Vicilin Ana o 1.0101 leader sequence residues 20-75
ID | Type | Value order | Atom ID 1 | Atom ID 2 |
---|---|---|---|---|
1 | disulfide | sing | 1:CYS16:SG | 1:CYS38:SG |
2 | disulfide | sing | 1:CYS20:SG | 1:CYS34:SG |
ID | Entity ID | Seq ID | Comp ID | Atom ID | Atom type | Val | Val err | Ambig. code |
---|---|---|---|---|---|---|---|---|
1 | 1 | 5 | ALA | HA | H | 4.2797 | 0.0000 | 1 |
2 | 1 | 5 | ALA | HB1 | H | 1.3909 | 0.0000 | 1 |
3 | 1 | 5 | ALA | HB2 | H | 1.3909 | 0.0000 | 1 |
4 | 1 | 5 | ALA | HB3 | H | 1.3909 | 0.0000 | 1 |
5 | 1 | 5 | ALA | CA | C | 52.4611 | 0.0000 | 1 |
6 | 1 | 5 | ALA | CB | C | 19.2055 | 0.0000 | 1 |
7 | 1 | 6 | LEU | H | H | 8.0243 | 0.0000 | 1 |
8 | 1 | 6 | LEU | HA | H | 4.2914 | 0.0000 | 1 |
9 | 1 | 6 | LEU | HB2 | H | 1.6697 | 0.0000 | 2 |
10 | 1 | 6 | LEU | HB3 | H | 1.5864 | 0.0000 | 2 |
11 | 1 | 6 | LEU | HG | H | 1.5992 | 0.0000 | 1 |
12 | 1 | 6 | LEU | HD11 | H | 1.3218 | 0.0000 | 2 |
13 | 1 | 6 | LEU | HD12 | H | 1.3218 | 0.0000 | 2 |
14 | 1 | 6 | LEU | HD13 | H | 1.3218 | 0.0000 | 2 |
15 | 1 | 6 | LEU | CA | C | 55.1427 | 0.0000 | 1 |
16 | 1 | 6 | LEU | CB | C | 42.3068 | 0.0000 | 1 |
17 | 1 | 6 | LEU | CG | C | 26.8990 | 0.0000 | 1 |
18 | 1 | 6 | LEU | CD1 | C | 24.8718 | 0.0000 | 2 |
19 | 1 | 6 | LEU | N | N | 121.8867 | 0.0000 | 1 |
20 | 1 | 7 | ALA | H | H | 8.1101 | 0.0000 | 1 |
21 | 1 | 7 | ALA | HA | H | 4.2202 | 0.0000 | 1 |
22 | 1 | 7 | ALA | HB1 | H | 1.4697 | 0.0000 | 1 |
23 | 1 | 7 | ALA | HB2 | H | 1.4697 | 0.0000 | 1 |
24 | 1 | 7 | ALA | HB3 | H | 1.4697 | 0.0000 | 1 |
25 | 1 | 7 | ALA | CA | C | 52.4967 | 0.0000 | 1 |
26 | 1 | 7 | ALA | CB | C | 19.1913 | 0.0000 | 1 |
27 | 1 | 7 | ALA | N | N | 125.0569 | 0.0000 | 1 |
28 | 1 | 8 | LYS | H | H | 8.2400 | 0.0000 | 1 |
29 | 1 | 8 | LYS | HA | H | 4.3066 | 0.0000 | 1 |
30 | 1 | 8 | LYS | HB2 | H | 1.7492 | 0.0000 | 2 |
31 | 1 | 8 | LYS | HB3 | H | 1.8240 | 0.0000 | 2 |
32 | 1 | 8 | LYS | HG2 | H | 1.4075 | 0.0000 | 2 |
33 | 1 | 8 | LYS | HE2 | H | 3.1854 | 0.0000 | 2 |
34 | 1 | 8 | LYS | CA | C | 56.2555 | 0.0000 | 1 |
35 | 1 | 8 | LYS | CB | C | 32.9965 | 0.0000 | 1 |
36 | 1 | 8 | LYS | CG | C | 24.6955 | 0.0000 | 1 |
37 | 1 | 8 | LYS | CE | C | 43.4081 | 0.0000 | 1 |
38 | 1 | 8 | LYS | N | N | 122.0847 | 0.0000 | 1 |
39 | 1 | 9 | ILE | H | H | 7.9726 | 0.0000 | 1 |
40 | 1 | 9 | ILE | HA | H | 4.1753 | 0.0000 | 1 |
41 | 1 | 9 | ILE | HB | H | 1.8292 | 0.0000 | 1 |
42 | 1 | 9 | ILE | HG12 | H | 1.2046 | 0.0000 | 2 |
43 | 1 | 9 | ILE | HG13 | H | 1.4849 | 0.0000 | 2 |
44 | 1 | 9 | ILE | HD11 | H | 0.8763 | 0.0000 | 1 |
45 | 1 | 9 | ILE | HD12 | H | 0.8763 | 0.0000 | 1 |
46 | 1 | 9 | ILE | HD13 | H | 0.8763 | 0.0000 | 1 |
47 | 1 | 9 | ILE | CA | C | 60.4261 | 0.0000 | 1 |
48 | 1 | 9 | ILE | CB | C | 38.8992 | 0.0000 | 1 |
49 | 1 | 9 | ILE | CG1 | C | 27.2588 | 0.0000 | 1 |
50 | 1 | 9 | ILE | CG2 | C | 17.3870 | 0.0000 | 1 |
51 | 1 | 9 | ILE | CD1 | C | 17.3870 | 0.0000 | 1 |
52 | 1 | 9 | ILE | N | N | 122.0635 | 0.0000 | 1 |
