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 .
531 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
28327.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
314 59.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES .
2 0.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
59 11.1 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 .
1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES .
5 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES .
1 0.2 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 .
44 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
33 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
146 27.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES .
6 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 3 0 1 0 2 1 0 0 0 1 2 1 1 0 0 2 0 1 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 .
5 3 2 1 0 0 2 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 .
1 0 0 2 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 A > 0 0 25 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -50.5 42.5 49.2 27.6
2 2 A H > + 0 0 11 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.922 360.0 51.5 -61.9 -42.6 45.1 51.6 26.1
3 3 L H > S+ 0 0 103 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.886 108.6 50.9 -62.7 -40.2 46.9 51.7 29.5
4 4 W H > S+ 0 0 60 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.838 102.0 62.4 -65.7 -32.4 46.9 47.9 29.6
5 5 L H X S+ 0 0 2 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.954 105.6 45.3 -56.6 -48.6 48.4 47.9 26.1
6 6 H H X S+ 0 0 31 -4,-1.6 4,-0.7 1,-0.3 -1,-0.2 0.837 108.8 56.4 -65.0 -34.5 51.4 49.7 27.4
7 7 R H >< S+ 0 0 141 -4,-1.5 3,-1.0 1,-0.2 -1,-0.3 0.906 104.9 53.8 -62.8 -38.9 51.6 47.4 30.3
8 8 A H 3< S+ 0 0 50 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.802 101.7 57.7 -63.8 -34.9 51.8 44.5 27.9
9 9 T H 3< S+ 0 0 57 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.692 81.9 121.9 -70.5 -21.1 54.7 46.1 26.0
10 10 G << - 0 0 5 -3,-1.0 2,-0.4 -4,-0.7 -3,-0.0 -0.038 47.1-158.8 -53.0 144.9 56.8 46.1 29.2
11 11 K + 0 0 28 6,-0.1 18,-0.6 3,-0.0 2,-0.3 -0.995 45.0 80.1-124.4 127.2 60.1 44.3 29.3
12 12 A B >S-a 16 0A 6 3,-0.6 5,-2.3 -2,-0.4 3,-0.1 -0.980 90.0 -49.8 164.6-168.9 61.5 43.3 32.7
13 13 H T > 5S+ 0 0 130 -2,-0.3 3,-0.5 3,-0.2 -1,-0.1 0.820 114.8 69.9 -66.0 -35.8 61.4 40.8 35.5
14 14 Y T 3 5S+ 0 0 127 1,-0.3 2,-1.1 2,-0.1 -1,-0.2 0.943 111.2 30.0 -58.4 -53.1 57.6 40.9 36.0
15 15 L T 3 5S- 0 0 88 -3,-0.1 -3,-0.6 412,-0.0 -1,-0.3 -0.842 117.7-110.6-102.6 94.0 56.8 39.1 32.8
16 16 D B < 5 +a 12 0A 106 -2,-1.1 2,-0.3 -3,-0.5 -3,-0.2 0.110 62.0 162.0 -34.5 93.2 60.1 37.3 32.9
