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 .
.
COMPND .
SOURCE .
AUTHOR .
130 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
6605.8 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
76 58.5 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 .
4 3.1 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 .
0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES .
1 0.8 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 .
7 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
7 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
52 40.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES .
4 3.1 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 1 0 1 1 1 0 0 0 1 0 0 0 0 0 0 1 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 .
0 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 ANTIPARALLEL BRIDGES PER LADDER .
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 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 I 0 0 45 0, 0.0 3,-0.3 0, 0.0 8,-0.1 0.000 360.0 360.0 360.0-120.7 23.0 -1.3 10.4
2 2 V - 0 0 27 1,-0.4 2,-0.2 6,-0.3 7,-0.1 0.874 360.0 -23.8 -63.3 -39.7 21.9 1.2 13.0
3 3 I S S- 0 0 8 2,-0.1 -1,-0.4 9,-0.1 86,-0.2 -0.734 79.5-137.0-135.3 160.4 19.7 -1.6 14.1
4 4 L > + 0 0 6 84,-1.4 5,-0.6 -3,-0.3 -2,-0.1 0.737 58.1 118.8 -94.6 -23.4 19.0 -4.0 11.5
5 5 S T > 5S- 0 0 13 3,-0.1 3,-3.6 1,-0.1 4,-0.3 -0.342 84.0 -89.0 -67.9 143.9 15.4 -5.0 11.6
6 6 V T 3 5S+ 0 0 0 1,-0.4 4,-0.2 105,-0.3 5,-0.2 0.229 120.5 44.3 -59.2 -38.2 14.0 -4.0 8.5
7 7 L T >>5S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 3,-0.7 0.851 114.1 51.3 -56.6 -37.1 12.8 -0.6 8.8
8 8 I H <>5S+ 0 0 5 -3,-3.6 4,-1.7 1,-0.3 -6,-0.3 0.899 111.4 48.0 -80.3 -30.6 15.9 0.5 10.5
9 9 M H 34 S+ 0 0 0 -3,-0.7 4,-0.8 -4,-0.2 -2,-0.2 0.373 107.0 60.1 -85.1 -29.4 15.9 0.6 5.1
11 11 L H X S+ 0 0 5 -4,-2.7 4,-1.1 1,-0.2 2,-0.3 0.906 116.0 37.7 -53.1 -45.7 16.2 3.8 7.3
12 12 V H < S+ 0 0 5 -4,-1.7 -1,-0.2 2,-0.3 -9,-0.1 -0.915 102.8 56.9-121.3 149.4 19.9 3.3 6.6
13 13 I H > S+ 0 0 30 -2,-0.3 4,-2.2 -3,-0.1 -1,-0.2 -0.806 113.9 61.2 81.8 -61.0 20.5 2.1 3.1
14 14 A H X S+ 0 0 10 -4,-0.8 4,-2.1 2,-0.3 6,-0.4 0.827 99.4 41.8 -72.4 -47.5 18.6 5.4 3.0
