forked from fuentesdt/MembraneProtein
-
Notifications
You must be signed in to change notification settings - Fork 0
/
Copy pathKALP-15_processed.gro
141 lines (141 loc) · 6.12 KB
/
KALP-15_processed.gro
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
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
frame t= 1.000
138
1ACE CA 1 -0.345 -0.568 -1.870
1ACE C 2 -0.443 -0.520 -1.764
1ACE O 3 -0.417 -0.531 -1.645
2GLY N 4 -0.566 -0.489 -1.807
2GLY H 5 -0.587 -0.498 -1.904
2GLY CA 6 -0.669 -0.443 -1.716
2GLY C 7 -0.706 -0.551 -1.617
2GLY O 8 -0.706 -0.529 -1.496
3LYS N 9 -0.712 -0.676 -1.667
3LYS H 10 -0.693 -0.691 -1.764
3LYS CA 11 -0.746 -0.790 -1.583
3LYS CB 12 -0.764 -0.915 -1.668
3LYS CG 13 -0.885 -0.910 -1.761
3LYS CD 14 -0.897 -1.038 -1.843
3LYS CE 15 -1.017 -1.033 -1.935
3LYS NZ 16 -1.031 -1.157 -2.016
3LYS HZ1 17 -1.111 -1.149 -2.075
3LYS HZ2 18 -0.949 -1.169 -2.072
3LYS HZ3 19 -1.042 -1.236 -1.955
3LYS C 20 -0.638 -0.811 -1.479
3LYS O 21 -0.667 -0.821 -1.360
4LYS N 22 -0.512 -0.794 -1.519
4LYS H 23 -0.495 -0.768 -1.614
4LYS CA 24 -0.398 -0.812 -1.430
4LYS CB 25 -0.267 -0.804 -1.508
4LYS CG 26 -0.246 -0.920 -1.605
4LYS CD 27 -0.114 -0.906 -1.678
4LYS CE 28 -0.092 -1.022 -1.775
4LYS NZ 29 0.037 -1.010 -1.847
4LYS HZ1 30 0.048 -1.087 -1.909
4LYS HZ2 31 0.038 -0.925 -1.899
4LYS HZ3 32 0.112 -1.010 -1.781
4LYS C 33 -0.402 -0.706 -1.320
4LYS O 34 -0.395 -0.739 -1.202
5LEU N 35 -0.438 -0.583 -1.358
5LEU H 36 -0.460 -0.566 -1.454
5LEU CA 37 -0.446 -0.473 -1.264
5LEU CB 38 -0.471 -0.342 -1.337
5LEU CG 39 -0.360 -0.294 -1.432
5LEU CD1 40 -0.403 -0.170 -1.508
5LEU CD2 41 -0.234 -0.259 -1.353
5LEU C 42 -0.555 -0.500 -1.161
5LEU O 43 -0.531 -0.492 -1.041
6ALA N 44 -0.667 -0.554 -1.209
6ALA H 45 -0.674 -0.574 -1.307
6ALA CA 46 -0.780 -0.584 -1.122
6ALA CB 47 -0.902 -0.628 -1.204
6ALA C 48 -0.741 -0.692 -1.021
6ALA O 49 -0.760 -0.675 -0.901
7LEU N 50 -0.665 -0.791 -1.069
7LEU H 51 -0.638 -0.790 -1.165
7LEU CA 52 -0.621 -0.900 -0.984
7LEU CB 53 -0.552 -1.008 -1.068
7LEU CG 54 -0.640 -1.082 -1.170
7LEU CD1 55 -0.556 -1.176 -1.256
7LEU CD2 56 -0.746 -1.165 -1.099
7LEU C 57 -0.528 -0.848 -0.876
7LEU O 58 -0.548 -0.876 -0.758
8ALA N 59 -0.440 -0.755 -0.914
8ALA H 60 -0.440 -0.725 -1.009
8ALA CA 61 -0.345 -0.697 -0.821
8ALA CB 62 -0.245 -0.607 -0.896
8ALA C 63 -0.419 -0.619 -0.713
8ALA O 64 -0.395 -0.640 -0.594
9LEU N 65 -0.523 -0.547 -0.754
9LEU H 66 -0.547 -0.548 -0.851