17 17 Y < - 0 0 34 -5,-2.3 46,-0.1 1,-0.1 -6,-0.1 -0.786 50.0 -63.6-121.9 158.6 61.6 39.1 30.0
18 18 V - 0 0 40 44,-0.5 2,-1.3 -2,-0.3 -1,-0.1 -0.124 40.2-139.3 -52.4 123.6 65.3 39.3 29.2
19 19 V - 0 0 75 9,-0.1 3,-0.3 1,-0.1 -1,-0.1 -0.785 38.3-171.6 -83.0 105.5 67.1 41.1 31.8
20 20 D + 0 0 4 -2,-1.3 7,-0.2 7,-0.2 8,-0.1 0.378 54.0 71.2 -78.9-155.2 69.2 42.9 29.2
21 21 N + 0 0 26 6,-0.2 3,-0.4 1,-0.2 -1,-0.2 0.477 59.3 129.4 59.9 10.4 72.3 45.1 29.7
22 22 A + 0 0 87 1,-0.3 -1,-0.2 -3,-0.3 -2,-0.1 0.919 69.3 56.1 -61.5 -39.2 74.2 42.0 30.6
23 23 D S S+ 0 0 85 46,-0.4 -1,-0.3 2,-0.1 2,-0.1 0.884 130.1 6.6 -59.4 -37.8 76.8 43.1 28.1
24 24 C S S- 0 0 67 -3,-0.4 2,-0.2 1,-0.2 3,-0.1 0.014 112.4 -51.2-116.2-136.5 77.1 46.4 30.0
25 25 F S S- 0 0 176 1,-0.2 -1,-0.2 -2,-0.1 -2,-0.1 -0.667 83.5 -41.5-106.3 165.3 75.5 47.4 33.3
26 26 G + 0 0 26 -2,-0.2 -1,-0.2 -4,-0.1 -5,-0.2 0.440 64.5 140.7 -18.7 149.7 71.8 47.2 34.4
27 27 G + 0 0 12 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.021 16.8 127.1 155.5 81.2 69.1 48.2 32.0
28 28 T + 0 0 7 -9,-0.1 -16,-0.2 -8,-0.1 2,-0.1 -0.899 49.3 42.8-138.1 161.3 65.8 46.3 31.9
29 29 G - 0 0 7 -18,-0.6 2,-0.3 -2,-0.3 -17,-0.1 -0.437 69.2-114.9 96.5-176.5 62.3 47.7 32.1
30 30 W > + 0 0 102 -2,-0.1 4,-0.6 4,-0.0 3,-0.3 -0.854 62.8 60.5-149.7 179.0 60.8 50.8 30.6
31 31 A H > S- 0 0 31 -2,-0.3 4,-1.9 1,-0.2 3,-0.2 -0.349 107.7 -41.8 89.5-170.3 59.3 54.0 31.8
32 32 I H > S+ 0 0 30 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.878 137.0 60.9 -61.9 -37.2 61.1 56.7 33.7
33 33 T H > S+ 0 0 80 -3,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.928 106.2 46.0 -57.9 -43.6 62.7 54.1 35.8
34 34 E H X S+ 0 0 42 -4,-0.6 4,-2.9 1,-0.2 -1,-0.2 0.915 108.7 55.9 -65.3 -39.4 64.4 52.6 32.8
35 35 F H X S+ 0 0 47 -4,-1.9 4,-1.0 1,-0.2 -1,-0.2 0.886 106.1 50.9 -61.4 -39.1 65.4 56.0 31.6
36 36 S H >< S+ 0 0 65 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.936 113.0 45.0 -62.5 -44.2 67.2 56.7 34.8
37 37 W H 3< S+ 0 0 140 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.874 108.7 58.1 -66.2 -37.3 69.0 53.4 34.6
38 38 D H 3< S+ 0 0 18 -4,-2.9 8,-1.5 1,-0.2 2,-0.8 0.682 100.7 61.3 -65.6 -24.7 69.8 54.1 30.9
39 39 V << + 0 0 21 -4,-1.0 -1,-0.2 -3,-0.8 6,-0.2 -0.700 56.7 158.7-108.9 85.8 71.5 57.3 31.9
40 40 K S S+ 0 0 132 -2,-0.8 2,-0.3 -3,-0.2 -1,-0.2 0.902 73.9 20.9 -69.0 -39.7 74.4 56.2 34.1
41 41 Y B > S-B 44 0B 161 3,-0.5 3,-0.8 -3,-0.2 -1,-0.1 -0.880 87.4-109.4-129.5 160.5 76.3 59.4 33.5
42 42 A T 3 S+ 0 0 18 -2,-0.3 88,-0.2 1,-0.3 -1,-0.1 0.894 117.9 44.1 -58.3 -43.5 75.1 62.8 32.3
43 43 G T 3 S+ 0 0 10 87,-0.1 2,-0.5 86,-0.1 -1,-0.3 0.645 104.6 72.6 -71.5 -25.7 76.8 62.4 28.9
