Structure in solution of the TANGO1 cargo-binding domain (21-131)
MPGQLDPSTG RRFSEHKLCA DDECSMLMYR GEALEDFTGP DCRFVNFKKG DPVYVYYKLA RGWPEVWAGS VGRTFGYFPK DLIQVVHEYT KEELQVPTDE TDFVCFDGGR DD
ID | Type | Value order | Atom ID 1 | Atom ID 2 |
---|---|---|---|---|
1 | disulfide | sing | 1:CYS19:SG | 1:CYS24:SG |
2 | disulfide | sing | 1:CYS42:SG | 1:CYS105:SG |
ID | Entity ID | Seq ID | Comp ID | Atom ID | Atom type | Val | Val err | Ambig. code |
---|---|---|---|---|---|---|---|---|
1 | 1 | 1 | MET | HA | H | 4.822 | 0.003 | 1 |
2 | 1 | 1 | MET | HB2 | H | 1.910 | 0.001 | 2 |
3 | 1 | 1 | MET | HB3 | H | 2.039 | 0.0 | 2 |
4 | 1 | 1 | MET | HG2 | H | 2.585 | 0.002 | 2 |
5 | 1 | 1 | MET | HG3 | H | 2.504 | 0.001 | 2 |
6 | 1 | 1 | MET | CA | C | 53.182 | 0.0 | 1 |
7 | 1 | 1 | MET | CB | C | 32.719 | 0.001 | 1 |
8 | 1 | 1 | MET | CG | C | 32.380 | 0.052 | 1 |
9 | 1 | 2 | PRO | HA | H | 4.411 | 0.008 | 1 |
10 | 1 | 2 | PRO | HB2 | H | 2.059 | 0.0 | 2 |
11 | 1 | 2 | PRO | HB3 | H | 2.333 | 0.001 | 2 |
12 | 1 | 2 | PRO | HG2 | H | 2.057 | 0.019 | 2 |
13 | 1 | 2 | PRO | HG3 | H | 2.028 | 0.008 | 2 |
14 | 1 | 2 | PRO | HD2 | H | 3.702 | 0.022 | 2 |
15 | 1 | 2 | PRO | HD3 | H | 3.789 | 0.011 | 2 |
16 | 1 | 2 | PRO | C | C | 177.496 | 0.004 | 1 |
17 | 1 | 2 | PRO | CA | C | 63.660 | 0.066 | 1 |
18 | 1 | 2 | PRO | CB | C | 31.991 | 0.004 | 1 |
19 | 1 | 2 | PRO | CG | C | 27.376 | 0.017 | 1 |
20 | 1 | 2 | PRO | CD | C | 50.921 | 0.019 | 1 |
21 | 1 | 3 | GLY | H | H | 8.599 | 0.005 | 1 |
22 | 1 | 3 | GLY | HA2 | H | 3.972 | 0.0 | 1 |
23 | 1 | 3 | GLY | HA3 | H | 3.972 | 0.0 | 1 |
24 | 1 | 3 | GLY | C | C | 174.124 | 0.01 | 1 |
25 | 1 | 3 | GLY | CA | C | 45.419 | 0.027 | 1 |
26 | 1 | 3 | GLY | N | N | 109.845 | 0.052 | 1 |
27 | 1 | 4 | GLN | H | H | 8.110 | 0.003 | 1 |
28 | 1 | 4 | GLN | HA | H | 4.356 | 0.009 | 1 |
29 | 1 | 4 | GLN | HB2 | H | 2.101 | 0.027 | 2 |
30 | 1 | 4 | GLN | HB3 | H | 2.043 | 0.02 | 2 |
31 | 1 | 4 | GLN | HG2 | H | 2.338 | 0.009 | 2 |
32 | 1 | 4 | GLN | HG3 | H | 2.339 | 0.009 | 2 |
33 | 1 | 4 | GLN | HE21 | H | 6.893 | 0.0 | 1 |
34 | 1 | 4 | GLN | HE22 | H | 7.610 | 0.001 | 1 |
35 | 1 | 4 | GLN | C | C | 175.707 | 0.008 | 1 |
36 | 1 | 4 | GLN | CA | C | 55.753 | 0.057 | 1 |
37 | 1 | 4 | GLN | CB | C | 29.770 | 0.023 | 1 |
38 | 1 | 4 | GLN | CG | C | 33.938 | 0.008 | 1 |
39 | 1 | 4 | GLN | N | N | 119.528 | 0.045 | 1 |
40 | 1 | 4 | GLN | NE2 | N | 112.575 | 1 | |
41 | 1 | 5 | LEU | H | H | 8.326 | 0.01 | 1 |
42 | 1 | 5 | LEU | HA | H | 4.339 | 0.007 | 1 |
43 | 1 | 5 | LEU | HB2 | H | 1.549 | 0.012 | 2 |
44 | 1 | 5 | LEU | HB3 | H | 1.594 | 0.01 | 2 |
45 | 1 | 5 | LEU | HG | H | 1.571 | 0.004 | 1 |
46 | 1 | 5 | LEU | HD11 | H | 0.833 | 0.012 | 2 |
47 | 1 | 5 | LEU | HD12 | H | 0.833 | 0.012 | 2 |
48 | 1 | 5 | LEU | HD13 | H | 0.833 | 0.012 | 2 |
49 | 1 | 5 | LEU | HD21 | H | 0.869 | 0.012 | 2 |
50 | 1 | 5 | LEU | HD22 | H | 0.869 | 0.012 | 2 |
51 | 1 | 5 | LEU | HD23 | H | 0.869 | 0.012 | 2 |
52 | 1 | 5 | LEU | C | C | 176.554 | 0.003 | 1 |
53 | 1 | 5 | LEU | CA | C | 55.067 | 0.076 | 1 |
54 | 1 | 5 | LEU | CB | C | 42.696 | 0.021 | 1 |
55 | 1 | 5 | LEU | CG | C | 27.303 | 0.066 | 1 |
56 | 1 | 5 | LEU | CD1 | C | 23.808 | 0.019 | 2 |
57 | 1 | 5 | LEU | CD2 | C | 24.940 | 0.018 | 2 |
58 | 1 | 5 | LEU | N | N | 123.249 | 0.037 | 1 |
59 | 1 | 6 | ASP | H | H | 8.415 | 0.015 | 1 |
60 | 1 | 6 | ASP | HA | H | 4.856 | 0.02 | 1 |
61 | 1 | 6 | ASP | HB2 | H | 2.844 | 0.003 | 2 |
62 | 1 | 6 | ASP | HB3 | H | 2.569 | 0.009 | 2 |
63 | 1 | 6 | ASP | C | C | 175.199 | 1 | |
64 | 1 | 6 | ASP | CA | C | 51.993 | 0.014 | 1 |
65 | 1 | 6 | ASP | CB | C | 41.681 | 0.015 | 1 |
66 | 1 | 6 | ASP | N | N | 123.212 | 0.039 | 1 |
67 | 1 | 7 | PRO | HA | H | 4.446 | 0.013 | 1 |
68 | 1 | 7 | PRO | HB2 | H | 2.311 | 0.008 | 2 |
69 | 1 | 7 | PRO | HB3 | H | 2.034 | 0.01 | 2 |
70 | 1 | 7 | PRO | HG2 | H | 2.038 | 0.002 | 2 |
71 | 1 | 7 | PRO | HG3 | H | 2.038 | 0.002 | 2 |
72 | 1 | 7 | PRO | HD2 | H | 3.892 | 0.017 | 2 |
73 | 1 | 7 | PRO | HD3 | H | 3.899 | 0.018 | 2 |
74 | 1 | 7 | PRO | C | C | 177.476 | 1 | |
75 | 1 | 7 | PRO | CA | C | 64.036 | 0.037 | 1 |
76 | 1 | 7 | PRO | CB | C | 32.268 | 0.027 | 1 |
77 | 1 | 7 | PRO | CG | C | 27.403 | 0.057 | 1 |
78 | 1 | 7 | PRO | CD | C | 51.103 | 0.007 | 1 |
79 | 1 | 8 | SER | H | H | 8.575 | 0.003 | 1 |
80 | 1 | 8 | SER | HA | H | 4.417 | 0.017 | 1 |
81 | 1 | 8 | SER | HB2 | H | 3.957 | 0.016 | 2 |
82 | 1 | 8 | SER | HB3 | H | 3.931 | 0.012 | 2 |
83 | 1 | 8 | SER | C | C | 175.350 | 0.005 | 1 |
84 | 1 | 8 | SER | CA | C | 59.767 | 0.05 | 1 |
85 | 1 | 8 | SER | CB | C | 63.775 | 0.061 | 1 |
86 | 1 | 8 | SER | N | N | 115.407 | 0.088 | 1 |
87 | 1 | 9 | THR | H | H | 7.909 | 0.004 | 1 |
88 | 1 | 9 | THR | HA | H | 4.334 | 0.024 | 1 |
89 | 1 | 9 | THR | HB | H | 4.289 | 0.005 | 1 |
90 | 1 | 9 | THR | HG21 | H | 1.241 | 0.005 | 1 |
91 | 1 | 9 | THR | HG22 | H | 1.241 | 0.005 | 1 |
92 | 1 | 9 | THR | HG23 | H | 1.241 | 0.005 | 1 |
93 | 1 | 9 | THR | C | C | 175.382 | 1 | |
94 | 1 | 9 | THR | CA | C | 62.564 | 0.039 | 1 |
95 | 1 | 9 | THR | CB | C | 69.803 | 0.036 | 1 |
96 | 1 | 9 | THR | CG2 | C | 21.712 | 0.007 | 1 |
97 | 1 | 9 | THR | N | N | 114.382 | 0.021 | 1 |
98 | 1 | 10 | GLY | H | H | 8.310 | 0.002 | 1 |
99 | 1 | 10 | GLY | HA2 | H | 3.935 | 0.008 | 2 |
100 | 1 | 10 | GLY | HA3 | H | 3.936 | 0.001 | 2 |
101 | 1 | 10 | GLY | C | C | 174.106 | 0.013 | 1 |
102 | 1 | 10 | GLY | CA | C | 45.748 | 0.019 | 1 |
103 | 1 | 10 | GLY | N | N | 110.554 | 0.042 | 1 |
104 | 1 | 11 | ARG | H | H | 8.154 | 0.005 | 1 |
105 | 1 | 11 | ARG | HA | H | 4.234 | 0.003 | 1 |
106 | 1 | 11 | ARG | HB2 | H | 1.877 | 0.0 | 2 |
107 | 1 | 11 | ARG | HB3 | H | 1.775 | 0.0 | 2 |
108 | 1 | 11 | ARG | HG2 | H | 1.655 | 0.012 | 2 |
109 | 1 | 11 | ARG | HG3 | H | 1.648 | 0.015 | 2 |
110 | 1 | 11 | ARG | HD3 | H | 3.216 | 0.007 | 1 |
111 | 1 | 11 | ARG | C | C | 176.015 | 0.004 | 1 |
112 | 1 | 11 | ARG | CA | C | 56.523 | 0.042 | 1 |
113 | 1 | 11 | ARG | CB | C | 31.308 | 0.037 | 1 |
114 | 1 | 11 | ARG | CG | C | 27.662 | 0.062 | 1 |
115 | 1 | 11 | ARG | CD | C | 43.391 | 0.011 | 1 |
116 | 1 | 11 | ARG | N | N | 119.876 | 0.056 | 1 |
117 | 1 | 12 | ARG | H | H | 7.997 | 0.003 | 1 |
118 | 1 | 12 | ARG | HA | H | 3.247 | 0.001 | 1 |
119 | 1 | 12 | ARG | HB2 | H | 1.476 | 0.002 | 2 |
120 | 1 | 12 | ARG | HB3 | H | 1.475 | 0.002 | 2 |
121 | 1 | 12 | ARG | HG2 | H | 1.311 | 0.001 | 2 |
122 | 1 | 12 | ARG | HG3 | H | 1.480 | 0.01 | 2 |
123 | 1 | 12 | ARG | HD3 | H | 3.074 | 0.005 | 1 |
124 | 1 | 12 | ARG | C | C | 176.281 | 1 | |
125 | 1 | 12 | ARG | CA | C | 55.343 | 0.019 | 1 |
126 | 1 | 12 | ARG | CB | C | 30.792 | 0.1 | 1 |
127 | 1 | 12 | ARG | CG | C | 27.118 | 0.077 | 1 |
128 | 1 | 12 | ARG | CD | C | 43.629 | 0.032 | 1 |
129 | 1 | 12 | ARG | N | N | 118.542 | 0.049 | 1 |
130 | 1 | 13 | PHE | HA | H | 4.534 | 0.005 | 1 |
131 | 1 | 13 | PHE | HB2 | H | 2.939 | 0.021 | 2 |
132 | 1 | 13 | PHE | HB3 | H | 2.978 | 0.003 | 2 |
133 | 1 | 13 | PHE | HD1 | H | 7.191 | 0.03 | 1 |
134 | 1 | 13 | PHE | HD2 | H | 7.191 | 0.03 | 1 |
135 | 1 | 13 | PHE | HE1 | H | 6.889 | 1 | |
136 | 1 | 13 | PHE | HE2 | H | 6.889 | 1 | |
137 | 1 | 13 | PHE | CA | C | 56.631 | 0.005 | 1 |
138 | 1 | 13 | PHE | CB | C | 38.549 | 0.046 | 1 |
139 | 1 | 13 | PHE | CD1 | C | 128.825 | 0.015 | 1 |
140 | 1 | 13 | PHE | CD2 | C | 128.825 | 0.015 | 1 |
141 | 1 | 13 | PHE | CE1 | C | 131.280 | 0.14 | 1 |
142 | 1 | 13 | PHE | CE2 | C | 131.280 | 0.14 | 1 |
143 | 1 | 14 | SER | HA | H | 4.623 | 0.003 | 1 |
144 | 1 | 14 | SER | HB2 | H | 4.138 | 0.011 | 2 |
145 | 1 | 14 | SER | HB3 | H | 3.812 | 0.003 | 2 |
146 | 1 | 14 | SER | CA | C | 58.422 | 0.006 | 1 |
147 | 1 | 14 | SER | CB | C | 65.613 | 0.057 | 1 |
148 | 1 | 15 | GLU | HA | H | 4.117 | 0.008 | 1 |
149 | 1 | 15 | GLU | HB2 | H | 1.956 | 0.002 | 2 |
150 | 1 | 15 | GLU | HB3 | H | 1.958 | 0.004 | 2 |
151 | 1 | 15 | GLU | HG2 | H | 2.246 | 0.001 | 2 |
152 | 1 | 15 | GLU | HG3 | H | 2.090 | 0.0 | 2 |
153 | 1 | 15 | GLU | C | C | 176.311 | 1 | |
154 | 1 | 15 | GLU | CA | C | 58.062 | 0.058 | 1 |
155 | 1 | 15 | GLU | CB | C | 30.625 | 0.001 | 1 |
156 | 1 | 15 | GLU | CG | C | 36.854 | 0.003 | 1 |
157 | 1 | 16 | HIS | H | H | 8.136 | 0.006 | 1 |
158 | 1 | 16 | HIS | HA | H | 5.384 | 0.01 | 1 |
159 | 1 | 16 | HIS | HB2 | H | 3.032 | 0.007 | 2 |
160 | 1 | 16 | HIS | HB3 | H | 2.770 | 0.01 | 2 |
161 | 1 | 16 | HIS | C | C | 173.660 | 0.004 | 1 |
