Secondary structure calculation program - copyright by David Keith Smith, 1989
1nstA.pdb
1NST SULFOTRANSFERASE MOL_ID: 1; MOL_ID: 1;
Sequence length - 282
A A K K hydrogen bonding Ooi's
strk chain/ l amino u & S structure bridge dihedral angles donor acceptor donor acceptor N N
num seq.no t acids t S + patterns partners phi psi omega alpha kappa tco to/energy fr/energy to/energy fr/energy 8 14
1 A 579 ASP D 0 0 999.9 121.7 179.6 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 3 22
2 A 580 PRO P - 0 0 -94.7 -173.3 177.7 -139.5 999.9 104.1 0 0.0 0 0.0 0 0.0 0 0.0 4 25
3 A 581 LEU L - 0 0 -150.9 79.6 -179.7 -146.5 18.8 125.5 0 0.0 0 0.0 0 0.0 0 0.0 7 32
4 A 582 TRP W - 0 0 -50.4 122.1 -179.5 -145.2 21.0 105.3 0 0.0 0 0.0 0 0.0 0 0.0 9 33
5 A 583 GLN Q - 0 0 -90.1 168.1 179.2 -73.9 33.0 114.1 0 0.0 0 0.0 0 0.0 0 0.0 6 31
6 A 584 ASP D - 0 0 -62.9 111.1 -179.7 -151.7 40.5 118.6 95 -0.7 0 0.0 0 0.0 0 0.0 8 27
7 A 585 PRO P 0 0 -60.2 -16.8 -179.1 999.9 999.9 48.3 0 0.0 0 0.0 0 0.0 0 0.0 5 24
8!A 586 CYS C 0 0 -121.0 999.9 999.9 999.9 999.9 110.0 0 0.0 0 0.0 0 0.0 0 0.0 3 20
9!A 601 CYS C t > T 0 0 999.9 -59.2 -179.2 999.9 999.9 999.9 0 0.0 12 -0.6 0 0.0 0 0.0 5 30
10 A 602 ASP D T T 3 T + 0 0 -56.0 -14.3 -179.8 73.7 999.9 50.3 0 0.0 0 0.0 0 0.0 0 0.0 4 32
11 A 603 ARG R T T 3 TS+ 0 0 -94.8 40.2 179.5 95.7 79.4 100.0 0 0.0 0 0.0 0 0.0 0 0.0 9 35
12 A 604 PHE F S e < TS- 0 0 -127.7 149.3 179.9 -99.6 83.5 160.6 9 -0.6 76 -0.5 0 0.0 0 0.0 9 48
13 A 605 PRO P E E Aa - 76 0 -67.6 146.6 179.4 -163.9 23.4 113.2 0 0.0 0 0.0 0 0.0 0 0.0 11 58
14 A 606 LYS K E E A* S+ 0 0 -106.4 -7.4 179.0 44.9 74.5 61.4 76 -3.3 101 -2.2 0 0.0 0 0.0 11 53
15 A 607 LEU L E E Aab - 77 101 -139.8 138.5 178.7 -162.5 63.1 179.5 76 -1.0 78 -1.6 0 0.0 0 0.0 11 67
16 A 608 LEU L E E Aab - 78 102 -123.3 118.4 176.9 -160.3 5.9 167.5 101 -2.7 103 -3.1 0 0.0 18 -1.0 13 77
17 A 609 ILE I E E Aab - 79 103 -98.1 102.2 -176.6 -176.3 13.6 148.4 78 -2.3 80 -2.2 0 0.0 0 0.0 13 73
18 A 610 ILE I e - 0 0 -82.9 2.7 -179.6 -169.3 20.4 68.1 103 -2.0 84 -3.0 16 -1.0 0 0.0 13 69
19 A 611 GLY G - 0 0 97.2 -147.1 0.1 -133.2 34.6 136.7 0 0.0 105 -2.2 0 0.0 0 0.0 16 67
20 A 612 PRO P t > T - 0 0 -71.0 -167.4 -179.0 -96.5 50.5 58.2 0 0.0 23 -0.6 0 0.0 0 0.0 15 66
21 A 613 GLN Q T T 3 TS+ 0 0 -79.9 149.5 178.7 19.5 99.1 115.8 0 0.0 0 0.0 0 0.0 0 0.0 10 61
22 A 614 LYS K T T 3 TS+ 0 0 65.9 32.5 179.8 109.1 89.3 37.7 0 0.0 0 0.0 0 0.0 0 0.0 9 61
23 A 615 THR T S t < TS- 0 0 -113.9 -3.7 -179.4 -85.2 102.5 65.8 20 -0.6 0 0.0 0 0.0 0 0.0 11 62
24 A 616 GLY G S h > TS+ 0 0 104.0 28.0 -179.3 144.2 78.6 45.5 0 0.0 28 -1.8 0 0.0 0 0.0 11 62
25 A 617 THR T H H > T + 0 0 -65.9 -39.2 -179.3 53.4 70.0 30.1 0 0.0 29 -2.7 0 0.0 0 0.0 14 62
26 A 618 THR T H H > TS+ 0 0 -65.9 -34.8 179.5 49.9 109.4 31.6 0 0.0 30 -2.0 0 0.0 0 0.0 7 57
27 A 619 ALA A H H > TS+ 0 0 -70.2 -43.2 179.2 45.6 112.2 25.3 0 0.0 31 -2.9 0 0.0 0 0.0 8 67
28 A 620 LEU L H H X TS+ 0 0 -62.8 -45.4 -180.0 50.4 114.9 19.1 24 -1.8 32 -2.6 0 0.0 0 0.0 10 71
29 A 621 TYR Y H H X TS+ 0 0 -58.8 -39.2 -179.7 44.6 113.5 33.7 25 -2.7 33 -1.1 0 0.0 0 0.0 11 65
30 A 622 LEU L H H X TS+ 0 0 -74.4 -46.8 -179.8 46.0 114.8 23.2 26 -2.0 34 -0.5 0 0.0 0 0.0 8 53
31 A 623 PHE F H H < > TS+ 0 0 -64.8 -39.5 179.7 53.4 110.8 29.3 27 -2.9 34 -0.9 0 0.0 0 0.0 10 57
32 A 624 LEU L H H < > TS+ 0 0 -64.2 -36.5 179.8 59.0 102.1 30.8 28 -2.6 35 -1.3 0 0.0 0 0.0 9 61
33 A 625 GLY G H H < 3 TS+ 0 0 -66.3 -18.4 -179.8 70.2 92.2 45.1 29 -1.1 0 0.0 0 0.0 0 0.0 10 53
34 A 626 MET M T h < < TS+ 0 0 -70.6 -25.2 178.7 95.1 75.1 39.6 31 -0.9 0 0.0 30 -0.5 0 0.0 7 45
