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 .
540 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
35439.4 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
219 40.6 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 .
84 15.6 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 .
1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES .
3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES .
5 0.9 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 .
71 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
19 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
10 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES .
4 0.7 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 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 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 .
4 5 2 2 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 ANTIPARALLEL BRIDGES PER LADDER .
3 0 0 0 0 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 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 E 0 0 227 0, 0.0 2,-0.3 0, 0.0 42,-0.0 0.000 360.0 360.0 360.0 174.1 19.4 18.9 -8.8
2 2 K + 0 0 55 44,-0.0 2,-0.3 535,-0.0 46,-0.1 -0.991 360.0 163.8-167.5 156.8 20.3 20.6 -5.7
3 3 E - 0 0 115 -2,-0.3 533,-0.6 533,-0.1 2,-0.3 -0.916 9.4-172.6-169.4 153.1 22.3 23.3 -4.0
4 4 D - 0 0 26 -2,-0.3 10,-0.1 531,-0.2 12,-0.1 -0.875 5.0-173.1-159.8 126.9 22.2 25.1 -0.6
5 5 Y - 0 0 157 -2,-0.3 2,-0.1 526,-0.1 530,-0.1 -0.979 15.0-156.1-121.8 121.0 24.1 28.0 0.8
6 6 P - 0 0 32 0, 0.0 3,-0.1 0, 0.0 2,-0.1 -0.436 14.6-120.9 -88.1 170.3 23.7 28.9 4.4
7 7 G S S- 0 0 18 1,-0.2 2,-0.4 -2,-0.1 499,-0.2 -0.074 76.3 -29.9 -88.9-163.4 24.2 32.3 6.1
8 8 E B S-a 506 0A 50 497,-0.7 499,-0.7 1,-0.2 -1,-0.2 -0.361 75.5-170.9 -57.9 109.6 26.7 32.7 9.0
9 9 W - 0 0 76 -2,-0.4 498,-0.3 497,-0.2 -1,-0.2 0.990 24.5-175.0 -69.0 -68.6 26.3 29.2 10.3
10 10 K S S+ 0 0 5 431,-0.1 61,-1.2 2,-0.1 62,-0.7 0.340 93.5 9.5 68.0 -0.7 28.1 28.8 13.6
11 11 H S S+ 0 0 7 59,-0.2 429,-2.4 60,-0.1 2,-0.3 -0.176 84.4 127.8 160.6 107.0 26.9 25.3 12.9