162 | 1 | 16 | HIS | CA | C | 56.816 | 0.055 | 1 |
163 | 1 | 16 | HIS | CB | C | 35.220 | 0.093 | 1 |
164 | 1 | 16 | HIS | N | N | 115.204 | 0.027 | 1 |
165 | 1 | 17 | LYS | H | H | 9.817 | 0.008 | 1 |
166 | 1 | 17 | LYS | HA | H | 5.258 | 0.006 | 1 |
167 | 1 | 17 | LYS | HB2 | H | 1.795 | 0.034 | 2 |
168 | 1 | 17 | LYS | HB3 | H | 1.464 | 0.019 | 2 |
169 | 1 | 17 | LYS | HG2 | H | 1.177 | 0.019 | 2 |
170 | 1 | 17 | LYS | HG3 | H | 1.178 | 0.019 | 2 |
171 | 1 | 17 | LYS | HD2 | H | 0.352 | 0.004 | 2 |
172 | 1 | 17 | LYS | HD3 | H | 0.679 | 0.003 | 2 |
173 | 1 | 17 | LYS | HE2 | H | 2.545 | 0.03 | 2 |
174 | 1 | 17 | LYS | HE3 | H | 2.623 | 0.035 | 2 |
175 | 1 | 17 | LYS | C | C | 173.329 | 0.006 | 1 |
176 | 1 | 17 | LYS | CA | C | 53.932 | 0.024 | 1 |
177 | 1 | 17 | LYS | CB | C | 36.375 | 0.011 | 1 |
178 | 1 | 17 | LYS | CG | C | 24.623 | 0.013 | 1 |
179 | 1 | 17 | LYS | CD | C | 29.124 | 0.031 | 1 |
180 | 1 | 17 | LYS | CE | C | 41.971 | 0.011 | 1 |
181 | 1 | 17 | LYS | N | N | 121.497 | 0.025 | 1 |
182 | 1 | 18 | LEU | H | H | 9.391 | 0.01 | 1 |
183 | 1 | 18 | LEU | HA | H | 5.370 | 0.011 | 1 |
184 | 1 | 18 | LEU | HB2 | H | 1.132 | 0.014 | 2 |
185 | 1 | 18 | LEU | HB3 | H | 1.726 | 0.031 | 2 |
186 | 1 | 18 | LEU | HG | H | 1.491 | 0.011 | 1 |
187 | 1 | 18 | LEU | HD11 | H | 0.922 | 0.016 | 2 |
188 | 1 | 18 | LEU | HD12 | H | 0.922 | 0.016 | 2 |
189 | 1 | 18 | LEU | HD13 | H | 0.922 | 0.016 | 2 |
190 | 1 | 18 | LEU | HD21 | H | 0.858 | 0.014 | 2 |
191 | 1 | 18 | LEU | HD22 | H | 0.858 | 0.014 | 2 |
192 | 1 | 18 | LEU | HD23 | H | 0.858 | 0.014 | 2 |
193 | 1 | 18 | LEU | C | C | 175.714 | 0.011 | 1 |
194 | 1 | 18 | LEU | CA | C | 53.240 | 0.034 | 1 |
195 | 1 | 18 | LEU | CB | C | 43.190 | 0.036 | 1 |
196 | 1 | 18 | LEU | CG | C | 27.560 | 0.004 | 1 |
197 | 1 | 18 | LEU | CD1 | C | 25.442 | 0.009 | 2 |
198 | 1 | 18 | LEU | CD2 | C | 23.501 | 0.036 | 2 |
199 | 1 | 18 | LEU | N | N | 121.641 | 0.046 | 1 |
200 | 1 | 19 | CYS | H | H | 8.887 | 0.005 | 1 |
201 | 1 | 19 | CYS | HA | H | 5.446 | 0.007 | 1 |
202 | 1 | 19 | CYS | HB2 | H | 4.064 | 0.011 | 2 |
203 | 1 | 19 | CYS | HB3 | H | 3.380 | 0.005 | 2 |
204 | 1 | 19 | CYS | C | C | 173.070 | 0.004 | 1 |
205 | 1 | 19 | CYS | CA | C | 54.099 | 0.054 | 1 |
206 | 1 | 19 | CYS | CB | C | 48.252 | 0.06 | 1 |
207 | 1 | 19 | CYS | N | N | 118.608 | 0.04 | 1 |
208 | 1 | 20 | ALA | H | H | 9.987 | 0.007 | 1 |
209 | 1 | 20 | ALA | HA | H | 4.390 | 0.008 | 1 |
210 | 1 | 20 | ALA | HB1 | H | 1.350 | 0.015 | 1 |
211 | 1 | 20 | ALA | HB2 | H | 1.350 | 0.015 | 1 |
212 | 1 | 20 | ALA | HB3 | H | 1.350 | 0.015 | 1 |
213 | 1 | 20 | ALA | C | C | 175.823 | 0.003 | 1 |
214 | 1 | 20 | ALA | CA | C | 53.074 | 0.081 | 1 |
215 | 1 | 20 | ALA | CB | C | 20.608 | 0.134 | 1 |
216 | 1 | 20 | ALA | N | N | 123.002 | 0.029 | 1 |
217 | 1 | 21 | ASP | H | H | 7.818 | 0.007 | 1 |
218 | 1 | 21 | ASP | HA | H | 4.681 | 0.017 | 1 |
219 | 1 | 21 | ASP | HB2 | H | 2.750 | 0.01 | 2 |
220 | 1 | 21 | ASP | HB3 | H | 2.751 | 0.01 | 2 |
221 | 1 | 21 | ASP | C | C | 175.675 | 0.004 | 1 |
222 | 1 | 21 | ASP | CA | C | 51.972 | 0.032 | 1 |
223 | 1 | 21 | ASP | CB | C | 43.293 | 0.07 | 1 |
224 | 1 | 21 | ASP | N | N | 113.647 | 0.085 | 1 |
225 | 1 | 22 | ASP | H | H | 8.780 | 0.014 | 1 |
226 | 1 | 22 | ASP | HA | H | 4.124 | 0.005 | 1 |
227 | 1 | 22 | ASP | HB2 | H | 2.719 | 0.014 | 2 |
228 | 1 | 22 | ASP | HB3 | H | 2.607 | 0.007 | 2 |
229 | 1 | 22 | ASP | C | C | 176.389 | 0.009 | 1 |
230 | 1 | 22 | ASP | CA | C | 57.189 | 0.083 | 1 |
231 | 1 | 22 | ASP | CB | C | 40.589 | 0.038 | 1 |
232 | 1 | 22 | ASP | N | N | 119.306 | 0.021 | 1 |
233 | 1 | 23 | GLU | H | H | 7.346 | 0.006 | 1 |
234 | 1 | 23 | GLU | HA | H | 4.305 | 0.004 | 1 |
235 | 1 | 23 | GLU | HB2 | H | 1.782 | 0.012 | 2 |
236 | 1 | 23 | GLU | HB3 | H | 2.206 | 0.013 | 2 |
237 | 1 | 23 | GLU | HG2 | H | 2.256 | 0.029 | 2 |
238 | 1 | 23 | GLU | HG3 | H | 2.166 | 0.017 | 2 |
239 | 1 | 23 | GLU | C | C | 175.365 | 1 | |
240 | 1 | 23 | GLU | CA | C | 55.739 | 0.028 | 1 |
241 | 1 | 23 | GLU | CB | C | 29.874 | 0.057 | 1 |
242 | 1 | 23 | GLU | CG | C | 36.770 | 0.093 | 1 |
243 | 1 | 23 | GLU | N | N | 114.293 | 0.026 | 1 |
244 | 1 | 24 | CYS | H | H | 8.351 | 0.008 | 1 |
245 | 1 | 24 | CYS | HA | H | 4.610 | 0.01 | 1 |
246 | 1 | 24 | CYS | HB2 | H | 3.363 | 0.002 | 2 |
247 | 1 | 24 | CYS | HB3 | H | 3.090 | 0.004 | 2 |
248 | 1 | 24 | CYS | C | C | 173.106 | 1 | |
249 | 1 | 24 | CYS | CA | C | 58.704 | 0.07 | 1 |
250 | 1 | 24 | CYS | CB | C | 45.733 | 0.055 | 1 |
251 | 1 | 24 | CYS | N | N | 119.831 | 0.074 | 1 |
252 | 1 | 25 | SER | H | H | 10.016 | 0.003 | 1 |
253 | 1 | 25 | SER | HA | H | 4.663 | 0.004 | 1 |
254 | 1 | 25 | SER | HB2 | H | 3.540 | 0.003 | 2 |
255 | 1 | 25 | SER | HB3 | H | 3.816 | 0.004 | 2 |
256 | 1 | 25 | SER | C | C | 174.552 | 0.007 | 1 |
257 | 1 | 25 | SER | CA | C | 58.303 | 0.05 | 1 |
258 | 1 | 25 | SER | CB | C | 66.792 | 0.056 | 1 |
259 | 1 | 25 | SER | N | N | 113.173 | 0.031 | 1 |
260 | 1 | 26 | MET | H | H | 8.425 | 0.034 | 1 |
261 | 1 | 26 | MET | HA | H | 4.577 | 0.005 | 1 |
262 | 1 | 26 | MET | HB2 | H | 1.955 | 0.007 | 2 |
263 | 1 | 26 | MET | HB3 | H | 1.850 | 0.025 | 2 |
264 | 1 | 26 | MET | HG2 | H | 2.417 | 0.013 | 2 |
265 | 1 | 26 | MET | HG3 | H | 2.457 | 0.023 | 2 |
266 | 1 | 26 | MET | HE1 | H | 2.096 | 0.001 | 1 |
267 | 1 | 26 | MET | HE2 | H | 2.096 | 0.001 | 1 |
268 | 1 | 26 | MET | HE3 | H | 2.096 | 0.001 | 1 |
269 | 1 | 26 | MET | C | C | 174.812 | 0.008 | 1 |
270 | 1 | 26 | MET | CA | C | 54.524 | 0.028 | 1 |
271 | 1 | 26 | MET | CB | C | 34.369 | 0.047 | 1 |
272 | 1 | 26 | MET | CG | C | 32.582 | 0.015 | 1 |
273 | 1 | 26 | MET | CE | C | 17.473 | 0.035 | 1 |
274 | 1 | 26 | MET | N | N | 124.547 | 0.053 | 1 |
275 | 1 | 27 | LEU | H | H | 7.746 | 0.012 | 1 |
276 | 1 | 27 | LEU | HA | H | 3.188 | 0.004 | 1 |
277 | 1 | 27 | LEU | HB2 | H | 0.853 | 0.023 | 2 |
278 | 1 | 27 | LEU | HB3 | H | 0.816 | 0.025 | 2 |
279 | 1 | 27 | LEU | HG | H | 1.054 | 0.007 | 1 |
280 | 1 | 27 | LEU | HD11 | H | 0.233 | 0.003 | 2 |
281 | 1 | 27 | LEU | HD12 | H | 0.233 | 0.003 | 2 |
282 | 1 | 27 | LEU | HD13 | H | 0.233 | 0.003 | 2 |
283 | 1 | 27 | LEU | HD21 | H | 0.436 | 0.002 | 2 |
284 | 1 | 27 | LEU | HD22 | H | 0.436 | 0.002 | 2 |
285 | 1 | 27 | LEU | HD23 | H | 0.436 | 0.002 | 2 |
286 | 1 | 27 | LEU | C | C | 175.829 | 0.018 | 1 |
287 | 1 | 27 | LEU | CA | C | 55.765 | 0.039 | 1 |
288 | 1 | 27 | LEU | CB | C | 43.503 | 0.047 | 1 |
289 | 1 | 27 | LEU | CG | C | 26.992 | 0.073 | 1 |
290 | 1 | 27 | LEU | CD1 | C | 25.684 | 0.083 | 2 |
291 | 1 | 27 | LEU | CD2 | C | 25.102 | 0.042 | 2 |
292 | 1 | 27 | LEU | N | N | 121.222 | 0.046 | 1 |
293 | 1 | 28 | MET | H | H | 8.313 | 0.005 | 1 |
294 | 1 | 28 | MET | HA | H | 4.339 | 0.005 | 1 |
295 | 1 | 28 | MET | HB2 | H | 1.071 | 0.024 | 2 |
296 | 1 | 28 | MET | HB3 | H | 1.085 | 0.022 | 2 |
297 | 1 | 28 | MET | HG2 | H | 1.566 | 0.022 | 2 |
298 | 1 | 28 | MET | HG3 | H | 2.419 | 0.021 | 2 |
299 | 1 | 28 | MET | HE1 | H | 1.731 | 0.015 | 1 |
300 | 1 | 28 | MET | HE2 | H | 1.731 | 0.015 | 1 |
301 | 1 | 28 | MET | HE3 | H | 1.731 | 0.015 | 1 |
302 | 1 | 28 | MET | C | C | 176.603 | 0.008 | 1 |
303 | 1 | 28 | MET | CA | C | 58.085 | 0.051 | 1 |
304 | 1 | 28 | MET | CB | C | 35.861 | 0.051 | 1 |
305 | 1 | 28 | MET | CG | C | 32.592 | 0.03 | 1 |
306 | 1 | 28 | MET | CE | C | 17.144 | 0.059 | 1 |
307 | 1 | 28 | MET | N | N | 117.972 | 0.026 | 1 |
308 | 1 | 29 | TYR | H | H | 7.574 | 0.01 | 1 |
309 | 1 | 29 | TYR | HA | H | 5.925 | 0.007 | 1 |
310 | 1 | 29 | TYR | HB2 | H | 3.653 | 0.005 | 2 |
311 | 1 | 29 | TYR | HB3 | H | 2.441 | 0.012 | 2 |
312 | 1 | 29 | TYR | HD1 | H | 6.827 | 1 | |
313 | 1 | 29 | TYR | HD2 | H | 6.827 | 1 | |
314 | 1 | 29 | TYR | HE1 | H | 6.252 | 0.022 | 1 |
315 | 1 | 29 | TYR | HE2 | H | 6.252 | 0.022 | 1 |
316 | 1 | 29 | TYR | C | C | 174.999 | 0.001 | 1 |
317 | 1 | 29 | TYR | CA | C | 54.080 | 0.054 | 1 |
318 | 1 | 29 | TYR | CB | C | 44.439 | 0.051 | 1 |
319 | 1 | 29 | TYR | CD1 | C | 133.903 | 0.038 | 1 |
320 | 1 | 29 | TYR | CD2 | C | 133.903 | 0.038 | 1 |
321 | 1 | 29 | TYR | CE1 | C | 118.059 | 0.122 | 1 |
322 | 1 | 29 | TYR | CE2 | C | 118.059 | 0.122 | 1 |
323 | 1 | 29 | TYR | N | N | 111.477 | 0.024 | 1 |
324 | 1 | 30 | ARG | H | H | 9.282 | 0.003 | 1 |
325 | 1 | 30 | ARG | HA | H | 5.190 | 0.007 | 1 |
326 | 1 | 30 | ARG | HB2 | H | 1.854 | 0.022 | 2 |
327 | 1 | 30 | ARG | HB3 | H | 2.086 | 0.013 | 2 |
