data_18128
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18128
_Entry.PDB_ID 2LMO
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 18128
_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 10 175.000 175.000 175.661 -0.661 18128
2 1 1 . 1 1 10 10 TYR CA C 10 57.300 57.300 57.468 -0.168 18128
3 1 1 . 1 1 10 10 TYR CB C 10 42.100 42.100 40.446 1.654 18128
4 1 1 . 1 1 12 12 VAL C C 12 174.600 174.600 174.963 -0.363 18128
5 1 1 . 1 1 12 12 VAL CA C 12 60.400 60.400 61.718 -1.318 18128
6 1 1 . 1 1 12 12 VAL CB C 12 35.300 35.300 33.426 1.874 18128
7 1 1 . 1 1 13 13 HIS C C 13 174.200 174.200 174.353 -0.153 18128
8 1 1 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.145 -0.945 18128
9 1 1 . 1 1 13 13 HIS CB C 13 34.800 34.800 31.373 3.427 18128
10 1 1 . 1 1 14 14 HIS C C 14 174.200 174.200 174.639 -0.439 18128
11 1 1 . 1 1 14 14 HIS CA C 14 55.400 55.400 55.536 -0.136 18128
12 1 1 . 1 1 14 14 HIS CB C 14 33.100 33.100 31.129 1.971 18128
13 1 1 . 1 1 15 15 GLN N N 15 123.800 123.800 118.427 5.373 18128
14 1 1 . 1 1 15 15 GLN C C 15 173.600 173.600 174.842 -1.242 18128
15 1 1 . 1 1 15 15 GLN CA C 15 55.000 55.000 55.014 -0.014 18128
16 1 1 . 1 1 15 15 GLN CB C 15 33.500 33.500 31.677 1.823 18128
17 1 1 . 1 1 16 16 LYS N N 16 126.400 126.400 121.839 4.561 18128
18 1 1 . 1 1 16 16 LYS C C 16 174.100 174.100 175.512 -1.412 18128
19 1 1 . 1 1 16 16 LYS CA C 16 54.700 54.700 56.201 -1.501 18128
20 1 1 . 1 1 16 16 LYS CB C 16 36.000 36.000 33.218 2.782 18128
21 1 1 . 1 1 17 17 LEU C C 17 174.600 174.600 175.745 -1.145 18128
22 1 1 . 1 1 17 17 LEU CA C 17 54.500 54.500 54.250 0.250 18128
23 1 1 . 1 1 17 17 LEU CB C 17 46.400 46.400 43.033 3.367 18128
24 1 1 . 1 1 18 18 VAL C C 18 172.800 172.800 174.501 -1.701 18128
25 1 1 . 1 1 18 18 VAL CA C 18 60.900 60.900 61.666 -0.765 18128
26 1 1 . 1 1 18 18 VAL CB C 18 35.600 35.600 33.879 1.722 18128
27 1 1 . 1 1 19 19 PHE C C 19 171.900 171.900 175.026 -3.126 18128
28 1 1 . 1 1 19 19 PHE CA C 19 56.500 56.500 57.504 -1.004 18128
29 1 1 . 1 1 19 19 PHE CB C 19 42.600 42.600 41.142 1.458 18128
30 1 1 . 1 1 20 20 PHE C C 20 172.200 172.200 174.414 -2.214 18128
31 1 1 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.068 -1.068 18128
32 1 1 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.294 2.606 18128
33 1 1 . 1 1 21 21 ALA C C 21 175.000 175.000 176.569 -1.569 18128
34 1 1 . 1 1 21 21 ALA CA C 21 50.100 50.100 51.675 -1.575 18128
35 1 1 . 1 1 21 21 ALA CB C 21 22.700 22.700 20.316 2.384 18128
36 1 1 . 1 1 22 22 GLU C C 22 174.900 174.900 174.899 0.001 18128
37 1 1 . 1 1 22 22 GLU CA C 22 53.900 53.900 55.754 -1.854 18128
