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 .
683 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
42896.9 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
269 39.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES .
9 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
31 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES .
2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES .
2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES .
3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES .
4 0.6 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 .
75 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
19 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
72 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES .
3 0.4 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 1 2 2 1 2 1 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX .
3 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 .
3 2 1 0 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 0 ANTIPARALLEL BRIDGES PER LADDER .
1 2 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 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 56 0, 0.0 2,-0.3 0, 0.0 154,-0.3 0.000 360.0 360.0 360.0-171.5 -1.2 14.1 41.2
2 2 G E -a 155 0A 14 152,-1.1 154,-1.4 326,-0.2 2,-0.4 -0.997 360.0 -97.8-159.4 156.5 -4.1 11.8 41.4
3 3 N E -a 156 0A 61 -2,-0.3 2,-2.5 152,-0.2 3,-0.3 -0.627 39.6-123.8 -76.1 130.5 -6.0 9.2 39.5
4 4 L + 0 0 0 152,-3.7 154,-0.2 -2,-0.4 -1,-0.1 -0.627 48.4 161.4 -82.2 81.4 -9.0 10.9 38.0
5 5 N S S+ 0 0 45 -2,-2.5 319,-0.4 1,-0.3 -1,-0.2 0.584 72.8 69.1 -70.8 -27.3 -11.1 8.4 39.7
6 6 G S > S+ 0 0 11 -3,-0.3 4,-1.0 308,-0.2 3,-0.4 0.830 98.3 178.0 -60.2 -32.7 -13.8 10.9 39.1
7 7 L H > - 0 0 1 305,-0.2 4,-1.9 149,-0.2 3,-0.3 -0.095 40.9 -23.4 71.0-160.7 -12.9 9.6 35.7
8 8 V H > S+ 0 0 4 1,-0.2 4,-3.8 2,-0.2 5,-0.2 0.852 129.1 61.7 -57.8 -42.0 -14.3 10.4 32.4
9 9 S H > S+ 0 0 18 -3,-0.4 4,-2.9 1,-0.3 -1,-0.2 0.931 107.5 42.5 -57.3 -48.4 -17.6 11.6 33.7
10 10 S H X S+ 0 0 0 -4,-1.0 4,-3.0 304,-0.3 5,-0.3 0.902 114.2 51.8 -68.6 -34.6 -16.0 14.4 35.6
11 11 L H X S+ 0 0 0 -4,-1.9 4,-3.2 301,-0.5 5,-0.3 0.965 111.2 48.9 -58.8 -48.4 -13.7 15.2 32.7
12 12 S H X S+ 0 0 16 -4,-3.8 4,-2.4 1,-0.2 12,-0.5 0.911 112.5 47.7 -58.4 -44.5 -16.8 15.3 30.6
13 13 S H < S+ 0 0 68 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.966 114.7 43.7 -62.4 -53.2 -18.6 17.6 33.0
14 14 L H < S+ 0 0 20 -4,-3.0 30,-1.0 299,-0.3 -2,-0.2 0.886 112.7 51.0 -63.7 -40.1 -15.8 20.0 33.5