328 | 1 | 30 | ARG | HG2 | H | 1.373 | 0.008 | 2 |
329 | 1 | 30 | ARG | HG3 | H | 1.083 | 0.018 | 2 |
330 | 1 | 30 | ARG | HD2 | H | 3.208 | 0.025 | 2 |
331 | 1 | 30 | ARG | HD3 | H | 3.150 | 0.024 | 2 |
332 | 1 | 30 | ARG | C | C | 175.324 | 0.007 | 1 |
333 | 1 | 30 | ARG | CA | C | 55.757 | 0.044 | 1 |
334 | 1 | 30 | ARG | CB | C | 33.417 | 0.041 | 1 |
335 | 1 | 30 | ARG | CG | C | 29.049 | 0.033 | 1 |
336 | 1 | 30 | ARG | CD | C | 43.953 | 0.021 | 1 |
337 | 1 | 30 | ARG | N | N | 121.018 | 0.026 | 1 |
338 | 1 | 31 | GLY | H | H | 9.879 | 0.019 | 1 |
339 | 1 | 31 | GLY | HA2 | H | 5.419 | 0.006 | 2 |
340 | 1 | 31 | GLY | HA3 | H | 3.461 | 0.019 | 2 |
341 | 1 | 31 | GLY | C | C | 171.942 | 0.005 | 1 |
342 | 1 | 31 | GLY | CA | C | 44.449 | 0.025 | 1 |
343 | 1 | 31 | GLY | N | N | 114.831 | 0.024 | 1 |
344 | 1 | 32 | GLU | H | H | 8.890 | 0.013 | 1 |
345 | 1 | 32 | GLU | HA | H | 4.868 | 0.011 | 1 |
346 | 1 | 32 | GLU | HB2 | H | 1.719 | 0.01 | 2 |
347 | 1 | 32 | GLU | HB3 | H | 1.770 | 0.02 | 2 |
348 | 1 | 32 | GLU | HG2 | H | 1.914 | 0.011 | 2 |
349 | 1 | 32 | GLU | HG3 | H | 1.932 | 0.019 | 2 |
350 | 1 | 32 | GLU | C | C | 175.520 | 0.003 | 1 |
351 | 1 | 32 | GLU | CA | C | 54.560 | 0.046 | 1 |
352 | 1 | 32 | GLU | CB | C | 33.826 | 0.058 | 1 |
353 | 1 | 32 | GLU | CG | C | 36.834 | 0.012 | 1 |
354 | 1 | 32 | GLU | N | N | 121.373 | 0.023 | 1 |
355 | 1 | 33 | ALA | H | H | 8.677 | 0.01 | 1 |
356 | 1 | 33 | ALA | HA | H | 4.112 | 0.004 | 1 |
357 | 1 | 33 | ALA | HB1 | H | 1.158 | 0.008 | 1 |
358 | 1 | 33 | ALA | HB2 | H | 1.158 | 0.008 | 1 |
359 | 1 | 33 | ALA | HB3 | H | 1.158 | 0.008 | 1 |
360 | 1 | 33 | ALA | C | C | 179.555 | 0.008 | 1 |
361 | 1 | 33 | ALA | CA | C | 53.104 | 0.053 | 1 |
362 | 1 | 33 | ALA | CB | C | 20.451 | 0.067 | 1 |
363 | 1 | 33 | ALA | N | N | 127.468 | 0.042 | 1 |
364 | 1 | 34 | LEU | H | H | 9.603 | 0.011 | 1 |
365 | 1 | 34 | LEU | HA | H | 4.217 | 0.024 | 1 |
366 | 1 | 34 | LEU | HB2 | H | 1.583 | 0.027 | 2 |
367 | 1 | 34 | LEU | HB3 | H | 1.588 | 0.023 | 2 |
368 | 1 | 34 | LEU | HG | H | 1.479 | 0.006 | 1 |
369 | 1 | 34 | LEU | HD11 | H | 0.754 | 0.002 | 2 |
370 | 1 | 34 | LEU | HD12 | H | 0.754 | 0.002 | 2 |
371 | 1 | 34 | LEU | HD13 | H | 0.754 | 0.002 | 2 |
372 | 1 | 34 | LEU | HD21 | H | 0.819 | 0.017 | 2 |
373 | 1 | 34 | LEU | HD22 | H | 0.819 | 0.017 | 2 |
374 | 1 | 34 | LEU | HD23 | H | 0.819 | 0.017 | 2 |
375 | 1 | 34 | LEU | C | C | 176.000 | 0.019 | 1 |
376 | 1 | 34 | LEU | CA | C | 55.977 | 0.066 | 1 |
377 | 1 | 34 | LEU | CB | C | 43.795 | 0.08 | 1 |
378 | 1 | 34 | LEU | CG | C | 27.230 | 0.067 | 1 |
379 | 1 | 34 | LEU | CD1 | C | 25.395 | 0.053 | 2 |
380 | 1 | 34 | LEU | CD2 | C | 22.484 | 0.003 | 2 |
381 | 1 | 34 | LEU | N | N | 126.269 | 0.021 | 1 |
382 | 1 | 35 | GLU | H | H | 7.551 | 0.005 | 1 |
383 | 1 | 35 | GLU | HA | H | 4.555 | 0.007 | 1 |
384 | 1 | 35 | GLU | HB2 | H | 1.785 | 0.019 | 2 |
385 | 1 | 35 | GLU | HB3 | H | 1.784 | 0.021 | 2 |
386 | 1 | 35 | GLU | HG2 | H | 2.308 | 0.007 | 2 |
387 | 1 | 35 | GLU | HG3 | H | 2.345 | 0.03 | 2 |
388 | 1 | 35 | GLU | C | C | 173.382 | 0.006 | 1 |
389 | 1 | 35 | GLU | CA | C | 53.806 | 0.047 | 1 |
390 | 1 | 35 | GLU | CB | C | 35.279 | 0.059 | 1 |
391 | 1 | 35 | GLU | CG | C | 35.593 | 0.017 | 1 |
392 | 1 | 35 | GLU | N | N | 114.216 | 0.033 | 1 |
393 | 1 | 36 | ASP | H | H | 8.670 | 0.002 | 1 |
394 | 1 | 36 | ASP | HA | H | 4.747 | 0.011 | 1 |
395 | 1 | 36 | ASP | HB2 | H | 2.767 | 0.022 | 2 |
396 | 1 | 36 | ASP | HB3 | H | 2.682 | 0.064 | 2 |
397 | 1 | 36 | ASP | C | C | 175.538 | 0.009 | 1 |
398 | 1 | 36 | ASP | CA | C | 54.731 | 0.027 | 1 |
399 | 1 | 36 | ASP | CB | C | 41.059 | 0.015 | 1 |
400 | 1 | 36 | ASP | N | N | 118.720 | 0.033 | 1 |
401 | 1 | 37 | PHE | H | H | 8.720 | 0.007 | 1 |
402 | 1 | 37 | PHE | HA | H | 4.642 | 0.004 | 1 |
403 | 1 | 37 | PHE | HB2 | H | 2.590 | 0.012 | 2 |
404 | 1 | 37 | PHE | HB3 | H | 1.274 | 0.017 | 2 |
405 | 1 | 37 | PHE | HD1 | H | 7.090 | 1 | |
406 | 1 | 37 | PHE | HD2 | H | 7.090 | 1 | |
407 | 1 | 37 | PHE | HE1 | H | 6.659 | 0.003 | 1 |
408 | 1 | 37 | PHE | HE2 | H | 6.659 | 0.003 | 1 |
409 | 1 | 37 | PHE | C | C | 173.489 | 0.007 | 1 |
410 | 1 | 37 | PHE | CA | C | 57.548 | 0.044 | 1 |
411 | 1 | 37 | PHE | CB | C | 43.649 | 0.057 | 1 |
412 | 1 | 37 | PHE | CE1 | C | 128.243 | 0.025 | 1 |
413 | 1 | 37 | PHE | CE2 | C | 128.243 | 0.025 | 1 |
414 | 1 | 37 | PHE | N | N | 120.878 | 0.033 | 1 |
415 | 1 | 38 | THR | H | H | 7.705 | 0.004 | 1 |
416 | 1 | 38 | THR | HA | H | 4.169 | 0.005 | 1 |
417 | 1 | 38 | THR | HB | H | 3.636 | 0.004 | 1 |
418 | 1 | 38 | THR | HG21 | H | 1.010 | 0.017 | 1 |
419 | 1 | 38 | THR | HG22 | H | 1.010 | 0.017 | 1 |
420 | 1 | 38 | THR | HG23 | H | 1.010 | 0.017 | 1 |
421 | 1 | 38 | THR | C | C | 173.536 | 0.003 | 1 |
422 | 1 | 38 | THR | CA | C | 60.097 | 0.056 | 1 |
423 | 1 | 38 | THR | CB | C | 69.922 | 0.071 | 1 |
424 | 1 | 38 | THR | CG2 | C | 21.320 | 0.036 | 1 |
425 | 1 | 38 | THR | N | N | 124.558 | 0.03 | 1 |
426 | 1 | 39 | GLY | H | H | 8.243 | 0.004 | 1 |
427 | 1 | 39 | GLY | HA2 | H | 3.267 | 0.011 | 2 |
428 | 1 | 39 | GLY | HA3 | H | 3.618 | 0.008 | 2 |
429 | 1 | 39 | GLY | C | C | 172.992 | 1 | |
430 | 1 | 39 | GLY | CA | C | 44.782 | 0.064 | 1 |
431 | 1 | 39 | GLY | N | N | 113.503 | 0.034 | 1 |
432 | 1 | 40 | PRO | HA | H | 4.343 | 0.004 | 1 |
433 | 1 | 40 | PRO | HB2 | H | 2.136 | 0.009 | 2 |
434 | 1 | 40 | PRO | HB3 | H | 1.952 | 0.012 | 2 |
435 | 1 | 40 | PRO | HG2 | H | 1.604 | 0.025 | 2 |
436 | 1 | 40 | PRO | HG3 | H | 1.643 | 0.014 | 2 |
437 | 1 | 40 | PRO | HD2 | H | 2.671 | 0.016 | 2 |
438 | 1 | 40 | PRO | HD3 | H | 3.194 | 0.003 | 2 |
439 | 1 | 40 | PRO | C | C | 176.059 | 0.0 | 1 |
440 | 1 | 40 | PRO | CA | C | 64.054 | 0.043 | 1 |
441 | 1 | 40 | PRO | CB | C | 32.178 | 0.024 | 1 |
442 | 1 | 40 | PRO | CG | C | 26.696 | 0.001 | 1 |
443 | 1 | 40 | PRO | CD | C | 49.981 | 0.015 | 1 |
444 | 1 | 41 | ASP | H | H | 7.384 | 0.008 | 1 |
445 | 1 | 41 | ASP | HA | H | 4.776 | 0.005 | 1 |
446 | 1 | 41 | ASP | HB2 | H | 3.194 | 0.007 | 2 |
447 | 1 | 41 | ASP | HB3 | H | 3.080 | 0.001 | 2 |
448 | 1 | 41 | ASP | C | C | 176.352 | 0.007 | 1 |
449 | 1 | 41 | ASP | CA | C | 53.758 | 0.021 | 1 |
450 | 1 | 41 | ASP | CB | C | 42.848 | 0.081 | 1 |
451 | 1 | 41 | ASP | N | N | 112.391 | 0.025 | 1 |
452 | 1 | 42 | CYS | H | H | 8.637 | 0.012 | 1 |
453 | 1 | 42 | CYS | HA | H | 4.824 | 0.016 | 1 |
454 | 1 | 42 | CYS | HB2 | H | 3.194 | 0.002 | 2 |
455 | 1 | 42 | CYS | HB3 | H | 3.945 | 0.006 | 2 |
456 | 1 | 42 | CYS | C | C | 175.283 | 1 | |
457 | 1 | 42 | CYS | CA | C | 57.254 | 0.091 | 1 |
458 | 1 | 42 | CYS | CB | C | 36.862 | 0.026 | 1 |
459 | 1 | 42 | CYS | N | N | 113.017 | 0.01 | 1 |
460 | 1 | 43 | ARG | H | H | 9.507 | 0.002 | 1 |
461 | 1 | 43 | ARG | HA | H | 4.477 | 0.015 | 1 |
462 | 1 | 43 | ARG | HB2 | H | 2.191 | 0.009 | 2 |
463 | 1 | 43 | ARG | HB3 | H | 2.189 | 0.01 | 2 |
464 | 1 | 43 | ARG | HG2 | H | 1.839 | 0.02 | 2 |
465 | 1 | 43 | ARG | HG3 | H | 1.631 | 0.011 | 2 |
466 | 1 | 43 | ARG | HD2 | H | 3.415 | 0.014 | 2 |
467 | 1 | 43 | ARG | HD3 | H | 2.994 | 0.016 | 2 |
468 | 1 | 43 | ARG | HE | H | 8.916 | 0.025 | 1 |
469 | 1 | 43 | ARG | C | C | 176.256 | 1 | |
470 | 1 | 43 | ARG | CA | C | 58.499 | 0.045 | 1 |
471 | 1 | 43 | ARG | CB | C | 30.515 | 0.028 | 1 |
472 | 1 | 43 | ARG | CG | C | 27.711 | 0.002 | 1 |
473 | 1 | 43 | ARG | CD | C | 43.747 | 0.058 | 1 |
474 | 1 | 43 | ARG | N | N | 123.140 | 0.054 | 1 |
475 | 1 | 43 | ARG | NE | N | 84.419 | 0.076 | 1 |
476 | 1 | 44 | PHE | H | H | 8.610 | 0.002 | 1 |
477 | 1 | 44 | PHE | HA | H | 5.411 | 0.01 | 1 |
478 | 1 | 44 | PHE | HB2 | H | 3.602 | 0.011 | 2 |
479 | 1 | 44 | PHE | HB3 | H | 3.245 | 0.01 | 2 |
480 | 1 | 44 | PHE | HD1 | H | 7.644 | 1 | |
481 | 1 | 44 | PHE | HD2 | H | 7.644 | 1 | |
482 | 1 | 44 | PHE | HE1 | H | 7.342 | 1 | |
483 | 1 | 44 | PHE | HE2 | H | 7.342 | 1 | |
484 | 1 | 44 | PHE | C | C | 175.460 | 0.011 | 1 |
485 | 1 | 44 | PHE | CA | C | 57.201 | 0.039 | 1 |
486 | 1 | 44 | PHE | CB | C | 42.302 | 0.039 | 1 |
487 | 1 | 44 | PHE | CD1 | C | 133.506 | 0.05 | 1 |
488 | 1 | 44 | PHE | CD2 | C | 133.506 | 0.05 | 1 |
489 | 1 | 44 | PHE | N | N | 116.521 | 0.036 | 1 |
490 | 1 | 45 | VAL | H | H | 8.762 | 0.014 | 1 |
491 | 1 | 45 | VAL | HA | H | 4.450 | 0.008 | 1 |
492 | 1 | 45 | VAL | HB | H | 1.937 | 0.012 | 1 |
493 | 1 | 45 | VAL | HG11 | H | 1.117 | 0.004 | 2 |
