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 .
255 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) .
12285.4 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) .
137 53.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES .
19 7.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES .
52 20.4 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 .
3 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES .
2 0.8 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 .
33 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES .
12 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES .
10 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES .
3 1.2 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 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 RESIDUES PER ALPHA HELIX .
1 0 0 1 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 PARALLEL BRIDGES PER LADDER .
2 0 3 3 2 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 ANTIPARALLEL BRIDGES PER LADDER .
1 0 2 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 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 95 0, 0.0 235,-0.1 0, 0.0 237,-0.1 0.000 360.0 360.0 360.0-179.1 -2.5 -10.5 8.1
2 2 R + 0 0 51 16,-0.1 2,-0.3 235,-0.1 18,-0.1 0.027 360.0 136.3-122.5 28.8 -1.9 -7.1 6.3
3 3 N - 0 0 128 16,-0.3 15,-0.0 1,-0.1 0, 0.0 -0.730 56.1-139.5 -59.6 135.8 -4.5 -6.4 3.8
4 4 W + 0 0 115 -2,-0.3 2,-0.6 16,-0.1 16,-0.2 0.048 43.7 153.6-103.9 24.7 -4.8 -2.9 5.0
5 5 G - 0 0 32 14,-0.2 16,-2.4 1,-0.1 2,-0.9 -0.367 22.0-172.6 -54.0 108.1 -8.6 -2.3 4.8
6 6 A E +a 21 0A 17 -2,-0.6 2,-0.6 14,-0.2 16,-0.2 -0.870 16.9 171.4-108.7 99.5 -9.0 0.3 7.4
7 7 N E -a 22 0A 85 14,-2.6 16,-0.9 -2,-0.9 2,-0.5 -0.960 32.5-150.6-119.4 109.6 -12.6 0.8 7.9
8 8 W E +a 23 0A 86 -2,-0.6 2,-0.4 14,-0.1 16,-0.2 -0.351 63.6 85.3-123.7 27.8 -12.0 3.0 10.9
9 9 Q E S-a 24 0A 48 14,-1.8 16,-3.3 -2,-0.5 18,-0.2 -0.852 86.6-115.9-137.6 102.3 -14.4 3.3 13.7
10 10 C E S+a 27 0A 1 16,-1.0 18,-1.3 -2,-0.4 19,-0.1 -0.271 73.7 107.6 -99.4 118.4 -13.3 0.4 15.7
11 11 N + 0 0 86 16,-0.2 -1,-0.2 -2,-0.2 13,-0.1 0.379 60.9 95.1-128.9 -30.6 -15.0 -2.8 16.6
