Secondary structure calculation program - copyright by David Keith Smith, 1989
1ap7-.pdb
1AP7 CELL CYCLE INHIBITOR MOL_ID: 1; MOL_ID: 1;
Sequence length - 168
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 1 GLY G 0 0 999.9 -179.1 -180.0 999.9 999.9 999.9 0 0.0 0 0.0 0 0.0 0 0.0 3 5
2 2 SER S + 0 0 -113.6 144.5 179.9 10.6 999.9 151.4 0 0.0 0 0.0 0 0.0 0 0.0 3 5
3 3 MET M + 0 0 55.3 74.5 180.0 147.2 69.0 8.7 0 0.0 0 0.0 0 0.0 0 0.0 5 8
4 4 LEU L + 0 0 -112.9 -11.6 -179.9 65.9 55.9 60.3 0 0.0 6 -0.6 0 0.0 0 0.0 5 8
5 5 LEU L + 0 0 -119.0 106.8 179.9 165.9 59.0 156.7 0 0.0 0 0.0 0 0.0 0 0.0 4 11
6 6 GLU E + 0 0 -124.6 124.5 -179.9 161.1 12.0 167.9 4 -0.6 0 0.0 0 0.0 0 0.0 6 19
7 7 GLU E + 0 0 -134.7 47.8 180.0 88.5 54.5 105.7 0 0.0 0 0.0 0 0.0 0 0.0 6 24
8 8 VAL V t > > T + 0 0 -114.9 -26.2 179.8 86.4 59.5 51.4 0 0.0 12 -0.8 0 0.0 11 -0.8 10 27
9 9 CYS C T T 4 3 TS+ 0 0 -44.0 -36.9 179.8 35.4 104.6 33.3 0 0.0 0 0.0 0 0.0 0 0.0 7 30
10 10 VAL V T h > 3 TS+ 0 0 -92.0 -18.2 179.9 77.3 106.3 50.2 0 0.0 14 -1.3 0 0.0 0 0.0 11 34
11 11 GLY G H H > < TS+ 0 0 -53.6 -83.1 179.9 27.0 104.0 12.8 8 -0.8 15 -1.8 0 0.0 0 0.0 15 39
12 12 ASP D H H X >TS+ 0 0 -51.9 -29.9 180.0 83.7 108.6 37.0 8 -0.8 16 -5.0 40 -0.8 17 -0.6 14 40
13 13 ARG R H H > 5TS+ 0 0 -37.0 -76.8 179.9 16.4 108.9 24.9 0 0.0 17 -1.4 0 0.0 0 0.0 11 46
14 14 LEU L H H X 5TS+ 0 0 -72.3 -23.8 -179.8 63.7 125.7 41.8 10 -1.3 18 -2.6 0 0.0 0 0.0 15 57
15 15 SER S H H X 5TS+ 0 0 -65.6 -49.9 180.0 37.6 108.3 19.0 11 -1.8 19 -1.6 0 0.0 0 0.0 17 58
16 16 GLY G H H X 5TS+ 0 0 -72.7 -27.9 -179.9 52.1 118.4 37.8 12 -5.0 20 -1.4 0 0.0 0 0.0 12 46
17 17 ALA A H H X TS+ 0 0 -60.5 -36.8 -179.9 48.4 118.1 30.6 14 -2.6 52 -0.9 0 0.0 21 -0.6 19 58
19 19 ALA A H H < 3 TS+ 0 0 -73.2 -32.6 -180.0 60.2 103.4 34.3 15 -1.6 0 0.0 0 0.0 0 0.0 14 52
20 20 ARG R H H < 3 TS- 0 0 -71.0 -9.9 179.9 -117.5 115.5 53.2 16 -1.4 0 0.0 0 0.0 0 0.0 8 34
21 21 GLY G h < < T + 0 0 70.4 75.9 180.0 147.2 59.9 5.9 18 -0.6 0 0.0 17 -0.5 0 0.0 12 39
