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 .
131 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
7448.9 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
75 57.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES .
3 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
5 3.8 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 .
1 0.8 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 .
11 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
6 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
46 35.1 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 1 0 1 3 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX .
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 PARALLEL BRIDGES PER LADDER .
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 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 M 0 0 66 0, 0.0 4,-0.2 0, 0.0 13,-0.1 0.000 360.0 360.0 360.0 175.5 -12.1 6.1 -2.4
2 2 A + 0 0 41 1,-0.2 12,-0.3 12,-0.1 13,-0.3 0.922 360.0 3.6 -61.4 -43.5 -13.7 2.8 -1.5
3 3 K S S+ 0 0 163 11,-0.1 5,-0.3 12,-0.1 -1,-0.2 0.856 97.9 90.9-101.9 -47.7 -15.7 2.1 -4.4
4 4 S S S+ 0 0 95 2,-0.1 -2,-0.1 3,-0.1 -1,-0.0 0.471 84.2 31.8 -74.8 -39.8 -15.5 4.5 -7.4
5 5 S S > S- 0 0 51 -4,-0.2 2,-2.4 0, 0.0 3,-0.6 -0.843 89.8-110.1 -97.9 141.2 -12.8 3.6 -10.0
6 6 P T 3 + 0 0 109 0, 0.0 -2,-0.1 0, 0.0 3,-0.1 -0.483 66.8 138.9 -84.4 74.0 -12.2 -0.1 -10.4
7 7 T T > + 0 0 35 -2,-2.4 2,-3.2 -4,-0.1 3,-1.0 0.468 45.1 176.5 -66.3 -16.3 -8.8 -0.2 -8.9
8 8 Y T <> + 0 0 114 -3,-0.6 4,-2.7 1,-0.4 5,-0.2 -0.102 61.3 64.0 70.1 -59.8 -11.0 -3.0 -7.9
9 9 T H 3> S+ 0 0 20 -2,-3.2 4,-2.3 1,-0.2 -1,-0.4 0.936 111.3 45.9 -62.9 -40.2 -8.6 -5.0 -5.9
10 10 V H <> S+ 0 0 5 -3,-1.0 4,-3.1 2,-0.2 -1,-0.2 0.804 107.1 55.0 -61.1 -42.1 -8.8 -1.8 -3.8
11 11 L H > S+ 0 0 61 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.940 110.9 46.3 -62.3 -41.6 -12.5 -1.7 -4.0
12 12 F H X S+ 0 0 45 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.895 112.5 48.7 -61.4 -46.7 -12.6 -5.1 -2.6
13 13 L H X S+ 0 0 16 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.927 113.9 48.5 -62.1 -43.6 -10.1 -4.4 0.1
14 14 L H X S+ 0 0 8 -4,-3.1 4,-1.9 -12,-0.3 -2,-0.2 0.857 108.6 51.2 -67.3 -36.4 -12.1 -1.3 1.0
15 15 G H X S+ 0 0 29 -4,-2.4 4,-2.2 -13,-0.3 -1,-0.2 0.864 106.0 57.2 -62.0 -38.4 -15.4 -3.1 1.1
