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 .
127 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
6536.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
62 48.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES .
2 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
2 1.6 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 0.8 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 .
13 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
7 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
32 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES .
1 0.8 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 0 0 0 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX .
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 PARALLEL 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 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 C 0 0 0 0, 0.0 2,-0.6 0, 0.0 17,-0.3 0.000 360.0 360.0 360.0 161.6 35.6 129.5 81.9
2 2 A > - 0 0 0 15,-0.2 3,-1.7 17,-0.1 13,-1.7 -0.771 360.0-174.0 -90.6 69.6 38.7 130.5 83.7
3 3 Q B 3 +aB 15 32A 9 29,-1.3 29,-1.9 -2,-0.6 28,-0.2 -0.535 65.4 73.1 -96.5 59.5 36.7 132.0 86.4
4 4 K T 3 S+ 0 0 114 -2,-1.5 -1,-0.3 11,-1.0 12,-0.1 -0.012 102.9 47.1-119.9 13.4 39.1 133.6 88.5
5 5 Y S < S+ 0 0 134 -3,-1.7 -2,-0.2 10,-0.3 11,-0.1 0.533 96.3 83.7 -90.2 -4.2 39.5 136.1 85.9
6 6 N > + 0 0 1 9,-0.2 4,-2.0 1,-0.2 5,-0.2 0.952 43.8 144.0 -81.6 -55.4 35.6 136.2 85.7
7 7 G T 4 S- 0 0 76 2,-0.2 2,-0.3 3,-0.2 -1,-0.2 0.486 88.1 -32.6 80.6 2.3 35.1 138.6 88.5
8 8 G T 4 S- 0 0 34 21,-0.2 2,-1.0 18,-0.0 3,-0.4 -0.956 131.2 -16.8 141.8-163.4 32.4 139.9 86.5
9 9 R T 4 S+ 0 0 193 -2,-0.3 -2,-0.2 1,-0.2 -3,-0.1 -0.543 108.5 114.8 -84.8 62.7 32.2 140.1 82.8
10 10 G < - 0 0 27 -4,-2.0 -1,-0.2 -2,-1.0 -3,-0.2 0.683 64.5-176.2 -77.6 -18.3 35.7 139.6 83.6
11 11 F - 0 0 54 -3,-0.4 3,-0.2 -5,-0.2 -8,-0.1 0.802 24.7 -64.7 -64.5 154.6 35.5 136.4 82.0
12 12 C S S+ 0 0 0 1,-0.3 2,-5.7 3,-0.1 3,-0.2 0.424 89.7 73.5 68.0 176.8 36.8 133.2 81.0
13 13 N S S+ 0 0 84 1,-0.2 -1,-0.3 5,-0.1 8,-0.1 -0.150 99.1 56.4 69.0 -49.7 39.6 132.9 78.5
14 14 S S S+ 0 0 58 -2,-5.7 2,-0.5 -3,-0.2 -1,-0.2 0.950 83.6 30.0 -94.7 -57.9 41.9 134.0 81.0
15 15 F B S-a 3 0A 114 -13,-1.7 -11,-1.0 -3,-0.2 -10,-0.3 -0.925 88.7 -32.0-140.6 117.1 42.9 132.9 84.5
16 16 G S S+ 0 0 50 -2,-0.5 2,-0.3 1,-0.2 19,-0.2 0.676 99.7 84.0 58.2 24.5 43.2 130.0 87.0
17 17 N S S- 0 0 8 -15,-0.1 2,-1.2 17,-0.1 -1,-0.2 -0.715 109.7 -77.2-120.4-176.0 40.5 127.8 85.9
