Site-specific Aspartic Acid Dehydration and Isomerization in Streptococcal Protein GB1: L-Aspartyl Succinimide 40-41 Variant
ID | Entity ID | Seq ID | Comp ID | Atom ID | Atom type | Val | Val err | Ambig. code |
---|---|---|---|---|---|---|---|---|
1 | 1 | 1 | MET | HA | H | 4.176 | 0.002 | 1 |
2 | 1 | 1 | MET | HB2 | H | 2.218 | 0.000 | 2 |
3 | 1 | 1 | MET | HB3 | H | 2.104 | 0.000 | 2 |
4 | 1 | 1 | MET | HG2 | H | 2.438 | 0.000 | 1 |
5 | 1 | 1 | MET | HG3 | H | 2.438 | 0.000 | 1 |
6 | 1 | 1 | MET | HE1 | H | 2.132 | 0.000 | 1 |
7 | 1 | 1 | MET | HE2 | H | 2.132 | 0.000 | 1 |
8 | 1 | 1 | MET | HE3 | H | 2.132 | 0.000 | 1 |
9 | 1 | 2 | GLN | H | H | 8.379 | 0.000 | 1 |
10 | 1 | 2 | GLN | HA | H | 4.984 | 0.001 | 1 |
11 | 1 | 2 | GLN | HB2 | H | 2.044 | 0.000 | 2 |
12 | 1 | 2 | GLN | HB3 | H | 1.999 | 0.000 | 2 |
13 | 1 | 2 | GLN | HG2 | H | 2.368 | 0.000 | 2 |
14 | 1 | 2 | GLN | HG3 | H | 2.128 | 0.000 | 2 |
15 | 1 | 2 | GLN | HE21 | H | 6.923 | 0.000 | 2 |
16 | 1 | 2 | GLN | HE22 | H | 7.855 | 0.000 | 2 |
17 | 1 | 3 | TYR | H | H | 9.124 | 0.002 | 1 |
18 | 1 | 3 | TYR | HA | H | 5.370 | 0.001 | 1 |
19 | 1 | 3 | TYR | HB2 | H | 3.391 | 0.000 | 2 |
20 | 1 | 3 | TYR | HB3 | H | 2.758 | 0.001 | 2 |
21 | 1 | 3 | TYR | HD1 | H | 7.081 | 0.000 | 1 |
22 | 1 | 3 | TYR | HD2 | H | 7.081 | 0.000 | 1 |
23 | 1 | 3 | TYR | HE1 | H | 6.780 | 0.000 | 1 |
24 | 1 | 3 | TYR | HE2 | H | 6.780 | 0.000 | 1 |
25 | 1 | 4 | LYS | H | H | 9.089 | 0.001 | 1 |
26 | 1 | 4 | LYS | HA | H | 5.218 | 0.000 | 1 |
27 | 1 | 4 | LYS | HB2 | H | 2.044 | 0.002 | 2 |
28 | 1 | 4 | LYS | HB3 | H | 1.901 | 0.002 | 2 |
29 | 1 | 4 | LYS | HG2 | H | 1.478 | 0.001 | 2 |
30 | 1 | 4 | LYS | HG3 | H | 1.357 | 0.005 | 2 |
31 | 1 | 4 | LYS | HD2 | H | 1.629 | 0.000 | 1 |
32 | 1 | 4 | LYS | HD3 | H | 1.629 | 0.000 | 1 |
33 | 1 | 4 | LYS | HE2 | H | 2.856 | 0.000 | 2 |
34 | 1 | 4 | LYS | HE3 | H | 2.783 | 0.002 | 2 |
35 | 1 | 5 | LEU | H | H | 8.655 | 0.000 | 1 |
36 | 1 | 5 | LEU | HA | H | 4.946 | 0.002 | 1 |
37 | 1 | 5 | LEU | HB2 | H | 0.808 | 0.000 | 2 |
38 | 1 | 5 | LEU | HB3 | H | -1.137 | 0.001 | 2 |
39 | 1 | 5 | LEU | HG | H | 0.858 | 0.001 | 1 |
40 | 1 | 5 | LEU | HD11 | H | 0.490 | 0.001 | 2 |
41 | 1 | 5 | LEU | HD12 | H | 0.490 | 0.001 | 2 |
42 | 1 | 5 | LEU | HD13 | H | 0.490 | 0.001 | 2 |
43 | 1 | 5 | LEU | HD21 | H | 0.554 | 0.000 | 2 |
44 | 1 | 5 | LEU | HD22 | H | 0.554 | 0.000 | 2 |
45 | 1 | 5 | LEU | HD23 | H | 0.554 | 0.000 | 2 |