15 15 Q H < S+ 0 0 37 -4,-1.1 -1,-0.2 2,-0.2 -3,-0.1 0.909 117.1 54.7 -57.0 -40.1 20.7 7.9 4.7
16 16 N H 4 S+ 0 0 127 1,-0.2 -2,-0.3 -5,-0.1 -1,-0.2 0.888 111.4 45.0 -61.0 -39.4 23.5 6.1 2.6
17 17 Q H < S- 0 0 108 -4,-2.2 2,-0.3 1,-0.3 -1,-0.2 0.897 134.9 -25.7 -61.2 -46.8 21.5 6.7 -0.5
18 18 V < - 0 0 54 -4,-2.1 2,-1.1 2,-0.1 -1,-0.3 -0.932 54.0-125.1-167.6 136.2 20.5 10.3 -0.1
19 19 E + 0 0 75 -2,-0.3 2,-0.7 -3,-0.1 -4,-0.1 -0.373 57.3 139.4 -89.9 63.3 20.1 12.4 3.0
20 20 A - 0 0 29 -2,-1.1 2,-0.5 -6,-0.4 36,-0.2 -0.904 55.1-126.6-104.5 119.5 16.6 13.5 2.2
21 21 K E +A 55 0A 6 34,-2.5 34,-1.6 -2,-0.7 2,-0.4 -0.630 37.2 178.4-112.1 124.5 15.3 13.2 5.6
22 22 S E +A 54 0A 11 -2,-0.5 2,-0.3 32,-0.2 32,-0.2 -0.832 7.1 172.2 -82.2 140.4 12.6 11.6 7.4
23 23 C E +A 53 0A 1 30,-1.8 30,-2.5 -2,-0.4 39,-0.0 -0.949 25.8 174.7-143.4 133.1 12.2 11.9 11.2
24 24 C - 0 0 0 -2,-0.3 28,-0.2 28,-0.2 2,-0.2 -0.641 35.8 -87.3-138.8 156.2 9.0 10.5 12.4
25 25 P S >S- 0 0 43 0, 0.0 5,-0.6 0, 0.0 -1,-0.1 -0.403 78.9 -38.0 -67.1-175.1 6.7 9.5 15.1
26 26 S T >5S- 0 0 51 3,-0.3 4,-3.5 2,-0.2 5,-0.4 0.876 79.3 -61.4 -83.1-147.6 7.3 6.2 16.5
27 27 I H >5S+ 0 0 6 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.898 136.1 46.5 -55.9 -35.5 8.2 2.7 15.5
28 28 T H >5S+ 0 0 54 2,-0.2 4,-2.9 3,-0.2 -1,-0.2 0.936 112.1 41.2 -66.8 -52.9 5.1 3.0 13.5
29 29 A H >5S+ 0 0 4 1,-0.2 4,-1.5 2,-0.2 -3,-0.3 0.888 119.5 50.0 -69.6 -32.5 5.3 6.2 11.8
30 30 R H < S+ 0 0 3 -2,-0.2 4,-2.1 -24,-0.1 -2,-0.2 -0.680 121.1 45.5 74.7 -73.6 10.7 3.1 5.3
35 35 V H < S+ 0 0 2 -4,-2.9 -2,-0.2 -2,-1.9 5,-0.2 0.947 112.8 41.5 -68.8 -47.8 7.7 1.4 3.8
36 36 C T X>S+ 0 0 22 -4,-3.7 5,-2.0 1,-0.2 4,-1.4 0.858 114.2 57.7 -66.3 -32.0 5.8 4.2 2.0
37 37 R T 45S+ 0 0 40 -5,-0.2 3,-0.3 3,-0.2 -1,-0.2 0.942 103.9 50.0 -58.2 -45.6 9.2 5.4 0.9
38 38 L T <5S+ 0 0 23 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.845 103.7 57.4 -60.4 -39.9 10.1 2.0 -0.8
39 39 P T 45S- 0 0 63 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.833 118.0-119.7 -62.4 -34.8 6.6 1.9 -2.8
40 40 G T <5 + 0 0 50 -4,-1.4 -3,-0.2 1,-0.5 -2,-0.1 0.799 58.8 160.0 103.0 37.4 8.0 5.2 -4.0
41 41 T < - 0 0 49 -5,-2.0 -1,-0.5 1,-0.1 5,-0.2 -0.820 61.3 -98.9-106.1 113.2 5.0 6.9 -2.6