53 | 1 | 10 | ASP | CA | C | 52.3140 | 0.0000 | 1 |
54 | 1 | 10 | ASP | CB | C | 41.1597 | 0.0000 | 1 |
55 | 1 | 11 | PRO | HA | H | 4.4109 | 0.0000 | 1 |
56 | 1 | 11 | PRO | HB2 | H | 2.2745 | 0.0000 | 2 |
57 | 1 | 11 | PRO | HB3 | H | 2.0008 | 0.0000 | 2 |
58 | 1 | 11 | PRO | HG2 | H | 1.8154 | 0.0000 | 2 |
59 | 1 | 11 | PRO | HD2 | H | 3.5987 | 0.0000 | 2 |
60 | 1 | 11 | PRO | HD3 | H | 3.7665 | 0.0000 | 2 |
61 | 1 | 11 | PRO | CA | C | 62.9500 | 0.0000 | 1 |
62 | 1 | 11 | PRO | CB | C | 32.0623 | 0.0000 | 1 |
63 | 1 | 11 | PRO | CG | C | 27.1635 | 0.0000 | 1 |
64 | 1 | 11 | PRO | CD | C | 50.3446 | 0.0000 | 1 |
65 | 1 | 12 | GLU | H | H | 8.3613 | 0.0000 | 1 |
66 | 1 | 12 | GLU | HA | H | 4.0401 | 0.0000 | 1 |
67 | 1 | 12 | GLU | HB2 | H | 2.0270 | 0.0000 | 2 |
68 | 1 | 12 | GLU | HG2 | H | 2.3230 | 0.0000 | 2 |
69 | 1 | 12 | GLU | CA | C | 59.3232 | 0.0000 | 1 |
70 | 1 | 12 | GLU | CB | C | 29.2413 | 0.0000 | 1 |
71 | 1 | 12 | GLU | CG | C | 37.0353 | 0.0000 | 1 |
72 | 1 | 12 | GLU | N | N | 119.7661 | 0.0000 | 1 |
73 | 1 | 13 | LEU | H | H | 7.5934 | 0.0000 | 1 |
74 | 1 | 13 | LEU | HA | H | 3.8710 | 0.0000 | 1 |
75 | 1 | 13 | LEU | HB2 | H | 1.8532 | 0.0000 | 2 |
76 | 1 | 13 | LEU | HB3 | H | 1.1391 | 0.0000 | 2 |
77 | 1 | 13 | LEU | HG | H | 1.5200 | 0.0000 | 1 |
78 | 1 | 13 | LEU | HD11 | H | 1.5810 | 0.0000 | 2 |
79 | 1 | 13 | LEU | HD12 | H | 1.5810 | 0.0000 | 2 |
80 | 1 | 13 | LEU | HD13 | H | 1.5810 | 0.0000 | 2 |
81 | 1 | 13 | LEU | HD21 | H | 1.3648 | 0.0000 | 2 |
82 | 1 | 13 | LEU | HD22 | H | 1.3648 | 0.0000 | 2 |
83 | 1 | 13 | LEU | HD23 | H | 1.3648 | 0.0000 | 2 |
84 | 1 | 13 | LEU | CA | C | 57.7289 | 0.0000 | 1 |
85 | 1 | 13 | LEU | CB | C | 40.9132 | 0.0000 | 1 |
86 | 1 | 13 | LEU | CG | C | 32.2160 | 0.0000 | 1 |
87 | 1 | 13 | LEU | CD1 | C | 24.9600 | 0.0000 | 2 |
88 | 1 | 13 | LEU | CD2 | C | 24.9600 | 0.0000 | 2 |
89 | 1 | 13 | LEU | N | N | 123.6965 | 0.0000 | 1 |
90 | 1 | 14 | LYS | H | H | 7.8806 | 0.0000 | 1 |
91 | 1 | 14 | LYS | HA | H | 3.8630 | 0.0000 | 1 |
92 | 1 | 14 | LYS | HB2 | H | 1.5877 | 0.0000 | 2 |
93 | 1 | 14 | LYS | HG2 | H | 1.3642 | 0.0000 | 2 |
94 | 1 | 14 | LYS | HG3 | H | 1.5207 | 0.0000 | 2 |
95 | 1 | 14 | LYS | HD2 | H | 1.6443 | 0.0000 | 2 |
96 | 1 | 14 | LYS | HE2 | H | 2.9437 | 0.0000 | 2 |
97 | 1 | 14 | LYS | CA | C | 60.0564 | 0.0000 | 1 |
98 | 1 | 14 | LYS | CB | C | 32.5106 | 0.0000 | 1 |
99 | 1 | 14 | LYS | CG | C | 25.0000 | 0.0000 | 1 |
100 | 1 | 14 | LYS | CD | C | 29.6412 | 0.0000 | 1 |
101 | 1 | 14 | LYS | CE | C | 40.8013 | 0.0000 | 1 |
102 | 1 | 14 | LYS | N | N | 119.3942 | 0.0000 | 1 |
103 | 1 | 15 | GLN | H | H | 7.8870 | 0.0000 | 1 |
104 | 1 | 15 | GLN | HA | H | 4.2153 | 0.0000 | 1 |
105 | 1 | 15 | GLN | HB2 | H | 2.1500 | 0.0000 | 2 |
106 | 1 | 15 | GLN | HG2 | H | 2.4858 | 0.0000 | 2 |
107 | 1 | 15 | GLN | CA | C | 58.5751 | 0.0000 | 1 |
108 | 1 | 15 | GLN | CB | C | 28.0750 | 0.0000 | 1 |
109 | 1 | 15 | GLN | CG | C | 33.3333 | 0.0000 | 1 |