46 | 1 | 6 | ILE | H | H | 9.102 | 0.002 | 1 |
47 | 1 | 6 | ILE | HA | H | 4.315 | 0.001 | 1 |
48 | 1 | 6 | ILE | HB | H | 1.970 | 0.002 | 1 |
49 | 1 | 6 | ILE | HG12 | H | 1.420 | 0.000 | 2 |
50 | 1 | 6 | ILE | HG13 | H | 1.090 | 0.005 | 2 |
51 | 1 | 6 | ILE | HG21 | H | 0.817 | 0.002 | 1 |
52 | 1 | 6 | ILE | HG22 | H | 0.817 | 0.002 | 1 |
53 | 1 | 6 | ILE | HG23 | H | 0.817 | 0.002 | 1 |
54 | 1 | 6 | ILE | HD11 | H | 0.787 | 0.003 | 1 |
55 | 1 | 6 | ILE | HD12 | H | 0.787 | 0.003 | 1 |
56 | 1 | 6 | ILE | HD13 | H | 0.787 | 0.003 | 1 |
57 | 1 | 7 | LEU | H | H | 8.756 | 0.000 | 1 |
58 | 1 | 7 | LEU | HA | H | 4.521 | 0.000 | 1 |
59 | 1 | 7 | LEU | HB2 | H | 1.455 | 0.000 | 2 |
60 | 1 | 7 | LEU | HB3 | H | 1.374 | 0.000 | 2 |
61 | 1 | 7 | LEU | HG | H | 1.309 | 0.000 | 1 |
62 | 1 | 7 | LEU | HD11 | H | 0.761 | 0.000 | 1 |
63 | 1 | 7 | LEU | HD12 | H | 0.761 | 0.000 | 1 |
64 | 1 | 7 | LEU | HD13 | H | 0.761 | 0.000 | 1 |
65 | 1 | 7 | LEU | HD21 | H | 0.761 | 0.000 | 1 |
66 | 1 | 7 | LEU | HD22 | H | 0.761 | 0.000 | 1 |
67 | 1 | 7 | LEU | HD23 | H | 0.761 | 0.000 | 1 |
68 | 1 | 8 | ASN | H | H | 9.080 | 0.001 | 1 |
69 | 1 | 8 | ASN | HA | H | 5.283 | 0.000 | 1 |
70 | 1 | 8 | ASN | HB2 | H | 3.029 | 0.000 | 2 |
71 | 1 | 8 | ASN | HB3 | H | 2.601 | 0.001 | 2 |
72 | 1 | 8 | ASN | HD21 | H | 6.782 | 0.000 | 2 |
73 | 1 | 8 | ASN | HD22 | H | 7.233 | 0.000 | 2 |
74 | 1 | 9 | GLY | H | H | 7.893 | 0.001 | 1 |
75 | 1 | 9 | GLY | HA2 | H | 4.303 | 0.000 | 2 |
76 | 1 | 9 | GLY | HA3 | H | 3.951 | 0.000 | 2 |
77 | 1 | 10 | LYS | H | H | 9.505 | 0.000 | 1 |
78 | 1 | 10 | LYS | HA | H | 4.069 | 0.001 | 1 |
79 | 1 | 10 | LYS | HB2 | H | 1.844 | 0.000 | 1 |
80 | 1 | 10 | LYS | HB3 | H | 1.844 | 0.000 | 1 |
81 | 1 | 10 | LYS | HG2 | H | 1.490 | 0.000 | 1 |
82 | 1 | 10 | LYS | HG3 | H | 1.490 | 0.000 | 1 |
83 | 1 | 10 | LYS | HD2 | H | 1.672 | 0.001 | 1 |
84 | 1 | 10 | LYS | HD3 | H | 1.672 | 0.001 | 1 |
85 | 1 | 10 | LYS | HE2 | H | 2.970 | 0.000 | 1 |
86 | 1 | 10 | LYS | HE3 | H | 2.970 | 0.000 | 1 |
87 | 1 | 11 | THR | H | H | 8.795 | 0.001 | 1 |
88 | 1 | 11 | THR | HA | H | 4.397 | 0.001 | 1 |
89 | 1 | 11 | THR | HB | H | 4.262 | 0.002 | 1 |
90 | 1 | 11 | THR | HG21 | H | 1.143 | 0.001 | 1 |
91 | 1 | 11 | THR | HG22 | H | 1.143 | 0.001 | 1 |
92 | 1 | 11 | THR | HG23 | H | 1.143 | 0.001 | 1 |
93 | 1 | 12 | LEU | H | H | 7.211 | 0.000 | 1 |
94 | 1 | 12 | LEU | HA | H | 4.464 | 0.001 | 1 |
95 | 1 | 12 | LEU | HB2 | H | 1.548 | 0.000 | 2 |