16 16 L H X S+ 0 0 27 -4,-2.1 4,-3.7 2,-0.2 -2,-0.2 0.890 104.3 51.9 -59.8 -39.0 -13.7 -5.5 3.3
17 17 L H X>S+ 0 0 2 -4,-1.7 4,-1.6 2,-0.2 5,-1.2 0.901 105.1 55.0 -58.9 -44.1 -12.9 -2.6 5.7
18 18 A H <5S+ 0 0 59 -4,-1.9 3,-0.3 1,-0.2 -1,-0.2 0.923 115.7 39.6 -60.0 -42.1 -16.5 -1.6 5.6
19 19 L H <5S+ 0 0 133 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.928 110.4 54.8 -66.2 -43.6 -17.2 -5.1 6.7
20 20 S H <5S- 0 0 2 -4,-3.7 -2,-0.2 -5,-0.1 -1,-0.2 0.487 111.6-129.0 -77.5 -5.5 -14.3 -5.5 9.2
21 21 T T <5S+ 0 0 104 -4,-1.6 -3,-0.2 -3,-0.3 3,-0.1 0.723 78.7 110.3 76.9 40.9 -15.9 -2.3 10.7
22 22 A >>< + 0 0 15 -5,-1.2 4,-1.0 1,-0.1 3,-0.9 -0.118 35.2 123.0-121.8 32.5 -12.9 0.2 10.9
23 23 T H 3> + 0 0 40 -6,-0.4 4,-3.5 1,-0.3 5,-0.3 0.654 54.7 81.8 -59.2 -18.6 -14.4 2.3 8.2
24 24 T H 3> S+ 0 0 85 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.940 96.6 40.2 -62.6 -44.6 -14.3 5.0 10.7
25 25 T H <4 S+ 0 0 34 -3,-0.9 -1,-0.2 2,-0.2 -2,-0.2 0.795 116.1 47.0 -65.6 -39.2 -10.5 5.6 9.8
26 26 F H < S+ 0 0 17 -4,-1.0 -2,-0.2 1,-0.1 -1,-0.2 0.919 114.8 50.2 -73.6 -35.9 -10.8 5.2 6.1
27 27 Q H < S+ 0 0 115 -4,-3.5 2,-2.6 1,-0.2 -2,-0.2 0.889 83.7 92.1 -63.2 -41.8 -13.9 7.6 6.1
28 28 N S < S- 0 0 78 -4,-1.8 2,-1.3 -5,-0.3 -1,-0.2 -0.459 74.8-148.6 -78.2 63.9 -12.5 10.4 8.0
29 29 E + 0 0 160 -2,-2.6 3,-0.2 1,-0.2 -1,-0.2 -0.158 55.9 123.7 71.1 -54.4 -11.2 12.4 5.2
30 30 G S S- 0 0 67 -2,-1.3 -1,-0.2 1,-0.2 97,-0.1 0.494 93.2 -69.9 -78.1 -11.3 -8.2 14.2 6.3
31 31 Q - 0 0 70 95,-0.3 96,-0.3 -3,-0.1 -1,-0.2 0.489 62.5-168.8 158.7 110.0 -6.3 12.7 3.6
32 32 R E -a 127 0A 37 94,-2.3 96,-1.4 -3,-0.2 97,-0.7 -0.387 23.3-136.1 -94.8 163.8 -5.2 9.0 3.4
33 33 S E -a 129 0A 0 41,-0.3 41,-0.3 95,-0.2 39,-0.2 -0.856 20.4-155.1 -86.9 146.1 -3.0 6.6 1.6
34 34 L + 0 0 10 95,-2.5 96,-0.1 -2,-0.4 40,-0.1 0.886 40.9 128.5 -68.5 -42.5 -4.8 3.4 0.8
35 35 I + 0 0 6 94,-0.3 3,-0.1 1,-0.2 -2,-0.0 -0.116 20.3 142.4-112.2 130.1 -2.2 0.7 0.4
36 36 G S S- 0 0 8 1,-0.1 2,-0.8 95,-0.1 3,-0.2 0.335 78.2 -28.4 -93.7-123.3 -0.9 -2.7 1.3
37 37 Q + 0 0 32 1,-0.2 3,-0.2 6,-0.1 -1,-0.1 -0.886 59.2 152.8 -98.4 113.3 0.8 -5.0 -1.2
38 38 F S S+ 0 0 14 -2,-0.8 -1,-0.2 1,-0.2 2,-0.2 0.451 76.7 38.5-107.3 -5.7 -0.3 -4.5 -4.7