44 44 V B < +B 41 0B 24 -3,-0.8 -3,-0.5 31,-0.1 2,-0.4 -0.839 50.5 172.4-109.7 135.9 75.8 58.8 28.2
45 45 Q E -C 74 0C 6 29,-2.2 29,-2.6 -2,-0.5 2,-0.8 -0.996 27.9-135.4-135.8 136.7 72.4 57.4 27.3
46 46 I E +C 73 0C 35 -8,-1.5 27,-0.3 -2,-0.4 3,-0.1 -0.791 23.9 178.2 -93.6 109.4 71.6 53.9 26.2
47 47 L E + 0 0C 37 -2,-0.8 2,-0.4 25,-0.5 26,-0.2 0.689 57.5 20.9 -80.4 -29.4 69.2 54.1 23.3
48 48 A E -C 72 0C 22 24,-1.6 24,-2.9 3,-0.0 2,-0.4 -0.995 46.1-164.2-152.0 149.7 68.7 50.5 22.4
49 49 A E +C 71 0C 37 -2,-0.4 22,-0.2 22,-0.2 21,-0.1 -0.995 65.6 17.2-129.4 124.2 68.8 47.0 23.6
50 50 R S S- 0 0 20 20,-3.6 2,-0.4 -2,-0.4 19,-0.2 -0.052 82.1 -83.8 102.7 160.0 68.7 44.1 21.1
51 51 D > - 0 0 32 17,-0.4 4,-2.1 1,-0.2 5,-0.2 -0.830 19.7-149.7 -98.9 135.1 69.3 43.7 17.4
52 52 G H > S+ 0 0 26 -2,-0.4 4,-2.4 93,-0.3 -1,-0.2 0.931 100.0 47.1 -65.7 -43.2 66.5 44.5 14.9
53 53 D H > S+ 0 0 105 2,-0.2 4,-1.3 1,-0.2 -1,-0.1 0.960 116.5 40.4 -64.7 -51.3 67.9 41.9 12.5
54 54 T H > S+ 0 0 48 1,-0.2 4,-0.9 2,-0.2 3,-0.3 0.902 115.3 53.5 -65.8 -38.7 68.4 39.1 15.0
55 55 D H >< S+ 0 0 36 -4,-2.1 3,-0.5 1,-0.2 -1,-0.2 0.913 105.8 52.6 -62.6 -43.7 65.2 39.9 16.7
56 56 H H 3< S+ 0 0 124 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.801 96.7 67.3 -65.9 -31.6 63.1 39.8 13.5
57 57 Y H 3< S+ 0 0 197 -4,-1.3 2,-0.3 -3,-0.3 -1,-0.2 0.911 94.7 61.2 -60.2 -42.2 64.3 36.3 12.5
58 58 C << - 0 0 25 -4,-0.9 2,-0.6 -3,-0.5 7,-0.0 -0.640 66.5-156.3 -93.0 143.3 62.7 34.5 15.3
59 59 W + 0 0 57 -2,-0.3 2,-0.3 273,-0.0 -3,-0.1 -0.921 48.5 106.0-114.1 105.9 58.9 34.5 15.9
60 60 Q S S- 0 0 9 -2,-0.6 419,-0.1 420,-0.1 273,-0.1 -0.976 71.6 -70.5-168.2 168.6 58.2 33.8 19.5
61 61 R > - 0 0 1 417,-0.6 3,-1.6 -2,-0.3 419,-0.1 -0.509 42.6-121.6 -75.7 146.3 57.1 35.2 22.8
62 62 P G > S+ 0 0 18 0, 0.0 3,-1.3 0, 0.0 -44,-0.5 0.727 102.6 71.7 -56.8 -29.4 59.5 37.6 24.5
63 63 E G 3 S+ 0 0 35 1,-0.3 365,-0.2 -46,-0.1 363,-0.0 0.798 107.6 32.4 -65.7 -29.4 59.7 35.5 27.6
64 64 D G < S+ 0 0 14 -3,-1.6 2,-0.3 414,-0.2 -1,-0.3 -0.072 75.9 158.3-121.8 43.7 61.7 32.8 26.0
65 65 M < - 0 0 19 -3,-1.3 414,-0.1 1,-0.2 -10,-0.0 -0.474 24.5-162.9 -68.7 123.8 63.8 34.6 23.4
66 66 T + 0 0 77 -2,-0.3 -1,-0.2 2,-0.1 413,-0.0 0.815 58.2 87.6 -73.4 -35.8 66.8 32.4 22.7
67 67 T S S- 0 0 53 1,-0.1 2,-0.1 -13,-0.1 -2,-0.0 -0.156 79.3-104.6 -78.7 163.7 69.0 35.0 21.1
68 68 S - 0 0 85 -18,-0.0 2,-0.4 1,-0.0 -17,-0.4 -0.407 26.0-146.8 -80.1 155.4 71.5 37.5 22.5
69 69 R - 0 0 37 -19,-0.2 -46,-0.4 -2,-0.1 -47,-0.2 -0.943 8.4-153.0-133.4 115.4 70.6 41.2 22.9
70 70 Q - 0 0 83 -2,-0.4 -20,-3.6 -21,-0.1 2,-0.4 -0.456 10.9-135.5 -85.2 153.9 73.3 43.8 22.5
