Solution NMR structure of the SH3 domain of human Caskin1
ID | Entity ID | Seq ID | Comp ID | Atom ID | Atom type | Val | Val err | Ambig. code |
---|---|---|---|---|---|---|---|---|
1 | 1 | 2 | SER | HA | H | 5.35 | 0 | |
2 | 1 | 2 | SER | HB2 | H | 3.81 | 0 | |
3 | 1 | 2 | SER | HB3 | H | 3.81 | 0 | |
4 | 1 | 2 | SER | CA | C | 58.3 | 0 | |
5 | 1 | 2 | SER | CB | C | 63.8 | 0 | |
6 | 1 | 3 | HIS | H | H | 8.51 | 0 | |
7 | 1 | 3 | HIS | HA | H | 4.64 | 0 | |
8 | 1 | 3 | HIS | HB2 | H | 3.08 | 0 | |
9 | 1 | 3 | HIS | HB3 | H | 3.08 | 0 | |
10 | 1 | 3 | HIS | CA | C | 56.2 | 0 | |
11 | 1 | 3 | HIS | CB | C | 30.6 | 0 | |
12 | 1 | 3 | HIS | N | N | 121.1 | 0 | |
13 | 1 | 4 | MET | H | H | 8.23 | 0 | |
14 | 1 | 4 | MET | HA | H | 4.40 | 0 | |
15 | 1 | 4 | MET | HB2 | H | 1.83 | 0 | |
16 | 1 | 4 | MET | HB3 | H | 1.83 | 0 | |
17 | 1 | 4 | MET | HG2 | H | 2.42 | 0 | |
18 | 1 | 4 | MET | HG3 | H | 2.42 | 0 | |
19 | 1 | 4 | MET | CA | C | 55.3 | 0 | |
20 | 1 | 4 | MET | CB | C | 33.4 | 0 | |
21 | 1 | 4 | MET | N | N | 122 | 0 | |
22 | 1 | 5 | LEU | H | H | 8.53 | 0 | |
23 | 1 | 5 | LEU | HA | H | 4.39 | 0 | |
24 | 1 | 5 | LEU | HB2 | H | 1.64 | 0 | |
25 | 1 | 5 | LEU | HB3 | H | 1 | 0 | |
26 | 1 | 5 | LEU | HD11 | H | 0.93 | 0 | |
27 | 1 | 5 | LEU | HD12 | H | 0.93 | 0 | |
28 | 1 | 5 | LEU | HD13 | H | 0.93 | 0 | |
29 | 1 | 5 | LEU | HD21 | H | 0.81 | 0 | |
30 | 1 | 5 | LEU | HD22 | H | 0.81 | 0 | |
31 | 1 | 5 | LEU | HD23 | H | 0.81 | 0 | |
32 | 1 | 5 | LEU | CA | C | 55.8 | 0 | |
33 | 1 | 5 | LEU | N | N | 125.2 | 0 | |
34 | 1 | 6 | GLN | H | H | 8.52 | 0 | |
35 | 1 | 6 | GLN | HA | H | 5.60 | 0 | |
36 | 1 | 6 | GLN | HB2 | H | 1.92 | 0 | |
37 | 1 | 6 | GLN | HB3 | H | 1.66 | 0 | |
38 | 1 | 6 | GLN | HG2 | H | 2.29 | 0 | |
39 | 1 | 6 | GLN | HG3 | H | 2.29 | 0 | |
40 | 1 | 6 | GLN | HE21 | H | 7.18 | 0 | |
41 | 1 | 6 | GLN | HE22 | H | 6.79 | 0 | |
42 | 1 | 6 | GLN | CA | C | 53.9 | 0 | |
43 | 1 | 6 | GLN | CB | C | 33.1 | 0 | |
44 | 1 | 6 | GLN | N | N | 122.5 | 0 | |
45 | 1 | 6 | GLN | NE2 | N | 111.5 | 0 | |
46 | 1 | 7 | VAL | H | H | 8.97 | 0 | |
47 | 1 | 7 | VAL | HA | H | 4.97 | 0 | |
48 | 1 | 7 | VAL | HB | H | 1.84 | 0 | |
49 | 1 | 7 | VAL | HG11 | H | 0.88 | 0 | |
50 | 1 | 7 | VAL | HG12 | H | 0.88 | 0 | |
51 | 1 | 7 | VAL | HG13 | H | 0.88 | 0 | |
52 | 1 | 7 | VAL | HG21 | H | 0.88 | 0 | |
53 | 1 | 7 | VAL | HG22 | H | 0.88 | 0 | |
54 | 1 | 7 | VAL | HG23 | H | 0.88 | 0 | |
55 | 1 | 7 | VAL | CA | C | 58.3 | 0 | |
56 | 1 | 7 | VAL | CB | C | 35.5 | 0 | |
57 | 1 | 7 | VAL | N | N | 112 | 0 | |
58 | 1 | 8 | ARG | H | H | 9.06 | 0 | |
59 | 1 | 8 | ARG | HA | H | 5.13 | 0 | |
60 | 1 | 8 | ARG | HB2 | H | 1.77 | 0 | |
61 | 1 | 8 | ARG | HB3 | H | 1.83 | 0 | |
62 | 1 | 8 | ARG | HG2 | H | 1.39 | 0 | |
63 | 1 | 8 | ARG | HG3 | H | 1.5 | 0 | |
64 | 1 | 8 | ARG | HD2 | H | 3.21 | 0 | |
65 | 1 | 8 | ARG | HD3 | H | 3.26 | 0 | |
66 | 1 | 8 | ARG | CA | C | 53.5 | 0 | |
67 | 1 | 8 | ARG | CB | C | 32.5 | 0 | |
68 | 1 | 8 | ARG | N | N | 122.1 | 0 | |
69 | 1 | 9 | ALA | H | H | 9.21 | 0 | |
70 | 1 | 9 | ALA | HA | H | 4.52 | 0 | |
71 | 1 | 9 | ALA | HB1 | H | 1.41 | 0 | |