12 12 S E -B 439 0B 22 427,-0.3 2,-0.3 -2,-0.1 427,-0.3 -0.932 22.8-177.6-161.4 146.5 25.4 23.9 9.7
13 13 K E +B 438 0B 57 425,-2.2 425,-1.1 -2,-0.3 2,-0.2 -0.891 11.7 177.1-157.6 120.5 26.4 20.9 7.6
14 14 S - 0 0 33 -2,-0.3 3,-0.1 423,-0.2 35,-0.1 -0.303 42.0-120.0 -95.1-171.2 25.0 19.6 4.4
15 15 E S S+ 0 0 11 33,-1.2 3,-0.3 35,-0.3 36,-0.0 -0.110 70.5 129.6-125.7 50.0 27.0 16.7 3.3
16 16 G S S+ 0 0 14 1,-0.3 32,-0.1 2,-0.1 -1,-0.1 0.867 71.6 55.0 -64.5 -39.6 28.0 18.2 0.1
17 17 H S S- 0 0 96 -3,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.830 101.2-140.6 -64.0 -28.4 31.6 17.4 0.7
18 18 D + 0 0 62 1,-0.4 2,-0.2 -3,-0.3 16,-0.2 0.673 65.4 114.1 73.4 18.8 30.4 13.8 1.1
19 19 D S S- 0 0 88 14,-0.1 2,-0.7 33,-0.0 -1,-0.4 -0.709 73.3-113.4-112.6 167.2 32.8 13.5 3.9
20 20 Y - 0 0 111 -2,-0.2 -5,-0.1 1,-0.1 14,-0.0 -0.913 24.5-176.9-109.7 113.0 32.1 12.9 7.5
21 21 G + 0 0 29 -2,-0.7 -1,-0.1 2,-0.1 -6,-0.0 0.661 55.4 103.9 -70.7 -25.1 33.1 15.9 9.7
22 22 L S S- 0 0 16 46,-0.1 2,-0.5 -3,-0.1 46,-0.2 -0.128 71.0-125.8 -68.6 160.6 32.0 14.0 12.8
23 23 L - 0 0 44 44,-2.4 43,-0.2 90,-0.0 -1,-0.1 -0.935 24.4-126.9-108.9 123.2 34.2 12.3 15.3
24 24 V - 0 0 58 -2,-0.5 41,-0.1 42,-0.2 40,-0.1 -0.389 28.7-111.0 -69.2 143.5 33.5 8.7 16.0
25 25 S - 0 0 10 39,-0.1 90,-0.2 1,-0.1 89,-0.1 -0.144 16.2-151.8 -64.7 166.6 33.0 7.8 19.6
26 26 D S S+ 0 0 100 88,-0.5 89,-0.2 87,-0.2 -1,-0.1 0.379 81.2 82.4-122.5 -6.0 35.6 5.7 21.3
27 27 K S S- 0 0 65 89,-0.3 2,-0.1 87,-0.2 90,-0.1 0.998 104.1 -97.4 -61.6 -59.8 33.5 4.0 23.8
28 28 A + 0 0 35 36,-0.4 2,-0.3 33,-0.1 -1,-0.1 -0.493 62.8 77.3 153.3 144.4 32.4 1.4 21.1
29 29 R + 0 0 119 -2,-0.1 33,-0.2 -4,-0.1 34,-0.2 -0.960 57.7 13.1 151.3-156.6 29.6 0.4 18.5
30 30 K - 0 0 11 32,-1.5 2,-0.2 -2,-0.3 26,-0.1 0.133 58.0-131.7 -50.3 164.6 27.7 0.7 15.1
31 31 Y E -C 55 0B 142 24,-0.7 24,-1.0 34,-0.1 2,-0.3 -0.652 12.0-145.9-124.0 173.1 29.1 2.6 12.1
32 32 A E -C 54 0B 19 -2,-0.2 2,-0.3 22,-0.2 22,-0.2 -0.965 8.2-170.2-142.8 158.0 27.8 5.3 9.7
33 33 I E -C 53 0B 75 20,-1.8 20,-2.7 -2,-0.3 2,-0.6 -0.950 22.1-131.7-141.6 159.3 28.3 6.3 6.1
