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 .
.
COMPND .
SOURCE .
AUTHOR .
435 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
21326.1 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
263 60.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES .
34 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
33 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
1 0.2 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 .
2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES .
3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES .
1 0.2 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 .
38 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
36 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
82 18.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES .
9 2.1 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 1 0 2 0 2 3 1 0 1 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX .
0 1 0 1 2 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 PARALLEL BRIDGES PER LADDER .
4 1 0 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 ANTIPARALLEL BRIDGES PER LADDER .
2 0 0 0 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 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 0 111 0, 0.0 2,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -95.2 -5.4 -7.9 16.8
2 2 Y + 0 0 231 3,-0.1 2,-0.3 0, 0.0 3,-0.1 -0.726 360.0 42.4-100.2 86.4 -2.9 -7.2 14.2
3 3 N S S- 0 0 58 -2,-1.3 2,-0.1 3,-0.0 156,-0.1 -0.866 119.3 -6.0 172.9-145.4 -3.4 -3.4 13.8
4 4 G S S- 0 0 7 -2,-0.3 2,-0.0 1,-0.1 153,-0.0 -0.506 90.2 -98.7 -66.8 144.0 -3.9 -1.0 16.6
5 5 S - 0 0 72 -2,-0.1 154,-0.9 151,-0.1 155,-0.1 -0.422 50.6-167.1 -61.0 138.2 -4.2 -2.9 19.8
6 6 I - 0 0 20 152,-0.2 152,-0.1 153,-0.1 151,-0.1 -0.900 30.8 -90.3-126.9 154.2 -7.9 -3.2 20.4
7 7 P - 0 0 30 0, 0.0 4,-0.2 0, 0.0 6,-0.1 -0.442 54.2-147.9 -63.3 147.7 -9.6 -4.2 23.5
8 8 T > > - 0 0 90 2,-0.2 5,-1.3 4,-0.1 3,-0.5 0.114 35.5 -48.5-107.4-151.0 -10.2 -8.0 23.4
9 9 L T 3 5S+ 0 0 126 1,-0.3 2,-2.0 3,-0.1 6,-0.1 0.917 132.9 44.5 -57.7 -52.2 -12.6 -10.7 24.5
10 10 V T 3 5S+ 0 0 126 2,-0.0 -1,-0.3 0, 0.0 2,-0.2 -0.476 122.5 42.2 -92.1 74.0 -12.9 -9.6 28.0
11 11 S T < 5S- 0 0 41 -2,-2.0 30,-0.1 -3,-0.5 -2,-0.1 -0.749 122.6 -30.3-172.0-144.5 -13.2 -6.1 26.9
12 12 T T 5S+ 0 0 0 -2,-0.2 29,-2.6 28,-0.1 -4,-0.1 0.762 91.7 121.4 -66.8 -29.1 -15.0 -4.1 24.2
13 13 T B < -A 40 0A 37 -5,-1.3 2,-0.6 27,-0.2 -2,-0.3 0.063 55.7-143.3 -47.1 144.6 -14.8 -7.0 21.7
14 14 Y - 0 0 9 25,-1.5 2,-0.4 4,-0.0 -1,-0.1 -0.947 9.6-143.9-110.9 120.9 -18.1 -8.1 20.4
15 15 S > - 0 0 42 -2,-0.6 4,-1.2 294,-0.3 3,-0.1 -0.711 10.2-139.3 -85.6 140.5 -18.3 -11.8 19.9
16 16 W T >4 S+ 0 0 9 -2,-0.4 3,-0.6 1,-0.2 -1,-0.2 0.938 103.2 56.8 -65.3 -37.5 -20.3 -12.5 16.9
17 17 T T 34 S+ 0 0 87 1,-0.3 -1,-0.2 -3,-0.1 5,-0.1 0.889 100.6 60.7 -58.1 -38.3 -21.9 -15.4 18.6
18 18 K T 34 S+ 0 0 117 291,-0.1 -1,-0.3 -3,-0.1 -2,-0.2 0.888 76.6 99.6 -59.3 -41.9 -23.1 -13.1 21.3
19 19 V S X< S- 0 0 0 -4,-1.2 3,-0.6 -3,-0.6 2,-0.1 -0.238 73.6-133.1 -58.0 125.2 -25.2 -10.8 19.2
