DSSP OUTPUT
==== Secondary Structure Definition by the program DSSP, CMBI version 3.0.1 ==== DATE=2019-06-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
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COMPND .
SOURCE .
AUTHOR .
178 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
10550.5 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
89 50.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
10 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES .
1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES .
23 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
7 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
43 24.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES .
2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES .
1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** .
0 0 0 0 0 2 1 0 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX .
0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER .
1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER .
0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET .
# RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA CHAIN AUTHCHAIN
1 1 L 0 0 159 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-133.7 60.5 100.6 2.2
2 2 A + 0 0 62 1,-0.2 3,-0.1 2,-0.2 0, 0.0 0.513 360.0 53.9 -93.2 2.1 59.6 100.9 5.9
3 3 L S S+ 0 0 87 151,-0.1 151,-0.4 1,-0.1 154,-0.3 0.764 121.5 37.9 -62.3 -40.5 62.9 102.3 6.9
4 4 F + 0 0 87 149,-0.1 2,-1.0 1,-0.1 -2,-0.2 -0.186 69.6 120.5-127.9 29.7 62.0 104.8 4.2
5 5 E + 0 0 116 150,-0.2 2,-0.4 -3,-0.1 -1,-0.1 -0.705 33.2 147.1-100.7 80.1 58.5 105.8 3.9
6 6 R - 0 0 67 -2,-1.0 2,-0.3 147,-0.1 147,-0.2 -0.860 23.7-173.4 -97.9 137.7 58.8 109.4 4.5
7 7 D E -A 152 0A 76 145,-2.0 145,-2.3 -2,-0.4 2,-0.5 -0.874 19.2-131.3-126.4 165.3 56.5 111.6 2.7
8 8 V E +A 151 0A 55 -2,-0.3 143,-0.2 143,-0.2 2,-0.2 -0.982 34.9 158.5-134.0 126.3 56.8 115.2 2.8
9 9 I E -A 150 0A 20 141,-2.5 141,-1.3 -2,-0.5 2,-0.1 -0.534 29.6 -81.1-131.9-175.6 53.9 117.6 3.6
10 10 T > - 0 0 52 -2,-0.2 4,-3.0 139,-0.2 5,-0.2 -0.438 29.1-119.2 -97.8 173.8 52.5 120.9 4.7
11 11 R H > S+ 0 0 32 137,-0.2 4,-2.4 2,-0.2 5,-0.1 0.893 124.6 51.6 -60.1 -44.8 51.7 122.9 8.0
12 12 E H > S+ 0 0 85 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.916 114.6 40.1 -62.6 -47.5 48.2 122.7 6.5