96 | 1 | 12 | LEU | HB3 | H | 1.414 | 0.002 | 2 |
97 | 1 | 12 | LEU | HG | H | 1.413 | 0.000 | 1 |
98 | 1 | 12 | LEU | HD11 | H | 0.784 | 0.000 | 2 |
99 | 1 | 12 | LEU | HD12 | H | 0.784 | 0.000 | 2 |
100 | 1 | 12 | LEU | HD13 | H | 0.784 | 0.000 | 2 |
101 | 1 | 12 | LEU | HD21 | H | 0.896 | 0.000 | 2 |
102 | 1 | 12 | LEU | HD22 | H | 0.896 | 0.000 | 2 |
103 | 1 | 12 | LEU | HD23 | H | 0.896 | 0.000 | 2 |
104 | 1 | 13 | LYS | H | H | 8.131 | 0.001 | 1 |
105 | 1 | 13 | LYS | HA | H | 5.142 | 0.001 | 1 |
106 | 1 | 13 | LYS | HB2 | H | 1.909 | 0.002 | 2 |
107 | 1 | 13 | LYS | HB3 | H | 1.732 | 0.001 | 2 |
108 | 1 | 13 | LYS | HG2 | H | 1.505 | 0.000 | 2 |
109 | 1 | 13 | LYS | HG3 | H | 1.460 | 0.000 | 2 |
110 | 1 | 13 | LYS | HD2 | H | 1.688 | 0.004 | 1 |
111 | 1 | 13 | LYS | HD3 | H | 1.688 | 0.004 | 1 |
112 | 1 | 13 | LYS | HE2 | H | 3.019 | 0.000 | 2 |
113 | 1 | 13 | LYS | HE3 | H | 2.953 | 0.000 | 2 |
114 | 1 | 14 | GLY | H | H | 8.512 | 0.000 | 1 |
115 | 1 | 14 | GLY | HA2 | H | 4.219 | 0.000 | 1 |
116 | 1 | 14 | GLY | HA3 | H | 4.219 | 0.000 | 1 |
117 | 1 | 15 | GLU | H | H | 8.424 | 0.000 | 1 |
118 | 1 | 15 | GLU | HA | H | 5.606 | 0.001 | 1 |
119 | 1 | 15 | GLU | HB2 | H | 2.019 | 0.000 | 2 |
120 | 1 | 15 | GLU | HB3 | H | 1.929 | 0.000 | 2 |
121 | 1 | 15 | GLU | HG2 | H | 2.147 | 0.000 | 1 |
122 | 1 | 15 | GLU | HG3 | H | 2.147 | 0.000 | 1 |
123 | 1 | 16 | THR | H | H | 8.807 | 0.001 | 1 |
124 | 1 | 16 | THR | HA | H | 4.747 | 0.000 | 1 |
125 | 1 | 16 | THR | HB | H | 3.937 | 0.003 | 1 |
126 | 1 | 16 | THR | HG21 | H | 0.468 | 0.002 | 1 |
127 | 1 | 16 | THR | HG22 | H | 0.468 | 0.002 | 1 |
128 | 1 | 16 | THR | HG23 | H | 0.468 | 0.002 | 1 |
129 | 1 | 17 | THR | H | H | 8.098 | 0.000 | 1 |
130 | 1 | 17 | THR | HA | H | 5.819 | 0.000 | 1 |
131 | 1 | 17 | THR | HB | H | 4.307 | 0.001 | 1 |
132 | 1 | 17 | THR | HG21 | H | 1.198 | 0.001 | 1 |
133 | 1 | 17 | THR | HG22 | H | 1.198 | 0.001 | 1 |
134 | 1 | 17 | THR | HG23 | H | 1.198 | 0.001 | 1 |
135 | 1 | 18 | THR | H | H | 8.998 | 0.000 | 1 |
136 | 1 | 18 | THR | HA | H | 4.677 | 0.001 | 1 |
137 | 1 | 18 | THR | HB | H | 3.851 | 0.000 | 1 |
138 | 1 | 18 | THR | HG21 | H | 0.492 | 0.001 | 1 |
139 | 1 | 18 | THR | HG22 | H | 0.492 | 0.001 | 1 |
140 | 1 | 18 | THR | HG23 | H | 0.492 | 0.001 | 1 |
141 | 1 | 19 | GLU | H | H | 7.960 | 0.002 | 1 |
142 | 1 | 19 | GLU | HA | H | 5.180 | 0.000 | 1 |
143 | 1 | 19 | GLU | HB2 | H | 1.950 | 0.000 | 1 |
