data_18131
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18131
_Entry.PDB_ID 2LMQ
save_
save_delta_chem_shifts
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts
_Entity_delta_chem_shifts.Model_type single
_Entity_delta_chem_shifts.Entry_ID 18131
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 10 10 TYR C C 10 173.700 173.700 175.101 -1.401 18131
2 1 1 . 1 1 10 10 TYR CA C 10 54.200 54.200 57.300 -3.100 18131
3 1 1 . 1 1 10 10 TYR CB C 10 37.700 37.700 39.580 -1.879 18131
4 1 1 . 1 1 11 11 GLU C C 11 173.200 173.200 175.053 -1.853 18131
5 1 1 . 1 1 11 11 GLU CA C 11 54.500 54.500 56.385 -1.885 18131
6 1 1 . 1 1 11 11 GLU CB C 11 31.400 31.400 31.780 -0.380 18131
7 1 1 . 1 1 12 12 VAL C C 12 174.100 174.100 175.594 -1.494 18131
8 1 1 . 1 1 12 12 VAL CA C 12 61.000 61.000 62.131 -1.131 18131
9 1 1 . 1 1 12 12 VAL CB C 12 35.400 35.400 32.836 2.564 18131
10 1 1 . 1 1 13 13 HIS C C 13 172.900 172.900 173.980 -1.080 18131
11 1 1 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.023 -0.823 18131
12 1 1 . 1 1 13 13 HIS CB C 13 31.200 31.200 30.956 0.244 18131
13 1 1 . 1 1 14 14 HIS C C 14 171.900 171.900 173.950 -2.050 18131
14 1 1 . 1 1 14 14 HIS CA C 14 53.700 53.700 55.255 -1.555 18131
15 1 1 . 1 1 14 14 HIS CB C 14 35.400 35.400 30.874 4.526 18131
16 1 1 . 1 1 15 15 GLN C C 15 173.400 173.400 175.338 -1.938 18131
17 1 1 . 1 1 15 15 GLN CA C 15 54.600 54.600 55.085 -0.485 18131
18 1 1 . 1 1 15 15 GLN CB C 15 33.700 33.700 31.601 2.099 18131
19 1 1 . 1 1 16 16 LYS C C 16 173.500 173.500 175.860 -2.360 18131
20 1 1 . 1 1 16 16 LYS CA C 16 54.300 54.300 56.144 -1.844 18131
21 1 1 . 1 1 16 16 LYS CB C 16 36.200 36.200 32.992 3.208 18131
22 1 1 . 1 1 17 17 LEU C C 17 174.700 174.700 176.441 -1.741 18131
23 1 1 . 1 1 17 17 LEU CA C 17 53.900 53.900 54.472 -0.572 18131
24 1 1 . 1 1 17 17 LEU CB C 17 44.900 44.900 43.136 1.764 18131
25 1 1 . 1 1 18 18 VAL C C 18 174.100 174.100 175.014 -0.914 18131
26 1 1 . 1 1 18 18 VAL CA C 18 60.600 60.600 62.036 -1.436 18131
27 1 1 . 1 1 18 18 VAL CB C 18 35.300 35.300 33.504 1.796 18131
28 1 1 . 1 1 19 19 PHE C C 19 172.700 172.700 174.490 -1.790 18131
29 1 1 . 1 1 19 19 PHE CA C 19 56.100 56.100 57.820 -1.720 18131
30 1 1 . 1 1 19 19 PHE CB C 19 42.200 42.200 40.955 1.245 18131
31 1 1 . 1 1 20 20 PHE C C 20 172.300 172.300 173.681 -1.381 18131
32 1 1 . 1 1 20 20 PHE CA C 20 56.000 56.000 56.812 -0.812 18131
33 1 1 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.615 2.285 18131
34 1 1 . 1 1 21 21 ALA C C 21 175.100 175.100 176.442 -1.342 18131
35 1 1 . 1 1 21 21 ALA CA C 21 49.700 49.700 51.988 -2.288 18131
36 1 1 . 1 1 21 21 ALA CB C 21 22.100 22.100 20.402 1.698 18131
37 1 1 . 1 1 22 22 GLU C C 22 176.000 176.000 175.244 0.756 18131
38 1 1 . 1 1 22 22 GLU CA C 22 54.400 54.400 56.021 -1.621 18131
39 1 1 . 1 1 22 22 GLU CB C 22 33.900 33.900 30.785 3.115 18131
40 1 1 . 1 1 23 23 ASP C C 23 174.400 174.400 174.693 -0.293 18131
41 1 1 . 1 1 23 23 ASP CA C 23 56.500 56.500 53.784 2.716 18131
42 1 1 . 1 1 23 23 ASP CB C 23 39.100 39.100 41.739 -2.639 18131
43 1 1 . 1 1 24 24 VAL C C 24 176.800 176.800 177.218 -0.418 18131
44 1 1 . 1 1 24 24 VAL CA C 24 60.100 60.100 63.214 -3.114 18131
45 1 1 . 1 1 24 24 VAL CB C 24 32.700 32.700 32.671 0.029 18131
46 1 1 . 1 1 25 25 GLY C C 25 171.500 171.500 173.679 -2.179 18131
47 1 1 . 1 1 25 25 GLY CA C 25 46.500 46.500 45.199 1.301 18131
48 1 1 . 1 1 26 26 SER C C 26 173.800 173.800 172.832 0.968 18131
49 1 1 . 1 1 26 26 SER CA C 26 55.700 55.700 56.892 -1.192 18131
50 1 1 . 1 1 26 26 SER CB C 26 65.300 65.300 65.687 -0.387 18131
51 1 1 . 1 1 27 27 ASN C C 27 174.300 174.300 176.021 -1.721 18131
52 1 1 . 1 1 27 27 ASN CA C 27 53.100 53.100 53.915 -0.815 18131
53 1 1 . 1 1 27 27 ASN CB C 27 40.800 40.800 39.201 1.599 18131
54 1 1 . 1 1 28 28 LYS C C 28 175.300 175.300 177.171 -1.871 18131
55 1 1 . 1 1 28 28 LYS CA C 28 55.500 55.500 57.601 -2.101 18131
56 1 1 . 1 1 28 28 LYS CB C 28 35.500 35.500 32.873 2.627 18131
57 1 1 . 1 1 29 29 GLY C C 29 171.700 171.700 173.479 -1.779 18131
58 1 1 . 1 1 29 29 GLY CA C 29 43.500 43.500 44.671 -1.171 18131
59 1 1 . 1 1 30 30 ALA C C 30 175.200 175.200 177.086 -1.886 18131
60 1 1 . 1 1 30 30 ALA CA C 30 49.800 49.800 51.700 -1.900 18131
61 1 1 . 1 1 30 30 ALA CB C 30 21.300 21.300 18.634 2.666 18131
62 1 1 . 1 1 31 31 ILE C C 31 173.600 173.600 174.760 -1.160 18131
63 1 1 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.460 0.340 18131
64 1 1 . 1 1 31 31 ILE CB C 31 39.900 39.900 40.208 -0.308 18131
65 1 1 . 1 1 32 32 ILE C C 32 175.700 175.700 175.838 -0.138 18131
66 1 1 . 1 1 32 32 ILE CA C 32 57.200 57.200 61.040 -3.840 18131
67 1 1 . 1 1 32 32 ILE CB C 32 42.200 42.200 38.153 4.048 18131
68 1 1 . 1 1 33 33 GLY C C 33 171.700 171.700 173.562 -1.862 18131
69 1 1 . 1 1 33 33 GLY CA C 33 48.100 48.100 44.932 3.168 18131
70 1 1 . 1 1 34 34 LEU C C 34 173.200 173.200 176.133 -2.933 18131
71 1 1 . 1 1 34 34 LEU CA C 34 54.200 54.200 54.301 -0.101 18131
72 1 1 . 1 1 34 34 LEU CB C 34 45.800 45.800 44.982 0.818 18131
73 1 1 . 1 1 35 35 MET C C 35 172.900 172.900 174.883 -1.983 18131
74 1 1 . 1 1 35 35 MET CA C 35 54.100 54.100 55.038 -0.938 18131
75 1 1 . 1 1 35 35 MET CB C 35 36.400 36.400 33.803 2.597 18131
76 1 1 . 1 1 36 36 VAL C C 36 175.400 175.400 175.295 0.105 18131
77 1 1 . 1 1 36 36 VAL CA C 36 58.900 58.900 62.222 -3.322 18131
78 1 1 . 1 1 36 36 VAL CB C 36 35.100 35.100 31.497 3.603 18131
79 1 1 . 1 1 37 37 GLY C C 37 172.300 172.300 174.639 -2.339 18131
80 1 1 . 1 1 37 37 GLY CA C 37 48.300 48.300 45.233 3.067 18131
81 1 1 . 1 1 38 38 GLY C C 38 171.300 171.300 173.994 -2.694 18131
82 1 1 . 1 1 38 38 GLY CA C 38 44.100 44.100 45.781 -1.681 18131
83 1 1 . 1 1 39 39 VAL C C 39 173.500 173.500 176.206 -2.706 18131
84 1 1 . 1 1 39 39 VAL CA C 39 60.600 60.600 61.258 -0.658 18131
85 1 1 . 1 1 39 39 VAL CB C 39 34.100 34.100 34.583 -0.483 18131
86 1 2 . 1 1 10 10 TYR C C 10 173.700 173.700 175.342 -1.642 18131
87 1 2 . 1 1 10 10 TYR CA C 10 54.200 54.200 57.630 -3.429 18131
88 1 2 . 1 1 10 10 TYR CB C 10 37.700 37.700 39.459 -1.759 18131
89 1 2 . 1 1 11 11 GLU C C 11 173.200 173.200 174.602 -1.402 18131
90 1 2 . 1 1 11 11 GLU CA C 11 54.500 54.500 55.535 -1.035 18131
91 1 2 . 1 1 11 11 GLU CB C 11 31.400 31.400 30.553 0.847 18131
92 1 2 . 1 1 12 12 VAL C C 12 174.100 174.100 175.024 -0.924 18131
93 1 2 . 1 1 12 12 VAL CA C 12 61.000 61.000 61.573 -0.573 18131
94 1 2 . 1 1 12 12 VAL CB C 12 35.400 35.400 32.788 2.612 18131
95 1 2 . 1 1 13 13 HIS C C 13 172.900 172.900 174.884 -1.984 18131
96 1 2 . 1 1 13 13 HIS CA C 13 54.200 54.200 54.924 -0.724 18131
97 1 2 . 1 1 13 13 HIS CB C 13 31.200 31.200 31.493 -0.293 18131
98 1 2 . 1 1 14 14 HIS C C 14 171.900 171.900 174.960 -3.060 18131
99 1 2 . 1 1 14 14 HIS CA C 14 53.700 53.700 55.986 -2.286 18131
100 1 2 . 1 1 14 14 HIS CB C 14 35.400 35.400 30.779 4.621 18131
101 1 2 . 1 1 15 15 GLN C C 15 173.400 173.400 175.340 -1.940 18131
102 1 2 . 1 1 15 15 GLN CA C 15 54.600 54.600 55.139 -0.539 18131
103 1 2 . 1 1 15 15 GLN CB C 15 33.700 33.700 31.219 2.481 18131
104 1 2 . 1 1 16 16 LYS C C 16 173.500 173.500 175.613 -2.113 18131
105 1 2 . 1 1 16 16 LYS CA C 16 54.300 54.300 55.843 -1.543 18131
106 1 2 . 1 1 16 16 LYS CB C 16 36.200 36.200 32.877 3.323 18131
107 1 2 . 1 1 17 17 LEU C C 17 174.700 174.700 175.574 -0.874 18131
108 1 2 . 1 1 17 17 LEU CA C 17 53.900 53.900 54.531 -0.631 18131
109 1 2 . 1 1 17 17 LEU CB C 17 44.900 44.900 43.069 1.831 18131
110 1 2 . 1 1 18 18 VAL C C 18 174.100 174.100 174.991 -0.891 18131
111 1 2 . 1 1 18 18 VAL CA C 18 60.600 60.600 61.894 -1.294 18131
112 1 2 . 1 1 18 18 VAL CB C 18 35.300 35.300 33.632 1.668 18131
113 1 2 . 1 1 19 19 PHE C C 19 172.700 172.700 175.074 -2.374 18131
114 1 2 . 1 1 19 19 PHE CA C 19 56.100 56.100 57.781 -1.681 18131
115 1 2 . 1 1 19 19 PHE CB C 19 42.200 42.200 41.801 0.399 18131
116 1 2 . 1 1 20 20 PHE C C 20 172.300 172.300 173.913 -1.613 18131
117 1 2 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.314 -1.314 18131
118 1 2 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.485 2.415 18131
119 1 2 . 1 1 21 21 ALA C C 21 175.100 175.100 176.662 -1.562 18131
120 1 2 . 1 1 21 21 ALA CA C 21 49.700 49.700 52.074 -2.374 18131
121 1 2 . 1 1 21 21 ALA CB C 21 22.100 22.100 20.092 2.008 18131