15 15 T H < S- 0 0 0 -4,-3.2 -1,-0.2 -5,-0.3 -2,-0.2 0.947 116.3-126.5 -61.1 -44.7 -14.9 20.2 29.8
16 16 S < - 0 0 52 -4,-2.4 8,-0.8 -5,-0.3 9,-0.3 -0.265 15.2 -80.5 119.5 163.3 -18.6 20.9 29.2
17 17 K - 0 0 170 6,-0.2 6,-0.2 -4,-0.1 2,-0.1 -0.861 40.0-158.1-100.2 116.8 -21.3 19.4 27.1
18 18 P > - 0 0 26 0, 0.0 4,-0.5 0, 0.0 2,-0.5 -0.500 42.6 -85.0 -80.6 162.0 -21.1 20.6 23.6
19 19 Y T 4 S+ 0 0 248 -2,-0.1 2,-0.3 2,-0.1 4,-0.0 -0.600 104.4 49.3 -72.5 125.6 -24.3 20.3 21.7
20 20 G T 4 S- 0 0 45 -2,-0.5 2,-0.7 2,-0.1 0, 0.0 -0.855 114.8 -55.9 137.9-173.3 -24.2 16.7 20.5
21 21 F T 4 S+ 0 0 194 -2,-0.3 2,-0.3 -4,-0.0 -2,-0.1 -0.299 109.2 72.7 -97.2 54.0 -23.5 13.4 22.1
22 22 Y < - 0 0 182 -2,-0.7 2,-0.2 -4,-0.5 3,-0.1 -0.941 61.3-143.3-154.2 173.9 -20.2 14.6 23.4
23 23 N S S+ 0 0 46 -2,-0.3 -6,-0.2 -6,-0.2 -11,-0.1 -0.430 70.1 77.8-121.0-162.9 -18.3 16.7 25.8
24 24 L S S- 0 0 18 -8,-0.8 -1,-0.1 -12,-0.5 -7,-0.1 0.995 78.8-144.5 54.0 63.7 -15.0 18.5 25.3
25 25 S > - 0 0 17 -9,-0.3 4,-0.5 -10,-0.2 3,-0.5 -0.256 13.3-120.9 -60.2 153.1 -16.9 21.3 23.5
26 26 S T >4 S+ 0 0 106 1,-0.3 3,-1.1 2,-0.2 -1,-0.1 0.844 114.0 59.8 -65.2 -33.3 -15.0 22.8 20.6
27 27 G T 34 S+ 0 0 56 1,-0.3 -1,-0.3 14,-0.0 -2,-0.0 0.862 100.5 57.3 -62.0 -35.2 -15.2 26.2 22.2
28 28 D T 34 S+ 0 0 20 -3,-0.5 14,-2.2 -13,-0.1 -1,-0.3 0.681 78.2 116.7 -67.8 -24.1 -13.3 24.7 25.2
29 29 S E << -B 41 0A 44 -3,-1.1 12,-0.3 -4,-0.5 3,-0.1 -0.315 43.7-171.9 -58.8 122.4 -10.4 23.6 23.0
30 30 S E - 0 0A 67 10,-2.1 2,-0.3 1,-0.4 -1,-0.2 0.814 59.3 -73.0 -78.0 -37.2 -7.3 25.4 24.1
31 31 G E -B 40 0A 29 9,-1.3 9,-2.6 -3,-0.0 2,-0.6 -0.931 59.5 -58.8 161.6 179.4 -5.3 24.1 21.1
32 32 E E -B 39 0A 128 -2,-0.3 7,-0.2 7,-0.2 275,-0.1 -0.788 57.8-127.0 -90.0 127.0 -3.7 21.0 19.8
33 33 R - 0 0 6 5,-1.3 5,-0.3 -2,-0.6 303,-0.1 -0.381 32.1 -91.4 -74.3 153.6 -1.2 19.8 22.2
34 34 A S S+ 0 0 14 301,-0.2 274,-0.3 3,-0.1 4,-0.2 -0.251 106.1 45.3 -58.5 155.1 2.3 19.2 21.0
35 35 Y S > S- 0 0 16 1,-0.1 3,-1.0 267,-0.1 403,-0.0 0.508 96.1-109.1 67.2 129.9 2.5 15.6 20.0
36 36 A T 3 S+ 0 0 50 1,-0.3 45,-0.2 -4,-0.1 -1,-0.1 0.646 92.1 103.8 -63.6 -20.6 -0.4 14.5 18.0
37 37 I T 3 S- 0 0 2 43,-0.1 44,-3.6 1,-0.1 2,-0.3 0.695 88.2 -23.3 -51.3 -32.3 -1.7 12.4 20.7
38 38 G E < - C 0 80A 1 -3,-1.0 -5,-1.3 42,-0.3 2,-0.3 -0.995 55.3-101.8-170.5 170.4 -4.5 14.7 21.6
39 39 L E -BC 32 79A 42 40,-0.9 40,-2.5 -2,-0.3 2,-0.4 -0.706 36.9-129.0 -94.3 150.1 -6.2 18.0 21.8
