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 .
238 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
12847.8 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
137 57.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES .
2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
28 11.8 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 .
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 0.4 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 .
30 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
11 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
49 20.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES .
4 1.7 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 3 0 3 1 1 1 0 0 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 1 0 1 1 0 1 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 0 0 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 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 A 0 0 2 0, 0.0 115,-0.1 0, 0.0 114,-0.0 0.000 360.0 360.0 360.0-143.1 8.8 -35.5 22.4
2 2 T + 0 0 98 2,-0.0 13,-0.4 12,-0.0 2,-0.3 0.960 360.0 43.7 -59.7 -46.2 6.4 -38.3 22.4
3 3 R S S- 0 0 70 1,-0.2 113,-0.1 11,-0.1 11,-0.1 -0.696 98.5-125.6 -86.6 151.5 9.3 -40.3 23.6
4 4 F S S+ 0 0 0 -2,-0.3 2,-0.4 46,-0.3 112,-0.2 0.970 105.3 42.7 -62.5 -44.5 11.2 -38.4 26.2
5 5 V S S- 0 0 31 45,-0.1 2,-0.6 -3,-0.1 -1,-0.1 -0.814 84.0-156.5 -97.3 135.9 14.2 -38.9 24.0
6 6 D + 0 0 58 -2,-0.4 5,-0.1 106,-0.1 3,-0.1 -0.920 30.2 145.5-121.8 113.1 13.6 -38.5 20.4
7 7 C - 0 0 64 -2,-0.6 -2,-0.1 3,-0.4 0, 0.0 -0.924 27.4-163.9-138.3 112.7 15.8 -40.1 17.8
8 8 P S S+ 0 0 113 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.823 89.6 59.4 -64.8 -31.9 14.0 -41.2 14.7
9 9 T S S+ 0 0 128 1,-0.2 2,-0.6 -3,-0.1 -2,-0.0 0.967 112.2 38.8 -63.8 -48.6 16.9 -43.4 13.7
10 10 D S S- 0 0 117 0, 0.0 -3,-0.4 0, 0.0 -1,-0.2 -0.884 81.3-153.0-109.5 118.2 16.6 -45.4 16.8
11 11 D - 0 0 140 -2,-0.6 2,-0.3 -3,-0.1 -5,-0.0 -0.231 15.4-173.3 -77.9 169.8 13.2 -46.2 18.1
12 12 A - 0 0 48 -7,-0.0 3,-0.1 -2,-0.0 2,-0.1 -0.924 26.5 -94.2-154.8 174.7 12.4 -46.8 21.7
13 13 T - 0 0 80 -2,-0.3 40,-0.0 1,-0.2 -1,-0.0 -0.222 65.9 -65.0 -84.4-179.3 9.7 -47.9 24.0
14 14 D - 0 0 104 -11,-0.1 38,-0.6 -2,-0.1 2,-0.3 -0.337 55.7-147.7 -68.1 154.7 7.5 -45.4 25.8
15 15 D E -A 51 0A 8 -13,-0.4 189,-0.4 36,-0.1 2,-0.3 -0.771 9.6-151.5-122.7 167.0 9.3 -43.2 28.3
16 16 Y E -A 50 0A 22 34,-2.2 34,-3.2 -2,-0.3 2,-0.4 -0.881 15.3-117.2-140.9 170.7 8.2 -41.6 31.5