144 | 1 | 19 | GLU | HB3 | H | 1.950 | 0.000 | 1 |
145 | 1 | 19 | GLU | HG2 | H | 2.299 | 0.000 | 2 |
146 | 1 | 19 | GLU | HG3 | H | 2.058 | 0.000 | 2 |
147 | 1 | 20 | ALA | H | H | 9.352 | 0.000 | 1 |
148 | 1 | 20 | ALA | HA | H | 4.943 | 0.000 | 1 |
149 | 1 | 20 | ALA | HB1 | H | 1.343 | 0.001 | 1 |
150 | 1 | 20 | ALA | HB2 | H | 1.343 | 0.001 | 1 |
151 | 1 | 20 | ALA | HB3 | H | 1.343 | 0.001 | 1 |
152 | 1 | 21 | VAL | H | H | 8.492 | 0.000 | 1 |
153 | 1 | 21 | VAL | HA | H | 4.125 | 0.001 | 1 |
154 | 1 | 21 | VAL | HB | H | 2.202 | 0.000 | 1 |
155 | 1 | 21 | VAL | HG11 | H | 1.010 | 0.001 | 1 |
156 | 1 | 21 | VAL | HG12 | H | 1.010 | 0.001 | 1 |
157 | 1 | 21 | VAL | HG13 | H | 1.010 | 0.001 | 1 |
158 | 1 | 21 | VAL | HG21 | H | 1.010 | 0.001 | 1 |
159 | 1 | 21 | VAL | HG22 | H | 1.010 | 0.001 | 1 |
160 | 1 | 21 | VAL | HG23 | H | 1.010 | 0.001 | 1 |
161 | 1 | 22 | ASP | H | H | 7.341 | 0.002 | 1 |
162 | 1 | 22 | ASP | HA | H | 4.764 | 0.001 | 1 |
163 | 1 | 22 | ASP | HB2 | H | 3.042 | 0.001 | 2 |
164 | 1 | 22 | ASP | HB3 | H | 2.987 | 0.004 | 2 |
165 | 1 | 23 | ALA | H | H | 8.299 | 0.002 | 1 |
166 | 1 | 23 | ALA | HA | H | 3.319 | 0.001 | 1 |
167 | 1 | 23 | ALA | HB1 | H | 1.187 | 0.001 | 1 |
168 | 1 | 23 | ALA | HB2 | H | 1.187 | 0.001 | 1 |
169 | 1 | 23 | ALA | HB3 | H | 1.187 | 0.001 | 1 |
170 | 1 | 24 | ALA | H | H | 8.062 | 0.001 | 1 |
171 | 1 | 24 | ALA | HA | H | 3.974 | 0.000 | 1 |
172 | 1 | 24 | ALA | HB1 | H | 1.297 | 0.002 | 1 |
173 | 1 | 24 | ALA | HB2 | H | 1.297 | 0.002 | 1 |
174 | 1 | 24 | ALA | HB3 | H | 1.297 | 0.002 | 1 |
175 | 1 | 25 | THR | H | H | 8.296 | 0.001 | 1 |
176 | 1 | 25 | THR | HA | H | 3.708 | 0.000 | 1 |
177 | 1 | 25 | THR | HB | H | 4.030 | 0.001 | 1 |
178 | 1 | 25 | THR | HG21 | H | 1.234 | 0.000 | 1 |
179 | 1 | 25 | THR | HG22 | H | 1.234 | 0.000 | 1 |
180 | 1 | 25 | THR | HG23 | H | 1.234 | 0.000 | 1 |
181 | 1 | 26 | ALA | H | H | 7.166 | 0.001 | 1 |
182 | 1 | 26 | ALA | HA | H | 3.101 | 0.001 | 1 |
183 | 1 | 26 | ALA | HB1 | H | 0.538 | 0.000 | 1 |
184 | 1 | 26 | ALA | HB2 | H | 0.538 | 0.000 | 1 |
185 | 1 | 26 | ALA | HB3 | H | 0.538 | 0.000 | 1 |
186 | 1 | 27 | GLU | H | H | 8.385 | 0.000 | 1 |
187 | 1 | 27 | GLU | HA | H | 2.674 | 0.001 | 1 |
188 | 1 | 27 | GLU | HB2 | H | 1.977 | 0.000 | 2 |
189 | 1 | 27 | GLU | HB3 | H | 1.856 | 0.000 | 2 |
190 | 1 | 27 | GLU | HG2 | H | 1.623 | 0.000 | 1 |
191 | 1 | 27 | GLU | HG3 | H | 1.623 | 0.000 | 1 |
192 | 1 | 28 | LYS | H | H | 6.988 | 0.000 | 1 |