22 22 ASP D h > > T - 0 0 -144.7 85.6 180.0 -176.6 26.3 132.8 0 0.0 26 -2.6 0 0.0 25 -0.9 11 34
23 23 VAL V H H > 3 TS+ 0 0 -52.9 -22.8 179.9 61.8 88.5 42.1 0 0.0 27 -1.2 0 0.0 0 0.0 10 38
24 24 GLN Q H H > 3 TS+ 0 0 -70.7 -45.0 179.9 36.4 109.9 23.1 0 0.0 28 -2.0 0 0.0 0 0.0 6 31
25 25 GLU E H H > < TS+ 0 0 -73.0 -49.4 179.8 51.0 116.9 19.7 22 -0.9 29 -3.0 0 0.0 0 0.0 9 38
26 26 VAL V H H X TS+ 0 0 -57.9 -29.5 180.0 50.9 112.6 36.3 22 -2.6 30 -1.2 0 0.0 0 0.0 14 50
27 27 ARG R H H X TS+ 0 0 -72.0 -60.9 -179.9 32.2 118.4 11.0 23 -1.2 31 -2.0 0 0.0 0 0.0 10 38
28 28 ARG R H H X >TS+ 0 0 -69.2 -22.8 180.0 73.1 110.4 42.5 24 -2.0 33 -1.8 0 0.0 32 -1.6 9 30
29 29 LEU L H H < >TS+ 0 0 -54.4 -66.6 -179.9 20.0 112.9 10.8 25 -3.0 34 -1.4 0 0.0 35 -0.9 11 40
30 30 LEU L H H < 5TS+ 0 0 -72.3 -40.6 -179.8 55.4 125.7 27.5 26 -1.2 0 0.0 0 0.0 0 0.0 12 38
31 31 HIS H H H < 5TS- 0 0 -65.4 -19.6 -179.8 -2.1 138.2 45.1 27 -2.0 0 0.0 0 0.0 0 0.0 7 27
32 32 ARG R T h < 5TS+ 0 0 -133.0 -66.7 -180.0 47.2 136.2 58.8 28 -1.6 0 0.0 0 0.0 0 0.0 7 21
33 33 GLU E T T T - 0 0 -84.2 144.3 180.0 -138.7 11.8 125.7 0 0.0 39 -1.1 0 0.0 0 0.0 10 45
37 37 PRO P T T 3 TS+ 0 0 -72.1 -23.0 180.0 58.7 104.2 42.9 0 0.0 47 -0.7 0 0.0 0 0.0 12 51
38 38 ASP D T T 3 TS+ 0 0 -86.5 2.5 179.9 147.1 75.6 66.3 0 0.0 0 0.0 0 0.0 0 0.0 10 47
39 39 ALA A t < T - 0 0 -42.2 124.7 -179.8 -162.9 31.1 96.3 36 -1.1 0 0.0 0 0.0 0 0.0 16 45
40 40 LEU L - 0 0 -122.0 130.1 179.9 -133.0 10.1 165.8 0 0.0 12 -0.8 0 0.0 0 0.0 14 38
41 41 ASN N - 0 0 -66.2 -179.5 -180.0 -77.2 47.7 88.5 45 -1.1 0 0.0 0 0.0 0 0.0 13 32
42 42 ARG R S S S+ 0 0 -47.8 -43.3 180.0 44.9 135.1 28.6 0 0.0 0 0.0 0 0.0 0 0.0 7 23
43 43 PHE F S S S- 0 0 -65.9 -65.3 180.0 -101.7 120.5 5.7 0 0.0 0 0.0 0 0.0 0 0.0 5 25
44 44 GLY G + 0 0 140.5 47.1 -179.9 138.6 66.3 59.1 0 0.0 0 0.0 0 0.0 0 0.0 6 33
45 45 LYS K - 0 0 -116.4 151.1 180.0 -120.5 45.6 149.2 0 0.0 41 -1.1 0 0.0 0 0.0 10 43