17 17 R E -AB 49 202A 0 185,-3.1 185,-2.4 -2,-0.3 2,-0.5 -0.879 24.9-157.8-107.9 134.4 8.7 -38.7 33.9
18 18 L E -AB 48 201A 10 30,-2.3 30,-3.0 -2,-0.4 2,-0.6 -0.941 4.0-157.9-124.6 119.9 9.9 -39.3 37.4
19 19 K E -AB 47 200A 0 181,-3.6 181,-2.2 -2,-0.5 2,-0.5 -0.814 13.5-159.9 -92.7 122.3 9.3 -36.9 40.2
20 20 F E -AB 46 199A 14 26,-3.0 25,-2.7 -2,-0.6 26,-1.3 -0.902 8.0-173.0-107.4 125.6 11.9 -37.4 42.9
21 21 V E -AB 44 198A 0 177,-2.7 177,-2.6 -2,-0.5 2,-0.3 -0.966 9.7-151.3-119.6 130.5 11.1 -36.1 46.3
22 22 R E -AB 43 197A 62 21,-2.9 21,-2.4 -2,-0.5 175,-0.2 -0.711 12.9-136.0-100.9 150.3 13.7 -36.2 49.1
23 23 L > - 0 0 21 173,-2.1 4,-2.4 -2,-0.3 3,-0.4 -0.918 19.1-152.9 -98.9 112.7 13.1 -36.5 52.8
24 24 P H > S+ 0 0 0 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.794 87.9 60.6 -60.8 -32.2 15.4 -33.9 54.1
25 25 S H > S+ 0 0 3 14,-0.2 4,-1.7 1,-0.2 212,-0.1 0.939 111.9 40.8 -61.6 -44.7 16.0 -35.5 57.5
26 26 K H > S+ 0 0 5 -3,-0.4 4,-3.0 169,-0.2 -1,-0.2 0.918 113.9 53.4 -67.6 -41.8 17.4 -38.6 55.8
27 27 M H X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 -2,-0.2 0.940 108.3 49.7 -60.1 -45.8 19.3 -36.5 53.3
28 28 K H < S+ 0 0 44 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.878 112.1 48.6 -63.6 -37.1 21.0 -34.5 55.9
29 29 F H < S+ 0 0 57 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.964 112.1 47.6 -67.2 -46.0 21.9 -37.6 57.8
30 30 A H < S+ 0 0 20 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.946 113.6 49.0 -62.5 -47.5 23.3 -39.4 54.7
31 31 D S < S- 0 0 61 -4,-3.0 -1,-0.2 -5,-0.2 153,-0.0 -0.818 74.0-158.3 -96.8 113.9 25.3 -36.4 53.6
32 32 P S S+ 0 0 115 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 0.700 81.4 73.0 -61.3 -18.8 27.2 -35.2 56.6
33 33 R + 0 0 139 -3,-0.1 2,-0.6 2,-0.0 3,-0.1 -0.812 53.3 150.7-105.1 96.0 27.4 -32.0 54.8
34 34 T - 0 0 33 -2,-0.9 52,-0.2 1,-0.2 53,-0.1 -0.956 19.4-175.5-120.8 109.8 24.1 -30.2 54.8
35 35 N + 0 0 67 50,-1.2 51,-0.2 -2,-0.6 54,-0.2 0.892 69.5 57.9 -69.9 -38.5 24.7 -26.5 54.7
36 36 S S S- 0 0 25 49,-1.9 2,-0.4 51,-0.2 52,-0.1 -0.475 96.3-102.0 -91.7 163.9 21.0 -25.7 55.1
37 37 I - 0 0 144 -2,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.700 44.0-105.9 -88.4 136.9 18.8 -26.8 57.9
38 38 I - 0 0 17 -2,-0.4 2,-0.1 -14,-0.1 -1,-0.1 -0.392 31.1-134.4 -65.9 126.2 16.6 -29.7 57.0
39 39 E - 0 0 57 -2,-0.2 -14,-0.2 2,-0.2 -1,-0.1 -0.467 13.7-125.1 -78.2 154.2 13.0 -28.8 56.4
40 40 T S S+ 0 0 94 -2,-0.1 2,-0.1 -16,-0.1 -15,-0.1 0.747 89.2 66.6 -68.6 -29.4 10.3 -31.0 58.0