193 | 1 | 28 | LYS | HA | H | 3.727 | 0.001 | 1 |
194 | 1 | 28 | LYS | HB2 | H | 1.843 | 0.001 | 1 |
195 | 1 | 28 | LYS | HB3 | H | 1.843 | 0.001 | 1 |
196 | 1 | 28 | LYS | HG2 | H | 1.533 | 0.000 | 2 |
197 | 1 | 28 | LYS | HG3 | H | 1.327 | 0.000 | 2 |
198 | 1 | 28 | LYS | HD2 | H | 1.611 | 0.002 | 1 |
199 | 1 | 28 | LYS | HD3 | H | 1.611 | 0.002 | 1 |
200 | 1 | 28 | LYS | HE2 | H | 2.893 | 0.003 | 1 |
201 | 1 | 28 | LYS | HE3 | H | 2.893 | 0.003 | 1 |
202 | 1 | 29 | VAL | H | H | 7.317 | 0.000 | 1 |
203 | 1 | 29 | VAL | HA | H | 3.625 | 0.001 | 1 |
204 | 1 | 29 | VAL | HB | H | 1.762 | 0.001 | 1 |
205 | 1 | 29 | VAL | HG11 | H | 0.803 | 0.002 | 2 |
206 | 1 | 29 | VAL | HG12 | H | 0.803 | 0.002 | 2 |
207 | 1 | 29 | VAL | HG13 | H | 0.803 | 0.002 | 2 |
208 | 1 | 29 | VAL | HG21 | H | 0.913 | 0.000 | 2 |
209 | 1 | 29 | VAL | HG22 | H | 0.913 | 0.000 | 2 |
210 | 1 | 29 | VAL | HG23 | H | 0.913 | 0.000 | 2 |
211 | 1 | 30 | PHE | H | H | 8.508 | 0.000 | 1 |
212 | 1 | 30 | PHE | HA | H | 4.790 | 0.000 | 1 |
213 | 1 | 30 | PHE | HB2 | H | 3.359 | 0.001 | 2 |
214 | 1 | 30 | PHE | HB3 | H | 2.848 | 0.000 | 2 |
215 | 1 | 30 | PHE | HD1 | H | 6.540 | 0.003 | 1 |
216 | 1 | 30 | PHE | HD2 | H | 6.540 | 0.003 | 1 |
217 | 1 | 30 | PHE | HE1 | H | 7.077 | 0.002 | 1 |
218 | 1 | 30 | PHE | HE2 | H | 7.077 | 0.002 | 1 |
219 | 1 | 30 | PHE | HZ | H | 7.191 | 0.001 | 1 |
220 | 1 | 31 | LYS | H | H | 9.178 | 0.000 | 1 |
221 | 1 | 31 | LYS | HA | H | 4.158 | 0.001 | 1 |
222 | 1 | 31 | LYS | HB2 | H | 1.689 | 0.002 | 2 |
223 | 1 | 31 | LYS | HB3 | H | 1.524 | 0.001 | 2 |
224 | 1 | 31 | LYS | HG2 | H | 0.790 | 0.000 | 2 |
225 | 1 | 31 | LYS | HG3 | H | 0.434 | 0.002 | 2 |
226 | 1 | 31 | LYS | HD2 | H | 1.049 | 0.000 | 2 |
227 | 1 | 31 | LYS | HD3 | H | 1.034 | 0.002 | 2 |
228 | 1 | 31 | LYS | HE2 | H | 1.797 | 0.003 | 2 |
229 | 1 | 31 | LYS | HE3 | H | 1.573 | 0.000 | 2 |
230 | 1 | 32 | GLN | H | H | 7.483 | 0.001 | 1 |
231 | 1 | 32 | GLN | HA | H | 4.053 | 0.001 | 1 |
232 | 1 | 32 | GLN | HB2 | H | 2.256 | 0.000 | 2 |
233 | 1 | 32 | GLN | HB3 | H | 2.211 | 0.001 | 2 |
234 | 1 | 32 | GLN | HG2 | H | 2.446 | 0.001 | 1 |
235 | 1 | 32 | GLN | HG3 | H | 2.446 | 0.001 | 1 |
236 | 1 | 32 | GLN | HE21 | H | 6.900 | 0.000 | 2 |
237 | 1 | 32 | GLN | HE22 | H | 7.981 | 0.000 | 2 |
238 | 1 | 33 | TYR | H | H | 8.192 | 0.000 | 1 |
239 | 1 | 33 | TYR | HA | H | 4.295 | 0.001 | 1 |
240 | 1 | 33 | TYR | HB2 | H | 3.317 | 0.001 | 1 |