12 12 S S S- 0 0 29 -5,-0.2 2,-0.1 11,-0.2 9,-0.1 -0.222 73.8 -98.1 -81.6 175.8 -13.3 -5.1 14.5
13 13 A + 0 0 57 -3,-0.1 2,-0.2 6,-0.0 -1,-0.1 -0.228 34.3 164.6-103.7 156.1 -10.3 -7.1 15.8
14 14 L + 0 0 15 5,-0.1 3,-0.1 -2,-0.1 55,-0.1 -0.852 14.5 160.6-169.4 168.5 -6.6 -7.5 16.2
15 15 V S S+ 0 0 94 1,-0.8 2,-0.3 -2,-0.2 55,-0.0 0.591 85.5 26.0-143.8 -64.5 -3.8 -9.4 18.1
16 16 G S S- 0 0 42 54,-0.1 -1,-0.8 58,-0.1 3,-0.3 -0.920 101.2-115.5 -96.8 164.1 -0.6 -9.3 16.0
17 17 Q S S+ 0 0 18 -2,-0.3 52,-0.1 1,-0.2 53,-0.1 -0.139 85.1 66.8-140.7-176.8 -0.7 -6.4 13.8
18 18 A S S+ 0 0 7 51,-0.2 -1,-0.2 57,-0.1 134,-0.1 -0.521 74.8 139.9 75.4 -44.6 -0.8 -4.8 10.5
19 19 L - 0 0 42 -3,-0.3 -16,-0.3 217,-0.0 -14,-0.2 0.202 44.6-150.3 -38.1 -49.0 -4.1 -6.5 10.7
20 20 S - 0 0 18 -16,-0.2 2,-0.3 -18,-0.1 -14,-0.2 -0.432 10.1-138.7 84.7 171.6 -6.6 -4.2 9.2
21 21 F E -a 6 0A 2 -16,-2.4 -14,-2.6 -2,-0.2 -7,-0.0 -0.876 6.6-143.1-174.3 161.8 -10.2 -4.2 10.4
22 22 R E +a 7 0A 204 -2,-0.3 2,-0.3 -16,-0.2 -14,-0.1 0.236 57.5 93.4-104.1 1.2 -13.6 -4.1 8.8
23 23 V E -a 8 0A 40 -16,-0.9 -14,-1.8 2,-0.1 2,-0.5 -0.769 45.4-157.8-148.4 142.8 -16.0 -2.1 10.9
24 24 T E +a 9 0A 91 -2,-0.3 2,-0.2 -16,-0.2 -14,-0.2 -0.783 49.1 108.7-139.3 88.2 -17.5 1.3 11.4
25 25 S E S- 0 0A 64 -16,-3.3 -2,-0.1 -2,-0.5 -16,-0.0 -0.773 78.6-111.1-161.8 122.8 -19.0 2.1 14.8
26 26 T E - 0 0A 42 -2,-0.2 -16,-1.0 1,-0.2 124,-0.2 0.547 67.2-178.7 -59.9 -44.8 -16.9 4.5 16.5
27 27 G E -a 10 0A 28 -18,-0.2 2,-0.3 1,-0.1 -16,-0.2 -0.195 23.9 -42.3 120.2-168.7 -15.9 1.9 19.2
28 28 G + 0 0 21 -18,-1.3 2,-0.6 -2,-0.1 97,-0.3 -0.212 69.7 120.4-104.2 35.4 -14.2 0.4 22.2
29 29 Q - 0 0 0 118,-0.4 98,-0.2 -2,-0.3 2,-0.2 -0.927 44.9-162.7-118.3 119.6 -10.7 1.7 22.2
30 30 T E -b 127 0B 41 96,-2.4 98,-1.7 -2,-0.6 2,-0.3 -0.520 10.4-166.7-126.8 165.2 -9.8 3.6 25.4
31 31 L E +b 128 0B 7 96,-0.2 2,-0.2 115,-0.2 98,-0.2 -0.824 24.3 172.0-155.2 151.4 -7.1 6.0 26.5
32 32 Q E -b 129 0B 26 96,-1.2 98,-2.9 -2,-0.3 2,-0.3 -0.923 28.3 -97.8-164.0-152.3 -4.7 8.4 28.2