42 42 P >> - 0 0 75 0, 0.0 4,-1.6 0, 0.0 3,-1.4 -0.185 32.0-102.4 -65.7 152.3 6.9 10.1 -2.6
43 43 R H 3> S+ 0 0 62 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.718 116.5 51.1 -43.9 -50.8 8.5 11.1 0.6
44 44 P H 3> S+ 0 0 73 0, 0.0 4,-2.5 0, 0.0 -1,-0.3 0.829 106.1 51.9 -65.6 -34.4 5.8 13.7 1.6
45 45 V H <> S+ 0 0 67 -3,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.944 113.6 48.1 -59.1 -43.8 2.8 11.6 1.1
46 46 C H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.900 114.5 44.2 -59.9 -46.6 4.5 9.0 3.4
47 47 A H X>S+ 0 0 2 -4,-2.5 5,-3.8 2,-0.2 4,-2.8 0.870 109.1 53.8 -67.0 -40.6 5.4 11.6 6.0
48 48 S H <5S+ 0 0 93 -4,-2.5 -1,-0.2 3,-0.2 -2,-0.2 0.893 112.4 49.5 -65.0 -37.8 2.0 13.3 6.0
49 49 I H <5S+ 0 0 107 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.946 117.5 37.6 -62.1 -46.9 0.6 9.7 6.6
50 50 S H <5S- 0 0 24 -4,-2.2 -2,-0.2 -21,-0.1 -1,-0.2 0.887 111.3-107.4 -62.6 -44.7 3.0 8.9 9.5
51 51 G T <5S+ 0 0 35 -4,-2.8 2,-0.4 1,-0.3 -3,-0.2 0.565 77.5 145.0 95.9 53.0 3.2 12.2 11.3
52 52 C < - 0 0 14 -5,-3.8 2,-0.4 -28,-0.2 -1,-0.3 -0.952 44.4-131.4-135.8 149.6 6.7 12.4 9.8
53 53 K E -A 23 0A 72 -30,-2.5 -30,-1.8 -2,-0.4 2,-0.4 -0.805 8.4-164.9 -91.3 135.1 9.0 15.0 8.5
54 54 I E +A 22 0A 62 -2,-0.4 -32,-0.2 -32,-0.2 2,-0.2 -0.999 23.6 155.0-116.4 137.8 11.0 15.4 5.5
55 55 L E -A 21 0A 74 -34,-1.6 -34,-2.5 -2,-0.4 5,-0.0 -0.764 52.7-105.9-134.6 170.1 13.8 18.1 5.3
56 56 S S S+ 0 0 113 -2,-0.2 2,-0.2 -36,-0.2 -37,-0.1 0.645 85.4 89.3 -64.3 -18.4 17.0 18.7 3.5
57 57 V - 0 0 42 2,-0.2 -2,-0.2 -36,-0.1 -37,-0.0 -0.642 66.1-144.9-131.7 140.2 19.1 17.9 6.4
58 58 T S S+ 0 0 107 -2,-0.2 2,-0.7 1,-0.1 -38,-0.0 0.542 94.2 72.6 -83.7 -4.2 21.1 15.6 8.7
59 59 K S S+ 0 0 177 3,-0.0 -2,-0.2 0, 0.0 -1,-0.1 -0.979 71.9 173.4-104.9 113.0 20.3 17.5 11.8
60 60 C - 0 0 25 -2,-0.7 -2,-0.0 1,-0.3 -38,-0.0 -0.947 36.0 -69.9-145.9 98.3 16.8 16.4 12.0
61 61 P - 0 0 37 0, 0.0 -1,-0.3 0, 0.0 -8,-0.0 0.787 11.8-149.9 6.6 145.6 14.6 17.3 15.1
62 62 S S S+ 0 0 110 2,-0.1 -2,-0.0 -3,-0.1 -3,-0.0 0.551 102.6 69.5 -66.7 -29.2 14.6 16.2 18.6
63 63 N S S+ 0 0 129 1,-0.3 -1,-0.0 -40,-0.0 -39,-0.0 0.881 119.1 14.5 -62.5 -41.3 10.9 16.9 18.4