122 1 2 . 1 1 22 22 GLU C C 22 176.000 176.000 175.008 0.992 18131
123 1 2 . 1 1 22 22 GLU CA C 22 54.400 54.400 56.456 -2.056 18131
124 1 2 . 1 1 22 22 GLU CB C 22 33.900 33.900 31.949 1.951 18131
125 1 2 . 1 1 23 23 ASP C C 23 174.400 174.400 175.077 -0.677 18131
126 1 2 . 1 1 23 23 ASP CA C 23 56.500 56.500 54.730 1.770 18131
127 1 2 . 1 1 23 23 ASP CB C 23 39.100 39.100 40.321 -1.221 18131
128 1 2 . 1 1 24 24 VAL C C 24 176.800 176.800 176.997 -0.197 18131
129 1 2 . 1 1 24 24 VAL CA C 24 60.100 60.100 61.304 -1.204 18131
130 1 2 . 1 1 24 24 VAL CB C 24 32.700 32.700 32.782 -0.083 18131
131 1 2 . 1 1 25 25 GLY C C 25 171.500 171.500 174.808 -3.308 18131
132 1 2 . 1 1 25 25 GLY CA C 25 46.500 46.500 46.251 0.249 18131
133 1 2 . 1 1 26 26 SER C C 26 173.800 173.800 173.643 0.157 18131
134 1 2 . 1 1 26 26 SER CA C 26 55.700 55.700 57.910 -2.210 18131
135 1 2 . 1 1 26 26 SER CB C 26 65.300 65.300 65.058 0.242 18131
136 1 2 . 1 1 27 27 ASN C C 27 174.300 174.300 176.330 -2.030 18131
137 1 2 . 1 1 27 27 ASN CA C 27 53.100 53.100 53.490 -0.390 18131
138 1 2 . 1 1 27 27 ASN CB C 27 40.800 40.800 39.096 1.704 18131
139 1 2 . 1 1 28 28 LYS C C 28 175.300 175.300 177.943 -2.643 18131
140 1 2 . 1 1 28 28 LYS CA C 28 55.500 55.500 58.208 -2.708 18131
141 1 2 . 1 1 28 28 LYS CB C 28 35.500 35.500 32.711 2.789 18131
142 1 2 . 1 1 29 29 GLY C C 29 171.700 171.700 173.869 -2.169 18131
143 1 2 . 1 1 29 29 GLY CA C 29 43.500 43.500 45.632 -2.132 18131
144 1 2 . 1 1 30 30 ALA C C 30 175.200 175.200 176.308 -1.108 18131
145 1 2 . 1 1 30 30 ALA CA C 30 49.800 49.800 52.144 -2.344 18131
146 1 2 . 1 1 30 30 ALA CB C 30 21.300 21.300 19.895 1.405 18131
147 1 2 . 1 1 31 31 ILE C C 31 173.600 173.600 174.782 -1.182 18131
148 1 2 . 1 1 31 31 ILE CA C 31 60.800 60.800 61.504 -0.704 18131
149 1 2 . 1 1 31 31 ILE CB C 31 39.900 39.900 39.082 0.818 18131
150 1 2 . 1 1 32 32 ILE C C 32 175.700 175.700 176.088 -0.388 18131
151 1 2 . 1 1 32 32 ILE CA C 32 57.200 57.200 60.998 -3.798 18131
152 1 2 . 1 1 32 32 ILE CB C 32 42.200 42.200 38.556 3.644 18131
153 1 2 . 1 1 33 33 GLY C C 33 171.700 171.700 173.564 -1.864 18131
154 1 2 . 1 1 33 33 GLY CA C 33 48.100 48.100 44.998 3.102 18131
155 1 2 . 1 1 34 34 LEU C C 34 173.200 173.200 176.628 -3.428 18131
156 1 2 . 1 1 34 34 LEU CA C 34 54.200 54.200 54.234 -0.034 18131
157 1 2 . 1 1 34 34 LEU CB C 34 45.800 45.800 44.880 0.920 18131
158 1 2 . 1 1 35 35 MET C C 35 172.900 172.900 175.100 -2.200 18131
159 1 2 . 1 1 35 35 MET CA C 35 54.100 54.100 54.922 -0.822 18131
160 1 2 . 1 1 35 35 MET CB C 35 36.400 36.400 32.798 3.602 18131
161 1 2 . 1 1 36 36 VAL C C 36 175.400 175.400 176.262 -0.862 18131
162 1 2 . 1 1 36 36 VAL CA C 36 58.900 58.900 61.798 -2.898 18131
163 1 2 . 1 1 36 36 VAL CB C 36 35.100 35.100 32.059 3.041 18131
164 1 2 . 1 1 37 37 GLY C C 37 172.300 172.300 174.883 -2.583 18131
165 1 2 . 1 1 37 37 GLY CA C 37 48.300 48.300 44.596 3.704 18131
166 1 2 . 1 1 38 38 GLY C C 38 171.300 171.300 174.583 -3.283 18131
167 1 2 . 1 1 38 38 GLY CA C 38 44.100 44.100 45.281 -1.181 18131
168 1 2 . 1 1 39 39 VAL C C 39 173.500 173.500 176.401 -2.901 18131
169 1 2 . 1 1 39 39 VAL CA C 39 60.600 60.600 61.314 -0.714 18131
170 1 2 . 1 1 39 39 VAL CB C 39 34.100 34.100 33.367 0.733 18131
171 1 3 . 1 1 10 10 TYR C C 10 173.700 173.700 176.096 -2.396 18131
172 1 3 . 1 1 10 10 TYR CA C 10 54.200 54.200 57.353 -3.153 18131
173 1 3 . 1 1 10 10 TYR CB C 10 37.700 37.700 39.667 -1.967 18131
174 1 3 . 1 1 11 11 GLU C C 11 173.200 173.200 175.579 -2.379 18131
175 1 3 . 1 1 11 11 GLU CA C 11 54.500 54.500 56.367 -1.867 18131
176 1 3 . 1 1 11 11 GLU CB C 11 31.400 31.400 29.472 1.928 18131
177 1 3 . 1 1 12 12 VAL C C 12 174.100 174.100 174.346 -0.246 18131
178 1 3 . 1 1 12 12 VAL CA C 12 61.000 61.000 60.391 0.609 18131
179 1 3 . 1 1 12 12 VAL CB C 12 35.400 35.400 34.142 1.258 18131
180 1 3 . 1 1 13 13 HIS C C 13 172.900 172.900 173.416 -0.516 18131
181 1 3 . 1 1 13 13 HIS CA C 13 54.200 54.200 56.062 -1.862 18131
182 1 3 . 1 1 13 13 HIS CB C 13 31.200 31.200 30.455 0.745 18131
183 1 3 . 1 1 14 14 HIS C C 14 171.900 171.900 173.772 -1.872 18131
184 1 3 . 1 1 14 14 HIS CA C 14 53.700 53.700 55.556 -1.856 18131
185 1 3 . 1 1 14 14 HIS CB C 14 35.400 35.400 32.348 3.052 18131
186 1 3 . 1 1 15 15 GLN C C 15 173.400 173.400 174.187 -0.787 18131
187 1 3 . 1 1 15 15 GLN CA C 15 54.600 54.600 55.170 -0.571 18131
188 1 3 . 1 1 15 15 GLN CB C 15 33.700 33.700 31.394 2.306 18131
189 1 3 . 1 1 16 16 LYS C C 16 173.500 173.500 176.269 -2.769 18131
190 1 3 . 1 1 16 16 LYS CA C 16 54.300 54.300 56.086 -1.786 18131
191 1 3 . 1 1 16 16 LYS CB C 16 36.200 36.200 32.733 3.467 18131
192 1 3 . 1 1 17 17 LEU C C 17 174.700 174.700 175.899 -1.199 18131
193 1 3 . 1 1 17 17 LEU CA C 17 53.900 53.900 54.351 -0.451 18131
194 1 3 . 1 1 17 17 LEU CB C 17 44.900 44.900 43.212 1.688 18131
195 1 3 . 1 1 18 18 VAL C C 18 174.100 174.100 175.019 -0.919 18131
196 1 3 . 1 1 18 18 VAL CA C 18 60.600 60.600 61.931 -1.331 18131
197 1 3 . 1 1 18 18 VAL CB C 18 35.300 35.300 33.797 1.504 18131
198 1 3 . 1 1 19 19 PHE C C 19 172.700 172.700 175.211 -2.511 18131
199 1 3 . 1 1 19 19 PHE CA C 19 56.100 56.100 57.630 -1.530 18131
200 1 3 . 1 1 19 19 PHE CB C 19 42.200 42.200 40.563 1.637 18131
201 1 3 . 1 1 20 20 PHE C C 20 172.300 172.300 174.257 -1.957 18131
202 1 3 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.170 -1.170 18131
203 1 3 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.535 2.365 18131
204 1 3 . 1 1 21 21 ALA C C 21 175.100 175.100 176.791 -1.691 18131
205 1 3 . 1 1 21 21 ALA CA C 21 49.700 49.700 51.595 -1.895 18131
206 1 3 . 1 1 21 21 ALA CB C 21 22.100 22.100 20.631 1.469 18131
207 1 3 . 1 1 22 22 GLU C C 22 176.000 176.000 176.651 -0.651 18131
208 1 3 . 1 1 22 22 GLU CA C 22 54.400 54.400 55.293 -0.893 18131
209 1 3 . 1 1 22 22 GLU CB C 22 33.900 33.900 30.238 3.662 18131
210 1 3 . 1 1 23 23 ASP C C 23 174.400 174.400 177.457 -3.057 18131
211 1 3 . 1 1 23 23 ASP CA C 23 56.500 56.500 56.329 0.171 18131
212 1 3 . 1 1 23 23 ASP CB C 23 39.100 39.100 40.466 -1.366 18131
213 1 3 . 1 1 24 24 VAL C C 24 176.800 176.800 177.182 -0.382 18131
214 1 3 . 1 1 24 24 VAL CA C 24 60.100 60.100 63.502 -3.402 18131
215 1 3 . 1 1 24 24 VAL CB C 24 32.700 32.700 32.767 -0.067 18131
216 1 3 . 1 1 25 25 GLY C C 25 171.500 171.500 173.832 -2.332 18131
217 1 3 . 1 1 25 25 GLY CA C 25 46.500 46.500 44.972 1.528 18131
218 1 3 . 1 1 26 26 SER C C 26 173.800 173.800 174.740 -0.940 18131
219 1 3 . 1 1 26 26 SER CA C 26 55.700 55.700 57.899 -2.199 18131
220 1 3 . 1 1 26 26 SER CB C 26 65.300 65.300 63.116 2.184 18131
221 1 3 . 1 1 27 27 ASN C C 27 174.300 174.300 176.180 -1.880 18131
222 1 3 . 1 1 27 27 ASN CA C 27 53.100 53.100 52.727 0.373 18131
223 1 3 . 1 1 27 27 ASN CB C 27 40.800 40.800 39.886 0.914 18131
224 1 3 . 1 1 28 28 LYS C C 28 175.300 175.300 177.369 -2.069 18131
225 1 3 . 1 1 28 28 LYS CA C 28 55.500 55.500 57.808 -2.308 18131
226 1 3 . 1 1 28 28 LYS CB C 28 35.500 35.500 32.552 2.948 18131
227 1 3 . 1 1 29 29 GLY C C 29 171.700 171.700 172.960 -1.260 18131
228 1 3 . 1 1 29 29 GLY CA C 29 43.500 43.500 44.333 -0.833 18131
229 1 3 . 1 1 30 30 ALA C C 30 175.200 175.200 176.824 -1.624 18131
230 1 3 . 1 1 30 30 ALA CA C 30 49.800 49.800 51.459 -1.659 18131
231 1 3 . 1 1 30 30 ALA CB C 30 21.300 21.300 18.534 2.766 18131
232 1 3 . 1 1 31 31 ILE C C 31 173.600 173.600 175.039 -1.439 18131
233 1 3 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.162 0.638 18131
234 1 3 . 1 1 31 31 ILE CB C 31 39.900 39.900 40.441 -0.541 18131
235 1 3 . 1 1 32 32 ILE C C 32 175.700 175.700 176.046 -0.346 18131
236 1 3 . 1 1 32 32 ILE CA C 32 57.200 57.200 61.018 -3.818 18131
237 1 3 . 1 1 32 32 ILE CB C 32 42.200 42.200 38.312 3.888 18131
238 1 3 . 1 1 33 33 GLY C C 33 171.700 171.700 173.513 -1.813 18131
239 1 3 . 1 1 33 33 GLY CA C 33 48.100 48.100 45.045 3.054 18131
240 1 3 . 1 1 34 34 LEU C C 34 173.200 173.200 176.394 -3.194 18131
241 1 3 . 1 1 34 34 LEU CA C 34 54.200 54.200 53.804 0.396 18131
242 1 3 . 1 1 34 34 LEU CB C 34 45.800 45.800 45.150 0.650 18131
243 1 3 . 1 1 35 35 MET C C 35 172.900 172.900 175.195 -2.295 18131
244 1 3 . 1 1 35 35 MET CA C 35 54.100 54.100 54.842 -0.742 18131
245 1 3 . 1 1 35 35 MET CB C 35 36.400 36.400 33.254 3.146 18131