39 39 N + 0 0 16 68,-0.2 75,-0.2 -3,-0.2 -1,-0.2 -0.668 55.3 111.5-151.6 101.1 3.0 -5.7 -5.9
40 40 S S S- 0 0 9 -3,-0.2 2,-1.0 70,-0.2 -1,-0.1 0.156 84.2-117.7-106.9 0.2 5.2 -8.4 -4.6
41 41 R S > S+ 0 0 160 1,-0.1 4,-2.8 -3,-0.1 5,-0.2 -0.606 116.5 56.3 71.2 -52.5 4.2 -10.1 -7.9
42 42 G H > S+ 0 0 40 -2,-1.0 4,-2.9 1,-0.2 5,-0.2 0.932 110.8 42.3 -63.9 -43.4 2.7 -12.7 -5.8
43 43 T H > S+ 0 0 16 2,-0.2 4,-2.7 3,-0.2 5,-0.3 0.892 111.8 53.6 -67.9 -37.6 0.6 -10.2 -4.2
44 44 F H > S+ 0 0 85 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.954 117.7 41.1 -60.9 -43.4 -0.2 -8.3 -7.6
45 45 K H X S+ 0 0 128 -4,-2.8 4,-3.8 2,-0.2 5,-0.2 0.937 114.2 48.9 -69.8 -44.8 -1.3 -11.6 -8.9
46 46 K H X S+ 0 0 75 -4,-2.9 4,-1.4 -5,-0.2 -2,-0.2 0.939 116.5 41.3 -61.5 -46.7 -3.1 -12.8 -5.9
47 47 I H < S+ 0 0 14 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.913 120.1 43.3 -71.6 -39.0 -5.1 -9.7 -5.4
48 48 K H < S+ 0 0 124 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.900 111.0 53.9 -65.3 -42.9 -5.8 -9.2 -9.1
49 49 N H < S- 0 0 121 -4,-3.8 -2,-0.2 -5,-0.2 -1,-0.2 0.658 114.6-145.1 -71.5 -17.6 -6.6 -13.0 -9.5
50 50 H < + 0 0 47 -4,-1.4 -3,-0.1 -5,-0.2 -2,-0.1 0.859 61.2 29.2 70.1 122.3 -8.8 -11.9 -6.8
51 51 P S S+ 0 0 57 0, 0.0 2,-0.2 0, 0.0 3,-0.1 0.856 81.2 145.9 9.7 136.3 -9.6 -14.3 -3.8
52 52 S S S- 0 0 23 1,-0.0 4,-0.5 0, 0.0 5,-0.2 -0.458 71.5 -76.8-171.9 166.2 -6.7 -16.3 -3.6
53 53 E S > S+ 0 0 149 -2,-0.2 4,-3.5 3,-0.2 5,-0.4 0.899 133.0 50.4 -61.2 -49.5 -4.8 -18.0 -0.9
54 54 S H > S+ 0 0 35 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.950 121.7 26.0 -61.8 -55.0 -3.5 -14.5 -0.2
55 55 V H > S+ 0 0 5 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.947 126.5 45.7 -69.6 -40.6 -6.6 -12.5 -0.1
56 56 Q H > S+ 0 0 99 -4,-0.5 4,-1.8 2,-0.2 -2,-0.2 0.909 112.3 53.5 -65.8 -37.1 -9.0 -15.2 1.0
57 57 R H X S+ 0 0 138 -4,-3.5 4,-2.1 -5,-0.2 -1,-0.2 0.939 116.4 39.9 -56.0 -47.7 -6.5 -16.4 3.6
58 58 S H X S+ 0 0 16 -4,-1.7 4,-2.7 -5,-0.4 7,-0.2 0.739 103.9 61.1 -74.2 -35.0 -6.4 -12.9 4.9
59 59 N H < S+ 0 0 39 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.917 116.3 41.6 -55.6 -43.7 -10.0 -12.0 4.7
60 60 E H < S+ 0 0 122 -4,-1.8 -2,-0.3 -5,-0.2 -1,-0.2 0.884 110.5 50.7 -64.8 -51.6 -10.2 -14.9 7.1
61 61 D H < S+ 0 0 71 -4,-2.1 -3,-0.2 -5,-0.1 -2,-0.2 0.849 80.3 173.8 -67.0 -37.0 -7.1 -14.3 9.4