20 20 A T 3 S+ 0 0 21 1,-0.2 3,-0.1 280,-0.1 -1,-0.1 -0.421 75.7 13.0 -81.9 151.9 -28.8 -11.9 19.6
21 21 N T 3 S+ 0 0 68 1,-0.2 83,-2.4 -2,-0.1 2,-0.3 0.845 91.9 126.3 49.4 43.6 -31.3 -12.5 16.9
22 22 I < - 0 0 6 -3,-0.6 2,-0.3 81,-0.2 -1,-0.2 -0.899 69.4-101.9-119.9 155.6 -28.7 -12.4 14.3
23 23 I - 0 0 46 -2,-0.3 2,-2.1 81,-0.2 3,-0.1 -0.573 18.5-134.0 -84.5 137.2 -28.4 -15.3 11.9
24 24 Y S S+ 0 0 131 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 -0.330 97.7 69.6 -87.8 60.7 -25.7 -17.7 12.6
25 25 L S S+ 0 0 135 -2,-2.1 2,-1.5 1,-0.2 -1,-0.2 0.401 95.6 42.5-129.8 -72.9 -24.9 -17.6 9.0
26 26 D S S+ 0 0 92 -3,-0.1 -1,-0.2 2,-0.0 -3,-0.2 -0.681 76.4 170.4 -83.8 96.0 -23.5 -14.2 8.4
27 27 Q - 0 0 65 -2,-1.5 2,-0.4 -3,-0.1 9,-0.3 -0.938 32.5-132.2-106.3 118.5 -21.3 -14.0 11.4
28 28 P + 0 0 3 0, 0.0 2,-0.3 0, 0.0 -12,-0.2 -0.594 41.4 159.7 -69.1 127.0 -19.0 -11.0 11.4
29 29 V - 0 0 53 -2,-0.4 8,-0.3 9,-0.1 9,-0.2 -0.995 42.3-108.2-149.0 146.9 -15.6 -12.2 12.3
30 30 G - 0 0 52 -2,-0.3 2,-0.3 6,-0.1 6,-0.1 -0.466 40.6-177.1 -74.4 146.9 -12.1 -10.8 11.7
31 31 A - 0 0 52 2,-0.2 4,-0.2 -2,-0.1 7,-0.1 -0.938 43.2-115.5-140.9 161.9 -10.1 -12.7 9.2
32 32 G S S+ 0 0 88 -2,-0.3 2,-0.2 2,-0.1 -1,-0.1 0.922 112.3 37.2 -61.1 -39.5 -6.6 -12.5 7.9
33 33 F S S- 0 0 181 1,-0.1 -2,-0.2 -3,-0.1 2,-0.0 -0.580 121.3 -66.5-104.6 169.8 -8.3 -11.6 4.7
34 34 S S S+ 0 0 78 -2,-0.2 2,-0.2 -4,-0.1 -1,-0.1 -0.367 71.0 152.4 -60.2 132.3 -11.4 -9.5 4.3
35 35 Y - 0 0 146 -4,-0.2 -5,-0.1 -6,-0.1 3,-0.1 -0.532 60.0 -51.6-140.8-157.8 -14.2 -11.4 5.9
36 36 S S S- 0 0 19 -9,-0.3 2,-0.2 -2,-0.2 -6,-0.1 0.963 84.8 -99.3 -55.6 -75.7 -17.5 -10.4 7.5
37 37 R - 0 0 7 -8,-0.3 -1,-0.2 -10,-0.2 -7,-0.1 -0.823 18.4-112.9 164.5 159.6 -16.2 -7.8 10.0
38 38 N - 0 0 43 -2,-0.2 24,-1.3 -9,-0.2 2,-0.2 -0.957 28.9-162.9-121.5 121.1 -15.3 -7.3 13.7
39 39 P E - B 0 61A 2 0, 0.0 -25,-1.5 0, 0.0 2,-0.3 -0.588 3.0-164.1 -93.6 164.5 -17.4 -5.1 15.9
40 40 F E -AB 13 60A 10 20,-2.2 20,-3.2 -27,-0.2 2,-0.4 -0.991 4.2-171.7-145.3 147.4 -16.7 -3.5 19.3
41 41 A E + B 0 59A 0 -29,-2.6 2,-0.2 -2,-0.3 18,-0.2 -0.973 33.2 105.7-142.2 127.8 -18.8 -1.9 22.0
42 42 D E - B 0 58A 0 16,-1.6 16,-3.1 -2,-0.4 270,-0.1 -0.804 61.7 -72.8-167.6-154.7 -17.6 -0.1 25.1
43 43 R - 0 0 4 14,-0.3 14,-0.2 -2,-0.2 2,-0.2 -0.986 25.7-148.8-132.5 132.7 -17.4 3.4 26.4
44 44 P - 0 0 1 0, 0.0 12,-2.4 0, 0.0 106,-0.2 -0.625 31.7-110.7 -83.8 156.4 -15.1 6.3 25.5
45 45 S B -K 55 0B 10 104,-1.7 10,-0.2 105,-0.3 108,-0.2 -0.310 39.5-171.0 -80.1 167.7 -14.2 8.7 28.2
46 46 D - 0 0 0 8,-1.6 8,-0.3 1,-0.2 7,-0.3 -0.672 29.1 -41.4-140.6-157.4 -15.6 12.2 28.0
47 47 T S S+ 0 0 39 -2,-0.2 7,-1.0 93,-0.2 2,-0.3 -0.163 75.2 91.7 -74.1 166.9 -15.4 15.6 29.6
48 48 G S S- 0 0 32 5,-0.2 3,-0.1 4,-0.1 101,-0.1 -0.861 90.0 -39.6 138.8-166.9 -15.1 16.4 33.2
49 49 S S > S- 0 0 91 -2,-0.3 4,-0.6 1,-0.2 2,-0.1 -0.369 96.2 -58.6 -78.0 173.7 -11.9 16.9 35.1
50 50 A T 4 S+ 0 0 103 2,-0.1 2,-0.3 3,-0.1 -1,-0.2 -0.359 113.7 64.6 -56.2 120.6 -9.1 14.5 34.2
51 51 E T 4 S- 0 0 139 -5,-0.2 3,-0.2 -2,-0.1 -5,-0.1 -0.956 105.6 -71.5 156.7-162.3 -10.7 11.2 34.9