110 | 1 | 15 | GLN | N | N | 119.5389 | 0.0000 | 1 |
111 | 1 | 16 | CYS | H | H | 8.0453 | 0.0000 | 1 |
112 | 1 | 16 | CYS | HB2 | H | 3.2464 | 0.0000 | 2 |
113 | 1 | 16 | CYS | HB3 | H | 3.5347 | 0.0000 | 2 |
114 | 1 | 16 | CYS | CA | C | 60.7433 | 0.0000 | 1 |
115 | 1 | 16 | CYS | CB | C | 36.8914 | 0.0000 | 1 |
116 | 1 | 16 | CYS | N | N | 121.5511 | 0.0000 | 1 |
117 | 1 | 17 | LYS | H | H | 8.2590 | 0.0000 | 1 |
118 | 1 | 17 | LYS | HA | H | 3.7665 | 0.0000 | 1 |
119 | 1 | 17 | LYS | HB2 | H | 1.9302 | 0.0000 | 2 |
120 | 1 | 17 | LYS | HG2 | H | 1.3963 | 0.0000 | 2 |
121 | 1 | 17 | LYS | HD2 | H | 1.7825 | 0.0000 | 2 |
122 | 1 | 17 | LYS | HE2 | H | 2.8535 | 0.0000 | 2 |
123 | 1 | 17 | LYS | CA | C | 60.9310 | 0.0000 | 1 |
124 | 1 | 17 | LYS | CB | C | 32.3364 | 0.0000 | 1 |
125 | 1 | 17 | LYS | CG | C | 24.7682 | 0.0000 | 1 |
126 | 1 | 17 | LYS | CD | C | 30.1280 | 0.0000 | 1 |
127 | 1 | 17 | LYS | CE | C | 41.5304 | 0.0000 | 1 |
128 | 1 | 17 | LYS | N | N | 118.1891 | 0.0000 | 1 |
129 | 1 | 18 | HIS | H | H | 8.1528 | 0.0000 | 1 |
130 | 1 | 18 | HIS | HA | H | 4.2233 | 0.0000 | 1 |
131 | 1 | 18 | HIS | HB2 | H | 3.1962 | 0.0000 | 2 |
132 | 1 | 18 | HIS | HB3 | H | 3.2987 | 0.0000 | 2 |
133 | 1 | 18 | HIS | HD2 | H | 7.0158 | 0.0000 | 1 |
134 | 1 | 18 | HIS | CA | C | 60.2510 | 0.0000 | 1 |
135 | 1 | 18 | HIS | CB | C | 30.2197 | 0.0000 | 1 |
136 | 1 | 18 | HIS | CD2 | C | 119.3927 | 0.0000 | 1 |
137 | 1 | 18 | HIS | N | N | 120.6126 | 0.0000 | 1 |
138 | 1 | 19 | GLN | H | H | 8.1903 | 0.0000 | 1 |
139 | 1 | 19 | GLN | HA | H | 3.9671 | 0.0000 | 1 |
140 | 1 | 19 | GLN | HB2 | H | 2.1815 | 0.0000 | 2 |
141 | 1 | 19 | GLN | HB3 | H | 2.3416 | 0.0000 | 2 |
142 | 1 | 19 | GLN | HG2 | H | 2.5680 | 0.0000 | 2 |
143 | 1 | 19 | GLN | HG3 | H | 2.5204 | 0.0000 | 2 |
144 | 1 | 19 | GLN | CA | C | 58.5386 | 0.0000 | 1 |
145 | 1 | 19 | GLN | CB | C | 27.8445 | 0.0000 | 1 |
146 | 1 | 19 | GLN | CG | C | 34.3386 | 0.0000 | 1 |
147 | 1 | 19 | GLN | N | N | 117.0272 | 0.0000 | 1 |
148 | 1 | 20 | CYS | H | H | 7.6545 | 0.0000 | 1 |
149 | 1 | 20 | CYS | HA | H | 4.4715 | 0.0000 | 1 |
150 | 1 | 20 | CYS | HB2 | H | 3.0943 | 0.0000 | 2 |
151 | 1 | 20 | CYS | HB3 | H | 3.4066 | 0.0000 | 2 |
152 | 1 | 20 | CYS | CA | C | 57.2238 | 0.0000 | 1 |
153 | 1 | 20 | CYS | CB | C | 37.6706 | 0.0000 | 1 |
154 | 1 | 20 | CYS | N | N | 116.6675 | 0.0000 | 1 |
155 | 1 | 21 | LYS | H | H | 7.4206 | 0.0000 | 1 |
156 | 1 | 21 | LYS | HA | H | 3.9240 | 0.0000 | 1 |
157 | 1 | 21 | LYS | HB2 | H | 1.9366 | 0.0000 | 2 |
158 | 1 | 21 | LYS | HB3 | H | 1.8507 | 0.0000 | 2 |
159 | 1 | 21 | LYS | HG2 | H | 1.3850 | 0.0000 | 2 |
160 | 1 | 21 | LYS | HD2 | H | 1.7121 | 0.0000 | 2 |
161 | 1 | 21 | LYS | CA | C | 58.7727 | 0.0000 | 1 |
162 | 1 | 21 | LYS | CB | C | 32.5025 | 0.0000 | 1 |
163 | 1 | 21 | LYS | CG | C | 24.7000 | 0.0000 | 1 |
164 | 1 | 21 | LYS | CD | C | 31.3168 | 0.0000 | 1 |
165 | 1 | 21 | LYS | N | N | 116.5381 | 0.0000 | 1 |