62 62 F < + 0 0 89 -4,-2.7 -1,-0.1 1,-0.2 -3,-0.1 0.673 48.4 83.8 54.2 26.1 -8.8 -11.0 9.5
63 63 A S > S+ 0 0 56 -5,-0.2 4,-1.9 3,-0.1 -1,-0.2 0.563 98.6 21.4-133.6 -72.5 -6.3 -9.9 12.1
64 64 M H > S+ 0 0 130 2,-0.2 4,-2.3 1,-0.2 -2,-0.1 0.883 129.2 53.4 -60.1 -38.1 -3.0 -8.7 10.6
65 65 H H > S+ 0 0 21 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.880 104.8 52.1 -64.2 -40.3 -5.1 -8.2 7.5
66 66 K H > S+ 0 0 57 2,-0.2 4,-3.4 1,-0.2 5,-0.5 0.887 104.8 54.3 -62.7 -38.6 -7.5 -6.2 9.4
67 67 T H X S+ 0 0 40 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.969 113.2 48.1 -56.2 -47.7 -4.4 -4.1 10.6
68 68 K H < S+ 0 0 67 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.862 118.9 34.2 -60.5 -44.2 -3.9 -3.7 6.8
69 69 L H < S+ 0 0 15 -4,-3.1 -1,-0.2 1,-0.1 -2,-0.2 0.895 122.1 46.7 -73.2 -41.3 -7.5 -2.8 5.7
70 70 K H < S+ 0 0 57 -4,-3.4 2,-0.4 -5,-0.3 -2,-0.2 0.824 125.5 27.6 -79.3 -29.7 -8.3 -0.8 8.7
71 71 H S < S- 0 0 25 -4,-2.8 -1,-0.3 -5,-0.5 4,-0.1 -0.999 73.9-146.9-134.2 137.7 -5.1 1.0 8.6
72 72 K - 0 0 2 2,-0.7 3,-0.1 -2,-0.4 -4,-0.1 0.647 40.5-106.7 -69.4 -25.5 -3.4 1.6 5.5
73 73 F S S+ 0 0 20 1,-0.2 30,-0.3 28,-0.2 2,-0.2 0.739 108.2 55.7 50.7 38.2 0.3 1.5 6.5
74 74 V + 0 0 1 -41,-0.3 -2,-0.7 -40,-0.1 -41,-0.3 -0.724 57.0 162.7-144.9-179.2 -0.1 5.2 5.9
75 75 A + 0 0 4 -2,-0.2 -44,-0.1 -43,-0.2 23,-0.1 0.516 69.0 39.6-139.4 -62.7 -2.4 7.9 7.2
76 76 R S S+ 0 0 117 -44,-0.1 -44,-0.1 1,-0.1 2,-0.0 0.574 86.5 173.7 -90.8 -0.9 -1.8 11.7 7.0
77 77 S + 0 0 7 1,-0.1 52,-0.5 52,-0.0 2,-0.3 0.094 29.6 177.6 53.8 42.1 -0.6 11.0 3.6
78 78 G > - 0 0 28 50,-0.1 4,-0.7 1,-0.1 3,-0.2 -0.683 52.6 -82.3 -70.2 150.0 0.3 13.7 1.2
79 79 G T 4 S- 0 0 50 -2,-0.3 2,-1.4 1,-0.2 -1,-0.1 -0.035 92.3 -1.3 -84.9 163.3 1.5 11.9 -1.7
80 80 E T > S+ 0 0 113 1,-0.2 4,-2.4 -3,-0.1 -1,-0.2 -0.036 112.6 83.6 61.4 -31.4 4.7 10.3 -3.1
81 81 T H > S+ 0 0 74 -2,-1.4 4,-2.1 2,-0.2 5,-0.3 0.847 83.2 57.5 -60.2 -43.2 6.1 11.5 0.2
82 82 D H X S+ 0 0 0 -4,-0.7 4,-2.1 1,-0.2 5,-0.2 0.921 109.7 45.6 -60.7 -43.1 4.6 8.3 1.8
83 83 V H > S+ 0 0 21 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.914 108.5 52.9 -64.9 -44.0 6.7 6.2 -0.8
84 84 K H X S+ 0 0 154 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.952 118.7 38.5 -57.4 -43.7 10.1 8.1 -0.4
