  624   1HE   LYS  73          1HE       LYS  73 -12.240  -0.182  -1.671
  625   2HE   LYS  73          2HE       LYS  73 -11.843  -1.890  -1.469
  626   1HZ   LYS  73          1HZ       LYS  73 -11.373  -1.218  -3.703
  627   2HZ   LYS  73          2HZ       LYS  73 -12.980  -0.760  -3.944
  628    H    GLN  74           H        GLN  74 -14.712   1.374   2.366
  629    HA   GLN  74           HA       GLN  74 -15.821   4.135   2.547
  630   1HB   GLN  74          1HB       GLN  74 -17.192   2.090   3.160
  631   2HB   GLN  74          2HB       GLN  74 -16.104   1.856   4.533
  632   1HG   GLN  74          1HG       GLN  74 -16.707   4.191   5.317
  633   2HG   GLN  74          2HG       GLN  74 -17.807   4.331   3.941
  634   1HE2  GLN  74          1HE2      GLN  74 -19.527   2.541   3.783
  635   2HE2  GLN  74          2HE2      GLN  74 -20.232   2.006   5.295
  636    H    GLY  75           H        GLY  75 -13.145   4.239   2.267
  637   1HA   GLY  75          1HA       GLY  75 -12.295   5.263   4.922
  638   2HA   GLY  75          2HA       GLY  75 -11.314   4.021   4.171
  639    HA   PRO  76           HA       PRO  76 -11.196   7.746   1.107
  640   1HB   PRO  76          1HB       PRO  76 -11.874  10.234   2.083
  641   2HB   PRO  76          2HB       PRO  76 -13.019   9.113   1.295
  642   1HG   PRO  76          1HG       PRO  76 -12.545   9.475   4.262
  643   2HG   PRO  76          2HG       PRO  76 -14.110   9.449   3.398
  644   1HD   PRO  76          1HD       PRO  76 -13.154   7.257   4.640
  645   2HD   PRO  76          2HD       PRO  76 -13.967   7.091   3.056
  646    HA   PRO  77           HA       PRO  77  -7.336   8.577   3.381
  647   1HB   PRO  77          1HB       PRO  77  -5.667   9.087   1.324
  648   2HB   PRO  77          2HB       PRO  77  -6.401   7.468   1.527
  649   1HG   PRO  77          1HG       PRO  77  -7.377   9.712  -0.266
  650   2HG   PRO  77          2HG       PRO  77  -7.057   8.012  -0.726
  651   1HD   PRO  77          1HD       PRO  77  -9.551   8.934  -0.034
  652   2HD   PRO  77          2HD       PRO  77  -9.019   7.266   0.351
  653    H    ALA  78           H        ALA  78  -5.617  10.482   3.235
  654    HA   ALA  78           HA       ALA  78  -7.075  12.979   3.534
  655   1HB   ALA  78          1HB       ALA  78  -4.930  13.814   4.368
  656   2HB   ALA  78          2HB       ALA  78  -5.308  12.246   5.102
  657   3HB   ALA  78          3HB       ALA  78  -4.110  12.346   3.792
  658    H    ALA  79           H        ALA  79  -7.124  12.009   0.760
  659    HA   ALA  79           HA       ALA  79  -5.926  14.293  -0.640
  660   1HB   ALA  79          1HB       ALA  79  -4.707  12.780  -2.174
  661   2HB   ALA  79          2HB       ALA  79  -4.074  12.834  -0.514
  662   3HB   ALA  79          3HB       ALA  79  -5.027  11.436  -1.044
  663    H    GLU  80           H        GLU  80  -6.625  14.287  -2.916
  664    HA   GLU  80           HA       GLU  80  -9.419  13.557  -3.142
  665   1HB   GLU  80          1HB       GLU  80  -7.503  14.842  -5.133
  666   2HB   GLU  80          2HB       GLU  80  -9.256  14.680  -5.333
  667   1HG   GLU  80          1HG       GLU  80  -9.594  16.011  -3.246
  668   2HG   GLU  80          2HG       GLU  80  -7.842  16.263  -3.138
  669    HE2  GLU  80           HE       GLU  80  -7.740  18.439  -5.940
  670    H    VAL  81           H        VAL  81  -9.359  11.258  -3.040
  671    HA   VAL  81           HA       VAL  81  -8.107   9.649  -5.080
  672    HB   VAL  81           HB       VAL  81  -8.581   8.855  -2.862
  673   1HG1  VAL  81          1HG1      VAL  81 -11.562   8.778  -3.465
  674   2HG1  VAL  81          2HG1      VAL  81 -10.725   8.208  -2.029
  675   3HG1  VAL  81          3HG1      VAL  81 -10.768   9.939  -2.384