166 | 1 | 22 | VAL | H | H | 7.4293 | 0.0000 | 1 |
167 | 1 | 22 | VAL | HA | H | 4.2914 | 0.0000 | 1 |
168 | 1 | 22 | VAL | HB | H | 2.2670 | 0.0000 | 1 |
169 | 1 | 22 | VAL | HG11 | H | 0.7528 | 0.0000 | 2 |
170 | 1 | 22 | VAL | HG12 | H | 0.7528 | 0.0000 | 2 |
171 | 1 | 22 | VAL | HG13 | H | 0.7528 | 0.0000 | 2 |
172 | 1 | 22 | VAL | HG21 | H | 0.7022 | 0.0000 | 2 |
173 | 1 | 22 | VAL | HG22 | H | 0.7022 | 0.0000 | 2 |
174 | 1 | 22 | VAL | HG23 | H | 0.7022 | 0.0000 | 2 |
175 | 1 | 22 | VAL | CA | C | 61.4286 | 0.0000 | 1 |
176 | 1 | 22 | VAL | CB | C | 31.4077 | 0.0000 | 1 |
177 | 1 | 22 | VAL | CG1 | C | 20.7292 | 0.0000 | 2 |
178 | 1 | 22 | VAL | CG2 | C | 20.7292 | 0.0000 | 2 |
179 | 1 | 23 | GLN | H | H | 6.9766 | 0.0000 | 1 |
180 | 1 | 23 | GLN | C | C | 176.4628 | 0.0000 | 1 |
181 | 1 | 23 | GLN | CA | C | 55.8834 | 0.0000 | 1 |
182 | 1 | 23 | GLN | CB | C | 27.7746 | 0.0000 | 1 |
183 | 1 | 23 | GLN | N | N | 122.0000 | 0.0000 | 1 |
184 | 1 | 25 | GLN | HA | H | 4.2794 | 0.0000 | 1 |
185 | 1 | 25 | GLN | HB2 | H | 2.2135 | 0.0000 | 2 |
186 | 1 | 25 | GLN | HB3 | H | 2.3096 | 0.0000 | 2 |
187 | 1 | 25 | GLN | HG2 | H | 2.3096 | 0.0000 | 2 |
188 | 1 | 25 | GLN | CA | C | 56.3133 | 0.0000 | 1 |
189 | 1 | 25 | GLN | CB | C | 28.1036 | 0.0000 | 1 |
190 | 1 | 25 | GLN | CG | C | 33.6860 | 0.0000 | 1 |
191 | 1 | 26 | TYR | H | H | 7.1647 | 0.0000 | 1 |
192 | 1 | 26 | TYR | HA | H | 4.6015 | 0.0000 | 1 |
193 | 1 | 26 | TYR | HB2 | H | 3.1023 | 0.0000 | 2 |
194 | 1 | 26 | TYR | HB3 | H | 3.2945 | 0.0000 | 2 |
195 | 1 | 26 | TYR | HD1 | H | 7.2440 | 0.0000 | 3 |
196 | 1 | 26 | TYR | HE1 | H | 6.9426 | 0.0000 | 3 |
197 | 1 | 26 | TYR | CA | C | 53.8400 | 0.0000 | 1 |
198 | 1 | 26 | TYR | CB | C | 39.4059 | 0.0000 | 1 |
199 | 1 | 26 | TYR | CD1 | C | 132.0020 | 0.0000 | 3 |
200 | 1 | 26 | TYR | CE1 | C | 118.1715 | 0.0000 | 3 |
201 | 1 | 26 | TYR | N | N | 119.8493 | 0.0000 | 1 |
202 | 1 | 27 | ASP | H | H | 8.5025 | 0.0000 | 1 |
203 | 1 | 27 | ASP | HB2 | H | 2.7940 | 0.0000 | 2 |
204 | 1 | 27 | ASP | HB3 | H | 3.2103 | 0.0000 | 2 |
205 | 1 | 27 | ASP | CA | C | 52.3448 | 0.0000 | 1 |
206 | 1 | 27 | ASP | CB | C | 40.8533 | 0.0000 | 1 |
207 | 1 | 27 | ASP | N | N | 122.5724 | 0.0000 | 1 |
208 | 1 | 28 | GLU | H | H | 8.4766 | 0.0000 | 1 |
209 | 1 | 28 | GLU | HA | H | 3.9431 | 0.0000 | 1 |
210 | 1 | 28 | GLU | HB2 | H | 2.0854 | 0.0000 | 2 |
211 | 1 | 28 | GLU | HG2 | H | 2.4137 | 0.0000 | 2 |
212 | 1 | 28 | GLU | CA | C | 60.2603 | 0.0000 | 1 |
213 | 1 | 28 | GLU | CB | C | 29.3695 | 0.0000 | 1 |
214 | 1 | 28 | GLU | CG | C | 36.1538 | 0.0000 | 1 |
215 | 1 | 28 | GLU | N | N | 118.1391 | 0.0000 | 1 |
216 | 1 | 29 | GLN | H | H | 8.0536 | 0.0000 | 1 |
217 | 1 | 29 | GLN | HA | H | 4.1352 | 0.0000 | 1 |
218 | 1 | 29 | GLN | HB2 | H | 2.1655 | 0.0000 | 2 |
219 | 1 | 29 | GLN | HG2 | H | 2.4217 | 0.0000 | 2 |
220 | 1 | 29 | GLN | CA | C | 59.2600 | 0.0000 | 1 |
221 | 1 | 29 | GLN | CB | C | 28.0533 | 0.0000 | 1 |