40 40 C E -BC 31 78A 8 -9,-2.6 -10,-2.1 -2,-0.3 -9,-1.3 -0.827 23.3-168.8-103.6 140.5 -6.2 20.0 25.0
41 41 R E -BC 29 77A 2 36,-2.2 36,-3.3 -2,-0.4 2,-0.4 -0.958 23.3-120.7-129.7 144.5 -9.4 21.4 26.5
42 42 R E - C 0 76A 13 -14,-2.2 2,-0.3 -2,-0.4 34,-0.2 -0.694 30.7-166.1 -82.2 131.6 -9.9 23.9 29.3
43 43 E E - C 0 75A 0 32,-2.9 32,-0.8 -2,-0.4 2,-0.4 -0.833 7.1-145.2-113.2 158.0 -12.0 22.4 32.1
44 44 V E - C 0 74A 19 -30,-1.0 2,-1.2 -2,-0.3 30,-0.2 -0.988 10.3-153.8-125.4 133.7 -13.6 24.3 34.8
45 45 K + 0 0 25 28,-1.0 18,-0.5 -2,-0.4 28,-0.1 -0.730 30.4 163.4 -97.3 81.4 -14.0 23.3 38.4
46 46 R S S+ 0 0 111 -2,-1.2 -1,-0.2 1,-0.1 27,-0.1 0.994 84.2 19.7 -64.1 -57.8 -17.0 25.5 38.9
47 47 D S S- 0 0 114 -3,-0.2 14,-0.6 2,-0.1 -1,-0.1 0.938 82.9-171.5 -71.8 -45.3 -18.1 23.7 42.0
48 48 D + 0 0 54 1,-0.2 2,-0.5 -4,-0.2 -3,-0.1 0.842 41.3 134.8 54.6 31.6 -14.7 22.3 42.5
49 49 C + 0 0 58 266,-0.1 2,-0.3 11,-0.1 -1,-0.2 -0.954 28.5 169.9-118.1 124.9 -16.5 20.3 45.2
50 50 L - 0 0 62 -2,-0.5 2,-0.2 -3,-0.1 275,-0.0 -0.943 43.3 -95.2-128.4 152.1 -15.9 16.6 45.5
51 51 A - 0 0 61 -2,-0.3 2,-0.4 2,-0.0 275,-0.2 -0.467 44.6-178.8 -67.6 135.2 -17.0 14.4 48.3
52 52 L - 0 0 95 2,-0.2 2,-1.4 -2,-0.2 275,-0.1 -0.995 36.0-114.5-132.1 137.7 -14.2 14.0 50.8
53 53 E S S+ 0 0 163 -2,-0.4 2,-0.3 2,-0.0 -2,-0.0 -0.610 79.8 95.4 -77.9 100.9 -14.6 11.8 53.8
54 54 S - 0 0 69 -2,-1.4 2,-0.5 2,-0.1 -2,-0.2 -0.948 69.3-117.1-170.1 165.7 -14.4 14.4 56.5
55 55 V + 0 0 144 -2,-0.3 3,-0.1 3,-0.0 -2,-0.0 -0.977 39.6 151.6-121.3 131.4 -16.8 16.5 58.5
56 56 M - 0 0 120 -2,-0.5 3,-0.1 1,-0.1 -2,-0.1 -0.978 52.5-117.0-149.0 154.2 -17.0 20.2 58.2
57 57 P S S- 0 0 121 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.827 98.5 -2.5 -64.4 -29.8 -19.7 22.7 58.7
58 58 S - 0 0 82 -3,-0.1 2,-0.5 2,-0.0 -3,-0.0 -0.984 61.6-149.6-156.9 152.3 -19.5 23.7 55.1
59 59 M + 0 0 90 -2,-0.3 2,-0.4 -3,-0.1 -3,-0.0 -0.954 26.7 153.4-130.7 117.3 -17.4 22.9 52.1
60 60 N + 0 0 144 -2,-0.5 2,-0.4 2,-0.0 -12,-0.1 -0.920 8.0 152.1-141.5 115.7 -16.7 25.4 49.4
61 61 V + 0 0 86 -14,-0.6 2,-0.2 -2,-0.4 -2,-0.0 -0.984 25.4 89.6-144.8 134.2 -13.7 25.3 47.3
62 62 S - 0 0 43 -2,-0.4 2,-0.6 -13,-0.0 -16,-0.1 -0.833 67.6-104.0 161.7 165.7 -13.2 26.5 43.7
63 63 S S S+ 0 0 36 -18,-0.5 10,-0.8 10,-0.4 2,-0.2 -0.808 80.2 62.8-120.0 96.2 -12.1 29.7 42.1
64 64 S - 0 0 39 -2,-0.6 2,-0.1 8,-0.1 296,-0.1 -0.833 50.2-152.0 167.7 156.4 -15.1 31.4 40.7
65 65 T - 0 0 61 -2,-0.2 298,-0.1 296,-0.2 -2,-0.0 -0.187 59.9 -70.1-115.3-147.6 -18.4 33.1 41.5