33 33 I E -b 130 0B 48 96,-0.3 2,-0.3 -2,-0.2 98,-0.2 -0.937 24.9-176.2-144.1 117.3 -1.7 10.7 28.3
34 34 N E +b 131 0B 37 96,-1.7 98,-1.9 -2,-0.3 7,-0.5 -0.998 48.4 8.8-136.4 148.0 2.1 10.3 29.4
35 35 S S S- 0 0 37 -2,-0.3 6,-0.5 96,-0.2 4,-0.4 0.989 97.7 -29.6 51.9 85.7 5.2 12.6 29.8
36 36 V > - 0 0 70 96,-0.1 3,-1.3 2,-0.1 5,-0.3 0.782 58.7-100.3 84.9 129.6 5.1 16.4 29.6
37 37 V T 3 S+ 0 0 94 1,-0.3 99,-0.1 95,-0.1 -1,-0.1 0.888 119.6 27.5 -52.7 -43.9 3.0 18.9 27.7
38 38 P T 3 S+ 0 0 76 0, 0.0 2,-0.4 0, 0.0 -1,-0.3 0.203 104.7 89.5-110.6 24.5 5.6 19.4 25.0
39 39 E S < S- 0 0 91 -3,-1.3 2,-2.1 -4,-0.4 93,-0.2 -0.938 76.9-111.5-123.0 146.1 7.6 16.2 24.8
40 40 W > - 0 0 0 -2,-0.4 3,-0.7 92,-0.1 -5,-0.1 -0.690 57.3-105.0 -66.1 87.3 7.5 12.9 23.0
41 41 W T 3 S- 0 0 10 -2,-2.1 -1,-0.1 -6,-0.5 -6,-0.1 0.353 92.4 -3.0 60.1-140.2 6.7 10.8 25.7
42 42 E T 3 S- 0 0 57 1,-0.1 -1,-0.2 -3,-0.0 -7,-0.1 0.639 73.9-155.5 -88.5 -7.3 9.6 8.7 27.0
43 43 F S < S+ 0 0 115 -3,-0.7 2,-0.2 -8,-0.1 -2,-0.1 0.828 85.2 55.5 51.4 44.3 11.8 9.9 24.4
44 44 G S S- 0 0 37 7,-0.0 2,-0.3 -4,-0.0 5,-0.1 -0.325 91.0-152.2 135.9 100.2 13.7 6.8 24.9
45 45 T B > -G 48 0C 18 3,-1.1 3,-2.1 -2,-0.2 60,-0.1 -0.783 28.8-118.3-128.7 155.4 11.4 3.8 24.4
46 46 T T 3 S+ 0 0 38 1,-0.3 59,-0.1 -2,-0.3 -1,-0.1 0.675 114.8 55.9 -62.2 -22.1 10.8 0.3 25.5
47 47 F T 3 S- 0 0 6 57,-1.1 169,-1.6 168,-0.1 2,-1.0 0.125 116.4-114.6 -92.9 15.9 11.1 -0.9 21.9
48 48 T B < +G 45 0C 27 -3,-2.1 -3,-1.1 167,-0.2 -1,-0.1 -0.709 51.6 163.1 78.8 -76.9 14.5 0.7 21.7
49 49 S - 0 0 10 -2,-1.0 2,-0.2 130,-0.2 167,-0.1 -0.342 20.2-160.4 64.8-164.8 14.3 3.6 19.1
50 50 N - 0 0 93 1,-0.3 2,-0.1 -2,-0.0 3,-0.1 -0.713 41.9 -19.5-147.7-100.4 17.1 5.9 19.4
51 51 G S S+ 0 0 51 -2,-0.2 -1,-0.3 1,-0.1 3,-0.1 -0.257 95.8 70.7 -94.1-170.6 17.3 9.5 18.1
52 52 N S S+ 0 0 105 1,-0.2 3,-0.5 -2,-0.1 2,-0.5 0.710 74.7 128.5 59.0 38.5 15.2 11.4 15.4
53 53 L + 0 0 27 1,-0.3 -1,-0.2 2,-0.1 6,-0.1 -0.949 68.8 16.1-134.3 126.8 12.4 11.3 17.7
54 54 Y S S+ 0 0 106 4,-0.8 -1,-0.3 -2,-0.5 5,-0.2 0.769 129.5 66.1 53.6 27.5 10.5 14.4 18.7
55 55 T S S+ 0 0 70 3,-0.7 2,-0.3 -3,-0.5 -2,-0.1 0.132 93.1 8.1-117.8 -84.1 12.3 15.6 15.6