52 52 D T 4 S+ 0 0 82 -2,-0.3 -5,-0.1 1,-0.1 -2,-0.1 -0.386 73.2 138.4-118.6 58.2 -13.6 9.3 33.4
53 53 E < + 0 0 83 -4,-0.6 2,-0.2 -7,-0.3 -5,-0.2 0.978 70.0 42.3 -64.7 -51.1 -16.3 11.5 34.8
54 54 D S S- 0 0 4 -7,-1.0 -8,-1.6 -8,-0.3 2,-0.3 -0.643 73.8-176.0 -93.6 152.1 -18.2 11.5 31.6
55 55 Q B -K 45 0B 35 -2,-0.2 2,-0.4 -10,-0.2 68,-0.4 -0.979 9.1-165.6-148.9 136.1 -18.6 8.4 29.6
56 56 M - 0 0 3 -12,-2.4 2,-0.4 -2,-0.3 64,-0.1 -0.915 19.4-131.2-120.8 146.6 -20.3 7.7 26.3
57 57 F E - C 0 119A 0 62,-0.6 62,-2.5 -2,-0.4 2,-0.4 -0.793 28.4-172.1 -95.0 138.7 -21.2 4.3 25.0
58 58 Y E -BC 42 118A 0 -16,-3.1 -16,-1.6 -2,-0.4 2,-0.5 -0.955 21.7-155.3-132.3 155.4 -20.1 3.5 21.5
59 59 Y E -BC 41 117A 0 58,-2.3 58,-2.7 -2,-0.4 2,-0.5 -0.991 19.9-168.0-122.5 118.1 -20.7 0.8 18.9
60 60 F E -BC 40 116A 0 -20,-3.2 -20,-2.2 -2,-0.5 2,-0.5 -0.931 5.5-169.2-117.5 125.5 -17.9 0.5 16.4
61 61 I E -B 39 0A 0 54,-2.7 3,-0.1 -2,-0.5 -2,-0.0 -0.955 17.9-135.9-117.3 123.3 -18.1 -1.5 13.3
62 62 K - 0 0 9 -24,-1.3 52,-0.1 -2,-0.5 51,-0.1 -0.300 37.4 -87.2 -73.8 158.0 -15.1 -2.2 11.2
63 63 S - 0 0 2 1,-0.2 -25,-0.2 4,-0.1 51,-0.2 -0.374 22.7-141.1 -69.1 141.2 -15.3 -1.8 7.4
64 64 E S S+ 0 0 53 47,-0.8 2,-0.5 49,-0.3 -1,-0.2 0.804 93.1 53.6 -68.6 -31.3 -16.4 -4.9 5.5
65 65 S S S- 0 0 72 46,-1.1 5,-0.2 1,-0.2 -1,-0.2 -0.945 130.3 -28.9-113.3 125.5 -13.9 -3.9 2.8
66 66 N > - 0 0 72 -2,-0.5 4,-2.3 1,-0.1 -1,-0.2 0.888 65.6-172.6 41.4 70.8 -10.2 -3.3 3.7
67 67 P T 4 S+ 0 0 40 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.861 77.1 56.8 -60.8 -38.4 -10.7 -2.1 7.2
68 68 E T 4 S+ 0 0 133 1,-0.2 -2,-0.1 -5,-0.1 46,-0.0 0.916 116.4 35.9 -61.7 -45.5 -7.1 -1.0 7.8
69 69 E T 4 S+ 0 0 149 -3,-0.1 -1,-0.2 94,-0.1 -3,-0.1 0.821 98.7 95.8 -74.2 -37.8 -7.2 1.3 4.8
70 70 D S < S- 0 0 39 -4,-2.3 94,-0.2 -5,-0.2 43,-0.1 -0.114 78.5 -99.9 -69.5 156.4 -10.7 2.6 5.0
71 71 P - 0 0 34 0, 0.0 43,-2.7 0, 0.0 2,-0.4 -0.251 26.8-119.1 -72.3 157.8 -11.7 5.7 6.7
72 72 L E -de 114 165A 8 92,-2.0 94,-2.2 41,-0.2 2,-0.5 -0.844 27.7-163.5 -99.1 132.1 -13.2 6.1 10.1
73 73 L E -de 115 166A 4 41,-2.8 43,-3.5 -2,-0.4 2,-0.4 -0.971 6.2-153.9-123.4 123.0 -16.6 7.7 10.1
74 74 V E -de 116 167A 1 92,-2.6 94,-2.9 -2,-0.5 2,-0.5 -0.775 12.6-162.8 -94.4 133.2 -18.2 9.1 13.3
75 75 W E +de 117 168A 11 41,-2.8 43,-1.6 -2,-0.4 2,-0.4 -0.975 9.4 179.5-121.3 130.1 -21.9 9.1 13.3
76 76 L E - e 0 169A 0 92,-1.3 94,-2.0 -2,-0.5 97,-0.1 -0.992 15.5-149.4-133.1 131.0 -24.0 11.2 15.7
77 77 S - 0 0 0 -2,-0.4 7,-0.2 41,-0.4 4,-0.2 -0.405 18.6-143.0 -84.8 170.2 -27.7 11.5 16.0
78 78 G > + 0 0 3 5,-0.1 4,-2.6 -2,-0.1 3,-0.5 0.362 49.8 117.2-105.6-128.9 -29.3 14.7 17.2
79 79 G T 4 S- 0 0 14 1,-0.3 2,-0.2 2,-0.2 -1,-0.1 -0.809 90.2-100.8 128.8 -83.5 -32.3 15.6 19.4
80 80 P T 4 S+ 0 0 6 0, 0.0 250,-1.0 0, 0.0 -1,-0.3 0.539 120.2 29.1 -65.6 152.8 -30.6 17.0 21.4
81 81 G T 4 S+ 0 0 1 -3,-0.5 244,-2.4 1,-0.4 -2,-0.2 0.388 90.6 130.9 108.4 0.8 -30.7 13.9 23.6
82 82 C B < -L 324 0C 12 -4,-2.6 38,-0.4 242,-0.2 -1,-0.4 -0.557 55.7-116.7 -90.5 156.0 -31.2 11.3 20.8
83 83 S > - 0 0 0 240,-1.9 3,-1.3 -2,-0.2 4,-0.4 -0.718 1.0-145.5-101.4 139.5 -29.2 8.1 20.5