246 1 3 . 1 1 36 36 VAL C C 36 175.400 175.400 176.487 -1.087 18131
247 1 3 . 1 1 36 36 VAL CA C 36 58.900 58.900 62.045 -3.145 18131
248 1 3 . 1 1 36 36 VAL CB C 36 35.100 35.100 31.892 3.208 18131
249 1 3 . 1 1 37 37 GLY C C 37 172.300 172.300 174.807 -2.507 18131
250 1 3 . 1 1 37 37 GLY CA C 37 48.300 48.300 44.604 3.696 18131
251 1 3 . 1 1 38 38 GLY C C 38 171.300 171.300 174.535 -3.235 18131
252 1 3 . 1 1 38 38 GLY CA C 38 44.100 44.100 45.325 -1.225 18131
253 1 3 . 1 1 39 39 VAL C C 39 173.500 173.500 176.687 -3.187 18131
254 1 3 . 1 1 39 39 VAL CA C 39 60.600 60.600 61.157 -0.557 18131
255 1 3 . 1 1 39 39 VAL CB C 39 34.100 34.100 33.986 0.114 18131
256 1 4 . 1 1 10 10 TYR C C 10 173.700 173.700 175.453 -1.753 18131
257 1 4 . 1 1 10 10 TYR CA C 10 54.200 54.200 57.749 -3.549 18131
258 1 4 . 1 1 10 10 TYR CB C 10 37.700 37.700 39.357 -1.657 18131
259 1 4 . 1 1 11 11 GLU C C 11 173.200 173.200 174.997 -1.797 18131
260 1 4 . 1 1 11 11 GLU CA C 11 54.500 54.500 55.839 -1.339 18131
261 1 4 . 1 1 11 11 GLU CB C 11 31.400 31.400 31.731 -0.331 18131
262 1 4 . 1 1 12 12 VAL C C 12 174.100 174.100 174.913 -0.813 18131
263 1 4 . 1 1 12 12 VAL CA C 12 61.000 61.000 61.777 -0.777 18131
264 1 4 . 1 1 12 12 VAL CB C 12 35.400 35.400 32.712 2.688 18131
265 1 4 . 1 1 13 13 HIS C C 13 172.900 172.900 174.678 -1.778 18131
266 1 4 . 1 1 13 13 HIS CA C 13 54.200 54.200 54.737 -0.537 18131
267 1 4 . 1 1 13 13 HIS CB C 13 31.200 31.200 32.436 -1.236 18131
268 1 4 . 1 1 14 14 HIS C C 14 171.900 171.900 174.019 -2.119 18131
269 1 4 . 1 1 14 14 HIS CA C 14 53.700 53.700 55.572 -1.872 18131
270 1 4 . 1 1 14 14 HIS CB C 14 35.400 35.400 31.535 3.865 18131
271 1 4 . 1 1 15 15 GLN C C 15 173.400 173.400 174.395 -0.995 18131
272 1 4 . 1 1 15 15 GLN CA C 15 54.600 54.600 55.152 -0.552 18131
273 1 4 . 1 1 15 15 GLN CB C 15 33.700 33.700 31.891 1.809 18131
274 1 4 . 1 1 16 16 LYS C C 16 173.500 173.500 176.056 -2.556 18131
275 1 4 . 1 1 16 16 LYS CA C 16 54.300 54.300 56.148 -1.848 18131
276 1 4 . 1 1 16 16 LYS CB C 16 36.200 36.200 32.963 3.237 18131
277 1 4 . 1 1 17 17 LEU C C 17 174.700 174.700 175.919 -1.219 18131
278 1 4 . 1 1 17 17 LEU CA C 17 53.900 53.900 54.257 -0.356 18131
279 1 4 . 1 1 17 17 LEU CB C 17 44.900 44.900 42.853 2.047 18131
280 1 4 . 1 1 18 18 VAL C C 18 174.100 174.100 174.626 -0.526 18131
281 1 4 . 1 1 18 18 VAL CA C 18 60.600 60.600 61.684 -1.085 18131
282 1 4 . 1 1 18 18 VAL CB C 18 35.300 35.300 33.483 1.817 18131
283 1 4 . 1 1 19 19 PHE C C 19 172.700 172.700 175.102 -2.402 18131
284 1 4 . 1 1 19 19 PHE CA C 19 56.100 56.100 57.680 -1.580 18131
285 1 4 . 1 1 19 19 PHE CB C 19 42.200 42.200 41.188 1.012 18131
286 1 4 . 1 1 20 20 PHE C C 20 172.300 172.300 175.268 -2.968 18131
287 1 4 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.715 -1.715 18131
288 1 4 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.498 2.402 18131
289 1 4 . 1 1 21 21 ALA C C 21 175.100 175.100 176.905 -1.805 18131
290 1 4 . 1 1 21 21 ALA CA C 21 49.700 49.700 51.685 -1.985 18131
291 1 4 . 1 1 21 21 ALA CB C 21 22.100 22.100 20.408 1.692 18131
292 1 4 . 1 1 22 22 GLU C C 22 176.000 176.000 176.161 -0.161 18131
293 1 4 . 1 1 22 22 GLU CA C 22 54.400 54.400 55.868 -1.468 18131
294 1 4 . 1 1 22 22 GLU CB C 22 33.900 33.900 30.462 3.438 18131
295 1 4 . 1 1 23 23 ASP C C 23 174.400 174.400 176.288 -1.888 18131
296 1 4 . 1 1 23 23 ASP CA C 23 56.500 56.500 55.892 0.608 18131
297 1 4 . 1 1 23 23 ASP CB C 23 39.100 39.100 40.978 -1.878 18131
298 1 4 . 1 1 24 24 VAL C C 24 176.800 176.800 176.282 0.518 18131
299 1 4 . 1 1 24 24 VAL CA C 24 60.100 60.100 63.365 -3.265 18131
300 1 4 . 1 1 24 24 VAL CB C 24 32.700 32.700 31.155 1.544 18131
301 1 4 . 1 1 25 25 GLY C C 25 171.500 171.500 174.337 -2.837 18131
302 1 4 . 1 1 25 25 GLY CA C 25 46.500 46.500 44.922 1.578 18131
303 1 4 . 1 1 26 26 SER C C 26 173.800 173.800 174.378 -0.578 18131
304 1 4 . 1 1 26 26 SER CA C 26 55.700 55.700 58.358 -2.658 18131
305 1 4 . 1 1 26 26 SER CB C 26 65.300 65.300 64.053 1.247 18131
306 1 4 . 1 1 27 27 ASN C C 27 174.300 174.300 175.618 -1.318 18131
307 1 4 . 1 1 27 27 ASN CA C 27 53.100 53.100 52.567 0.533 18131
308 1 4 . 1 1 27 27 ASN CB C 27 40.800 40.800 40.026 0.774 18131
309 1 4 . 1 1 28 28 LYS C C 28 175.300 175.300 177.219 -1.919 18131
310 1 4 . 1 1 28 28 LYS CA C 28 55.500 55.500 57.805 -2.305 18131
311 1 4 . 1 1 28 28 LYS CB C 28 35.500 35.500 32.498 3.002 18131
312 1 4 . 1 1 29 29 GLY C C 29 171.700 171.700 172.927 -1.227 18131
313 1 4 . 1 1 29 29 GLY CA C 29 43.500 43.500 44.155 -0.655 18131
314 1 4 . 1 1 30 30 ALA C C 30 175.200 175.200 176.764 -1.564 18131
315 1 4 . 1 1 30 30 ALA CA C 30 49.800 49.800 51.445 -1.645 18131
316 1 4 . 1 1 30 30 ALA CB C 30 21.300 21.300 19.580 1.720 18131
317 1 4 . 1 1 31 31 ILE C C 31 173.600 173.600 174.920 -1.320 18131
318 1 4 . 1 1 31 31 ILE CA C 31 60.800 60.800 59.958 0.842 18131
319 1 4 . 1 1 31 31 ILE CB C 31 39.900 39.900 40.333 -0.433 18131
320 1 4 . 1 1 32 32 ILE C C 32 175.700 175.700 175.933 -0.233 18131
321 1 4 . 1 1 32 32 ILE CA C 32 57.200 57.200 61.086 -3.885 18131
322 1 4 . 1 1 32 32 ILE CB C 32 42.200 42.200 38.073 4.127 18131
323 1 4 . 1 1 33 33 GLY C C 33 171.700 171.700 173.583 -1.883 18131
324 1 4 . 1 1 33 33 GLY CA C 33 48.100 48.100 44.917 3.183 18131
325 1 4 . 1 1 34 34 LEU C C 34 173.200 173.200 176.157 -2.957 18131
326 1 4 . 1 1 34 34 LEU CA C 34 54.200 54.200 54.335 -0.135 18131
327 1 4 . 1 1 34 34 LEU CB C 34 45.800 45.800 44.960 0.840 18131
328 1 4 . 1 1 35 35 MET C C 35 172.900 172.900 175.043 -2.143 18131
329 1 4 . 1 1 35 35 MET CA C 35 54.100 54.100 55.014 -0.914 18131
330 1 4 . 1 1 35 35 MET CB C 35 36.400 36.400 32.959 3.441 18131
331 1 4 . 1 1 36 36 VAL C C 36 175.400 175.400 175.730 -0.330 18131
332 1 4 . 1 1 36 36 VAL CA C 36 58.900 58.900 62.281 -3.381 18131
333 1 4 . 1 1 36 36 VAL CB C 36 35.100 35.100 31.009 4.090 18131
334 1 4 . 1 1 37 37 GLY C C 37 172.300 172.300 174.401 -2.101 18131
335 1 4 . 1 1 37 37 GLY CA C 37 48.300 48.300 45.531 2.769 18131
336 1 4 . 1 1 38 38 GLY C C 38 171.300 171.300 174.069 -2.769 18131
337 1 4 . 1 1 38 38 GLY CA C 38 44.100 44.100 45.060 -0.960 18131
338 1 4 . 1 1 39 39 VAL C C 39 173.500 173.500 176.016 -2.516 18131
339 1 4 . 1 1 39 39 VAL CA C 39 60.600 60.600 60.408 0.191 18131
340 1 4 . 1 1 39 39 VAL CB C 39 34.100 34.100 33.253 0.847 18131
341 1 5 . 1 1 10 10 TYR C C 10 173.700 173.700 175.816 -2.116 18131
342 1 5 . 1 1 10 10 TYR CA C 10 54.200 54.200 57.633 -3.433 18131
343 1 5 . 1 1 10 10 TYR CB C 10 37.700 37.700 39.529 -1.829 18131
344 1 5 . 1 1 11 11 GLU C C 11 173.200 173.200 175.223 -2.023 18131
345 1 5 . 1 1 11 11 GLU CA C 11 54.500 54.500 55.782 -1.282 18131
346 1 5 . 1 1 11 11 GLU CB C 11 31.400 31.400 32.313 -0.913 18131
347 1 5 . 1 1 12 12 VAL C C 12 174.100 174.100 175.266 -1.166 18131
348 1 5 . 1 1 12 12 VAL CA C 12 61.000 61.000 62.109 -1.109 18131
349 1 5 . 1 1 12 12 VAL CB C 12 35.400 35.400 33.001 2.399 18131
350 1 5 . 1 1 13 13 HIS C C 13 172.900 172.900 174.359 -1.459 18131
351 1 5 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.231 -1.031 18131
352 1 5 . 1 1 13 13 HIS CB C 13 31.200 31.200 31.281 -0.081 18131
353 1 5 . 1 1 14 14 HIS C C 14 171.900 171.900 174.507 -2.607 18131
354 1 5 . 1 1 14 14 HIS CA C 14 53.700 53.700 55.700 -2.000 18131
355 1 5 . 1 1 14 14 HIS CB C 14 35.400 35.400 30.779 4.620 18131
356 1 5 . 1 1 15 15 GLN C C 15 173.400 173.400 174.384 -0.984 18131
357 1 5 . 1 1 15 15 GLN CA C 15 54.600 54.600 55.161 -0.561 18131
358 1 5 . 1 1 15 15 GLN CB C 15 33.700 33.700 30.986 2.713 18131
359 1 5 . 1 1 16 16 LYS C C 16 173.500 173.500 176.293 -2.793 18131
360 1 5 . 1 1 16 16 LYS CA C 16 54.300 54.300 56.067 -1.767 18131
361 1 5 . 1 1 16 16 LYS CB C 16 36.200 36.200 32.821 3.380 18131
362 1 5 . 1 1 17 17 LEU C C 17 174.700 174.700 175.945 -1.245 18131
363 1 5 . 1 1 17 17 LEU CA C 17 53.900 53.900 54.328 -0.428 18131
364 1 5 . 1 1 17 17 LEU CB C 17 44.900 44.900 43.012 1.888 18131
365 1 5 . 1 1 18 18 VAL C C 18 174.100 174.100 174.720 -0.620 18131
366 1 5 . 1 1 18 18 VAL CA C 18 60.600 60.600 61.828 -1.228 18131
367 1 5 . 1 1 18 18 VAL CB C 18 35.300 35.300 33.624 1.676 18131
368 1 5 . 1 1 19 19 PHE C C 19 172.700 172.700 175.028 -2.328 18131
369 1 5 . 1 1 19 19 PHE CA C 19 56.100 56.100 57.549 -1.449 18131