46 46 THR T h > > T - 0 0 -85.1 162.1 -179.9 -108.1 29.1 115.4 0 0.0 50 -1.4 0 0.0 49 -0.5 15 55
47 47 ALA A H H > > TS+ 0 0 -53.8 -47.5 -179.9 50.2 122.6 23.8 37 -0.7 51 -3.9 0 0.0 50 -0.7 17 69
48 48 LEU L H H 4 3 TS+ 0 0 -62.8 -27.6 179.9 57.5 106.4 37.7 0 0.0 0 0.0 0 0.0 0 0.0 13 70
49 49 GLN Q H H 4 < TS+ 0 0 -73.0 -29.3 179.9 28.4 119.9 37.0 46 -0.5 0 0.0 0 0.0 0 0.0 11 60
50 50 VAL V H H < < TS+ 0 0 -101.6 -26.7 180.0 122.4 92.1 46.4 46 -1.4 0 0.0 47 -0.7 0 0.0 12 58
51 51 MET M h < T - 0 0 -36.6 143.0 -179.9 -144.2 57.7 87.3 47 -3.9 0 0.0 0 0.0 0 0.0 15 68
52 52 MET M - 0 0 -102.3 22.7 -180.0 -126.6 28.0 86.1 18 -0.9 0 0.0 0 0.0 0 0.0 9 52
53 53 PHE F S S S+ 0 0 36.6 31.4 180.0 127.3 74.0 39.5 0 0.0 91 -0.9 0 0.0 0 0.0 14 53
54 54 GLY G + 0 0 -76.9 -77.8 179.9 41.2 57.1 12.4 0 0.0 0 0.0 0 0.0 0 0.0 11 45
55 55 SER S S h > TS- 0 0 -77.9 121.0 179.9 -150.5 70.3 128.9 0 0.0 59 -1.2 0 0.0 0 0.0 11 41
56 56 PRO P H H > > TS+ 0 0 -55.5 -45.7 -180.0 51.7 98.7 25.1 0 0.0 60 -1.4 0 0.0 59 -0.6 10 42
57 57 ALA A H H > 3 TS+ 0 0 -63.2 -28.7 179.6 63.7 100.9 37.0 0 0.0 61 -2.1 0 0.0 0 0.0 8 43
58 58 VAL V H H > 3 TS+ 0 0 -63.0 -38.6 179.6 51.3 100.9 27.9 0 0.0 62 -2.0 0 0.0 0 0.0 15 57
59 59 ALA A H H X < TS+ 0 0 -63.3 -49.8 -180.0 45.6 111.2 19.3 55 -1.2 63 -2.4 56 -0.6 0 0.0 15 61
60 60 LEU L H H X TS+ 0 0 -63.2 -33.1 -180.0 58.3 109.2 33.6 56 -1.4 64 -1.9 0 0.0 0 0.0 10 48
61 61 GLU E H H X TS+ 0 0 -62.5 -49.1 179.8 41.3 110.1 19.4 57 -2.1 65 -0.9 0 0.0 0 0.0 11 51
62 62 LEU L H H X > TS+ 0 0 -63.0 -56.3 179.9 41.0 120.9 13.6 58 -2.0 65 -1.3 0 0.0 66 -1.2 14 66
63 63 LEU L H H < 3 TS+ 0 0 -63.4 -25.7 -179.9 69.3 105.1 39.8 59 -2.4 0 0.0 0 0.0 0 0.0 12 53
64 64 LYS K H H < 3 TS+ 0 0 -62.8 -29.8 180.0 45.0 102.8 36.1 60 -1.9 0 0.0 0 0.0 0 0.0 7 38
65 65 GLN Q H H < < TS- 0 0 -76.9 -73.2 -180.0 -81.1 125.8 11.2 62 -1.3 0 0.0 61 -0.9 0 0.0 9 35
66 66 GLY G h < T + 0 0 162.9 63.0 -180.0 153.5 64.4 80.0 62 -1.2 0 0.0 0 0.0 0 0.0 8 33
67 67 ALA A - 0 0 -107.5 153.3 179.9 -121.5 43.5 139.9 0 0.0 0 0.0 0 0.0 0 0.0 11 43