66 66 E + 0 0 142 -2,-0.1 2,-0.2 2,-0.1 -2,-0.0 -0.687 67.8 158.4-113.2 83.6 -21.2 33.1 39.0
67 67 P - 0 0 10 0, 0.0 2,-1.1 0, 0.0 295,-0.1 -0.577 49.7-120.4 -90.7 165.4 -20.1 35.4 36.3
68 68 L + 0 0 173 -2,-0.2 2,-0.4 0, 0.0 295,-0.2 -0.722 67.8 133.3-100.0 81.4 -21.5 35.3 32.8
69 69 L - 0 0 66 -2,-1.1 292,-0.0 1,-0.1 293,-0.0 -0.963 62.7-130.5-132.3 148.1 -18.2 34.5 31.3
70 70 M S S+ 0 0 141 -2,-0.4 2,-0.3 1,-0.0 -1,-0.1 0.917 92.1 44.3 -63.3 -42.4 -17.2 31.9 28.7
71 71 S - 0 0 35 -3,-0.1 2,-0.2 -28,-0.0 -27,-0.0 -0.788 60.9-175.6-112.8 148.8 -14.3 30.6 30.7
72 72 L - 0 0 21 -2,-0.3 2,-0.5 -8,-0.1 -8,-0.1 -0.718 39.0 -89.7-123.6 175.7 -13.9 29.9 34.4
73 73 N S S+ 0 0 32 -10,-0.8 -28,-1.0 -2,-0.2 -10,-0.4 -0.773 71.6 96.3-101.4 136.1 -10.7 28.8 36.1
74 74 D E -C 44 0A 11 -2,-0.5 95,-1.1 -30,-0.2 -30,-0.2 -0.490 64.6 -36.7-166.5-115.7 -9.6 25.2 36.4
75 75 V E -CD 43 168A 0 -32,-0.8 -32,-2.9 93,-0.2 2,-0.4 -0.690 43.0-106.2-131.3 177.5 -7.4 22.8 34.6
76 76 T E -CD 42 167A 12 91,-3.0 91,-2.6 -34,-0.2 2,-0.5 -0.940 33.0-172.0-112.7 133.8 -6.1 21.7 31.2
77 77 V E -C 41 0A 0 -36,-3.3 -36,-2.2 -2,-0.4 234,-0.5 -0.903 8.1-169.5-133.3 97.9 -7.4 18.5 29.8
78 78 S E -Ce 40 310A 0 232,-1.7 233,-1.1 231,-1.2 87,-0.6 -0.529 13.5-148.0 -77.7 154.5 -6.2 16.8 26.7
79 79 E E -CF 39 164A 42 -40,-2.5 -40,-0.9 231,-0.3 2,-0.4 -0.983 25.8-118.2-114.1 128.0 -8.1 13.9 25.4
80 80 L E -C 38 0A 0 83,-2.3 83,-0.3 -2,-0.6 -42,-0.3 -0.590 45.9-101.0 -67.1 131.6 -6.0 11.4 23.8
81 81 S - 0 0 6 -44,-3.6 5,-0.1 -2,-0.4 50,-0.1 -0.144 56.6 -69.9 -53.8 148.2 -7.3 11.5 20.4
82 82 P - 0 0 49 0, 0.0 -1,-0.2 0, 0.0 80,-0.0 -0.196 53.0-133.2 -45.9 121.5 -9.6 8.7 19.6
83 83 R S S+ 0 0 53 1,-0.2 3,-0.3 -3,-0.2 48,-0.2 0.917 98.6 41.0 -55.0 -52.0 -7.1 5.9 19.6
84 84 A S S+ 0 0 44 1,-0.2 2,-1.4 46,-0.1 -1,-0.2 0.929 112.6 54.2 -65.1 -44.4 -8.2 4.3 16.4
85 85 L S S+ 0 0 135 1,-0.2 -1,-0.2 16,-0.1 -2,-0.1 -0.559 76.4 92.4-100.4 79.4 -8.8 7.5 14.4
86 86 F S S+ 0 0 82 -2,-1.4 2,-0.3 -3,-0.3 -1,-0.2 -0.292 86.4 16.2-155.2 68.1 -5.7 9.5 14.5
87 87 A S S- 0 0 68 14,-0.1 2,-0.5 13,-0.0 13,-0.0 -0.936 91.2 -70.0 157.8-176.7 -3.7 8.5 11.4
88 88 I - 0 0 153 -2,-0.3 2,-0.2 -3,-0.1 14,-0.2 -0.940 48.0-124.3-109.4 129.2 -4.0 6.8 8.1
89 89 C - 0 0 85 -2,-0.5 2,-0.4 12,-0.1 14,-0.0 -0.525 25.2-165.6 -74.0 136.6 -4.5 3.1 8.3
90 90 L - 0 0 70 -2,-0.2 2,-0.5 12,-0.1 10,-0.0 -0.977 6.0-151.4-120.6 136.5 -1.9 1.1 6.4
91 91 C - 0 0 118 -2,-0.4 2,-0.4 4,-0.0 3,-0.1 -0.932 13.5-179.1-113.6 130.1 -2.5 -2.5 5.6