41 41 N S S- 0 0 68 1,-0.1 -2,-0.2 -18,-0.1 2,-0.1 -0.448 95.6 -88.6 -96.6 170.5 8.6 -31.6 54.7
42 42 T - 0 0 6 -19,-0.1 2,-0.3 -2,-0.1 -19,-0.2 -0.418 43.3-157.5 -73.1 151.1 9.6 -33.4 51.6
43 43 E E -A 22 0A 4 -21,-2.4 -21,-2.9 88,-0.1 2,-0.6 -0.831 25.9 -91.0-129.0 166.6 11.5 -31.4 49.0
44 44 D E -A 21 0A 2 37,-2.4 -23,-0.2 -2,-0.3 3,-0.1 -0.690 31.1-180.0 -88.2 118.6 12.1 -31.8 45.3
45 45 I E - 0 0A 4 -25,-2.7 2,-0.3 -2,-0.6 -1,-0.2 0.907 62.1 -72.8 -73.5 -53.1 15.2 -33.8 44.4
46 46 Q E -A 20 0A 1 -26,-1.3 -26,-3.0 -3,-0.1 2,-0.4 -0.973 35.2-104.2 174.6 178.5 14.5 -33.3 40.7
47 47 F E -A 19 0A 0 -2,-0.3 2,-0.6 -28,-0.2 -28,-0.2 -0.990 35.5-163.4-128.8 124.3 12.3 -34.4 37.9
48 48 W E -A 18 0A 54 -30,-3.0 -30,-2.3 -2,-0.4 2,-0.3 -0.912 16.5-145.6-120.4 124.5 13.9 -36.8 35.5
49 49 E E +A 17 0A 0 -2,-0.6 2,-0.3 60,-0.3 -32,-0.2 -0.632 42.8 174.9 -74.3 142.7 12.7 -37.6 32.1
50 50 H E -A 16 0A 28 -34,-3.2 -34,-2.2 -2,-0.3 2,-0.3 -0.945 30.4-134.2-153.3 169.4 13.5 -41.2 31.8
51 51 E E -A 15 0A 23 -2,-0.3 6,-0.2 2,-0.2 -36,-0.1 -0.839 25.2-121.4-125.2 160.8 13.4 -44.4 29.9
52 52 W S S+ 0 0 150 -38,-0.6 2,-0.2 -2,-0.3 -1,-0.1 0.924 92.9 71.9 -62.4 -47.3 12.6 -48.0 30.7
53 53 K S > S- 0 0 77 1,-0.2 4,-1.2 -3,-0.1 3,-0.3 -0.484 76.2-139.5 -85.2 146.3 15.9 -49.3 29.6
54 54 K T >4 S+ 0 0 164 1,-0.3 3,-0.5 2,-0.2 -1,-0.2 0.915 107.9 58.5 -61.2 -42.0 19.0 -48.7 31.5
55 55 H T 34 S+ 0 0 152 1,-0.3 -1,-0.3 2,-0.1 -2,-0.0 0.801 95.5 62.8 -60.4 -31.8 20.7 -48.2 28.3
56 56 G T 34 S+ 0 0 15 -3,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.965 77.4 168.9 -58.0 -48.6 18.3 -45.4 27.6
57 57 R << - 0 0 115 -4,-1.2 2,-0.7 -3,-0.5 -3,-0.1 0.893 37.1-133.1 39.8 71.7 19.8 -43.8 30.7
58 58 C + 0 0 0 -7,-0.1 2,-0.3 -10,-0.1 -1,-0.2 -0.359 56.2 131.8 -58.4 103.3 18.2 -40.4 30.3
59 59 S + 0 0 41 -2,-0.7 3,-0.1 -3,-0.3 48,-0.1 -0.992 53.5 7.6-155.9 150.9 21.2 -38.3 30.8
60 60 E - 0 0 141 -2,-0.3 47,-0.1 1,-0.1 -1,-0.1 0.907 69.1-157.8 45.5 61.9 23.0 -35.3 29.2
61 61 A - 0 0 8 45,-0.2 2,-1.6 1,-0.1 -1,-0.1 -0.433 27.0-110.8 -64.3 146.5 20.4 -34.5 26.6
62 62 L S S+ 0 0 144 -3,-0.1 2,-0.3 50,-0.1 -1,-0.1 -0.643 79.3 97.3 -87.5 93.0 22.2 -32.6 23.9
63 63 L S S- 0 0 59 -2,-1.6 48,-0.1 43,-0.2 49,-0.1 -0.945 77.3 -66.8-161.8 173.0 20.7 -29.2 24.4
64 64 K - 0 0 168 -2,-0.3 -3,-0.0 1,-0.1 2,-0.0 -0.288 46.8-116.4 -72.2 154.7 21.4 -25.9 26.0
65 65 Q - 0 0 121 1,-0.2 -1,-0.1 45,-0.0 57,-0.1 -0.129 41.4 -89.0 -76.5 178.3 21.6 -25.4 29.7
66 66 T - 0 0 20 36,-0.2 -1,-0.2 1,-0.2 2,-0.0 -0.153 32.6-111.6 -88.8-177.1 19.2 -23.1 31.5