18 18 Y - 0 0 119 -17,-0.3 2,-4.1 -2,-0.3 -5,-0.1 -0.661 47.6-146.0 -69.7 101.0 41.2 125.4 83.0
19 19 N + 0 0 95 -2,-1.2 -17,-0.1 1,-0.2 -1,-0.1 -0.368 64.2 127.4 -81.5 74.4 40.8 128.3 80.5
20 20 F + 0 0 97 -2,-4.1 -1,-0.2 -19,-0.2 -2,-0.1 -0.293 50.2 174.7-104.7 32.9 39.4 125.5 78.3
21 21 C - 0 0 34 1,-0.2 -2,-0.1 -8,-0.1 18,-0.0 -0.118 50.6-178.0 -73.0 127.9 36.7 128.2 78.1
22 22 Q - 0 0 23 43,-0.1 -1,-0.2 3,-0.0 -3,-0.1 0.609 49.0-134.1 -63.8 -15.7 33.8 128.0 76.0
23 23 C + 0 0 13 1,-0.1 42,-0.1 38,-0.1 -2,-0.1 0.831 42.6 172.5 54.4 40.1 33.7 131.3 77.8
24 24 E - 0 0 0 1,-0.2 41,-0.1 40,-0.1 -1,-0.1 0.745 53.9 -91.6 -62.8 -24.6 30.4 129.9 78.1
25 25 Y - 0 0 30 42,-0.1 2,-4.6 43,-0.1 3,-0.2 0.188 45.2 -71.4 137.1 144.4 30.1 132.8 80.3
26 26 P S S+ 0 0 4 0, 0.0 16,-0.1 0, 0.0 15,-0.1 -0.110 87.4 118.3 -70.3 67.6 30.7 133.1 84.0
27 27 C S S+ 0 0 1 -2,-4.6 13,-0.2 14,-0.3 3,-0.1 -0.008 76.2 66.8 -88.2 7.9 27.7 131.3 84.9
28 28 C S S+ 0 0 1 -3,-0.2 2,-2.5 11,-0.1 -1,-0.1 0.724 93.6 165.5 -60.5 -42.3 30.6 129.6 86.1
29 29 I - 0 0 52 -21,-0.1 2,-0.3 3,-0.1 -21,-0.2 -0.299 51.5 -1.0 83.5 -54.3 29.7 133.0 87.6
30 30 S S S+ 0 0 61 -2,-2.5 -26,-0.1 1,-0.1 -27,-0.1 -0.965 118.7 19.2-154.4 168.7 32.1 132.7 90.5
31 31 K + 0 0 175 -2,-0.3 2,-0.4 -28,-0.2 3,-0.2 0.892 65.0 154.1 54.8 57.6 34.5 130.4 92.0
32 32 C B +B 3 0A 3 -29,-1.9 -29,-1.3 1,-0.2 -1,-0.1 -0.709 39.7 104.1-129.9 85.5 35.3 128.1 89.1
33 33 D + 0 0 74 -2,-0.4 -1,-0.2 -31,-0.1 -16,-0.1 -0.503 45.1 132.7-113.5 34.4 38.6 126.6 89.3
34 34 G S >> S- 0 0 33 -3,-0.2 3,-4.2 4,-0.1 4,-0.9 -0.419 90.0-113.5 -61.2 29.7 35.8 124.3 90.2
35 35 E T 34 - 0 0 109 1,-0.4 -2,-0.1 2,-0.2 -18,-0.1 0.302 61.7 -47.7 60.4 31.6 38.5 123.1 87.8
36 36 V T 34 S+ 0 0 10 -35,-0.3 -1,-0.4 2,-0.2 59,-0.1 0.481 108.2 132.9 63.1 19.6 36.4 122.9 84.7
37 37 G T <4 + 0 0 0 -3,-4.2 2,-0.5 1,-0.2 54,-0.5 0.868 69.1 26.8 -63.7 -45.8 34.1 121.2 86.9
38 38 M < + 0 0 17 -4,-0.9 -2,-0.2 -37,-0.1 -1,-0.2 -0.992 46.8 161.7-118.3 130.7 31.1 123.1 85.8
39 39 L + 0 0 0 -2,-0.5 2,-0.2 48,-0.2 3,-0.2 -0.435 45.1 156.6-122.8 57.0 30.9 124.6 82.4
40 40 S + 0 0 0 1,-0.2 -13,-0.2 -13,-0.2 -2,-0.1 -0.490 44.9 21.7 -91.3 138.7 27.3 124.7 83.4
41 41 C - 0 0 4 -2,-0.2 -14,-0.3 1,-0.1 -1,-0.2 0.993 65.1-162.7 61.5 79.9 24.8 127.0 81.9
42 42 T - 0 0 12 1,-0.2 27,-0.1 -3,-0.2 -1,-0.1 0.570 47.2-103.4 -67.5 -23.8 26.5 127.8 78.8
43 43 C - 0 0 0 25,-0.1 2,-0.5 24,-0.1 26,-0.4 0.260 20.3-115.9 105.5 151.7 24.3 130.6 78.6
44 44 T - 0 0 1 24,-1.6 2,-0.5 69,-0.1 13,-0.1 -0.957 15.6-151.1-120.5 117.0 21.3 131.8 76.7