68 68 SER S - 0 0 -96.6 99.2 180.0 -174.1 20.9 142.2 0 0.0 0 0.0 0 0.0 0 0.0 7 39
69 69 PRO P + 0 0 -64.3 -15.8 -180.0 92.6 67.5 48.5 0 0.0 71 -2.3 0 0.0 0 0.0 12 55
70 70 ASN N + 0 0 -79.7 65.9 -179.9 129.0 60.2 114.9 0 0.0 0 0.0 0 0.0 0 0.0 7 40
71 71 VAL V - 0 0 -126.4 138.1 180.0 -177.1 33.3 166.6 69 -2.3 0 0.0 0 0.0 0 0.0 10 45
72 72 GLN Q + 0 0 -134.4 146.5 -179.9 173.7 3.6 168.1 0 0.0 0 0.0 0 0.0 0 0.0 9 39
73 73 ASP D t > T - 0 0 -153.1 143.0 -179.9 -0.7 57.5 172.1 0 0.0 77 -1.2 0 0.0 0 0.0 7 31
74 74 ALA A T T 4 TS+ 0 0 40.9 97.6 179.9 6.3 140.2 26.9 0 0.0 0 0.0 0 0.0 0 0.0 5 23
75 75 SER S T T 4 TS- 0 0 73.7 30.7 179.9 -82.6 122.6 36.0 0 0.0 0 0.0 0 0.0 0 0.0 8 23
76 76 GLY G T T 4 TS+ 0 0 37.2 62.8 180.0 163.8 76.6 27.1 0 0.0 78 -0.6 0 0.0 0 0.0 9 34
77 77 THR T t < T + 0 0 -114.9 102.1 -180.0 178.1 10.3 152.6 73 -1.2 0 0.0 0 0.0 0 0.0 13 43
78 78 SER S h > T - 0 0 -89.8 -174.6 -179.7 -81.2 49.7 100.8 76 -0.6 82 -1.8 0 0.0 0 0.0 13 51
79 79 PRO P H H > TS+ 0 0 -55.6 -41.6 -179.8 52.9 129.7 29.0 0 0.0 83 -2.9 0 0.0 0 0.0 13 68
80 80 VAL V H H > TS+ 0 0 -62.9 -41.3 -179.9 54.4 105.5 26.8 0 0.0 84 -1.7 0 0.0 0 0.0 13 67
81 81 HIS H H H > TS+ 0 0 -58.1 -51.4 -179.9 37.5 115.6 19.2 0 0.0 85 -1.9 0 0.0 0 0.0 14 62
82 82 ASP D H H X TS+ 0 0 -66.6 -50.4 -179.7 56.3 112.6 18.9 78 -1.8 86 -3.4 0 0.0 0 0.0 9 59
83 83 ALA A H H X >TS+ 0 0 -52.4 -30.4 -179.7 49.2 110.7 37.0 79 -2.9 88 -1.7 0 0.0 87 -1.4 14 69
84 84 ALA A H H < 5TS+ 0 0 -73.4 -67.1 -179.4 31.9 118.5 8.2 80 -1.7 0 0.0 0 0.0 0 0.0 17 59
85 85 ARG R H H < 5TS+ 0 0 -62.3 -29.5 -179.7 57.3 119.6 37.2 81 -1.9 0 0.0 0 0.0 0 0.0 10 47
86 86 THR T H H < 5TS- 0 0 -67.0 -54.1 -179.7 -119.4 109.3 15.1 82 -3.4 0 0.0 0 0.0 0 0.0 6 41
87 87 GLY G T h < 5T + 0 0 110.4 66.0 -179.9 131.9 64.3 38.6 83 -1.4 0 0.0 0 0.0 0 0.0 8 40
88 88 PHE F h > TS+ 0 0 -52.2 -19.1 179.8 69.3 71.9 45.2 0 0.0 93 -1.6 0 0.0 0 0.0 11 49
90 90 ASP D H H > TS+ 0 0 -63.5 -72.3 179.7 16.6 115.6 1.3 0 0.0 94 -1.1 0 0.0 0 0.0 10 39