35 A 627 HIS H S t X TS- 0 0 -70.7 112.7 -179.7 -138.5 78.2 124.9 32 -1.3 38 -2.4 0 0.0 0 0.0 9 43
36 A 628 PRO P T T 3 TS+ 0 0 -42.9 -25.4 -178.4 51.9 100.8 46.2 0 0.0 0 0.0 0 0.0 0 0.0 7 29
37 A 629 ASP D T e 3 TS+ 0 0 -89.9 -18.0 -179.3 71.5 98.9 48.3 0 0.0 74 -1.3 0 0.0 75 -0.6 7 33
38 A 630 LEU L E E Ac < T - 75 0 -103.8 133.4 -178.6 -168.2 63.3 148.1 35 -2.4 0 0.0 0 0.0 0 0.0 13 46
39 A 631 SER S E E Ac - 76 0 -129.3 126.9 179.0 -151.3 6.8 167.1 75 -2.7 77 -1.5 0 0.0 0 0.0 12 41
40 A 632 SER S E E Ac - 77 0 -83.9 173.1 179.1 -93.6 31.0 106.2 0 0.0 0 0.0 0 0.0 0 0.0 10 48
41 A 633 ASN N e - 0 0 -78.4 169.9 178.3 -96.1 44.5 104.9 77 -0.7 0 0.0 0 0.0 0 0.0 11 51
42 A 634 TYR Y - 0 0 -91.2 141.5 -179.3 -95.4 51.6 137.9 69 -2.4 0 0.0 0 0.0 0 0.0 8 36
43 A 635 PRO P - 0 0 -57.4 151.1 178.9 -129.8 27.9 93.7 0 0.0 0 0.0 0 0.0 0 0.0 10 30
44 A 636 SER S B B > A T - 48 0 -100.9 142.0 179.9 -137.4 9.8 143.8 48 -2.6 48 -1.7 0 0.0 0 0.0 9 24
45 A 637 SER S T T 4 TS+ 0 0 -74.9 -6.9 -179.8 36.5 107.9 54.9 0 0.0 0 0.0 0 0.0 0 0.0 5 14
46 A 638 GLU E T T 4 TS+ 0 0 -112.1 -39.4 179.5 21.4 133.1 42.1 0 0.0 0 0.0 0 0.0 0 0.0 4 16
47 A 639 THR T T T 4 > TS- 0 0 -114.5 8.7 178.8 -154.8 88.8 72.1 0 0.0 50 -1.8 0 0.0 0 0.0 9 28
48 A 640 PHE F B B < A 3 TS+ 44 0 56.7 -137.2 179.8 2.2 74.5 104.1 44 -1.7 44 -2.6 0 0.0 0 0.0 8 27
49 A 641 GLU E T T 3 TS+ 0 0 -52.1 -25.0 -178.8 81.8 122.7 43.1 0 0.0 79 -0.5 0 0.0 0 0.0 9 45
50 A 642 GLU E t < T - 0 0 -86.7 155.4 179.6 -168.7 55.9 119.6 47 -1.8 0 0.0 0 0.0 0 0.0 10 51
51 A 643 ILE I - 0 0 -105.5 -43.5 179.5 -165.1 13.2 40.5 0 0.0 0 0.0 0 0.0 0 0.0 13 53
52 A 644 GLN Q + 0 0 54.2 56.5 -179.3 143.1 34.0 19.7 0 0.0 0 0.0 0 0.0 0 0.0 12 55
53 A 645 PHE F + 0 0 -89.1 -56.8 -178.0 39.9 64.1 21.1 0 0.0 0 0.0 0 0.0 0 0.0 9 60
54 A 646 PHE F S S S+ 0 0 -67.5 -29.0 -177.1 65.7 106.0 40.0 0 0.0 0 0.0 0 0.0 0 0.0 12 58
55 A 647 ASN N S S S- 0 0 -64.2 -56.2 -177.5 -25.2 108.5 18.8 0 0.0 0 0.0 0 0.0 0 0.0 13 47
56 A 648 GLY G S g > TS- 0 0 -128.8 -127.2 -178.1 -14.2 104.7 88.5 0 0.0 59 -1.2 0 0.0 0 0.0 7 33
57 A 649 HIS H G G > TS+ 0 0 -63.3 -19.6 -178.7 67.9 115.3 49.3 0 0.0 60 -0.6 0 0.0 0 0.0 7 27
58 A 650 ASN N G G > TS+ 0 0 -74.4 -22.6 -178.2 71.5 86.0 39.6 0 0.0 61 -1.4 0 0.0 0 0.0 9 35
59 A 651 TYR Y G G X TS+ 0 0 -64.1 -30.5 -179.6 63.6 85.2 39.6 56 -1.2 62 -1.3 0 0.0 0 0.0 9 40
60 A 652 HIS H G G < TS+ 0 0 -77.6 8.0 180.0 82.2 84.8 67.7 57 -0.6 0 0.0 0 0.0 0 0.0 7 27
61 A 653 LYS K G G < TS- 0 0 -88.2 -10.2 176.4 -118.6 98.5 55.9 58 -1.4 0 0.0 0 0.0 0 0.0 8 25
62 A 654 GLY G h > < T - 0 0 97.7 163.7 -177.6 -70.0 23.8 92.2 59 -1.3 66 -1.2 0 0.0 0 0.0 8 31
63 A 655 ILE I H H > TS+ 0 0 -64.6 -37.8 -178.4 58.3 122.7 37.4 0 0.0 67 -2.5 0 0.0 0 0.0 7 37
64 A 656 ASP D H H > TS+ 0 0 -68.0 -33.3 179.0 56.7 101.1 32.1 0 0.0 68 -1.8 0 0.0 0 0.0 7 31
65 A 657 TRP W H H 4 TS+ 0 0 -61.0 -42.0 179.9 44.6 111.6 25.5 0 0.0 0 0.0 0 0.0 0 0.0 8 31
66 A 658 TYR Y H H < > TS+ 0 0 -68.1 -50.1 -179.0 53.7 109.5 19.8 62 -1.2 69 -1.6 0 0.0 0 0.0 10 51
67 A 659 MET M H H < > TS+ 0 0 -56.5 -33.5 -179.1 69.9 94.9 36.4 63 -2.5 70 -2.1 0 0.0 0 0.0 9 45
68 A 660 GLU E T h < 3 TS+ 0 0 -57.9 -25.5 -179.1 66.5 87.8 42.3 64 -1.8 0 0.0 0 0.0 0 0.0 7 33
69 A 661 PHE F T T < TS+ 0 0 -71.0 -17.8 -177.3 73.6 94.3 48.0 66 -1.6 42 -2.4 0 0.0 0 0.0 10 42
70 A 662 PHE F S t < TS- 0 0 -107.4 148.7 -180.0 -100.6 88.6 139.2 67 -2.1 0 0.0 0 0.0 0 0.0 13 38
71 A 663 PRO P 0 0 -59.4 160.8 -172.4 999.9 999.9 98.1 0 0.0 0 0.0 0 0.0 0 0.0 7 31
72!A 664 ILE I 0 0 -91.1 999.9 999.9 999.9 999.9 120.6 0 0.0 0 0.0 0 0.0 0 0.0 3 23