13 13 T H > S+ 0 0 59 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.904 114.0 51.1 -66.2 -42.3 48.4 118.9 6.0
14 14 V H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.875 108.2 54.4 -69.8 -34.1 50.1 118.2 9.3
15 15 E H X S+ 0 0 18 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.885 104.4 54.3 -62.1 -40.9 47.4 120.3 11.1
16 16 A H X S+ 0 0 43 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.901 111.5 47.1 -58.1 -44.3 44.7 118.1 9.5
17 17 V H X S+ 0 0 62 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.912 111.4 47.9 -66.7 -40.4 46.5 115.2 11.0
18 18 L H < S+ 0 0 4 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.896 108.5 53.2 -66.0 -38.6 46.9 116.7 14.3
19 19 K H < S+ 0 0 62 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.861 108.2 55.3 -62.8 -36.4 43.2 117.7 14.5
20 20 K H < S+ 0 0 145 -4,-1.7 2,-0.8 -5,-0.2 -1,-0.2 0.854 77.5 92.2 -62.4 -38.1 42.4 114.1 13.7
21 21 T < + 0 0 56 -4,-1.6 24,-0.1 1,-0.2 -1,-0.0 -0.619 60.9 107.7 -71.5 113.4 44.4 112.9 16.5
22 22 N + 0 0 47 -2,-0.8 3,-0.2 0, 0.0 -1,-0.2 -0.232 19.3 140.3 134.4 39.3 41.2 113.1 18.2
23 23 P S S+ 0 0 114 0, 0.0 3,-0.2 0, 0.0 -2,-0.1 0.580 84.6 50.6 -61.1 -27.5 40.0 109.6 18.7
24 24 N > + 0 0 16 1,-0.2 3,-0.7 2,-0.1 -3,-0.1 -0.090 68.0 123.1-112.6 17.4 39.0 111.0 22.0
25 25 S T 3 + 0 0 17 1,-0.2 3,-0.4 -3,-0.2 5,-0.2 0.563 49.7 84.4 -64.7 -17.3 37.1 114.1 21.2
26 26 N T 3 S+ 0 0 137 1,-0.3 2,-1.5 -3,-0.2 -1,-0.2 0.873 80.9 61.3 -60.3 -43.9 33.8 113.3 23.0
27 27 T S < S+ 0 0 84 -3,-0.7 -1,-0.3 2,-0.1 2,-0.2 -0.388 101.5 27.8 -91.7 59.9 34.7 114.4 26.4
28 28 M S S- 0 0 43 -2,-1.5 2,-0.7 -3,-0.4 3,-0.1 -0.931 98.1 -64.6-161.1 172.0 35.5 118.2 26.0
29 29 L S > S- 0 0 115 -2,-0.2 4,-2.9 1,-0.2 5,-0.4 -0.897 75.9-149.1 -81.1 96.6 35.3 121.6 24.5
30 30 Q H > S+ 0 0 93 -2,-0.7 4,-2.6 1,-0.2 5,-0.3 0.715 71.0 34.3 -56.9 -50.7 36.8 119.5 21.8
31 31 E H > S+ 0 0 67 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.930 124.9 34.1 -82.4 -46.7 39.1 121.6 19.8
32 32 D H > S+ 0 0 34 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.894 119.5 50.3 -61.7 -44.4 40.7 124.1 22.4
33 33 A H X S+ 0 0 15 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.905 111.8 46.6 -65.9 -40.2 40.7 121.7 25.2
34 34 I H X S+ 0 0 7 -4,-2.6 4,-3.4 -5,-0.4 5,-0.2 0.848 110.0 52.7 -68.0 -34.8 42.4 118.9 23.3
35 35 N H X S+ 0 0 48 -4,-1.8 4,-2.0 -5,-0.3 -1,-0.2 0.956 113.6 45.2 -62.2 -45.2 45.1 121.2 21.9