64 64 L S S+ 0 0 44 -39,-0.1 -1,-0.3 3,-0.0 -11,-0.2 -0.455 82.0 145.8-132.3 65.3 10.6 13.9 16.0
65 65 P + 0 0 54 0, 0.0 -42,-0.1 0, 0.0 -3,-0.1 -0.622 19.5 172.8 -62.6 151.7 13.7 11.6 16.1
66 66 Y + 0 0 17 -2,-0.2 2,-1.1 -37,-0.0 3,-0.3 0.140 67.2 90.4-117.6 -9.7 13.1 8.0 15.7
67 67 E + 0 0 28 1,-0.2 4,-0.4 -3,-0.1 3,-0.2 -0.587 23.4 144.0 -90.3 64.4 16.9 7.9 15.6
68 68 N + 0 0 49 -2,-1.1 -1,-0.2 1,-0.2 6,-0.2 0.801 49.4 134.7 -65.9 -32.1 18.0 7.4 19.0
69 69 L S S- 0 0 29 -3,-0.3 5,-0.2 1,-0.3 -1,-0.2 0.239 78.5 -9.1 58.3-129.0 20.2 5.5 16.6
70 70 K S S+ 0 0 162 1,-0.2 2,-3.9 -3,-0.2 -1,-0.3 0.775 129.4 73.0 -63.6 -36.1 23.9 6.0 17.3
71 71 N S S- 0 0 128 -4,-0.4 -1,-0.2 1,-0.3 -2,-0.1 -0.172 93.8-165.3 -79.7 58.5 22.7 8.5 19.8
72 72 S + 0 0 79 -2,-3.9 -1,-0.3 1,-0.2 2,-0.3 0.381 38.9 144.7 -60.4 -47.0 21.9 5.3 21.2
73 73 G S S- 0 0 63 -3,-0.2 -1,-0.2 2,-0.1 -4,-0.1 0.537 70.1 -81.7 64.2 3.5 19.6 6.3 23.8
74 74 D - 0 0 113 -2,-0.3 2,-0.1 -5,-0.2 -6,-0.1 0.683 32.5-105.4 71.2 148.3 17.5 3.2 23.3
75 75 V - 0 0 27 1,-0.1 -1,-0.1 -7,-0.1 -2,-0.1 -0.347 51.0-113.4-126.8 41.1 14.8 1.9 20.9
76 76 V > - 0 0 67 3,-0.2 4,-1.6 -2,-0.1 -1,-0.1 0.795 22.3 -82.5 69.1 154.2 11.4 1.8 22.5
77 77 N H > S+ 0 0 126 1,-0.3 4,-1.8 2,-0.3 5,-0.1 0.758 115.6 44.9 -77.9 -43.9 8.6 -0.4 23.7
78 78 E H > S+ 0 0 103 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.895 115.7 53.1 -62.9 -37.1 6.4 -1.4 20.7
79 79 Y H > S+ 0 0 0 1,-0.3 4,-3.4 2,-0.2 -2,-0.3 0.891 102.6 57.8 -68.4 -36.2 9.7 -2.0 18.9
80 80 C H < S+ 0 0 43 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.857 107.5 47.0 -62.8 -34.1 10.6 -4.1 21.8
81 81 K H < S+ 0 0 180 -4,-1.8 -2,-0.2 1,-0.1 -1,-0.2 0.904 115.4 43.9 -62.0 -42.6 7.4 -6.1 21.0
82 82 L H < S- 0 0 45 -4,-2.2 -2,-0.2 -5,-0.1 -3,-0.2 0.912 136.0 -0.1 -60.2 -45.8 8.3 -6.3 17.2
83 83 G S < S- 0 0 17 -4,-3.4 2,-0.3 -5,-0.2 -3,-0.1 0.218 84.1 -92.9 -96.4-162.6 11.7 -7.1 18.3
84 84 C > - 0 0 78 -2,-0.0 4,-1.7 0, 0.0 5,-0.1 -0.657 33.8-136.4 -74.5 147.1 13.8 -7.6 21.1
85 85 A H > S+ 0 0 29 -2,-0.3 4,-0.9 1,-0.2 5,-0.1 0.850 114.4 47.4 -64.0 -35.1 15.1 -4.3 21.5
86 86 S H > S+ 0 0 91 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.807 101.5 63.8 -61.2 -36.2 18.2 -6.5 22.0