72 | 1 | 9 | ALA | HB2 | H | 1.41 | 0 | |
73 | 1 | 9 | ALA | HB3 | H | 1.41 | 0 | |
74 | 1 | 9 | ALA | CA | C | 52.3 | 0 | |
75 | 1 | 9 | ALA | CB | C | 20.4 | 0 | |
76 | 1 | 9 | ALA | N | N | 128.7 | 0 | |
77 | 1 | 10 | THR | H | H | 9.36 | 0 | |
78 | 1 | 10 | THR | HA | H | 4.29 | 0 | |
79 | 1 | 10 | THR | HB | H | 4.42 | 0 | |
80 | 1 | 10 | THR | HG21 | H | 1.27 | 0 | |
81 | 1 | 10 | THR | HG22 | H | 1.27 | 0 | |
82 | 1 | 10 | THR | HG23 | H | 1.27 | 0 | |
83 | 1 | 10 | THR | CA | C | 62.6 | 0 | |
84 | 1 | 10 | THR | CB | C | 69.5 | 0 | |
85 | 1 | 10 | THR | N | N | 115.5 | 0 | |
86 | 1 | 11 | LYS | H | H | 7.39 | 0 | |
87 | 1 | 11 | LYS | HA | H | 4.60 | 0 | |
88 | 1 | 11 | LYS | HB2 | H | 2.02 | 0 | |
89 | 1 | 11 | LYS | HB3 | H | 2.02 | 0 | |
90 | 1 | 11 | LYS | HG2 | H | 1.45 | 0 | |
91 | 1 | 11 | LYS | HG3 | H | 1.40 | 0 | |
92 | 1 | 11 | LYS | HD2 | H | 1.72 | 0 | |
93 | 1 | 11 | LYS | HD3 | H | 1.7 | 0 | |
94 | 1 | 11 | LYS | HE2 | H | 2.98 | 0 | |
95 | 1 | 11 | LYS | HE3 | H | 2.98 | 0 | |
96 | 1 | 11 | LYS | N | N | 117.1 | 0 | |
97 | 1 | 12 | ASP | H | H | 8.14 | 0 | |
98 | 1 | 12 | ASP | HA | H | 4.60 | 0 | |
99 | 1 | 12 | ASP | HB2 | H | 2.71 | 0 | |
100 | 1 | 12 | ASP | HB3 | H | 2.63 | 0 | |
101 | 1 | 12 | ASP | CA | C | 54.0 | 0 | |
102 | 1 | 12 | ASP | CB | C | 41.6 | 0 | |
103 | 1 | 12 | ASP | N | N | 116.5 | 0 | |
104 | 1 | 13 | TYR | H | H | 9.04 | 0 | |
105 | 1 | 13 | TYR | HA | H | 4.61 | 0 | |
106 | 1 | 13 | TYR | HB2 | H | 3.03 | 0 | |
107 | 1 | 13 | TYR | HB3 | H | 2.67 | 0 | |
108 | 1 | 13 | TYR | HD1 | H | 7.44 | 0 | |
109 | 1 | 13 | TYR | HD2 | H | 7.44 | 0 | |
110 | 1 | 13 | TYR | HE1 | H | 7.07 | 0 | |
111 | 1 | 13 | TYR | HE2 | H | 7.07 | 0 | |
112 | 1 | 13 | TYR | CA | C | 58.8 | 0 | |
113 | 1 | 13 | TYR | CB | C | 42.7 | 0 | |
114 | 1 | 13 | TYR | N | N | 120.8 | 0 | |
115 | 1 | 14 | CYS | H | H | 8.09 | 0 | |
116 | 1 | 14 | CYS | HA | H | 4.42 | 0 | |
117 | 1 | 14 | CYS | HB2 | H | 2.75 | 0 | |
118 | 1 | 14 | CYS | HB3 | H | 2.70 | 0 | |
119 | 1 | 14 | CYS | CA | C | 57.1 | 0 | |
120 | 1 | 14 | CYS | CB | C | 28.2 | 0 | |
121 | 1 | 14 | CYS | N | N | 125.7 | 0 | |
122 | 1 | 15 | ASN | H | H | 8.85 | 0 | |
123 | 1 | 15 | ASN | HA | H | 4.81 | 0 | |
124 | 1 | 15 | ASN | HB2 | H | 2.43 | 0 | |
125 | 1 | 15 | ASN | HB3 | H | 2.99 | 0 | |
126 | 1 | 15 | ASN | HD21 | H | 7.32 | 0 | |
127 | 1 | 15 | ASN | HD22 | H | 7.12 | 0 | |
128 | 1 | 15 | ASN | CA | C | 51.5 | 0 | |
129 | 1 | 15 | ASN | CB | C | 38.6 | 0 | |
130 | 1 | 15 | ASN | N | N | 124.7 | 0 | |
131 | 1 | 15 | ASN | ND2 | N | 110.8 | 0 | |
132 | 1 | 16 | ASN | HA | H | 4.34 | 0 | |
133 | 1 | 16 | ASN | HB2 | H | 2.55 | 0 | |
134 | 1 | 16 | ASN | HB3 | H | 2.29 | 0 | |
135 | 1 | 16 | ASN | HD21 | H | 7.35 | 0 | |
136 | 1 | 16 | ASN | HD22 | H | 6.65 | 0 | |
137 | 1 | 16 | ASN | CA | C | 54.5 | 0 | |
138 | 1 | 16 | ASN | CB | C | 38.2 | 0 | |
139 | 1 | 16 | ASN | ND2 | N | 112.1 | 0 | |
140 | 1 | 17 | TYR | H | H | 7.96 | 0 | |
141 | 1 | 17 | TYR | HA | H | 4.45 | 0 | |
142 | 1 | 17 | TYR | HB2 | H | 3.21 | 0 | |
143 | 1 | 17 | TYR | HB3 | H | 2.94 | 0 | |