91 91 THR T H H > TS+ 0 0 -73.1 -24.1 179.8 70.3 121.1 41.3 53 -0.9 95 -2.1 0 0.0 0 0.0 14 53
92 92 LEU L H H X TS+ 0 0 -56.2 -59.8 -179.8 41.2 101.1 13.9 88 -3.1 96 -4.0 0 0.0 0 0.0 13 61
93 93 LYS K H H X TS+ 0 0 -58.3 -38.0 -179.9 62.8 109.2 29.5 89 -1.6 97 -3.3 0 0.0 0 0.0 10 52
94 94 VAL V H H X TS+ 0 0 -51.7 -61.2 179.5 20.9 120.9 14.0 90 -1.1 98 -1.6 0 0.0 0 0.0 11 40
95 95 LEU L H H X >TS+ 0 0 -74.8 -43.5 179.9 58.3 123.1 24.7 91 -2.1 99 -2.6 0 0.0 100 -1.5 12 55
96 96 VAL V H H < 5TS+ 0 0 -52.5 -42.6 179.9 41.2 112.8 26.9 92 -4.0 0 0.0 0 0.0 0 0.0 12 61
97 97 GLU E H H < 5TS+ 0 0 -73.5 -39.5 -179.7 58.4 110.2 29.4 93 -3.3 0 0.0 0 0.0 0 0.0 9 40
98 98 HIS H H H < 5TS- 0 0 -56.3 -51.9 -179.8 -73.2 134.3 19.8 94 -1.6 0 0.0 0 0.0 0 0.0 7 37
99 99 GLY G T h < 5TS+ 0 0 178.8 -27.0 -179.7 155.5 72.8 74.9 95 -2.6 0 0.0 0 0.0 0 0.0 8 36
100 100 ALA A t > T - 0 0 -65.3 143.8 180.0 -110.5 25.3 110.4 109 -0.6 114 -1.7 0 0.0 115 -1.1 17 58
112 112 PRO P H H > 3 TS+ 0 0 -45.2 -26.1 179.7 59.6 120.9 41.4 0 0.0 116 -1.2 0 0.0 0 0.0 17 68
113 113 ILE I H H > 3 TS+ 0 0 -72.1 -40.0 -180.0 61.2 94.4 27.8 0 0.0 117 -2.0 0 0.0 0 0.0 13 71
114 114 HIS H H H > < TS+ 0 0 -53.0 -46.0 179.7 51.3 103.1 24.4 111 -1.7 118 -1.9 0 0.0 0 0.0 13 65
115 115 LEU L H H X TS+ 0 0 -58.8 -44.2 179.6 52.7 107.3 23.8 111 -1.1 119 -0.8 0 0.0 0 0.0 12 66
116 116 ALA A H H X >TS+ 0 0 -60.0 -35.6 179.6 54.6 106.6 30.5 112 -1.2 120 -2.5 0 0.0 121 -0.8 14 63
117 117 ILE I H H < 5TS+ 0 0 -64.5 -43.6 179.8 47.7 107.6 24.2 113 -2.0 0 0.0 0 0.0 0 0.0 14 55
118 118 ARG R H H < 5TS+ 0 0 -73.3 -10.1 179.9 53.3 113.5 53.4 114 -1.9 0 0.0 0 0.0 0 0.0 10 46
119 119 GLU E H H < 5TS- 0 0 -88.0 -59.8 180.0 -140.1 93.2 21.3 115 -0.8 0 0.0 0 0.0 0 0.0 9 40
120 120 GLY G T h < 5T + 0 0 103.1 25.2 -180.0 149.6 45.7 46.3 116 -2.5 0 0.0 0 0.0 0 0.0 13 40
121 121 HIS H t TS+ 0 0 70.5 -68.4 -180.0 44.0 85.4 111.3 0 0.0 126 -1.8 0 0.0 0 0.0 9 45