85 85 K H X S+ 0 0 75 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.741 110.5 52.2 -91.7 -24.1 9.9 7.6 3.3
86 86 M H < S+ 0 0 9 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.922 104.4 59.2 -64.5 -41.9 8.6 4.2 3.8
87 87 E H < S+ 0 0 81 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.925 108.6 47.5 -54.6 -44.6 11.2 3.0 1.5
88 88 G H < S+ 0 0 67 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.891 107.1 71.6 -60.2 -42.4 13.6 4.5 4.0
89 89 S < - 0 0 28 -4,-2.0 3,-0.1 1,-0.2 14,-0.0 -0.409 48.8-176.3 -64.3 139.7 11.9 2.9 6.9
90 90 M S S- 0 0 106 1,-0.3 14,-2.6 -2,-0.1 2,-0.3 0.713 71.5 -8.9 -69.7 -53.4 11.7 -0.6 8.0
91 91 P B +C 103 0B 63 0, 0.0 -1,-0.3 0, 0.0 12,-0.2 -0.901 31.2 154.2-147.7 146.3 9.3 0.0 10.9
92 92 D - 0 0 67 10,-0.6 11,-0.2 -2,-0.3 9,-0.1 -0.018 54.4-144.4-117.0 -8.0 7.4 2.1 13.1
93 93 Q - 0 0 116 9,-0.9 2,-2.8 1,-0.2 10,-0.1 0.411 28.3-116.7 64.4 8.0 5.1 -1.1 13.3
94 94 G - 0 0 5 6,-0.4 2,-0.5 8,-0.2 5,-0.4 -0.311 41.0-171.5 81.2 -47.0 2.2 1.3 13.5
95 95 K S S+ 0 0 175 -2,-2.8 2,-0.5 3,-0.1 -2,-0.1 -0.507 74.2 2.8 60.9-109.6 1.2 0.1 16.9
96 96 T S > S- 0 0 123 -2,-0.5 3,-0.6 3,-0.1 -2,-0.1 -0.966 100.5-116.1-101.8 130.6 -2.1 1.8 17.5
97 97 A T 3 S+ 0 0 17 -2,-0.5 4,-0.3 1,-0.3 -3,-0.1 0.450 83.4 110.9 -66.0 -14.2 -2.3 3.3 14.3
98 98 G T 3 S+ 0 0 49 2,-0.1 2,-0.3 -23,-0.1 -1,-0.3 0.501 75.0 14.6 -62.7 -40.2 -2.2 6.8 15.4
99 99 R S < S- 0 0 168 -3,-0.6 3,-0.1 -5,-0.4 -5,-0.1 -0.979 120.9 -5.3-136.0 150.7 1.2 8.2 14.4
100 100 D S S+ 0 0 73 -2,-0.3 2,-3.9 1,-0.2 -6,-0.4 0.812 70.5 175.5 57.9 37.2 4.1 7.5 12.1
101 101 Q + 0 0 8 -4,-0.3 2,-0.6 -8,-0.1 -1,-0.2 -0.259 16.8 157.1 -86.2 69.9 2.3 4.3 11.4
102 102 Q + 0 0 21 -2,-3.9 -9,-0.9 -3,-0.1 -10,-0.6 -0.794 18.7 172.1-103.4 116.1 4.8 3.3 8.9
103 103 V B +C 91 0B 15 -2,-0.6 2,-0.4 -30,-0.3 -17,-0.1 -0.967 2.1 171.5-122.2 128.2 5.6 -0.2 7.8
104 104 T + 0 0 4 -14,-2.6 2,-0.3 -2,-0.5 -2,-0.0 -0.937 6.0 167.6-132.9 112.4 7.8 -1.2 5.0
105 105 V >> - 0 0 50 -2,-0.4 3,-4.7 -14,-0.0 4,-0.5 -0.899 53.4 -90.8-134.4 155.3 8.7 -4.6 4.4
106 106 Q H 3> S+ 0 0 98 1,-0.4 4,-2.4 -2,-0.3 5,-0.1 0.447 124.3 58.8 -64.3 -25.1 10.3 -6.0 1.5
107 107 N H 3> S+ 0 0 70 2,-0.2 4,-2.4 1,-0.2 -1,-0.4 0.867 109.4 49.8 -57.1 -44.8 7.0 -6.9 -0.4