144 | 1 | 17 | TYR | HD1 | H | 7.88 | 0 | |
145 | 1 | 17 | TYR | HD2 | H | 7.88 | 0 | |
146 | 1 | 17 | TYR | HE1 | H | 7.16 | 0 | |
147 | 1 | 17 | TYR | HE2 | H | 7.16 | 0 | |
148 | 1 | 17 | TYR | CA | C | 58.3 | 0 | |
149 | 1 | 17 | TYR | CB | C | 38.1 | 0 | |
150 | 1 | 17 | TYR | N | N | 116 | 0 | |
151 | 1 | 18 | ASP | H | H | 7.13 | 0 | |
152 | 1 | 18 | ASP | HA | H | 4.85 | 0 | |
153 | 1 | 18 | ASP | HB2 | H | 2.78 | 0 | |
154 | 1 | 18 | ASP | HB3 | H | 2.63 | 0 | |
155 | 1 | 18 | ASP | CA | C | 52.1 | 0 | |
156 | 1 | 18 | ASP | CB | C | 41.6 | 0 | |
157 | 1 | 18 | ASP | N | N | 117.6 | 0 | |
158 | 1 | 19 | LEU | H | H | 9.00 | 0 | |
159 | 1 | 19 | LEU | HA | H | 4.35 | 0 | |
160 | 1 | 19 | LEU | HB2 | H | 1.78 | 0 | |
161 | 1 | 19 | LEU | N | N | 126.1 | 0 | |
162 | 1 | 20 | THR | H | H | 8.49 | 0 | |
163 | 1 | 20 | THR | HA | H | 4.79 | 0 | |
164 | 1 | 20 | THR | HG21 | H | 1.32 | 0 | |
165 | 1 | 20 | THR | HG22 | H | 1.32 | 0 | |
166 | 1 | 20 | THR | HG23 | H | 1.32 | 0 | |
167 | 1 | 20 | THR | CA | C | 61.9 | 0 | |
168 | 1 | 20 | THR | CB | C | 69.4 | 0 | |
169 | 1 | 20 | THR | N | N | 108.2 | 0 | |
170 | 1 | 21 | SER | H | H | 7.85 | 0 | |
171 | 1 | 21 | SER | HA | H | 4.99 | 0 | |
172 | 1 | 21 | SER | HB2 | H | 4.29 | 0 | |
173 | 1 | 21 | SER | HB3 | H | 4.24 | 0 | |
174 | 1 | 21 | SER | CA | C | 59.1 | 0 | |
175 | 1 | 21 | SER | CB | C | 65.3 | 0 | |
176 | 1 | 21 | SER | N | N | 118.2 | 0 | |
177 | 1 | 22 | LEU | H | H | 9.33 | 0 | |
178 | 1 | 22 | LEU | HA | H | 4.26 | 0 | |
179 | 1 | 22 | LEU | HB2 | H | 1.64 | 0 | |
180 | 1 | 22 | LEU | HB3 | H | 1.26 | 0 | |
181 | 1 | 22 | LEU | HD11 | H | 0.65 | 0 | |
182 | 1 | 22 | LEU | HD12 | H | 0.65 | 0 | |
183 | 1 | 22 | LEU | HD13 | H | 0.65 | 0 | |
184 | 1 | 22 | LEU | HD21 | H | 1 | 0 | |
185 | 1 | 22 | LEU | HD22 | H | 1 | 0 | |
186 | 1 | 22 | LEU | HD23 | H | 1 | 0 | |
187 | 1 | 22 | LEU | N | N | 126.5 | 0 | |
188 | 1 | 23 | ASN | H | H | 8.46 | 0 | |
189 | 1 | 23 | ASN | HA | H | 5.02 | 0 | |
190 | 1 | 23 | ASN | HB2 | H | 2.72 | 0 | |
191 | 1 | 23 | ASN | HB3 | H | 2.72 | 0 | |
192 | 1 | 23 | ASN | HD21 | H | 7.56 | 0 | |
193 | 1 | 23 | ASN | HD22 | H | 6.91 | 0 | |
194 | 1 | 23 | ASN | CA | C | 53.3 | 0 | |
195 | 1 | 23 | ASN | CB | C | 38.6 | 0 | |
196 | 1 | 23 | ASN | N | N | 124.1 | 0 | |
197 | 1 | 23 | ASN | ND2 | N | 112.4 | 0 | |
198 | 1 | 24 | VAL | H | H | 9.29 | 0 | |
199 | 1 | 24 | VAL | HA | H | 4.10 | 0 | |
200 | 1 | 24 | VAL | HB | H | 2.15 | 0 | |
201 | 1 | 24 | VAL | HG11 | H | 0.85 | 0 | |
202 | 1 | 24 | VAL | HG12 | H | 0.85 | 0 | |
203 | 1 | 24 | VAL | HG13 | H | 0.85 | 0 | |
204 | 1 | 24 | VAL | HG21 | H | 0.85 | 0 | |
205 | 1 | 24 | VAL | HG22 | H | 0.85 | 0 | |
206 | 1 | 24 | VAL | HG23 | H | 0.85 | 0 | |
207 | 1 | 24 | VAL | CA | C | 61.9 | 0 | |
208 | 1 | 24 | VAL | CB | C | 35.4 | 0 | |
209 | 1 | 24 | VAL | N | N | 126.9 | 0 | |
210 | 1 | 25 | LYS | H | H | 9.26 | 0 | |
211 | 1 | 25 | LYS | HA | H | 4.88 | 0 | |
212 | 1 | 25 | LYS | HB2 | H | 1.70 | 0 | |
213 | 1 | 25 | LYS | HB3 | H | 1.70 | 0 | |
214 | 1 | 25 | LYS | HG2 | H | 1.42 | 0 | |