123 123 SER S H H > TS+ 0 0 -70.6 -52.9 180.0 47.8 114.2 16.8 121 -3.0 127 -2.7 0 0.0 0 0.0 7 44
124 124 VAL V H H > TS+ 0 0 -52.8 -55.9 180.0 46.1 114.7 18.0 0 0.0 128 -4.3 0 0.0 0 0.0 13 54
125 125 VAL V H H > TS+ 0 0 -52.0 -61.3 -179.9 41.2 117.7 15.4 0 0.0 129 -1.2 0 0.0 0 0.0 16 62
126 126 SER S H H < TS+ 0 0 -58.0 -30.4 180.0 49.5 119.4 35.7 122 -1.8 0 0.0 0 0.0 0 0.0 11 57
127 127 PHE F H H X TS+ 0 0 -73.3 -55.4 -179.8 45.7 110.1 15.7 123 -2.7 131 -1.2 0 0.0 0 0.0 10 57
128 128 LEU L H H < TS+ 0 0 -63.9 -11.7 179.9 80.9 99.5 51.3 124 -4.3 0 0.0 0 0.0 0 0.0 13 68
129 129 ALA A T h < > TS+ 0 0 -57.6 -70.2 179.9 23.1 104.5 7.0 125 -1.2 132 -0.8 0 0.0 0 0.0 14 60
130 130 PRO P T T 4 3 TS+ 0 0 -71.5 -17.9 -179.9 69.3 116.7 47.1 0 0.0 0 0.0 0 0.0 0 0.0 11 48
131 131 GLU E T T < 3 TS+ 0 0 -90.6 31.0 179.9 44.2 104.2 91.7 127 -1.2 0 0.0 0 0.0 0 0.0 11 51
132 132 SER S S t < TS- 0 0 -152.1 -168.6 -179.9 -48.6 112.2 144.1 129 -0.8 134 -1.8 0 0.0 0 0.0 11 54
133 133 ASP D - 0 0 -77.1 83.8 180.0 -161.8 48.4 123.1 0 0.0 135 -4.1 0 0.0 0 0.0 9 45
134 134 LEU L S S S+ 0 0 -65.0 61.0 -180.0 33.9 84.5 104.4 132 -1.8 0 0.0 0 0.0 0 0.0 10 43
135 135 HIS H S S S+ 0 0 -175.1 -49.7 -180.0 99.6 87.9 84.3 133 -4.1 0 0.0 0 0.0 0 0.0 6 38
136 136 HIS H - 0 0 -54.9 155.0 179.9 -161.4 52.7 96.3 0 0.0 0 0.0 0 0.0 0 0.0 7 36
137 137 ARG R - 0 0 -140.7 158.3 179.8 -90.8 23.0 163.2 0 0.0 0 0.0 0 0.0 0 0.0 12 39
138 138 ASP D t > T - 0 0 -64.2 158.7 179.4 -102.9 44.9 101.5 142 -2.2 141 -1.1 0 0.0 0 0.0 12 33
139 139 ALA A T T 3 TS+ 0 0 -54.7 -19.7 179.7 66.8 122.4 43.3 0 0.0 0 0.0 0 0.0 0 0.0 8 22
140 140 SER S T T 3 TS- 0 0 -67.9 -46.2 -179.9 -103.3 120.5 23.1 0 0.0 0 0.0 0 0.0 0 0.0 5 24
141 141 GLY G S t < TS+ 0 0 125.1 32.3 -179.9 118.2 77.9 51.8 138 -1.1 0 0.0 0 0.0 0 0.0 6 21
142 142 LEU L - 0 0 -129.2 146.3 179.9 -164.8 38.3 163.8 0 0.0 138 -2.2 0 0.0 0 0.0 10 34
143 143 THR T h > T - 0 0 -115.8 -174.3 180.0 -74.1 48.4 120.2 0 0.0 147 -3.3 0 0.0 0 0.0 12 48