92 92 L - 0 0 64 -2,-0.5 -2,-0.0 1,-0.2 3,-0.0 -0.918 35.0-125.4-119.0 149.2 0.3 -4.9 5.2
93 93 L S S+ 0 0 163 -2,-0.4 2,-0.3 1,-0.1 -1,-0.2 0.961 101.1 25.2 -60.1 -46.2 -0.3 -8.5 4.4
94 94 L S S- 0 0 108 -3,-0.1 -1,-0.1 12,-0.0 2,-0.1 -0.868 96.0-106.2-116.5 150.4 1.7 -9.5 7.4
95 95 K - 0 0 71 -2,-0.3 2,-0.3 8,-0.0 10,-0.1 -0.437 36.8-162.4 -72.4 149.1 2.3 -7.4 10.5
96 96 W - 0 0 111 8,-0.1 2,-1.4 -2,-0.1 8,-0.2 -0.898 34.6 -94.3-126.8 158.5 5.8 -5.9 10.7
97 97 K S S+ 0 0 146 -2,-0.3 355,-1.7 355,-0.1 2,-0.3 -0.620 74.5 135.2 -75.0 102.3 7.5 -4.5 13.6
98 98 K - 0 0 21 -2,-1.4 2,-1.0 353,-0.2 358,-0.1 -0.991 58.3-124.8-145.8 148.4 6.6 -0.9 13.1
99 99 N + 0 0 58 -2,-0.3 2,-0.3 356,-0.1 3,-0.1 -0.843 51.0 147.9 -97.9 106.5 5.4 1.8 15.3
100 100 K - 0 0 47 -2,-1.0 -2,-0.1 1,-0.2 -11,-0.1 -0.835 61.5-108.2-129.5 167.8 2.2 3.0 13.8
101 101 S S S+ 0 0 31 -2,-0.3 29,-2.0 -13,-0.2 2,-0.3 0.999 113.3 36.0 -56.9 -61.2 -0.9 4.4 15.2
102 102 V S S+ 0 0 65 -14,-0.2 2,-0.3 27,-0.2 -12,-0.1 -0.649 80.5 155.9 -91.6 144.5 -2.7 1.2 14.3
103 103 G - 0 0 36 -2,-0.3 2,-0.3 -4,-0.1 25,-0.3 -0.972 23.1-161.2-164.4 153.7 -0.8 -2.0 14.6
104 104 R - 0 0 178 -2,-0.3 2,-0.5 -8,-0.2 -8,-0.1 -0.967 15.0-137.0-137.7 152.6 -1.3 -5.7 15.1
105 105 V + 0 0 83 -2,-0.3 2,-0.3 19,-0.1 -2,-0.0 -0.951 35.9 148.4-114.3 129.9 0.9 -8.5 16.3
106 106 K + 0 0 114 -2,-0.5 2,-0.2 -11,-0.0 -2,-0.1 -0.981 4.6 133.4-151.4 157.3 0.9 -11.8 14.5
107 107 G - 0 0 69 -2,-0.3 2,-0.4 2,-0.0 -2,-0.0 -0.751 36.6-133.1 164.8 151.1 3.3 -14.5 13.7
108 108 N - 0 0 149 -2,-0.2 2,-0.5 2,-0.0 -2,-0.0 -0.984 18.9-151.5-122.7 132.3 3.8 -18.2 13.7
109 109 K - 0 0 117 -2,-0.4 2,-0.4 2,-0.0 -2,-0.0 -0.868 13.4-176.0-105.5 136.9 6.9 -19.7 15.2
110 110 H + 0 0 168 -2,-0.5 2,-0.4 2,-0.0 -2,-0.0 -0.987 8.1 165.7-133.4 125.2 8.1 -23.0 13.8
111 111 N - 0 0 118 -2,-0.4 2,-0.8 2,-0.1 -2,-0.0 -0.996 27.3-145.9-136.5 142.7 11.1 -24.8 15.2
112 112 L + 0 0 141 -2,-0.4 2,-0.3 2,-0.1 -2,-0.0 -0.854 49.6 124.9-110.6 98.3 12.1 -28.4 14.6
113 113 L - 0 0 118 -2,-0.8 2,-1.2 2,-0.1 -2,-0.1 -0.987 63.0-119.0-147.0 152.3 13.7 -29.6 17.8
114 114 L + 0 0 160 -2,-0.3 2,-0.3 3,-0.0 3,-0.1 -0.784 65.7 124.0 -95.4 97.3 13.1 -32.5 20.1
115 115 L S S- 0 0 89 -2,-1.2 -2,-0.1 1,-0.1 3,-0.0 -0.883 79.7-100.9-142.6 171.9 12.2 -30.7 23.3
116 116 V S S- 0 0 120 -2,-0.3 -1,-0.1 1,-0.1 2,-0.1 0.935 85.0 -86.0 -59.7 -42.5 9.4 -30.7 25.7
117 117 I - 0 0 146 -3,-0.1 2,-0.4 2,-0.0 -1,-0.1 -0.001 53.4-178.8 137.0 121.4 8.4 -27.5 23.9