84 84 S T 3> S+ 0 0 0 -2,-0.3 4,-1.4 1,-0.3 3,-0.3 0.591 95.0 78.1 -72.4 -13.2 -26.8 7.3 17.7
85 85 F H 3> S+ 0 0 2 40,-0.3 4,-3.1 1,-0.2 -1,-0.3 0.794 85.4 60.8 -65.2 -30.8 -27.8 3.7 18.2
86 86 T H <>>S+ 0 0 5 -3,-1.3 4,-3.5 1,-0.2 5,-1.1 0.870 101.4 53.6 -63.1 -36.9 -31.0 4.5 16.3
87 87 G I 4>S+ 0 0 0 -4,-0.4 5,-2.6 -3,-0.3 6,-0.6 0.909 112.6 42.9 -62.9 -43.0 -28.8 5.4 13.4
88 88 L I <>S+ 0 0 2 -4,-1.4 5,-1.8 3,-0.2 -2,-0.2 0.981 122.4 38.4 -65.1 -53.6 -27.2 2.0 13.5
89 89 V I <5S+ 0 0 2 -4,-3.1 8,-1.4 1,-0.1 -2,-0.2 0.855 133.7 18.1 -64.2 -53.3 -30.4 0.1 14.1
90 90 Y I <5S+ 0 0 108 -4,-3.5 -3,-0.2 -5,-0.2 -2,-0.1 0.863 126.9 36.9 -89.0 -48.0 -32.7 2.0 11.8
91 91 E I - 0 0 82 5,-2.4 3,-1.1 -2,-0.2 202,-0.1 -0.401 27.9 -97.7 -95.1 173.3 -37.1 -5.7 12.5
99 99 V T 3 S+ 0 0 115 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.827 123.4 60.5 -59.0 -36.5 -40.7 -5.0 13.4
100 100 E T 3 S- 0 0 111 1,-0.1 -1,-0.3 3,-0.0 -3,-0.0 0.845 97.4-142.2 -62.0 -31.8 -40.6 -7.9 15.9
101 101 K S < S+ 0 0 55 -3,-1.1 -1,-0.1 2,-0.3 -2,-0.1 0.386 84.9 92.6 78.5 -3.2 -37.8 -6.0 17.7
102 102 L S S+ 0 0 85 1,-0.0 2,-0.2 198,-0.0 -3,-0.1 0.919 81.4 37.6 -78.1 -49.7 -36.6 -9.5 18.1
103 103 V - 0 0 25 -81,-0.0 -5,-2.4 -80,-0.0 2,-0.3 -0.523 60.0-145.2-118.0 165.8 -34.3 -9.8 15.1
104 104 N E -M 97 0D 0 -83,-2.4 -81,-0.2 -7,-0.2 2,-0.2 -0.932 14.9-174.7-126.3 152.6 -31.8 -8.0 12.9
105 105 E E -M 96 0D 81 -9,-1.9 -9,-2.9 -2,-0.3 2,-0.3 -0.739 16.9-122.7-133.8 179.9 -31.1 -8.2 9.2
106 106 F + 0 0 49 -11,-0.2 2,-0.2 -2,-0.2 -11,-0.1 -0.801 35.8 139.1-125.8 164.1 -28.6 -6.8 6.6
107 107 V S S- 0 0 134 -13,-0.3 2,-0.7 -2,-0.3 -15,-0.0 -0.548 72.9 -19.7-164.8-125.3 -28.8 -4.8 3.4
108 108 R S S+ 0 0 154 -2,-0.2 2,-0.2 2,-0.0 -15,-0.0 -0.900 70.5 168.5-107.6 106.3 -26.6 -1.9 2.3
109 109 K - 0 0 8 -2,-0.7 2,-2.8 -15,-0.1 3,-0.3 -0.430 59.7 -75.1-104.4 176.1 -24.9 -0.4 5.3
110 110 W > + 0 0 63 -18,-1.7 3,-1.2 1,-0.2 -46,-0.1 -0.393 68.0 159.7 -78.9 77.8 -22.0 2.0 5.2
111 111 L T 3 + 0 0 60 -2,-2.8 -46,-1.1 1,-0.3 -47,-0.8 0.677 57.4 75.8 -67.2 -26.9 -19.7 -0.9 4.2
112 112 A T 3 S+ 0 0 54 -3,-0.3 -1,-0.3 -49,-0.1 2,-0.2 0.746 101.7 24.4 -61.6 -30.9 -17.2 1.6 2.8
113 113 K S < S- 0 0 49 -3,-1.2 -49,-0.3 -43,-0.1 -41,-0.2 -0.676 82.7 -95.6-131.8-176.3 -15.9 2.7 6.1
114 114 H E - d 0 72A 4 -43,-2.7 -41,-2.8 -2,-0.2 2,-0.4 -0.915 48.6-155.0 -95.2 101.6 -15.3 1.9 9.8
115 115 P E - d 0 73A 0 0, 0.0 -54,-2.7 0, 0.0 2,-0.6 -0.697 12.2-163.7 -87.7 137.8 -18.3 3.5 11.4
116 116 D E -Cd 60 74A 0 -43,-3.5 -41,-2.8 -2,-0.4 2,-0.6 -0.951 3.5-163.6-119.4 116.7 -18.3 4.6 15.0
117 117 Y E -Cd 59 75A 2 -58,-2.7 -58,-2.3 -2,-0.6 2,-0.5 -0.863 11.4-172.6 -98.9 120.2 -21.7 5.3 16.5
118 118 F E -C 58 0A 0 -43,-1.6 2,-0.8 -2,-0.6 -41,-0.4 -0.952 17.4-145.5-118.0 128.3 -21.4 7.3 19.6
119 119 S E -C 57 0A 0 -62,-2.5 -62,-0.6 -2,-0.5 6,-0.3 -0.807 38.3-154.0 -95.2 118.8 -24.2 8.0 21.9
120 120 N + 0 0 1 -2,-0.8 -39,-0.3 -38,-0.4 2,-0.2 -0.973 50.5 38.3-148.6 158.3 -23.8 11.4 23.3
121 121 P S >> S- 0 0 8 0, 0.0 3,-1.5 0, 0.0 4,-1.3 0.568 97.1 -84.2 -75.0-177.0 -24.1 13.5 25.4