73!A 670 SER S 0 0 999.9 126.4 -179.8 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 7 28
74 A 671 ASP D + 0 0 -159.3 26.2 -178.9 79.9 999.9 86.0 37 -1.3 0 0.0 0 0.0 0 0.0 7 31
75 A 672 PHE F E E A c - 0 38 -144.9 106.5 -179.0 -169.9 58.8 152.7 37 -0.6 39 -2.7 0 0.0 0 0.0 9 45
76 A 673 TYR Y E E Aac - 13 39 -100.6 156.5 178.8 -177.6 4.5 130.2 12 -0.5 14 -3.3 0 0.0 15 -1.0 15 53
77 A 674 PHE F E E Aac - 15 40 -147.4 155.4 178.3 -162.2 7.7 168.4 39 -1.5 41 -0.7 0 0.0 0 0.0 13 68
78 A 675 GLU E E E Aa - 16 0 -135.9 157.9 179.2 -145.4 9.5 160.7 15 -1.6 17 -2.3 0 0.0 0 0.0 13 62
79 A 676 LYS K E E Aa + 17 0 -132.1 127.0 178.4 160.8 23.5 171.9 49 -0.5 0 0.0 0 0.0 0 0.0 15 62
80 A 677 SER S e > T - 0 0 -144.3 95.9 -178.2 -162.2 21.7 142.4 17 -2.2 83 -2.7 0 0.0 0 0.0 12 60
81 A 678 ALA A T h > 3 TS+ 0 0 -57.7 -3.8 179.8 71.7 88.0 58.8 0 0.0 85 -0.5 0 0.0 0 0.0 12 62
82 A 679 ASN N H H > 3 TS+ 0 0 -87.0 -15.4 -179.0 71.4 81.3 53.6 0 0.0 86 -1.1 0 0.0 0 0.0 12 54
83 A 680 TYR Y H H 4 < TS+ 0 0 -69.4 -39.0 -178.4 61.2 88.2 30.0 80 -2.7 0 0.0 0 0.0 0 0.0 14 60
84 A 681 PHE F H H 4 TS+ 0 0 -51.8 -56.9 -178.6 35.7 112.5 18.3 18 -3.0 0 0.0 0 0.0 0 0.0 12 65
85 A 682 ASP D H H < TS+ 0 0 -70.5 -26.4 -177.8 112.4 94.5 44.5 81 -0.5 0 0.0 0 0.0 0 0.0 9 55
86 A 683 SER S h < T - 0 0 -58.7 133.2 -179.8 -158.6 52.8 104.7 82 -1.1 0 0.0 0 0.0 0 0.0 10 49
87 A 684 GLU E S S S+ 0 0 -77.9 -38.4 -178.3 33.8 92.7 31.7 0 0.0 0 0.0 0 0.0 0 0.0 8 40
88 A 685 VAL V S h > TS+ 0 0 -91.2 -26.2 -178.2 80.1 98.6 44.5 0 0.0 92 -2.0 0 0.0 0 0.0 8 40
89 A 686 ALA A H H > TS+ 0 0 -51.5 -45.8 -179.5 60.4 85.5 28.0 0 0.0 93 -2.9 0 0.0 0 0.0 10 55
90 A 687 PRO P H H > TS+ 0 0 -50.6 -54.5 -179.4 33.8 112.7 24.5 0 0.0 94 -2.2 0 0.0 0 0.0 13 55
91 A 688 ARG R H H > TS+ 0 0 -72.6 -34.4 179.4 53.8 118.2 32.3 0 0.0 95 -1.9 0 0.0 0 0.0 9 42
92 A 689 ARG R H H X TS+ 0 0 -65.1 -40.0 -179.7 42.6 114.0 27.3 88 -2.0 96 -1.3 0 0.0 0 0.0 11 47
93 A 690 ALA A H H X TS+ 0 0 -72.9 -41.6 179.8 53.0 112.4 27.9 89 -2.9 97 -3.2 0 0.0 0 0.0 10 62
94 A 691 ALA A H H < TS+ 0 0 -63.3 -33.3 -179.7 53.1 107.5 33.8 90 -2.2 0 0.0 0 0.0 0 0.0 12 50
95 A 692 ALA A H H < TS+ 0 0 -70.4 -38.8 -179.2 31.7 119.7 28.9 91 -1.9 6 -0.7 0 0.0 0 0.0 11 41
96 A 693 LEU L H H < TS+ 0 0 -85.9 -46.4 -179.5 25.5 134.3 25.7 92 -1.3 0 0.0 0 0.0 0 0.0 11 43
97 A 694 LEU L h < > T + 0 0 -120.7 67.3 -179.9 163.7 67.8 125.7 93 -3.2 100 -1.6 0 0.0 0 0.0 10 49
98 A 695 PRO P T T 3 TS+ 0 0 -52.8 -32.9 -178.4 45.0 78.8 39.6 0 0.0 0 0.0 0 0.0 0 0.0 9 37
99 A 696 LYS K T T 3 TS+ 0 0 -95.3 -1.2 -179.9 124.9 86.4 63.1 0 0.0 0 0.0 0 0.0 0 0.0 7 42
100 A 697 ALA A t < T - 0 0 -56.9 156.1 177.6 -118.7 62.1 94.1 97 -1.6 0 0.0 0 0.0 0 0.0 11 52
101 A 698 LYS K E E Ab - 15 0 -96.0 143.8 -179.3 -148.0 23.5 140.9 14 -2.2 16 -2.7 0 0.0 103 -0.5 11 54
102 A 699 VAL V E E Abd - 16 176 -119.9 121.5 -179.3 -176.5 15.8 165.4 175 -3.2 177 -2.4 0 0.0 0 0.0 12 68
103 A 700 LEU L E E Abd + 17 177 -121.4 136.5 179.4 176.7 3.4 162.9 16 -3.1 18 -2.0 101 -0.5 0 0.0 13 75
104 A 701 THR T E E A d - 0 178 -135.2 151.7 -179.1 -144.3 17.1 164.4 177 -2.5 179 -3.3 0 0.0 0 0.0 13 77
105 A 702 ILE I E E A d - 0 179 -122.8 128.2 -179.8 -165.1 13.1 166.1 19 -2.2 0 0.0 0 0.0 0 0.0 13 69
106 A 703 LEU L E E A d + 0 180 -118.8 132.9 176.3 169.1 11.8 159.1 179 -2.3 181 -3.4 0 0.0 182 -0.6 14 71
107 A 704 ILE I - 0 0 -125.6 167.3 179.2 -59.3 60.6 145.1 0 0.0 0 0.0 0 0.0 0 0.0 11 63
108 A 705 ASN N h > > T - 0 0 -49.8 124.0 -179.6 -133.5 51.6 106.9 0 0.0 112 -2.1 0 0.0 111 -0.6 8 62
109 A 706 PRO P H H > 3 TS+ 0 0 -51.2 -35.4 -179.9 57.2 102.6 38.0 0 0.0 113 -2.0 0 0.0 0 0.0 11 67