241 | 1 | 33 | TYR | HB3 | H | 3.317 | 0.001 | 1 |
242 | 1 | 33 | TYR | HD1 | H | 6.989 | 0.000 | 1 |
243 | 1 | 33 | TYR | HD2 | H | 6.989 | 0.000 | 1 |
244 | 1 | 33 | TYR | HE1 | H | 6.737 | 0.000 | 1 |
245 | 1 | 33 | TYR | HE2 | H | 6.737 | 0.000 | 1 |
246 | 1 | 34 | ALA | H | H | 9.163 | 0.000 | 1 |
247 | 1 | 34 | ALA | HA | H | 3.811 | 0.001 | 1 |
248 | 1 | 34 | ALA | HB1 | H | 1.851 | 0.001 | 1 |
249 | 1 | 34 | ALA | HB2 | H | 1.851 | 0.001 | 1 |
250 | 1 | 34 | ALA | HB3 | H | 1.851 | 0.001 | 1 |
251 | 1 | 35 | ASN | H | H | 8.311 | 0.000 | 1 |
252 | 1 | 35 | ASN | HA | H | 4.450 | 0.000 | 1 |
253 | 1 | 35 | ASN | HB2 | H | 2.954 | 0.000 | 1 |
254 | 1 | 35 | ASN | HB3 | H | 2.954 | 0.000 | 1 |
255 | 1 | 35 | ASN | HD21 | H | 6.926 | 0.000 | 2 |
256 | 1 | 35 | ASN | HD22 | H | 7.589 | 0.000 | 2 |
257 | 1 | 36 | ASP | H | H | 8.964 | 0.001 | 1 |
258 | 1 | 36 | ASP | HA | H | 4.364 | 0.002 | 1 |
259 | 1 | 36 | ASP | HB2 | H | 2.728 | 0.000 | 2 |
260 | 1 | 36 | ASP | HB3 | H | 2.579 | 0.003 | 2 |
261 | 1 | 37 | ASN | H | H | 7.385 | 0.000 | 1 |
262 | 1 | 37 | ASN | HA | H | 4.616 | 0.002 | 1 |
263 | 1 | 37 | ASN | HB2 | H | 2.686 | 0.001 | 2 |
264 | 1 | 37 | ASN | HB3 | H | 2.104 | 0.001 | 2 |
265 | 1 | 37 | ASN | HD21 | H | 6.326 | 0.000 | 2 |
266 | 1 | 37 | ASN | HD22 | H | 6.673 | 0.000 | 2 |
267 | 1 | 38 | GLY | H | H | 7.832 | 0.000 | 1 |
268 | 1 | 38 | GLY | HA2 | H | 3.941 | 0.000 | 1 |
269 | 1 | 38 | GLY | HA3 | H | 3.941 | 0.000 | 1 |
270 | 1 | 39 | VAL | H | H | 8.178 | 0.001 | 1 |
271 | 1 | 39 | VAL | HA | H | 4.156 | 0.002 | 1 |
272 | 1 | 39 | VAL | HB | H | 1.774 | 0.002 | 1 |
273 | 1 | 39 | VAL | HG11 | H | 0.844 | 0.002 | 2 |
274 | 1 | 39 | VAL | HG12 | H | 0.844 | 0.002 | 2 |
275 | 1 | 39 | VAL | HG13 | H | 0.844 | 0.002 | 2 |
276 | 1 | 39 | VAL | HG21 | H | 0.870 | 0.001 | 2 |
277 | 1 | 39 | VAL | HG22 | H | 0.870 | 0.001 | 2 |
278 | 1 | 39 | VAL | HG23 | H | 0.870 | 0.001 | 2 |
279 | 1 | 40 | ASP | H | H | 9.124 | 0.001 | 1 |
280 | 1 | 40 | ASP | HA | H | 5.242 | 0.002 | 1 |
281 | 1 | 40 | ASP | HB2 | H | 2.874 | 0.001 | 2 |
282 | 1 | 40 | ASP | HB3 | H | 3.431 | 0.002 | 2 |
283 | 1 | 41 | GLY | HA2 | H | 4.671 | 0.000 | 2 |
284 | 1 | 41 | GLY | HA3 | H | 4.163 | 0.000 | 2 |
285 | 1 | 42 | GLU | H | H | 8.381 | 0.002 | 1 |
286 | 1 | 42 | GLU | HA | H | 4.737 | 0.000 | 1 |
287 | 1 | 42 | GLU | HB2 | H | 2.113 | 0.000 | 2 |
288 | 1 | 42 | GLU | HB3 | H | 1.977 | 0.000 | 2 |