36 36 A H X S+ 0 0 52 -4,-2.5 4,-1.1 1,-0.2 -2,-0.2 0.936 116.9 44.1 -63.0 -45.0 45.7 122.3 25.4
37 37 L H X S+ 0 0 10 -4,-2.8 4,-3.4 2,-0.2 5,-0.2 0.817 108.2 56.9 -65.9 -36.1 45.7 118.6 26.7
38 38 T H X>S+ 0 0 10 -4,-3.4 4,-1.5 1,-0.2 5,-1.3 0.937 104.3 58.3 -58.1 -43.8 47.9 117.3 23.7
39 39 G H <5S+ 0 0 26 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.817 116.4 29.4 -48.3 -49.2 50.3 120.0 25.0
40 40 K H <5S+ 0 0 166 -4,-1.1 -1,-0.2 1,-0.1 -2,-0.2 0.790 115.1 55.8 -80.8 -38.0 50.6 118.5 28.4
41 41 T H <5S- 0 0 23 -4,-3.4 -2,-0.2 -5,-0.1 -3,-0.2 0.616 101.3-131.9 -83.5 -7.2 50.0 114.8 27.8
42 42 L T <5 - 0 0 108 -4,-1.5 -3,-0.2 1,-0.3 -4,-0.1 0.875 64.9 -55.8 66.0 42.0 52.9 115.0 25.3
43 43 I S S+ 0 0 40 -24,-0.1 4,-2.8 -7,-0.0 2,-1.0 -0.411 77.4 71.0 59.6 -50.3 46.5 109.7 23.8
46 46 A T 4 S+ 0 0 67 -2,-1.1 -1,-0.0 1,-0.3 0, 0.0 -0.646 101.9 26.6-123.8 73.3 47.0 107.1 26.2
47 47 I T > S+ 0 0 108 -2,-1.0 4,-3.1 0, 0.0 -1,-0.3 -0.390 118.2 61.3 144.6 -61.5 47.3 108.5 29.7
48 48 L H > S+ 0 0 10 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.945 105.8 46.3 -60.8 -45.3 45.3 111.6 28.6
49 49 E H X S+ 0 0 95 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.924 116.7 43.4 -61.8 -48.0 42.3 109.4 27.9
50 50 E H > S+ 0 0 116 -5,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.923 115.7 49.6 -62.5 -44.6 42.6 107.5 31.2
51 51 A H X S+ 0 0 39 -4,-3.1 4,-1.9 1,-0.2 -2,-0.2 0.882 109.8 51.4 -64.0 -41.2 43.3 110.8 33.1
52 52 L H < S+ 0 0 17 -4,-3.0 5,-0.2 2,-0.2 -1,-0.2 0.877 105.1 55.1 -64.3 -36.5 40.2 112.5 31.4
53 53 L H < S+ 0 0 127 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.889 108.3 48.9 -61.0 -39.1 37.9 109.5 32.5
54 54 K H < S+ 0 0 161 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.861 115.2 76.6 -62.4 -39.2 39.2 110.2 36.0
55 55 N < + 0 0 53 -4,-1.9 -3,-0.0 -5,-0.1 3,-0.0 -0.262 35.7 167.3 -65.9 153.0 38.3 114.0 35.3
56 56 G S S+ 0 0 105 -2,-0.0 2,-0.2 2,-0.0 -1,-0.1 -0.612 74.1 124.8 -90.9 61.7 35.8 116.5 34.9
57 57 V + 0 0 86 -5,-0.2 -2,-0.1 2,-0.0 2,-0.1 -0.801 18.0 71.0-128.6 161.4 39.1 118.5 35.0
58 58 V - 0 0 73 -2,-0.2 -25,-0.1 -22,-0.0 -2,-0.0 0.199 61.8-150.0 80.4 146.0 41.0 121.2 32.8
59 59 G + 0 0 66 1,-0.1 -26,-0.0 -2,-0.1 -2,-0.0 0.461 50.2 93.4-111.6-151.1 39.6 124.6 32.7
60 60 G - 0 0 58 1,-0.1 -1,-0.1 42,-0.1 43,-0.0 0.632 25.6-176.8 64.6 43.8 39.1 127.6 31.0