87 87 S H > S+ 0 0 45 1,-0.2 4,-3.3 2,-0.2 -2,-0.2 0.905 102.2 48.8 -63.0 -43.7 17.5 -8.7 18.9
88 88 V H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 -84,-1.4 0.861 113.3 45.6 -62.9 -40.0 18.0 -5.8 16.6
89 89 C H X S+ 0 0 55 -4,-0.9 4,-2.8 2,-0.2 5,-0.2 0.869 113.6 50.1 -66.5 -42.9 21.2 -4.7 18.2
90 90 G H X S+ 0 0 32 -4,-3.0 4,-3.1 1,-0.2 -2,-0.2 0.920 113.5 48.3 -62.9 -40.1 22.4 -8.3 18.3
91 91 A H X S+ 0 0 21 -4,-3.3 4,-3.2 2,-0.2 -2,-0.2 0.934 111.9 44.8 -64.7 -44.8 21.5 -8.5 14.7
92 92 L H X S+ 0 0 20 -4,-2.7 4,-3.6 1,-0.2 5,-0.5 0.919 117.2 48.3 -69.9 -34.7 23.2 -5.3 13.6
93 93 T H X S+ 0 0 56 -4,-2.8 4,-2.9 2,-0.2 5,-0.4 0.971 115.0 43.8 -68.5 -44.9 26.3 -6.3 15.6
94 94 T H X S+ 0 0 83 -4,-3.1 4,-2.7 -5,-0.2 -2,-0.2 0.959 119.1 44.3 -61.8 -46.8 26.4 -9.8 14.2
95 95 L H X S+ 0 0 14 -4,-3.2 4,-1.2 -5,-0.2 -1,-0.2 0.883 120.2 36.7 -68.7 -42.8 25.8 -8.5 10.8
96 96 Q H < S+ 0 0 102 -4,-3.6 -1,-0.2 -5,-0.2 -3,-0.2 0.943 120.2 48.0 -67.1 -44.2 28.2 -5.6 10.7
97 97 N H < S+ 0 0 123 -4,-2.9 -2,-0.2 -5,-0.5 -3,-0.2 0.833 110.9 49.7 -74.6 -32.4 30.7 -7.2 12.7
98 98 S H < S- 0 0 86 -4,-2.7 2,-0.2 -5,-0.4 -1,-0.2 0.989 125.2 -51.1 -53.4 -68.9 30.8 -10.5 10.7
99 99 D < - 0 0 69 -4,-1.2 -1,-0.2 -5,-0.2 0, 0.0 -0.699 50.5-120.7-172.1 176.1 31.0 -9.3 7.1
100 100 A S > S+ 0 0 60 -2,-0.2 4,-1.9 3,-0.1 5,-0.1 0.797 94.3 26.9-122.9 -52.3 29.1 -6.8 5.0
101 101 S H > S+ 0 0 84 2,-0.3 4,-2.7 1,-0.2 5,-0.1 0.846 121.7 55.1 -85.8 -31.9 27.3 -7.8 1.8
102 102 E H > S+ 0 0 131 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.902 110.5 49.4 -65.4 -34.5 26.9 -11.4 3.2
103 103 V H > S+ 0 0 18 2,-0.2 4,-4.1 1,-0.2 -2,-0.3 0.920 104.8 53.1 -70.9 -34.8 25.3 -9.5 6.1
104 104 V H X S+ 0 0 69 -4,-1.9 4,-3.4 2,-0.2 5,-0.2 0.957 116.2 45.2 -56.8 -46.2 23.0 -7.4 3.9
105 105 D H X S+ 0 0 114 -4,-2.7 4,-1.2 2,-0.2 -2,-0.2 0.939 117.0 40.4 -65.9 -44.7 21.9 -10.8 2.4
106 106 G H X S+ 0 0 38 -4,-3.1 4,-1.3 1,-0.2 -1,-0.2 0.899 119.7 48.6 -66.8 -38.9 21.6 -12.7 5.6
107 107 A H X S+ 0 0 0 -4,-4.1 4,-4.0 -5,-0.2 5,-0.4 0.862 97.5 64.4 -65.9 -40.9 20.0 -9.6 7.1
108 108 V H X S+ 0 0 45 -4,-3.4 4,-1.9 -5,-0.2 -1,-0.2 0.912 109.0 48.5 -55.3 -38.4 17.5 -9.0 4.2