118 118 V - 0 0 106 -2,-0.1 2,-0.5 -3,-0.0 -3,-0.0 -0.998 9.6-158.8-138.6 140.4 9.6 -24.0 24.4
119 119 I - 0 0 88 -2,-0.4 2,-0.7 2,-0.1 -2,-0.0 -0.980 0.6-163.4-123.0 129.2 8.6 -20.9 22.6
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511 511 S H < S- 0 0 1 -4,-1.9 80,-0.3 78,-0.2 -2,-0.2 0.738 89.3-138.5 -87.0 -32.5 13.8 36.3 15.5
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580 580 N + 0 0 7 -81,-0.4 6,-3.9 8,-0.2 -80,-0.4 0.619 33.0 154.4 27.9 42.5 21.6 43.2 14.0
581 581 S + 0 0 0 -82,-0.5 -81,-1.1 4,-0.2 -91,-0.6 -0.387 6.3 121.0 -94.2 167.8 19.0 41.0 15.6
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585 585 C S S+ 0 0 10 5,-0.9 41,-0.2 1,-0.3 -4,-0.2 -0.712 78.3 9.6 175.2-113.9 16.2 45.7 15.0
586 586 I S S- 0 0 14 -6,-3.9 -1,-0.3 35,-0.2 3,-0.2 -0.146 91.1 -71.1 -91.3-171.5 17.6 44.4 11.7
587 587 Q S S+ 0 0 51 1,-0.3 -8,-0.1 -9,-0.2 -7,-0.1 0.838 132.4 45.3 -52.7 -43.0 16.4 41.6 9.6
588 588 I S S+ 0 0 1 -9,-0.7 -1,-0.3 -10,-0.6 -7,-0.2 0.941 100.5 79.9 -68.5 -42.1 17.4 38.9 11.9
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599 599 L - 0 0 69 1,-0.1 2,-0.3 -3,-0.0 -2,-0.1 -0.267 56.2-142.9 -57.1 128.8 17.7 58.4 23.4
600 600 T - 0 0 110 2,-0.0 2,-0.7 1,-0.0 -1,-0.1 -0.739 11.8-132.8 -92.4 143.3 19.3 61.2 21.6
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608 608 T + 0 0 105 -2,-0.4 2,-0.3 2,-0.0 -2,-0.0 -0.886 51.9 71.3-120.9 100.5 43.3 59.3 11.4
609 609 H S S- 0 0 130 -2,-0.6 -2,-0.1 2,-0.1 0, 0.0 -0.963 87.7 -92.0 175.6 175.9 44.3 57.0 8.7
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611 611 M - 0 0 108 2,-0.0 2,-0.7 0, 0.0 -2,-0.1 -0.986 62.2-148.9-129.5 141.0 41.2 53.1 6.5
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613 613 R + 0 0 201 -2,-0.7 2,-0.4 2,-0.1 -1,-0.1 -0.618 35.2 116.2-129.5 74.6 36.0 51.3 9.7
614 614 Y - 0 0 152 -2,-0.2 2,-0.2 -9,-0.0 -2,-0.0 -0.997 52.7-139.2-143.0 146.5 33.0 53.2 10.7
615 615 S - 0 0 25 -2,-0.4 2,-0.8 2,-0.1 -2,-0.1 -0.465 42.3 -94.8 -89.2 171.5 29.3 52.6 10.7
616 616 N S S- 0 0 95 -2,-0.2 8,-0.3 3,-0.0 3,-0.1 -0.812 87.3 -28.2 -93.6 117.0 27.0 55.3 9.7
617 617 M S S- 0 0 135 -2,-0.8 2,-0.7 1,-0.1 -2,-0.1 0.245 86.6 -81.5 64.1 161.6 25.9 57.1 12.8
618 618 I + 0 0 35 5,-0.1 2,-0.3 -3,-0.0 -1,-0.1 -0.894 64.1 154.4-104.6 114.2 25.6 55.4 16.1
619 619 I - 0 0 12 -2,-0.7 2,-0.4 -127,-0.1 4,-0.2 -0.950 34.3-137.8-135.9 155.7 22.4 53.4 16.4
620 620 Y S S- 0 0 43 -2,-0.3 2,-2.4 8,-0.2 8,-0.4 -0.950 88.7 -6.8-118.5 137.6 21.5 50.4 18.3