110 A 707 ALA A H H > 3 TS+ 0 0 -65.5 -44.5 179.3 41.5 110.9 25.2 0 0.0 114 -2.1 0 0.0 0 0.0 11 57
111 A 708 ASP D H H > < TS+ 0 0 -71.9 -32.6 179.4 54.6 113.3 34.6 108 -0.6 115 -2.6 0 0.0 0 0.0 9 59
112 A 709 ARG R H H X TS+ 0 0 -67.8 -35.4 179.1 46.2 110.5 32.2 108 -2.1 116 -1.3 0 0.0 0 0.0 14 61
113 A 710 ALA A H H X TS+ 0 0 -72.4 -41.8 179.9 50.3 112.6 26.5 109 -2.0 117 -2.1 0 0.0 0 0.0 12 59
114 A 711 TYR Y H H X TS+ 0 0 -62.9 -42.6 -179.9 52.5 108.4 25.4 110 -2.1 118 -3.0 0 0.0 0 0.0 11 58
115 A 712 SER S H H X TS+ 0 0 -63.6 -35.5 -180.0 50.9 108.2 31.0 111 -2.6 119 -2.0 0 0.0 0 0.0 9 59
116 A 713 TRP W H H X TS+ 0 0 -67.8 -44.3 179.4 48.4 110.8 20.8 112 -1.3 120 -2.7 0 0.0 0 0.0 12 59
117 A 714 TYR Y H H X TS+ 0 0 -58.4 -50.6 179.5 46.1 113.6 18.7 113 -2.1 121 -2.0 0 0.0 0 0.0 11 59
118 A 715 GLN Q H H X TS+ 0 0 -60.6 -32.2 179.6 55.2 111.6 32.1 114 -3.0 122 -2.1 0 0.0 0 0.0 10 46
119 A 716 HIS H H H X TS+ 0 0 -67.3 -44.6 179.5 47.2 107.2 24.7 115 -2.0 123 -1.3 0 0.0 0 0.0 8 45
120 A 717 GLN Q H H < >TS+ 0 0 -68.5 -29.5 179.0 52.0 111.4 35.0 116 -2.7 125 -3.4 0 0.0 0 0.0 10 40
121 A 718 ARG R H H < >5TS+ 0 0 -70.7 -43.6 179.5 54.2 105.8 22.1 117 -2.0 124 -2.2 0 0.0 0 0.0 11 36
122 A 719 ALA A H H < 35TS+ 0 0 -58.0 -32.9 179.1 51.0 107.1 35.5 118 -2.1 0 0.0 0 0.0 0 0.0 7 29
123 A 720 HIS H T h < 35TS- 0 0 -91.4 20.6 179.4 -111.6 123.4 83.0 119 -1.3 0 0.0 0 0.0 0 0.0 6 23
124 A 721 ASP D T T <5T + 0 0 52.8 39.7 177.5 178.2 49.3 35.5 121 -2.2 0 0.0 0 0.0 0 0.0 8 20
125 A 722 ASP D h > TS+ 0 0 -59.2 -42.7 179.5 50.5 95.9 31.9 0 0.0 130 -2.4 0 0.0 0 0.0 7 27
127 A 724 VAL V H H > TS+ 0 0 -64.8 -37.9 -179.9 45.5 114.9 27.0 0 0.0 131 -1.9 0 0.0 0 0.0 9 35
128 A 725 ALA A H H 4 TS+ 0 0 -74.2 -30.1 179.9 44.2 117.2 37.4 0 0.0 0 0.0 0 0.0 0 0.0 16 40
129 A 726 LEU L H H < TS+ 0 0 -85.1 -25.2 -179.3 50.7 114.4 41.6 125 -1.9 0 0.0 0 0.0 0 0.0 9 28
130 A 727 LYS K H H < TS+ 0 0 -81.7 -35.7 -179.4 46.4 110.9 34.1 126 -2.4 0 0.0 0 0.0 0 0.0 6 30
131 A 728 TYR Y S h < TS- 0 0 -110.4 154.5 178.3 -123.5 80.2 141.8 127 -1.9 0 0.0 0 0.0 0 0.0 9 37
132 A 729 THR T h > T - 0 0 -84.9 171.8 -179.7 -99.9 36.0 111.3 0 0.0 136 -1.6 0 0.0 0 0.0 8 43
133 A 730 PHE F H H > TS+ 0 0 -59.0 -45.9 -180.0 50.8 122.9 24.1 0 0.0 137 -2.4 0 0.0 0 0.0 10 51
134 A 731 HIS H H H > TS+ 0 0 -61.3 -38.3 179.7 52.6 108.3 27.7 0 0.0 138 -1.6 0 0.0 0 0.0 8 42
135 A 732 GLU E H H 4 TS+ 0 0 -66.2 -32.2 -179.6 49.9 110.1 33.0 0 0.0 0 0.0 0 0.0 0 0.0 8 42
136 A 733 VAL V H H < > TS+ 0 0 -71.8 -47.0 -177.9 42.3 113.6 20.3 132 -1.6 139 -0.9 0 0.0 0 0.0 13 51
137 A 734 ILE I H H < 3 TS+ 0 0 -75.1 -18.8 179.0 41.3 121.5 46.4 133 -2.4 0 0.0 0 0.0 0 0.0 9 55
138 A 735 THR T T h < 3 TS+ 0 0 -110.7 13.7 179.5 150.9 80.5 79.0 134 -1.6 0 0.0 0 0.0 0 0.0 7 42
139 A 736 ALA A t < T + 0 0 -46.9 125.4 -178.3 144.6 26.6 103.2 136 -0.9 0 0.0 0 0.0 0 0.0 11 34
140 A 737 GLY G t > T - 0 0 -137.8 -140.4 -178.3 -16.2 49.9 107.3 0 0.0 143 -2.5 0 0.0 0 0.0 6 22
141 A 738 SER S T T 3 TS+ 0 0 -49.3 -28.4 179.4 38.4 133.8 45.1 0 0.0 0 0.0 0 0.0 0 0.0 4 15
142 A 739 ASP D T T 3 TS+ 0 0 -106.8 7.3 -179.2 115.8 94.1 71.8 0 0.0 0 0.0 0 0.0 0 0.0 5 16
143 A 740 ALA A t < T - 0 0 -80.1 144.8 179.7 -123.3 63.2 120.1 140 -2.5 0 0.0 0 0.0 0 0.0 8 24
144 A 741 SER S h > T - 0 0 -75.8 180.0 179.8 -106.0 25.1 93.9 0 0.0 148 -1.6 0 0.0 0 0.0 6 23
145 A 742 SER S H H > TS+ 0 0 -75.4 -43.5 179.5 46.7 120.9 25.2 0 0.0 149 -2.9 0 0.0 0 0.0 6 23
146 A 743 LYS K H H > TS+ 0 0 -65.9 -37.1 179.7 49.4 113.5 30.6 0 0.0 150 -2.0 0 0.0 0 0.0 7 30