494 | 1 | 45 | VAL | HG12 | H | 1.117 | 0.004 | 2 |
495 | 1 | 45 | VAL | HG13 | H | 1.117 | 0.004 | 2 |
496 | 1 | 45 | VAL | HG21 | H | 0.960 | 0.009 | 2 |
497 | 1 | 45 | VAL | HG22 | H | 0.960 | 0.009 | 2 |
498 | 1 | 45 | VAL | HG23 | H | 0.960 | 0.009 | 2 |
499 | 1 | 45 | VAL | C | C | 171.433 | 0.007 | 1 |
500 | 1 | 45 | VAL | CA | C | 60.048 | 0.014 | 1 |
501 | 1 | 45 | VAL | CB | C | 33.778 | 0.035 | 1 |
502 | 1 | 45 | VAL | CG1 | C | 22.088 | 0.024 | 2 |
503 | 1 | 45 | VAL | CG2 | C | 21.046 | 0.098 | 2 |
504 | 1 | 45 | VAL | N | N | 120.558 | 0.052 | 1 |
505 | 1 | 46 | ASN | H | H | 7.603 | 0.012 | 1 |
506 | 1 | 46 | ASN | HA | H | 5.153 | 0.007 | 1 |
507 | 1 | 46 | ASN | HB2 | H | 2.664 | 0.007 | 2 |
508 | 1 | 46 | ASN | HB3 | H | 2.913 | 0.008 | 2 |
509 | 1 | 46 | ASN | HD21 | H | 7.561 | 0.022 | 1 |
510 | 1 | 46 | ASN | HD22 | H | 6.926 | 0.008 | 1 |
511 | 1 | 46 | ASN | C | C | 175.899 | 0.007 | 1 |
512 | 1 | 46 | ASN | CA | C | 51.381 | 0.033 | 1 |
513 | 1 | 46 | ASN | CB | C | 40.904 | 0.049 | 1 |
514 | 1 | 46 | ASN | N | N | 116.425 | 0.024 | 1 |
515 | 1 | 46 | ASN | ND2 | N | 113.422 | 0.063 | 1 |
516 | 1 | 47 | PHE | H | H | 8.830 | 0.026 | 1 |
517 | 1 | 47 | PHE | HA | H | 5.005 | 0.007 | 1 |
518 | 1 | 47 | PHE | HB2 | H | 3.436 | 0.016 | 2 |
519 | 1 | 47 | PHE | HB3 | H | 3.476 | 0.02 | 2 |
520 | 1 | 47 | PHE | HD1 | H | 6.917 | 1 | |
521 | 1 | 47 | PHE | HD2 | H | 6.917 | 1 | |
522 | 1 | 47 | PHE | HE1 | H | 6.936 | 0.009 | 1 |
523 | 1 | 47 | PHE | HE2 | H | 6.936 | 0.009 | 1 |
524 | 1 | 47 | PHE | C | C | 175.194 | 0.004 | 1 |
525 | 1 | 47 | PHE | CA | C | 55.881 | 0.017 | 1 |
526 | 1 | 47 | PHE | CB | C | 41.180 | 0.064 | 1 |
527 | 1 | 47 | PHE | CD1 | C | 133.326 | 0.03 | 1 |
528 | 1 | 47 | PHE | CD2 | C | 133.326 | 0.03 | 1 |
529 | 1 | 47 | PHE | N | N | 113.518 | 0.035 | 1 |
530 | 1 | 48 | LYS | H | H | 9.524 | 0.004 | 1 |
531 | 1 | 48 | LYS | HA | H | 5.035 | 0.008 | 1 |
532 | 1 | 48 | LYS | HB2 | H | 1.780 | 0.02 | 2 |
533 | 1 | 48 | LYS | HB3 | H | 1.783 | 0.018 | 2 |
534 | 1 | 48 | LYS | HG2 | H | 1.452 | 0.005 | 2 |
535 | 1 | 48 | LYS | HG3 | H | 1.452 | 0.005 | 2 |
536 | 1 | 48 | LYS | HD3 | H | 1.683 | 1 | |
537 | 1 | 48 | LYS | HE3 | H | 2.982 | 0.001 | 1 |
538 | 1 | 48 | LYS | C | C | 175.611 | 0.006 | 1 |
539 | 1 | 48 | LYS | CA | C | 53.229 | 0.034 | 1 |
540 | 1 | 48 | LYS | CB | C | 34.951 | 0.044 | 1 |
541 | 1 | 48 | LYS | CG | C | 24.572 | 0.072 | 1 |
542 | 1 | 48 | LYS | CD | C | 28.651 | 0.011 | 1 |
543 | 1 | 48 | LYS | CE | C | 42.049 | 0.005 | 1 |
544 | 1 | 48 | LYS | N | N | 122.280 | 0.038 | 1 |
545 | 1 | 49 | LYS | H | H | 8.923 | 0.012 | 1 |
546 | 1 | 49 | LYS | HA | H | 3.227 | 0.011 | 1 |
547 | 1 | 49 | LYS | HB2 | H | 1.702 | 0.007 | 2 |
548 | 1 | 49 | LYS | HB3 | H | 1.546 | 0.013 | 2 |
549 | 1 | 49 | LYS | HG2 | H | 1.185 | 0.018 | 2 |
550 | 1 | 49 | LYS | HG3 | H | 1.177 | 0.011 | 2 |
551 | 1 | 49 | LYS | HD2 | H | 1.704 | 0.003 | 1 |
552 | 1 | 49 | LYS | HD3 | H | 1.704 | 0.003 | 1 |
553 | 1 | 49 | LYS | HE2 | H | 3.026 | 0.001 | 2 |
554 | 1 | 49 | LYS | HE3 | H | 3.026 | 0.001 | 2 |
555 | 1 | 49 | LYS | C | C | 176.974 | 0.003 | 1 |
556 | 1 | 49 | LYS | CA | C | 59.114 | 0.027 | 1 |
557 | 1 | 49 | LYS | CB | C | 32.837 | 0.025 | 1 |
558 | 1 | 49 | LYS | CG | C | 24.542 | 0.023 | 1 |
559 | 1 | 49 | LYS | CD | C | 29.690 | 0.006 | 1 |
560 | 1 | 49 | LYS | CE | C | 41.924 | 0.025 | 1 |
561 | 1 | 49 | LYS | N | N | 120.653 | 0.029 | 1 |
562 | 1 | 50 | GLY | H | H | 8.880 | 0.008 | 1 |
563 | 1 | 50 | GLY | HA2 | H | 3.583 | 0.005 | 2 |
564 | 1 | 50 | GLY | HA3 | H | 4.445 | 0.005 | 2 |
565 | 1 | 50 | GLY | C | C | 174.264 | 0.011 | 1 |
566 | 1 | 50 | GLY | CA | C | 44.786 | 0.023 | 1 |
567 | 1 | 50 | GLY | N | N | 115.683 | 0.031 | 1 |
568 | 1 | 51 | ASP | H | H | 8.572 | 0.003 | 1 |
569 | 1 | 51 | ASP | HA | H | 4.828 | 0.005 | 1 |
570 | 1 | 51 | ASP | HB2 | H | 2.666 | 0.016 | 2 |
571 | 1 | 51 | ASP | HB3 | H | 2.478 | 0.006 | 2 |
572 | 1 | 51 | ASP | C | C | 174.172 | 1 | |
573 | 1 | 51 | ASP | CA | C | 53.868 | 0.02 | 1 |
574 | 1 | 51 | ASP | CB | C | 40.438 | 0.035 | 1 |
575 | 1 | 51 | ASP | N | N | 123.507 | 0.096 | 1 |
576 | 1 | 52 | PRO | HA | H | 4.872 | 0.014 | 1 |
577 | 1 | 52 | PRO | HB2 | H | 2.222 | 0.003 | 2 |
578 | 1 | 52 | PRO | HB3 | H | 1.798 | 0.008 | 2 |
579 | 1 | 52 | PRO | HG2 | H | 2.190 | 0.011 | 2 |
580 | 1 | 52 | PRO | HG3 | H | 2.406 | 0.011 | 2 |
581 | 1 | 52 | PRO | HD2 | H | 3.795 | 0.003 | 2 |
582 | 1 | 52 | PRO | HD3 | H | 4.107 | 0.005 | 2 |
583 | 1 | 52 | PRO | C | C | 176.045 | 1 | |
584 | 1 | 52 | PRO | CA | C | 62.042 | 0.044 | 1 |
585 | 1 | 52 | PRO | CB | C | 31.686 | 0.027 | 1 |
586 | 1 | 52 | PRO | CG | C | 27.687 | 0.037 | 1 |
587 | 1 | 52 | PRO | CD | C | 50.914 | 0.018 | 1 |
588 | 1 | 53 | VAL | H | H | 7.794 | 0.002 | 1 |
589 | 1 | 53 | VAL | HA | H | 4.464 | 0.005 | 1 |
590 | 1 | 53 | VAL | HB | H | 1.050 | 0.014 | 1 |
591 | 1 | 53 | VAL | HG11 | H | 0.024 | 0.012 | 2 |
592 | 1 | 53 | VAL | HG12 | H | 0.024 | 0.012 | 2 |
593 | 1 | 53 | VAL | HG13 | H | 0.024 | 0.012 | 2 |
594 | 1 | 53 | VAL | HG21 | H | 0.078 | 0.021 | 2 |
595 | 1 | 53 | VAL | HG22 | H | 0.078 | 0.021 | 2 |
596 | 1 | 53 | VAL | HG23 | H | 0.078 | 0.021 | 2 |
597 | 1 | 53 | VAL | C | C | 174.734 | 0.033 | 1 |
598 | 1 | 53 | VAL | CA | C | 60.444 | 0.004 | 1 |
599 | 1 | 53 | VAL | CB | C | 35.376 | 0.055 | 1 |
600 | 1 | 53 | VAL | CG1 | C | 19.445 | 0.057 | 2 |
601 | 1 | 53 | VAL | CG2 | C | 20.784 | 0.039 | 2 |
602 | 1 | 53 | VAL | N | N | 122.152 | 0.027 | 1 |
603 | 1 | 54 | TYR | H | H | 9.023 | 0.013 | 1 |
604 | 1 | 54 | TYR | HA | H | 4.818 | 0.013 | 1 |
605 | 1 | 54 | TYR | HB2 | H | 2.937 | 0.005 | 2 |
606 | 1 | 54 | TYR | HB3 | H | 3.403 | 0.009 | 2 |
607 | 1 | 54 | TYR | HD1 | H | 7.242 | 1 | |
608 | 1 | 54 | TYR | HD2 | H | 7.242 | 1 | |
609 | 1 | 54 | TYR | HE1 | H | 6.931 | 1 | |
610 | 1 | 54 | TYR | HE2 | H | 6.931 | 1 | |
611 | 1 | 54 | TYR | C | C | 174.686 | 1 | |
612 | 1 | 54 | TYR | CA | C | 58.364 | 0.027 | 1 |
613 | 1 | 54 | TYR | CB | C | 38.033 | 0.069 | 1 |
614 | 1 | 54 | TYR | CD1 | C | 133.909 | 0.04 | 1 |
615 | 1 | 54 | TYR | CD2 | C | 133.909 | 0.04 | 1 |
616 | 1 | 54 | TYR | CE1 | C | 118.086 | 0.017 | 1 |
617 | 1 | 54 | TYR | CE2 | C | 118.086 | 0.017 | 1 |
618 | 1 | 54 | TYR | N | N | 128.347 | 0.019 | 1 |
619 | 1 | 55 | VAL | H | H | 9.077 | 0.006 | 1 |
620 | 1 | 55 | VAL | HA | H | 4.477 | 0.022 | 1 |
621 | 1 | 55 | VAL | HB | H | 2.194 | 0.005 | 1 |
622 | 1 | 55 | VAL | HG11 | H | 1.341 | 0.021 | 2 |
623 | 1 | 55 | VAL | HG12 | H | 1.341 | 0.021 | 2 |
624 | 1 | 55 | VAL | HG13 | H | 1.341 | 0.021 | 2 |
625 | 1 | 55 | VAL | HG21 | H | 1.051 | 0.009 | 2 |
626 | 1 | 55 | VAL | HG22 | H | 1.051 | 0.009 | 2 |
627 | 1 | 55 | VAL | HG23 | H | 1.051 | 0.009 | 2 |
628 | 1 | 55 | VAL | C | C | 175.243 | 0.001 | 1 |
629 | 1 | 55 | VAL | CA | C | 63.650 | 0.119 | 1 |
630 | 1 | 55 | VAL | CB | C | 33.422 | 0.01 | 1 |
631 | 1 | 55 | VAL | CG1 | C | 21.616 | 0.072 | 2 |
632 | 1 | 55 | VAL | CG2 | C | 21.733 | 0.017 | 2 |
633 | 1 | 55 | VAL | N | N | 123.286 | 0.023 | 1 |
634 | 1 | 56 | TYR | H | H | 9.137 | 0.007 | 1 |
635 | 1 | 56 | TYR | HA | H | 4.592 | 0.012 | 1 |
636 | 1 | 56 | TYR | HB2 | H | 2.647 | 0.007 | 2 |
637 | 1 | 56 | TYR | HB3 | H | 3.243 | 0.018 | 2 |
638 | 1 | 56 | TYR | HD1 | H | 7.036 | 1 | |
639 | 1 | 56 | TYR | HD2 | H | 7.036 | 1 | |
640 | 1 | 56 | TYR | HE1 | H | 6.799 | 1 | |
641 | 1 | 56 | TYR | HE2 | H | 6.799 | 1 | |
642 | 1 | 56 | TYR | C | C | 173.389 | 0.015 | 1 |
643 | 1 | 56 | TYR | CA | C | 61.366 | 0.058 | 1 |
644 | 1 | 56 | TYR | CB | C | 42.000 | 0.025 | 1 |
645 | 1 | 56 | TYR | CD1 | C | 133.442 | 0.009 | 1 |
646 | 1 | 56 | TYR | CD2 | C | 133.442 | 0.009 | 1 |
647 | 1 | 56 | TYR | CE1 | C | 118.883 | 0.011 | 1 |
648 | 1 | 56 | TYR | CE2 | C | 118.883 | 0.011 | 1 |
649 | 1 | 56 | TYR | N | N | 127.157 | 0.029 | 1 |
650 | 1 | 57 | TYR | H | H | 7.650 | 0.004 | 1 |
651 | 1 | 57 | TYR | HA | H | 5.517 | 0.008 | 1 |
652 | 1 | 57 | TYR | HB2 | H | 4.086 | 0.013 | 2 |
653 | 1 | 57 | TYR | HB3 | H | 3.073 | 0.018 | 2 |
654 | 1 | 57 | TYR | HD1 | H | 6.879 | 0.022 | 1 |
655 | 1 | 57 | TYR | HD2 | H | 6.879 | 0.022 | 1 |
656 | 1 | 57 | TYR | HE1 | H | 6.879 | 1 | |
657 | 1 | 57 | TYR | HE2 | H | 6.879 | 1 | |
658 | 1 | 57 | TYR | C | C | 173.145 | 0.004 | 1 |
659 | 1 | 57 | TYR | CA | C | 57.289 | 0.023 | 1 |
660 | 1 | 57 | TYR | CB | C | 41.415 | 0.04 | 1 |