122 122 F T 34 S+ 0 0 25 1,-0.3 7,-0.2 2,-0.2 -66,-0.1 -0.207 113.3 13.3 -59.9 145.6 -23.9 11.6 28.6
123 123 Y T 34 S+ 0 0 44 -68,-0.4 3,-0.3 5,-0.2 -1,-0.3 0.077 118.0 71.9 76.7 -19.0 -27.1 9.9 29.8
124 124 V T <4 S+ 0 0 1 -3,-1.5 -2,-0.2 1,-0.2 198,-0.2 0.801 73.2 87.2 -82.0 -25.2 -28.6 10.5 26.4
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211 211 G H X S+ 0 0 0 -4,-1.9 4,-2.1 -7,-0.4 -1,-0.2 0.917 112.1 49.1 -63.6 -41.4 -34.9 26.9 9.3
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213 213 H H X S+ 0 0 40 -4,-2.7 4,-1.3 1,-0.2 3,-0.3 0.943 115.6 43.9 -64.4 -48.5 -38.2 31.1 7.9
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215 215 L H < S+ 0 0 33 -4,-2.1 -1,-0.2 -5,-0.3 5,-0.2 0.893 98.8 53.5 -61.9 -40.1 -40.3 26.2 7.2
216 216 E H X S+ 0 0 6 -4,-1.5 4,-1.9 -3,-0.3 -1,-0.2 0.947 111.6 46.3 -62.4 -42.4 -43.2 28.7 7.0
217 217 Y H X S+ 0 0 94 -4,-1.3 4,-2.8 2,-0.2 5,-0.3 0.937 107.8 56.9 -62.6 -45.3 -42.8 28.8 3.2
218 218 K H X S+ 0 0 27 -4,-2.8 4,-2.6 1,-0.3 5,-0.2 0.943 109.1 44.7 -59.8 -51.3 -42.6 25.0 2.9
219 219 P H >>S+ 0 0 7 0, 0.0 5,-2.8 0, 0.0 6,-0.8 0.872 111.7 52.4 -55.8 -36.5 -45.9 24.4 4.6
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237 237 Q H <5S+ 0 0 4 -4,-3.1 13,-1.5 -5,-0.4 2,-0.6 0.842 98.3 73.8 -74.4 -35.1 -44.9 38.7 10.4
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239 239 N S S+ 0 0 125 -2,-0.6 2,-0.4 9,-0.5 -1,-0.2 0.962 74.7 1.5 -61.5 -52.7 -42.7 44.3 9.3
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245 245 I + 0 0 130 -2,-0.2 -4,-0.1 -4,-0.1 -2,-0.1 -0.918 65.1 97.8-112.9 134.8 -43.1 44.5 -2.9
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260 260 I H X S+ 0 0 48 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.933 108.8 44.4 -63.4 -48.7 -46.6 34.4 17.5
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264 264 H H X S+ 0 0 112 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.888 102.8 55.4 -62.2 -37.3 -48.2 28.6 16.7
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270 270 S G < S+ 0 0 47 -3,-2.3 -1,-0.3 -4,-0.4 -2,-0.2 0.313 72.5 102.6 -69.5 6.3 -47.0 19.4 13.6
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277 277 L S S+ 0 0 42 92,-1.9 -1,-0.2 -2,-0.4 93,-0.1 0.932 95.7 51.9 -63.6 -41.1 -45.1 14.9 4.8
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279 279 R S S- 0 0 153 1,-0.1 -5,-0.1 -5,-0.0 -3,-0.1 -0.316 81.5-123.7 -72.6 152.7 -45.9 9.3 5.4
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281 281 C > - 0 0 9 -9,-0.2 3,-1.6 -2,-0.1 2,-0.1 -0.816 34.6-126.2 -97.4 127.2 -48.0 9.2 11.5
282 282 G T 3 S+ 0 0 46 9,-1.0 9,-0.3 -2,-0.6 10,-0.1 -0.456 90.9 11.7 -68.8 136.0 -47.9 5.9 13.2
283 283 G T 3 S- 0 0 41 -2,-0.1 -1,-0.3 8,-0.1 9,-0.0 0.563 112.7 -98.1 80.3 9.8 -50.1 5.6 16.2
284 284 S S < S- 0 0 82 -3,-1.6 7,-0.3 -12,-0.1 2,-0.3 -0.136 78.0 -24.2 69.2-178.1 -52.0 8.8 15.5
285 285 Y S S+ 0 0 149 5,-0.1 2,-0.2 1,-0.1 -13,-0.1 -0.529 96.2 105.7 -70.4 128.2 -51.1 12.0 17.3
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289 289 V S > S- 0 0 40 1,-0.1 3,-1.6 2,-0.1 -2,-0.1 -0.497 97.3 -85.1 -63.8 140.8 -40.7 11.3 18.7