67 67 D - 0 0 90 1,-0.1 2,-0.3 -2,-0.0 -1,-0.2 0.117 46.8 -77.6 -92.9-152.8 19.2 -19.4 32.3
68 68 Y - 0 0 92 29,-0.1 2,-1.0 -2,-0.0 29,-0.1 -0.869 31.4-125.5-117.3 150.2 19.5 -17.9 35.7
69 69 F - 0 0 18 27,-0.9 3,-0.1 -2,-0.3 2,-0.1 -0.824 29.8-157.0 -96.5 106.0 16.8 -17.7 38.3
70 70 R > - 0 0 187 -2,-1.0 5,-0.6 1,-0.2 2,-0.2 -0.418 41.5 -77.0 -76.9 155.8 16.7 -14.0 39.2
71 71 T T 5S+ 0 0 94 4,-0.1 2,-0.3 3,-0.1 -1,-0.2 -0.361 92.5 103.0 -57.6 119.5 15.2 -13.2 42.5
72 72 A T >5S- 0 0 29 -2,-0.2 4,-3.1 -3,-0.1 5,-0.3 -0.898 92.8 -57.3-172.8-165.7 11.5 -13.6 41.9
73 73 L H >5S+ 0 0 121 -2,-0.3 4,-3.7 1,-0.2 5,-0.3 0.935 136.7 51.0 -61.5 -40.5 8.8 -16.0 42.6
74 74 A H >5S+ 0 0 31 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.927 111.3 48.2 -61.4 -42.6 10.8 -18.6 40.8
75 75 F H >S+ 0 0 58 -4,-3.7 4,-2.8 -5,-0.3 5,-0.5 0.947 109.3 49.8 -62.5 -46.0 9.8 -20.9 45.1
78 78 A H X5S+ 0 0 3 -4,-2.9 4,-2.1 -5,-0.3 -1,-0.2 0.902 104.9 58.1 -62.3 -40.6 12.9 -22.9 44.2
79 79 F H <5S+ 0 0 61 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.938 118.6 28.5 -59.0 -50.4 14.6 -22.1 47.5
80 80 D H ><5S+ 0 0 60 -4,-1.8 3,-0.9 2,-0.1 -2,-0.2 0.972 128.0 39.2 -75.2 -51.1 11.9 -23.6 49.6
81 81 I H 3<5S+ 0 0 0 -4,-2.8 -37,-2.4 1,-0.3 2,-0.2 0.913 134.0 22.9 -67.5 -44.9 10.4 -26.2 47.3
82 82 V T 3< - 0 0 4 1,-0.2 3,-0.9 -5,-0.1 -1,-0.1 -0.728 28.5-179.3 -89.6 94.2 19.7 -27.0 47.7
85 85 L T 3 S+ 0 0 1 -2,-1.4 -49,-1.9 1,-0.3 -50,-1.2 0.776 71.1 67.4 -65.1 -30.6 20.5 -28.6 51.1
86 86 N T 3 S+ 0 0 46 -52,-0.2 -1,-0.3 -51,-0.2 2,-0.3 0.815 102.1 44.3 -63.6 -34.6 24.1 -29.2 50.0
87 87 Q S < S- 0 0 58 -3,-0.9 -51,-0.2 1,-0.1 -3,-0.1 -0.734 93.4 -89.5-118.5 167.2 25.0 -25.5 50.0
88 88 E - 0 0 94 -2,-0.3 5,-0.3 -53,-0.1 -52,-0.1 -0.170 42.4-110.3 -65.2 159.1 24.5 -22.5 52.1
89 89 G S > S+ 0 0 28 1,-0.2 4,-2.3 -54,-0.2 5,-0.3 0.924 116.5 52.1 -61.0 -39.1 21.4 -20.4 51.4
90 90 I H >>S+ 0 0 132 2,-0.2 4,-3.7 3,-0.2 5,-0.6 0.975 108.3 48.2 -62.2 -52.0 23.5 -17.6 50.1
91 91 Y H >5S+ 0 0 99 1,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.927 116.2 40.0 -63.6 -51.5 25.5 -19.6 47.6
92 92 P H 45S+ 0 0 1 0, 0.0 -1,-0.3 0, 0.0 -2,-0.2 0.891 121.2 44.1 -63.4 -36.2 22.7 -21.5 46.0
93 93 N H <5S+ 0 0 32 -4,-2.3 -2,-0.2 -5,-0.3 -3,-0.2 0.974 121.6 36.0 -70.8 -51.9 20.4 -18.6 45.9
94 94 N H <5S+ 0 0 93 -4,-3.7 2,-0.3 -5,-0.3 -3,-0.2 0.917 95.0 93.3 -69.0 -39.5 22.8 -16.0 44.8
95 95 D S < - 0 0 2 -2,-1.3 4,-3.9 1,-0.2 5,-0.4 -0.578 17.4-135.7 -61.3 122.0 22.4 -22.7 41.7