215 | 1 | 25 | LYS | HG3 | H | 1.42 | 0 | |
216 | 1 | 25 | LYS | HE2 | H | 2.99 | 0 | |
217 | 1 | 25 | LYS | HE3 | H | 2.99 | 0 | |
218 | 1 | 25 | LYS | N | N | 130.3 | 0 | |
219 | 1 | 26 | ALA | H | H | 9.00 | 0 | |
220 | 1 | 26 | ALA | HA | H | 3.30 | 0 | |
221 | 1 | 26 | ALA | HB1 | H | 1.15 | 0 | |
222 | 1 | 26 | ALA | HB2 | H | 1.15 | 0 | |
223 | 1 | 26 | ALA | HB3 | H | 1.15 | 0 | |
224 | 1 | 26 | ALA | CA | C | 54.0 | 0 | |
225 | 1 | 26 | ALA | CB | C | 17.8 | 0 | |
226 | 1 | 26 | ALA | N | N | 124.2 | 0 | |
227 | 1 | 27 | GLY | H | H | 8.84 | 0 | |
228 | 1 | 27 | GLY | HA2 | H | 3.45 | 0 | |
229 | 1 | 27 | GLY | HA3 | H | 4.46 | 0 | |
230 | 1 | 27 | GLY | CA | C | 44.9 | 0 | |
231 | 1 | 27 | GLY | N | N | 112.2 | 0 | |
232 | 1 | 28 | ASP | H | H | 8.57 | 0 | |
233 | 1 | 28 | ASP | HA | H | 4.46 | 0 | |
234 | 1 | 28 | ASP | HB2 | H | 2.70 | 0 | |
235 | 1 | 28 | ASP | HB3 | H | 2.27 | 0 | |
236 | 1 | 28 | ASP | CA | C | 55.8 | 0 | |
237 | 1 | 28 | ASP | CB | C | 41.6 | 0 | |
238 | 1 | 28 | ASP | N | N | 122.1 | 0 | |
239 | 1 | 29 | ILE | H | H | 8.43 | 0 | |
240 | 1 | 29 | ILE | HA | H | 4.58 | 0 | |
241 | 1 | 29 | ILE | HB | H | 1.92 | 0 | |
242 | 1 | 29 | ILE | HG12 | H | 1.75 | 0 | |
243 | 1 | 29 | ILE | HG13 | H | 1.34 | 0 | |
244 | 1 | 29 | ILE | HG21 | H | 0.75 | 0 | |
245 | 1 | 29 | ILE | HG22 | H | 0.75 | 0 | |
246 | 1 | 29 | ILE | HG23 | H | 0.75 | 0 | |
247 | 1 | 29 | ILE | HD11 | H | 0.80 | 0 | |
248 | 1 | 29 | ILE | HD12 | H | 0.80 | 0 | |
249 | 1 | 29 | ILE | HD13 | H | 0.80 | 0 | |
250 | 1 | 29 | ILE | N | N | 120.4 | 0 | |
251 | 1 | 30 | ILE | H | H | 9.29 | 0 | |
252 | 1 | 30 | ILE | HA | H | 4.32 | 0 | |
253 | 1 | 30 | ILE | HG12 | H | 1.37 | 0 | |
254 | 1 | 30 | ILE | HG13 | H | 1.45 | 0 | |
255 | 1 | 30 | ILE | HG21 | H | 0.29 | 0 | |
256 | 1 | 30 | ILE | HG22 | H | 0.29 | 0 | |
257 | 1 | 30 | ILE | HG23 | H | 0.29 | 0 | |
258 | 1 | 30 | ILE | HD11 | H | -0.08 | 0 | |
259 | 1 | 30 | ILE | HD12 | H | -0.08 | 0 | |
260 | 1 | 30 | ILE | HD13 | H | -0.08 | 0 | |
261 | 1 | 30 | ILE | N | N | 128.44 | 0 | |
262 | 1 | 31 | THR | H | H | 9.13 | 0 | |
263 | 1 | 31 | THR | HA | H | 4.60 | 0 | |
264 | 1 | 31 | THR | HB | H | 4.15 | 0 | |
265 | 1 | 31 | THR | HG21 | H | 1.13 | 0 | |
266 | 1 | 31 | THR | HG22 | H | 1.13 | 0 | |
267 | 1 | 31 | THR | HG23 | H | 1.13 | 0 | |
268 | 1 | 31 | THR | CA | C | 63.5 | 0 | |
269 | 1 | 31 | THR | CB | C | 69.0 | 0 | |
270 | 1 | 31 | THR | N | N | 124.1 | 0 | |
271 | 1 | 32 | VAL | H | H | 9.31 | 0 | |
272 | 1 | 32 | VAL | HA | H | 4.00 | 0 | |
273 | 1 | 32 | VAL | HB | H | 2.10 | 0 | |
274 | 1 | 32 | VAL | HG11 | H | 1.22 | 0 | |
275 | 1 | 32 | VAL | HG12 | H | 1.22 | 0 | |
276 | 1 | 32 | VAL | HG13 | H | 1.22 | 0 | |
277 | 1 | 32 | VAL | HG21 | H | 0.65 | 0 | |
278 | 1 | 32 | VAL | HG22 | H | 0.65 | 0 | |
279 | 1 | 32 | VAL | HG23 | H | 0.65 | 0 | |
280 | 1 | 32 | VAL | CA | C | 64.6 | 0 | |
281 | 1 | 32 | VAL | CB | C | 31.3 | 0 | |
282 | 1 | 32 | VAL | N | N | 129.4 | 0 | |
283 | 1 | 33 | LEU | H | H | 9.04 | 0 | |
284 | 1 | 33 | LEU | HA | H | 4.41 | 0 | |
285 | 1 | 33 | LEU | HB2 | H | 1.60 | 0 | |