289 | 1 | 42 | GLU | HG2 | H | 2.377 | 0.002 | 2 |
290 | 1 | 42 | GLU | HG3 | H | 2.276 | 0.000 | 2 |
291 | 1 | 43 | TRP | H | H | 9.215 | 0.001 | 1 |
292 | 1 | 43 | TRP | HA | H | 5.247 | 0.001 | 1 |
293 | 1 | 43 | TRP | HB2 | H | 3.369 | 0.000 | 2 |
294 | 1 | 43 | TRP | HB3 | H | 3.135 | 0.002 | 2 |
295 | 1 | 43 | TRP | HD1 | H | 7.308 | 0.000 | 1 |
296 | 1 | 43 | TRP | HE1 | H | 10.107 | 0.000 | 1 |
297 | 1 | 43 | TRP | HE3 | H | 7.623 | 0.001 | 1 |
298 | 1 | 43 | TRP | HZ2 | H | 7.327 | 0.000 | 1 |
299 | 1 | 43 | TRP | HZ3 | H | 6.608 | 0.000 | 1 |
300 | 1 | 43 | TRP | HH2 | H | 6.730 | 0.002 | 1 |
301 | 1 | 44 | THR | H | H | 9.296 | 0.001 | 1 |
302 | 1 | 44 | THR | HA | H | 4.826 | 0.001 | 1 |
303 | 1 | 44 | THR | HB | H | 4.237 | 0.002 | 1 |
304 | 1 | 44 | THR | HG21 | H | 1.210 | 0.002 | 1 |
305 | 1 | 44 | THR | HG22 | H | 1.210 | 0.002 | 1 |
306 | 1 | 44 | THR | HG23 | H | 1.210 | 0.002 | 1 |
307 | 1 | 45 | TYR | H | H | 8.574 | 0.001 | 1 |
308 | 1 | 45 | TYR | HA | H | 4.981 | 0.003 | 1 |
309 | 1 | 45 | TYR | HB2 | H | 2.904 | 0.000 | 2 |
310 | 1 | 45 | TYR | HB3 | H | 2.508 | 0.001 | 2 |
311 | 1 | 45 | TYR | HD1 | H | 7.150 | 0.000 | 1 |
312 | 1 | 45 | TYR | HD2 | H | 7.150 | 0.000 | 1 |
313 | 1 | 45 | TYR | HE1 | H | 6.360 | 0.000 | 1 |
314 | 1 | 45 | TYR | HE2 | H | 6.360 | 0.000 | 1 |
315 | 1 | 46 | ASP | H | H | 7.576 | 0.000 | 1 |
316 | 1 | 46 | ASP | HA | H | 4.598 | 0.001 | 1 |
317 | 1 | 46 | ASP | HB2 | H | 2.612 | 0.000 | 2 |
318 | 1 | 46 | ASP | HB3 | H | 2.272 | 0.001 | 2 |
319 | 1 | 47 | ASP | H | H | 8.597 | 0.000 | 1 |
320 | 1 | 47 | ASP | HA | H | 4.177 | 0.001 | 1 |
321 | 1 | 47 | ASP | HB2 | H | 2.844 | 0.001 | 2 |
322 | 1 | 47 | ASP | HB3 | H | 2.532 | 0.002 | 2 |
323 | 1 | 48 | ALA | H | H | 8.360 | 0.000 | 1 |
324 | 1 | 48 | ALA | HA | H | 4.124 | 0.001 | 1 |
325 | 1 | 48 | ALA | HB1 | H | 1.515 | 0.001 | 1 |
326 | 1 | 48 | ALA | HB2 | H | 1.515 | 0.001 | 1 |
327 | 1 | 48 | ALA | HB3 | H | 1.515 | 0.001 | 1 |
328 | 1 | 49 | THR | H | H | 7.023 | 0.000 | 1 |
329 | 1 | 49 | THR | HA | H | 4.404 | 0.000 | 1 |
330 | 1 | 49 | THR | HB | H | 4.420 | 0.000 | 1 |
331 | 1 | 49 | THR | HG21 | H | 1.089 | 0.000 | 1 |
332 | 1 | 49 | THR | HG22 | H | 1.089 | 0.000 | 1 |
333 | 1 | 49 | THR | HG23 | H | 1.089 | 0.000 | 1 |
334 | 1 | 50 | LYS | H | H | 7.875 | 0.000 | 1 |
335 | 1 | 50 | LYS | HA | H | 4.214 | 0.000 | 1 |
336 | 1 | 50 | LYS | HB2 | H | 2.082 | 0.003 | 2 |
337 | 1 | 50 | LYS | HB3 | H | 2.004 | 0.002 | 2 |