99 99 P H > S+ 0 0 40 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.848 99.6 47.7 -53.2 -40.0 24.8 -25.5 41.4
100 100 K H > S+ 0 0 15 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.969 118.7 36.6 -67.1 -54.0 22.1 -27.9 42.4
101 101 M H > S+ 0 0 3 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.899 118.0 51.8 -67.8 -39.2 19.4 -26.7 40.0
102 102 I H X S+ 0 0 32 -4,-3.9 4,-3.4 2,-0.2 -1,-0.2 0.938 111.3 46.9 -63.3 -44.7 21.9 -25.9 37.3
103 103 K H X S+ 0 0 99 -4,-2.2 4,-2.5 -5,-0.4 -1,-0.2 0.929 113.5 48.6 -63.2 -43.3 23.4 -29.4 37.5
104 104 E H < S+ 0 0 27 -4,-2.4 6,-1.5 1,-0.2 5,-0.3 0.925 115.1 45.3 -62.9 -44.4 19.9 -31.0 37.5
105 105 A H < S+ 0 0 0 -4,-3.1 6,-1.2 1,-0.2 -2,-0.2 0.915 110.5 52.7 -65.3 -43.6 18.9 -28.9 34.5
106 106 I H < S+ 0 0 56 -4,-3.4 -1,-0.2 -5,-0.2 -2,-0.2 0.911 96.4 80.2 -63.0 -41.2 22.1 -29.5 32.6
107 107 K S >X S- 0 0 52 -4,-2.5 4,-2.0 -5,-0.2 3,-0.5 -0.047 110.1 -92.6 -58.3 170.9 21.7 -33.2 32.9
108 108 K H 3> S+ 0 0 34 1,-0.2 4,-3.0 3,-0.2 5,-0.3 0.642 117.5 82.9 -62.6 -12.7 19.3 -34.8 30.5
109 109 H H 3> S+ 0 0 1 -5,-0.3 4,-0.6 2,-0.2 -60,-0.3 0.997 108.4 19.1 -57.2 -60.3 16.8 -34.3 33.2
110 110 L H X4 S+ 0 0 3 -6,-1.5 3,-1.4 -3,-0.5 -2,-0.2 0.975 130.1 50.5 -69.4 -45.9 16.1 -30.8 32.2
111 111 N H 3X S+ 0 0 8 -4,-2.0 4,-0.5 -6,-1.2 -3,-0.2 0.783 100.4 62.3 -64.3 -32.7 17.6 -31.0 28.8
112 112 A H 3< S+ 0 0 3 -4,-3.0 3,-0.5 -5,-0.2 4,-0.3 0.786 98.5 61.2 -62.1 -31.2 15.6 -34.2 27.8
113 113 V T << S+ 0 0 0 -3,-1.4 7,-0.4 -4,-0.6 3,-0.4 0.885 97.3 53.9 -66.3 -42.9 12.5 -32.2 28.2
114 114 P T 4 S+ 0 0 45 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.620 79.2 90.4 -73.4 -12.1 13.0 -29.5 25.6
115 115 E < + 0 0 88 -4,-0.5 -2,-0.1 -3,-0.5 4,-0.1 0.906 68.8 77.0 -58.4 -47.7 13.7 -31.5 22.5
116 116 I S S- 0 0 49 -3,-0.4 -112,-0.0 -4,-0.3 -111,-0.0 -0.336 87.2-126.7 -65.7 143.1 10.2 -31.8 21.2
117 117 D S S+ 0 0 148 1,-0.2 2,-1.1 2,-0.0 -1,-0.2 0.932 106.0 50.1 -57.1 -44.7 9.2 -28.6 19.6
118 118 F S S+ 0 0 183 2,-0.0 -1,-0.2 -3,-0.0 2,-0.2 -0.783 93.8 100.6 -95.0 102.6 6.1 -28.5 21.7
119 119 T S S- 0 0 41 -2,-1.1 2,-0.3 -5,-0.1 -6,-0.1 -0.789 73.2 -56.5-156.3-160.8 7.5 -29.1 25.1
120 120 K - 0 0 43 -7,-0.4 2,-0.1 -2,-0.2 -4,-0.0 -0.726 40.6-145.1 -96.7 141.3 8.4 -27.5 28.4
121 121 N > - 0 0 90 -2,-0.3 4,-3.6 1,-0.1 5,-0.2 -0.397 39.9 -90.9 -90.9 177.9 10.9 -24.7 28.6
122 122 E H > S+ 0 0 52 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.922 130.5 47.1 -60.9 -41.1 13.3 -24.4 31.6