45 45 Y > - 0 0 96 -2,-0.5 3,-0.9 3,-0.2 6,-0.2 -0.827 23.9-132.0-109.9 119.6 21.5 134.6 74.4
46 46 E T 3 S+ 0 0 96 -2,-0.5 -1,-0.1 1,-0.3 -2,-0.0 0.370 94.2 83.9 -79.6 -0.6 18.1 136.0 74.5
47 47 C T 3 S- 0 0 86 1,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.328 119.4 -95.0 -66.4 -3.4 17.6 136.3 70.8
48 48 G S < S- 0 0 34 -3,-0.9 66,-0.2 2,-0.0 -3,-0.2 -0.848 89.8 -24.8 116.7 -84.5 16.6 132.6 71.1
49 49 P - 0 0 50 0, 0.0 8,-0.1 0, 0.0 -3,-0.1 -0.889 34.5-162.6-151.2 128.1 19.9 131.2 70.2
50 50 P S S+ 0 0 40 0, 0.0 7,-0.1 0, 0.0 -4,-0.1 0.542 81.0 105.2 -58.1 -16.4 22.7 132.7 68.3
51 51 L S S- 0 0 16 5,-0.2 14,-0.0 -6,-0.2 -7,-0.0 -0.407 82.2 -99.2 -86.1 152.7 23.3 128.9 68.5
52 52 P - 0 0 84 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.050 55.7 -63.5 -83.1-176.0 22.6 126.8 65.5
53 53 P S S+ 0 0 128 0, 0.0 2,-1.2 0, 0.0 3,-0.1 0.124 108.2 88.5 -87.0 13.9 19.6 124.7 64.8
54 54 K S S- 0 0 127 -2,-0.2 3,-0.0 1,-0.2 -3,-0.0 -0.813 96.6-125.2 -81.1 79.1 19.7 122.3 67.5
55 55 G S S+ 0 0 41 -2,-1.2 -1,-0.2 -6,-0.0 -4,-0.1 0.341 73.9 104.3 51.3-130.8 17.8 124.8 69.3
56 56 N - 0 0 33 55,-0.2 2,-0.3 -3,-0.1 -5,-0.2 0.149 68.0-109.3 67.9-171.5 20.0 125.3 72.5
57 57 V + 0 0 6 1,-0.1 -15,-0.2 -8,-0.1 -1,-0.1 -0.866 68.6 13.2-150.5 159.0 22.1 128.3 73.0
58 58 C - 0 0 0 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.941 46.6-176.8 65.7 79.9 25.8 129.1 73.1
59 59 S - 0 0 27 -3,-0.1 3,-0.3 1,-0.0 -1,-0.2 -0.941 40.7 -99.4-120.4 147.3 28.2 126.7 71.8
60 60 G S S+ 0 0 30 -2,-0.4 2,-0.4 1,-0.2 3,-0.4 0.337 83.7 53.9 -60.1 -42.0 31.6 127.9 72.3
61 61 G + 0 0 78 1,-0.2 -1,-0.2 2,-0.1 4,-0.2 -0.166 68.8 80.6-111.0 34.5 33.7 129.4 69.8
62 62 T S S- 0 0 111 2,-2.3 -1,-0.2 -2,-0.4 3,-0.1 0.552 115.3 -75.8 -97.0 -1.2 32.7 132.5 67.7
63 63 G S S+ 0 0 85 1,-0.4 2,-0.3 -3,-0.4 -2,-0.1 0.160 119.4 86.2 84.2 -1.3 33.4 135.3 70.1
64 64 M + 0 0 76 -4,-0.2 -2,-2.3 -5,-0.1 -1,-0.4 -0.907 25.1 88.0-154.9 175.1 30.1 133.9 71.5
65 65 C S S+ 0 0 1 -2,-0.3 -1,-0.1 -4,-0.2 -5,-0.1 -0.027 72.7 133.2 71.0 15.6 28.6 131.4 73.6
66 66 S - 0 0 34 1,-0.1 3,-0.2 -7,-0.1 -2,-0.1 0.454 53.3-173.5 -74.8 -12.5 29.5 134.7 75.3
67 67 G - 0 0 4 1,-0.2 -24,-0.1 -24,-0.2 -1,-0.1 0.558 49.4-116.7 102.8 157.3 26.1 134.4 76.6
68 68 K + 0 0 78 -43,-0.1 -24,-1.6 -23,-0.1 -1,-0.2 -0.661 48.8 151.6-123.2 99.1 23.4 135.7 78.4
69 69 C - 0 0 7 -26,-0.4 -24,-0.1 -3,-0.2 45,-0.0 -0.987 25.6-170.4 -95.7 121.9 23.2 133.3 81.2
70 70 P - 0 0 65 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.746 63.4 -34.6 -59.0 -24.6 21.8 135.2 84.0