370 1 5 . 1 1 19 19 PHE CB C 19 42.200 42.200 41.026 1.174 18131
371 1 5 . 1 1 20 20 PHE C C 20 172.300 172.300 174.307 -2.007 18131
372 1 5 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.230 -1.230 18131
373 1 5 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.550 2.350 18131
374 1 5 . 1 1 21 21 ALA C C 21 175.100 175.100 176.432 -1.332 18131
375 1 5 . 1 1 21 21 ALA CA C 21 49.700 49.700 51.738 -2.038 18131
376 1 5 . 1 1 21 21 ALA CB C 21 22.100 22.100 19.733 2.367 18131
377 1 5 . 1 1 22 22 GLU C C 22 176.000 176.000 175.745 0.255 18131
378 1 5 . 1 1 22 22 GLU CA C 22 54.400 54.400 56.758 -2.358 18131
379 1 5 . 1 1 22 22 GLU CB C 22 33.900 33.900 31.927 1.974 18131
380 1 5 . 1 1 23 23 ASP C C 23 174.400 174.400 175.688 -1.288 18131
381 1 5 . 1 1 23 23 ASP CA C 23 56.500 56.500 54.581 1.919 18131
382 1 5 . 1 1 23 23 ASP CB C 23 39.100 39.100 40.543 -1.443 18131
383 1 5 . 1 1 24 24 VAL C C 24 176.800 176.800 176.545 0.255 18131
384 1 5 . 1 1 24 24 VAL CA C 24 60.100 60.100 61.174 -1.074 18131
385 1 5 . 1 1 24 24 VAL CB C 24 32.700 32.700 32.813 -0.113 18131
386 1 5 . 1 1 25 25 GLY C C 25 171.500 171.500 175.000 -3.500 18131
387 1 5 . 1 1 25 25 GLY CA C 25 46.500 46.500 46.214 0.286 18131
388 1 5 . 1 1 26 26 SER C C 26 173.800 173.800 173.773 0.027 18131
389 1 5 . 1 1 26 26 SER CA C 26 55.700 55.700 57.821 -2.121 18131
390 1 5 . 1 1 26 26 SER CB C 26 65.300 65.300 64.458 0.842 18131
391 1 5 . 1 1 27 27 ASN C C 27 174.300 174.300 176.057 -1.757 18131
392 1 5 . 1 1 27 27 ASN CA C 27 53.100 53.100 54.150 -1.050 18131
393 1 5 . 1 1 27 27 ASN CB C 27 40.800 40.800 39.202 1.598 18131
394 1 5 . 1 1 28 28 LYS C C 28 175.300 175.300 176.267 -0.967 18131
395 1 5 . 1 1 28 28 LYS CA C 28 55.500 55.500 56.388 -0.888 18131
396 1 5 . 1 1 28 28 LYS CB C 28 35.500 35.500 31.267 4.233 18131
397 1 5 . 1 1 29 29 GLY C C 29 171.700 171.700 174.454 -2.754 18131
398 1 5 . 1 1 29 29 GLY CA C 29 43.500 43.500 44.762 -1.262 18131
399 1 5 . 1 1 30 30 ALA C C 30 175.200 175.200 176.533 -1.333 18131
400 1 5 . 1 1 30 30 ALA CA C 30 49.800 49.800 51.876 -2.076 18131
401 1 5 . 1 1 30 30 ALA CB C 30 21.300 21.300 18.052 3.248 18131
402 1 5 . 1 1 31 31 ILE C C 31 173.600 173.600 175.421 -1.821 18131
403 1 5 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.973 -0.173 18131
404 1 5 . 1 1 31 31 ILE CB C 31 39.900 39.900 40.970 -1.070 18131
405 1 5 . 1 1 32 32 ILE C C 32 175.700 175.700 175.792 -0.092 18131
406 1 5 . 1 1 32 32 ILE CA C 32 57.200 57.200 60.944 -3.744 18131
407 1 5 . 1 1 32 32 ILE CB C 32 42.200 42.200 38.914 3.286 18131
408 1 5 . 1 1 33 33 GLY C C 33 171.700 171.700 173.429 -1.729 18131
409 1 5 . 1 1 33 33 GLY CA C 33 48.100 48.100 44.992 3.108 18131
410 1 5 . 1 1 34 34 LEU C C 34 173.200 173.200 176.053 -2.853 18131
411 1 5 . 1 1 34 34 LEU CA C 34 54.200 54.200 55.083 -0.883 18131
412 1 5 . 1 1 34 34 LEU CB C 34 45.800 45.800 44.708 1.092 18131
413 1 5 . 1 1 35 35 MET C C 35 172.900 172.900 175.746 -2.846 18131
414 1 5 . 1 1 35 35 MET CA C 35 54.100 54.100 54.524 -0.424 18131
415 1 5 . 1 1 35 35 MET CB C 35 36.400 36.400 32.122 4.278 18131
416 1 5 . 1 1 36 36 VAL C C 36 175.400 175.400 176.778 -1.378 18131
417 1 5 . 1 1 36 36 VAL CA C 36 58.900 58.900 61.999 -3.099 18131
418 1 5 . 1 1 36 36 VAL CB C 36 35.100 35.100 32.438 2.662 18131
419 1 5 . 1 1 37 37 GLY C C 37 172.300 172.300 175.377 -3.077 18131
420 1 5 . 1 1 37 37 GLY CA C 37 48.300 48.300 45.351 2.949 18131
421 1 5 . 1 1 38 38 GLY C C 38 171.300 171.300 175.015 -3.715 18131
422 1 5 . 1 1 38 38 GLY CA C 38 44.100 44.100 44.913 -0.813 18131
423 1 5 . 1 1 39 39 VAL C C 39 173.500 173.500 177.319 -3.819 18131
424 1 5 . 1 1 39 39 VAL CA C 39 60.600 60.600 61.414 -0.814 18131
425 1 5 . 1 1 39 39 VAL CB C 39 34.100 34.100 31.825 2.275 18131
426 1 6 . 1 1 10 10 TYR C C 10 173.700 173.700 174.958 -1.258 18131
427 1 6 . 1 1 10 10 TYR CA C 10 54.200 54.200 57.784 -3.584 18131
428 1 6 . 1 1 10 10 TYR CB C 10 37.700 37.700 39.138 -1.438 18131
429 1 6 . 1 1 11 11 GLU C C 11 173.200 173.200 174.490 -1.290 18131
430 1 6 . 1 1 11 11 GLU CA C 11 54.500 54.500 55.349 -0.849 18131
431 1 6 . 1 1 11 11 GLU CB C 11 31.400 31.400 32.395 -0.995 18131
432 1 6 . 1 1 12 12 VAL C C 12 174.100 174.100 175.517 -1.417 18131
433 1 6 . 1 1 12 12 VAL CA C 12 61.000 61.000 61.877 -0.877 18131
434 1 6 . 1 1 12 12 VAL CB C 12 35.400 35.400 33.000 2.400 18131
435 1 6 . 1 1 13 13 HIS C C 13 172.900 172.900 174.839 -1.939 18131
436 1 6 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.650 -1.450 18131
437 1 6 . 1 1 13 13 HIS CB C 13 31.200 31.200 30.877 0.323 18131
438 1 6 . 1 1 14 14 HIS C C 14 171.900 171.900 174.596 -2.696 18131
439 1 6 . 1 1 14 14 HIS CA C 14 53.700 53.700 55.463 -1.763 18131
440 1 6 . 1 1 14 14 HIS CB C 14 35.400 35.400 30.636 4.764 18131
441 1 6 . 1 1 15 15 GLN C C 15 173.400 173.400 174.298 -0.898 18131
442 1 6 . 1 1 15 15 GLN CA C 15 54.600 54.600 54.849 -0.249 18131
443 1 6 . 1 1 15 15 GLN CB C 15 33.700 33.700 31.359 2.341 18131
444 1 6 . 1 1 16 16 LYS C C 16 173.500 173.500 175.807 -2.307 18131
445 1 6 . 1 1 16 16 LYS CA C 16 54.300 54.300 56.175 -1.875 18131
446 1 6 . 1 1 16 16 LYS CB C 16 36.200 36.200 32.947 3.252 18131
447 1 6 . 1 1 17 17 LEU C C 17 174.700 174.700 176.063 -1.363 18131
448 1 6 . 1 1 17 17 LEU CA C 17 53.900 53.900 54.550 -0.650 18131
449 1 6 . 1 1 17 17 LEU CB C 17 44.900 44.900 42.792 2.108 18131
450 1 6 . 1 1 18 18 VAL C C 18 174.100 174.100 175.152 -1.052 18131
451 1 6 . 1 1 18 18 VAL CA C 18 60.600 60.600 62.074 -1.474 18131
452 1 6 . 1 1 18 18 VAL CB C 18 35.300 35.300 33.458 1.842 18131
453 1 6 . 1 1 19 19 PHE C C 19 172.700 172.700 174.505 -1.805 18131
454 1 6 . 1 1 19 19 PHE CA C 19 56.100 56.100 57.953 -1.853 18131
455 1 6 . 1 1 19 19 PHE CB C 19 42.200 42.200 41.261 0.939 18131
456 1 6 . 1 1 20 20 PHE C C 20 172.300 172.300 173.362 -1.062 18131
457 1 6 . 1 1 20 20 PHE CA C 20 56.000 56.000 56.660 -0.660 18131
458 1 6 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.284 2.616 18131
459 1 6 . 1 1 21 21 ALA C C 21 175.100 175.100 176.307 -1.207 18131
460 1 6 . 1 1 21 21 ALA CA C 21 49.700 49.700 51.727 -2.027 18131
461 1 6 . 1 1 21 21 ALA CB C 21 22.100 22.100 19.712 2.388 18131
462 1 6 . 1 1 22 22 GLU C C 22 176.000 176.000 174.791 1.209 18131
463 1 6 . 1 1 22 22 GLU CA C 22 54.400 54.400 55.824 -1.424 18131
464 1 6 . 1 1 22 22 GLU CB C 22 33.900 33.900 32.703 1.198 18131
465 1 6 . 1 1 23 23 ASP C C 23 174.400 174.400 175.280 -0.880 18131
466 1 6 . 1 1 23 23 ASP CA C 23 56.500 56.500 54.733 1.767 18131
467 1 6 . 1 1 23 23 ASP CB C 23 39.100 39.100 39.648 -0.548 18131
468 1 6 . 1 1 24 24 VAL C C 24 176.800 176.800 176.842 -0.042 18131
469 1 6 . 1 1 24 24 VAL CA C 24 60.100 60.100 61.933 -1.833 18131
470 1 6 . 1 1 24 24 VAL CB C 24 32.700 32.700 32.551 0.149 18131
471 1 6 . 1 1 25 25 GLY C C 25 171.500 171.500 174.335 -2.835 18131
472 1 6 . 1 1 25 25 GLY CA C 25 46.500 46.500 45.675 0.825 18131
473 1 6 . 1 1 26 26 SER C C 26 173.800 173.800 173.399 0.401 18131
474 1 6 . 1 1 26 26 SER CA C 26 55.700 55.700 57.247 -1.547 18131
475 1 6 . 1 1 26 26 SER CB C 26 65.300 65.300 63.999 1.301 18131
476 1 6 . 1 1 27 27 ASN C C 27 174.300 174.300 174.831 -0.531 18131
477 1 6 . 1 1 27 27 ASN CA C 27 53.100 53.100 54.167 -1.067 18131
478 1 6 . 1 1 27 27 ASN CB C 27 40.800 40.800 39.015 1.785 18131
479 1 6 . 1 1 28 28 LYS C C 28 175.300 175.300 176.345 -1.045 18131
480 1 6 . 1 1 28 28 LYS CA C 28 55.500 55.500 56.246 -0.746 18131
481 1 6 . 1 1 28 28 LYS CB C 28 35.500 35.500 34.181 1.319 18131
482 1 6 . 1 1 29 29 GLY C C 29 171.700 171.700 173.440 -1.740 18131
483 1 6 . 1 1 29 29 GLY CA C 29 43.500 43.500 45.985 -2.485 18131
484 1 6 . 1 1 30 30 ALA C C 30 175.200 175.200 176.268 -1.068 18131
485 1 6 . 1 1 30 30 ALA CA C 30 49.800 49.800 52.629 -2.829 18131
486 1 6 . 1 1 30 30 ALA CB C 30 21.300 21.300 19.934 1.366 18131
487 1 6 . 1 1 31 31 ILE C C 31 173.600 173.600 175.109 -1.509 18131
488 1 6 . 1 1 31 31 ILE CA C 31 60.800 60.800 61.498 -0.698 18131
489 1 6 . 1 1 31 31 ILE CB C 31 39.900 39.900 39.883 0.017 18131
490 1 6 . 1 1 32 32 ILE C C 32 175.700 175.700 176.129 -0.429 18131
491 1 6 . 1 1 32 32 ILE CA C 32 57.200 57.200 61.028 -3.828 18131
492 1 6 . 1 1 32 32 ILE CB C 32 42.200 42.200 38.479 3.721 18131