123 123 N H > S+ 0 0 85 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.948 115.0 47.8 -63.8 -42.4 10.9 -22.2 33.4
124 124 S H > S+ 0 0 33 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.909 108.1 53.5 -63.9 -43.3 8.1 -24.6 32.6
125 125 E H X S+ 0 0 1 -4,-3.6 4,-1.5 1,-0.3 -1,-0.2 0.951 112.9 43.7 -61.4 -44.6 10.0 -27.7 33.6
126 126 Y H < S+ 0 0 4 -4,-2.3 -1,-0.3 1,-0.2 3,-0.2 0.905 109.9 58.1 -63.8 -37.7 10.7 -26.1 37.0
127 127 V H < S+ 0 0 64 -4,-2.5 11,-2.9 1,-0.2 -1,-0.2 0.922 105.2 51.4 -57.9 -43.1 7.1 -25.0 37.1
128 128 L H < S+ 0 0 16 -4,-2.7 11,-4.0 9,-0.3 2,-0.6 0.841 104.4 58.5 -65.8 -35.2 5.9 -28.6 36.7
129 129 T < + 0 0 1 -4,-1.5 8,-0.2 -3,-0.2 -1,-0.1 -0.846 68.7 131.1-108.2 124.1 8.0 -30.1 39.5
130 130 D - 0 0 0 -2,-0.6 2,-0.3 7,-0.2 8,-0.1 -0.195 45.5-107.1-131.0-141.1 7.6 -28.8 43.0
131 131 I - 0 0 4 6,-0.3 2,-0.5 3,-0.2 5,-0.1 -0.922 52.6 -75.2-155.5 155.0 7.0 -29.8 46.7
132 132 N S S+ 0 0 46 -2,-0.3 2,-0.2 11,-0.2 9,-0.2 -0.513 87.9 109.7 -62.3 117.2 4.0 -29.6 48.9
133 133 V S S- 0 0 40 -2,-0.5 3,-0.2 1,-0.4 -56,-0.0 -0.785 77.0 -45.8-162.3-161.1 4.1 -25.9 49.7
134 134 C S S- 0 0 108 -2,-0.2 2,-0.5 1,-0.2 -1,-0.4 -0.020 100.0 -45.1 -70.1-172.2 1.9 -23.0 48.8
135 135 V S S+ 0 0 135 -3,-0.1 -1,-0.2 1,-0.1 2,-0.2 -0.451 99.5 120.0 -62.2 114.3 1.0 -22.7 45.2
136 136 N + 0 0 22 1,-0.6 -6,-0.1 -2,-0.5 -1,-0.1 -0.404 63.0 3.1-145.5-142.9 4.3 -23.4 43.6
137 137 Q S > S- 0 0 9 -8,-0.2 4,-0.7 -2,-0.2 -1,-0.6 -0.186 74.7-127.9 -55.6 146.2 5.7 -26.0 41.2
138 138 Q H > S+ 0 0 90 -11,-2.9 4,-1.8 3,-0.1 -9,-0.2 0.963 87.9 51.5 -70.5 -52.4 2.8 -28.1 40.2
139 139 M H > S+ 0 0 2 -11,-4.0 4,-0.8 1,-0.3 3,-0.3 0.920 116.2 33.4 -65.0 -51.2 3.6 -31.8 40.7
140 140 R H >4 S+ 0 0 0 1,-0.3 3,-0.6 2,-0.2 -1,-0.3 0.845 112.8 62.2 -75.9 -23.4 4.8 -32.0 44.2
141 141 A H 3< S+ 0 0 26 -4,-0.7 -1,-0.3 1,-0.3 -2,-0.2 0.879 97.6 62.9 -59.2 -33.6 2.5 -29.2 45.3
142 142 I H 3< S+ 0 0 75 -4,-1.8 2,-0.4 -3,-0.3 -1,-0.3 0.860 103.7 51.9 -59.8 -37.9 -0.1 -31.7 44.2
143 143 Y << - 0 0 27 -4,-0.8 2,-0.5 -3,-0.6 -11,-0.2 -0.854 54.9-168.6-116.5 141.5 0.8 -34.2 46.8
144 144 I > + 0 0 57 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.830 15.9 172.0-114.7 86.9 1.3 -33.9 50.5
145 145 I H > S+ 0 0 3 -2,-0.5 4,-3.4 1,-0.2 5,-0.3 0.867 74.8 60.7 -67.1 -35.8 3.0 -37.2 51.3
146 146 S H > S+ 0 0 32 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.944 110.9 41.0 -57.0 -46.5 3.7 -36.2 54.9
147 147 V H > S+ 0 0 78 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.919 114.4 51.7 -66.9 -43.0 -0.1 -35.8 55.4