34 34 V E +C 52 0B 17 -2,-0.3 18,-0.2 18,-0.2 2,-0.2 -0.807 48.3 138.8-118.3 98.0 27.2 9.3 4.0
35 35 K E -C 51 0B 119 16,-0.7 16,-1.7 -2,-0.6 -17,-0.1 -0.501 64.1 -41.6-121.3-171.5 25.6 8.1 0.8
36 36 E E S-C 50 0B 68 14,-0.2 2,-0.7 -2,-0.2 -1,-0.2 -0.271 70.2-119.8 -54.0 137.8 22.6 9.2 -1.3
37 37 L S S+ 0 0 10 12,-1.1 5,-0.4 6,-0.2 6,-0.3 -0.788 72.8 31.9-100.1 116.8 19.9 9.8 1.2
38 38 E S S- 0 0 33 -2,-0.7 3,-0.2 3,-0.1 53,-0.1 -0.822 87.5 -88.7 141.7-172.3 16.8 7.7 0.9
39 39 K S S+ 0 0 119 1,-0.5 2,-0.4 -2,-0.3 52,-0.0 0.651 119.5 23.9 -98.1 -97.7 16.1 4.2 -0.1
40 40 P S S- 0 0 111 0, 0.0 -1,-0.5 0, 0.0 2,-0.2 -0.591 107.1-117.2 -65.9 129.3 15.5 4.6 -3.9
41 41 V - 0 0 56 -2,-0.4 3,-0.3 -3,-0.2 -3,-0.1 -0.394 26.6-166.8 -75.8 129.4 17.5 7.8 -4.4
42 42 E S S+ 0 0 151 -5,-0.4 2,-0.7 1,-0.3 -1,-0.2 0.917 89.9 37.4 -72.9 -45.2 15.6 10.8 -5.6
43 43 L - 0 0 20 -6,-0.3 -1,-0.3 1,-0.2 3,-0.2 -0.850 65.6-177.9-113.3 102.6 18.9 12.5 -6.4
44 44 K S S+ 0 0 162 -2,-0.7 3,-0.2 -3,-0.3 -1,-0.2 0.874 84.1 61.9 -64.7 -35.7 21.4 10.1 -7.8
45 45 D S S+ 0 0 102 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.928 76.4 162.6 -58.9 -41.3 24.0 12.8 -8.0
46 46 G > + 0 0 0 -3,-0.2 3,-2.1 1,-0.1 2,-0.9 -0.454 19.6 126.3 63.1-119.9 23.7 13.1 -4.2
47 47 T G > S+ 0 0 43 -2,-0.4 3,-0.5 1,-0.3 -29,-0.2 -0.525 91.9 19.3 70.2-107.6 26.8 14.9 -3.2
48 48 I G 3 S+ 0 0 28 -2,-0.9 2,-2.0 1,-0.3 -33,-1.2 0.930 126.1 59.6 -62.0 -40.4 25.2 17.7 -1.3
49 49 V G < S+ 0 0 4 -3,-2.1 -12,-1.1 -35,-0.1 -1,-0.3 -0.376 86.6 97.5 -91.5 67.4 22.1 15.6 -1.0
50 50 L E < -C 36 0B 7 -2,-2.0 2,-0.3 -3,-0.5 -35,-0.3 -0.838 54.7-173.5-133.7 165.6 23.9 12.9 0.8
51 51 G E -C 35 0B 1 -16,-1.7 -16,-0.7 -2,-0.3 2,-0.3 -0.997 35.4 -78.0-162.0 165.6 23.9 12.6 4.5
52 52 I E -C 34 0B 14 -2,-0.3 383,-1.9 383,-0.2 2,-0.4 -0.533 51.8-169.9 -69.6 128.6 25.1 10.8 7.5
53 53 L E -CD 33 434B 24 -20,-2.7 -20,-1.8 -2,-0.3 381,-0.2 -0.978 16.3-139.7-124.8 132.2 23.2 7.6 7.7
54 54 L E -C 32 0B 0 379,-1.6 378,-0.9 -2,-0.4 -22,-0.2 -0.490 23.2-177.6 -80.7 161.9 23.2 5.2 10.6
55 55 G E +C 31 0B 33 -24,-1.0 -24,-0.7 376,-0.2 2,-0.3 -0.567 40.3 35.8-167.4 104.2 23.3 1.6 9.6