222 | 1 | 29 | GLN | CG | C | 34.3910 | 0.0000 | 1 |
223 | 1 | 29 | GLN | N | N | 120.2278 | 0.0000 | 1 |
224 | 1 | 30 | GLN | H | H | 8.7332 | 0.0000 | 1 |
225 | 1 | 30 | GLN | HA | H | 3.8710 | 0.0000 | 1 |
226 | 1 | 30 | GLN | HB2 | H | 2.0934 | 0.0000 | 2 |
227 | 1 | 30 | GLN | HG2 | H | 2.5330 | 0.0000 | 2 |
228 | 1 | 30 | GLN | CA | C | 58.8312 | 0.0000 | 1 |
229 | 1 | 30 | GLN | CB | C | 28.2165 | 0.0000 | 1 |
230 | 1 | 30 | GLN | CG | C | 34.4790 | 0.0000 | 1 |
231 | 1 | 30 | GLN | N | N | 122.0184 | 0.0000 | 1 |
232 | 1 | 31 | LYS | H | H | 8.5266 | 0.0000 | 1 |
233 | 1 | 31 | LYS | HA | H | 3.8630 | 0.0000 | 1 |
234 | 1 | 31 | LYS | HB2 | H | 1.8359 | 0.0000 | 2 |
235 | 1 | 31 | LYS | HG2 | H | 1.6850 | 0.0000 | 2 |
236 | 1 | 31 | LYS | HD2 | H | 1.6376 | 0.0000 | 2 |
237 | 1 | 31 | LYS | HE2 | H | 3.0000 | 0.0000 | 2 |
238 | 1 | 31 | LYS | CA | C | 61.3870 | 0.0000 | 1 |
239 | 1 | 31 | LYS | CB | C | 32.7608 | 0.0000 | 1 |
240 | 1 | 31 | LYS | CG | C | 27.1413 | 0.0000 | 1 |
241 | 1 | 31 | LYS | CD | C | 27.1413 | 0.0000 | 1 |
242 | 1 | 31 | LYS | CE | C | 42.2360 | 0.0000 | 1 |
243 | 1 | 31 | LYS | N | N | 121.9728 | 0.0000 | 1 |
244 | 1 | 32 | GLU | H | H | 7.8043 | 0.0000 | 1 |
245 | 1 | 32 | GLU | HA | H | 4.0872 | 0.0000 | 1 |
246 | 1 | 32 | GLU | HB2 | H | 2.1895 | 0.0000 | 2 |
247 | 1 | 32 | GLU | HB3 | H | 2.2700 | 0.0000 | 2 |
248 | 1 | 32 | GLU | HG2 | H | 2.4057 | 0.0000 | 2 |
249 | 1 | 32 | GLU | HG3 | H | 2.2700 | 0.0000 | 2 |
250 | 1 | 32 | GLU | CA | C | 59.2812 | 0.0000 | 1 |
251 | 1 | 32 | GLU | CB | C | 29.3781 | 0.0000 | 1 |
252 | 1 | 32 | GLU | CG | C | 36.0657 | 0.0000 | 1 |
253 | 1 | 32 | GLU | N | N | 119.7047 | 0.0000 | 1 |
254 | 1 | 33 | GLN | H | H | 8.0738 | 0.0000 | 1 |
255 | 1 | 33 | GLN | HA | H | 3.9831 | 0.0000 | 1 |
256 | 1 | 33 | GLN | HB2 | H | 2.0854 | 0.0000 | 2 |
257 | 1 | 33 | GLN | HG2 | H | 2.4377 | 0.0000 | 2 |
258 | 1 | 33 | GLN | CA | C | 58.7425 | 0.0000 | 1 |
259 | 1 | 33 | GLN | CB | C | 27.9097 | 0.0000 | 1 |
260 | 1 | 33 | GLN | CG | C | 33.1570 | 0.0000 | 1 |
261 | 1 | 33 | GLN | N | N | 120.1675 | 0.0000 | 1 |
262 | 1 | 34 | CYS | H | H | 7.9139 | 0.0000 | 1 |
263 | 1 | 34 | CYS | HA | H | 4.2954 | 0.0000 | 1 |
264 | 1 | 34 | CYS | HB2 | H | 2.9181 | 0.0000 | 2 |
265 | 1 | 34 | CYS | HB3 | H | 3.7109 | 0.0000 | 2 |
266 | 1 | 34 | CYS | CA | C | 59.8629 | 0.0000 | 1 |
267 | 1 | 34 | CYS | CB | C | 34.1071 | 0.0000 | 1 |
268 | 1 | 34 | CYS | N | N | 120.9810 | 0.0000 | 1 |
269 | 1 | 35 | VAL | H | H | 8.2712 | 0.0000 | 1 |
270 | 1 | 35 | VAL | HA | H | 4.0391 | 0.0000 | 1 |
271 | 1 | 35 | VAL | HB | H | 2.2872 | 0.0000 | 1 |
272 | 1 | 35 | VAL | HG11 | H | 1.1026 | 0.0000 | 2 |
273 | 1 | 35 | VAL | HG12 | H | 1.1026 | 0.0000 | 2 |
274 | 1 | 35 | VAL | HG13 | H | 1.1026 | 0.0000 | 2 |
275 | 1 | 35 | VAL | HG21 | H | 0.9762 | 0.0000 | 2 |
276 | 1 | 35 | VAL | HG22 | H | 0.9762 | 0.0000 | 2 |
277 | 1 | 35 | VAL | HG23 | H | 0.9762 | 0.0000 | 2 |
278 | 1 | 35 | VAL | CA | C | 67.8229 | 0.0000 | 1 |