661 | 1 | 57 | TYR | CD1 | C | 132.723 | 0.001 | 1 |
662 | 1 | 57 | TYR | CD2 | C | 132.723 | 0.001 | 1 |
663 | 1 | 57 | TYR | CE1 | C | 118.099 | 0.01 | 1 |
664 | 1 | 57 | TYR | CE2 | C | 118.099 | 0.01 | 1 |
665 | 1 | 57 | TYR | N | N | 108.536 | 0.015 | 1 |
666 | 1 | 58 | LYS | H | H | 8.570 | 0.003 | 1 |
667 | 1 | 58 | LYS | HA | H | 4.810 | 0.006 | 1 |
668 | 1 | 58 | LYS | HB2 | H | 1.818 | 0.03 | 2 |
669 | 1 | 58 | LYS | HB3 | H | 1.662 | 0.005 | 2 |
670 | 1 | 58 | LYS | HG2 | H | 0.760 | 0.021 | 2 |
671 | 1 | 58 | LYS | HG3 | H | -0.629 | 0.005 | 2 |
672 | 1 | 58 | LYS | HD2 | H | 1.438 | 0.022 | 2 |
673 | 1 | 58 | LYS | HD3 | H | 1.489 | 0.017 | 2 |
674 | 1 | 58 | LYS | HE2 | H | 2.469 | 0.019 | 2 |
675 | 1 | 58 | LYS | HE3 | H | 2.675 | 0.006 | 2 |
676 | 1 | 58 | LYS | C | C | 177.477 | 1 | |
677 | 1 | 58 | LYS | CA | C | 54.144 | 0.033 | 1 |
678 | 1 | 58 | LYS | CB | C | 36.246 | 0.062 | 1 |
679 | 1 | 58 | LYS | CG | C | 22.709 | 0.108 | 1 |
680 | 1 | 58 | LYS | CD | C | 29.673 | 0.082 | 1 |
681 | 1 | 58 | LYS | CE | C | 42.010 | 0.059 | 1 |
682 | 1 | 58 | LYS | N | N | 115.721 | 0.046 | 1 |
683 | 1 | 59 | LEU | H | H | 8.676 | 0.008 | 1 |
684 | 1 | 59 | LEU | HA | H | 5.029 | 0.007 | 1 |
685 | 1 | 59 | LEU | HB2 | H | 2.496 | 0.012 | 2 |
686 | 1 | 59 | LEU | HB3 | H | 1.678 | 0.011 | 2 |
687 | 1 | 59 | LEU | HD11 | H | 1.238 | 0.013 | 2 |
688 | 1 | 59 | LEU | HD12 | H | 1.238 | 0.013 | 2 |
689 | 1 | 59 | LEU | HD13 | H | 1.238 | 0.013 | 2 |
690 | 1 | 59 | LEU | HD21 | H | 0.871 | 0.012 | 2 |
691 | 1 | 59 | LEU | HD22 | H | 0.871 | 0.012 | 2 |
692 | 1 | 59 | LEU | HD23 | H | 0.871 | 0.012 | 2 |
693 | 1 | 59 | LEU | C | C | 177.709 | 0.002 | 1 |
694 | 1 | 59 | LEU | CA | C | 55.495 | 0.048 | 1 |
695 | 1 | 59 | LEU | CB | C | 40.677 | 0.093 | 1 |
696 | 1 | 59 | LEU | CD1 | C | 22.087 | 0.004 | 2 |
697 | 1 | 59 | LEU | CD2 | C | 27.109 | 0.022 | 2 |
698 | 1 | 59 | LEU | N | N | 120.082 | 0.043 | 1 |
699 | 1 | 60 | ALA | H | H | 8.187 | 0.003 | 1 |
700 | 1 | 60 | ALA | HA | H | 4.438 | 0.006 | 1 |
701 | 1 | 60 | ALA | HB1 | H | 1.337 | 0.008 | 1 |
702 | 1 | 60 | ALA | HB2 | H | 1.337 | 0.008 | 1 |
703 | 1 | 60 | ALA | HB3 | H | 1.337 | 0.008 | 1 |
704 | 1 | 60 | ALA | C | C | 176.481 | 0.001 | 1 |
705 | 1 | 60 | ALA | CA | C | 52.804 | 0.019 | 1 |
706 | 1 | 60 | ALA | CB | C | 19.402 | 0.062 | 1 |
707 | 1 | 60 | ALA | N | N | 126.095 | 0.031 | 1 |
708 | 1 | 61 | ARG | H | H | 8.161 | 0.008 | 1 |
709 | 1 | 61 | ARG | HA | H | 4.484 | 0.019 | 1 |
710 | 1 | 61 | ARG | HB2 | H | 2.012 | 0.018 | 2 |
711 | 1 | 61 | ARG | HB3 | H | 2.120 | 0.001 | 2 |
712 | 1 | 61 | ARG | HG2 | H | 1.717 | 0.009 | 2 |
713 | 1 | 61 | ARG | HG3 | H | 1.766 | 0.006 | 2 |
714 | 1 | 61 | ARG | HD2 | H | 3.289 | 0.003 | 2 |
715 | 1 | 61 | ARG | HD3 | H | 3.288 | 0.004 | 2 |
716 | 1 | 61 | ARG | C | C | 175.678 | 0.003 | 1 |
717 | 1 | 61 | ARG | CA | C | 56.335 | 0.059 | 1 |
718 | 1 | 61 | ARG | CB | C | 31.161 | 0.038 | 1 |
719 | 1 | 61 | ARG | CG | C | 27.881 | 0.0 | 1 |
720 | 1 | 61 | ARG | CD | C | 43.108 | 0.012 | 1 |
721 | 1 | 61 | ARG | N | N | 118.074 | 0.04 | 1 |
722 | 1 | 62 | GLY | H | H | 8.259 | 0.008 | 1 |
723 | 1 | 62 | GLY | HA2 | H | 4.058 | 0.013 | 2 |
724 | 1 | 62 | GLY | HA3 | H | 4.052 | 0.007 | 2 |
725 | 1 | 62 | GLY | C | C | 172.187 | 0.001 | 1 |
726 | 1 | 62 | GLY | CA | C | 44.665 | 0.018 | 1 |
727 | 1 | 62 | GLY | N | N | 109.469 | 0.021 | 1 |
728 | 1 | 63 | TRP | H | H | 8.178 | 0.006 | 1 |
729 | 1 | 63 | TRP | HA | H | 4.562 | 0.014 | 1 |
730 | 1 | 63 | TRP | HB2 | H | 3.290 | 0.02 | 2 |
731 | 1 | 63 | TRP | HB3 | H | 3.210 | 0.032 | 2 |
732 | 1 | 63 | TRP | HD1 | H | 7.506 | 0.029 | 1 |
733 | 1 | 63 | TRP | HE1 | H | 10.382 | 0.002 | 1 |
734 | 1 | 63 | TRP | HZ2 | H | 7.479 | 0.011 | 1 |
735 | 1 | 63 | TRP | HZ3 | H | 7.126 | 0.0 | 1 |
736 | 1 | 63 | TRP | HH2 | H | 7.203 | 0.005 | 1 |
737 | 1 | 63 | TRP | C | C | 175.008 | 1 | |
738 | 1 | 63 | TRP | CA | C | 56.450 | 0.02 | 1 |
739 | 1 | 63 | TRP | CB | C | 31.092 | 0.072 | 1 |
740 | 1 | 63 | TRP | CD1 | C | 127.850 | 0.1 | 1 |
741 | 1 | 63 | TRP | CZ2 | C | 114.680 | 0.003 | 1 |
742 | 1 | 63 | TRP | CZ3 | C | 121.877 | 0.011 | 1 |
743 | 1 | 63 | TRP | CH2 | C | 124.871 | 0.004 | 1 |
744 | 1 | 63 | TRP | N | N | 120.134 | 0.011 | 1 |
745 | 1 | 63 | TRP | NE1 | N | 130.094 | 0.076 | 1 |
746 | 1 | 64 | PRO | HA | H | 3.564 | 0.013 | 1 |
747 | 1 | 64 | PRO | HB2 | H | 1.459 | 0.016 | 2 |
748 | 1 | 64 | PRO | HB3 | H | 1.437 | 0.034 | 2 |
749 | 1 | 64 | PRO | HG2 | H | 0.926 | 0.009 | 2 |
750 | 1 | 64 | PRO | HG3 | H | 1.464 | 0.001 | 2 |
751 | 1 | 64 | PRO | HD2 | H | 3.197 | 0.007 | 2 |
752 | 1 | 64 | PRO | HD3 | H | 2.997 | 0.003 | 2 |
753 | 1 | 64 | PRO | C | C | 174.780 | 1 | |
754 | 1 | 64 | PRO | CA | C | 62.266 | 0.056 | 1 |
755 | 1 | 64 | PRO | CB | C | 33.577 | 0.072 | 1 |
756 | 1 | 64 | PRO | CG | C | 25.104 | 0.029 | 1 |
757 | 1 | 64 | PRO | CD | C | 50.049 | 0.065 | 1 |
758 | 1 | 65 | GLU | H | H | 8.837 | 0.006 | 1 |
759 | 1 | 65 | GLU | HA | H | 4.204 | 0.007 | 1 |
760 | 1 | 65 | GLU | HB2 | H | 1.938 | 0.028 | 2 |
761 | 1 | 65 | GLU | HB3 | H | 1.932 | 0.024 | 2 |
762 | 1 | 65 | GLU | HG2 | H | 2.425 | 0.032 | 2 |
763 | 1 | 65 | GLU | HG3 | H | 2.473 | 0.029 | 2 |
764 | 1 | 65 | GLU | C | C | 176.893 | 0.005 | 1 |
765 | 1 | 65 | GLU | CA | C | 57.767 | 0.033 | 1 |
766 | 1 | 65 | GLU | CB | C | 30.287 | 0.036 | 1 |
767 | 1 | 65 | GLU | CG | C | 37.481 | 0.016 | 1 |
768 | 1 | 65 | GLU | N | N | 122.960 | 0.037 | 1 |
769 | 1 | 66 | VAL | H | H | 8.890 | 0.004 | 1 |
770 | 1 | 66 | VAL | HA | H | 4.470 | 0.012 | 1 |
771 | 1 | 66 | VAL | HB | H | 1.950 | 0.008 | 1 |
772 | 1 | 66 | VAL | HG11 | H | 0.838 | 0.006 | 2 |
773 | 1 | 66 | VAL | HG12 | H | 0.838 | 0.006 | 2 |
774 | 1 | 66 | VAL | HG13 | H | 0.838 | 0.006 | 2 |
775 | 1 | 66 | VAL | HG21 | H | 1.002 | 0.016 | 2 |
776 | 1 | 66 | VAL | HG22 | H | 1.002 | 0.016 | 2 |
777 | 1 | 66 | VAL | HG23 | H | 1.002 | 0.016 | 2 |
778 | 1 | 66 | VAL | C | C | 173.612 | 0.007 | 1 |
779 | 1 | 66 | VAL | CA | C | 61.724 | 0.046 | 1 |
780 | 1 | 66 | VAL | CB | C | 35.487 | 0.058 | 1 |
781 | 1 | 66 | VAL | CG1 | C | 22.518 | 0.049 | 2 |
782 | 1 | 66 | VAL | CG2 | C | 23.223 | 0.04 | 2 |
783 | 1 | 66 | VAL | N | N | 126.192 | 0.014 | 1 |
784 | 1 | 67 | TRP | H | H | 8.515 | 0.015 | 1 |
785 | 1 | 67 | TRP | HA | H | 5.285 | 0.007 | 1 |
786 | 1 | 67 | TRP | HB2 | H | 3.137 | 0.007 | 2 |
787 | 1 | 67 | TRP | HB3 | H | 2.478 | 0.006 | 2 |
788 | 1 | 67 | TRP | HD1 | H | 7.344 | 0.006 | 1 |
789 | 1 | 67 | TRP | HE1 | H | 11.240 | 0.002 | 1 |
790 | 1 | 67 | TRP | HE3 | H | 7.576 | 0.008 | 1 |
791 | 1 | 67 | TRP | HZ2 | H | 7.529 | 0.013 | 1 |
792 | 1 | 67 | TRP | HH2 | H | 6.975 | 0.01 | 1 |
793 | 1 | 67 | TRP | C | C | 172.024 | 0.008 | 1 |
794 | 1 | 67 | TRP | CA | C | 52.870 | 0.035 | 1 |
795 | 1 | 67 | TRP | CB | C | 34.560 | 0.063 | 1 |
796 | 1 | 67 | TRP | CD1 | C | 122.331 | 0.085 | 1 |
797 | 1 | 67 | TRP | CE3 | C | 121.159 | 0.001 | 1 |
798 | 1 | 67 | TRP | CZ2 | C | 115.171 | 0.008 | 1 |
799 | 1 | 67 | TRP | CH2 | C | 125.347 | 0.003 | 1 |
800 | 1 | 67 | TRP | N | N | 127.993 | 0.028 | 1 |
801 | 1 | 67 | TRP | NE1 | N | 130.294 | 0.035 | 1 |
802 | 1 | 68 | ALA | H | H | 8.742 | 0.01 | 1 |
803 | 1 | 68 | ALA | HA | H | 4.834 | 0.013 | 1 |
804 | 1 | 68 | ALA | HB1 | H | 0.072 | 0.003 | 1 |
805 | 1 | 68 | ALA | HB2 | H | 0.072 | 0.003 | 1 |
806 | 1 | 68 | ALA | HB3 | H | 0.072 | 0.003 | 1 |
807 | 1 | 68 | ALA | C | C | 177.473 | 0.017 | 1 |
808 | 1 | 68 | ALA | CA | C | 50.186 | 0.02 | 1 |
809 | 1 | 68 | ALA | CB | C | 21.498 | 0.071 | 1 |
810 | 1 | 68 | ALA | N | N | 120.454 | 0.029 | 1 |
811 | 1 | 69 | GLY | H | H | 8.655 | 0.013 | 1 |
812 | 1 | 69 | GLY | HA2 | H | 4.631 | 0.006 | 2 |
813 | 1 | 69 | GLY | HA3 | H | 4.631 | 0.009 | 2 |
814 | 1 | 69 | GLY | C | C | 178.772 | 0.003 | 1 |
815 | 1 | 69 | GLY | CA | C | 46.989 | 0.054 | 1 |
816 | 1 | 69 | GLY | N | N | 109.239 | 0.019 | 1 |
817 | 1 | 70 | SER | H | H | 9.719 | 0.003 | 1 |
818 | 1 | 70 | SER | HA | H | 5.816 | 0.006 | 1 |
819 | 1 | 70 | SER | HB2 | H | 3.968 | 0.006 | 2 |
820 | 1 | 70 | SER | HB3 | H | 4.240 | 0.011 | 2 |
821 | 1 | 70 | SER | C | C | 173.920 | 0.013 | 1 |
822 | 1 | 70 | SER | CA | C | 56.524 | 0.028 | 1 |
823 | 1 | 70 | SER | CB | C | 67.970 | 0.06 | 1 |
824 | 1 | 70 | SER | N | N | 113.324 | 0.045 | 1 |
825 | 1 | 71 | VAL | H | H | 8.070 | 0.007 | 1 |