290 290 I T 3 S- 0 0 46 1,-0.3 -15,-0.3 -2,-0.1 -1,-0.1 -0.189 98.4 -9.0 -61.6 133.6 -43.6 12.2 16.5
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295 295 D T 4 S+ 0 0 63 2,-0.2 5,-0.3 1,-0.2 -1,-0.2 0.880 73.7 52.5 -66.6 -42.3 -40.8 0.2 19.6
296 296 M T > S+ 0 0 27 -3,-0.3 4,-1.8 1,-0.2 5,-0.2 0.981 113.7 41.8 -63.5 -49.7 -38.5 -2.0 17.5
297 297 T H > S+ 0 0 3 -4,-0.2 4,-2.5 1,-0.2 5,-0.3 0.914 114.1 50.3 -63.5 -47.9 -35.3 -0.3 18.7
298 298 I H X S+ 0 0 55 -4,-2.5 4,-2.6 1,-0.2 23,-0.2 0.959 111.1 45.4 -68.9 -47.3 -36.2 -0.1 22.3
299 299 P H > S+ 0 0 36 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.851 114.2 49.7 -61.4 -28.9 -37.3 -3.6 22.9
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301 301 L H 3< S+ 0 0 9 -4,-2.5 -1,-0.2 1,-0.3 -3,-0.2 0.768 109.5 62.2 -67.2 -31.0 -31.8 -2.9 23.0
302 302 G H 3< S+ 0 0 27 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.781 78.1 111.8 -64.8 -31.5 -33.8 -3.4 26.2
303 303 T S+ 0 0 113 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.892 102.9 56.1 -64.8 -40.3 -30.8 -8.3 28.8
305 305 A H > S+ 0 0 47 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.919 107.9 46.9 -61.4 -44.9 -28.9 -10.5 26.3
306 306 W H > S+ 0 0 5 -6,-0.3 4,-2.5 2,-0.2 5,-0.3 0.924 110.3 52.7 -64.6 -42.5 -28.2 -7.6 24.0
307 307 I H X S+ 0 0 23 -4,-2.1 4,-1.9 1,-0.2 5,-0.3 0.947 111.7 46.5 -59.8 -45.0 -27.1 -5.4 26.8
308 308 R H < S+ 0 0 164 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.882 108.7 55.3 -65.1 -36.8 -24.7 -8.1 28.0
309 309 S H < S+ 0 0 4 -4,-2.4 -294,-0.3 1,-0.2 -1,-0.2 0.926 105.1 50.8 -64.9 -40.0 -23.4 -8.7 24.5
310 310 L H < S+ 0 0 0 -4,-2.5 -1,-0.2 -5,-0.1 -269,-0.2 0.915 94.5 179.6 -61.7 -36.9 -22.5 -5.1 24.1
311 311 N < + 0 0 77 -4,-1.9 2,-0.2 -5,-0.3 -270,-0.1 0.857 30.3 99.7 46.9 68.0 -20.8 -5.8 27.4
312 312 Y S > S- 0 0 84 -5,-0.3 3,-1.2 -270,-0.1 -1,-0.1 -0.396 106.1 -35.3-140.3-130.6 -19.1 -2.7 28.6
313 313 S T 3 S+ 0 0 18 1,-0.3 5,-0.2 -2,-0.2 -2,-0.1 0.471 114.4 102.5 -73.2 6.0 -20.3 -0.2 31.1
314 314 I T 3 + 0 0 7 -7,-0.1 -1,-0.3 -273,-0.1 -3,-0.1 0.600 56.6 149.7 -58.2 -19.9 -23.6 -1.3 29.4
315 315 T X - 0 0 59 -3,-1.2 3,-1.5 1,-0.1 -2,-0.0 0.327 62.1-103.5 -25.5 149.5 -24.0 -3.4 32.6
316 316 E T 3 S+ 0 0 71 1,-0.3 -1,-0.1 -12,-0.1 -2,-0.0 0.653 106.6 77.6 -57.6 -29.7 -27.5 -4.1 33.8
317 317 K T 3 S+ 0 0 182 2,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.875 78.7 87.2 -56.9 -38.1 -27.6 -1.7 36.7
318 318 W S < S- 0 0 92 -3,-1.5 3,-0.1 -5,-0.2 -190,-0.0 -0.203 89.2 -87.6 -71.0 157.6 -28.2 1.3 34.4
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320 320 P - 0 0 96 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.277 52.5 -94.5 -68.4 156.9 -33.4 1.2 30.3
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322 322 M - 0 0 51 -2,-0.2 3,-0.2 -198,-0.2 -239,-0.1 -0.971 30.5-133.7-131.0 145.4 -34.6 5.3 25.3
323 323 I S S+ 0 0 11 -2,-0.3 -240,-1.9 1,-0.3 2,-0.4 0.972 100.8 17.3 -60.7 -50.9 -34.3 6.7 21.8
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325 325 D > - 0 0 3 -244,-2.4 4,-1.0 -2,-0.4 5,-0.4 -0.851 7.7-159.2 -95.7 119.5 -33.8 11.0 26.8