61 61 S - 0 0 90 1,-0.1 -1,-0.1 42,-0.0 -29,-0.1 0.725 53.0-125.6 -65.1 -24.1 35.9 127.6 29.1
62 62 I - 0 0 48 39,-0.2 2,-0.6 1,-0.1 40,-0.1 0.511 26.5-132.4 125.5 139.7 37.0 131.1 27.8
63 63 P - 0 0 57 0, 0.0 40,-1.4 0, 0.0 33,-0.1 -0.976 18.8-174.1 -81.4 130.6 36.3 134.5 27.4
64 64 C + 0 0 6 -2,-0.6 32,-0.1 17,-0.5 18,-0.1 0.576 54.1 161.7 -63.5 -10.1 37.2 134.8 23.8
65 65 G + 0 0 7 16,-0.3 2,-0.2 36,-0.1 33,-0.2 0.110 32.6 103.0 -84.8 130.0 36.4 138.1 25.2
66 66 E S S- 0 0 49 20,-0.3 2,-1.7 31,-0.1 20,-0.2 -0.686 70.1-116.3-146.0 141.1 36.8 141.7 24.7
67 67 S - 0 0 67 -2,-0.2 2,-0.3 18,-0.1 20,-0.2 -0.481 32.7-156.9 -85.0 98.1 33.6 142.9 23.4
68 68 C B -C 86 0B 10 18,-3.0 18,-0.9 -2,-1.7 20,-0.2 -0.599 3.8-156.3 -86.2 130.2 35.1 144.0 20.0
69 69 V + 0 0 126 -2,-0.3 2,-0.7 16,-0.1 -1,-0.2 0.368 51.6 114.1 -97.7 4.5 32.6 146.6 19.1
70 70 F + 0 0 110 18,-0.1 3,-0.2 16,-0.0 18,-0.1 -0.716 27.1 156.4-110.7 86.0 33.1 146.5 15.4
71 71 I + 0 0 90 -2,-0.7 -2,-0.0 1,-0.2 -1,-0.0 -0.771 21.1 136.1-134.9 76.9 30.3 145.3 13.1
72 72 P S S+ 0 0 103 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.660 81.0 51.2 -56.8 -27.4 30.3 146.5 9.5
73 73 C - 0 0 26 -3,-0.2 0, 0.0 1,-0.1 0, 0.0 -0.592 42.3-177.2-128.4 149.5 29.6 142.9 8.9
74 74 I S S+ 0 0 158 -2,-0.2 -1,-0.1 2,-0.0 -3,-0.0 0.330 106.1 47.9-120.3 -4.9 27.8 139.7 9.5
75 75 S S S+ 0 0 99 -3,-0.1 -2,-0.0 1,-0.1 0, 0.0 0.921 120.1 37.2 -64.5 -45.0 30.0 137.9 7.2
76 76 S S S+ 0 0 58 1,-0.2 2,-1.6 2,-0.1 3,-0.2 0.627 95.2 79.2 -94.2 -12.0 33.1 139.3 8.8
77 77 I S S- 0 0 30 1,-0.2 -1,-0.2 9,-0.0 -6,-0.0 -0.765 70.3-171.5 -88.7 90.6 32.2 139.4 12.3
78 78 V - 0 0 83 -2,-1.6 -1,-0.2 31,-0.1 -2,-0.1 0.781 27.1-128.7 -60.3 -42.3 32.9 135.7 12.4
79 79 G + 0 0 47 1,-0.2 2,-0.3 -3,-0.2 7,-0.1 0.847 38.1 167.0 98.6 98.8 31.5 135.3 15.8
80 80 C - 0 0 27 2,-0.1 2,-3.1 29,-0.0 -1,-0.2 -0.955 58.4 -69.0-155.1 157.2 33.0 133.7 18.8
81 81 S S S+ 0 0 95 -2,-0.3 2,-0.6 -16,-0.1 -17,-0.5 -0.100 75.1 133.7 -86.1 67.4 31.8 133.9 22.2
82 82 C > - 0 0 8 -2,-3.1 3,-1.0 -18,-0.1 -2,-0.1 -0.918 67.3-110.4-108.4 121.2 32.4 137.4 23.1
83 83 K T 3 S- 0 0 175 -2,-0.6 2,-0.8 1,-0.3 3,-0.2 -0.081 79.2 -14.5 -77.4 147.0 29.1 138.2 24.7
84 84 S T 3 S+ 0 0 129 1,-0.2 -1,-0.3 -17,-0.0 -3,-0.0 0.172 130.6 41.7 70.1 -21.7 26.8 140.6 23.0
85 85 K S < S- 0 0 107 -3,-1.0 2,-0.2 -2,-0.8 -1,-0.2 0.462 96.0 -78.8-118.9-112.2 29.2 142.1 20.5