826 | 1 | 71 | VAL | HA | H | 4.596 | 0.008 | 1 |
827 | 1 | 71 | VAL | HB | H | 2.058 | 0.005 | 1 |
828 | 1 | 71 | VAL | HG11 | H | 1.160 | 0.023 | 2 |
829 | 1 | 71 | VAL | HG12 | H | 1.160 | 0.023 | 2 |
830 | 1 | 71 | VAL | HG13 | H | 1.160 | 0.023 | 2 |
831 | 1 | 71 | VAL | HG21 | H | 1.071 | 0.016 | 2 |
832 | 1 | 71 | VAL | HG22 | H | 1.071 | 0.016 | 2 |
833 | 1 | 71 | VAL | HG23 | H | 1.071 | 0.016 | 2 |
834 | 1 | 71 | VAL | C | C | 177.680 | 0.006 | 1 |
835 | 1 | 71 | VAL | CA | C | 61.651 | 0.006 | 1 |
836 | 1 | 71 | VAL | CB | C | 34.145 | 0.036 | 1 |
837 | 1 | 71 | VAL | CG1 | C | 20.746 | 0.051 | 2 |
838 | 1 | 71 | VAL | CG2 | C | 22.416 | 0.019 | 2 |
839 | 1 | 71 | VAL | N | N | 121.350 | 0.035 | 1 |
840 | 1 | 72 | GLY | H | H | 9.391 | 0.003 | 1 |
841 | 1 | 72 | GLY | HA2 | H | 3.866 | 0.003 | 2 |
842 | 1 | 72 | GLY | HA3 | H | 4.160 | 0.003 | 2 |
843 | 1 | 72 | GLY | CA | C | 47.381 | 0.027 | 1 |
844 | 1 | 72 | GLY | N | N | 119.025 | 0.029 | 1 |
845 | 1 | 73 | ARG | HA | H | 4.601 | 0.003 | 1 |
846 | 1 | 73 | ARG | HB2 | H | 1.833 | 0.001 | 2 |
847 | 1 | 73 | ARG | HB3 | H | 2.161 | 0.016 | 2 |
848 | 1 | 73 | ARG | HG2 | H | 1.759 | 0.008 | 2 |
849 | 1 | 73 | ARG | HG3 | H | 1.757 | 0.007 | 2 |
850 | 1 | 73 | ARG | HD2 | H | 3.275 | 0.004 | 2 |
851 | 1 | 73 | ARG | HD3 | H | 3.276 | 0.004 | 2 |
852 | 1 | 73 | ARG | C | C | 175.464 | 0.004 | 1 |
853 | 1 | 73 | ARG | CA | C | 55.923 | 0.026 | 1 |
854 | 1 | 73 | ARG | CB | C | 29.916 | 0.021 | 1 |
855 | 1 | 73 | ARG | CG | C | 27.645 | 0.03 | 1 |
856 | 1 | 73 | ARG | CD | C | 43.386 | 0.016 | 1 |
857 | 1 | 74 | THR | H | H | 8.134 | 0.029 | 1 |
858 | 1 | 74 | THR | HA | H | 4.827 | 0.007 | 1 |
859 | 1 | 74 | THR | HB | H | 4.392 | 0.01 | 1 |
860 | 1 | 74 | THR | HG21 | H | 1.402 | 0.006 | 1 |
861 | 1 | 74 | THR | HG22 | H | 1.402 | 0.006 | 1 |
862 | 1 | 74 | THR | HG23 | H | 1.402 | 0.006 | 1 |
863 | 1 | 74 | THR | C | C | 172.291 | 0.007 | 1 |
864 | 1 | 74 | THR | CA | C | 61.164 | 0.024 | 1 |
865 | 1 | 74 | THR | CB | C | 71.741 | 0.046 | 1 |
866 | 1 | 74 | THR | CG2 | C | 22.371 | 0.013 | 1 |
867 | 1 | 74 | THR | N | N | 113.068 | 0.03 | 1 |
868 | 1 | 75 | PHE | H | H | 8.575 | 0.014 | 1 |
869 | 1 | 75 | PHE | HA | H | 5.314 | 0.006 | 1 |
870 | 1 | 75 | PHE | HB2 | H | 2.744 | 0.014 | 2 |
871 | 1 | 75 | PHE | HB3 | H | 2.515 | 0.008 | 2 |
872 | 1 | 75 | PHE | HD1 | H | 6.485 | 1 | |
873 | 1 | 75 | PHE | HD2 | H | 6.485 | 1 | |
874 | 1 | 75 | PHE | C | C | 173.532 | 0.019 | 1 |
875 | 1 | 75 | PHE | CA | C | 56.300 | 0.036 | 1 |
876 | 1 | 75 | PHE | CB | C | 44.250 | 0.047 | 1 |
877 | 1 | 75 | PHE | CD1 | C | 132.082 | 0.066 | 1 |
878 | 1 | 75 | PHE | CD2 | C | 132.082 | 0.066 | 1 |
879 | 1 | 75 | PHE | N | N | 122.998 | 0.066 | 1 |
880 | 1 | 76 | GLY | H | H | 7.816 | 0.003 | 1 |
881 | 1 | 76 | GLY | HA2 | H | 4.076 | 0.006 | 2 |
882 | 1 | 76 | GLY | HA3 | H | 3.268 | 0.014 | 2 |
883 | 1 | 76 | GLY | C | C | 179.674 | 0.005 | 1 |
884 | 1 | 76 | GLY | CA | C | 44.840 | 0.044 | 1 |
885 | 1 | 76 | GLY | N | N | 112.550 | 0.059 | 1 |
886 | 1 | 77 | TYR | H | H | 8.855 | 0.002 | 1 |
887 | 1 | 77 | TYR | HA | H | 5.482 | 0.023 | 1 |
888 | 1 | 77 | TYR | HB2 | H | 2.780 | 0.014 | 2 |
889 | 1 | 77 | TYR | HB3 | H | 1.963 | 0.02 | 2 |
890 | 1 | 77 | TYR | HD1 | H | 7.031 | 1 | |
891 | 1 | 77 | TYR | HD2 | H | 7.031 | 1 | |
892 | 1 | 77 | TYR | C | C | 177.064 | 1 | |
893 | 1 | 77 | TYR | CA | C | 58.169 | 0.049 | 1 |
894 | 1 | 77 | TYR | CB | C | 40.377 | 0.021 | 1 |
895 | 1 | 77 | TYR | CD1 | C | 133.339 | 0.003 | 1 |
896 | 1 | 77 | TYR | CD2 | C | 133.339 | 0.003 | 1 |
897 | 1 | 77 | TYR | N | N | 117.173 | 0.021 | 1 |
898 | 1 | 78 | PHE | H | H | 8.786 | 0.017 | 1 |
899 | 1 | 78 | PHE | HA | H | 5.001 | 0.013 | 1 |
900 | 1 | 78 | PHE | HB2 | H | 3.537 | 0.008 | 2 |
901 | 1 | 78 | PHE | HB3 | H | 2.618 | 0.006 | 2 |
902 | 1 | 78 | PHE | HD1 | H | 6.999 | 1 | |
903 | 1 | 78 | PHE | HD2 | H | 6.999 | 1 | |
904 | 1 | 78 | PHE | HE1 | H | 6.856 | 1 | |
905 | 1 | 78 | PHE | HE2 | H | 6.856 | 1 | |
906 | 1 | 78 | PHE | C | C | 179.694 | 1 | |
907 | 1 | 78 | PHE | CA | C | 55.862 | 0.031 | 1 |
908 | 1 | 78 | PHE | CB | C | 38.930 | 0.042 | 1 |
909 | 1 | 78 | PHE | CD1 | C | 133.523 | 1 | |
910 | 1 | 78 | PHE | CD2 | C | 133.523 | 1 | |
911 | 1 | 78 | PHE | N | N | 112.939 | 0.054 | 1 |
912 | 1 | 79 | PRO | HA | H | 4.630 | 0.008 | 1 |
913 | 1 | 79 | PRO | HB2 | H | 2.009 | 0.037 | 2 |
914 | 1 | 79 | PRO | HB3 | H | 1.997 | 0.046 | 2 |
915 | 1 | 79 | PRO | HG3 | H | 1.475 | 0.0 | 1 |
916 | 1 | 79 | PRO | HD2 | H | 2.768 | 0.004 | 2 |
917 | 1 | 79 | PRO | HD3 | H | 2.634 | 0.003 | 2 |
918 | 1 | 79 | PRO | C | C | 176.668 | 0.008 | 1 |
919 | 1 | 79 | PRO | CA | C | 61.668 | 0.089 | 1 |
920 | 1 | 79 | PRO | CB | C | 31.428 | 0.004 | 1 |
921 | 1 | 79 | PRO | CD | C | 50.309 | 0.043 | 1 |
922 | 1 | 80 | LYS | H | H | 7.551 | 0.005 | 1 |
923 | 1 | 80 | LYS | HA | H | 2.962 | 0.005 | 1 |
924 | 1 | 80 | LYS | HB2 | H | -0.269 | 0.009 | 2 |
925 | 1 | 80 | LYS | HB3 | H | 0.326 | 0.013 | 2 |
926 | 1 | 80 | LYS | HG2 | H | 0.004 | 0.006 | 2 |
927 | 1 | 80 | LYS | HG3 | H | 0.414 | 0.01 | 2 |
928 | 1 | 80 | LYS | HD2 | H | 1.059 | 0.015 | 2 |
929 | 1 | 80 | LYS | HD3 | H | 1.276 | 0.017 | 2 |
930 | 1 | 80 | LYS | HE2 | H | 2.872 | 0.006 | 2 |
931 | 1 | 80 | LYS | HE3 | H | 2.761 | 0.003 | 2 |
932 | 1 | 80 | LYS | C | C | 176.918 | 0.009 | 1 |
933 | 1 | 80 | LYS | CA | C | 58.802 | 0.028 | 1 |
934 | 1 | 80 | LYS | CB | C | 31.231 | 0.048 | 1 |
935 | 1 | 80 | LYS | CG | C | 23.662 | 0.021 | 1 |
936 | 1 | 80 | LYS | CD | C | 29.524 | 0.035 | 1 |
937 | 1 | 80 | LYS | CE | C | 42.169 | 0.054 | 1 |
938 | 1 | 80 | LYS | N | N | 127.635 | 0.012 | 1 |
939 | 1 | 81 | ASP | H | H | 8.539 | 0.008 | 1 |
940 | 1 | 81 | ASP | HA | H | 4.334 | 0.003 | 1 |
941 | 1 | 81 | ASP | HB2 | H | 2.741 | 0.012 | 2 |
942 | 1 | 81 | ASP | HB3 | H | 2.243 | 0.003 | 2 |
943 | 1 | 81 | ASP | C | C | 176.185 | 0.01 | 1 |
944 | 1 | 81 | ASP | CA | C | 56.426 | 0.053 | 1 |
945 | 1 | 81 | ASP | CB | C | 41.156 | 0.059 | 1 |
946 | 1 | 81 | ASP | N | N | 114.188 | 0.033 | 1 |
947 | 1 | 82 | LEU | H | H | 7.360 | 0.01 | 1 |
948 | 1 | 82 | LEU | HA | H | 4.468 | 0.017 | 1 |
949 | 1 | 82 | LEU | HB2 | H | 2.108 | 0.009 | 2 |
950 | 1 | 82 | LEU | HB3 | H | 1.810 | 0.01 | 2 |
951 | 1 | 82 | LEU | HG | H | 1.524 | 0.021 | 1 |
952 | 1 | 82 | LEU | HD11 | H | 0.814 | 0.015 | 2 |
953 | 1 | 82 | LEU | HD12 | H | 0.814 | 0.015 | 2 |
954 | 1 | 82 | LEU | HD13 | H | 0.814 | 0.015 | 2 |
955 | 1 | 82 | LEU | HD21 | H | 0.850 | 0.015 | 2 |
956 | 1 | 82 | LEU | HD22 | H | 0.850 | 0.015 | 2 |
957 | 1 | 82 | LEU | HD23 | H | 0.850 | 0.015 | 2 |
958 | 1 | 82 | LEU | C | C | 175.492 | 0.01 | 1 |
959 | 1 | 82 | LEU | CA | C | 54.727 | 0.132 | 1 |
960 | 1 | 82 | LEU | CB | C | 42.084 | 0.05 | 1 |
961 | 1 | 82 | LEU | CG | C | 28.177 | 0.004 | 1 |
962 | 1 | 82 | LEU | CD1 | C | 23.118 | 0.024 | 2 |
963 | 1 | 82 | LEU | CD2 | C | 26.636 | 0.027 | 2 |
964 | 1 | 82 | LEU | N | N | 115.946 | 0.023 | 1 |
965 | 1 | 83 | ILE | H | H | 7.763 | 0.004 | 1 |
966 | 1 | 83 | ILE | HA | H | 4.994 | 0.006 | 1 |
967 | 1 | 83 | ILE | HB | H | 1.330 | 0.004 | 1 |
968 | 1 | 83 | ILE | HG12 | H | 1.247 | 0.016 | 2 |
969 | 1 | 83 | ILE | HG13 | H | 1.249 | 0.017 | 2 |
970 | 1 | 83 | ILE | HG21 | H | 0.283 | 0.004 | 1 |
971 | 1 | 83 | ILE | HG22 | H | 0.283 | 0.004 | 1 |
972 | 1 | 83 | ILE | HG23 | H | 0.283 | 0.004 | 1 |
973 | 1 | 83 | ILE | HD11 | H | 0.769 | 0.008 | 1 |
974 | 1 | 83 | ILE | HD12 | H | 0.769 | 0.008 | 1 |
975 | 1 | 83 | ILE | HD13 | H | 0.769 | 0.008 | 1 |
976 | 1 | 83 | ILE | C | C | 173.698 | 0.001 | 1 |
977 | 1 | 83 | ILE | CA | C | 58.684 | 0.021 | 1 |
978 | 1 | 83 | ILE | CB | C | 42.091 | 0.105 | 1 |
979 | 1 | 83 | ILE | CG1 | C | 25.970 | 0.047 | 1 |
980 | 1 | 83 | ILE | CG2 | C | 17.716 | 0.057 | 1 |
981 | 1 | 83 | ILE | CD1 | C | 14.982 | 0.032 | 1 |
982 | 1 | 83 | ILE | N | N | 112.008 | 0.031 | 1 |
983 | 1 | 84 | GLN | H | H | 8.496 | 0.006 | 1 |
984 | 1 | 84 | GLN | HA | H | 4.780 | 0.008 | 1 |
985 | 1 | 84 | GLN | HB2 | H | 1.983 | 0.009 | 2 |
986 | 1 | 84 | GLN | HB3 | H | 1.980 | 0.01 | 2 |
987 | 1 | 84 | GLN | HG2 | H | 2.168 | 0.011 | 2 |
988 | 1 | 84 | GLN | HG3 | H | 2.188 | 0.019 | 2 |
989 | 1 | 84 | GLN | HE21 | H | 6.808 | 0.007 | 1 |
990 | 1 | 84 | GLN | HE22 | H | 7.319 | 0.0 | 1 |
991 | 1 | 84 | GLN | C | C | 176.038 | 0.002 | 1 |
992 | 1 | 84 | GLN | CA | C | 53.066 | 0.031 | 1 |