326 326 Q T >4 S+ 0 0 92 -2,-0.7 6,-0.8 1,-0.2 3,-0.5 0.873 91.1 60.1 -64.8 -34.8 -36.2 13.7 27.7
327 327 V T 34 S+ 0 0 41 1,-0.3 6,-0.6 5,-0.1 -1,-0.2 0.880 90.9 69.3 -60.7 -38.1 -34.0 14.7 30.6
328 328 A T 34 S- 0 0 5 -3,-0.3 -1,-0.3 -247,-0.2 -192,-0.2 0.898 111.9-113.9 -57.5 -40.7 -31.2 15.5 28.2
329 329 G S <<>S+ 0 0 3 -4,-1.0 5,-1.1 -3,-0.5 -248,-0.2 0.694 87.6 110.8 133.0 -1.6 -33.1 18.3 27.0
330 330 Y T 5S+ 0 0 146 -250,-1.0 4,-0.1 -5,-0.4 -249,-0.1 0.966 120.8 19.0 -64.6 -46.0 -34.5 18.8 23.6
331 331 T T 5S+ 0 0 86 -251,-0.3 -1,-0.1 -6,-0.2 -5,-0.1 0.802 141.8 41.5 -76.2 -33.0 -37.7 18.4 25.6
332 332 K T 5S- 0 0 106 -6,-0.8 2,-1.2 -7,-0.3 -5,-0.1 0.252 117.5 -45.0 -98.6-144.1 -35.8 19.2 28.7
333 333 T T 5 + 0 0 87 -6,-0.6 -197,-0.7 -199,-0.1 2,-0.5 -0.684 68.7 145.9 -99.3 87.0 -33.2 21.7 29.7
334 334 Y E < -n 136 0E 25 -2,-1.2 2,-0.6 -5,-1.1 -197,-0.2 -0.977 38.7-144.8-114.6 124.3 -30.6 21.7 27.0
335 335 A E -n 137 0E 41 -199,-2.3 2,-0.7 -2,-0.5 -197,-0.7 -0.834 4.6-152.7-100.0 125.0 -29.2 25.1 26.4
336 336 S - 0 0 79 -2,-0.6 -199,-0.1 1,-0.2 3,-0.0 -0.830 11.3-174.1 -96.4 115.1 -28.3 25.9 22.9
337 337 I + 0 0 67 -2,-0.7 2,-0.5 1,-0.1 -1,-0.2 0.936 61.0 50.4 -73.9 -47.4 -25.5 28.4 22.8
338 338 V - 0 0 54 1,-0.2 -1,-0.1 3,-0.0 3,-0.0 -0.802 48.0-172.0-111.7 132.6 -25.1 29.3 19.2
339 339 D S S+ 0 0 83 -2,-0.5 -131,-0.9 -132,-0.1 2,-0.3 0.872 73.7 58.2 -74.5 -45.3 -27.8 30.3 16.7
340 340 P B -O 207 0F 56 0, 0.0 4,-0.2 0, 0.0 -133,-0.2 -0.779 46.5-172.0-102.8 145.1 -25.5 30.2 13.6
341 341 L S > S+ 0 0 3 -135,-1.3 4,-2.2 -2,-0.3 3,-0.5 0.512 73.3 97.7 -83.6 -20.1 -23.4 27.5 12.0
342 342 N H > S+ 0 0 57 1,-0.3 4,-2.2 -136,-0.3 5,-0.2 0.828 79.6 44.6 -49.7 -50.5 -22.1 30.2 9.8
343 343 T H > S+ 0 0 88 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.922 112.6 53.6 -63.4 -40.3 -18.8 31.0 11.6
344 344 E H > S+ 0 0 18 -3,-0.5 4,-2.5 1,-0.2 -2,-0.2 0.926 109.4 46.9 -60.2 -47.7 -18.1 27.3 12.0
345 345 C H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.929 112.5 49.0 -62.1 -45.0 -18.4 26.6 8.3
346 346 L H < S+ 0 0 65 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.923 111.4 51.1 -61.5 -40.2 -16.3 29.6 7.3
347 347 K H >< S+ 0 0 104 -4,-2.8 3,-0.5 1,-0.2 -1,-0.2 0.914 106.9 55.3 -62.0 -42.3 -13.7 28.4 9.8
348 348 L H 3< S+ 0 0 8 -4,-2.5 10,-0.9 1,-0.3 2,-0.5 0.893 120.9 23.6 -63.6 -45.6 -13.7 24.9 8.4
349 349 I T 3< S+ 0 0 10 -4,-2.2 2,-0.3 8,-0.2 -1,-0.3 -0.700 93.3 115.1-126.5 93.9 -12.9 25.9 4.9
350 350 K < - 0 0 119 -3,-0.5 2,-0.9 -2,-0.5 7,-0.3 -0.925 63.0-113.4-147.0 167.4 -11.2 29.2 4.7
351 351 D + 0 0 128 -2,-0.3 2,-0.5 5,-0.1 5,-0.1 -0.798 45.5 154.8-106.1 91.0 -8.0 30.8 3.6
352 352 Y - 0 0 130 -2,-0.9 5,-0.2 3,-0.7 -2,-0.1 -0.964 40.4-138.0-113.3 136.5 -6.4 32.2 6.7
353 353 H S S+ 0 0 175 -2,-0.5 -1,-0.2 1,-0.2 4,-0.0 0.933 94.7 52.3 -60.7 -48.3 -2.7 32.5 6.4
354 354 K S S+ 0 0 169 1,-0.1 2,-0.5 -3,-0.1 -1,-0.2 0.953 116.1 33.7 -61.3 -53.4 -1.7 31.2 9.8
355 355 C S S- 0 0 81 0, 0.0 -3,-0.7 0, 0.0 2,-0.3 -0.863 87.2-130.1-105.0 131.3 -3.6 28.0 9.8