71 71 A E -C 49 0C 18 -22,-0.2 2,-0.3 -2,-0.1 -22,-0.2 -0.876 20.1-169.5-109.6 142.8 73.1 47.2 24.2
72 72 Y E -C 48 0C 64 -24,-2.9 -24,-1.6 -2,-0.4 -25,-0.5 -0.937 5.1-179.2-130.5 153.6 73.9 50.4 22.3
73 73 K E -C 46 0C 69 -2,-0.3 2,-0.4 -27,-0.3 -27,-0.2 -0.926 21.6-130.8-146.0 170.3 74.4 53.9 23.5
74 74 V E +C 45 0C 0 -29,-2.6 -29,-2.2 -2,-0.3 2,-0.2 -0.948 34.8 151.7-122.6 144.1 75.1 57.5 22.4
75 75 D - 0 0 23 3,-2.6 -31,-0.1 -2,-0.4 -32,-0.0 -0.812 61.1 -66.3-152.3-167.2 77.7 59.7 24.0
76 76 R S S+ 0 0 171 -2,-0.2 -32,-0.0 1,-0.2 -1,-0.0 0.896 130.3 53.0 -60.9 -39.7 80.1 62.6 23.3
77 77 E S S+ 0 0 130 1,-0.3 -1,-0.2 -3,-0.0 -3,-0.0 0.923 131.0 14.2 -64.2 -41.8 82.1 60.4 21.0
78 78 R S S- 0 0 105 58,-0.0 -3,-2.6 2,-0.0 -1,-0.3 -0.866 90.8-166.2-134.5 100.1 79.0 59.5 19.1
79 79 P - 0 0 6 0, 0.0 63,-0.1 0, 0.0 59,-0.1 -0.195 21.1-166.1 -84.7 172.4 76.1 61.8 19.9
80 80 G > + 0 0 0 54,-0.3 4,-2.2 62,-0.1 5,-0.2 -0.572 9.3 174.5-158.2 87.4 72.4 61.7 19.4
81 81 S H > S+ 0 0 0 55,-1.9 4,-2.7 1,-0.2 5,-0.3 0.879 79.7 56.1 -65.7 -37.8 70.7 65.0 20.1
82 82 D H > S+ 0 0 7 54,-0.6 4,-1.9 55,-0.2 -1,-0.2 0.957 113.1 37.4 -62.4 -51.2 67.4 63.9 18.9
83 83 V H > S+ 0 0 21 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.876 117.9 50.9 -68.2 -39.9 67.0 60.9 21.2
84 84 A H X S+ 0 0 1 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.920 111.6 46.7 -65.0 -43.9 68.7 62.6 24.1
85 85 G H X S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.876 111.3 52.9 -65.5 -38.2 66.4 65.7 23.8
86 86 E H X S+ 0 0 37 -4,-1.9 4,-2.5 -5,-0.3 -1,-0.2 0.917 109.2 48.5 -63.1 -42.9 63.4 63.4 23.5
87 87 T H X S+ 0 0 9 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.897 110.8 51.6 -64.6 -39.0 64.4 61.6 26.7
88 88 A H X S+ 0 0 4 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.929 110.7 48.2 -61.9 -44.0 64.8 64.9 28.4
89 89 A H X S+ 0 0 1 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.885 110.1 52.4 -63.8 -40.5 61.4 66.0 27.3
90 90 A H X S+ 0 0 45 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.918 113.7 41.4 -64.4 -45.6 59.8 62.7 28.4
91 91 M H X S+ 0 0 6 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.902 115.2 51.2 -70.8 -37.5 61.3 62.9 31.9
92 92 A H X S+ 0 0 3 -4,-2.7 4,-1.3 -5,-0.2 -2,-0.2 0.959 113.6 44.2 -63.2 -46.7 60.6 66.6 32.2
93 93 A H X S+ 0 0 26 -4,-2.9 4,-1.3 1,-0.2 3,-0.4 0.911 112.2 53.4 -63.5 -41.4 57.0 66.2 31.1
94 94 A H X S+ 0 0 19 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.865 101.5 59.6 -62.5 -37.4 56.5 63.2 33.4
95 95 S H X S+ 0 0 0 -4,-2.2 4,-3.5 1,-0.2 5,-0.2 0.893 99.9 56.5 -61.6 -36.3 57.8 65.1 36.4
96 96 I H X S+ 0 0 13 -4,-1.3 4,-2.5 -3,-0.4 -1,-0.2 0.934 106.0 50.5 -61.4 -42.9 55.0 67.6 36.0