993 | 1 | 84 | GLN | CB | C | 31.316 | 0.021 | 1 |
994 | 1 | 84 | GLN | CG | C | 33.177 | 0.001 | 1 |
995 | 1 | 84 | GLN | N | N | 119.853 | 0.032 | 1 |
996 | 1 | 84 | GLN | NE2 | N | 111.607 | 0.023 | 1 |
997 | 1 | 85 | VAL | H | H | 9.233 | 0.002 | 1 |
998 | 1 | 85 | VAL | HA | H | 3.818 | 0.005 | 1 |
999 | 1 | 85 | VAL | HB | H | 1.989 | 0.011 | 1 |
1000 | 1 | 85 | VAL | HG11 | H | 0.798 | 0.014 | 2 |
1001 | 1 | 85 | VAL | HG12 | H | 0.798 | 0.014 | 2 |
1002 | 1 | 85 | VAL | HG13 | H | 0.798 | 0.014 | 2 |
1003 | 1 | 85 | VAL | HG21 | H | 0.946 | 0.016 | 2 |
1004 | 1 | 85 | VAL | HG22 | H | 0.946 | 0.016 | 2 |
1005 | 1 | 85 | VAL | HG23 | H | 0.946 | 0.016 | 2 |
1006 | 1 | 85 | VAL | C | C | 176.028 | 0.013 | 1 |
1007 | 1 | 85 | VAL | CA | C | 65.632 | 0.016 | 1 |
1008 | 1 | 85 | VAL | CB | C | 31.707 | 0.019 | 1 |
1009 | 1 | 85 | VAL | CG1 | C | 21.517 | 0.084 | 2 |
1010 | 1 | 85 | VAL | CG2 | C | 22.590 | 0.046 | 2 |
1011 | 1 | 85 | VAL | N | N | 127.980 | 0.059 | 1 |
1012 | 1 | 86 | VAL | H | H | 9.033 | 0.015 | 1 |
1013 | 1 | 86 | VAL | HA | H | 4.508 | 0.005 | 1 |
1014 | 1 | 86 | VAL | HB | H | 2.180 | 0.009 | 1 |
1015 | 1 | 86 | VAL | HG11 | H | 0.747 | 0.025 | 2 |
1016 | 1 | 86 | VAL | HG12 | H | 0.747 | 0.025 | 2 |
1017 | 1 | 86 | VAL | HG13 | H | 0.747 | 0.025 | 2 |
1018 | 1 | 86 | VAL | HG21 | H | 0.844 | 0.017 | 2 |
1019 | 1 | 86 | VAL | HG22 | H | 0.844 | 0.017 | 2 |
1020 | 1 | 86 | VAL | HG23 | H | 0.844 | 0.017 | 2 |
1021 | 1 | 86 | VAL | C | C | 175.433 | 0.01 | 1 |
1022 | 1 | 86 | VAL | CA | C | 61.599 | 0.059 | 1 |
1023 | 1 | 86 | VAL | CB | C | 33.238 | 0.062 | 1 |
1024 | 1 | 86 | VAL | CG1 | C | 19.400 | 0.051 | 2 |
1025 | 1 | 86 | VAL | CG2 | C | 21.392 | 0.018 | 2 |
1026 | 1 | 86 | VAL | N | N | 122.942 | 0.042 | 1 |
1027 | 1 | 87 | HIS | H | H | 7.915 | 0.003 | 1 |
1028 | 1 | 87 | HIS | HA | H | 4.613 | 0.003 | 1 |
1029 | 1 | 87 | HIS | HB2 | H | 2.916 | 0.003 | 2 |
1030 | 1 | 87 | HIS | HB3 | H | 2.505 | 0.017 | 2 |
1031 | 1 | 87 | HIS | C | C | 173.328 | 0.009 | 1 |
1032 | 1 | 87 | HIS | CA | C | 57.083 | 0.02 | 1 |
1033 | 1 | 87 | HIS | CB | C | 34.929 | 0.061 | 1 |
1034 | 1 | 87 | HIS | N | N | 119.968 | 0.017 | 1 |
1035 | 1 | 88 | GLU | H | H | 8.145 | 0.003 | 1 |
1036 | 1 | 88 | GLU | HA | H | 4.791 | 0.006 | 1 |
1037 | 1 | 88 | GLU | HB2 | H | 1.939 | 0.017 | 2 |
1038 | 1 | 88 | GLU | HB3 | H | 1.940 | 0.016 | 2 |
1039 | 1 | 88 | GLU | HG2 | H | 2.112 | 0.019 | 2 |
1040 | 1 | 88 | GLU | HG3 | H | 1.988 | 0.008 | 2 |
1041 | 1 | 88 | GLU | C | C | 174.685 | 0.007 | 1 |
1042 | 1 | 88 | GLU | CA | C | 54.916 | 0.017 | 1 |
1043 | 1 | 88 | GLU | CB | C | 30.721 | 0.024 | 1 |
1044 | 1 | 88 | GLU | CG | C | 36.627 | 0.022 | 1 |
1045 | 1 | 88 | GLU | N | N | 127.040 | 0.02 | 1 |
1046 | 1 | 89 | TYR | H | H | 8.672 | 0.003 | 1 |
1047 | 1 | 89 | TYR | HA | H | 4.238 | 0.028 | 1 |
1048 | 1 | 89 | TYR | HB2 | H | 2.686 | 0.006 | 2 |
1049 | 1 | 89 | TYR | HB3 | H | 3.089 | 0.007 | 2 |
1050 | 1 | 89 | TYR | HD1 | H | 6.976 | 1 | |
1051 | 1 | 89 | TYR | HD2 | H | 6.976 | 1 | |
1052 | 1 | 89 | TYR | HE1 | H | 6.819 | 1 | |
1053 | 1 | 89 | TYR | HE2 | H | 6.819 | 1 | |
1054 | 1 | 89 | TYR | C | C | 176.094 | 0.012 | 1 |
1055 | 1 | 89 | TYR | CA | C | 60.821 | 0.019 | 1 |
1056 | 1 | 89 | TYR | CB | C | 38.686 | 0.049 | 1 |
1057 | 1 | 89 | TYR | CD1 | C | 133.786 | 0.069 | 1 |
1058 | 1 | 89 | TYR | CD2 | C | 133.786 | 0.069 | 1 |
1059 | 1 | 89 | TYR | CE1 | C | 119.013 | 0.077 | 1 |
1060 | 1 | 89 | TYR | CE2 | C | 119.013 | 0.077 | 1 |
1061 | 1 | 89 | TYR | N | N | 122.753 | 0.036 | 1 |
1062 | 1 | 90 | THR | H | H | 7.571 | 0.007 | 1 |
1063 | 1 | 90 | THR | HA | H | 4.655 | 0.016 | 1 |
1064 | 1 | 90 | THR | HB | H | 4.332 | 0.002 | 1 |
1065 | 1 | 90 | THR | HG21 | H | 1.216 | 0.006 | 1 |
1066 | 1 | 90 | THR | HG22 | H | 1.216 | 0.006 | 1 |
1067 | 1 | 90 | THR | HG23 | H | 1.216 | 0.006 | 1 |
1068 | 1 | 90 | THR | C | C | 172.299 | 0.002 | 1 |
1069 | 1 | 90 | THR | CA | C | 59.459 | 0.04 | 1 |
1070 | 1 | 90 | THR | CB | C | 69.127 | 0.1 | 1 |
1071 | 1 | 90 | THR | CG2 | C | 20.676 | 0.036 | 1 |
1072 | 1 | 90 | THR | N | N | 110.818 | 0.039 | 1 |
1073 | 1 | 91 | LYS | H | H | 8.600 | 0.01 | 1 |
1074 | 1 | 91 | LYS | HA | H | 4.598 | 0.014 | 1 |
1075 | 1 | 91 | LYS | HB2 | H | 1.701 | 0.012 | 2 |
1076 | 1 | 91 | LYS | HB3 | H | 1.992 | 0.014 | 2 |
1077 | 1 | 91 | LYS | HG2 | H | 1.443 | 0.005 | 2 |
1078 | 1 | 91 | LYS | HG3 | H | 1.445 | 0.003 | 2 |
1079 | 1 | 91 | LYS | HD2 | H | 1.694 | 0.002 | 2 |
1080 | 1 | 91 | LYS | HD3 | H | 1.694 | 0.003 | 2 |
1081 | 1 | 91 | LYS | HE2 | H | 3.019 | 0.006 | 2 |
1082 | 1 | 91 | LYS | HE3 | H | 3.017 | 0.006 | 2 |
1083 | 1 | 91 | LYS | C | C | 176.629 | 0.009 | 1 |
1084 | 1 | 91 | LYS | CA | C | 55.677 | 0.082 | 1 |
1085 | 1 | 91 | LYS | CB | C | 33.188 | 0.03 | 1 |
1086 | 1 | 91 | LYS | CG | C | 24.730 | 0.052 | 1 |
1087 | 1 | 91 | LYS | CD | C | 29.017 | 0.076 | 1 |
1088 | 1 | 91 | LYS | CE | C | 42.368 | 0.0 | 1 |
1089 | 1 | 91 | LYS | N | N | 123.649 | 0.106 | 1 |
1090 | 1 | 92 | GLU | H | H | 8.219 | 0.026 | 1 |
1091 | 1 | 92 | GLU | HA | H | 4.252 | 0.005 | 1 |
1092 | 1 | 92 | GLU | HB2 | H | 1.982 | 0.019 | 2 |
1093 | 1 | 92 | GLU | HB3 | H | 1.984 | 0.021 | 2 |
1094 | 1 | 92 | GLU | HG2 | H | 2.253 | 0.006 | 2 |
1095 | 1 | 92 | GLU | HG3 | H | 2.253 | 0.005 | 2 |
1096 | 1 | 92 | GLU | C | C | 175.336 | 0.007 | 1 |
1097 | 1 | 92 | GLU | CA | C | 56.588 | 0.029 | 1 |
1098 | 1 | 92 | GLU | CB | C | 31.149 | 0.053 | 1 |
1099 | 1 | 92 | GLU | CG | C | 36.448 | 0.0 | 1 |
1100 | 1 | 92 | GLU | N | N | 121.824 | 0.022 | 1 |
1101 | 1 | 93 | GLU | H | H | 8.257 | 0.003 | 1 |
1102 | 1 | 93 | GLU | HA | H | 4.645 | 0.005 | 1 |
1103 | 1 | 93 | GLU | HB2 | H | 1.769 | 0.007 | 2 |
1104 | 1 | 93 | GLU | HB3 | H | 1.770 | 0.007 | 2 |
1105 | 1 | 93 | GLU | HG2 | H | 2.024 | 0.008 | 2 |
1106 | 1 | 93 | GLU | HG3 | H | 1.893 | 0.001 | 2 |
1107 | 1 | 93 | GLU | C | C | 174.585 | 0.008 | 1 |
1108 | 1 | 93 | GLU | CA | C | 55.473 | 0.042 | 1 |
1109 | 1 | 93 | GLU | CB | C | 33.101 | 0.085 | 1 |
1110 | 1 | 93 | GLU | CG | C | 36.626 | 0.008 | 1 |
1111 | 1 | 93 | GLU | N | N | 120.053 | 0.023 | 1 |
1112 | 1 | 94 | LEU | H | H | 9.470 | 0.008 | 1 |
1113 | 1 | 94 | LEU | HA | H | 4.575 | 0.006 | 1 |
1114 | 1 | 94 | LEU | HB2 | H | 1.420 | 0.019 | 2 |
1115 | 1 | 94 | LEU | HB3 | H | 1.357 | 0.021 | 2 |
1116 | 1 | 94 | LEU | HG | H | 1.460 | 0.017 | 1 |
1117 | 1 | 94 | LEU | HD11 | H | 0.729 | 0.011 | 2 |
1118 | 1 | 94 | LEU | HD12 | H | 0.729 | 0.011 | 2 |
1119 | 1 | 94 | LEU | HD13 | H | 0.729 | 0.011 | 2 |
1120 | 1 | 94 | LEU | HD21 | H | 0.752 | 0.006 | 2 |
1121 | 1 | 94 | LEU | HD22 | H | 0.752 | 0.006 | 2 |
1122 | 1 | 94 | LEU | HD23 | H | 0.752 | 0.006 | 2 |
1123 | 1 | 94 | LEU | C | C | 175.396 | 0.002 | 1 |
1124 | 1 | 94 | LEU | CA | C | 53.931 | 0.037 | 1 |
1125 | 1 | 94 | LEU | CB | C | 44.105 | 0.065 | 1 |
1126 | 1 | 94 | LEU | CG | C | 27.372 | 0.006 | 1 |
1127 | 1 | 94 | LEU | CD1 | C | 25.065 | 0.027 | 2 |
1128 | 1 | 94 | LEU | CD2 | C | 24.592 | 0.086 | 2 |
1129 | 1 | 94 | LEU | N | N | 126.308 | 0.027 | 1 |
1130 | 1 | 95 | GLN | H | H | 8.563 | 0.009 | 1 |
1131 | 1 | 95 | GLN | HA | H | 4.967 | 0.006 | 1 |
1132 | 1 | 95 | GLN | HB2 | H | 1.862 | 0.013 | 2 |
1133 | 1 | 95 | GLN | HB3 | H | 1.862 | 0.012 | 2 |
1134 | 1 | 95 | GLN | HG2 | H | 1.976 | 0.026 | 2 |
1135 | 1 | 95 | GLN | HG3 | H | 1.988 | 0.014 | 2 |
1136 | 1 | 95 | GLN | HE21 | H | 6.763 | 0.001 | 1 |
1137 | 1 | 95 | GLN | HE22 | H | 6.477 | 0.002 | 1 |
1138 | 1 | 95 | GLN | C | C | 175.493 | 0.003 | 1 |
1139 | 1 | 95 | GLN | CA | C | 55.923 | 0.029 | 1 |
1140 | 1 | 95 | GLN | CB | C | 30.070 | 0.049 | 1 |
1141 | 1 | 95 | GLN | CG | C | 35.155 | 0.014 | 1 |
1142 | 1 | 95 | GLN | N | N | 122.568 | 0.045 | 1 |
1143 | 1 | 95 | GLN | NE2 | N | 110.203 | 0.039 | 1 |
1144 | 1 | 96 | VAL | H | H | 9.425 | 0.008 | 1 |
1145 | 1 | 96 | VAL | HA | H | 4.779 | 0.006 | 1 |
1146 | 1 | 96 | VAL | HB | H | 1.895 | 0.007 | 1 |
1147 | 1 | 96 | VAL | HG11 | H | 1.070 | 0.005 | 2 |
1148 | 1 | 96 | VAL | HG12 | H | 1.070 | 0.005 | 2 |
1149 | 1 | 96 | VAL | HG13 | H | 1.070 | 0.005 | 2 |
1150 | 1 | 96 | VAL | HG21 | H | 0.912 | 0.009 | 2 |
1151 | 1 | 96 | VAL | HG22 | H | 0.912 | 0.009 | 2 |
1152 | 1 | 96 | VAL | HG23 | H | 0.912 | 0.009 | 2 |
1153 | 1 | 96 | VAL | C | C | 173.545 | 1 | |
1154 | 1 | 96 | VAL | CA | C | 59.486 | 0.03 | 1 |