279 | 1 | 35 | VAL | CB | C | 31.5197 | 0.0000 | 1 |
280 | 1 | 35 | VAL | CG1 | C | 23.7900 | 0.0000 | 2 |
281 | 1 | 35 | VAL | CG2 | C | 21.8000 | 0.0000 | 2 |
282 | 1 | 35 | VAL | N | N | 122.7854 | 0.0000 | 1 |
283 | 1 | 36 | LYS | H | H | 8.0251 | 0.0000 | 1 |
284 | 1 | 36 | LYS | HA | H | 4.0872 | 0.0000 | 1 |
285 | 1 | 36 | LYS | HB2 | H | 2.0133 | 0.0000 | 2 |
286 | 1 | 36 | LYS | HB3 | H | 1.9493 | 0.0000 | 2 |
287 | 1 | 36 | LYS | HG2 | H | 1.4929 | 0.0000 | 2 |
288 | 1 | 36 | LYS | HD2 | H | 1.6770 | 0.0000 | 2 |
289 | 1 | 36 | LYS | HE2 | H | 3.0000 | 0.0000 | 2 |
290 | 1 | 36 | LYS | CA | C | 59.5832 | 0.0000 | 1 |
291 | 1 | 36 | LYS | CB | C | 32.0569 | 0.0000 | 1 |
292 | 1 | 36 | LYS | CG | C | 25.3300 | 0.0000 | 1 |
293 | 1 | 36 | LYS | CD | C | 30.6000 | 0.0000 | 1 |
294 | 1 | 36 | LYS | CE | C | 42.1474 | 0.0000 | 1 |
295 | 1 | 36 | LYS | N | N | 120.8344 | 0.0000 | 1 |
296 | 1 | 37 | GLU | H | H | 8.3255 | 0.0000 | 1 |
297 | 1 | 37 | GLU | HA | H | 4.1352 | 0.0000 | 1 |
298 | 1 | 37 | GLU | HB2 | H | 2.1815 | 0.0000 | 2 |
299 | 1 | 37 | GLU | HG2 | H | 2.4217 | 0.0000 | 2 |
300 | 1 | 37 | GLU | CA | C | 59.5921 | 0.0000 | 1 |
301 | 1 | 37 | GLU | CB | C | 28.6856 | 0.0000 | 1 |
302 | 1 | 37 | GLU | CG | C | 36.3141 | 0.0000 | 1 |
303 | 1 | 37 | GLU | N | N | 121.9681 | 0.0000 | 1 |
304 | 1 | 38 | CYS | H | H | 8.2890 | 0.0000 | 1 |
305 | 1 | 38 | CYS | HA | H | 4.5756 | 0.0000 | 1 |
306 | 1 | 38 | CYS | HB2 | H | 3.0302 | 0.0000 | 2 |
307 | 1 | 38 | CYS | HB3 | H | 3.6708 | 0.0000 | 2 |
308 | 1 | 38 | CYS | CA | C | 58.5899 | 0.0000 | 1 |
309 | 1 | 38 | CYS | CB | C | 38.7359 | 0.0000 | 1 |
310 | 1 | 38 | CYS | N | N | 119.7987 | 0.0000 | 1 |
311 | 1 | 39 | GLU | H | H | 8.0459 | 0.0000 | 1 |
312 | 1 | 39 | GLU | HA | H | 4.0231 | 0.0000 | 1 |
313 | 1 | 39 | GLU | HB2 | H | 2.2536 | 0.0000 | 2 |
314 | 1 | 39 | GLU | HG2 | H | 2.5980 | 0.0000 | 2 |
315 | 1 | 39 | GLU | CA | C | 59.6087 | 0.0000 | 1 |
316 | 1 | 39 | GLU | CB | C | 29.4173 | 0.0000 | 1 |
317 | 1 | 39 | GLU | CG | C | 36.8750 | 0.0000 | 1 |
318 | 1 | 39 | GLU | N | N | 119.2344 | 0.0000 | 1 |
319 | 1 | 40 | LYS | H | H | 8.0792 | 0.0000 | 1 |
320 | 1 | 40 | LYS | HA | H | 4.0552 | 0.0000 | 1 |
321 | 1 | 40 | LYS | HB2 | H | 1.9173 | 0.0000 | 2 |
322 | 1 | 40 | LYS | HG2 | H | 1.2927 | 0.0000 | 2 |
323 | 1 | 40 | LYS | HD2 | H | 1.5207 | 0.0000 | 2 |
324 | 1 | 40 | LYS | HE2 | H | 3.0454 | 0.0000 | 2 |
325 | 1 | 40 | LYS | CA | C | 59.3910 | 0.0000 | 1 |
326 | 1 | 40 | LYS | CB | C | 32.9150 | 0.0000 | 1 |
327 | 1 | 40 | LYS | CG | C | 24.6955 | 0.0000 | 1 |
328 | 1 | 40 | LYS | CD | C | 29.8200 | 0.0000 | 1 |
329 | 1 | 40 | LYS | CE | C | 41.8429 | 0.0000 | 1 |
330 | 1 | 40 | LYS | N | N | 120.9838 | 0.0000 | 1 |
331 | 1 | 41 | TYR | H | H | 8.2251 | 0.0000 | 1 |
332 | 1 | 41 | TYR | HA | H | 4.1757 | 0.0000 | 1 |
333 | 1 | 41 | TYR | HB2 | H | 3.0480 | 0.0000 | 2 |
334 | 1 | 41 | TYR | HB3 | H | 3.1002 | 0.0000 | 2 |