97 97 V H < S+ 0 0 66 -4,-1.3 7,-0.4 1,-0.2 -1,-0.2 0.952 116.4 40.9 -59.1 -48.5 52.5 64.8 36.2
98 98 F H X S+ 0 0 51 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.844 108.1 58.7 -70.0 -35.3 54.1 63.5 39.3
99 99 R H < S+ 0 0 102 -4,-3.5 4,-0.3 -5,-0.2 -1,-0.2 0.959 128.0 20.1 -61.1 -43.8 54.8 66.9 40.9
100 100 K T >< S+ 0 0 65 -4,-2.5 2,-2.8 -5,-0.2 3,-0.5 0.552 90.0 107.3 -83.5-117.9 51.1 67.3 40.7
101 101 G T 34 S+ 0 0 5 1,-0.4 5,-0.5 -5,-0.1 -3,-0.2 -0.434 95.3 38.0 78.7 -79.5 49.6 63.8 40.3
102 102 F T 3< S+ 0 0 132 -2,-2.8 -1,-0.4 -4,-0.5 4,-0.1 0.935 124.7 44.5 -65.0 -39.0 48.3 63.9 43.7
103 103 D S < S+ 0 0 106 -3,-0.5 -1,-0.2 -4,-0.3 -3,-0.1 0.964 107.5 68.9 -62.7 -48.0 47.7 67.5 42.7
104 104 H S S- 0 0 71 -7,-0.4 2,-1.2 1,-0.1 5,-0.0 -0.294 97.1-114.7 -67.9 151.1 46.4 66.4 39.3
105 105 W + 0 0 179 4,-0.0 2,-0.3 2,-0.0 -1,-0.1 -0.774 59.4 151.4 -89.1 105.6 43.0 64.7 39.5
106 106 F - 0 0 105 -2,-1.2 3,-0.5 -5,-0.5 2,-0.2 -0.957 43.7-118.6-134.1 148.8 44.1 61.3 38.3
107 107 G S S+ 0 0 40 -2,-0.3 3,-0.2 1,-0.2 -2,-0.0 -0.608 94.5 14.4 -87.9 154.2 42.7 57.9 39.1
108 108 R S S- 0 0 243 -2,-0.2 -1,-0.2 1,-0.2 2,-0.1 0.953 92.1-153.4 50.8 55.0 44.8 55.2 40.8
109 109 R + 0 0 151 -3,-0.5 2,-0.3 -8,-0.1 -1,-0.2 -0.387 28.0 167.4 -67.4 129.6 47.2 57.9 41.7
110 110 S + 0 0 100 -3,-0.2 2,-0.3 -2,-0.1 -1,-0.0 -0.877 22.7 136.8-137.9 106.4 50.8 56.7 42.2
111 111 S - 0 0 31 -2,-0.3 -13,-0.0 -12,-0.0 -12,-0.0 -0.999 45.1-154.4-153.4 151.6 53.2 59.6 42.4
112 112 N >> - 0 0 86 -2,-0.3 5,-1.5 1,-0.2 4,-0.6 -0.893 23.1-175.2-121.3 94.4 56.2 60.9 44.3
113 113 P H >5S+ 0 0 38 0, 0.0 4,-1.0 0, 0.0 5,-0.4 0.973 75.7 23.7 -60.1 -61.7 55.9 64.5 43.8
114 114 N H >5S+ 0 0 145 3,-0.2 4,-2.4 2,-0.1 5,-0.3 0.979 132.7 36.7 -71.9 -51.8 59.0 65.9 45.4
115 115 V H >5S+ 0 0 94 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.965 124.0 37.7 -67.7 -52.5 61.2 62.9 45.2
116 116 L H X5S+ 0 0 43 -4,-0.6 4,-2.3 1,-0.2 5,-0.2 0.958 121.2 44.8 -66.0 -47.4 60.2 61.4 41.9
117 117 V H X S+ 0 0 3 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.780 103.9 57.0 -57.6 -29.4 66.5 65.9 31.9
125 125 D H X S+ 0 0 69 -4,-1.8 4,-2.2 -3,-0.2 -2,-0.2 0.956 111.7 44.2 -65.2 -43.5 68.5 69.0 32.5
126 126 R H X S+ 0 0 133 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.929 114.1 48.4 -63.0 -47.3 71.6 66.9 32.0
127 127 R H X S+ 0 0 6 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.878 110.9 50.7 -65.1 -37.5 70.3 65.1 29.0
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148 148 A H 4 S+ 0 0 98 2,-0.2 3,-0.3 1,-0.2 -1,-0.2 0.938 121.7 37.9 -64.5 -45.5 65.9 50.8 9.4