56 56 Q S S+ 0 0 131 2,-0.1 2,-0.9 3,-0.1 -1,-0.1 -0.816 110.6 1.6-126.9 135.9 11.9 14.5 12.0
57 57 G S S+ 0 0 40 -2,-0.3 2,-0.4 100,-0.1 -1,-0.1 -0.416 141.1 35.5 84.0 -57.0 9.5 12.3 9.8
58 58 Y S S- 0 0 7 -2,-0.9 -4,-0.8 -6,-0.4 2,-0.7 -0.951 81.9-176.8-111.8 106.5 7.7 11.7 13.0
59 59 G S S- 0 0 30 -2,-0.4 -3,-0.1 -5,-0.2 -6,-0.1 -0.834 74.2 -42.5-107.0 81.7 7.9 15.0 14.8
60 60 V S S+ 0 0 23 -2,-0.7 2,-2.0 1,-0.1 74,-0.4 0.292 100.5 124.7 73.9 0.4 6.1 14.2 18.1
61 61 Y + 0 0 86 72,-0.1 41,-2.0 73,-0.1 2,-0.3 -0.488 45.9 138.1 -86.4 67.5 3.3 12.2 16.6
62 62 N E +c 102 0B 0 -2,-2.0 69,-1.9 39,-0.2 72,-0.2 -0.913 28.1 177.9-128.2 150.1 4.1 9.2 18.8
63 63 A E -cD 103 130B 0 39,-2.4 41,-2.0 -2,-0.3 42,-1.3 -0.865 24.7-130.7-139.0 163.2 2.3 6.6 20.8
64 64 A E -cD 105 129B 3 65,-2.5 65,-2.9 -2,-0.2 42,-0.3 -0.937 28.3-167.8-107.3 144.6 2.0 3.5 23.0
65 65 L E -cD 106 128B 1 40,-1.7 42,-2.3 -2,-0.4 63,-0.2 -0.918 19.8-108.7-124.3 161.3 -0.3 0.5 22.5
66 66 S >> - 0 0 3 61,-1.4 4,-2.9 -2,-0.3 3,-0.6 -0.052 53.3 -83.2 -68.1 169.9 -1.8 -2.8 24.2
67 67 T T 34 S+ 0 0 63 1,-0.2 -1,-0.0 2,-0.2 -2,-0.0 0.831 128.0 52.3 -59.4 -32.0 -0.8 -6.4 23.2
68 68 A T 34 S+ 0 0 21 57,-0.2 -1,-0.2 1,-0.1 3,-0.2 0.910 117.3 34.8 -61.0 -42.4 -3.3 -6.4 20.4
69 69 L T <4 S+ 0 0 0 -3,-0.6 2,-0.4 1,-0.4 -2,-0.2 0.814 134.1 26.7 -93.4 -39.7 -2.2 -3.3 18.7
70 70 F S < S- 0 0 0 -4,-2.9 2,-1.0 -53,-0.1 -1,-0.4 -0.990 80.5-160.6-106.8 116.0 1.5 -3.8 19.5
71 71 N > - 0 0 52 -2,-0.4 3,-1.4 -3,-0.2 5,-0.1 -0.778 63.0 -51.4-104.9 93.3 2.2 -7.5 19.9
72 72 G T 3 S- 0 0 41 -2,-1.0 143,-0.3 1,-0.3 -1,-0.1 0.728 112.5 -45.3 58.4 33.2 5.3 -8.1 21.8
73 73 G T > S+ 0 0 4 141,-0.2 3,-1.2 143,-0.0 -1,-0.3 0.172 116.2 101.7 98.0 -14.6 7.6 -5.7 19.6
74 74 A T < S+ 0 0 11 -3,-1.4 162,-0.3 1,-0.3 -2,-0.1 0.843 78.5 52.9 -63.3 -37.6 6.4 -6.8 16.2
75 75 S T > S+ 0 0 0 112,-0.1 3,-1.8 2,-0.1 2,-0.3 0.166 76.8 130.1 -95.4 19.0 4.2 -3.9 15.6
76 76 C T < S+ 0 0 8 -3,-1.2 112,-0.6 139,-0.5 28,-0.2 -0.575 74.7 27.6 -69.5 133.6 7.0 -1.4 16.4