147 A 744 LEU L H H > TS+ 0 0 -68.8 -40.1 179.5 47.7 112.3 26.5 0 0.0 151 -1.5 0 0.0 0 0.0 13 35
148 A 745 ARG R H H X TS+ 0 0 -64.5 -46.7 179.5 53.3 110.1 19.6 144 -1.6 152 -2.1 0 0.0 0 0.0 12 32
149 A 746 ALA A H H X TS+ 0 0 -55.4 -41.9 179.4 50.9 107.2 29.8 145 -2.9 153 -1.9 0 0.0 0 0.0 8 33
150 A 747 LEU L H H X TS+ 0 0 -65.5 -34.6 179.7 54.4 107.6 30.6 146 -2.0 154 -0.9 0 0.0 0 0.0 11 43
151 A 748 GLN Q H H X TS+ 0 0 -64.0 -43.8 179.5 49.9 107.0 25.5 147 -1.5 155 -2.8 0 0.0 0 0.0 12 51
152 A 749 ASN N H H X TS+ 0 0 -61.4 -42.6 -179.8 52.9 108.8 26.1 148 -2.1 156 -1.7 0 0.0 0 0.0 9 43
153 A 750 ARG R H H < TS+ 0 0 -66.9 -22.6 179.7 43.0 114.2 45.1 149 -1.9 0 0.0 0 0.0 0 0.0 10 47
154 A 751 CYS C H H < TS+ 0 0 -88.3 -46.2 -176.9 25.1 127.8 28.3 150 -0.9 0 0.0 0 0.0 0 0.0 14 55
155 A 752 LEU L H H < > TS+ 0 0 -88.2 -49.5 -177.2 61.3 110.0 24.5 151 -2.8 158 -2.0 0 0.0 0 0.0 12 58
156 A 753 VAL V G h < > TS+ 0 0 -51.6 -47.6 179.7 58.0 98.0 29.4 152 -1.7 159 -2.3 0 0.0 0 0.0 7 51
157 A 754 PRO P G T 3 TS+ 0 0 -58.3 -14.6 179.9 68.3 97.4 44.5 0 0.0 0 0.0 0 0.0 0 0.0 10 53
158 A 755 GLY G G T < T + 0 0 -84.9 1.0 176.9 96.6 66.1 67.7 155 -2.0 160 -1.9 0 0.0 0 0.0 10 60
159 A 756 TRP W h > < T + 0 0 -85.2 61.9 -177.5 172.7 56.4 119.1 156 -2.3 163 -1.4 0 0.0 0 0.0 11 51
160 A 757 TYR Y H H > T + 0 0 -41.3 -51.1 -178.3 51.2 66.6 34.1 158 -1.9 164 -2.4 0 0.0 0 0.0 11 66
161 A 758 ALA A H H > TS+ 0 0 -58.1 -47.8 -179.6 57.5 104.5 23.4 0 0.0 165 -2.0 0 0.0 0 0.0 11 52
162 A 759 THR T H H > TS+ 0 0 -50.5 -48.4 -179.1 37.0 114.4 26.0 0 0.0 166 -0.8 0 0.0 0 0.0 7 41
163 A 760 HIS H H H X TS+ 0 0 -76.0 -35.2 -179.9 58.4 111.5 32.1 159 -1.4 167 -1.3 0 0.0 0 0.0 12 51
164 A 761 ILE I H H X TS+ 0 0 -65.1 -28.2 178.8 57.8 101.6 36.7 160 -2.4 168 -2.1 0 0.0 0 0.0 9 62
165 A 762 GLU E H H X TS+ 0 0 -68.6 -37.6 -179.7 54.6 101.8 28.3 161 -2.0 169 -1.1 0 0.0 0 0.0 8 49
166 A 763 ARG R H H < TS+ 0 0 -63.4 -36.9 179.5 40.7 114.0 31.1 162 -0.8 0 0.0 0 0.0 0 0.0 10 44
167 A 764 TRP W H H X > TS+ 0 0 -79.4 -33.0 -179.3 58.5 110.7 35.5 163 -1.3 171 -1.6 0 0.0 170 -0.6 11 56
168 A 765 LEU L H H < 3 TS+ 0 0 -71.2 -16.8 179.3 53.9 102.8 48.2 164 -2.1 0 0.0 0 0.0 0 0.0 10 49
169 A 766 SER S T h < 3 TS+ 0 0 -88.8 -19.0 -179.6 41.3 114.0 47.7 165 -1.1 0 0.0 0 0.0 0 0.0 7 35
170 A 767 ALA A T T 4 < TS+ 0 0 -100.4 -17.4 -179.8 42.2 120.5 52.9 167 -0.6 0 0.0 0 0.0 0 0.0 9 42
171 A 768 TYR Y S t < TS- 0 0 -136.1 145.4 179.0 -110.0 84.0 169.7 167 -1.6 0 0.0 0 0.0 0 0.0 11 41
172 A 769 HIS H g > T - 0 0 -65.7 152.3 179.9 -114.8 35.3 108.0 0 0.0 175 -1.6 0 0.0 0 0.0 8 35
173 A 770 ALA A G G > TS+ 0 0 -56.5 -43.0 -178.6 59.3 113.6 27.1 0 0.0 176 -2.0 0 0.0 0 0.0 8 36
174 A 771 ASN N G G 3 TS+ 0 0 -72.1 8.4 178.3 58.5 100.0 68.8 0 0.0 0 0.0 0 0.0 0 0.0 5 37
175 A 772 GLN Q G e < TS+ 0 0 -116.5 10.8 -178.4 77.1 97.5 78.2 172 -1.6 102 -3.2 0 0.0 0 0.0 10 45
176 A 773 ILE I E E Ad < T - 102 0 -125.7 145.1 179.0 -168.2 56.2 159.8 173 -2.0 0 0.0 0 0.0 0 0.0 12 56
177 A 774 LEU L E E Ad - 103 0 -135.8 120.1 179.0 -160.0 7.0 167.0 102 -2.4 104 -2.5 0 0.0 179 -0.8 12 59
178 A 775 VAL V E E Ad - 104 0 -101.9 108.7 -178.6 -157.0 20.3 151.1 0 0.0 0 0.0 0 0.0 0 0.0 10 69
179 A 776 LEU L E E Ad - 105 0 -86.3 152.9 177.7 -116.9 20.0 120.3 104 -3.3 106 -2.3 177 -0.8 181 -0.8 11 71
180 A 777 ASP D E E >Ad T - 106 0 -88.1 109.4 -179.6 -161.7 21.8 143.2 0 0.0 184 -1.9 0 0.0 0 0.0 13 55
181 A 778 GLY G H H > TS+ 0 0 -61.3 -32.6 179.7 53.9 89.4 34.7 106 -3.4 185 -1.4 179 -0.8 0 0.0 12 57
182 A 779 LYS K H H > TS+ 0 0 -68.3 -43.7 179.3 47.0 109.2 24.7 106 -0.6 186 -2.5 0 0.0 0 0.0 11 45