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157 157 H H 3> S+ 0 0 80 1,-0.3 4,-1.4 -3,-0.3 3,-0.4 0.851 88.8 48.8 -52.7 -43.7 66.2 70.6 15.3
158 158 E H 3> S+ 0 0 2 -3,-0.3 4,-2.5 1,-0.2 -1,-0.3 0.886 109.2 54.1 -62.7 -40.3 62.6 69.8 16.3
159 159 E H <> S+ 0 0 3 -3,-0.7 4,-3.2 -4,-0.3 5,-0.3 0.791 102.3 56.8 -66.0 -32.8 63.7 68.0 19.4
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163 163 S H X S+ 0 0 2 -4,-3.2 4,-2.3 1,-0.2 5,-0.2 0.924 110.9 50.4 -64.0 -43.9 62.9 69.5 24.7
164 164 T H X S+ 0 0 1 -4,-2.2 4,-2.0 -5,-0.3 -1,-0.2 0.894 109.8 49.7 -65.8 -39.1 63.6 73.1 25.7
165 165 L H X S+ 0 0 11 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.925 110.7 50.2 -65.3 -41.1 59.9 74.0 26.1
166 166 E H X S+ 0 0 10 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.901 110.4 49.0 -64.3 -42.2 59.2 70.9 28.2
167 167 Q H X S+ 0 0 22 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.891 108.0 55.8 -65.3 -35.7 62.1 71.7 30.5
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185 185 D H >< S+ 0 0 117 -4,-2.5 3,-1.2 1,-0.2 4,-0.4 0.932 110.8 48.8 -66.9 -44.4 65.0 81.0 19.3
186 186 G H >< S+ 0 0 19 -4,-2.4 3,-1.5 1,-0.3 -1,-0.2 0.789 96.1 74.2 -64.6 -30.1 65.3 77.4 18.0
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188 188 A T << S+ 0 0 76 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.861 94.9 55.1 -59.5 -37.2 63.1 79.8 13.8
189 189 D T < S+ 0 0 109 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.034 80.3 134.0 -91.8 34.8 65.2 77.0 12.3
190 190 A < - 0 0 12 -3,-1.5 -3,-0.0 1,-0.1 -33,-0.0 -0.349 67.6 -79.6 -77.3 162.3 62.3 74.7 11.9
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197 197 G S > S+ 0 0 41 -2,-0.2 3,-1.3 1,-0.1 -4,-0.2 0.244 88.0 119.9 31.7-115.3 62.5 79.8 4.2
198 198 G T 3 S- 0 0 69 1,-0.2 2,-0.4 -6,-0.1 -1,-0.1 -0.073 94.0 -57.0 57.9-161.3 59.7 82.3 3.9
199 199 M T 3 S+ 0 0 143 -3,-0.1 2,-0.4 1,-0.1 -1,-0.2 -0.478 100.9 116.6-109.7 61.4 56.9 81.7 6.3
200 200 L < + 0 0 46 -3,-1.3 -7,-1.6 -2,-0.4 -5,-0.2 -0.766 38.2 175.5-130.2 90.7 56.2 78.2 5.2
201 201 M B -D 192 0D 53 -2,-0.4 -9,-0.3 -9,-0.2 -8,-0.1 -0.479 42.3 -87.3 -85.8 164.9 56.8 75.8 8.0
202 202 R + 0 0 75 -11,-1.5 -1,-0.2 -2,-0.1 42,-0.1 0.033 46.2 168.4 -60.5-178.6 56.0 72.1 7.6
203 203 G + 0 0 9 2,-0.1 3,-0.1 41,-0.1 -1,-0.1 0.333 39.0 109.4 175.1 2.9 52.5 71.1 8.4
204 204 R S S- 0 0 86 1,-0.2 2,-0.2 43,-0.1 -2,-0.0 0.900 87.1 -48.8 -68.9 -44.4 51.9 67.5 7.2
205 205 A - 0 0 11 71,-0.0 2,-0.4 2,-0.0 -1,-0.2 -0.821 41.0-109.9 173.6 154.1 51.8 65.8 10.7
206 206 L + 0 0 6 -2,-0.2 2,-0.2 67,-0.2 5,-0.2 -0.754 46.8 148.8 -94.3 136.8 53.3 65.2 14.2
207 207 V - 0 0 20 3,-1.8 6,-0.1 -2,-0.4 -2,-0.0 -0.841 64.5 -77.2-153.7-177.0 54.8 61.8 14.9