148 148 I H X S+ 0 0 28 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.940 110.4 48.5 -62.7 -43.1 -0.9 -38.9 53.5
149 149 I H <>S+ 0 0 11 -4,-3.4 5,-2.9 1,-0.2 4,-0.3 0.919 108.8 53.8 -63.0 -40.8 1.5 -41.0 55.4
150 150 V H ><5S+ 0 0 62 -4,-2.0 3,-2.1 -5,-0.3 -1,-0.2 0.902 104.9 52.9 -62.4 -39.0 0.2 -39.7 58.7
151 151 S H 3<5S+ 0 0 90 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.885 107.7 53.3 -60.7 -35.9 -3.3 -40.7 57.8
152 152 L T 3<5S- 0 0 68 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.497 123.9-112.6 -71.0 -9.8 -1.8 -44.1 57.1
153 153 S T < 5S+ 0 0 103 -3,-2.1 2,-0.6 1,-0.3 -3,-0.2 0.791 77.2 132.7 75.9 28.9 -0.4 -43.9 60.6
154 154 I < + 0 0 0 -5,-2.9 -1,-0.3 -6,-0.1 2,-0.3 -0.963 26.9 156.7-111.3 118.9 3.1 -43.7 59.3
155 155 F > - 0 0 114 -2,-0.6 3,-0.8 -3,-0.1 78,-0.2 -0.873 44.1 -81.1-137.4 168.7 5.0 -40.9 60.9
156 156 S T 3 S+ 0 0 17 -2,-0.3 78,-0.2 1,-0.2 79,-0.1 -0.203 105.2 44.3 -69.8 165.8 8.6 -40.0 61.5
157 157 W T 3 S+ 0 0 207 76,-2.4 2,-0.3 1,-0.3 -1,-0.2 0.453 103.5 82.1 78.5 6.5 10.6 -41.6 64.4
158 158 G E < S-C 233 0A 23 -3,-0.8 75,-2.9 75,-0.7 2,-0.4 -0.850 72.6-124.4-135.6 172.4 9.2 -45.0 63.6
159 159 G E -C 232 0A 23 -2,-0.3 2,-0.3 73,-0.3 73,-0.3 -0.903 25.6-175.8-118.0 147.6 9.9 -47.8 61.2
160 160 N E -C 231 0A 30 71,-2.9 71,-4.0 -2,-0.4 2,-0.1 -0.925 32.1 -93.2-139.0 162.4 7.3 -49.4 58.9
161 161 A > - 0 0 46 -2,-0.3 4,-1.9 69,-0.2 69,-0.1 -0.375 34.3-120.6 -72.2 154.3 7.2 -52.2 56.5
162 162 R T 4 S+ 0 0 50 67,-0.3 5,-0.3 1,-0.2 -1,-0.1 0.904 113.2 55.8 -63.4 -39.1 8.0 -51.5 52.9
163 163 S T > S+ 0 0 71 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.931 106.0 51.7 -61.1 -39.8 4.5 -52.6 51.8
164 164 D H > S+ 0 0 58 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.933 108.8 48.2 -64.3 -45.5 2.9 -50.2 54.2
165 165 Y H X S+ 0 0 9 -4,-1.9 4,-2.1 1,-0.2 5,-0.2 0.968 114.8 44.7 -66.6 -50.1 4.7 -47.1 53.0
166 166 P H > S+ 0 0 29 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.842 108.4 57.9 -59.0 -30.3 4.1 -47.8 49.4
167 167 W H X S+ 0 0 181 -4,-2.3 4,-1.1 -5,-0.3 -2,-0.2 0.954 108.3 46.8 -62.0 -44.4 0.5 -48.7 50.0
168 168 A H >X S+ 0 0 1 -4,-2.2 3,-0.7 1,-0.2 4,-0.6 0.922 114.5 45.9 -61.9 -44.0 -0.0 -45.3 51.5
169 169 M H >X S+ 0 0 1 -4,-2.1 4,-2.6 1,-0.2 3,-1.0 0.857 102.7 66.5 -66.2 -34.3 1.8 -43.5 48.7
170 170 F H 3X S+ 0 0 72 -4,-2.3 4,-3.6 1,-0.3 -1,-0.2 0.799 88.4 66.8 -59.5 -32.9 -0.1 -45.5 46.1
171 171 A H << S+ 0 0 81 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.925 113.3 30.8 -57.7 -44.8 -3.3 -43.9 47.1