77 77 G T 3 S+ 0 0 4 26,-1.8 -1,-0.3 1,-0.3 2,-0.2 0.533 88.4 139.4 83.9 8.6 7.0 1.0 13.6
78 78 Q < - 0 0 7 -3,-1.8 25,-2.3 108,-0.2 2,-0.4 -0.530 43.0-142.3 -63.8 147.4 3.3 0.6 12.7
79 79 C E +EF 102 153B 1 74,-0.5 74,-2.4 106,-0.3 2,-0.4 -0.987 21.2 176.4-118.8 126.7 1.4 3.7 11.9
80 80 Y E -EF 101 152B 0 21,-2.8 21,-2.5 -2,-0.4 2,-0.4 -0.985 20.0-141.7-130.2 148.7 -2.1 4.3 13.0
81 81 L E +EF 100 151B 27 70,-2.9 70,-1.7 -2,-0.4 2,-0.3 -0.823 23.7 177.4-103.7 143.1 -4.3 7.3 12.5
82 82 I E +EF 99 150B 1 17,-1.8 17,-1.8 -2,-0.4 68,-0.3 -0.914 17.6 110.1-131.7 154.8 -6.7 8.4 15.3
83 83 M + 0 0 15 66,-2.4 2,-0.1 -2,-0.3 11,-0.1 0.029 27.8 177.6 130.2 141.6 -9.2 11.3 15.8
84 84 C B -h 94 0D 4 9,-0.9 12,-6.1 12,-0.2 11,-2.7 -0.295 37.8-118.8-144.9-173.2 -12.8 12.0 16.1
85 85 D S S- 0 0 108 10,-0.3 2,-0.2 9,-0.2 -1,-0.1 0.578 84.1 -45.3-121.9 -73.1 -16.1 14.0 16.6
86 86 A + 0 0 58 7,-0.1 3,-0.1 1,-0.1 -60,-0.1 -0.469 66.4 134.0-163.9 128.4 -17.6 12.3 19.5
87 87 S S S+ 0 0 33 1,-0.2 2,-0.2 -2,-0.2 -1,-0.1 0.611 100.5 35.4 -67.9 -38.9 -18.3 9.0 20.8
88 88 K S S- 0 0 89 1,-0.1 5,-0.2 -3,-0.0 -1,-0.2 -0.772 74.3-151.7-163.8 147.0 -17.0 10.8 23.7
89 89 T > + 0 0 90 -2,-0.2 3,-1.2 -3,-0.1 4,-0.4 0.966 44.4 109.2-115.3 -92.6 -16.7 14.0 25.5
90 90 P T 3 S- 0 0 37 0, 0.0 53,-0.5 0, 0.0 52,-0.2 0.318 96.7 -68.8 -47.3 108.7 -15.2 16.6 27.7
91 91 E T 3 S+ 0 0 103 1,-0.2 50,-0.5 51,-0.1 49,-0.2 0.539 114.9 79.9 50.2 38.8 -14.2 19.4 25.2
92 92 W < + 0 0 0 -3,-1.2 48,-0.4 -4,-0.2 -1,-0.2 0.588 68.8 54.0-140.2 -75.6 -11.5 17.5 23.5
93 93 C S S+ 0 0 0 -4,-0.4 2,-1.6 -5,-0.2 -9,-0.9 0.541 70.2 120.3 -70.8 -11.3 -11.8 14.9 20.8
94 94 K B +h 84 0D 124 1,-0.2 -9,-0.2 -5,-0.2 -1,-0.2 -0.312 29.3 110.5 -87.9 75.8 -13.9 17.1 18.6
95 95 A - 0 0 24 -11,-2.7 -10,-0.3 -2,-1.6 -1,-0.2 0.544 60.3-151.6-126.2 -25.4 -11.8 17.3 15.6
96 96 G S S+ 0 0 53 -12,-6.1 -11,-0.2 -3,-0.3 -12,-0.2 0.717 73.7 100.2 65.1 20.0 -13.9 15.2 13.1
97 97 T - 0 0 58 -13,-0.6 2,-0.3 -4,-0.4 -1,-0.2 -0.259 68.5-112.2-136.8-173.3 -10.5 14.8 12.0
98 98 A + 0 0 52 -3,-0.2 2,-0.3 -2,-0.1 -15,-0.2 -0.998 15.1 178.7-145.7 152.5 -7.1 12.7 11.8