144 144 PRO P H H > TS+ 0 0 -48.7 -43.7 180.0 40.0 134.9 28.9 0 0.0 148 -1.0 0 0.0 0 0.0 15 59
145 145 LEU L H H > TS+ 0 0 -73.2 -47.9 -179.8 48.0 117.3 21.6 0 0.0 149 -1.3 0 0.0 0 0.0 11 51
146 146 GLU E H H > > TS+ 0 0 -57.5 -57.5 179.8 48.6 111.3 14.5 0 0.0 149 -1.4 0 0.0 150 -1.3 9 41
147 147 LEU L H H X 3 TS+ 0 0 -52.3 -34.3 179.4 59.3 107.0 32.2 143 -3.3 151 -1.6 0 0.0 0 0.0 13 48
148 148 ALA A H H < 3 TS+ 0 0 -63.8 -33.0 179.3 54.5 100.8 32.4 144 -1.0 157 -0.6 0 0.0 0 0.0 14 50
149 149 ARG R H H < < TS+ 0 0 -69.6 -30.2 179.3 49.3 110.1 35.2 146 -1.4 0 0.0 145 -1.3 0 0.0 9 34
150 150 GLN Q H H < TS+ 0 0 -70.4 -80.1 178.6 37.0 114.5 10.7 146 -1.3 152 -2.7 0 0.0 0 0.0 7 33
151 151 ARG R S h < TS+ 0 0 -74.2 71.9 -179.2 178.2 75.5 115.8 147 -1.6 153 -2.3 0 0.0 0 0.0 11 32
152 152 GLY G + 0 0 -72.5 46.2 179.3 159.6 14.3 98.2 150 -2.7 0 0.0 0 0.0 0 0.0 10 31
153 153 ALA A S S S- 0 0 -36.8 -32.8 179.7 -58.7 74.4 37.4 151 -2.3 0 0.0 0 0.0 0 0.0 7 29
154 154 GLN Q S S S- 0 0 -179.7 -143.7 178.7 -4.9 110.5 147.6 0 0.0 156 -4.0 0 0.0 0 0.0 6 27
155 155 ASN N S h > TS+ 0 0 -68.8 57.2 -179.5 133.0 87.0 102.8 0 0.0 159 -1.4 0 0.0 0 0.0 7 33
156 156 LEU L H H > > T + 0 0 -71.5 -69.8 -180.0 40.8 68.9 6.0 154 -4.0 160 -1.7 0 0.0 159 -0.9 16 39
157 157 MET M H H > 3 TS+ 0 0 -52.7 -19.5 -179.9 62.4 113.3 45.0 148 -0.6 161 -1.2 0 0.0 0 0.0 13 44
158 158 ASP D H H > 3 TS+ 0 0 -73.6 -47.3 -179.7 45.1 102.4 22.3 0 0.0 162 -1.9 0 0.0 0 0.0 9 34
159 159 ILE I H H X < TS+ 0 0 -62.1 -50.6 -179.8 40.6 119.5 18.9 155 -1.4 163 -2.0 156 -0.9 0 0.0 9 41
160 160 LEU L H H X TS+ 0 0 -68.3 -30.0 -180.0 61.3 110.2 36.4 156 -1.7 164 -1.6 0 0.0 0 0.0 14 50
161 161 GLN Q H H X TS+ 0 0 -63.5 -42.9 -180.0 41.1 108.9 24.8 157 -1.2 165 -0.8 0 0.0 0 0.0 9 39
162 162 GLY G H H < TS+ 0 0 -71.2 -47.8 -179.8 42.8 119.1 20.7 158 -1.9 0 0.0 0 0.0 0 0.0 8 27
163 163 HIS H H H < TS+ 0 0 -71.1 -20.0 179.9 83.3 97.7 44.8 159 -2.0 0 0.0 0 0.0 0 0.0 8 32
164 164 MET M H H < TS- 0 0 -45.7 -70.0 -179.9 -113.1 101.6 17.4 160 -1.6 0 0.0 0 0.0 0 0.0 9 33