86 86 V B -C 68 0B 6 -18,-0.9 -18,-3.0 -20,-0.2 -20,-0.3 -0.924 13.6-144.1-140.2-168.4 31.9 140.4 18.4
87 87 C + 0 0 2 -2,-0.2 2,-1.5 -20,-0.2 3,-0.1 0.264 47.1 135.6-121.0 5.1 35.5 139.0 18.9
88 88 Y + 0 0 58 -20,-0.2 -18,-0.1 1,-0.2 4,-0.1 -0.411 15.6 165.5 -84.3 88.9 37.2 139.9 15.6
89 89 K - 0 0 76 -2,-1.5 -1,-0.2 1,-0.1 3,-0.1 0.848 58.9-108.9 -64.8 -39.6 40.6 141.2 16.6
90 90 N S S+ 0 0 99 -3,-0.1 2,-0.4 25,-0.0 -1,-0.1 -0.439 111.3 31.9 137.5 -40.6 42.0 140.9 13.0
91 91 S S S- 0 0 29 2,-0.2 19,-0.1 22,-0.1 20,-0.1 -0.959 73.7-154.4-124.9 133.2 44.0 138.1 14.3
92 92 L + 0 0 4 -2,-0.4 18,-0.2 17,-0.2 2,-0.2 -0.026 41.4 152.9 -87.5 16.4 42.6 136.1 17.1
93 93 A - 0 0 29 17,-0.2 -2,-0.2 1,-0.1 -4,-0.0 -0.444 58.4-100.2 -60.6 138.6 46.1 135.4 17.9
94 94 L S S+ 0 0 59 -2,-0.2 11,-0.6 1,-0.1 2,-0.2 -0.370 91.4 82.4-114.3 48.1 45.4 134.9 21.4
95 95 P + 0 0 79 0, 0.0 2,-0.2 0, 0.0 4,-0.2 -0.501 57.2 148.6-130.7 77.2 45.9 137.3 24.4
96 96 T + 0 0 4 7,-0.2 2,-0.7 2,-0.2 6,-0.2 -0.540 54.6 22.1-115.7 169.5 42.8 139.5 24.2
97 97 L S S- 0 0 79 -2,-0.2 2,-0.3 4,-0.1 -31,-0.1 -0.772 130.9 -61.9 62.7-107.3 40.7 141.3 27.0
98 98 E >> - 0 0 126 -2,-0.7 4,-1.3 -33,-0.2 3,-0.5 -0.872 60.3 -85.9-131.8-177.3 43.8 141.0 29.0
99 99 K T 34 S+ 0 0 169 -2,-0.3 -3,-0.1 1,-0.2 -2,-0.1 0.675 114.7 71.5 -62.2 -20.2 45.6 137.8 30.1
100 100 D T 34 S+ 0 0 146 1,-0.2 -1,-0.2 3,-0.0 -3,-0.1 0.976 112.1 16.8 -60.9 -54.5 43.4 137.5 33.2
101 101 V T <4 S+ 0 0 75 -3,-0.5 -1,-0.2 -36,-0.1 -39,-0.2 0.644 108.2 102.7 -97.5 -11.2 39.9 136.5 32.0
102 102 I < - 0 0 22 -4,-1.3 -38,-0.2 -6,-0.2 -5,-0.1 -0.313 47.2-175.2 -67.7 147.4 41.3 135.4 28.5
103 103 T - 0 0 49 -40,-1.4 -7,-0.2 -42,-0.1 -2,-0.0 -0.871 66.2 -42.2-129.4 171.9 41.8 131.8 27.5
104 104 P - 0 0 41 0, 0.0 -11,-0.1 0, 0.0 -72,-0.0 0.110 60.8-156.8 -48.7 123.0 43.5 131.0 24.1
105 105 A + 0 0 4 -11,-0.6 2,-0.1 2,-0.0 -12,-0.1 0.383 59.3 88.9 -95.5 2.4 41.7 133.5 22.0
106 106 A + 0 0 11 -12,-0.1 2,-0.2 3,-0.1 -13,-0.1 -0.334 41.2 170.0 -63.1 152.3 42.3 131.7 18.9
107 107 L S > S- 0 0 58 -2,-0.1 3,-0.9 -76,-0.0 4,-0.5 -0.708 74.4 -77.0-119.3-148.0 40.7 129.1 16.9
108 108 E T 3> S+ 0 0 71 -2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.517 135.7 81.4 -63.3 -5.1 41.7 128.1 13.4
109 109 A H 3> S+ 0 0 13 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.885 81.4 59.5 -59.5 -38.5 39.7 131.4 13.6