286 | 1 | 33 | LEU | HB3 | H | 1.60 | 0 | |
287 | 1 | 33 | LEU | HG | H | 1.22 | 0 | |
288 | 1 | 33 | LEU | HD11 | H | 0.81 | 0 | |
289 | 1 | 33 | LEU | HD12 | H | 0.81 | 0 | |
290 | 1 | 33 | LEU | HD13 | H | 0.81 | 0 | |
291 | 1 | 33 | LEU | HD21 | H | -0.05 | 0 | |
292 | 1 | 33 | LEU | HD22 | H | -0.05 | 0 | |
293 | 1 | 33 | LEU | HD23 | H | -0.05 | 0 | |
294 | 1 | 33 | LEU | N | N | 128 | 0 | |
295 | 1 | 34 | GLU | H | H | 7.64 | 0 | |
296 | 1 | 34 | GLU | HA | H | 4.37 | 0 | |
297 | 1 | 34 | GLU | HB2 | H | 1.75 | 0 | |
298 | 1 | 34 | GLU | HB3 | H | 1.84 | 0 | |
299 | 1 | 34 | GLU | HG2 | H | 2.25 | 0 | |
300 | 1 | 34 | GLU | HG3 | H | 2.25 | 0 | |
301 | 1 | 34 | GLU | CA | C | 55.3 | 0 | |
302 | 1 | 34 | GLU | CB | C | 34.5 | 0 | |
303 | 1 | 34 | GLU | N | N | 114.3 | 0 | |
304 | 1 | 35 | GLN | H | H | 8.39 | 0 | |
305 | 1 | 35 | GLN | HA | H | 3.05 | 0 | |
306 | 1 | 35 | GLN | HB2 | H | 1.22 | 0 | |
307 | 1 | 35 | GLN | HB3 | H | 1.22 | 0 | |
308 | 1 | 35 | GLN | HG2 | H | 2.02 | 0 | |
309 | 1 | 35 | GLN | HG3 | H | 2.02 | 0 | |
310 | 1 | 35 | GLN | HE21 | H | 6.65 | 0 | |
311 | 1 | 35 | GLN | HE22 | H | 6.27 | 0 | |
312 | 1 | 35 | GLN | CA | C | 53.7 | 0 | |
313 | 1 | 35 | GLN | CB | C | 29.6 | 0 | |
314 | 1 | 35 | GLN | N | N | 122.5 | 0 | |
315 | 1 | 35 | GLN | NE2 | N | 111.5 | 0 | |
316 | 1 | 36 | HIS | H | H | 6.95 | 0 | |
317 | 1 | 36 | HIS | HA | H | 4.88 | 0 | |
318 | 1 | 36 | HIS | HB2 | H | 3.31 | 0 | |
319 | 1 | 36 | HIS | HB3 | H | 3.28 | 0 | |
320 | 1 | 36 | HIS | CA | C | 55.1 | 0 | |
321 | 1 | 36 | HIS | CB | C | 32.6 | 0 | |
322 | 1 | 36 | HIS | N | N | 121.2 | 0 | |
323 | 1 | 37 | PRO | HA | H | 4.54 | 0 | |
324 | 1 | 37 | PRO | HB2 | H | 2.09 | 0 | |
325 | 1 | 37 | PRO | HB3 | H | 2.09 | 0 | |
326 | 1 | 37 | PRO | CA | C | 64.8 | 0 | |
327 | 1 | 37 | PRO | CB | C | 32.0 | 0 | |
328 | 1 | 38 | ASP | H | H | 8.58 | 0 | |
329 | 1 | 38 | ASP | HA | H | 4.52 | 0 | |
330 | 1 | 38 | ASP | HB2 | H | 2.96 | 0 | |
331 | 1 | 38 | ASP | HB3 | H | 2.68 | 0 | |
332 | 1 | 38 | ASP | CA | C | 54.0 | 0 | |
333 | 1 | 38 | ASP | CB | C | 39.8 | 0 | |
334 | 1 | 38 | ASP | N | N | 117.7 | 0 | |
335 | 1 | 39 | GLY | H | H | 8.25 | 0 | |
336 | 1 | 39 | GLY | HA2 | H | 3.63 | 0 | |
337 | 1 | 39 | GLY | HA3 | H | 4.17 | 0 | |
338 | 1 | 39 | GLY | CA | C | 45.4 | 0 | |
339 | 1 | 39 | GLY | N | N | 107 | 0 | |
340 | 1 | 40 | ARG | H | H | 8.23 | 0 | |
341 | 1 | 40 | ARG | HA | H | 4.53 | 0 | |
342 | 1 | 40 | ARG | HB2 | H | 1.42 | 0 | |
343 | 1 | 40 | ARG | HB3 | H | 1.42 | 0 | |
344 | 1 | 40 | ARG | HG2 | H | 1.92 | 0 | |
345 | 1 | 40 | ARG | HG3 | H | 1.80 | 0 | |
346 | 1 | 40 | ARG | HD2 | H | 2.90 | 0 | |
347 | 1 | 40 | ARG | HD3 | H | 2.90 | 0 | |
348 | 1 | 40 | ARG | CA | C | 55.5 | 0 | |
349 | 1 | 40 | ARG | CB | C | 29.1 | 0 | |
350 | 1 | 40 | ARG | N | N | 123.5 | 0 | |
351 | 1 | 41 | TRP | H | H | 8.37 | 0 | |
352 | 1 | 41 | TRP | HA | H | 5.19 | 0 | |
353 | 1 | 41 | TRP | HB2 | H | 2.95 | 0 | |
354 | 1 | 41 | TRP | HB3 | H | 2.00 | 0 | |
355 | 1 | 41 | TRP | HD1 | H | 7 | 0 | |
356 | 1 | 41 | TRP | HE1 | H | 10.08 | 0 | |