493 1 6 . 1 1 33 33 GLY C C 33 171.700 171.700 173.606 -1.906 18131
494 1 6 . 1 1 33 33 GLY CA C 33 48.100 48.100 44.932 3.168 18131
495 1 6 . 1 1 34 34 LEU C C 34 173.200 173.200 176.224 -3.024 18131
496 1 6 . 1 1 34 34 LEU CA C 34 54.200 54.200 54.213 -0.013 18131
497 1 6 . 1 1 34 34 LEU CB C 34 45.800 45.800 44.793 1.007 18131
498 1 6 . 1 1 35 35 MET C C 35 172.900 172.900 174.742 -1.842 18131
499 1 6 . 1 1 35 35 MET CA C 35 54.100 54.100 54.923 -0.823 18131
500 1 6 . 1 1 35 35 MET CB C 35 36.400 36.400 32.616 3.784 18131
501 1 6 . 1 1 36 36 VAL C C 36 175.400 175.400 176.738 -1.338 18131
502 1 6 . 1 1 36 36 VAL CA C 36 58.900 58.900 61.826 -2.926 18131
503 1 6 . 1 1 36 36 VAL CB C 36 35.100 35.100 32.425 2.675 18131
504 1 6 . 1 1 37 37 GLY C C 37 172.300 172.300 174.762 -2.462 18131
505 1 6 . 1 1 37 37 GLY CA C 37 48.300 48.300 44.604 3.696 18131
506 1 6 . 1 1 38 38 GLY C C 38 171.300 171.300 175.024 -3.724 18131
507 1 6 . 1 1 38 38 GLY CA C 38 44.100 44.100 46.075 -1.975 18131
508 1 6 . 1 1 39 39 VAL C C 39 173.500 173.500 176.696 -3.196 18131
509 1 6 . 1 1 39 39 VAL CA C 39 60.600 60.600 61.192 -0.592 18131
510 1 6 . 1 1 39 39 VAL CB C 39 34.100 34.100 33.528 0.572 18131
511 1 7 . 1 1 10 10 TYR C C 10 173.700 173.700 175.122 -1.422 18131
512 1 7 . 1 1 10 10 TYR CA C 10 54.200 54.200 57.323 -3.123 18131
513 1 7 . 1 1 10 10 TYR CB C 10 37.700 37.700 39.803 -2.103 18131
514 1 7 . 1 1 11 11 GLU C C 11 173.200 173.200 175.891 -2.691 18131
515 1 7 . 1 1 11 11 GLU CA C 11 54.500 54.500 56.125 -1.625 18131
516 1 7 . 1 1 11 11 GLU CB C 11 31.400 31.400 30.466 0.934 18131
517 1 7 . 1 1 12 12 VAL C C 12 174.100 174.100 175.273 -1.173 18131
518 1 7 . 1 1 12 12 VAL CA C 12 61.000 61.000 61.785 -0.785 18131
519 1 7 . 1 1 12 12 VAL CB C 12 35.400 35.400 32.858 2.542 18131
520 1 7 . 1 1 13 13 HIS C C 13 172.900 172.900 174.217 -1.317 18131
521 1 7 . 1 1 13 13 HIS CA C 13 54.200 54.200 56.229 -2.029 18131
522 1 7 . 1 1 13 13 HIS CB C 13 31.200 31.200 32.035 -0.835 18131
523 1 7 . 1 1 14 14 HIS C C 14 171.900 171.900 173.721 -1.821 18131
524 1 7 . 1 1 14 14 HIS CA C 14 53.700 53.700 55.773 -2.074 18131
525 1 7 . 1 1 14 14 HIS CB C 14 35.400 35.400 30.358 5.042 18131
526 1 7 . 1 1 15 15 GLN C C 15 173.400 173.400 173.601 -0.201 18131
527 1 7 . 1 1 15 15 GLN CA C 15 54.600 54.600 54.541 0.059 18131
528 1 7 . 1 1 15 15 GLN CB C 15 33.700 33.700 32.367 1.333 18131
529 1 7 . 1 1 16 16 LYS C C 16 173.500 173.500 175.882 -2.382 18131
530 1 7 . 1 1 16 16 LYS CA C 16 54.300 54.300 56.361 -2.061 18131
531 1 7 . 1 1 16 16 LYS CB C 16 36.200 36.200 32.938 3.262 18131
532 1 7 . 1 1 17 17 LEU C C 17 174.700 174.700 176.260 -1.560 18131
533 1 7 . 1 1 17 17 LEU CA C 17 53.900 53.900 54.355 -0.455 18131
534 1 7 . 1 1 17 17 LEU CB C 17 44.900 44.900 42.994 1.906 18131
535 1 7 . 1 1 18 18 VAL C C 18 174.100 174.100 175.127 -1.027 18131
536 1 7 . 1 1 18 18 VAL CA C 18 60.600 60.600 62.045 -1.445 18131
537 1 7 . 1 1 18 18 VAL CB C 18 35.300 35.300 33.442 1.858 18131
538 1 7 . 1 1 19 19 PHE C C 19 172.700 172.700 174.445 -1.745 18131
539 1 7 . 1 1 19 19 PHE CA C 19 56.100 56.100 57.959 -1.859 18131
540 1 7 . 1 1 19 19 PHE CB C 19 42.200 42.200 41.763 0.437 18131
541 1 7 . 1 1 20 20 PHE C C 20 172.300 172.300 173.699 -1.399 18131
542 1 7 . 1 1 20 20 PHE CA C 20 56.000 56.000 56.660 -0.660 18131
543 1 7 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.690 2.211 18131
544 1 7 . 1 1 21 21 ALA C C 21 175.100 175.100 176.586 -1.486 18131
545 1 7 . 1 1 21 21 ALA CA C 21 49.700 49.700 51.607 -1.907 18131
546 1 7 . 1 1 21 21 ALA CB C 21 22.100 22.100 19.842 2.258 18131
547 1 7 . 1 1 22 22 GLU C C 22 176.000 176.000 175.275 0.725 18131
548 1 7 . 1 1 22 22 GLU CA C 22 54.400 54.400 56.190 -1.790 18131
549 1 7 . 1 1 22 22 GLU CB C 22 33.900 33.900 31.607 2.293 18131
550 1 7 . 1 1 23 23 ASP C C 23 174.400 174.400 175.665 -1.265 18131
551 1 7 . 1 1 23 23 ASP CA C 23 56.500 56.500 55.010 1.490 18131
552 1 7 . 1 1 23 23 ASP CB C 23 39.100 39.100 40.029 -0.929 18131
553 1 7 . 1 1 24 24 VAL C C 24 176.800 176.800 176.902 -0.102 18131
554 1 7 . 1 1 24 24 VAL CA C 24 60.100 60.100 62.499 -2.399 18131
555 1 7 . 1 1 24 24 VAL CB C 24 32.700 32.700 32.369 0.331 18131
556 1 7 . 1 1 25 25 GLY C C 25 171.500 171.500 173.499 -1.999 18131
557 1 7 . 1 1 25 25 GLY CA C 25 46.500 46.500 45.480 1.020 18131
558 1 7 . 1 1 26 26 SER C C 26 173.800 173.800 173.296 0.504 18131
559 1 7 . 1 1 26 26 SER CA C 26 55.700 55.700 57.493 -1.793 18131
560 1 7 . 1 1 26 26 SER CB C 26 65.300 65.300 63.603 1.697 18131
561 1 7 . 1 1 27 27 ASN C C 27 174.300 174.300 174.951 -0.651 18131
562 1 7 . 1 1 27 27 ASN CA C 27 53.100 53.100 54.310 -1.210 18131
563 1 7 . 1 1 27 27 ASN CB C 27 40.800 40.800 38.757 2.043 18131
564 1 7 . 1 1 28 28 LYS C C 28 175.300 175.300 177.788 -2.488 18131
565 1 7 . 1 1 28 28 LYS CA C 28 55.500 55.500 56.850 -1.350 18131
566 1 7 . 1 1 28 28 LYS CB C 28 35.500 35.500 33.045 2.455 18131
567 1 7 . 1 1 29 29 GLY C C 29 171.700 171.700 174.118 -2.418 18131
568 1 7 . 1 1 29 29 GLY CA C 29 43.500 43.500 45.011 -1.511 18131
569 1 7 . 1 1 30 30 ALA C C 30 175.200 175.200 175.563 -0.363 18131
570 1 7 . 1 1 30 30 ALA CA C 30 49.800 49.800 51.955 -2.155 18131
571 1 7 . 1 1 30 30 ALA CB C 30 21.300 21.300 19.715 1.585 18131
572 1 7 . 1 1 31 31 ILE C C 31 173.600 173.600 174.807 -1.207 18131
573 1 7 . 1 1 31 31 ILE CA C 31 60.800 60.800 61.478 -0.678 18131
574 1 7 . 1 1 31 31 ILE CB C 31 39.900 39.900 39.284 0.616 18131
575 1 7 . 1 1 32 32 ILE C C 32 175.700 175.700 175.958 -0.258 18131
576 1 7 . 1 1 32 32 ILE CA C 32 57.200 57.200 60.976 -3.776 18131
577 1 7 . 1 1 32 32 ILE CB C 32 42.200 42.200 38.652 3.548 18131
578 1 7 . 1 1 33 33 GLY C C 33 171.700 171.700 173.472 -1.772 18131
579 1 7 . 1 1 33 33 GLY CA C 33 48.100 48.100 45.163 2.937 18131
580 1 7 . 1 1 34 34 LEU C C 34 173.200 173.200 176.036 -2.836 18131
581 1 7 . 1 1 34 34 LEU CA C 34 54.200 54.200 53.974 0.226 18131
582 1 7 . 1 1 34 34 LEU CB C 34 45.800 45.800 44.915 0.885 18131
583 1 7 . 1 1 35 35 MET C C 35 172.900 172.900 175.064 -2.164 18131
584 1 7 . 1 1 35 35 MET CA C 35 54.100 54.100 55.043 -0.943 18131
585 1 7 . 1 1 35 35 MET CB C 35 36.400 36.400 33.383 3.017 18131
586 1 7 . 1 1 36 36 VAL C C 36 175.400 175.400 175.776 -0.376 18131
587 1 7 . 1 1 36 36 VAL CA C 36 58.900 58.900 62.090 -3.190 18131
588 1 7 . 1 1 36 36 VAL CB C 36 35.100 35.100 32.069 3.031 18131
589 1 7 . 1 1 37 37 GLY C C 37 172.300 172.300 174.780 -2.480 18131
590 1 7 . 1 1 37 37 GLY CA C 37 48.300 48.300 44.956 3.344 18131
591 1 7 . 1 1 38 38 GLY C C 38 171.300 171.300 174.306 -3.006 18131
592 1 7 . 1 1 38 38 GLY CA C 38 44.100 44.100 45.653 -1.553 18131
593 1 7 . 1 1 39 39 VAL C C 39 173.500 173.500 176.346 -2.846 18131
594 1 7 . 1 1 39 39 VAL CA C 39 60.600 60.600 60.497 0.103 18131
595 1 7 . 1 1 39 39 VAL CB C 39 34.100 34.100 33.778 0.322 18131
596 1 8 . 1 1 10 10 TYR C C 10 173.700 173.700 175.160 -1.460 18131
597 1 8 . 1 1 10 10 TYR CA C 10 54.200 54.200 57.566 -3.366 18131
598 1 8 . 1 1 10 10 TYR CB C 10 37.700 37.700 39.663 -1.963 18131
599 1 8 . 1 1 11 11 GLU C C 11 173.200 173.200 175.112 -1.912 18131
600 1 8 . 1 1 11 11 GLU CA C 11 54.500 54.500 55.998 -1.498 18131
601 1 8 . 1 1 11 11 GLU CB C 11 31.400 31.400 31.339 0.061 18131
602 1 8 . 1 1 12 12 VAL C C 12 174.100 174.100 174.644 -0.544 18131
603 1 8 . 1 1 12 12 VAL CA C 12 61.000 61.000 60.535 0.465 18131
604 1 8 . 1 1 12 12 VAL CB C 12 35.400 35.400 33.460 1.940 18131
605 1 8 . 1 1 13 13 HIS C C 13 172.900 172.900 173.843 -0.943 18131
606 1 8 . 1 1 13 13 HIS CA C 13 54.200 54.200 56.397 -2.197 18131
607 1 8 . 1 1 13 13 HIS CB C 13 31.200 31.200 31.395 -0.195 18131
608 1 8 . 1 1 14 14 HIS C C 14 171.900 171.900 173.714 -1.814 18131
609 1 8 . 1 1 14 14 HIS CA C 14 53.700 53.700 56.008 -2.308 18131
610 1 8 . 1 1 14 14 HIS CB C 14 35.400 35.400 31.223 4.177 18131
611 1 8 . 1 1 15 15 GLN C C 15 173.400 173.400 173.752 -0.352 18131
612 1 8 . 1 1 15 15 GLN CA C 15 54.600 54.600 55.131 -0.531 18131
613 1 8 . 1 1 15 15 GLN CB C 15 33.700 33.700 31.502 2.198 18131
614 1 8 . 1 1 16 16 LYS C C 16 173.500 173.500 176.260 -2.760 18131
615 1 8 . 1 1 16 16 LYS CA C 16 54.300 54.300 56.039 -1.739 18131
616 1 8 . 1 1 16 16 LYS CB C 16 36.200 36.200 32.746 3.454 18131
617 1 8 . 1 1 17 17 LEU C C 17 174.700 174.700 175.720 -1.020 18131