109 109 A H < S+ 0 0 54 -4,-1.2 4,-0.3 2,-0.2 -1,-0.2 0.950 115.1 36.8 -63.4 -55.5 16.1 -12.3 5.4
110 110 Q H >X S+ 0 0 108 -4,-1.3 4,-3.1 2,-0.3 3,-0.9 0.863 113.5 60.7 -62.9 -39.4 15.8 -11.9 9.1
111 111 C H 3X S+ 0 0 1 -4,-4.0 4,-2.6 1,-0.3 -105,-0.3 0.897 105.6 49.3 -59.0 -42.6 14.8 -8.3 8.4
112 112 T H 3< S+ 0 0 47 -4,-1.9 -1,-0.3 -5,-0.4 -2,-0.3 0.388 103.6 55.3 -90.8 6.7 11.9 -9.8 6.6
113 113 N H X> S+ 0 0 102 -3,-0.9 4,-1.2 -4,-0.3 3,-0.9 0.772 108.7 51.9 -59.5 -52.9 11.2 -12.1 9.5
114 114 A H 3X S+ 0 0 15 -4,-3.1 4,-1.0 1,-0.3 -2,-0.3 0.855 131.8 12.4 -62.8 -37.2 11.0 -8.7 11.3
115 115 C H 3< S+ 0 0 0 -4,-2.6 11,-0.4 2,-0.2 -1,-0.3 -0.337 100.4 81.2-148.9 78.2 8.6 -7.4 8.8
116 116 S H <> S+ 0 0 37 -3,-0.9 4,-1.4 -4,-0.2 5,-0.3 0.317 116.8 35.5 -66.6 -42.3 7.2 -9.9 6.5
117 117 N H >X S+ 0 0 87 -4,-1.2 4,-1.6 2,-0.2 3,-0.7 0.957 121.0 42.3 -74.1 -56.0 5.1 -10.0 9.8
118 118 F H 3X S+ 0 0 63 -4,-1.0 4,-1.8 -5,-0.3 -1,-0.2 0.894 125.4 38.7 -58.2 -38.0 5.0 -6.5 10.9
119 119 C H 34 S+ 0 0 0 2,-0.2 -1,-0.3 1,-0.2 -2,-0.2 0.254 105.5 57.0-110.4 13.4 4.4 -5.4 7.4
120 120 T H << S+ 0 0 86 -4,-1.4 -1,-0.2 -3,-0.7 -3,-0.2 0.712 115.5 47.0 -77.6 -30.8 2.0 -7.9 5.8
121 121 K H < S+ 0 0 169 -4,-1.6 2,-0.3 -5,-0.3 -2,-0.2 0.855 126.3 23.8 -87.9 -39.6 -0.2 -6.9 8.7
122 122 G S < S- 0 0 32 -4,-1.8 0, 0.0 -5,-0.2 0, 0.0 -0.668 123.4 -56.2 -72.6 157.2 0.2 -3.3 8.5
123 123 S S S- 0 0 96 -2,-0.3 2,-0.3 2,-0.0 -91,-0.0 0.580 86.8 -16.2 65.3-153.2 1.1 -2.3 5.1
124 124 A S S- 0 0 33 -92,-0.1 2,-0.2 -3,-0.0 -4,-0.1 -0.776 75.4 -88.6-115.5 144.0 3.8 -3.1 2.6
125 125 N - 0 0 60 -2,-0.3 -9,-0.1 1,-0.1 3,-0.1 -0.488 36.7-122.2 -68.1 137.4 7.1 -4.8 3.5
126 126 A S > S+ 0 0 0 -11,-0.4 2,-0.7 1,-0.2 3,-0.6 0.692 91.7 55.3 -62.4 -40.9 9.8 -2.5 4.5
127 127 V T 3 + 0 0 17 -12,-0.3 -1,-0.2 1,-0.2 -2,-0.1 -0.778 49.6 107.3-105.3 99.6 12.5 -3.2 2.1
128 128 E T 3 S+ 0 0 137 -2,-0.7 -1,-0.2 -93,-0.1 -2,-0.1 -0.025 84.1 77.0 -95.6 -0.1 11.5 -2.9 -1.4
129 129 T < 0 0 15 -3,-0.6 -2,-0.2 -95,-0.0 -3,-0.1 0.809 360.0 360.0 -63.9 -40.2 13.8 -0.0 -0.2
130 130 A 0 0 57 -22,-0.0 -120,-0.0 -117,-0.0 -117,-0.0 -0.583 360.0 360.0-131.8 360.0 16.4 -2.7 -0.6