1155 | 1 | 96 | VAL | CB | C | 36.406 | 0.045 | 1 |
1156 | 1 | 96 | VAL | CG1 | C | 21.007 | 0.029 | 2 |
1157 | 1 | 96 | VAL | CG2 | C | 20.947 | 0.053 | 2 |
1158 | 1 | 96 | VAL | N | N | 129.162 | 0.024 | 1 |
1159 | 1 | 97 | PRO | HA | H | 4.842 | 0.009 | 1 |
1160 | 1 | 97 | PRO | HB2 | H | 2.407 | 0.003 | 2 |
1161 | 1 | 97 | PRO | HB3 | H | 1.953 | 0.006 | 2 |
1162 | 1 | 97 | PRO | HG2 | H | 2.109 | 0.017 | 2 |
1163 | 1 | 97 | PRO | HG3 | H | 2.105 | 0.013 | 2 |
1164 | 1 | 97 | PRO | HD2 | H | 4.028 | 0.011 | 2 |
1165 | 1 | 97 | PRO | HD3 | H | 3.826 | 0.002 | 2 |
1166 | 1 | 97 | PRO | C | C | 177.670 | 0.002 | 1 |
1167 | 1 | 97 | PRO | CA | C | 63.540 | 0.086 | 1 |
1168 | 1 | 97 | PRO | CB | C | 32.468 | 0.046 | 1 |
1169 | 1 | 97 | PRO | CG | C | 28.119 | 0.045 | 1 |
1170 | 1 | 97 | PRO | CD | C | 51.304 | 0.025 | 1 |
1171 | 1 | 98 | THR | H | H | 7.849 | 0.011 | 1 |
1172 | 1 | 98 | THR | HA | H | 4.530 | 0.01 | 1 |
1173 | 1 | 98 | THR | HB | H | 4.579 | 0.008 | 1 |
1174 | 1 | 98 | THR | HG21 | H | 1.017 | 0.004 | 1 |
1175 | 1 | 98 | THR | HG22 | H | 1.017 | 0.004 | 1 |
1176 | 1 | 98 | THR | HG23 | H | 1.017 | 0.004 | 1 |
1177 | 1 | 98 | THR | C | C | 174.289 | 0.009 | 1 |
1178 | 1 | 98 | THR | CA | C | 59.905 | 0.02 | 1 |
1179 | 1 | 98 | THR | CB | C | 71.510 | 0.054 | 1 |
1180 | 1 | 98 | THR | CG2 | C | 22.393 | 0.051 | 1 |
1181 | 1 | 98 | THR | N | N | 111.090 | 0.044 | 1 |
1182 | 1 | 99 | ASP | H | H | 8.998 | 0.009 | 1 |
1183 | 1 | 99 | ASP | HA | H | 4.838 | 0.01 | 1 |
1184 | 1 | 99 | ASP | HB2 | H | 2.877 | 0.005 | 2 |
1185 | 1 | 99 | ASP | HB3 | H | 2.631 | 0.011 | 2 |
1186 | 1 | 99 | ASP | C | C | 176.975 | 0.006 | 1 |
1187 | 1 | 99 | ASP | CA | C | 52.887 | 0.015 | 1 |
1188 | 1 | 99 | ASP | CB | C | 44.029 | 0.052 | 1 |
1189 | 1 | 99 | ASP | N | N | 120.344 | 0.028 | 1 |
1190 | 1 | 100 | GLU | H | H | 9.066 | 0.004 | 1 |
1191 | 1 | 100 | GLU | HA | H | 4.125 | 0.005 | 1 |
1192 | 1 | 100 | GLU | HB2 | H | 2.099 | 0.017 | 2 |
1193 | 1 | 100 | GLU | HB3 | H | 2.125 | 0.016 | 2 |
1194 | 1 | 100 | GLU | HG2 | H | 2.359 | 0.002 | 2 |
1195 | 1 | 100 | GLU | HG3 | H | 2.359 | 0.002 | 2 |
1196 | 1 | 100 | GLU | C | C | 179.041 | 0.016 | 1 |
1197 | 1 | 100 | GLU | CA | C | 60.293 | 0.021 | 1 |
1198 | 1 | 100 | GLU | CB | C | 29.346 | 0.041 | 1 |
1199 | 1 | 100 | GLU | CG | C | 36.577 | 0.0 | 1 |
1200 | 1 | 100 | GLU | N | N | 119.465 | 0.02 | 1 |
1201 | 1 | 101 | THR | H | H | 8.469 | 0.003 | 1 |
1202 | 1 | 101 | THR | HA | H | 4.070 | 0.011 | 1 |
1203 | 1 | 101 | THR | HB | H | 4.330 | 0.003 | 1 |
1204 | 1 | 101 | THR | HG21 | H | 1.246 | 0.005 | 1 |
1205 | 1 | 101 | THR | HG22 | H | 1.246 | 0.005 | 1 |
1206 | 1 | 101 | THR | HG23 | H | 1.246 | 0.005 | 1 |
1207 | 1 | 101 | THR | C | C | 175.018 | 0.011 | 1 |
1208 | 1 | 101 | THR | CA | C | 64.099 | 0.036 | 1 |
1209 | 1 | 101 | THR | CB | C | 68.773 | 0.031 | 1 |
1210 | 1 | 101 | THR | CG2 | C | 22.103 | 0.018 | 1 |
1211 | 1 | 101 | THR | N | N | 110.890 | 0.047 | 1 |
1212 | 1 | 102 | ASP | H | H | 7.652 | 0.018 | 1 |
1213 | 1 | 102 | ASP | HA | H | 4.698 | 0.005 | 1 |
1214 | 1 | 102 | ASP | HB2 | H | 2.396 | 0.003 | 2 |
1215 | 1 | 102 | ASP | HB3 | H | 1.998 | 0.021 | 2 |
1216 | 1 | 102 | ASP | C | C | 176.689 | 1 | |
1217 | 1 | 102 | ASP | CA | C | 55.842 | 0.026 | 1 |
1218 | 1 | 102 | ASP | CB | C | 41.284 | 0.035 | 1 |
1219 | 1 | 102 | ASP | N | N | 117.818 | 0.044 | 1 |
1220 | 1 | 103 | PHE | H | H | 7.800 | 0.003 | 1 |
1221 | 1 | 103 | PHE | HA | H | 4.692 | 0.027 | 1 |
1222 | 1 | 103 | PHE | HB2 | H | 3.054 | 0.002 | 2 |
1223 | 1 | 103 | PHE | HB3 | H | 3.054 | 0.002 | 2 |
1224 | 1 | 103 | PHE | HD1 | H | 6.923 | 1 | |
1225 | 1 | 103 | PHE | HD2 | H | 6.923 | 1 | |
1226 | 1 | 103 | PHE | HE1 | H | 7.329 | 0.0 | 1 |
1227 | 1 | 103 | PHE | HE2 | H | 7.329 | 0.0 | 1 |
1228 | 1 | 103 | PHE | CA | C | 56.598 | 0.014 | 1 |
1229 | 1 | 103 | PHE | CB | C | 31.684 | 0.026 | 1 |
1230 | 1 | 103 | PHE | N | N | 118.163 | 0.051 | 1 |
1231 | 1 | 104 | VAL | H | H | 6.615 | 0.012 | 1 |
1232 | 1 | 104 | VAL | HA | H | 4.375 | 0.008 | 1 |
1233 | 1 | 104 | VAL | HB | H | 2.090 | 0.007 | 1 |
1234 | 1 | 104 | VAL | HG11 | H | 0.542 | 0.007 | 2 |
1235 | 1 | 104 | VAL | HG12 | H | 0.542 | 0.007 | 2 |
1236 | 1 | 104 | VAL | HG13 | H | 0.542 | 0.007 | 2 |
1237 | 1 | 104 | VAL | HG21 | H | 0.894 | 0.012 | 2 |
1238 | 1 | 104 | VAL | HG22 | H | 0.894 | 0.012 | 2 |
1239 | 1 | 104 | VAL | HG23 | H | 0.894 | 0.012 | 2 |
1240 | 1 | 104 | VAL | C | C | 174.274 | 1 | |
1241 | 1 | 104 | VAL | CA | C | 59.731 | 0.142 | 1 |
1242 | 1 | 104 | VAL | CB | C | 33.512 | 0.071 | 1 |
1243 | 1 | 104 | VAL | CG1 | C | 18.340 | 0.01 | 2 |
1244 | 1 | 104 | VAL | CG2 | C | 21.690 | 0.048 | 2 |
1245 | 1 | 104 | VAL | N | N | 113.686 | 0.036 | 1 |
1246 | 1 | 105 | CYS | H | H | 8.172 | 0.018 | 1 |
1247 | 1 | 105 | CYS | HA | H | 4.467 | 0.01 | 1 |
1248 | 1 | 105 | CYS | HB2 | H | 3.191 | 0.016 | 2 |
1249 | 1 | 105 | CYS | HB3 | H | 3.218 | 0.009 | 2 |
1250 | 1 | 105 | CYS | C | C | 174.952 | 0.008 | 1 |
1251 | 1 | 105 | CYS | CA | C | 55.343 | 0.028 | 1 |
1252 | 1 | 105 | CYS | CB | C | 38.226 | 0.04 | 1 |
1253 | 1 | 105 | CYS | N | N | 115.344 | 0.065 | 1 |
1254 | 1 | 106 | PHE | H | H | 8.474 | 0.006 | 1 |
1255 | 1 | 106 | PHE | HA | H | 4.529 | 0.004 | 1 |
1256 | 1 | 106 | PHE | HB2 | H | 3.212 | 0.019 | 2 |
1257 | 1 | 106 | PHE | HB3 | H | 3.285 | 0.04 | 2 |
1258 | 1 | 106 | PHE | HD1 | H | 7.385 | 1 | |
1259 | 1 | 106 | PHE | HD2 | H | 7.385 | 1 | |
1260 | 1 | 106 | PHE | C | C | 175.787 | 0.003 | 1 |
1261 | 1 | 106 | PHE | CA | C | 59.136 | 0.03 | 1 |
1262 | 1 | 106 | PHE | CB | C | 39.867 | 0.045 | 1 |
1263 | 1 | 106 | PHE | CD1 | C | 132.343 | 0.079 | 1 |
1264 | 1 | 106 | PHE | CD2 | C | 132.343 | 0.079 | 1 |
1265 | 1 | 106 | PHE | N | N | 124.865 | 0.057 | 1 |
1266 | 1 | 107 | ASP | H | H | 8.509 | 0.005 | 1 |
1267 | 1 | 107 | ASP | HA | H | 4.757 | 0.017 | 1 |
1268 | 1 | 107 | ASP | HB2 | H | 2.781 | 0.006 | 2 |
1269 | 1 | 107 | ASP | HB3 | H | 2.783 | 0.005 | 2 |
1270 | 1 | 107 | ASP | C | C | 176.617 | 0.002 | 1 |
1271 | 1 | 107 | ASP | CA | C | 54.125 | 0.01 | 1 |
1272 | 1 | 107 | ASP | CB | C | 41.656 | 0.054 | 1 |
1273 | 1 | 107 | ASP | N | N | 121.815 | 0.037 | 1 |
1274 | 1 | 108 | GLY | H | H | 8.211 | 0.005 | 1 |
1275 | 1 | 108 | GLY | HA2 | H | 4.024 | 0.001 | 2 |
1276 | 1 | 108 | GLY | HA3 | H | 4.024 | 0.001 | 2 |
1277 | 1 | 108 | GLY | C | C | 174.789 | 0.004 | 1 |
1278 | 1 | 108 | GLY | CA | C | 45.622 | 0.038 | 1 |
1279 | 1 | 108 | GLY | N | N | 109.494 | 0.018 | 1 |
1280 | 1 | 109 | GLY | H | H | 8.459 | 0.003 | 1 |
1281 | 1 | 109 | GLY | HA2 | H | 3.995 | 0.009 | 2 |
1282 | 1 | 109 | GLY | HA3 | H | 3.996 | 0.008 | 2 |
1283 | 1 | 109 | GLY | C | C | 174.080 | 0.008 | 1 |
1284 | 1 | 109 | GLY | CA | C | 45.458 | 0.044 | 1 |
1285 | 1 | 109 | GLY | N | N | 108.877 | 0.012 | 1 |
1286 | 1 | 110 | ARG | H | H | 8.188 | 0.002 | 1 |
1287 | 1 | 110 | ARG | HA | H | 4.417 | 0.014 | 1 |
1288 | 1 | 110 | ARG | HB2 | H | 1.899 | 0.023 | 2 |
1289 | 1 | 110 | ARG | HB3 | H | 1.802 | 0.019 | 2 |
1290 | 1 | 110 | ARG | HG2 | H | 1.629 | 0.015 | 2 |
1291 | 1 | 110 | ARG | HG3 | H | 1.630 | 0.015 | 2 |
1292 | 1 | 110 | ARG | HD2 | H | 3.196 | 0.003 | 2 |
1293 | 1 | 110 | ARG | HD3 | H | 3.197 | 0.003 | 2 |
1294 | 1 | 110 | ARG | C | C | 175.993 | 1 | |
1295 | 1 | 110 | ARG | CA | C | 56.042 | 0.024 | 1 |
1296 | 1 | 110 | ARG | CB | C | 31.402 | 0.027 | 1 |
1297 | 1 | 110 | ARG | CG | C | 27.349 | 0.001 | 1 |
1298 | 1 | 110 | ARG | CD | C | 43.370 | 0.002 | 1 |
1299 | 1 | 110 | ARG | N | N | 120.029 | 0.011 | 1 |
1300 | 1 | 111 | ASP | H | H | 8.485 | 0.002 | 1 |
1301 | 1 | 111 | ASP | HA | H | 4.715 | 0.002 | 1 |
1302 | 1 | 111 | ASP | HB2 | H | 2.772 | 0.001 | 2 |
1303 | 1 | 111 | ASP | HB3 | H | 2.772 | 0.001 | 2 |
1304 | 1 | 111 | ASP | C | C | 175.006 | 1 | |
1305 | 1 | 111 | ASP | CA | C | 54.273 | 0.01 | 1 |
1306 | 1 | 111 | ASP | CB | C | 41.546 | 0.035 | 1 |
1307 | 1 | 111 | ASP | N | N | 121.836 | 0.017 | 1 |
1308 | 1 | 112 | ASP | H | H | 7.919 | 0.002 | 1 |
1309 | 1 | 112 | ASP | HA | H | 4.377 | 0.006 | 1 |
1310 | 1 | 112 | ASP | HB2 | H | 2.629 | 0.006 | 1 |
1311 | 1 | 112 | ASP | HB3 | H | 2.629 | 0.006 | 1 |
1312 | 1 | 112 | ASP | C | C | 175.444 | 1 | |
1313 | 1 | 112 | ASP | CA | C | 55.865 | 0.022 | 1 |
1314 | 1 | 112 | ASP | CB | C | 42.342 | 0.016 | 1 |
1315 | 1 | 112 | ASP | N | N | 125.902 | 0.02 | 1 |