110 110 V H <> S+ 0 0 0 -3,-0.9 4,-1.1 -18,-0.2 -1,-0.2 0.807 106.4 44.6 -62.4 -40.8 43.1 132.7 14.5
111 111 L H > S+ 0 0 23 -4,-0.5 4,-1.1 1,-0.1 3,-0.3 0.992 109.9 54.8 -59.6 -51.9 44.4 131.4 11.1
112 112 K H < S+ 0 0 138 -4,-2.4 3,-0.3 1,-0.2 -2,-0.2 0.827 111.0 41.2 -62.4 -43.0 41.7 132.7 9.2
113 113 S H < S+ 0 0 18 -4,-2.2 -1,-0.2 1,-0.2 -22,-0.1 0.848 102.2 61.3 -71.0 -45.0 41.8 136.3 10.2
114 114 N H < S- 0 0 58 -4,-1.1 2,-0.3 -3,-0.3 -1,-0.2 0.685 108.3 -89.9 -60.5 -27.8 45.6 137.3 10.3
115 115 G < - 0 0 22 -4,-1.1 2,-1.6 -3,-0.3 -1,-0.2 -0.981 64.6 -4.4 155.4-164.5 46.1 136.6 6.8
116 116 G S S- 0 0 69 -2,-0.3 2,-4.1 1,-0.2 -4,-0.1 -0.431 77.7-100.2 -85.9 56.1 46.8 134.9 3.6
117 117 A S > S+ 0 0 57 -2,-1.6 4,-3.4 1,-0.3 5,-0.2 -0.274 120.0 70.1 73.3 -53.1 48.0 131.5 4.6
118 118 I H > S+ 0 0 108 -2,-4.1 4,-2.2 1,-0.2 5,-0.3 0.934 102.4 42.6 -60.5 -45.8 51.6 132.6 4.1
119 119 V H > S+ 0 0 56 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.920 117.6 43.8 -64.0 -45.7 51.5 134.8 7.1
120 120 N H > S+ 0 0 6 1,-0.2 4,-0.9 2,-0.2 8,-0.3 0.902 114.6 51.9 -63.0 -46.6 49.6 132.4 9.3
121 121 T H < S+ 0 0 22 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.847 120.2 30.0 -59.7 -45.1 51.8 129.6 8.2
122 122 K H < S+ 0 0 149 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.888 118.5 45.1 -81.1 -49.9 55.1 131.2 8.8
123 123 T H < S- 0 0 99 -4,-2.8 2,-0.3 -5,-0.3 -3,-0.1 0.926 108.9 -89.9 -62.7 -51.8 54.7 133.7 11.7
124 124 I < + 0 0 76 -4,-0.9 -1,-0.3 -5,-0.3 2,-0.2 -0.779 61.4 140.2 137.2-162.0 52.8 131.8 14.4
125 125 I S > S- 0 0 2 -2,-0.3 4,-2.0 -3,-0.1 5,-0.1 -0.349 78.1 -68.6 71.4 173.6 49.1 131.6 15.0
126 126 S H > S+ 0 0 24 -19,-0.4 4,-1.9 2,-0.3 5,-0.4 0.756 129.8 67.2 -60.4 -39.9 47.9 128.1 16.1
127 127 N H > S+ 0 0 3 1,-0.2 4,-1.5 3,-0.1 -1,-0.2 0.981 116.4 34.5 -44.0 -44.8 48.4 126.2 12.9
128 128 A H > S+ 0 0 9 -8,-0.3 4,-0.7 2,-0.2 -2,-0.3 0.814 113.9 49.9 -88.7 -40.7 52.0 126.9 13.8
129 129 I H >X S+ 0 0 69 -4,-2.0 3,-0.9 2,-0.2 4,-0.8 0.903 114.0 52.3 -64.3 -41.8 52.3 126.8 17.7
130 130 F H 3X>S+ 0 0 23 -4,-1.9 5,-1.2 1,-0.3 4,-0.7 0.938 100.7 58.3 -65.6 -40.5 50.4 123.4 17.3
131 131 E H 3<5S+ 0 0 11 -4,-1.5 -1,-0.3 -5,-0.4 -2,-0.2 0.695 109.2 56.2 -61.6 -18.8 53.1 122.4 14.7
132 132 E H XX5S+ 0 0 109 -3,-0.9 4,-1.8 -4,-0.7 3,-1.4 0.694 109.5 28.4 -59.8-110.8 55.4 123.1 17.8