208 208 L S S+ 0 0 75 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.843 130.4 47.9 -61.8 -35.4 57.6 60.3 17.0
209 209 V S S+ 0 0 38 1,-0.2 2,-0.6 2,-0.0 -1,-0.2 0.931 112.6 45.9 -70.7 -47.3 60.1 61.6 14.4
210 210 A + 0 0 11 1,-0.1 -3,-1.8 -5,-0.1 3,-0.2 -0.895 48.2 171.4-119.0 116.8 58.8 65.2 14.1
211 211 A >> + 0 0 1 -2,-0.6 4,-1.6 -5,-0.2 3,-1.0 0.513 57.1 98.6 -77.4 -22.1 58.0 67.3 17.1
212 212 L H 3> S+ 0 0 7 1,-0.3 4,-1.7 2,-0.2 3,-0.3 0.858 78.9 52.6 -49.9 -46.8 57.5 70.5 15.1
213 213 L H 3> S+ 0 0 8 1,-0.3 4,-1.5 -3,-0.2 -1,-0.3 0.870 108.7 50.6 -59.5 -39.9 53.7 70.4 14.9
214 214 L H <> S+ 0 0 22 -3,-1.0 4,-2.9 1,-0.2 -1,-0.3 0.894 106.4 56.6 -64.2 -37.6 53.4 70.0 18.6
215 215 Q H X S+ 0 0 4 -4,-1.6 4,-2.8 -3,-0.3 5,-0.4 0.860 100.9 57.5 -61.3 -40.2 55.7 73.0 19.1
216 216 L H X S+ 0 0 3 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.961 113.9 37.0 -59.4 -49.3 53.4 75.1 17.1
217 217 L H X S+ 0 0 14 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.928 116.9 51.8 -68.9 -43.7 50.4 74.5 19.3
218 218 L H X S+ 0 0 62 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.924 114.4 40.9 -62.4 -47.0 52.4 74.4 22.5
219 219 L H X>S+ 0 0 11 -4,-2.8 4,-3.1 1,-0.2 5,-0.7 0.918 114.2 53.3 -68.1 -39.8 54.1 77.7 22.0
220 220 A H X5S+ 0 0 6 -4,-2.0 4,-1.5 -5,-0.4 5,-0.4 0.893 110.8 48.0 -61.7 -39.9 50.9 79.3 20.6
221 221 A H X5S+ 0 0 57 -4,-2.8 4,-1.8 3,-0.2 -1,-0.2 0.955 115.6 43.5 -65.1 -46.6 49.1 78.1 23.7
222 222 A H <5S+ 0 0 58 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.980 130.8 22.3 -65.4 -55.9 51.8 79.5 26.0
223 223 G H <5S+ 0 0 13 -4,-3.1 10,-0.4 1,-0.2 -3,-0.2 0.930 122.8 57.4 -73.2 -44.1 52.4 82.8 24.4
224 224 G H < + 0 0 25 1,-0.2 4,-0.7 -2,-0.1 3,-0.3 -0.197 40.5 176.9 -59.3 115.2 53.4 85.1 19.0
235 235 H H > S+ 0 0 91 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.671 78.9 80.6 -73.9 -22.6 50.6 85.0 16.5
236 236 N H > S+ 0 0 65 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.884 90.1 47.1 -54.6 -43.7 53.4 83.4 14.5
237 237 Y H > S+ 0 0 47 -3,-0.3 4,-3.0 1,-0.2 -1,-0.3 0.919 110.7 52.9 -65.2 -40.0 52.8 80.2 16.3
238 238 E H X S+ 0 0 54 -4,-0.7 4,-3.0 1,-0.2 -2,-0.2 0.895 106.9 52.3 -62.5 -38.7 49.1 80.5 15.7
239 239 D H X S+ 0 0 59 -4,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.933 111.8 45.3 -64.0 -43.1 49.7 81.1 12.0
240 240 A H X S+ 0 0 8 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.938 114.3 49.3 -64.6 -43.2 51.8 77.9 11.8
241 241 L H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 5,-0.3 0.914 110.7 50.5 -60.8 -43.5 49.2 76.0 13.8
242 242 R H X S+ 0 0 105 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.907 107.9 52.0 -63.6 -41.7 46.4 77.3 11.6