618 1 8 . 1 1 17 17 LEU CA C 17 53.900 53.900 54.184 -0.284 18131
619 1 8 . 1 1 17 17 LEU CB C 17 44.900 44.900 43.166 1.734 18131
620 1 8 . 1 1 18 18 VAL C C 18 174.100 174.100 174.195 -0.095 18131
621 1 8 . 1 1 18 18 VAL CA C 18 60.600 60.600 61.532 -0.932 18131
622 1 8 . 1 1 18 18 VAL CB C 18 35.300 35.300 33.757 1.543 18131
623 1 8 . 1 1 19 19 PHE C C 19 172.700 172.700 174.822 -2.122 18131
624 1 8 . 1 1 19 19 PHE CA C 19 56.100 56.100 57.613 -1.513 18131
625 1 8 . 1 1 19 19 PHE CB C 19 42.200 42.200 41.479 0.721 18131
626 1 8 . 1 1 20 20 PHE C C 20 172.300 172.300 174.485 -2.185 18131
627 1 8 . 1 1 20 20 PHE CA C 20 56.000 56.000 56.940 -0.939 18131
628 1 8 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.303 2.596 18131
629 1 8 . 1 1 21 21 ALA C C 21 175.100 175.100 176.335 -1.235 18131
630 1 8 . 1 1 21 21 ALA CA C 21 49.700 49.700 51.731 -2.031 18131
631 1 8 . 1 1 21 21 ALA CB C 21 22.100 22.100 20.169 1.931 18131
632 1 8 . 1 1 22 22 GLU C C 22 176.000 176.000 175.506 0.494 18131
633 1 8 . 1 1 22 22 GLU CA C 22 54.400 54.400 55.587 -1.187 18131
634 1 8 . 1 1 22 22 GLU CB C 22 33.900 33.900 30.996 2.904 18131
635 1 8 . 1 1 23 23 ASP C C 23 174.400 174.400 175.640 -1.240 18131
636 1 8 . 1 1 23 23 ASP CA C 23 56.500 56.500 54.511 1.989 18131
637 1 8 . 1 1 23 23 ASP CB C 23 39.100 39.100 38.758 0.342 18131
638 1 8 . 1 1 24 24 VAL C C 24 176.800 176.800 176.441 0.359 18131
639 1 8 . 1 1 24 24 VAL CA C 24 60.100 60.100 61.888 -1.788 18131
640 1 8 . 1 1 24 24 VAL CB C 24 32.700 32.700 32.894 -0.194 18131
641 1 8 . 1 1 25 25 GLY C C 25 171.500 171.500 174.109 -2.609 18131
642 1 8 . 1 1 25 25 GLY CA C 25 46.500 46.500 45.363 1.137 18131
643 1 8 . 1 1 26 26 SER C C 26 173.800 173.800 174.084 -0.284 18131
644 1 8 . 1 1 26 26 SER CA C 26 55.700 55.700 57.514 -1.814 18131
645 1 8 . 1 1 26 26 SER CB C 26 65.300 65.300 63.556 1.744 18131
646 1 8 . 1 1 27 27 ASN C C 27 174.300 174.300 175.947 -1.647 18131
647 1 8 . 1 1 27 27 ASN CA C 27 53.100 53.100 52.400 0.700 18131
648 1 8 . 1 1 27 27 ASN CB C 27 40.800 40.800 38.954 1.846 18131
649 1 8 . 1 1 28 28 LYS C C 28 175.300 175.300 177.329 -2.029 18131
650 1 8 . 1 1 28 28 LYS CA C 28 55.500 55.500 57.704 -2.204 18131
651 1 8 . 1 1 28 28 LYS CB C 28 35.500 35.500 32.349 3.151 18131
652 1 8 . 1 1 29 29 GLY C C 29 171.700 171.700 172.879 -1.179 18131
653 1 8 . 1 1 29 29 GLY CA C 29 43.500 43.500 44.171 -0.671 18131
654 1 8 . 1 1 30 30 ALA C C 30 175.200 175.200 176.653 -1.453 18131
655 1 8 . 1 1 30 30 ALA CA C 30 49.800 49.800 51.430 -1.630 18131
656 1 8 . 1 1 30 30 ALA CB C 30 21.300 21.300 20.730 0.570 18131
657 1 8 . 1 1 31 31 ILE C C 31 173.600 173.600 175.482 -1.882 18131
658 1 8 . 1 1 31 31 ILE CA C 31 60.800 60.800 61.061 -0.261 18131
659 1 8 . 1 1 31 31 ILE CB C 31 39.900 39.900 39.856 0.044 18131
660 1 8 . 1 1 32 32 ILE C C 32 175.700 175.700 176.220 -0.520 18131
661 1 8 . 1 1 32 32 ILE CA C 32 57.200 57.200 61.054 -3.854 18131
662 1 8 . 1 1 32 32 ILE CB C 32 42.200 42.200 38.198 4.002 18131
663 1 8 . 1 1 33 33 GLY C C 33 171.700 171.700 173.455 -1.755 18131
664 1 8 . 1 1 33 33 GLY CA C 33 48.100 48.100 44.831 3.269 18131
665 1 8 . 1 1 34 34 LEU C C 34 173.200 173.200 175.939 -2.739 18131
666 1 8 . 1 1 34 34 LEU CA C 34 54.200 54.200 54.767 -0.567 18131
667 1 8 . 1 1 34 34 LEU CB C 34 45.800 45.800 45.108 0.692 18131
668 1 8 . 1 1 35 35 MET C C 35 172.900 172.900 175.159 -2.259 18131
669 1 8 . 1 1 35 35 MET CA C 35 54.100 54.100 54.867 -0.768 18131
670 1 8 . 1 1 35 35 MET CB C 35 36.400 36.400 33.139 3.261 18131
671 1 8 . 1 1 36 36 VAL C C 36 175.400 175.400 175.887 -0.487 18131
672 1 8 . 1 1 36 36 VAL CA C 36 58.900 58.900 61.820 -2.920 18131
673 1 8 . 1 1 36 36 VAL CB C 36 35.100 35.100 31.895 3.205 18131
674 1 8 . 1 1 37 37 GLY C C 37 172.300 172.300 174.683 -2.383 18131
675 1 8 . 1 1 37 37 GLY CA C 37 48.300 48.300 44.603 3.697 18131
676 1 8 . 1 1 38 38 GLY C C 38 171.300 171.300 174.890 -3.590 18131
677 1 8 . 1 1 38 38 GLY CA C 38 44.100 44.100 45.756 -1.656 18131
678 1 8 . 1 1 39 39 VAL C C 39 173.500 173.500 177.053 -3.553 18131
679 1 8 . 1 1 39 39 VAL CA C 39 60.600 60.600 60.994 -0.394 18131
680 1 8 . 1 1 39 39 VAL CB C 39 34.100 34.100 33.211 0.889 18131
681 1 9 . 1 1 10 10 TYR C C 10 173.700 173.700 175.327 -1.627 18131
682 1 9 . 1 1 10 10 TYR CA C 10 54.200 54.200 57.489 -3.289 18131
683 1 9 . 1 1 10 10 TYR CB C 10 37.700 37.700 40.001 -2.301 18131
684 1 9 . 1 1 11 11 GLU C C 11 173.200 173.200 175.334 -2.134 18131
685 1 9 . 1 1 11 11 GLU CA C 11 54.500 54.500 56.119 -1.619 18131
686 1 9 . 1 1 11 11 GLU CB C 11 31.400 31.400 31.584 -0.183 18131
687 1 9 . 1 1 12 12 VAL C C 12 174.100 174.100 175.193 -1.093 18131
688 1 9 . 1 1 12 12 VAL CA C 12 61.000 61.000 61.551 -0.551 18131
689 1 9 . 1 1 12 12 VAL CB C 12 35.400 35.400 33.884 1.516 18131
690 1 9 . 1 1 13 13 HIS C C 13 172.900 172.900 174.201 -1.301 18131
691 1 9 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.261 -1.061 18131
692 1 9 . 1 1 13 13 HIS CB C 13 31.200 31.200 30.634 0.566 18131
693 1 9 . 1 1 14 14 HIS C C 14 171.900 171.900 174.519 -2.619 18131
694 1 9 . 1 1 14 14 HIS CA C 14 53.700 53.700 55.094 -1.394 18131
695 1 9 . 1 1 14 14 HIS CB C 14 35.400 35.400 31.663 3.737 18131
696 1 9 . 1 1 15 15 GLN C C 15 173.400 173.400 174.738 -1.338 18131
697 1 9 . 1 1 15 15 GLN CA C 15 54.600 54.600 54.959 -0.359 18131
698 1 9 . 1 1 15 15 GLN CB C 15 33.700 33.700 30.899 2.801 18131
699 1 9 . 1 1 16 16 LYS C C 16 173.500 173.500 175.832 -2.332 18131
700 1 9 . 1 1 16 16 LYS CA C 16 54.300 54.300 55.825 -1.525 18131
701 1 9 . 1 1 16 16 LYS CB C 16 36.200 36.200 32.979 3.221 18131
702 1 9 . 1 1 17 17 LEU C C 17 174.700 174.700 175.763 -1.063 18131
703 1 9 . 1 1 17 17 LEU CA C 17 53.900 53.900 54.228 -0.328 18131
704 1 9 . 1 1 17 17 LEU CB C 17 44.900 44.900 42.936 1.964 18131
705 1 9 . 1 1 18 18 VAL C C 18 174.100 174.100 174.698 -0.598 18131
706 1 9 . 1 1 18 18 VAL CA C 18 60.600 60.600 61.958 -1.357 18131
707 1 9 . 1 1 18 18 VAL CB C 18 35.300 35.300 34.063 1.237 18131
708 1 9 . 1 1 19 19 PHE C C 19 172.700 172.700 175.051 -2.351 18131
709 1 9 . 1 1 19 19 PHE CA C 19 56.100 56.100 57.690 -1.590 18131
710 1 9 . 1 1 19 19 PHE CB C 19 42.200 42.200 40.778 1.422 18131
711 1 9 . 1 1 20 20 PHE C C 20 172.300 172.300 174.255 -1.955 18131
712 1 9 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.907 -1.907 18131
713 1 9 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.940 1.960 18131
714 1 9 . 1 1 21 21 ALA C C 21 175.100 175.100 175.328 -0.228 18131
715 1 9 . 1 1 21 21 ALA CA C 21 49.700 49.700 51.442 -1.742 18131
716 1 9 . 1 1 21 21 ALA CB C 21 22.100 22.100 20.225 1.875 18131
717 1 9 . 1 1 22 22 GLU C C 22 176.000 176.000 175.737 0.263 18131
718 1 9 . 1 1 22 22 GLU CA C 22 54.400 54.400 56.518 -2.118 18131
719 1 9 . 1 1 22 22 GLU CB C 22 33.900 33.900 31.954 1.946 18131
720 1 9 . 1 1 23 23 ASP C C 23 174.400 174.400 175.851 -1.451 18131
721 1 9 . 1 1 23 23 ASP CA C 23 56.500 56.500 54.679 1.821 18131
722 1 9 . 1 1 23 23 ASP CB C 23 39.100 39.100 40.368 -1.268 18131
723 1 9 . 1 1 24 24 VAL C C 24 176.800 176.800 176.636 0.164 18131
724 1 9 . 1 1 24 24 VAL CA C 24 60.100 60.100 61.135 -1.035 18131
725 1 9 . 1 1 24 24 VAL CB C 24 32.700 32.700 33.002 -0.302 18131
726 1 9 . 1 1 25 25 GLY C C 25 171.500 171.500 174.769 -3.269 18131
727 1 9 . 1 1 25 25 GLY CA C 25 46.500 46.500 46.342 0.158 18131
728 1 9 . 1 1 26 26 SER C C 26 173.800 173.800 173.543 0.257 18131
729 1 9 . 1 1 26 26 SER CA C 26 55.700 55.700 57.666 -1.966 18131
730 1 9 . 1 1 26 26 SER CB C 26 65.300 65.300 64.495 0.805 18131
731 1 9 . 1 1 27 27 ASN C C 27 174.300 174.300 175.951 -1.651 18131
732 1 9 . 1 1 27 27 ASN CA C 27 53.100 53.100 54.007 -0.907 18131
733 1 9 . 1 1 27 27 ASN CB C 27 40.800 40.800 39.101 1.699 18131
734 1 9 . 1 1 28 28 LYS C C 28 175.300 175.300 175.860 -0.560 18131
735 1 9 . 1 1 28 28 LYS CA C 28 55.500 55.500 56.759 -1.259 18131
736 1 9 . 1 1 28 28 LYS CB C 28 35.500 35.500 31.110 4.390 18131
737 1 9 . 1 1 29 29 GLY C C 29 171.700 171.700 174.391 -2.691 18131
738 1 9 . 1 1 29 29 GLY CA C 29 43.500 43.500 44.555 -1.055 18131
739 1 9 . 1 1 30 30 ALA C C 30 175.200 175.200 176.620 -1.420 18131
740 1 9 . 1 1 30 30 ALA CA C 30 49.800 49.800 51.939 -2.139 18131
741 1 9 . 1 1 30 30 ALA CB C 30 21.300 21.300 17.650 3.650 18131