335 | 1 | 41 | TYR | HD1 | H | 6.6371 | 0.0000 | 3 |
336 | 1 | 41 | TYR | HE1 | H | 6.7972 | 0.0000 | 3 |
337 | 1 | 41 | TYR | CA | C | 61.0085 | 0.0000 | 1 |
338 | 1 | 41 | TYR | CB | C | 38.3500 | 0.0000 | 1 |
339 | 1 | 41 | TYR | CD1 | C | 133.2155 | 0.0000 | 3 |
340 | 1 | 41 | TYR | CE1 | C | 118.2396 | 0.0000 | 3 |
341 | 1 | 41 | TYR | N | N | 119.7047 | 0.0000 | 1 |
342 | 1 | 42 | TYR | H | H | 7.9963 | 0.0000 | 1 |
343 | 1 | 42 | TYR | HA | H | 3.9570 | 0.0000 | 1 |
344 | 1 | 42 | TYR | HB2 | H | 3.0331 | 0.0000 | 2 |
345 | 1 | 42 | TYR | HB3 | H | 3.2790 | 0.0000 | 2 |
346 | 1 | 42 | TYR | HD1 | H | 7.2109 | 0.0000 | 3 |
347 | 1 | 42 | TYR | HE1 | H | 6.9873 | 0.0000 | 3 |
348 | 1 | 42 | TYR | CA | C | 61.7480 | 0.0000 | 1 |
349 | 1 | 42 | TYR | CB | C | 38.5979 | 0.0000 | 1 |
350 | 1 | 42 | TYR | CG | C | 133.3167 | 0.0000 | 1 |
351 | 1 | 42 | TYR | CE1 | C | 118.5573 | 0.0000 | 3 |
352 | 1 | 42 | TYR | N | N | 117.1187 | 0.0000 | 1 |
353 | 1 | 43 | LYS | H | H | 7.9795 | 0.0000 | 1 |
354 | 1 | 43 | LYS | HA | H | 4.1060 | 0.0000 | 1 |
355 | 1 | 43 | LYS | HB2 | H | 1.9826 | 0.0000 | 2 |
356 | 1 | 43 | LYS | HG2 | H | 1.5207 | 0.0000 | 2 |
357 | 1 | 43 | LYS | HD2 | H | 1.7219 | 0.0000 | 2 |
358 | 1 | 43 | LYS | HE2 | H | 2.9440 | 0.0000 | 2 |
359 | 1 | 43 | LYS | CA | C | 58.9813 | 0.0000 | 1 |
360 | 1 | 43 | LYS | CB | C | 32.7365 | 0.0000 | 1 |
361 | 1 | 43 | LYS | CG | C | 25.3365 | 0.0000 | 1 |
362 | 1 | 43 | LYS | CD | C | 29.2628 | 0.0000 | 1 |
363 | 1 | 43 | LYS | CE | C | 42.0833 | 0.0000 | 1 |
364 | 1 | 43 | LYS | N | N | 121.1652 | 0.0000 | 1 |
365 | 1 | 44 | GLU | H | H | 7.9757 | 0.0000 | 1 |
366 | 1 | 44 | GLU | HA | H | 4.1432 | 0.0000 | 1 |
367 | 1 | 44 | GLU | HB2 | H | 2.0273 | 0.0000 | 2 |
368 | 1 | 44 | GLU | HB3 | H | 2.2210 | 0.0000 | 2 |
369 | 1 | 44 | GLU | HG2 | H | 2.4147 | 0.0000 | 2 |
370 | 1 | 44 | GLU | HG3 | H | 2.2210 | 0.0000 | 2 |
371 | 1 | 44 | GLU | CA | C | 57.8634 | 0.0000 | 1 |
372 | 1 | 44 | GLU | CB | C | 29.4395 | 0.0000 | 1 |
373 | 1 | 44 | GLU | CG | C | 36.3942 | 0.0000 | 1 |
374 | 1 | 44 | GLU | N | N | 119.7676 | 0.0000 | 1 |
375 | 1 | 45 | LYS | H | H | 7.8518 | 0.0000 | 1 |
376 | 1 | 45 | LYS | HA | H | 4.0389 | 0.0000 | 1 |
377 | 1 | 45 | LYS | HB2 | H | 1.7368 | 0.0000 | 2 |
378 | 1 | 45 | LYS | HG2 | H | 1.3270 | 0.0000 | 2 |
379 | 1 | 45 | LYS | HD2 | H | 1.6474 | 0.0000 | 2 |
380 | 1 | 45 | LYS | CA | C | 57.9230 | 0.0000 | 1 |
381 | 1 | 45 | LYS | CB | C | 32.5671 | 0.0000 | 1 |
382 | 1 | 45 | LYS | CG | C | 24.6955 | 0.0000 | 1 |
383 | 1 | 45 | LYS | CE | C | 41.9231 | 0.0000 | 1 |
384 | 1 | 45 | LYS | N | N | 121.3019 | 0.0000 | 1 |
385 | 1 | 46 | LYS | H | H | 8.0008 | 0.0000 | 1 |
386 | 1 | 46 | LYS | HA | H | 4.2028 | 0.0000 | 1 |
387 | 1 | 46 | LYS | HB2 | H | 1.7815 | 0.0000 | 2 |
388 | 1 | 46 | LYS | HB3 | H | 1.7070 | 0.0000 | 2 |
389 | 1 | 46 | LYS | HG2 | H | 1.4164 | 0.0000 | 2 |
390 | 1 | 46 | LYS | HE2 | H | 2.8561 | 0.0000 | 2 |
391 | 1 | 46 | LYS | HE3 | H | 2.8741 | 0.0000 | 2 |