338 | 1 | 50 | LYS | HG2 | H | 1.396 | 0.000 | 2 |
339 | 1 | 50 | LYS | HG3 | H | 1.232 | 0.000 | 2 |
340 | 1 | 50 | LYS | HD2 | H | 1.705 | 0.000 | 2 |
341 | 1 | 50 | LYS | HD3 | H | 1.414 | 0.000 | 2 |
342 | 1 | 50 | LYS | HE2 | H | 3.099 | 0.001 | 2 |
343 | 1 | 50 | LYS | HE3 | H | 2.971 | 0.000 | 2 |
344 | 1 | 51 | THR | H | H | 7.393 | 0.001 | 1 |
345 | 1 | 51 | THR | HA | H | 5.515 | 0.001 | 1 |
346 | 1 | 51 | THR | HB | H | 3.779 | 0.001 | 1 |
347 | 1 | 51 | THR | HG21 | H | 1.003 | 0.001 | 1 |
348 | 1 | 51 | THR | HG22 | H | 1.003 | 0.001 | 1 |
349 | 1 | 51 | THR | HG23 | H | 1.003 | 0.001 | 1 |
350 | 1 | 52 | PHE | H | H | 10.363 | 0.002 | 1 |
351 | 1 | 52 | PHE | HA | H | 5.653 | 0.000 | 1 |
352 | 1 | 52 | PHE | HB2 | H | 3.280 | 0.001 | 2 |
353 | 1 | 52 | PHE | HB3 | H | 3.187 | 0.001 | 2 |
354 | 1 | 52 | PHE | HD1 | H | 7.816 | 0.001 | 1 |
355 | 1 | 52 | PHE | HD2 | H | 7.816 | 0.001 | 1 |
356 | 1 | 52 | PHE | HE1 | H | 7.156 | 0.000 | 1 |
357 | 1 | 52 | PHE | HE2 | H | 7.156 | 0.000 | 1 |
358 | 1 | 52 | PHE | HZ | H | 6.998 | 0.000 | 1 |
359 | 1 | 53 | THR | H | H | 9.117 | 0.001 | 1 |
360 | 1 | 53 | THR | HA | H | 5.167 | 0.001 | 1 |
361 | 1 | 53 | THR | HB | H | 3.835 | 0.002 | 1 |
362 | 1 | 53 | THR | HG21 | H | 0.988 | 0.001 | 1 |
363 | 1 | 53 | THR | HG22 | H | 0.988 | 0.001 | 1 |
364 | 1 | 53 | THR | HG23 | H | 0.988 | 0.001 | 1 |
365 | 1 | 54 | VAL | H | H | 8.347 | 0.001 | 1 |
366 | 1 | 54 | VAL | HA | H | 4.524 | 0.000 | 1 |
367 | 1 | 54 | VAL | HB | H | 0.063 | 0.002 | 1 |
368 | 1 | 54 | VAL | HG11 | H | -0.368 | 0.001 | 2 |
369 | 1 | 54 | VAL | HG12 | H | -0.368 | 0.001 | 2 |
370 | 1 | 54 | VAL | HG13 | H | -0.368 | 0.001 | 2 |
371 | 1 | 54 | VAL | HG21 | H | 0.364 | 0.000 | 2 |
372 | 1 | 54 | VAL | HG22 | H | 0.364 | 0.000 | 2 |
373 | 1 | 54 | VAL | HG23 | H | 0.364 | 0.000 | 2 |
374 | 1 | 55 | THR | H | H | 8.360 | 0.001 | 1 |
375 | 1 | 55 | THR | HA | H | 4.736 | 0.000 | 1 |
376 | 1 | 55 | THR | HB | H | 3.847 | 0.001 | 1 |
377 | 1 | 55 | THR | HG21 | H | 1.263 | 0.001 | 1 |
378 | 1 | 55 | THR | HG22 | H | 1.263 | 0.001 | 1 |
379 | 1 | 55 | THR | HG23 | H | 1.263 | 0.001 | 1 |
380 | 1 | 56 | GLU | H | H | 7.855 | 0.000 | 1 |
381 | 1 | 56 | GLU | HA | H | 4.269 | 0.001 | 1 |
382 | 1 | 56 | GLU | HB2 | H | 2.053 | 0.000 | 2 |
383 | 1 | 56 | GLU | HB3 | H | 1.913 | 0.000 | 2 |
384 | 1 | 56 | GLU | HG2 | H | 2.149 | 0.000 | 1 |
385 | 1 | 56 | GLU | HG3 | H | 2.149 | 0.000 | 1 |