71 71 Y S S- 0 0 74 -3,-0.1 3,-0.1 1,-0.1 -28,-0.1 -0.804 90.2 -44.7-156.7-168.5 22.7 132.2 86.3
72 72 K S S+ 0 0 60 -2,-0.2 2,-2.2 1,-0.2 -31,-0.1 0.591 92.4 165.9 -52.8 -22.0 23.2 128.6 87.3
73 73 C + 0 0 0 44,-0.1 47,-0.6 -32,-0.1 48,-0.4 -0.219 17.5 78.2 80.6 -52.0 20.0 129.3 85.3
74 74 C S > S- 0 0 3 -2,-2.2 2,-1.0 46,-0.2 4,-0.7 -0.100 81.8 -91.5-117.0 171.9 18.5 126.3 84.2
75 75 D T 4 S+ 0 0 24 1,-0.2 50,-0.2 2,-0.1 36,-0.1 -0.874 81.0 105.8 -92.1 95.1 16.4 123.4 85.3
76 76 T T 4 S- 0 0 25 -2,-1.0 -1,-0.2 48,-0.2 49,-0.2 0.028 106.8 -98.0-112.8 14.9 18.7 120.8 86.4
77 77 S T >4 - 0 0 11 47,-0.7 3,-3.9 -3,-0.4 4,-0.3 0.924 52.4-149.2 55.7 64.8 17.6 121.7 90.0
78 78 M T 3X S+ 0 0 0 -4,-0.7 4,-3.4 46,-0.4 5,-0.2 0.651 90.2 77.5 -55.4 -21.1 20.8 123.5 89.5
79 79 E T 34 S+ 0 0 106 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.891 109.6 37.1 -52.1 -30.6 21.7 123.3 93.2
80 80 R T <4 S+ 0 0 135 -3,-3.9 -2,-0.3 2,-0.2 6,-0.3 0.350 109.3 58.2 -96.4 -4.7 22.5 119.8 91.6
81 81 I T 4 S+ 0 0 1 -4,-0.3 -2,-0.2 1,-0.1 -3,-0.2 0.883 107.6 52.7 -64.6 -40.7 23.8 121.0 88.3
82 82 T S < S+ 0 0 31 -4,-3.4 -2,-0.2 4,-0.1 2,-0.1 0.693 103.4 89.4 -65.9 -15.2 26.3 122.8 90.4
83 83 S S >> S- 0 0 34 -5,-0.2 4,-2.1 4,-0.1 3,-1.4 -0.451 87.2 -89.3-126.1 163.6 27.1 119.7 92.2
84 84 L H 3>>S+ 0 0 130 1,-0.3 4,-1.7 2,-0.2 5,-0.6 0.475 114.6 38.0 -60.2 -43.4 29.4 116.7 92.1
85 85 V H 3>5S+ 0 0 123 1,-0.2 4,-1.3 2,-0.2 5,-0.4 0.928 130.4 36.2 -64.0 -41.2 27.9 113.9 90.0
86 86 F H <>5S+ 0 0 45 -3,-1.4 4,-4.2 -6,-0.3 5,-0.5 0.996 114.7 53.6 -69.2 -48.0 26.6 116.5 87.7
87 87 F H X5S+ 0 0 56 -4,-2.1 4,-1.9 1,-0.3 -48,-0.2 0.857 119.9 27.8 -73.5 -38.7 29.4 119.0 87.7
88 88 A H X5S+ 0 0 30 -4,-1.7 4,-2.0 2,-0.2 -1,-0.3 0.867 121.8 49.5 -78.7 -41.9 32.2 116.7 86.8
89 89 S H X> S- 0 0 55 -2,-0.3 4,-2.8 4,-0.1 3,-0.8 0.425 100.4-176.4 82.5 9.0 32.4 113.6 73.4
98 98 V H 3> + 0 0 60 1,-0.3 4,-3.1 -3,-0.2 5,-0.2 0.463 49.7 23.8 -54.6 -54.2 32.0 117.1 73.3
99 99 N H 3> S+ 0 0 104 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.909 129.9 36.6 -69.1 -44.6 29.0 117.7 70.9
100 100 Q H <> S+ 0 0 112 -3,-0.8 4,-2.8 2,-0.2 5,-0.3 0.870 118.1 49.5 -65.3 -40.3 27.2 114.5 71.1
101 101 T H X S+ 0 0 42 -4,-2.8 4,-2.4 2,-0.2 5,-0.4 0.921 113.9 50.7 -66.4 -35.7 27.8 114.0 74.6
102 102 R H X S+ 0 0 16 -4,-3.1 4,-2.6 -5,-0.4 5,-0.5 0.943 113.5 42.6 -63.8 -47.0 26.6 117.6 75.1
103 103 A H X S+ 0 0 7 -4,-2.8 4,-3.3 -5,-0.2 5,-0.4 0.958 116.4 45.9 -62.9 -47.9 23.5 117.2 73.2