243 243 K H X S+ 0 0 43 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.936 112.1 46.5 -61.3 -45.2 48.1 76.3 8.4
244 244 S H X S+ 0 0 2 -4,-2.1 4,-1.5 1,-0.2 3,-0.2 0.960 115.2 43.6 -62.0 -53.0 48.7 72.8 9.7
245 245 L H X S+ 0 0 9 -4,-2.5 4,-2.3 1,-0.3 -1,-0.2 0.850 110.9 56.5 -63.4 -35.0 45.2 72.2 11.0
246 246 L H <>S+ 0 0 34 -4,-2.6 5,-2.4 -5,-0.3 4,-0.4 0.911 101.4 57.3 -62.0 -40.2 43.7 73.8 7.9
247 247 Y H <5S+ 0 0 29 -4,-1.9 9,-1.5 1,-0.3 -1,-0.2 0.913 109.8 44.5 -58.7 -44.5 45.5 71.3 5.8
248 248 F H <5S+ 0 0 9 -4,-1.5 -1,-0.3 7,-0.2 -2,-0.2 0.878 128.8 23.9 -68.2 -44.4 43.9 68.4 7.6
249 249 E T <5S+ 0 0 52 -4,-2.3 -3,-0.2 -5,-0.1 -2,-0.1 0.918 138.3 8.5 -82.6 -76.1 40.4 70.0 7.6
250 250 A T 5S- 0 0 32 -4,-0.4 -3,-0.2 -5,-0.2 2,-0.2 0.950 102.0-115.2 -73.4 -53.2 39.8 72.5 4.8
251 251 Q < - 0 0 107 -5,-2.4 2,-0.3 -8,-0.2 4,-0.3 -0.399 12.2-134.7 127.5 156.4 42.9 72.1 2.7
252 252 R S S- 0 0 140 2,-1.2 -5,-0.0 -5,-0.2 -1,-0.0 -0.848 87.6 -28.2-142.4 106.2 45.9 74.2 1.8
253 253 S S S- 0 0 130 -2,-0.3 -2,-0.0 0, 0.0 2,-0.0 0.917 147.6 -2.8 53.0 43.5 46.8 74.1 -1.8
254 254 G S S- 0 0 36 2,-0.0 -2,-1.2 -4,-0.0 2,-0.1 0.223 88.4-120.8 107.6 128.7 45.4 70.6 -1.8
255 255 R - 0 0 111 -4,-0.3 -7,-0.2 -5,-0.2 -8,-0.1 -0.430 36.3 -81.9 -98.1 166.8 44.0 68.9 1.3
256 256 L - 0 0 5 -9,-1.5 -1,-0.2 -2,-0.1 9,-0.1 -0.396 61.4 -93.9 -65.2 146.7 45.0 65.6 2.9
257 257 P - 0 0 48 0, 0.0 7,-2.6 0, 0.0 2,-0.4 -0.384 44.5-155.6 -67.1 141.8 43.5 62.7 1.2
258 258 H B -E 263 0E 60 5,-0.2 5,-0.2 -3,-0.1 98,-0.1 -0.930 11.6-155.8-126.2 147.0 40.2 61.5 2.6
259 259 N - 0 0 15 3,-3.5 98,-0.2 -2,-0.4 97,-0.1 0.112 69.4 -57.7 -87.1-154.4 38.5 58.2 2.5
260 260 Q S S- 0 0 157 96,-0.5 97,-0.1 1,-0.1 96,-0.0 0.935 128.6 -24.7 -59.6 -41.3 34.8 58.1 2.9
261 261 R S S+ 0 0 175 95,-0.1 2,-0.3 42,-0.0 -1,-0.1 0.400 118.1 97.6-148.2 0.5 35.5 59.9 6.2
262 262 V - 0 0 0 94,-0.2 -3,-3.5 44,-0.1 2,-0.6 -0.732 65.1-134.1 -98.0 141.9 39.0 58.9 7.2
263 263 A B -E 258 0E 0 -2,-0.3 2,-0.7 -5,-0.2 -5,-0.2 -0.803 22.4-164.9 -89.8 123.6 42.0 61.2 6.6
264 264 W + 0 0 46 -7,-2.6 92,-0.1 -2,-0.6 3,-0.1 -0.855 18.9 169.2-115.9 103.9 44.7 59.0 5.2
265 265 R - 0 0 91 -2,-0.7 2,-0.3 5,-0.3 -1,-0.2 0.947 67.7 -11.7 -72.7 -46.7 48.1 60.6 5.2
266 266 D - 0 0 86 2,-0.1 -1,-0.2 1,-0.1 7,-0.1 -0.904 65.4-103.2-149.2 172.6 50.1 57.6 4.4
267 267 H S > S+ 0 0 69 -2,-0.3 3,-0.5 2,-0.1 2,-0.5 0.806 98.1 70.8 -69.0 -35.0 50.0 53.8 4.0
268 268 S T 3 S- 0 0 74 1,-0.3 5,-0.2 2,-0.1 -2,-0.1 -0.753 117.8 -11.9 -97.2 132.7 51.8 53.0 7.3
269 269 G T 3> S+ 0 0 6 -2,-0.5 4,-1.9 83,-0.1 -1,-0.3 0.907 76.6 171.4 55.5 48.6 50.1 53.6 10.6
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