621 621 G S S+ 0 0 1 -2,-0.4 -35,-0.2 -129,-0.2 -32,-0.1 -0.241 132.6 67.9 74.7 -52.5 19.4 47.6 16.8
622 622 R S > S+ 0 0 93 -2,-2.4 3,-1.2 6,-0.4 -1,-0.2 0.683 70.2 131.4 -65.9 -26.8 19.2 50.1 13.9
623 623 K T 3 S- 0 0 7 1,-0.3 -124,-0.1 -4,-0.2 3,-0.1 -0.075 91.0 -13.2 -43.6 126.6 22.9 49.6 13.3
624 624 E T 3 S+ 0 0 105 -8,-0.3 -1,-0.3 1,-0.2 2,-0.3 0.916 132.8 80.0 31.3 65.3 23.3 49.0 9.6
625 625 T S < S- 0 0 35 -3,-1.2 -1,-0.2 -39,-0.1 -39,-0.1 -0.917 98.2 -68.2-168.8 178.3 19.6 48.6 9.5
626 626 T S S- 0 0 100 -2,-0.3 0, 0.0 -41,-0.2 0, 0.0 -0.477 81.1 -68.2 -75.6 161.6 16.5 50.7 9.4
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628 628 T - 0 0 10 -8,-0.4 -6,-0.4 1,-0.1 -8,-0.2 -0.958 7.2-162.9-118.2 123.3 15.2 50.0 15.3
629 629 L + 0 0 65 -2,-0.5 -1,-0.1 -8,-0.1 -37,-0.1 0.883 62.8 5.8 -73.2 -39.8 13.1 51.3 18.1
630 630 S + 0 0 10 -39,-0.2 -36,-0.1 -33,-0.0 -2,-0.1 0.596 49.3 145.4-115.4-108.2 13.4 48.8 20.9
631 631 F - 0 0 9 1,-0.2 2,-0.4 -141,-0.1 -141,-0.1 0.723 32.5-153.3 60.6 128.2 15.4 45.7 21.8
632 632 Q + 0 0 24 -143,-0.4 -367,-1.2 2,-0.1 -366,-0.6 -0.955 58.4 47.0-134.8 117.5 16.2 45.4 25.5
633 633 A S S- 0 0 0 -2,-0.4 2,-0.3 -368,-0.2 -143,-0.2 -0.954 96.0 -56.5 154.7-144.2 19.2 43.4 26.5
634 634 T > - 0 0 4 -2,-0.3 4,-3.0 -144,-0.2 5,-0.2 -0.948 31.5-124.6-131.5 157.9 22.7 43.6 25.1
635 635 G H > S+ 0 0 0 -2,-0.3 4,-1.1 1,-0.3 -145,-0.3 0.857 119.6 55.6 -63.1 -33.9 23.9 43.1 21.5
636 636 S H > S+ 0 0 27 2,-0.2 4,-0.6 1,-0.2 -1,-0.3 0.857 105.5 48.4 -65.3 -38.8 26.1 40.6 23.2
637 637 R H >> S+ 0 0 33 2,-0.3 3,-1.8 1,-0.3 4,-0.9 0.964 113.6 45.8 -64.8 -42.8 23.1 38.8 24.6
638 638 S H 3< S+ 0 0 0 -4,-3.0 -1,-0.3 1,-0.3 7,-0.3 0.808 115.5 55.6 -58.9 -32.7 21.6 39.0 21.2
639 639 E H 3< S+ 0 0 28 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.3 0.395 96.2 59.9 -75.6 -21.6 25.1 37.8 20.5
640 640 I H << S+ 0 0 3 -3,-1.8 6,-2.6 -4,-0.6 -2,-0.2 0.977 93.0 57.9 -79.5 -42.1 25.4 34.8 22.6
641 641 L S < S- 0 0 0 -4,-0.9 -139,-0.2 -153,-0.4 -1,-0.1 0.120 91.1-107.4 -78.0 -13.1 22.7 32.4 21.4
642 642 R B S+k 502 0D 0 -140,-0.5 -139,-3.1 -141,-0.5 -140,-0.6 0.924 93.2 97.3 48.7 91.6 22.9 31.3 17.4
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644 644 I S S- 0 0 0 -143,-1.2 -142,-0.2 -90,-0.1 -5,-0.1 0.474 149.0 -14.7-127.6 -74.4 24.1 33.9 15.4
645 645 H S > S+ 0 0 0 -144,-0.5 4,-0.9 -7,-0.3 -4,-0.3 0.871 126.2 16.3-108.2 -73.5 26.3 32.1 18.0
646 646 I H > S+ 0 0 1 -6,-2.6 4,-2.2 1,-0.2 -4,-0.4 0.897 118.2 62.2 -65.2 -38.9 25.3 29.3 20.3