56 56 S - 0 0 55 -2,-0.2 7,-0.1 -26,-0.1 -2,-0.0 -0.888 60.7-124.5 150.1-174.2 23.2 -1.4 12.0
57 57 R + 0 0 124 -2,-0.3 3,-0.1 5,-0.1 371,-0.1 -0.242 40.3 180.0-154.2 64.8 21.5 -2.3 15.2
58 58 S > - 0 0 10 1,-0.1 4,-0.7 369,-0.1 5,-0.2 -0.308 33.6-101.2 -82.0 151.5 24.3 -3.2 17.4
59 59 L T 4 S+ 0 0 130 2,-0.1 -29,-0.1 3,-0.1 -1,-0.1 -0.260 96.1 25.7 -63.4 152.7 23.9 -4.3 21.0
60 60 R T 4 S- 0 0 146 1,-0.1 2,-1.8 -3,-0.1 3,-0.2 -0.277 138.4 -25.4 78.7-176.5 24.7 -1.6 23.5
61 61 W T 4 S- 0 0 63 1,-0.2 -2,-0.1 -33,-0.1 366,-0.1 -0.545 76.8-175.8 -70.6 97.2 24.3 1.9 22.2
62 62 K S < S+ 0 0 20 -2,-1.8 -32,-1.5 -4,-0.7 -1,-0.2 0.957 81.5 34.5 -59.3 -57.1 24.8 0.8 18.7
63 63 K S S+ 0 0 3 363,-1.1 -1,-0.3 364,-0.5 364,-0.2 0.672 84.3 135.2 -71.5 -19.3 24.7 4.2 17.1
64 64 R + 0 0 11 362,-0.3 -36,-0.4 361,-0.2 2,-0.3 -0.023 53.8 63.7 -37.0 92.6 26.3 5.6 20.2
65 65 N E +I 424 0C 15 359,-1.4 359,-0.8 1,-0.2 -41,-0.2 -0.976 49.6 82.5 172.6-175.0 28.8 7.8 18.4
66 66 R E + 0 0C 27 -2,-0.3 358,-1.8 -43,-0.2 2,-0.3 0.662 36.9 153.8 58.2 142.3 29.4 10.7 16.1
67 67 R E -I 423 0C 5 356,-0.3 -44,-2.4 -42,-0.0 2,-0.3 -0.934 24.0-145.3 178.6 164.7 29.5 14.3 17.1
68 68 L E -I 422 0C 19 354,-1.9 354,-1.7 -2,-0.3 2,-0.2 -0.992 21.2-113.8-150.2 147.5 31.1 17.5 15.8
69 69 K E -I 421 0C 104 -2,-0.3 352,-0.2 352,-0.2 -2,-0.0 -0.571 38.2-118.8 -78.3 145.4 32.5 20.6 17.4
70 70 K E - 0 0C 12 350,-3.2 -59,-0.2 -2,-0.2 -1,-0.1 -0.208 20.0-114.8 -74.2 168.8 30.5 23.7 16.7
71 71 N E S- 0 0C 67 -61,-1.2 -60,-0.1 1,-0.4 -1,-0.1 0.945 98.6 -3.2 -67.0 -49.6 32.1 26.6 14.9
72 72 Q E S- 0 0C 73 -62,-0.7 -1,-0.4 370,-0.1 370,-0.2 -0.994 91.9 -88.7-144.1 148.3 31.8 28.7 17.9
73 73 P E - 0 0C 50 0, 0.0 2,-0.7 0, 0.0 347,-0.2 -0.220 40.0-129.0 -59.6 140.8 30.3 28.1 21.2
74 74 L E -I 419 0C 5 345,-2.0 345,-1.0 367,-0.1 2,-0.3 -0.847 22.7-166.2 -98.9 118.2 26.7 28.9 21.4
75 75 L - 0 0 45 -2,-0.7 2,-0.3 343,-0.2 342,-0.1 -0.748 16.6-131.5 -98.6 148.1 25.8 31.2 24.3
76 76 D + 0 0 12 340,-0.5 2,-1.0 -2,-0.3 3,-0.1 -0.756 67.5 9.5-108.3 153.7 22.2 31.6 25.2