742 1 9 . 1 1 31 31 ILE C C 31 173.600 173.600 175.153 -1.553 18131
743 1 9 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.673 0.126 18131
744 1 9 . 1 1 31 31 ILE CB C 31 39.900 39.900 41.406 -1.506 18131
745 1 9 . 1 1 32 32 ILE C C 32 175.700 175.700 175.779 -0.079 18131
746 1 9 . 1 1 32 32 ILE CA C 32 57.200 57.200 60.947 -3.747 18131
747 1 9 . 1 1 32 32 ILE CB C 32 42.200 42.200 38.174 4.026 18131
748 1 9 . 1 1 33 33 GLY C C 33 171.700 171.700 173.559 -1.859 18131
749 1 9 . 1 1 33 33 GLY CA C 33 48.100 48.100 44.971 3.129 18131
750 1 9 . 1 1 34 34 LEU C C 34 173.200 173.200 176.466 -3.266 18131
751 1 9 . 1 1 34 34 LEU CA C 34 54.200 54.200 54.114 0.086 18131
752 1 9 . 1 1 34 34 LEU CB C 34 45.800 45.800 44.871 0.929 18131
753 1 9 . 1 1 35 35 MET C C 35 172.900 172.900 175.223 -2.323 18131
754 1 9 . 1 1 35 35 MET CA C 35 54.100 54.100 54.411 -0.312 18131
755 1 9 . 1 1 35 35 MET CB C 35 36.400 36.400 32.304 4.096 18131
756 1 9 . 1 1 36 36 VAL C C 36 175.400 175.400 176.330 -0.930 18131
757 1 9 . 1 1 36 36 VAL CA C 36 58.900 58.900 62.711 -3.811 18131
758 1 9 . 1 1 36 36 VAL CB C 36 35.100 35.100 31.765 3.335 18131
759 1 9 . 1 1 37 37 GLY C C 37 172.300 172.300 174.715 -2.415 18131
760 1 9 . 1 1 37 37 GLY CA C 37 48.300 48.300 45.202 3.098 18131
761 1 9 . 1 1 38 38 GLY C C 38 171.300 171.300 174.006 -2.706 18131
762 1 9 . 1 1 38 38 GLY CA C 38 44.100 44.100 45.139 -1.039 18131
763 1 9 . 1 1 39 39 VAL C C 39 173.500 173.500 176.298 -2.798 18131
764 1 9 . 1 1 39 39 VAL CA C 39 60.600 60.600 61.045 -0.445 18131
765 1 9 . 1 1 39 39 VAL CB C 39 34.100 34.100 33.875 0.225 18131
766 1 10 . 1 1 10 10 TYR C C 10 173.700 173.700 175.912 -2.212 18131
767 1 10 . 1 1 10 10 TYR CA C 10 54.200 54.200 57.698 -3.498 18131
768 1 10 . 1 1 10 10 TYR CB C 10 37.700 37.700 39.458 -1.758 18131
769 1 10 . 1 1 11 11 GLU C C 11 173.200 173.200 175.104 -1.904 18131
770 1 10 . 1 1 11 11 GLU CA C 11 54.500 54.500 56.200 -1.700 18131
771 1 10 . 1 1 11 11 GLU CB C 11 31.400 31.400 31.652 -0.252 18131
772 1 10 . 1 1 12 12 VAL C C 12 174.100 174.100 174.356 -0.256 18131
773 1 10 . 1 1 12 12 VAL CA C 12 61.000 61.000 62.350 -1.350 18131
774 1 10 . 1 1 12 12 VAL CB C 12 35.400 35.400 32.505 2.895 18131
775 1 10 . 1 1 13 13 HIS C C 13 172.900 172.900 174.163 -1.263 18131
776 1 10 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.797 -1.597 18131
777 1 10 . 1 1 13 13 HIS CB C 13 31.200 31.200 32.140 -0.940 18131
778 1 10 . 1 1 14 14 HIS C C 14 171.900 171.900 174.714 -2.814 18131
779 1 10 . 1 1 14 14 HIS CA C 14 53.700 53.700 55.254 -1.554 18131
780 1 10 . 1 1 14 14 HIS CB C 14 35.400 35.400 31.185 4.215 18131
781 1 10 . 1 1 15 15 GLN C C 15 173.400 173.400 175.724 -2.324 18131
782 1 10 . 1 1 15 15 GLN CA C 15 54.600 54.600 55.335 -0.735 18131
783 1 10 . 1 1 15 15 GLN CB C 15 33.700 33.700 29.893 3.807 18131
784 1 10 . 1 1 16 16 LYS C C 16 173.500 173.500 175.128 -1.628 18131
785 1 10 . 1 1 16 16 LYS CA C 16 54.300 54.300 56.322 -2.022 18131
786 1 10 . 1 1 16 16 LYS CB C 16 36.200 36.200 33.078 3.122 18131
787 1 10 . 1 1 17 17 LEU C C 17 174.700 174.700 175.572 -0.872 18131
788 1 10 . 1 1 17 17 LEU CA C 17 53.900 53.900 54.490 -0.591 18131
789 1 10 . 1 1 17 17 LEU CB C 17 44.900 44.900 43.297 1.603 18131
790 1 10 . 1 1 18 18 VAL C C 18 174.100 174.100 174.510 -0.410 18131
791 1 10 . 1 1 18 18 VAL CA C 18 60.600 60.600 61.755 -1.155 18131
792 1 10 . 1 1 18 18 VAL CB C 18 35.300 35.300 34.046 1.254 18131
793 1 10 . 1 1 19 19 PHE C C 19 172.700 172.700 175.190 -2.490 18131
794 1 10 . 1 1 19 19 PHE CA C 19 56.100 56.100 57.452 -1.351 18131
795 1 10 . 1 1 19 19 PHE CB C 19 42.200 42.200 40.404 1.796 18131
796 1 10 . 1 1 20 20 PHE C C 20 172.300 172.300 175.336 -3.036 18131
797 1 10 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.619 -1.619 18131
798 1 10 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.156 2.744 18131
799 1 10 . 1 1 21 21 ALA C C 21 175.100 175.100 176.890 -1.790 18131
800 1 10 . 1 1 21 21 ALA CA C 21 49.700 49.700 51.613 -1.913 18131
801 1 10 . 1 1 21 21 ALA CB C 21 22.100 22.100 19.996 2.104 18131
802 1 10 . 1 1 22 22 GLU C C 22 176.000 176.000 176.840 -0.840 18131
803 1 10 . 1 1 22 22 GLU CA C 22 54.400 54.400 55.882 -1.482 18131
804 1 10 . 1 1 22 22 GLU CB C 22 33.900 33.900 30.221 3.679 18131
805 1 10 . 1 1 23 23 ASP C C 23 174.400 174.400 177.031 -2.631 18131
806 1 10 . 1 1 23 23 ASP CA C 23 56.500 56.500 56.387 0.113 18131
807 1 10 . 1 1 23 23 ASP CB C 23 39.100 39.100 40.885 -1.784 18131
808 1 10 . 1 1 24 24 VAL C C 24 176.800 176.800 176.630 0.170 18131
809 1 10 . 1 1 24 24 VAL CA C 24 60.100 60.100 63.738 -3.638 18131
810 1 10 . 1 1 24 24 VAL CB C 24 32.700 32.700 32.480 0.220 18131
811 1 10 . 1 1 25 25 GLY C C 25 171.500 171.500 174.144 -2.644 18131
812 1 10 . 1 1 25 25 GLY CA C 25 46.500 46.500 44.987 1.512 18131
813 1 10 . 1 1 26 26 SER C C 26 173.800 173.800 174.500 -0.700 18131
814 1 10 . 1 1 26 26 SER CA C 26 55.700 55.700 58.698 -2.998 18131
815 1 10 . 1 1 26 26 SER CB C 26 65.300 65.300 63.497 1.803 18131
816 1 10 . 1 1 27 27 ASN C C 27 174.300 174.300 176.235 -1.935 18131
817 1 10 . 1 1 27 27 ASN CA C 27 53.100 53.100 52.710 0.390 18131
818 1 10 . 1 1 27 27 ASN CB C 27 40.800 40.800 39.735 1.065 18131
819 1 10 . 1 1 28 28 LYS C C 28 175.300 175.300 177.460 -2.160 18131
820 1 10 . 1 1 28 28 LYS CA C 28 55.500 55.500 57.964 -2.464 18131
821 1 10 . 1 1 28 28 LYS CB C 28 35.500 35.500 32.544 2.956 18131
822 1 10 . 1 1 29 29 GLY C C 29 171.700 171.700 172.792 -1.092 18131
823 1 10 . 1 1 29 29 GLY CA C 29 43.500 43.500 44.164 -0.664 18131
824 1 10 . 1 1 30 30 ALA C C 30 175.200 175.200 176.771 -1.571 18131
825 1 10 . 1 1 30 30 ALA CA C 30 49.800 49.800 51.568 -1.768 18131
826 1 10 . 1 1 30 30 ALA CB C 30 21.300 21.300 19.126 2.174 18131
827 1 10 . 1 1 31 31 ILE C C 31 173.600 173.600 174.998 -1.398 18131
828 1 10 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.139 0.661 18131
829 1 10 . 1 1 31 31 ILE CB C 31 39.900 39.900 40.372 -0.472 18131
830 1 10 . 1 1 32 32 ILE C C 32 175.700 175.700 176.143 -0.443 18131
831 1 10 . 1 1 32 32 ILE CA C 32 57.200 57.200 61.084 -3.884 18131
832 1 10 . 1 1 32 32 ILE CB C 32 42.200 42.200 38.418 3.782 18131
833 1 10 . 1 1 33 33 GLY C C 33 171.700 171.700 173.569 -1.869 18131
834 1 10 . 1 1 33 33 GLY CA C 33 48.100 48.100 44.904 3.196 18131
835 1 10 . 1 1 34 34 LEU C C 34 173.200 173.200 176.660 -3.460 18131
836 1 10 . 1 1 34 34 LEU CA C 34 54.200 54.200 54.182 0.018 18131
837 1 10 . 1 1 34 34 LEU CB C 34 45.800 45.800 44.901 0.899 18131
838 1 10 . 1 1 35 35 MET C C 35 172.900 172.900 175.066 -2.166 18131
839 1 10 . 1 1 35 35 MET CA C 35 54.100 54.100 54.329 -0.229 18131
840 1 10 . 1 1 35 35 MET CB C 35 36.400 36.400 31.753 4.647 18131
841 1 10 . 1 1 36 36 VAL C C 36 175.400 175.400 176.395 -0.995 18131
842 1 10 . 1 1 36 36 VAL CA C 36 58.900 58.900 62.142 -3.242 18131
843 1 10 . 1 1 36 36 VAL CB C 36 35.100 35.100 32.285 2.815 18131
844 1 10 . 1 1 37 37 GLY C C 37 172.300 172.300 174.917 -2.617 18131
845 1 10 . 1 1 37 37 GLY CA C 37 48.300 48.300 44.523 3.777 18131
846 1 10 . 1 1 38 38 GLY C C 38 171.300 171.300 175.008 -3.708 18131
847 1 10 . 1 1 38 38 GLY CA C 38 44.100 44.100 45.172 -1.072 18131
848 1 10 . 1 1 39 39 VAL C C 39 173.500 173.500 176.525 -3.025 18131
849 1 10 . 1 1 39 39 VAL CA C 39 60.600 60.600 61.292 -0.692 18131
850 1 10 . 1 1 39 39 VAL CB C 39 34.100 34.100 33.424 0.676 18131
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 0 0.000 0.000 0.000 18131
2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 18131
3 1 1 "Average Difference" C 30 1.734 1.449 0.969 18131
4 1 1 "Average Difference" CA 30 1.956 0.984 1.720 18131
5 1 1 "Average Difference" CB 25 2.298 -1.458 1.812 18131
6 1 1 "Average Difference" HN 0 0.000 0.000 0.000 18131
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18131
8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 18131
9 1 2 "Average Difference" C 30 1.975 1.668 1.074 18131
10 1 2 "Average Difference" CA 30 1.953 1.060 1.668 18131
11 1 2 "Average Difference" CB 25 2.200 -1.588 1.554 18131
12 1 2 "Average Difference" HN 0 0.000 0.000 0.000 18131
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18131
14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 18131