357 | 1 | 41 | TRP | HE3 | H | 7.16 | 0 | |
358 | 1 | 41 | TRP | HZ2 | H | 7.23 | 0 | |
359 | 1 | 41 | TRP | HZ3 | H | 6.86 | 0 | |
360 | 1 | 41 | TRP | HH2 | H | 7.41 | 0 | |
361 | 1 | 41 | TRP | CA | C | 54.4 | 0 | |
362 | 1 | 41 | TRP | CB | C | 31.8 | 0 | |
363 | 1 | 41 | TRP | N | N | 126.8 | 0 | |
364 | 1 | 41 | TRP | NE1 | N | 127.5 | 0.4 | |
365 | 1 | 42 | LYS | H | H | 8.83 | 0 | |
366 | 1 | 42 | LYS | HA | H | 4.75 | 0 | |
367 | 1 | 42 | LYS | HB2 | H | 1.52 | 0 | |
368 | 1 | 42 | LYS | HB3 | H | 1.52 | 0 | |
369 | 1 | 42 | LYS | N | N | 120.5 | 0 | |
370 | 1 | 43 | GLY | H | H | 9.68 | 0 | |
371 | 1 | 43 | GLY | HA2 | H | 3.67 | 0 | |
372 | 1 | 43 | GLY | HA3 | H | 5.35 | 0 | |
373 | 1 | 43 | GLY | CA | C | 45.4 | 0 | |
374 | 1 | 43 | GLY | N | N | 114.2 | 0 | |
375 | 1 | 44 | CYS | H | H | 8.96 | 0 | |
376 | 1 | 44 | CYS | HA | H | 5.81 | 0 | |
377 | 1 | 44 | CYS | HB2 | H | 2.74 | 0 | |
378 | 1 | 44 | CYS | HB3 | H | 2.74 | 0 | |
379 | 1 | 44 | CYS | CA | C | 55.2 | 0 | |
380 | 1 | 44 | CYS | CB | C | 30.7 | 0 | |
381 | 1 | 44 | CYS | N | N | 116.8 | 0 | |
382 | 1 | 45 | ILE | H | H | 9.23 | 0 | |
383 | 1 | 45 | ILE | HA | H | 4.47 | 0 | |
384 | 1 | 45 | ILE | HG21 | H | 0.88 | 0 | |
385 | 1 | 45 | ILE | HG22 | H | 0.88 | 0 | |
386 | 1 | 45 | ILE | HG23 | H | 0.88 | 0 | |
387 | 1 | 45 | ILE | HD11 | H | 0.88 | 0 | |
388 | 1 | 45 | ILE | HD12 | H | 0.88 | 0 | |
389 | 1 | 45 | ILE | HD13 | H | 0.88 | 0 | |
390 | 1 | 45 | ILE | N | N | 121.9 | 0 | |
391 | 1 | 46 | HIS | H | H | 9.13 | 0 | |
392 | 1 | 46 | HIS | HA | H | 5.00 | 0 | |
393 | 1 | 46 | HIS | HB2 | H | 3.08 | 0 | |
394 | 1 | 46 | HIS | HB3 | H | 3.08 | 0 | |
395 | 1 | 46 | HIS | CA | C | 55.4 | 0 | |
396 | 1 | 46 | HIS | CB | C | 29.7 | 0 | |
397 | 1 | 46 | HIS | N | N | 127.3 | 0 | |
398 | 1 | 47 | ASP | H | H | 8.34 | 0 | |
399 | 1 | 47 | ASP | HA | H | 4.69 | 0 | |
400 | 1 | 47 | ASP | HB2 | H | 3.06 | 0 | |
401 | 1 | 47 | ASP | HB3 | H | 2.42 | 0 | |
402 | 1 | 47 | ASP | CA | C | 53.0 | 0 | |
403 | 1 | 47 | ASP | CB | C | 42.5 | 0 | |
404 | 1 | 47 | ASP | N | N | 127.8 | 0 | |
405 | 1 | 48 | ASN | H | H | 8.94 | 0 | |
406 | 1 | 48 | ASN | HA | H | 4.40 | 0 | |
407 | 1 | 48 | ASN | HB2 | H | 2.86 | 0 | |
408 | 1 | 48 | ASN | HB3 | H | 2.86 | 0 | |
409 | 1 | 48 | ASN | HD21 | H | 7.7 | 0 | |
410 | 1 | 48 | ASN | HD22 | H | 7.03 | 0 | |
411 | 1 | 48 | ASN | CA | C | 55.3 | 0 | |
412 | 1 | 48 | ASN | CB | C | 38.6 | 0 | |
413 | 1 | 48 | ASN | N | N | 123.8 | 0 | |
414 | 1 | 48 | ASN | ND2 | N | 112.6 | 0 | |
415 | 1 | 49 | ARG | H | H | 8.66 | 0 | |
416 | 1 | 49 | ARG | HA | H | 4.25 | 0 | |
417 | 1 | 49 | ARG | HB2 | H | 1.99 | 0 | |
418 | 1 | 49 | ARG | HB3 | H | 1.99 | 0 | |
419 | 1 | 49 | ARG | HG2 | H | 1.66 | 0 | |
420 | 1 | 49 | ARG | HG3 | H | 1.66 | 0 | |
421 | 1 | 49 | ARG | HD2 | H | 3.25 | 0 | |
422 | 1 | 49 | ARG | HD3 | H | 3.25 | 0 | |
423 | 1 | 49 | ARG | CA | C | 58.6 | 0 | |
424 | 1 | 49 | ARG | CB | C | 30.4 | 0 | |
425 | 1 | 49 | ARG | N | N | 118.8 | 0 | |
426 | 1 | 50 | THR | H | H | 7.57 | 0 | |
427 | 1 | 50 | THR | HA | H | 4.33 | 0 | |
428 | 1 | 50 | THR | HB | H | 4.31 | 0 | |