77 77 G S S+ 0 0 1 2,-0.5 338,-0.1 -2,-0.3 110,-0.0 -0.793 127.9 36.9 94.7-101.0 20.2 34.7 25.9
78 78 L S S+ 0 0 42 -2,-1.0 2,-1.2 1,-0.1 -1,-0.2 0.901 106.3 78.9 -55.3 -40.4 22.3 37.7 25.0
79 79 K S S- 0 0 30 -3,-0.1 -2,-0.5 422,-0.1 -1,-0.1 -0.604 112.7 -85.6 -78.7 99.7 23.6 35.7 22.1
80 80 G S S- 0 0 19 -2,-1.2 2,-0.3 420,-0.4 -3,-0.2 0.068 71.8 -59.3 44.3-139.3 20.9 35.8 19.5
81 81 I - 0 0 33 360,-0.2 2,-0.5 -5,-0.1 427,-0.2 -0.911 53.5-100.2-134.5 158.5 18.2 33.2 19.9
82 82 Q E +E 183 0B 6 101,-1.4 101,-1.6 -2,-0.3 2,-0.3 -0.711 46.2 163.1 -87.0 126.7 18.5 29.5 19.9
83 83 K E +EF 182 441B 6 358,-0.5 358,-0.9 -2,-0.5 2,-0.4 -0.918 3.4 165.9-145.2 119.2 17.6 27.8 16.7
84 84 A E +EF 181 440B 11 97,-1.9 97,-2.7 -2,-0.3 2,-0.3 -0.976 6.7 162.8-129.9 141.6 18.5 24.3 15.8
85 85 V E +EF 180 439B 8 354,-1.4 354,-2.0 -2,-0.4 2,-0.3 -0.911 7.6 135.0-160.5 132.6 17.1 22.2 13.0
86 86 F E -E 179 0B 5 93,-1.5 93,-1.9 -2,-0.3 2,-0.4 -0.928 34.0-123.1-155.8 176.2 17.9 19.2 11.1
87 87 D E -EF 178 436B 0 349,-1.7 349,-1.2 -2,-0.3 2,-0.3 -0.968 14.0-164.5-147.2 174.8 16.1 16.2 9.9
88 88 V E -EF 177 435B 1 89,-1.1 89,-1.9 -2,-0.4 347,-0.2 -0.807 4.8-169.7-132.3 158.2 15.6 12.5 9.8
89 89 L E - F 0 434B 5 345,-0.8 345,-1.0 -2,-0.3 2,-0.7 -0.669 20.5-145.1-152.7 102.9 13.8 10.0 7.8
90 90 Y E - F 0 433B 2 343,-0.2 84,-0.3 -2,-0.2 343,-0.2 -0.607 40.0-142.6 -68.2 117.2 13.8 6.5 9.1
91 91 K > - 0 0 30 341,-1.3 3,-1.1 -2,-0.7 83,-0.2 0.615 46.9 -42.8 -66.7-143.3 13.8 5.1 5.6
92 92 I T 3 S+ 0 0 83 1,-0.3 -1,-0.1 82,-0.1 -2,-0.1 0.860 140.7 62.3 -55.6 -31.1 12.1 2.1 4.2
93 93 A T 3 S+ 0 0 8 339,-0.1 -1,-0.3 338,-0.1 -2,-0.1 0.915 84.6 173.9 -59.2 -43.6 13.2 0.6 7.4
94 94 D < - 0 0 26 -3,-1.1 3,-0.3 1,-0.2 -3,-0.2 0.209 47.9 -88.5 49.2 171.1 11.1 3.1 9.4
95 95 L + 0 0 4 76,-0.8 -1,-0.2 -5,-0.2 4,-0.2 -0.505 63.9 149.3-113.5 73.6 11.1 2.5 13.1
96 96 P S S+ 0 0 67 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.723 77.3 52.4 -64.9 -20.3 8.2 0.2 13.5
97 97 F S S- 0 0 97 -3,-0.3 2,-0.4 1,-0.1 -2,-0.1 0.197 113.1 -71.1 -93.9-149.5 10.4 -0.9 16.3