172 172 L H << S+ 0 0 23 -3,-1.0 -2,-0.2 -4,-0.6 -1,-0.2 0.893 123.2 48.1 -75.7 -42.5 -2.0 -40.6 45.8
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174 174 L S < S+ 0 0 114 -4,-3.6 2,-0.3 -5,-0.2 -1,-0.2 0.082 73.5 63.4 74.4 -21.6 -2.5 -44.4 41.7
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184 184 N - 0 0 11 -2,-0.5 2,-1.0 4,-0.4 8,-0.1 -0.762 25.3-114.8-115.4 159.1 24.5 -44.9 54.8
185 185 N S S+ 0 0 166 -2,-0.3 2,-0.3 -155,-0.1 4,-0.2 -0.799 85.3 64.5 -87.1 108.0 28.0 -45.3 56.1
186 186 A S S- 0 0 52 -2,-1.0 4,-0.1 2,-0.1 -156,-0.1 -0.952 111.6 -36.2 170.6-159.0 27.7 -43.5 59.4
187 187 C S S+ 0 0 117 -2,-0.3 2,-0.9 1,-0.1 -1,-0.1 0.947 130.2 61.8 -58.5 -45.4 26.0 -43.8 62.7
188 188 D S S+ 0 0 27 -159,-0.1 -4,-0.4 -3,-0.1 -1,-0.1 -0.732 87.4 174.1 -81.2 112.5 23.0 -45.0 60.8
189 189 T > - 0 0 65 -2,-0.9 3,-0.7 1,-0.3 -5,-0.3 -0.171 31.3 -46.0-108.6-162.3 24.5 -48.1 59.4
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191 191 S T 3 S+ 0 0 102 1,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.612 97.5 98.0 63.3 14.3 20.5 -53.2 58.2
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195 195 T E + D 0 181A 6 37,-2.7 39,-0.3 -2,-0.3 -14,-0.2 -0.581 48.2 167.0 -73.7 103.4 13.1 -43.8 53.6
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208 208 G S S- 0 0 71 -2,-0.4 -1,-0.3 1,-0.2 3,-0.1 0.974 126.7 -85.8 62.2 50.8 -4.3 -34.5 33.5
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212 212 L B -F 201 0A 47 -11,-1.8 -11,-0.5 -2,-0.3 2,-0.4 -0.933 39.4 -89.2-133.0 160.7 2.6 -44.3 35.1
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214 214 C - 0 0 3 -38,-2.5 -1,-0.2 -2,-0.4 -36,-0.1 0.684 32.0-129.0 -67.5 -24.5 7.4 -46.1 38.4
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217 217 T - 0 0 21 -38,-0.3 -1,-0.2 1,-0.1 4,-0.1 -0.607 58.4-100.1 -71.1 122.0 14.0 -49.6 42.0
218 218 A S S+ 0 0 91 -2,-0.5 -1,-0.1 2,-0.1 -3,-0.0 -0.222 109.0 10.3 -50.6 120.3 16.0 -52.2 40.2
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223 223 S + 0 0 50 -2,-0.4 2,-0.7 7,-0.1 -30,-0.2 -0.802 29.6 162.4 -99.8 99.8 15.5 -54.2 52.1
224 224 V + 0 0 48 -2,-1.1 6,-0.1 -63,-0.1 4,-0.1 -0.803 19.3 179.9-115.3 92.1 12.2 -55.4 53.5
225 225 S > - 0 0 82 -2,-0.7 4,-0.6 2,-0.2 -2,-0.0 -0.256 45.3-103.9 -88.3 174.5 12.9 -59.1 54.1
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237 237 S 0 0 75 -2,-0.2 -3,-0.0 1,-0.2 -208,-0.0 -0.397 360.0 360.0 -70.1 146.2 17.6 -34.8 64.4
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