  676   1HG2  VAL  81          1HG2      VAL  81 -10.110   7.269  -4.971
  677   2HG2  VAL  81          2HG2      VAL  81  -8.348   7.277  -4.755
  678   3HG2  VAL  81          3HG2      VAL  81  -9.396   6.635  -3.476
  679    H    GLU  82           H        GLU  82  -8.651  10.948  -6.848
  680    HA   GLU  82           HA       GLU  82 -10.926  11.667  -7.994
  681   1HB   GLU  82          1HB       GLU  82  -8.654  11.983  -8.884
  682   2HB   GLU  82          2HB       GLU  82  -8.610  10.299  -9.418
  683   1HG   GLU  82          1HG       GLU  82  -9.101  11.789 -11.290
  684   2HG   GLU  82          2HG       GLU  82 -10.486  10.736 -10.985
  685    HE2  GLU  82           HE       GLU  82 -10.784  14.678  -9.967
  686    H    LYS  83           H        LYS  83  -9.595   8.315  -8.623
  687    HA   LYS  83           HA       LYS  83 -12.254   7.217  -8.489
  688   1HB   LYS  83          1HB       LYS  83 -12.484   6.481 -10.829
  689   2HB   LYS  83          2HB       LYS  83 -12.611   8.222 -10.609
  690   1HG   LYS  83          1HG       LYS  83 -10.102   8.320 -11.277
  691   2HG   LYS  83          2HG       LYS  83 -10.348   6.651 -11.826
  692   1HD   LYS  83          1HD       LYS  83 -12.200   7.400 -13.300
  693   2HD   LYS  83          2HD       LYS  83 -11.968   9.063 -12.732
  694   1HE   LYS  83          1HE       LYS  83 -10.888   8.844 -14.873
  695   2HE   LYS  83          2HE       LYS  83  -9.635   9.031 -13.629
  696   1HZ   LYS  83          1HZ       LYS  83  -9.039   7.244 -15.101
  697   2HZ   LYS  83          2HZ       LYS  83 -10.474   6.426 -14.747
  698    H    VAL  84           H        VAL  84 -11.361   5.875  -7.037
  699    HA   VAL  84           HA       VAL  84  -9.228   4.032  -7.634
  700    HB   VAL  84           HB       VAL  84  -9.552   4.574  -5.401
  701   1HG1  VAL  84          1HG1      VAL  84 -12.393   3.485  -5.437
  702   2HG1  VAL  84          2HG1      VAL  84 -11.478   4.020  -4.023
  703   3HG1  VAL  84          3HG1      VAL  84 -11.921   5.188  -5.268
  704   1HG2  VAL  84          1HG2      VAL  84 -10.590   1.722  -5.604
  705   2HG2  VAL  84          2HG2      VAL  84  -8.935   2.181  -6.033
  706   3HG2  VAL  84          3HG2      VAL  84  -9.527   2.425  -4.376
  707    H    ASP  85           H        ASP  85  -9.597   3.057  -9.560
  708    HA   ASP  85           HA       ASP  85 -12.041   1.455 -10.006
  709   1HB   ASP  85          1HB       ASP  85 -11.308   2.987 -11.744
  710   2HB   ASP  85          2HB       ASP  85  -9.705   2.242 -11.781
  711    HD2  ASP  85           HD       ASP  85 -10.775   0.044 -14.216
  712    H    TYR  86           H        TYR  86 -11.404  -0.110  -8.255
  713    HA   TYR  86           HA       TYR  86  -8.888  -1.432  -8.462
  714   1HB   TYR  86          1HB       TYR  86  -9.441  -2.622  -6.562
  715   2HB   TYR  86          2HB       TYR  86 -10.326  -1.130  -6.343
  716    HD1  TYR  86           1HD      TYR  86 -12.894  -1.250  -7.186
  717    HD2  TYR  86           2HD      TYR  86 -10.457  -4.728  -6.380
  718    HE1  TYR  86           1HE      TYR  86 -14.930  -2.610  -6.841
  719    HE2  TYR  86           2HE      TYR  86 -12.490  -6.055  -5.983
  720    HH   TYR  86           HH       TYR  86 -14.791  -6.078  -5.950
  721    H    SER  87           H        SER  87  -8.637  -3.846  -8.608
  722    HA   SER  87           HA       SER  87 -10.534  -5.144 -10.488
  723   1HB   SER  87          1HB       SER  87  -7.509  -5.195 -10.709
  724   2HB   SER  87          2HB       SER  87  -8.659  -6.030 -11.760
  725    HG   SER  87           HG       SER  87  -9.513  -3.882 -12.223
  726    H    PHE  88           H        PHE  88 -11.278  -6.904  -9.581