392 | 1 | 46 | LYS | CA | C | 57.0910 | 0.0000 | 1 |
393 | 1 | 46 | LYS | CB | C | 32.3664 | 0.0000 | 1 |
394 | 1 | 46 | LYS | CG | C | 24.5353 | 0.0000 | 1 |
395 | 1 | 46 | LYS | CE | C | 41.6830 | 0.0000 | 1 |
396 | 1 | 46 | LYS | N | N | 120.7542 | 0.0000 | 1 |
397 | 1 | 47 | GLY | H | H | 8.1332 | 0.0000 | 1 |
398 | 1 | 47 | GLY | HA2 | H | 3.9570 | 0.0000 | 2 |
399 | 1 | 47 | GLY | CA | C | 45.9526 | 0.0000 | 1 |
400 | 1 | 47 | GLY | N | N | 109.0468 | 0.0000 | 1 |
401 | 1 | 48 | ARG | H | H | 7.9600 | 0.0000 | 1 |
402 | 1 | 48 | ARG | HA | H | 4.3220 | 0.0000 | 1 |
403 | 1 | 48 | ARG | HB2 | H | 1.8709 | 0.0000 | 2 |
404 | 1 | 48 | ARG | HG2 | H | 1.6772 | 0.0000 | 2 |
405 | 1 | 48 | ARG | HD2 | H | 3.1970 | 0.0000 | 2 |
406 | 1 | 48 | ARG | CA | C | 56.7055 | 0.0000 | 1 |
407 | 1 | 48 | ARG | CB | C | 30.4839 | 0.0000 | 1 |
408 | 1 | 48 | ARG | CG | C | 27.0994 | 0.0000 | 1 |
409 | 1 | 48 | ARG | CD | C | 43.3660 | 0.0000 | 1 |
410 | 1 | 48 | ARG | N | N | 120.8557 | 0.0000 | 1 |
411 | 1 | 49 | GLU | H | H | 8.3184 | 0.0000 | 1 |
412 | 1 | 49 | GLU | HA | H | 4.2252 | 0.0000 | 1 |
413 | 1 | 49 | GLU | HB2 | H | 2.0646 | 0.0000 | 2 |
414 | 1 | 49 | GLU | HG2 | H | 2.3551 | 0.0000 | 2 |
415 | 1 | 49 | GLU | CA | C | 57.4169 | 0.0000 | 1 |
416 | 1 | 49 | GLU | CB | C | 29.9240 | 0.0000 | 1 |
417 | 1 | 49 | GLU | CG | C | 36.3414 | 0.0000 | 1 |
418 | 1 | 49 | GLU | N | N | 121.7357 | 0.0000 | 1 |
419 | 1 | 50 | ARG | H | H | 8.1601 | 0.0000 | 1 |
420 | 1 | 50 | ARG | HA | H | 4.2922 | 0.0000 | 1 |
421 | 1 | 50 | ARG | HB2 | H | 1.8634 | 0.0000 | 2 |
422 | 1 | 50 | ARG | HG2 | H | 1.6548 | 0.0000 | 2 |
423 | 1 | 50 | ARG | HD2 | H | 3.2119 | 0.0000 | 2 |
424 | 1 | 50 | ARG | CA | C | 56.4372 | 0.0000 | 1 |
425 | 1 | 50 | ARG | CB | C | 30.3846 | 0.0000 | 1 |
426 | 1 | 50 | ARG | CG | C | 26.9391 | 0.0000 | 1 |
427 | 1 | 50 | ARG | CD | C | 43.3904 | 0.0000 | 1 |
428 | 1 | 50 | ARG | N | N | 120.9749 | 0.0000 | 1 |
429 | 1 | 51 | GLU | H | H | 8.2596 | 0.0000 | 1 |
430 | 1 | 51 | GLU | CA | C | 57.4620 | 0.0000 | 1 |
431 | 1 | 51 | GLU | CB | C | 30.0278 | 0.0000 | 1 |
432 | 1 | 51 | GLU | N | N | 121.5892 | 0.0000 | 1 |
433 | 1 | 55 | ARG | H | H | 7.9560 | 0.0000 | 1 |
434 | 1 | 55 | ARG | HA | H | 4.3891 | 0.0000 | 1 |
435 | 1 | 55 | ARG | HB2 | H | 1.3856 | 0.0000 | 2 |
436 | 1 | 55 | ARG | HG2 | H | 1.6175 | 0.0000 | 2 |
437 | 1 | 55 | ARG | HD2 | H | 3.1896 | 0.0000 | 2 |
438 | 1 | 55 | ARG | CA | C | 55.6385 | 0.0000 | 1 |
439 | 1 | 55 | ARG | CB | C | 31.3221 | 0.0000 | 1 |
440 | 1 | 55 | ARG | CG | C | 26.6987 | 0.0000 | 1 |
441 | 1 | 55 | ARG | CD | C | 43.2051 | 0.0000 | 1 |
442 | 1 | 55 | ARG | N | N | 122.6800 | 0.0000 | 1 |
443 | 1 | 56 | ASP | H | H | 7.9838 | 0.0000 | 1 |
444 | 1 | 56 | ASP | HB2 | H | 3.0000 | 0.0000 | 2 |
445 | 1 | 56 | ASP | CA | C | 55.9017 | 0.0000 | 1 |
446 | 1 | 56 | ASP | CB | C | 42.4273 | 0.0000 | 1 |
447 | 1 | 56 | ASP | N | N | 127.8815 | 0.0000 | 1 |