98 98 L + 0 0 50 33,-0.1 33,-0.3 35,-0.1 2,-0.3 -0.942 66.7 128.0-113.7 139.4 11.8 1.3 19.0
99 99 G E -J 130 0C 8 31,-1.3 31,-3.0 -2,-0.4 2,-0.4 -0.969 41.8-128.0-173.5 171.9 14.6 3.8 18.4
100 100 D E +J 129 0C 24 -2,-0.3 29,-0.2 29,-0.2 28,-0.1 -0.994 16.2 176.9-137.8 138.9 15.7 7.4 18.7
101 101 H + 0 0 0 27,-2.4 27,-0.4 -2,-0.4 2,-0.2 -0.329 40.9 136.0-135.2 50.9 17.0 9.8 16.2
102 102 K - 0 0 25 25,-0.3 2,-0.3 323,-0.1 25,-0.3 -0.526 49.9-124.4 -95.9 161.5 17.2 12.8 18.5
103 103 V E -K 126 0C 4 23,-3.2 23,-2.1 -2,-0.2 2,-0.4 -0.774 15.1-146.4-108.5 154.5 20.2 15.2 18.6
104 104 K E -KL 125 423C 28 319,-2.8 319,-3.1 -2,-0.3 2,-1.1 -0.986 5.8-146.2-123.0 134.2 22.2 16.1 21.7
105 105 V E -KL 124 422C 5 19,-2.8 18,-2.5 -2,-0.4 19,-0.7 -0.742 22.9-144.2 -98.5 92.8 23.7 19.4 22.3
106 106 L E -KL 122 421C 4 315,-1.2 315,-1.8 -2,-1.1 314,-1.5 -0.333 20.4-119.0 -65.2 133.0 26.9 18.6 24.1
107 107 E E - L 0 419C 56 14,-1.4 312,-0.3 312,-0.3 2,-0.3 -0.122 32.6 -91.3 -68.8 161.4 27.7 21.2 26.7
108 108 L S S+ 0 0 72 310,-3.1 2,-0.3 312,-0.1 -1,-0.1 -0.616 71.6 116.3 -77.9 134.0 30.8 23.3 26.7
109 109 I S S- 0 0 102 -2,-0.3 -3,-0.0 2,-0.1 310,-0.0 -0.914 86.0 -73.8-171.6-173.2 33.7 21.8 28.6
110 110 E S S+ 0 0 180 -2,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.843 76.5 173.8 -62.6 -31.0 37.2 20.5 27.9
111 111 K - 0 0 61 1,-0.2 2,-0.9 2,-0.1 3,-0.1 0.796 34.5-139.0 19.2 111.1 35.1 17.6 26.5
112 112 A > - 0 0 74 1,-0.2 3,-0.7 3,-0.1 -1,-0.2 -0.805 14.5-165.0 -87.0 113.1 37.0 14.9 24.7
113 113 E T 3 S+ 0 0 13 -2,-0.9 -87,-0.2 1,-0.2 -1,-0.2 0.947 79.9 70.1 -63.4 -42.6 34.7 14.3 21.8
114 114 T T 3 S+ 0 0 75 1,-0.3 -88,-0.5 -89,-0.1 -87,-0.2 0.725 101.5 44.2 -53.9 -33.1 36.5 11.1 21.0
115 115 Q S < S+ 0 0 70 -3,-0.7 2,-0.9 -90,-0.2 -1,-0.3 -0.305 74.8 174.4-107.3 54.5 35.1 9.4 24.1
116 116 P - 0 0 7 0, 0.0 -89,-0.3 0, 0.0 -3,-0.1 -0.429 20.8-164.4 -59.7 104.9 31.6 10.6 23.8
117 117 N - 0 0 42 -2,-0.9 -52,-0.0 1,-0.1 -2,-0.0 -0.182 30.7-112.0 -86.5 174.4 30.3 8.6 26.7
118 118 I S S+ 0 0 71 1,-0.2 -1,-0.1 -54,-0.1 307,-0.1 0.879 117.5 51.7 -68.5 -42.9 26.7 7.9 27.5