429 | 1 | 50 | THR | HG21 | H | 1.168 | 0 | |
430 | 1 | 50 | THR | HG22 | H | 1.168 | 0 | |
431 | 1 | 50 | THR | HG23 | H | 1.168 | 0 | |
432 | 1 | 50 | THR | CA | C | 61.5 | 0 | |
433 | 1 | 50 | THR | CB | C | 70.6 | 0 | |
434 | 1 | 50 | THR | N | N | 105.8 | 0 | |
435 | 1 | 51 | GLY | H | H | 8.16 | 0 | |
436 | 1 | 51 | GLY | HA2 | H | 3.62 | 0 | |
437 | 1 | 51 | GLY | HA3 | H | 4.20 | 0 | |
438 | 1 | 51 | GLY | CA | C | 45.7 | 0 | |
439 | 1 | 51 | GLY | N | N | 110.2 | 0 | |
440 | 1 | 52 | ASN | H | H | 7.68 | 0 | |
441 | 1 | 52 | ASN | HA | H | 4.82 | 0 | |
442 | 1 | 52 | ASN | HB2 | H | 2.65 | 0 | |
443 | 1 | 52 | ASN | HB3 | H | 2.65 | 0 | |
444 | 1 | 52 | ASN | HD21 | H | 7.35 | 0 | |
445 | 1 | 52 | ASN | HD22 | H | 6.97 | 0 | |
446 | 1 | 52 | ASN | CA | C | 52.4 | 0 | |
447 | 1 | 52 | ASN | CB | C | 40.3 | 0 | |
448 | 1 | 52 | ASN | N | N | 117.1 | 0 | |
449 | 1 | 52 | ASN | ND2 | N | 111.8 | 0 | |
450 | 1 | 53 | ASP | H | H | 8.51 | 0 | |
451 | 1 | 53 | ASP | HA | H | 5.35 | 0 | |
452 | 1 | 53 | ASP | HB2 | H | 2.47 | 0 | |
453 | 1 | 53 | ASP | HB3 | H | 2.47 | 0 | |
454 | 1 | 53 | ASP | CA | C | 54.0 | 0 | |
455 | 1 | 53 | ASP | CB | C | 43.2 | 0 | |
456 | 1 | 53 | ASP | N | N | 120.4 | 0 | |
457 | 1 | 54 | ARG | H | H | 8.81 | 0 | |
458 | 1 | 54 | ARG | HA | H | 4.69 | 0 | |
459 | 1 | 54 | ARG | HB2 | H | 1.73 | 0 | |
460 | 1 | 54 | ARG | HB3 | H | 1.73 | 0 | |
461 | 1 | 54 | ARG | HD2 | H | 3.32 | 0 | |
462 | 1 | 54 | ARG | HD3 | H | 3.32 | 0 | |
463 | 1 | 54 | ARG | CA | C | 55.6 | 0 | |
464 | 1 | 54 | ARG | CB | C | 32.7 | 0 | |
465 | 1 | 54 | ARG | N | N | 122.6 | 0 | |
466 | 1 | 55 | VAL | H | H | 8.59 | 0 | |
467 | 1 | 55 | VAL | HA | H | 5.32 | 0 | |
468 | 1 | 55 | VAL | HB | H | 1.89 | 0 | |
469 | 1 | 55 | VAL | HG11 | H | 0.86 | 0 | |
470 | 1 | 55 | VAL | HG12 | H | 0.86 | 0 | |
471 | 1 | 55 | VAL | HG13 | H | 0.86 | 0 | |
472 | 1 | 55 | VAL | HG21 | H | 0.37 | 0 | |
473 | 1 | 55 | VAL | HG22 | H | 0.37 | 0 | |
474 | 1 | 55 | VAL | HG23 | H | 0.37 | 0 | |
475 | 1 | 55 | VAL | CA | C | 59.8 | 0 | |
476 | 1 | 55 | VAL | CB | C | 35.4 | 0 | |
477 | 1 | 55 | VAL | N | N | 120.6 | 0 | |
478 | 1 | 56 | GLY | H | H | 8.67 | 0 | |
479 | 1 | 56 | GLY | HA2 | H | 4.08 | 0 | |
480 | 1 | 56 | GLY | HA3 | H | 4.08 | 0 | |
481 | 1 | 56 | GLY | CA | C | 45.5 | 0 | |
482 | 1 | 56 | GLY | N | N | 111.2 | 0 | |
483 | 1 | 57 | TYR | H | H | 8.93 | 0 | |
484 | 1 | 57 | TYR | HA | H | 5.97 | 0 | |
485 | 1 | 57 | TYR | HB2 | H | 2.80 | 0 | |
486 | 1 | 57 | TYR | HB3 | H | 2.80 | 0 | |
487 | 1 | 57 | TYR | CA | C | 58.1 | 0 | |
488 | 1 | 57 | TYR | CB | C | 40.6 | 0 | |
489 | 1 | 57 | TYR | N | N | 119.8 | 0 | |
490 | 1 | 58 | PHE | H | H | 9.61 | 0 | |
491 | 1 | 58 | PHE | HA | H | 5.04 | 0 | |
492 | 1 | 58 | PHE | HB2 | H | 3.02 | 0 | |
493 | 1 | 58 | PHE | HB3 | H | 2.63 | 0 | |
494 | 1 | 58 | PHE | HD1 | H | 7.59 | 0 | |
495 | 1 | 58 | PHE | HD2 | H | 7.59 | 0 | |
496 | 1 | 58 | PHE | HE1 | H | 7.75 | 0 | |
497 | 1 | 58 | PHE | HE2 | H | 7.75 | 0 | |
498 | 1 | 58 | PHE | CA | C | 55.0 | 0 | |
499 | 1 | 58 | PHE | CB | C | 39.6 | 0 | |