183 A 780 LEU L H H > TS+ 0 0 -66.8 -34.2 -179.9 57.8 107.5 33.0 0 0.0 187 -3.4 0 0.0 0 0.0 11 40
184 A 781 LEU L H H < TS+ 0 0 -63.6 -38.6 -178.9 36.4 115.0 26.6 180 -1.9 0 0.0 0 0.0 0 0.0 15 57
185 A 782 ARG R H H < TS+ 0 0 -81.7 -34.4 -178.1 38.5 126.4 33.1 181 -1.4 0 0.0 0 0.0 0 0.0 10 52
186 A 783 THR T H H < TS+ 0 0 -87.1 -34.5 179.5 8.9 138.2 36.5 182 -2.5 0 0.0 0 0.0 0 0.0 8 38
187 A 784 GLU E h X > T + 0 0 -147.0 65.7 -179.4 170.6 67.9 116.9 183 -3.4 190 -2.1 0 0.0 191 -0.9 8 39
188 A 785 PRO P H H > 3 TS+ 0 0 -48.3 -35.8 -178.3 62.8 75.3 39.5 0 0.0 192 -2.3 0 0.0 0 0.0 12 53
189 A 786 ALA A H H > 3 TS+ 0 0 -65.6 -24.0 180.0 56.5 99.4 41.4 0 0.0 193 -0.6 0 0.0 0 0.0 11 43
190 A 787 LYS K H H > < TS+ 0 0 -74.6 -42.7 -179.7 36.9 113.3 26.3 187 -2.1 194 -1.2 0 0.0 0 0.0 11 39
191 A 788 VAL V H H X TS+ 0 0 -80.4 -28.7 178.7 63.1 108.8 37.6 187 -0.9 195 -2.6 0 0.0 0 0.0 12 52
192 A 789 MET M H H X TS+ 0 0 -62.5 -26.8 179.6 51.1 105.5 37.6 188 -2.3 196 -1.8 0 0.0 0 0.0 13 57
193 A 790 ASP D H H X TS+ 0 0 -75.1 -48.4 179.6 47.5 108.2 24.3 189 -0.6 197 -2.7 0 0.0 0 0.0 12 41
194 A 791 MET M H H X TS+ 0 0 -61.9 -39.0 179.4 52.2 112.2 29.5 190 -1.2 198 -2.3 0 0.0 0 0.0 8 45
195 A 792 VAL V H H X TS+ 0 0 -62.9 -53.5 -180.0 46.4 110.3 14.5 191 -2.6 199 -2.1 0 0.0 0 0.0 9 57
196 A 793 GLN Q H H X >TS+ 0 0 -53.6 -53.4 179.2 48.0 114.0 16.9 192 -1.8 201 -2.4 0 0.0 200 -1.0 10 48
197 A 794 LYS K H H < >5TS+ 0 0 -53.0 -41.1 -178.7 51.0 112.6 28.1 193 -2.7 200 -0.6 0 0.0 0 0.0 9 33
198 A 795 PHE F H H < 35TS+ 0 0 -69.7 -28.6 179.8 50.3 108.4 39.7 194 -2.3 0 0.0 0 0.0 0 0.0 8 41
199 A 796 LEU L H H < 35TS- 0 0 -86.1 -8.3 -178.9 -114.9 115.3 55.8 195 -2.1 0 0.0 0 0.0 0 0.0 7 47
200 A 797 GLY G T h < <5T - 0 0 76.4 34.2 -179.5 -165.0 43.5 32.4 196 -1.0 0 0.0 197 -0.6 0 0.0 6 32
201 A 798 VAL V t > TS+ 0 0 -76.1 -25.5 178.7 73.0 77.7 41.1 205 -0.8 210 -1.0 0 0.0 211 -0.6 11 43
208 A 805 HIS H G G 4 > TS+ 0 0 -51.4 -42.2 -176.1 49.1 101.3 23.3 0 0.0 211 -0.6 0 0.0 0 0.0 9 34
209 A 806 LYS K G G 4 3 TS+ 0 0 -75.9 -17.1 -175.2 29.9 120.4 49.9 0 0.0 0 0.0 0 0.0 0 0.0 5 29
210 A 807 THR T G e 4 < TS+ 0 0 -143.7 37.2 172.2 69.8 105.7 84.0 207 -1.0 223 -1.0 0 0.0 0 0.0 9 35
211 A 808 LEU L E E BE >T - 219 0 -94.9 100.4 -179.8 -167.2 5.0 142.3 219 -2.7 218 -2.8 212 -0.7 219 -1.2 11 31
215 A 812 PRO P T T 4 5TS+ 0 0 -53.1 -42.0 179.5 50.7 88.5 34.6 0 0.0 0 0.0 0 0.0 0 0.0 6 23
216 A 813 LYS K T T 4 5TS+ 0 0 -70.4 -24.1 179.8 42.4 117.5 38.9 0 0.0 0 0.0 0 0.0 0 0.0 4 22
217 A 814 LYS K T T 4 5TS- 0 0 -89.0 -32.0 -179.8 -139.2 99.9 37.8 0 0.0 0 0.0 0 0.0 0 0.0 8 29
218 A 815 GLY G T T < 5TS+ 0 0 80.7 14.8 -179.6 69.4 73.7 50.3 214 -2.8 0 0.0 0 0.0 0 0.0 8 33
219 A 816 PHE F E E BE TS- 0 0 -67.6 127.1 178.3 -2.8 116.3 115.4 0 0.0 228 -0.8 0 0.0 0 0.0 5 14
226 A 823 GLY G T T 3 TS- 0 0 57.7 75.7 179.0 -42.7 131.4 10.3 0 0.0 228 -1.3 0 0.0 0 0.0 4 14
227 A 824 GLY G T T 3 TS+ 0 0 69.9 -33.7 -174.7 139.9 100.4 89.5 0 0.0 0 0.0 0 0.0 0 0.0 6 20
228 A 825 LYS K e < T - 0 0 -48.1 143.8 179.4 -158.5 34.7 88.4 226 -1.3 224 -3.3 225 -0.8 0 0.0 7 22
229 A 826 THR T E E BF - 223 0 -131.4 146.9 178.3 -155.7 17.0 163.5 0 0.0 231 -0.6 0 0.0 0 0.0 10 29
230 A 827 LYS K E E BF - 222 0 -119.9 104.6 -177.7 -176.9 29.7 161.0 222 -2.2 222 -2.6 0 0.0 0 0.0 8 33
231 A 828 CYS C - 0 0 -97.5 177.5 178.5 -86.4 31.1 110.0 229 -0.6 0 0.0 0 0.0 0 0.0 9 38
232 A 829 LEU L - 0 0 -78.6 159.1 179.8 -82.7 60.7 116.1 0 0.0 0 0.0 0 0.0 0 0.0 8 42
233 A 830 GLY G t > T - 0 0 -58.0 170.6 -179.0 -94.4 43.3 87.2 0 0.0 236 -2.2 0 0.0 0 0.0 5 31
234 A 831 LYS K T T 3 TS+ 0 0 -59.0 -26.4 -179.5 60.7 123.0 42.4 0 0.0 0 0.0 0 0.0 0 0.0 6 25