647 647 G H > S+ 0 0 0 1,-0.3 4,-2.1 2,-0.3 -5,-0.3 0.811 105.3 37.6 -62.9 -50.3 22.2 28.4 18.4
648 648 L H > S+ 0 0 11 2,-0.3 4,-0.6 1,-0.2 -1,-0.3 0.713 112.0 63.2 -74.6 -25.9 23.3 27.4 15.0
649 649 L H >< S+ 0 0 20 -4,-0.9 3,-0.9 1,-0.2 -2,-0.3 0.962 111.0 36.8 -59.2 -44.1 26.1 25.8 16.9
650 650 C H 3< S+ 0 0 0 -4,-2.2 -2,-0.3 1,-0.2 -1,-0.2 0.867 118.2 52.8 -66.9 -38.1 23.3 23.8 18.4
651 651 V H 3< S+ 0 0 0 -4,-2.1 -1,-0.2 -9,-0.2 -2,-0.2 0.350 79.8 141.2 -77.0 -2.4 21.6 23.8 14.9
652 652 Q << - 0 0 56 -3,-0.9 6,-0.1 -4,-0.6 -3,-0.1 -0.170 56.1-133.1 -54.6 141.4 24.8 22.5 13.2
653 653 E S S+ 0 0 26 29,-0.1 -185,-0.3 -187,-0.1 -1,-0.1 0.880 93.3 67.6 -62.9 -38.9 24.0 19.9 10.5
654 654 S S > S- 0 0 61 1,-0.2 3,-0.8 -187,-0.1 4,-0.3 -0.743 73.8-153.7 -88.7 124.3 26.7 17.6 11.7
655 655 P G > S+ 0 0 31 0, 0.0 3,-1.0 0, 0.0 -1,-0.2 0.755 89.8 66.1 -66.3 -25.8 25.7 16.2 15.1
656 656 A G 3 S+ 0 0 89 1,-0.3 -3,-0.0 -3,-0.0 -2,-0.0 0.851 99.0 53.6 -63.5 -36.8 29.3 15.6 16.1
657 657 S G < S+ 0 0 51 -3,-0.8 -1,-0.3 2,-0.0 -5,-0.1 0.556 85.7 106.6 -75.6 -12.2 29.9 19.4 16.1
658 658 R < - 0 0 16 -3,-1.0 -8,-0.2 -4,-0.3 2,-0.1 -0.408 67.5-125.1 -75.9 148.2 27.0 20.2 18.4
659 659 P - 0 0 22 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.403 23.2-103.1 -83.8 164.0 27.7 21.2 22.0
660 660 T > - 0 0 35 -2,-0.1 4,-1.9 1,-0.1 5,-0.1 -0.448 33.1-112.9 -81.1 162.6 26.4 19.7 25.1
661 661 M H > S+ 0 0 2 1,-0.2 4,-2.0 2,-0.2 -379,-0.1 0.867 118.4 53.7 -64.5 -37.4 23.6 21.5 26.9
662 662 D H > S+ 0 0 52 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.895 107.3 50.5 -65.4 -39.3 26.0 22.2 29.8
663 663 S H > S+ 0 0 43 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.890 109.2 52.5 -65.1 -37.2 28.5 23.7 27.5
664 664 V H X S+ 0 0 2 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.898 105.2 53.6 -65.6 -39.3 25.8 25.9 26.0
665 665 A H X S+ 0 0 27 -4,-2.0 4,-2.0 1,-0.2 6,-0.3 0.892 106.5 53.7 -61.9 -38.6 24.8 27.1 29.4
666 666 L H <>S+ 0 0 73 -4,-1.8 5,-2.4 1,-0.2 6,-1.0 0.919 111.3 44.5 -62.0 -44.3 28.4 28.1 30.1
667 667 M H ><5S+ 0 0 3 -4,-1.9 3,-1.6 1,-0.2 -1,-0.2 0.878 108.3 59.2 -66.5 -36.9 28.5 30.1 26.9
668 668 L H 3<5S+ 0 0 6 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.895 112.6 38.3 -59.4 -43.7 25.1 31.6 27.6
669 669 N T 3<5S- 0 0 66 -4,-2.0 -1,-0.3 -5,-0.1 -249,-0.2 0.047 113.8-112.2-104.2 29.9 26.3 33.1 30.9
670 670 S T < 5S+ 0 0 14 -3,-1.6 -3,-0.2 1,-0.1 -2,-0.1 0.665 78.9 130.8 58.7 15.7 29.7 34.1 29.6
671 671 Y S