500 | 1 | 58 | PHE | N | N | 119.5 | 0 | |
501 | 1 | 60 | SER | HA | H | 4.08 | 0 | |
502 | 1 | 60 | SER | HB2 | H | 3.87 | 0 | |
503 | 1 | 60 | SER | HB3 | H | 3.87 | 0 | |
504 | 1 | 60 | SER | CA | C | 60.3 | 0 | |
505 | 1 | 60 | SER | CB | C | 60.0 | 0 | |
506 | 1 | 61 | SER | H | H | 7.56 | 0 | |
507 | 1 | 61 | SER | HA | H | 4.11 | 0 | |
508 | 1 | 61 | SER | HB2 | H | 3.95 | 0 | |
509 | 1 | 61 | SER | HB3 | H | 3.75 | 0 | |
510 | 1 | 61 | SER | CA | C | 59.1 | 0 | |
511 | 1 | 61 | SER | CB | C | 62.7 | 0 | |
512 | 1 | 61 | SER | N | N | 114.9 | 0 | |
513 | 1 | 62 | LEU | H | H | 7.78 | 0 | |
514 | 1 | 62 | LEU | HA | H | 4.23 | 0 | |
515 | 1 | 62 | LEU | HB2 | H | 2.06 | 0 | |
516 | 1 | 62 | LEU | HB3 | H | 1.75 | 0 | |
517 | 1 | 62 | LEU | HG | H | 1.75 | 0 | |
518 | 1 | 62 | LEU | HD11 | H | 0.84 | 0 | |
519 | 1 | 62 | LEU | HD12 | H | 0.84 | 0 | |
520 | 1 | 62 | LEU | HD13 | H | 0.84 | 0 | |
521 | 1 | 62 | LEU | HD21 | H | 0.84 | 0 | |
522 | 1 | 62 | LEU | HD22 | H | 0.84 | 0 | |
523 | 1 | 62 | LEU | HD23 | H | 0.84 | 0 | |
524 | 1 | 62 | LEU | N | N | 120.2 | 0 | |
525 | 1 | 63 | GLY | H | H | 7.74 | 0 | |
526 | 1 | 63 | GLY | HA2 | H | 3.31 | 0 | |
527 | 1 | 63 | GLY | HA3 | H | 4.69 | 0 | |
528 | 1 | 63 | GLY | CA | C | 44.8 | 0 | |
529 | 1 | 63 | GLY | N | N | 103.1 | 0 | |
530 | 1 | 64 | GLU | H | H | 8.73 | 0 | |
531 | 1 | 64 | GLU | HA | H | 4.71 | 0 | |
532 | 1 | 64 | GLU | HB2 | H | 1.99 | 0 | |
533 | 1 | 64 | GLU | HB3 | H | 1.99 | 0 | |
534 | 1 | 64 | GLU | HG2 | H | 2.31 | 0 | |
535 | 1 | 64 | GLU | HG3 | H | 2.31 | 0 | |
536 | 1 | 64 | GLU | CA | C | 54.0 | 0 | |
537 | 1 | 64 | GLU | CB | C | 32.3 | 0 | |
538 | 1 | 64 | GLU | N | N | 122.5 | 0 | |
539 | 1 | 65 | ALA | H | H | 8.75 | 0 | |
540 | 1 | 65 | ALA | HA | H | 4.49 | 0 | |
541 | 1 | 65 | ALA | HB1 | H | 1.45 | 0 | |
542 | 1 | 65 | ALA | HB2 | H | 1.45 | 0 | |
543 | 1 | 65 | ALA | HB3 | H | 1.45 | 0 | |
544 | 1 | 65 | ALA | CA | C | 53.2 | 0 | |
545 | 1 | 65 | ALA | CB | C | 19.0 | 0 | |
546 | 1 | 65 | ALA | N | N | 125.8 | 0 | |
547 | 1 | 66 | ILE | H | H | 8.45 | 0 | |
548 | 1 | 66 | ILE | HA | H | 4.15 | 0 | |
549 | 1 | 66 | ILE | HB | H | 1.83 | 0 | |
550 | 1 | 66 | ILE | HG12 | H | 1.83 | 0 | |
551 | 1 | 66 | ILE | HG13 | H | 1.83 | 0 | |
552 | 1 | 66 | ILE | HG21 | H | 0.94 | 0 | |
553 | 1 | 66 | ILE | HG22 | H | 0.94 | 0 | |
554 | 1 | 66 | ILE | HG23 | H | 0.94 | 0 | |
555 | 1 | 66 | ILE | HD11 | H | 0.94 | 0 | |
556 | 1 | 66 | ILE | HD12 | H | 0.94 | 0 | |
557 | 1 | 66 | ILE | HD13 | H | 0.94 | 0 | |
558 | 1 | 66 | ILE | N | N | 121.9 | 0 | |
559 | 1 | 67 | VAL | H | H | 7.78 | 0 | |
560 | 1 | 67 | VAL | HA | H | 4.13 | 0 | |
561 | 1 | 67 | VAL | HB | H | 2.08 | 0 | |
562 | 1 | 67 | VAL | HG11 | H | 0.90 | 0 | |
563 | 1 | 67 | VAL | HG12 | H | 0.90 | 0 | |
564 | 1 | 67 | VAL | HG13 | H | 0.90 | 0 | |
565 | 1 | 67 | VAL | HG21 | H | 0.90 | 0 | |
566 | 1 | 67 | VAL | HG22 | H | 0.90 | 0 | |
567 | 1 | 67 | VAL | HG23 | H | 0.90 | 0 | |
568 | 1 | 67 | VAL | CA | C | 63.5 | 0 | |
569 | 1 | 67 | VAL | CB | C | 33.6 | 0 | |
570 | 1 | 67 | VAL | N | N | 128.6 | 0 |