  727    HA   PHE  88           HA       PHE  88  -9.878  -8.393  -7.475
  728   1HB   PHE  88          1HB       PHE  88 -12.270  -8.047  -7.360
  729   2HB   PHE  88          2HB       PHE  88 -12.512  -8.680  -8.967
  730    HD1  PHE  88           1HD      PHE  88 -11.759 -11.282  -9.290
  731    HD2  PHE  88           2HD      PHE  88 -12.944  -9.404  -5.592
  732    HE1  PHE  88           1HE      PHE  88 -12.129 -13.500  -8.280
  733    HE2  PHE  88           2HE      PHE  88 -13.372 -11.630  -4.609
  734    HZ   PHE  88           HZ       PHE  88 -12.919 -13.687  -5.930
  735    H    SER  89           H        SER  89  -8.377  -9.923  -8.002
  736    HA   SER  89           HA       SER  89  -8.621 -11.442 -10.546
  737   1HB   SER  89          1HB       SER  89  -5.995 -10.474  -9.433
  738   2HB   SER  89          2HB       SER  89  -6.324 -11.184 -11.014
  739    HG   SER  89           HG       SER  89  -7.664  -9.312 -11.417
  740    H    GLU  90           H        GLU  90  -6.845 -13.324 -10.419
  741    HA   GLU  90           HA       GLU  90  -7.510 -14.893  -8.036
  742   1HB   GLU  90          1HB       GLU  90  -8.063 -15.956 -10.063
  743   2HB   GLU  90          2HB       GLU  90  -6.650 -15.311 -10.898
  744   1HG   GLU  90          1HG       GLU  90  -6.326 -17.547 -10.738
  745   2HG   GLU  90          2HG       GLU  90  -5.160 -16.846  -9.645
  746    HE2  GLU  90           HE       GLU  90  -7.005 -19.836  -8.225
  747    H    TYR  91           H        TYR  91  -5.948 -16.000  -6.896
  748    HA   TYR  91           HA       TYR  91  -3.470 -15.079  -6.156
  749   1HB   TYR  91          1HB       TYR  91  -4.599 -16.790  -4.981
  750   2HB   TYR  91          2HB       TYR  91  -4.613 -17.866  -6.375
  751    HD1  TYR  91           1HD      TYR  91  -2.164 -15.939  -4.265
  752    HD2  TYR  91           2HD      TYR  91  -2.971 -19.559  -6.463
  753    HE1  TYR  91           1HE      TYR  91   0.159 -16.649  -3.944
  754    HE2  TYR  91           2HE      TYR  91  -0.622 -20.240  -6.214
  755    HH   TYR  91           HH       TYR  91   1.459 -19.693  -5.339
  756    H    LYS  92           H        LYS  92  -1.968 -14.420  -7.716
  757    HA   LYS  92           HA       LYS  92  -1.178 -16.247  -9.894
  758   1HB   LYS  92          1HB       LYS  92  -1.454 -13.898 -10.414
  759   2HB   LYS  92          2HB       LYS  92  -0.280 -13.447  -9.171
  760   1HG   LYS  92          1HG       LYS  92   0.714 -13.329 -11.370
  761   2HG   LYS  92          2HG       LYS  92   1.532 -14.552 -10.396
  762   1HD   LYS  92          1HD       LYS  92   0.357 -16.349 -11.581
  763   2HD   LYS  92          2HD       LYS  92  -0.641 -15.161 -12.451
  764   1HE   LYS  92          1HE       LYS  92   1.403 -14.256 -13.539
  765   2HE   LYS  92          2HE       LYS  92   2.394 -15.443 -12.661
  766   1HZ   LYS  92          1HZ       LYS  92   1.876 -16.284 -14.833
  767   2HZ   LYS  92          2HZ       LYS  92   0.220 -16.175 -14.518
  768    H    GLY  93           H        GLY  93   0.360 -14.514  -7.115
  769   1HA   GLY  93          1HA       GLY  93   2.187 -16.725  -6.572
  770   2HA   GLY  93          2HA       GLY  93   2.941 -15.257  -7.236
  771    H    GLU  94           H        GLU  94   3.133 -16.496  -4.536
  772    HA   GLU  94           HA       GLU  94   1.631 -14.748  -2.726
  773   1HB   GLU  94          1HB       GLU  94   2.645 -16.151  -0.975
  774   2HB   GLU  94          2HB       GLU  94   1.498 -16.931  -2.059
  775   1HG   GLU  94          1HG       GLU  94   3.264 -18.072  -3.268
  776   2HG   GLU  94          2HG       GLU  94   4.516 -17.218  -2.355
  777    HE2  GLU  94           HE       GLU  94   2.425 -20.227  -0.619
  778    H    PHE  95           H        PHE  95   2.413 -12.793  -2.526