108 108 I H <> S+ 0 0 13 -3,-4.7 4,-3.1 2,-0.2 -2,-0.2 0.903 107.7 54.6 -63.0 -38.6 6.4 -3.1 -0.1
109 109 K H X S+ 0 0 91 -4,-0.5 4,-1.5 1,-0.2 -2,-0.2 0.926 109.4 46.9 -61.5 -45.0 9.9 -2.5 -1.4
110 110 E H X S+ 0 0 75 -4,-2.4 4,-3.8 1,-0.2 5,-0.3 0.877 114.2 45.5 -61.4 -41.9 9.1 -4.5 -4.4
111 111 A H X S+ 0 0 1 -4,-2.4 4,-2.7 2,-0.2 5,-0.4 0.912 106.3 56.9 -64.7 -44.8 5.9 -2.9 -5.1
112 112 S H < S+ 0 0 4 -4,-3.1 4,-0.3 1,-0.2 -1,-0.2 0.765 121.2 32.0 -62.5 -30.1 7.1 0.6 -4.6
113 113 K H X S+ 0 0 111 -4,-1.5 4,-0.8 -5,-0.2 -2,-0.2 0.811 118.9 47.8 -88.5 -38.8 9.7 -0.2 -7.4
114 114 E H < S+ 0 0 63 -4,-3.8 4,-0.3 -75,-0.2 -3,-0.2 0.898 116.8 43.1 -73.7 -37.3 8.0 -2.6 -9.6
115 115 N T < S+ 0 0 6 -4,-2.7 6,-0.3 -5,-0.3 5,-0.2 0.888 112.4 57.2 -61.9 -38.3 4.8 -0.6 -9.9
116 116 V T >> S+ 0 0 42 -5,-0.4 3,-1.1 -4,-0.3 4,-0.7 0.879 88.4 50.9 -99.0 -49.8 6.4 2.7 -10.3
117 117 G T 3< S+ 0 0 83 -4,-0.8 -1,-0.3 1,-0.3 -2,-0.1 0.781 131.1 33.2 -61.1 -15.4 8.8 3.6 -12.9
118 118 G T 34 S+ 0 0 64 -4,-0.3 -2,-0.3 -5,-0.2 -1,-0.3 0.000 125.9 30.5-147.4 52.3 5.9 2.1 -14.8
119 119 N T <4 S- 0 0 91 -3,-1.1 -3,-0.2 0, 0.0 -2,-0.1 0.181 75.1-156.4 -95.4 -50.4 2.7 2.7 -13.5
120 120 T < - 0 0 95 -4,-0.7 -4,-0.1 -5,-0.2 -3,-0.1 0.541 28.4-173.4 50.1 24.1 3.6 6.0 -11.9
121 121 N + 0 0 20 -6,-0.3 10,-0.2 1,-0.1 3,-0.1 0.586 36.8 137.6 49.0-135.0 0.8 5.0 -9.8
122 122 D - 0 0 41 8,-0.2 9,-0.2 1,-0.2 2,-0.1 0.832 42.7-170.1 55.5 41.6 -0.1 7.9 -7.4
123 123 I E -B 130 0A 57 7,-2.2 7,-2.4 1,-0.1 2,-0.2 -0.368 16.5 -95.1 -79.2 157.4 -3.6 7.3 -8.1
124 124 Y E +B 129 0A 179 5,-0.2 5,-0.1 1,-0.2 -1,-0.1 -0.496 64.9 8.9-118.4 137.6 -6.1 9.8 -6.9
125 125 K + 0 0 139 3,-0.8 -1,-0.2 -2,-0.2 4,-0.1 0.869 60.6 112.5 69.6 68.4 -8.4 10.9 -4.3
126 126 S S S- 0 0 5 -94,-0.4 -94,-2.3 -3,-0.2 -95,-0.3 -0.317 120.1 -69.2-110.6 24.7 -8.6 9.1 -0.9
127 127 G E S-a 32 0A 34 1,-0.5 -94,-0.1 -96,-0.3 -48,-0.1 -0.276 110.7 -21.8 117.0 -36.9 -7.3 12.3 0.0
128 128 G E S+ 0 0A 17 -96,-1.4 -3,-0.8 -50,-0.1 -1,-0.5 -0.080 109.4 43.9-131.9 -79.0 -4.0 11.7 -1.6
129 129 M E +aB 33 124A 4 -97,-0.7 -95,-2.5 -52,-0.5 2,-0.3 -0.671 29.5 157.7-116.4 119.6 -2.4 8.3 -2.5
130 130 H E B 0 123A 3 -7,-2.4 -7,-2.2 -2,-0.3 -8,-0.2 -0.955 360.0 360.0-109.9 135.6 -3.3 5.0 -4.1
131 131 H 0 0 18 -2,-0.3 -95,-0.1 -9,-0.2 -19,-0.1 -0.978 360.0 360.0-161.4 360.0 -0.5 2.8 -5.7