99 99 V E - E 0 82B 25 -17,-1.8 -17,-1.8 -2,-0.3 2,-0.5 -0.985 29.3-114.0-144.5 156.9 -3.6 12.4 12.8
100 100 T E + E 0 81B 31 -2,-0.3 2,-0.5 -19,-0.2 -19,-0.2 -0.749 30.4 179.9-101.4 123.8 -0.7 10.0 12.3
101 101 I E - E 0 80B 1 -21,-2.5 -21,-2.8 -2,-0.5 2,-0.4 -0.971 12.6-150.0-115.5 124.6 0.8 8.1 15.3
102 102 T E -cE 62 79B 4 -41,-2.0 -39,-2.4 -2,-0.5 2,-0.8 -0.851 20.2-116.7-105.6 152.8 3.6 5.6 15.3
103 103 A E +c 63 0B 0 -25,-2.3 -26,-1.8 -2,-0.4 -25,-0.2 -0.560 50.3 143.2 -75.8 95.8 4.2 2.7 17.6
104 104 T E + 0 0B 11 -41,-2.0 -57,-1.1 -2,-0.8 2,-0.3 0.593 69.6 15.5-122.0 -6.8 7.4 3.1 19.6
105 105 N E -c 64 0B 1 -42,-1.3 -40,-1.7 -59,-0.1 -1,-0.3 -0.979 64.2-159.1-156.1 172.9 6.3 1.6 22.9
106 106 L E -c 65 0B 11 -42,-0.3 -40,-0.3 -2,-0.3 -60,-0.1 -0.739 19.6-122.4-141.4-177.9 3.6 -0.6 24.3
107 107 C > + 0 0 5 -42,-2.3 5,-0.6 -2,-0.2 -41,-0.2 0.890 46.4 139.5 -73.8 -55.0 1.7 -1.7 27.4
108 108 P T 5S- 0 0 25 0, 0.0 2,-4.6 0, 0.0 13,-0.2 0.373 72.8-118.8 -62.0 85.9 1.8 -5.2 28.0
109 109 P T >>5S+ 0 0 39 0, 0.0 3,-2.6 0, 0.0 4,-2.4 -0.056 95.2 94.0 16.2 -35.8 2.2 -4.1 31.6
110 110 N H 3>>S+ 0 0 110 -2,-4.6 4,-1.9 1,-0.3 5,-0.6 0.767 84.2 42.3 -61.9 -57.2 5.6 -5.7 31.9
111 111 W H 345S+ 0 0 71 3,-0.2 -1,-0.3 1,-0.2 4,-0.1 0.765 128.6 39.8 -54.0 -24.5 8.1 -2.7 31.0
112 112 A H <>XS+ 0 0 2 -3,-2.6 4,-1.4 -5,-0.6 5,-1.1 0.889 114.3 42.6 -96.2 -49.8 5.6 -0.7 33.2
113 113 L H <5S+ 0 0 111 -4,-2.4 4,-0.2 1,-0.2 5,-0.2 0.934 135.0 25.9 -59.7 -39.9 4.5 -2.8 36.3
114 114 A T <5S+ 0 0 71 -4,-1.9 -3,-0.2 -5,-0.4 -2,-0.2 0.588 132.9 28.7-107.8 -17.7 8.2 -3.8 36.5
115 115 N T 4 -b 34 0B 0 -69,-1.9 4,-2.9 -2,-0.2 5,-0.4 -0.342 38.7-116.0 -62.9 141.6 2.3 11.1 24.1
132 132 Q H > S+ 0 0 16 -98,-1.9 4,-2.7 -97,-0.3 5,-0.2 0.894 111.3 48.1 -47.5 -47.0 1.2 14.2 25.7
133 133 P H > S+ 0 0 11 0, 0.0 4,-3.1 0, 0.0 -1,-0.2 0.934 117.8 40.1 -61.0 -41.5 1.9 16.5 22.6
134 134 A H > S+ 0 0 2 -74,-0.4 4,-2.0 -72,-0.2 -2,-0.2 0.938 114.3 51.4 -67.7 -45.9 0.2 14.2 20.1
135 135 W H X S+ 0 0 0 -4,-2.9 4,-0.9 1,-0.2 -1,-0.2 0.903 117.6 43.1 -59.1 -44.9 -2.6 13.5 22.5
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