235 A 832 SER S T T 3 TS+ 0 0 -82.6 1.1 179.6 75.3 94.3 64.6 0 0.0 237 -0.6 0 0.0 0 0.0 5 31
236 A 833 LYS K S t < TS+ 0 0 -117.7 112.2 -177.9 12.6 106.2 162.0 233 -2.2 0 0.0 0 0.0 0 0.0 6 43
237 A 834 GLY G S S S- 0 0 89.2 47.2 -179.9 -158.4 88.8 29.0 235 -0.6 0 0.0 0 0.0 0 0.0 9 45
238 A 835 ARG R - 0 0 -60.7 145.3 -179.6 -119.2 16.2 104.1 0 0.0 240 -0.9 0 0.0 0 0.0 6 37
239 A 836 LYS K + 0 0 -94.0 104.4 179.6 136.8 55.2 141.1 0 0.0 0 0.0 0 0.0 0 0.0 4 28
240 A 837 TYR Y - 0 0 -139.7 167.6 -179.5 -72.4 55.1 154.3 238 -0.9 0 0.0 0 0.0 0 0.0 5 29
241 A 838 PRO P - 0 0 -64.8 145.6 178.7 -99.1 53.7 105.4 0 0.0 0 0.0 0 0.0 0 0.0 4 24
242 A 839 GLU E - 0 0 -60.7 142.8 -179.4 -95.4 55.2 112.3 0 0.0 0 0.0 0 0.0 0 0.0 4 25
243 A 840 MET M - 0 0 -64.7 147.6 179.0 -86.3 47.7 106.2 0 0.0 0 0.0 0 0.0 0 0.0 8 33
244 A 841 ASP D h > T - 0 0 -50.7 139.8 -180.0 -134.8 29.6 100.4 0 0.0 248 -2.3 0 0.0 0 0.0 7 28
245 A 842 LEU L H H > TS+ 0 0 -68.8 -32.8 180.0 50.0 106.9 32.9 0 0.0 249 -2.5 0 0.0 0 0.0 6 20
246 A 843 ASP D H H > TS+ 0 0 -71.3 -39.6 180.0 48.8 111.8 27.5 0 0.0 250 -2.8 0 0.0 0 0.0 6 23
247 A 844 SER S H H > TS+ 0 0 -65.7 -41.6 179.9 51.0 110.6 25.9 0 0.0 251 -2.3 0 0.0 0 0.0 10 35
248 A 845 ARG R H H X TS+ 0 0 -58.7 -58.2 179.7 43.9 113.4 10.8 244 -2.3 252 -2.4 0 0.0 0 0.0 10 38
249 A 846 ALA A H H X TS+ 0 0 -53.3 -45.9 179.3 56.3 110.1 27.3 245 -2.5 253 -2.1 0 0.0 0 0.0 8 27
250 A 847 PHE F H H X TS+ 0 0 -53.4 -46.2 -179.6 42.1 112.5 22.3 246 -2.8 254 -1.7 0 0.0 0 0.0 8 31
251 A 848 LEU L H H X TS+ 0 0 -72.1 -31.4 179.0 63.4 105.9 34.8 247 -2.3 255 -2.1 0 0.0 0 0.0 9 45
252 A 849 LYS K H H X TS+ 0 0 -58.0 -42.6 -179.6 43.9 107.5 23.6 248 -2.4 256 -1.1 0 0.0 0 0.0 10 38
253 A 850 ASP D H H < TS+ 0 0 -67.7 -46.2 -179.0 54.9 110.4 24.4 249 -2.1 0 0.0 0 0.0 0 0.0 7 30
254 A 851 TYR Y H H < TS+ 0 0 -59.2 -37.0 -179.1 37.6 114.6 34.1 250 -1.7 0 0.0 0 0.0 0 0.0 7 38
255 A 852 TYR Y H H X TS+ 0 0 -92.0 -15.3 -179.7 102.4 84.9 50.5 251 -2.1 259 -3.6 0 0.0 0 0.0 10 44
256 A 853 ARG R H H X TS+ 0 0 -31.8 -56.4 -179.5 38.0 90.4 34.0 252 -1.1 260 -1.3 0 0.0 0 0.0 10 33
257 A 854 ASP D H H > TS+ 0 0 -68.6 -41.3 178.6 52.5 114.7 28.7 0 0.0 261 -2.6 0 0.0 0 0.0 7 30
258 A 855 HIS H H H > TS+ 0 0 -59.1 -41.6 -179.8 49.1 111.9 24.6 0 0.0 262 -2.5 0 0.0 0 0.0 10 37
259 A 856 ASN N H H X TS+ 0 0 -68.1 -30.8 178.7 54.1 107.4 37.8 255 -3.6 263 -2.2 0 0.0 0 0.0 12 46
260 A 857 ILE I H H X TS+ 0 0 -67.9 -48.4 179.4 45.0 111.4 18.4 256 -1.3 264 -1.6 0 0.0 0 0.0 9 34
261 A 858 GLU E H H X TS+ 0 0 -60.3 -45.8 179.9 53.4 111.4 23.1 257 -2.6 265 -2.7 0 0.0 0 0.0 9 32
262 A 859 LEU L H H X TS+ 0 0 -54.8 -50.8 179.9 52.9 105.7 20.6 258 -2.5 266 -3.0 0 0.0 0 0.0 10 49
263 A 860 SER S H H X TS+ 0 0 -53.9 -38.7 179.2 45.6 112.6 30.9 259 -2.2 267 -1.7 0 0.0 0 0.0 10 42
264 A 861 LYS K H H X TS+ 0 0 -71.4 -45.2 -179.6 48.4 113.6 24.4 260 -1.6 268 -2.4 0 0.0 0 0.0 8 30
265 A 862 LEU L H H X TS+ 0 0 -61.0 -52.0 179.9 47.5 112.0 19.8 261 -2.7 269 -1.7 0 0.0 0 0.0 9 39
266 A 863 LEU L H H X >TS+ 0 0 -56.3 -50.3 179.2 51.6 111.3 18.9 262 -3.0 271 -2.4 0 0.0 270 -1.1 12 46
267 A 864 TYR Y H H < >5TS+ 0 0 -51.7 -47.6 -179.6 47.3 111.5 21.2 263 -1.7 270 -1.0 0 0.0 0 0.0 10 31
268 A 865 LYS K H H < 35TS+ 0 0 -66.1 -24.4 -179.8 51.6 111.4 40.3 264 -2.4 0 0.0 0 0.0 0 0.0 7 25
269 A 866 MET M H H < 35TS- 0 0 -87.6 -9.8 -179.7 -117.3 116.1 55.7 265 -1.7 0 0.0 0 0.0 0 0.0 7 36
270 A 867 GLY G T h < <5T + 0 0 79.4 23.3 179.3 141.3 67.5 42.4 266 -1.1 0 0.0 267 -1.0 0 0.0 7 29
271 A 868 GLN Q t > T - 0 0 -60.3 145.5 178.8 -121.5 20.4 104.9 0 0.0 278 -1.9 0 0.0 277 -0.6 11 46