  779    HA   PHE  95           HA       PHE  95   5.223 -12.115  -2.053
  780   1HB   PHE  95          1HB       PHE  95   2.560 -10.735  -1.545
  781   2HB   PHE  95          2HB       PHE  95   4.097 -10.052  -1.066
  782    HD1  PHE  95           1HD      PHE  95   2.110 -11.116  -4.050
  783    HD2  PHE  95           2HD      PHE  95   5.449  -8.813  -2.572
  784    HE1  PHE  95           1HE      PHE  95   2.150  -9.816  -6.149
  785    HE2  PHE  95           2HE      PHE  95   5.446  -7.482  -4.657
  786    HZ   PHE  95           HZ       PHE  95   3.777  -7.952  -6.435
  787    H    GLU  96           H        GLU  96   5.736 -11.164   0.193
  788    HA   GLU  96           HA       GLU  96   4.235 -12.129   2.402
  789   1HB   GLU  96          1HB       GLU  96   6.158 -13.439   3.427
  790   2HB   GLU  96          2HB       GLU  96   5.367 -14.214   2.056
  791   1HG   GLU  96          1HG       GLU  96   7.163 -13.517   0.533
  792   2HG   GLU  96          2HG       GLU  96   7.976 -12.651   1.847
  793    HE2  GLU  96           HE       GLU  96   8.971 -15.671   3.469
  794    H    ASP  97           H        ASP  97   4.462  -9.753   1.723
  795    HA   ASP  97           HA       ASP  97   5.220  -8.263   3.897
  796   1HB   ASP  97          1HB       ASP  97   7.600  -8.657   3.556
  797   2HB   ASP  97          2HB       ASP  97   7.464  -8.278   1.831
  798    HD2  ASP  97           HD       ASP  97   7.143  -5.225   4.526
  799    H    PHE  98           H        PHE  98   3.368  -7.077   3.432
  800    HA   PHE  98           HA       PHE  98   3.056  -5.723   0.820
  801   1HB   PHE  98          1HB       PHE  98   1.078  -6.616   1.921
  802   2HB   PHE  98          2HB       PHE  98   1.402  -5.671   3.368
  803    HD1  PHE  98           1HD      PHE  98   0.388  -5.554  -0.205
  804    HD2  PHE  98           2HD      PHE  98   0.748  -3.322   3.458
  805    HE1  PHE  98           1HE      PHE  98  -0.839  -3.669  -1.225
  806    HE2  PHE  98           2HE      PHE  98  -0.504  -1.448   2.430
  807    HZ   PHE  98           HZ       PHE  98  -1.365  -1.643   0.124
  808    H    GLU  99           H        GLU  99   5.055  -4.406   0.909
  809    HA   GLU  99           HA       GLU  99   4.941  -2.195   2.939
  810   1HB   GLU  99          1HB       GLU  99   6.806  -3.607   3.094
  811   2HB   GLU  99          2HB       GLU  99   7.287  -3.290   1.431
  812   1HG   GLU  99          1HG       GLU  99   7.669  -0.921   1.961
  813   2HG   GLU  99          2HG       GLU  99   6.971  -1.133   3.576
  814    HE2  GLU  99           HE       GLU  99   9.827  -2.959   4.743
  815    H    THR 100           H        THR 100   5.643  -0.049   2.165
  816    HA   THR 100           HA       THR 100   4.308   0.527  -0.377
  817    HB   THR 100           HB       THR 100   3.683   2.491   0.439
  818    HG1  THR 100           1HG      THR 100   5.822   3.303   0.764
  819   1HG2  THR 100          1HG2      THR 100   3.110   2.388   2.804
  820   2HG2  THR 100          2HG2      THR 100   2.908   0.788   2.061
  821   3HG2  THR 100          3HG2      THR 100   4.310   1.133   3.105
  822    H    TYR 101           H        TYR 101   5.231   1.463  -2.119
  823    HA   TYR 101           HA       TYR 101   8.166   1.592  -2.302
  824   1HB   TYR 101          1HB       TYR 101   6.539   0.749  -4.069
  825   2HB   TYR 101          2HB       TYR 101   6.111   2.455  -4.336
  826    HD1  TYR 101           1HD      TYR 101   7.562   3.914  -5.564
  827    HD2  TYR 101           2HD      TYR 101   8.462  -0.244  -4.979
  828    HE1  TYR 101           1HE      TYR 101   9.375   4.071  -7.262
  829    HE2  TYR 101           2HE      TYR 101  10.277  -0.099  -6.660
  830    HH   TYR 101           HH       TYR 101  11.454   1.271  -8.088