104 104 D H X S+ 0 0 92 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.961 120.7 38.3 -62.8 -49.2 22.5 113.9 74.6
105 105 S H X S+ 0 0 28 -4,-2.4 4,-2.1 -5,-0.3 -1,-0.2 0.946 123.4 39.5 -66.7 -49.0 23.2 114.8 78.2
106 106 C H X S+ 0 0 14 -4,-2.6 4,-3.5 -5,-0.4 -1,-0.2 0.900 115.2 49.6 -73.7 -38.7 22.0 118.2 78.1
107 107 D H < S+ 0 0 72 -4,-3.3 -1,-0.2 -5,-0.5 -2,-0.2 0.885 112.0 49.0 -66.8 -39.0 19.0 117.7 76.0
108 108 E H < S+ 0 0 166 -4,-2.3 -1,-0.2 -5,-0.4 -2,-0.2 0.911 119.4 39.3 -61.6 -42.9 17.8 114.8 78.1
109 109 S H < S+ 0 0 56 -4,-2.1 2,-0.3 -5,-0.2 -2,-0.2 0.854 121.6 22.6 -70.5 -41.6 18.2 116.8 81.2
110 110 L < - 0 0 31 -4,-3.5 -1,-0.1 1,-0.2 3,-0.1 -0.902 52.2-149.3-156.4 173.6 17.0 120.1 80.1
111 111 G - 0 0 34 -2,-0.3 2,-0.5 1,-0.2 -55,-0.2 0.802 65.5 -9.6-110.9-116.4 15.2 122.2 78.0
112 112 L >> - 0 0 97 1,-0.2 4,-3.6 -57,-0.1 3,-0.7 -0.937 56.3-138.2-116.3 127.3 15.5 125.6 76.8
113 113 C H 3> S+ 0 0 11 -2,-0.5 4,-3.0 1,-0.3 -1,-0.2 0.773 101.3 43.2 -62.5 -41.5 18.2 127.4 78.4
114 114 E H 3> S+ 0 0 78 -66,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.909 118.7 42.6 -62.6 -42.6 16.2 130.7 78.8
115 115 T H <> S+ 0 0 74 -3,-0.7 4,-2.7 2,-0.2 -2,-0.2 0.853 113.8 54.4 -62.4 -38.2 13.0 129.1 79.8
116 116 C H X S+ 0 0 5 -4,-3.6 4,-2.6 1,-0.2 -2,-0.2 0.905 107.3 52.3 -58.1 -45.0 15.1 126.9 82.0
117 117 D H X S+ 0 0 4 -4,-3.0 4,-2.4 -5,-0.3 -2,-0.2 0.860 109.6 45.0 -59.3 -45.3 16.5 129.9 83.5
118 118 E H X S+ 0 0 136 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.894 111.3 53.1 -60.4 -46.6 13.3 131.6 84.3
119 119 R H X S+ 0 0 129 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.913 114.7 45.4 -59.2 -43.2 11.9 128.3 85.7
120 120 C H < S+ 0 0 3 -4,-2.6 -2,-0.2 -47,-0.6 -1,-0.2 0.834 105.4 55.4 -66.6 -40.9 15.1 128.3 87.9
121 121 Q H < S+ 0 0 129 -4,-2.4 -1,-0.2 -48,-0.4 -2,-0.2 0.893 109.6 51.0 -61.2 -39.3 15.0 131.8 89.1
122 122 A H < S- 0 0 85 -4,-2.1 2,-0.3 1,-0.3 -2,-0.2 0.947 145.3 -37.0 -59.7 -49.6 11.5 131.0 90.2
123 123 K S < S- 0 0 120 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.1 -0.811 71.2-101.8-174.3 152.7 12.9 127.9 92.0
124 124 H S S- 0 0 45 -2,-0.3 -47,-0.7 -3,-0.2 -46,-0.4 0.716 83.9 -36.4 -62.4 -38.4 15.6 125.9 90.8
125 125 G S S- 0 0 0 -48,-0.2 -50,-0.0 -49,-0.2 -9,-0.0 -0.648 107.9 -35.3-160.5-165.1 13.8 123.0 89.4
126 126 P 0 0 74 0, 0.0 -2,-0.1 0, 0.0 -51,-0.0 0.725 360.0 360.0 -51.5 -27.7 10.8 121.1 90.7
127 127 S 0 0 100 -4,-0.0 -4,-0.1 0, 0.0 0, 0.0 -0.840 360.0 360.0-167.7 360.0 12.2 122.0 94.1