275 A 872 THR T H H > 3 TS+ 0 0 -50.2 -50.9 179.5 52.7 115.0 24.0 0 0.0 279 -2.0 0 0.0 0 0.0 9 35
276 A 873 TRP W H H > 3 TS+ 0 0 -56.6 -33.3 -179.0 52.9 108.8 32.3 0 0.0 280 -2.2 0 0.0 0 0.0 9 42
277 A 874 LEU L H H > < TS+ 0 0 -72.4 -39.0 179.4 50.6 105.6 29.7 274 -0.6 281 -1.9 0 0.0 0 0.0 11 45
278 A 875 ARG R H H X TS+ 0 0 -65.6 -40.1 179.7 47.8 113.0 25.2 274 -1.9 282 -0.7 0 0.0 0 0.0 9 34
279 A 876 GLU E H H < > TS+ 0 0 -64.8 -50.7 -179.9 48.1 111.6 18.1 275 -2.0 282 -1.1 0 0.0 0 0.0 7 29
280 A 877 ASP D H H < 3 TS+ 0 0 -59.4 -33.2 -178.7 53.5 111.0 33.4 276 -2.2 0 0.0 0 0.0 0 0.0 8 33
281 A 878 LEU L H H < 3 T 0 0 -79.2 -14.6 179.8 999.9 999.9 51.0 277 -1.9 0 0.0 0 0.0 0 0.0 8 30
282 A 879 GLN Q h < < T 0 0 -84.3 999.9 999.9 999.9 999.9 129.9 279 -1.1 0 0.0 278 -0.7 0 0.0 4 18
1nstA.pdb
1NST SULFOTRANSFERASE MOL_ID: 1; MOL_ID: 1;
author author
Kabs/Sand TTSEEEEE TTSSHHHHHHHHHTSTTEEE BTTTBT SSSGGGGG HHHHHTTS EEEEE THHHH SSHHHHHHHH TT Kabs/Sand
chirality ----- ++--+------++-+++++++++++-++-------++-++--+++--++++--+++++++- +----+-+++++-+++++++++++++- chirality
bends SS S SSSS SSSSSSSSSSSS SSSSS SSSSSSSS SSSSSSSS SSSSS SSSSSSSSSS SS bends
turns TTTT TTTTTTTTTTTTTTTTTTT TTTTTTT TTTTTTTTTTTTTTT TTTTTTT TTTTTTTTTTTTT turns
5-turns 5-turns
3-turns >33< >33< >>333< >>>X<<< >>3<< >33< >33< 3-turns
bridge-2 bbb ccc bridge-2
bridge-1 a*aaa ccc A A aaaa bridge-1
sheets AAAAA AAA AAAAA sheets
4-turns >>>>XXX<<<< >444< >>>4<<< >>44<< >>>>XX<<<< 4-turns
summary tTTeEEEEEe tTTthHHHHHHHHHhtTeEEEe BTTTBTt SSgGGGGGhHHHHHhTt EEEEEehHHHHhShHHHHHHHHhTTt summary
sequence DPLWQDPCCDRFPKLLIIGPQKTGTTALYLFLGMHPDLSSNYPSSETFEEIQFFNGHNYHKGIDWYMEFFPISDFYFEKSANYFDSEVAPRRAAALLPKA sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand EEEEEE HHHHHHHHHHHHHHTT HHHHHS HHHHHT TT HHHHHHHHHHHGGG HHHHHHHHHTTS GGGEEEEEHHHHHH HHHHHHHHHHHHT Kabs/Sand
chirality --+--+--++++++++++++++-+-+++++--+++++++-++--++++++++++++++++++++++++++--+++-----++++++++++++++++++-- chirality
bends SSSSSSSSSSSSSSS SSSSSS SSSSSS SS SSSSSSSSSSSSS SSSSSSSSSSS SSS SSSSSS SSSSSSSSSSSS bends
turns TTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTT turns
5-turns >5555< >5555 5-turns
3-turns >33< >33< >33<>33< >>3<< >33< >>3<< >33< >33< 3-turns
bridge-2 ddddd bridge-2
bridge-1 bbb ddddd bridge-1
sheets AAAAAA AAAAA sheets
4-turns >>>>XXXXXXXX<<<< >>>4<<<>>>4<<< >>>>XXXXX<<<< >>>>XXX>>><<>>XXXXXX<<<< 4-turns
summary EEEEEE hHHHHHHHHHHHHHHhThHHHHHhhHHHHHhttTTthHHHHHHHHHHHhTThHHHHHHHHHhTtgGGeEEEEEHHHHHHhHHHHHHHHHHHHh summary
sequence KVLTILINPADRAYSWYQHQRAHDDPVALKYTFHEVITAGSDASSKLRALQNRCLVPGWYATHIERWLSAYHANQILVLDGKLLRTEPAKVMDMVQKFLG sequence
110 120 130 140 150 160 170 180 190 200
author author
Kabs/Sand SS SGGGEEEETTTTEEEEE STT EE TTSS HHHHHHHHHHHHHHHHHHHHHHHHHT HHHHHHH Kabs/Sand
chirality -+----++++----++-+-+--+---+------+++--+-----++++++++++++++++++++++++-+----++++++ chirality
bends SS SSSS SSSSS SSS SSSS SSSSSSSSSSSSSSSSSSSSSSSSS SSSSSS bends
turns T TTTTT TTTTTT TTTT TTTT TTTTTTTTTTTTTTTTTTTTTTTTTTTT TTTTTTTTT turns
5-turns < >5555< >5555< 5-turns
3-turns >>3<< >33< >33< >33< >33< >33< 3-turns
bridge-2 FF bridge-2
bridge-1 EEEE EEEE FF bridge-1
sheets BBBB BBBBB BB sheets
4-turns >444< >444< >>>>XXXXX<>XXXXXXXX<<<< >>>>X<<<< 4-turns
summary tSS gGGeEEEETTTTEEEEEetTTeEE tTTtS hHHHHHHHHHHHHHHHHHHHHHHHHHht hHHHHHHHh summary
sequence VTNTIDYHKTLAFDPKKGFWCQLLEGGKTKCLGKSKGRKYPEMDLDSRAFLKDYYRDHNIELSKLLYKMGQTLPTWLREDLQ sequence
210 220 230 240 250 260 270 280
Messages
chain break between 8(A 586 ) and 9(A 601 )
chain break between 72(A 664 ) and 73(A 670 )