133 133 T H 3X5S+ 0 0 55 -4,-0.8 4,-2.2 1,-0.3 5,-0.2 0.586 130.6 27.9 -62.7 -47.9 54.4 121.1 20.7
134 134 L H 3X5S+ 0 0 8 -4,-0.7 4,-3.2 2,-0.2 -1,-0.3 0.908 118.9 59.0 -70.9 -37.7 52.8 117.9 19.4
135 135 L H <> - 0 0 100 -2,-0.5 3,-0.6 -154,-0.3 -3,-0.1 -0.802 66.5 -90.7-148.7-179.2 66.7 107.3 11.3
158 158 T T 3 S+ 0 0 60 -2,-0.3 3,-0.2 1,-0.3 14,-0.1 0.234 84.8 117.2 -90.0 6.4 68.9 109.3 9.1
159 159 S T 3 S- 0 0 56 1,-0.2 2,-0.3 -156,-0.1 -1,-0.3 0.852 89.5 -3.8 -59.9 -42.4 68.6 106.9 6.0
160 160 A < - 0 0 14 -3,-0.6 -1,-0.2 -157,-0.2 -3,-0.1 -0.945 50.8-171.2-167.6 144.2 67.1 109.7 4.0
161 161 I + 0 0 46 -2,-0.3 2,-1.7 -3,-0.2 -3,-0.0 -0.436 15.3 172.0-132.6 47.3 65.9 113.2 4.5
162 162 G + 0 0 19 1,-0.2 7,-0.1 -2,-0.1 6,-0.1 -0.362 15.1 153.4 -84.0 67.2 64.1 114.3 1.4
163 163 C - 0 0 13 -2,-1.7 -1,-0.2 4,-0.3 5,-0.1 0.488 47.5-139.6 -88.8 -14.5 62.7 117.6 2.4
164 164 S S S+ 0 0 114 3,-0.1 -1,-0.1 1,-0.0 -2,-0.1 0.502 77.0 111.5 63.2 19.3 62.1 119.9 -0.5
165 165 C S S- 0 0 13 2,-0.3 -18,-0.3 -16,-0.1 3,-0.1 0.309 86.0-115.6-109.3 1.4 63.5 122.4 2.1
166 166 K S S+ 0 0 219 1,-0.2 2,-0.3 2,-0.1 3,-0.1 0.858 84.1 105.5 50.0 45.8 66.9 123.7 1.0
167 167 S S S- 0 0 37 1,-0.1 -2,-0.3 -21,-0.0 -4,-0.3 -0.969 80.4-127.1-145.5 141.3 68.6 122.1 4.0
168 168 K - 0 0 179 -2,-0.3 -5,-0.2 9,-0.1 -7,-0.2 0.920 52.5-152.2 -55.1 -40.0 70.7 119.0 3.8
169 169 V - 0 0 3 8,-0.4 2,-0.3 1,-0.1 -8,-0.1 0.667 21.2-172.9 70.6 127.6 68.2 117.8 6.6
170 170 C - 0 0 15 6,-0.8 2,-0.5 5,-0.3 -1,-0.1 -0.974 6.3-165.0-141.1 143.1 69.2 115.3 9.2
171 171 Y + 0 0 1 -2,-0.3 4,-0.1 1,-0.1 -11,-0.1 -0.968 32.0 136.5-130.5 121.2 67.0 113.7 11.8
172 172 R S S+ 0 0 179 -2,-0.5 -1,-0.1 -15,-0.1 3,-0.1 0.550 83.9 11.1-111.9 -21.6 68.5 111.9 14.6
173 173 N S S- 0 0 128 -16,-0.1 -2,-0.1 -34,-0.0 -17,-0.1 0.731 127.9 -54.8-130.1 -86.3 66.4 113.0 17.5
174 174 S S S+ 0 0 27 -35,-0.1 -34,-0.1 -36,-0.0 -37,-0.0 0.234 129.7 3.9 -97.7 -40.3 63.5 114.9 16.5
175 175 L S S- 0 0 63 -4,-0.1 -5,-0.3 -33,-0.1 -31,-0.1 0.215 71.4-166.0-118.7 8.8 65.2 117.5 14.5
176 176 A - 0 0 11 -7,-0.1 -6,-0.8 1,-0.1 -7,-0.1 0.515 16.2-146.6 -64.1 143.6 68.8 117.2 14.0
177 177 A 0 0 99 1,-0.1 -8,-0.4 -8,-0.1 -9,-0.1 0.870 360.0 360.0 -60.4 -42.6 70.6 120.2 12.6
178 178 N 0 0 120 -9,-0.1 -1,-0.1 -10,-0.1 -8,-0.1 -0.779 360.0 360.0 179.2 360.0 73.3 118.1 10.5