9LEU CA 67 -0.603 -0.467 -0.663
9LEU CB 68 -0.704 -0.382 -0.738
9LEU CG 69 -0.646 -0.274 -0.830
9LEU CD1 70 -0.756 -0.207 -0.911
9LEU CD2 71 -0.574 -0.167 -0.749
9LEU C 72 -0.673 -0.558 -0.563
9LEU O 73 -0.663 -0.537 -0.442
10ALA N 74 -0.724 -0.671 -0.611
10ALA H 75 -0.714 -0.690 -0.709
10ALA CA 76 -0.793 -0.767 -0.528
10ALA CB 77 -0.856 -0.879 -0.613
10ALA C 78 -0.698 -0.825 -0.424
10ALA O 79 -0.727 -0.825 -0.305
11LEU N 80 -0.574 -0.854 -0.468
11LEU H 81 -0.551 -0.837 -0.564
11LEU CA 82 -0.473 -0.910 -0.380
11LEU CB 83 -0.349 -0.948 -0.461
11LEU CG 84 -0.366 -1.061 -0.563
11LEU CD1 85 -0.239 -1.079 -0.645
11LEU CD2 86 -0.397 -1.192 -0.494
11LEU C 87 -0.438 -0.810 -0.271
11LEU O 88 -0.441 -0.844 -0.152
12ALA N 89 -0.429 -0.682 -0.308
12ALA H 90 -0.445 -0.658 -0.404
12ALA CA 91 -0.397 -0.578 -0.214
12ALA CB 92 -0.376 -0.444 -0.286
12ALA C 93 -0.506 -0.565 -0.109
12ALA O 94 -0.479 -0.567 0.010
13LEU N 95 -0.632 -0.576 -0.154
13LEU H 96 -0.647 -0.592 -0.252
13LEU CA 97 -0.746 -0.566 -0.066
13LEU CB 98 -0.876 -0.565 -0.146
13LEU CG 99 -0.898 -0.444 -0.238
13LEU CD1 100 -1.023 -0.462 -0.322
13LEU CD2 101 -0.914 -0.316 -0.157
13LEU C 102 -0.746 -0.681 0.034
13LEU O 103 -0.755 -0.659 0.154
14LYS N 104 -0.710 -0.800 -0.015
14LYS H 105 -0.686 -0.808 -0.112
14LYS CA 106 -0.705 -0.918 0.069
14LYS CB 107 -0.680 -1.043 -0.015
14LYS CG 108 -0.794 -1.079 -0.110
14LYS CD 109 -0.762 -1.203 -0.191
14LYS CE 110 -0.876 -1.239 -0.286
14LYS NZ 111 -0.846 -1.361 -0.366
14LYS HZ1 112 -0.923 -1.381 -0.427
14LYS HZ2 113 -0.764 -1.346 -0.421
14LYS HZ3 114 -0.831 -1.438 -0.304
14LYS C 115 -0.598 -0.903 0.175
14LYS O 116 -0.625 -0.922 0.294
15LYS N 117 -0.485 -0.845 0.136
15LYS H 118 -0.477 -0.814 0.041
15LYS CA 119 -0.373 -0.825 0.227
15LYS CB 120 -0.251 -0.774 0.152
15LYS CG 121 -0.190 -0.877 0.056
15LYS CD 122 -0.069 -0.821 -0.016
15LYS CE 123 -0.009 -0.922 -0.111
15LYS NZ 124 0.110 -0.868 -0.182
15LYS HZ1 125 0.147 -0.938 -0.244
15LYS HZ2 126 0.084 -0.787 -0.235
15LYS HZ3 127 0.180 -0.843 -0.115
15LYS C 128 -0.413 -0.726 0.336
15LYS O 129 -0.397 -0.755 0.455
16ALA N 130 -0.487 -0.623 0.298
16ALA H 131 -0.513 -0.615 0.202
16ALA CA 132 -0.532 -0.521 0.391
16ALA CB 133 -0.599 -0.404 0.316
16ALA C 134 -0.629 -0.582 0.492
16ALA O 135 -0.610 -0.567 0.612
17NH2 N 136 -0.715 -0.670 0.443
17NH2 H1 137 -0.713 -0.692 0.346
17NH2 H2 138 -0.781 -0.714 0.503
2.34310 1.59650 1.94500