119 119 T S S+ 0 0 106 2,-0.1 -1,-0.2 0, 0.0 3,-0.1 0.779 78.3 137.7 -66.6 -31.8 26.8 10.1 30.6
120 120 I - 0 0 37 1,-0.1 2,-0.2 -14,-0.0 0, 0.0 0.284 58.5-116.1 -27.6 125.2 28.3 13.1 28.8
121 121 G + 0 0 46 -15,-0.1 -14,-1.4 -14,-0.0 2,-0.3 -0.455 38.3 177.7 -73.3 139.7 26.6 16.3 29.9
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523 523 K + 0 0 123 -2,-0.2 -1,-0.1 2,-0.0 -2,-0.0 0.845 54.5 108.2 -70.7 -33.7 6.2 34.0 -1.4
524 524 W + 0 0 145 1,-0.0 2,-0.3 10,-0.0 -2,-0.0 -0.060 40.6 143.8 -53.5 142.2 6.4 30.5 0.0
525 525 H - 0 0 69 -12,-0.0 6,-0.1 8,-0.0 5,-0.1 -0.932 51.1 -99.6-162.1 176.8 9.4 29.8 2.3
526 526 A - 0 0 0 4,-0.4 8,-0.3 -2,-0.3 7,-0.2 -0.945 29.6-144.6-109.9 133.2 10.3 27.9 5.4
527 527 P S S+ 0 0 59 0, 0.0 3,-0.5 0, 0.0 -15,-0.5 0.781 79.9 65.6 -71.1 -28.8 10.3 29.9 8.5
528 528 L S S- 0 0 16 1,-0.4 2,-0.5 2,-0.1 3,-0.1 0.980 132.6 -10.7 -63.8 -68.5 13.1 28.6 10.7
529 529 I S > S- 0 0 3 1,-0.2 4,-3.6 -18,-0.1 5,-0.4 -0.950 82.6-162.9-125.3 99.8 16.1 29.5 8.7
530 530 D H > S+ 0 0 13 -20,-0.8 4,-3.3 -2,-0.5 -4,-0.4 0.945 82.3 43.2 -61.0 -47.3 14.2 30.4 5.7
531 531 N H > S+ 0 0 57 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.984 119.4 39.8 -66.0 -52.1 17.0 30.2 3.4
532 532 P H 4 S+ 0 0 8 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.865 119.6 47.5 -67.0 -31.6 18.6 27.1 4.7
533 533 A H < S+ 0 0 9 -4,-3.6 6,-1.1 -7,-0.2 -2,-0.2 0.911 111.4 50.5 -68.0 -43.6 15.3 25.4 5.2
534 534 Y H < S+ 0 0 75 -4,-3.3 5,-0.3 -5,-0.4 4,-0.3 0.944 122.5 35.0 -61.8 -44.9 14.1 26.5 1.8
535 535 K S < S+ 0 0 58 -4,-3.1 4,-0.4 -5,-0.3 -531,-0.2 -0.098 97.2 65.7 -88.1-166.0 17.3 25.1 0.4
536 536 G S S- 0 0 10 -533,-0.6 2,-2.7 1,-0.2 -533,-0.1 -0.116 115.1 -43.6 82.9 176.5 18.8 22.0 1.9
537 537 I S S+ 0 0 20 -489,-0.1 -1,-0.2 1,-0.1 -2,-0.1 -0.521 121.5 82.0 -84.3 77.7 17.3 18.6 1.8
538 538 W S S+ 0 0 58 -2,-2.7 -4,-0.1 -4,-0.3 -2,-0.1 0.112 102.1 7.6-136.4 -99.8 14.0 20.2 2.7
539 539 K 0 0 61 -6,-1.1 -4,-0.1 -4,-0.4 -5,-0.1 0.929 360.0 360.0 -61.4 -41.6 11.9 21.7 -0.0
540 540 P 0 0 66 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.527 360.0 360.0 -81.6 360.0 14.2 20.4 -2.6