356 356 V + 0 0 119 -2,-0.5 2,-0.2 -5,-0.1 -5,-0.1 -0.590 40.4 158.4 -78.9 136.6 -3.9 26.3 6.5
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358 358 G + 0 0 20 -10,-0.9 -9,-0.1 -2,-0.2 -1,-0.1 0.498 66.5 109.8 88.8 1.9 -9.5 24.5 2.7
359 359 I + 0 0 111 -11,-0.3 2,-0.3 -9,-0.1 -10,-0.1 -0.279 57.8 87.3-105.9 49.0 -8.5 20.9 3.3
360 360 Y - 0 0 38 2,-0.0 2,-0.4 -164,-0.0 -165,-0.2 -0.992 64.2-147.5-141.4 144.9 -11.9 19.9 4.4
361 361 Q E -g 195 0A 93 -167,-1.6 -165,-1.9 -2,-0.3 2,-0.4 -0.939 17.0-161.5-113.9 138.1 -14.8 18.7 2.4
362 362 E E -gh 196 418A 5 55,-2.0 57,-1.6 -2,-0.4 2,-0.4 -0.961 9.4-176.5-125.6 140.9 -18.3 19.6 3.5
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364 364 I E -gh 198 420A 1 55,-2.3 57,-2.6 -2,-0.4 2,-0.4 -0.984 14.5-176.2-116.0 120.9 -25.0 19.1 3.7
365 365 L E -gh 199 421A 31 -167,-3.0 -165,-3.1 -2,-0.5 -164,-0.3 -0.920 2.7-178.8-118.8 144.0 -27.7 16.6 2.6
366 366 K E - h 0 422A 0 55,-2.2 57,-1.8 -2,-0.4 2,-0.2 -0.939 25.5-130.7-146.4 121.2 -31.4 17.1 3.1
367 367 P E > - h 0 423A 0 0, 0.0 3,-1.1 0, 0.0 8,-0.3 -0.572 23.3-132.8 -71.3 141.3 -34.3 15.0 2.2
368 368 K T 3 S+ 0 0 108 55,-2.7 58,-0.2 1,-0.3 7,-0.2 0.627 97.4 51.8 -65.4 -31.1 -37.0 17.0 0.5
369 369 C T 3 S+ 0 0 19 56,-2.5 -92,-1.9 54,-0.2 2,-0.5 0.187 80.8 113.6-104.3 24.4 -40.0 15.9 2.3
370 370 E < - 0 0 2 -3,-1.1 5,-0.3 55,-0.2 -95,-0.2 -0.800 37.6-179.5 -97.3 122.0 -38.7 16.6 5.8
371 371 T S S+ 0 0 16 -97,-1.6 -96,-0.2 -2,-0.5 -1,-0.1 0.660 76.0 67.9 -85.6 -25.7 -40.4 19.4 7.7
372 372 T S S+ 0 0 28 1,-0.3 -97,-0.1 -98,-0.3 -1,-0.1 0.983 124.0 7.5 -60.9 -55.4 -38.3 19.1 10.8
373 373 S S S- 0 0 0 -170,-0.3 -1,-0.3 -171,-0.2 -3,-0.2 -0.759 93.6-149.6-126.5 81.5 -35.1 20.3 9.1
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375 375 D H > S+ 0 0 14 -5,-0.3 4,-2.1 -8,-0.3 5,-0.2 0.826 102.0 64.0 -64.6 -36.8 -34.0 21.2 2.7
376 376 C H > S+ 0 0 35 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.896 99.0 49.6 -64.0 -41.8 -34.6 24.8 1.8
377 377 Y H > S+ 0 0 31 1,-0.2 4,-3.2 -3,-0.2 -1,-0.2 0.964 112.5 47.0 -66.3 -40.1 -33.1 26.4 4.8
378 378 T H X S+ 0 0 0 -4,-1.2 4,-2.5 1,-0.2 -1,-0.2 0.880 111.4 53.1 -64.0 -32.9 -30.0 24.4 4.6
379 379 Y H X S+ 0 0 40 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.945 111.5 45.4 -62.7 -46.5 -29.9 25.3 0.9
380 380 R H X S+ 0 0 115 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.896 110.4 56.2 -63.3 -39.5 -30.2 28.9 1.8
381 381 Y H X S+ 0 0 2 -4,-3.2 4,-1.0 -5,-0.2 -1,-0.2 0.935 108.4 44.5 -62.1 -47.3 -27.6 28.5 4.4
382 382 L H X>S+ 0 0 0 -4,-2.5 4,-0.8 1,-0.2 5,-0.7 0.903 114.9 48.8 -66.4 -38.3 -24.9 27.1 2.1
383 383 L H ><5S+ 0 0 59 -4,-2.1 3,-1.7 1,-0.2 -2,-0.2 0.951 107.4 54.3 -64.8 -44.8 -25.6 29.7 -0.5
384 384 S H 3<5S+ 0 0 50 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.720 95.2 70.0 -65.0 -17.2 -25.5 32.5 1.9
385 385 I H 3<5S- 0 0 12 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.928 84.2-155.5 -63.0 -37.4 -22.1 31.3 3.0
386 386 Y T <<5 - 0 0 184 -3,-1.7 -3,-0.1 -4,-0.8 -2,-0.1 0.961 23.5-178.7 54.0 49.3 -20.7 32.4 -0.3
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