165 165 MET M h < T + 0 0 169.1 -77.2 179.9 172.0 43.2 110.8 161 -0.8 0 0.0 0 0.0 0 0.0 6 22
166 166 ILE I - 0 0 35.4 77.7 -180.0 -172.8 11.4 26.5 0 0.0 0 0.0 0 0.0 0 0.0 5 16
167 167 PRO P 0 0 -78.8 7.4 -179.9 999.9 999.9 70.0 0 0.0 0 0.0 0 0.0 0 0.0 3 8
168 168 MET M 0 0 -126.3 999.9 999.9 999.9 999.9 56.8 0 0.0 0 0.0 0 0.0 0 0.0 2 7
1ap7-.pdb
1AP7 CELL CYCLE INHIBITOR MOL_ID: 1; MOL_ID: 1;
author author
Kabs/Sand TTHHHHHHHHHH HHHHHHHHHTT TT SS HHHH S SHHHHHHHHHH TTT HHHHHHHHT HHHHHHHHHHT Kabs/Sand
chirality ++++++++++++++++++-+-++++++++-+----++---+-+--++++--++-+++++++++-+--++-+-+-++-+++++++-+++++++++++-+- chirality
bends SSSSSSSSSSSS SSSSSSSSSSS SS SS SSSS S SSSSSSSSSSS SSS SSSSSSSS SSSSSSSSSSS bends
turns TTTTTTTTTTTTTTTTTTTTTTTTTTT TTTT TTTTTT TTTTTTTTTTTT TTTTTTTTTTTTTTTTTTTTTTTTTTTT turns
5-turns >5555< >>555<< >5555< >5555< 5-turns
3-turns >33< >33<>33< >33< >>3<< >33< >33< 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns >4>>X>XXXX<<<<>>>>XXX<<<< >>44<< >>>>XXXX<<<< >444<>>>>XX<<<<>>>>XXXX<<<< 4-turns
summary tThHHHHHHHHHHhhHHHHHHHHHhTt tTTt SS hHHHHh S hHHHHHHHHHHh tTTTthHHHHHHHHhhHHHHHHHHHHht summary
sequence GSMLLEEVCVGDRLSGAAARGDVQEVRRLLHRELVHPDALNRFGKTALQVMMFGSPAVALELLKQGASPNVQDASGTSPVHDAARTGFLDTLKVLVEHGA sequence
10 20 30 40 50 60 70 80 90 100
author author
Kabs/Sand S SS HHHHHHHHT SHHHHHHTTTS SS TTS HHHHHHHS SSSHHHHHHHHH Kabs/Sand
chirality +++---+-+--+++++++-+-++++++++++--++---+-+--+++++++++--+++++++++-+- chirality
bends S SS SSSSSSSS SSSSSSSSSSS SS SSS SSSSSSSS SSS SSSSSSSS bends
turns TTTTTTTTTTTTTTTTTTTTTT TTTT TTTTTTTTT TTTTTTTTTTT turns
5-turns >5555< 5-turns
3-turns >33< >33< >33< >33< >33< 3-turns
bridge-2 bridge-2
bridge-1 bridge-1
sheets sheets
4-turns >>>>XX<<<< >>>>>>>X<<<< >>>>XXX<<<< 4-turns
summary S SS hHHHHHHHHhthHHHHHHhTTt SS tTTt hHHHHHHHh SShHHHHHHHHHh summary
sequence DVNALDSTGSLPIHLAIREGHSSVVSFLAPESDLHHRDASGLTPLELARQRGAQNLMDILQGHMMIPM sequence
110 120 130 140 150 160