15 1 3 "Average Difference" C 30 1.967 1.751 0.911 18131
16 1 3 "Average Difference" CA 30 1.935 0.926 1.728 18131
17 1 3 "Average Difference" CB 25 2.238 -1.638 1.556 18131
18 1 3 "Average Difference" HN 0 0.000 0.000 0.000 18131
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18131
20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 18131
21 1 4 "Average Difference" C 30 1.831 1.599 0.908 18131
22 1 4 "Average Difference" CA 30 1.928 0.959 1.701 18131
23 1 4 "Average Difference" CB 25 2.337 -1.604 1.734 18131
24 1 4 "Average Difference" HN 0 0.000 0.000 0.000 18131
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18131
26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 18131
27 1 5 "Average Difference" C 30 2.086 1.769 1.124 18131
28 1 5 "Average Difference" CA 30 1.823 1.002 1.548 18131
29 1 5 "Average Difference" CB 25 2.453 -1.704 1.800 18131
30 1 5 "Average Difference" HN 0 0.000 0.000 0.000 18131
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18131
32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 18131
33 1 6 "Average Difference" C 30 1.805 1.475 1.058 18131
34 1 6 "Average Difference" CA 30 1.945 1.021 1.683 18131
35 1 6 "Average Difference" CB 25 2.153 -1.555 1.519 18131
36 1 6 "Average Difference" HN 0 0.000 0.000 0.000 18131
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18131
38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 18131
39 1 7 "Average Difference" C 30 1.750 1.441 1.011 18131
40 1 7 "Average Difference" CA 30 1.908 1.040 1.627 18131
41 1 7 "Average Difference" CB 25 2.205 -1.589 1.559 18131
42 1 7 "Average Difference" HN 0 0.000 0.000 0.000 18131
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18131
44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 18131
45 1 8 "Average Difference" C 30 1.825 1.507 1.047 18131
46 1 8 "Average Difference" CA 30 1.904 0.860 1.727 18131
47 1 8 "Average Difference" CB 25 2.207 -1.626 1.522 18131
48 1 8 "Average Difference" HN 0 0.000 0.000 0.000 18131
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18131
50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 18131
51 1 9 "Average Difference" C 30 1.863 1.564 1.029 18131
52 1 9 "Average Difference" CA 30 1.831 0.938 1.600 18131
53 1 9 "Average Difference" CB 25 2.398 -1.594 1.829 18131
54 1 9 "Average Difference" HN 0 0.000 0.000 0.000 18131
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18131
56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 18131
57 1 10 "Average Difference" C 30 2.049 1.803 0.991 18131
58 1 10 "Average Difference" CA 30 2.042 1.052 1.780 18131
59 1 10 "Average Difference" CB 25 2.479 -1.722 1.821 18131
60 1 10 "Average Difference" HN 0 0.000 0.000 0.000 18131
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Model_type average
_Entity_delta_chem_shifts.Entry_ID 18131
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 10 10 TYR C C 10 173.700 173.700 175.429 -1.729 18131
2 1 . 1 1 10 10 TYR CA C 10 54.200 54.200 57.552 -3.352 18131
3 1 . 1 1 10 10 TYR CB C 10 37.700 37.700 39.566 -1.865 18131
4 1 . 1 1 11 11 GLU C C 11 173.200 173.200 175.139 -1.938 18131
5 1 . 1 1 11 11 GLU CA C 11 54.500 54.500 55.970 -1.470 18131
6 1 . 1 1 11 11 GLU CB C 11 31.400 31.400 31.328 0.072 18131
7 1 . 1 1 12 12 VAL C C 12 174.100 174.100 175.013 -0.913 18131
8 1 . 1 1 12 12 VAL CA C 12 61.000 61.000 61.608 -0.608 18131
9 1 . 1 1 12 12 VAL CB C 12 35.400 35.400 33.119 2.281 18131
10 1 . 1 1 13 13 HIS C C 13 172.900 172.900 174.258 -1.358 18131
11 1 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.531 -1.331 18131
12 1 . 1 1 13 13 HIS CB C 13 31.200 31.200 31.370 -0.170 18131
13 1 . 1 1 14 14 HIS C C 14 171.900 171.900 174.247 -2.347 18131
14 1 . 1 1 14 14 HIS CA C 14 53.700 53.700 55.566 -1.866 18131
15 1 . 1 1 14 14 HIS CB C 14 35.400 35.400 31.138 4.262 18131
16 1 . 1 1 15 15 GLN C C 15 173.400 173.400 174.576 -1.176 18131
17 1 . 1 1 15 15 GLN CA C 15 54.600 54.600 55.052 -0.452 18131
18 1 . 1 1 15 15 GLN CB C 15 33.700 33.700 31.311 2.389 18131
19 1 . 1 1 16 16 LYS C C 16 173.500 173.500 175.900 -2.400 18131
20 1 . 1 1 16 16 LYS CA C 16 54.300 54.300 56.101 -1.801 18131
21 1 . 1 1 16 16 LYS CB C 16 36.200 36.200 32.907 3.293 18131
22 1 . 1 1 17 17 LEU C C 17 174.700 174.700 175.916 -1.216 18131
23 1 . 1 1 17 17 LEU CA C 17 53.900 53.900 54.375 -0.475 18131
24 1 . 1 1 17 17 LEU CB C 17 44.900 44.900 43.047 1.853 18131
25 1 . 1 1 18 18 VAL C C 18 174.100 174.100 174.805 -0.705 18131
26 1 . 1 1 18 18 VAL CA C 18 60.600 60.600 61.874 -1.274 18131
27 1 . 1 1 18 18 VAL CB C 18 35.300 35.300 33.681 1.619 18131
28 1 . 1 1 19 19 PHE C C 19 172.700 172.700 174.892 -2.192 18131
29 1 . 1 1 19 19 PHE CA C 19 56.100 56.100 57.713 -1.613 18131
30 1 . 1 1 19 19 PHE CB C 19 42.200 42.200 41.122 1.078 18131
31 1 . 1 1 20 20 PHE C C 20 172.300 172.300 174.256 -1.956 18131
32 1 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.203 -1.203 18131
33 1 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.506 2.394 18131
34 1 . 1 1 21 21 ALA C C 21 175.100 175.100 176.468 -1.368 18131
35 1 . 1 1 21 21 ALA CA C 21 49.700 49.700 51.720 -2.020 18131
36 1 . 1 1 21 21 ALA CB C 21 22.100 22.100 20.121 1.979 18131
37 1 . 1 1 22 22 GLU C C 22 176.000 176.000 175.696 0.304 18131
38 1 . 1 1 22 22 GLU CA C 22 54.400 54.400 56.040 -1.640 18131
39 1 . 1 1 22 22 GLU CB C 22 33.900 33.900 31.284 2.616 18131
40 1 . 1 1 23 23 ASP C C 23 174.400 174.400 175.867 -1.467 18131
41 1 . 1 1 23 23 ASP CA C 23 56.500 56.500 55.064 1.436 18131
42 1 . 1 1 23 23 ASP CB C 23 39.100 39.100 40.373 -1.273 18131
43 1 . 1 1 24 24 VAL C C 24 176.800 176.800 176.768 0.033 18131
44 1 . 1 1 24 24 VAL CA C 24 60.100 60.100 62.375 -2.275 18131
45 1 . 1 1 24 24 VAL CB C 24 32.700 32.700 32.548 0.151 18131
46 1 . 1 1 25 25 GLY C C 25 171.500 171.500 174.251 -2.751 18131
47 1 . 1 1 25 25 GLY CA C 25 46.500 46.500 45.541 0.959 18131
48 1 . 1 1 26 26 SER C C 26 173.800 173.800 173.819 -0.019 18131
49 1 . 1 1 26 26 SER CA C 26 55.700 55.700 57.750 -2.050 18131
50 1 . 1 1 26 26 SER CB C 26 65.300 65.300 64.152 1.148 18131
51 1 . 1 1 27 27 ASN C C 27 174.300 174.300 175.812 -1.512 18131
52 1 . 1 1 27 27 ASN CA C 27 53.100 53.100 53.444 -0.344 18131
53 1 . 1 1 27 27 ASN CB C 27 40.800 40.800 39.297 1.503 18131
54 1 . 1 1 28 28 LYS C C 28 175.300 175.300 177.075 -1.775 18131
55 1 . 1 1 28 28 LYS CA C 28 55.500 55.500 57.333 -1.833 18131
56 1 . 1 1 28 28 LYS CB C 28 35.500 35.500 32.513 2.987 18131
57 1 . 1 1 29 29 GLY C C 29 171.700 171.700 173.531 -1.831 18131
58 1 . 1 1 29 29 GLY CA C 29 43.500 43.500 44.744 -1.244 18131
59 1 . 1 1 30 30 ALA C C 30 175.200 175.200 176.539 -1.339 18131
60 1 . 1 1 30 30 ALA CA C 30 49.800 49.800 51.814 -2.014 18131
61 1 . 1 1 30 30 ALA CB C 30 21.300 21.300 19.185 2.115 18131
62 1 . 1 1 31 31 ILE C C 31 173.600 173.600 175.047 -1.447 18131
63 1 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.791 0.009 18131
64 1 . 1 1 31 31 ILE CB C 31 39.900 39.900 40.184 -0.283 18131
65 1 . 1 1 32 32 ILE C C 32 175.700 175.700 175.993 -0.293 18131
66 1 . 1 1 32 32 ILE CA C 32 57.200 57.200 61.017 -3.817 18131
67 1 . 1 1 32 32 ILE CB C 32 42.200 42.200 38.393 3.807 18131
68 1 . 1 1 33 33 GLY C C 33 171.700 171.700 173.531 -1.831 18131
69 1 . 1 1 33 33 GLY CA C 33 48.100 48.100 44.969 3.131 18131
70 1 . 1 1 34 34 LEU C C 34 173.200 173.200 176.269 -3.069 18131
71 1 . 1 1 34 34 LEU CA C 34 54.200 54.200 54.301 -0.101 18131
72 1 . 1 1 34 34 LEU CB C 34 45.800 45.800 44.927 0.873 18131
73 1 . 1 1 35 35 MET C C 35 172.900 172.900 175.122 -2.222 18131
74 1 . 1 1 35 35 MET CA C 35 54.100 54.100 54.791 -0.692 18131
75 1 . 1 1 35 35 MET CB C 35 36.400 36.400 32.813 3.587 18131
76 1 . 1 1 36 36 VAL C C 36 175.400 175.400 176.168 -0.768 18131
77 1 . 1 1 36 36 VAL CA C 36 58.900 58.900 62.093 -3.193 18131
78 1 . 1 1 36 36 VAL CB C 36 35.100 35.100 31.933 3.167 18131
79 1 . 1 1 37 37 GLY C C 37 172.300 172.300 174.796 -2.496 18131
80 1 . 1 1 37 37 GLY CA C 37 48.300 48.300 44.920 3.380 18131
81 1 . 1 1 38 38 GLY C C 38 171.300 171.300 174.543 -3.243 18131
82 1 . 1 1 38 38 GLY CA C 38 44.100 44.100 45.416 -1.315 18131
83 1 . 1 1 39 39 VAL C C 39 173.500 173.500 176.555 -3.055 18131
84 1 . 1 1 39 39 VAL CA C 39 60.600 60.600 61.057 -0.457 18131
85 1 . 1 1 39 39 VAL CB C 39 34.100 34.100 33.483 0.617 18131
stop_
save_