38 1 1 . 1 1 22 22 GLU CB C 22 34.100 34.100 31.758 2.342 18128
39 1 1 . 1 1 23 23 ASP N N 23 126.900 126.900 121.677 5.223 18128
40 1 1 . 1 1 23 23 ASP C C 23 174.200 174.200 176.255 -2.055 18128
41 1 1 . 1 1 23 23 ASP CA C 23 56.800 56.800 53.336 3.464 18128
42 1 1 . 1 1 23 23 ASP CB C 23 39.200 39.200 41.875 -2.675 18128
43 1 1 . 1 1 24 24 VAL N N 24 121.200 121.200 123.033 -1.833 18128
44 1 1 . 1 1 24 24 VAL C C 24 174.500 174.500 177.175 -2.675 18128
45 1 1 . 1 1 24 24 VAL CA C 24 60.300 60.300 61.778 -1.478 18128
46 1 1 . 1 1 24 24 VAL CB C 24 32.900 32.900 31.917 0.983 18128
47 1 1 . 1 1 25 25 GLY N N 25 118.000 118.000 109.014 8.986 18128
48 1 1 . 1 1 25 25 GLY C C 25 171.300 171.300 174.609 -3.309 18128
49 1 1 . 1 1 25 25 GLY CA C 25 47.000 47.000 46.754 0.246 18128
50 1 1 . 1 1 26 26 SER N N 26 112.600 112.600 114.850 -2.250 18128
51 1 1 . 1 1 26 26 SER C C 26 174.100 174.100 173.503 0.597 18128
52 1 1 . 1 1 26 26 SER CA C 26 56.400 56.400 56.718 -0.317 18128
53 1 1 . 1 1 26 26 SER CB C 26 65.700 65.700 63.873 1.827 18128
54 1 1 . 1 1 27 27 ASN N N 27 124.000 124.000 118.672 5.328 18128
55 1 1 . 1 1 27 27 ASN C C 27 174.300 174.300 173.799 0.501 18128
56 1 1 . 1 1 27 27 ASN CA C 27 53.300 53.300 54.533 -1.233 18128
57 1 1 . 1 1 27 27 ASN CB C 27 40.400 40.400 38.819 1.581 18128
58 1 1 . 1 1 28 28 LYS N N 28 124.000 124.000 120.221 3.779 18128
59 1 1 . 1 1 28 28 LYS C C 28 173.600 173.600 176.532 -2.932 18128
60 1 1 . 1 1 28 28 LYS CA C 28 55.500 55.500 55.958 -0.458 18128
61 1 1 . 1 1 28 28 LYS CB C 28 35.000 35.000 33.864 1.136 18128
62 1 1 . 1 1 29 29 GLY N N 29 107.500 107.500 112.674 -5.174 18128
63 1 1 . 1 1 29 29 GLY C C 29 171.400 171.400 173.901 -2.501 18128
64 1 1 . 1 1 29 29 GLY CA C 29 44.000 44.000 44.779 -0.779 18128
65 1 1 . 1 1 30 30 ALA N N 30 127.800 127.800 124.904 2.896 18128
66 1 1 . 1 1 30 30 ALA C C 30 174.800 174.800 176.864 -2.064 18128
67 1 1 . 1 1 30 30 ALA CA C 30 49.900 49.900 51.614 -1.714 18128
68 1 1 . 1 1 30 30 ALA CB C 30 22.700 22.700 19.896 2.804 18128
69 1 1 . 1 1 31 31 ILE N N 31 117.900 117.900 120.770 -2.870 18128
70 1 1 . 1 1 31 31 ILE C C 31 174.100 174.100 175.180 -1.080 18128
71 1 1 . 1 1 31 31 ILE CA C 31 60.800 60.800 61.000 -0.200 18128
72 1 1 . 1 1 31 31 ILE CB C 31 40.200 40.200 39.407 0.793 18128
73 1 1 . 1 1 32 32 ILE C C 32 174.800 174.800 175.855 -1.055 18128
74 1 1 . 1 1 32 32 ILE CA C 32 58.200 58.200 61.176 -2.976 18128
75 1 1 . 1 1 32 32 ILE CB C 32 42.400 42.400 38.729 3.671 18128
76 1 1 . 1 1 33 33 GLY N N 33 110.800 110.800 115.119 -4.319 18128
77 1 1 . 1 1 33 33 GLY C C 33 171.600 171.600 173.612 -2.012 18128
78 1 1 . 1 1 33 33 GLY CA C 33 48.800 48.800 44.898 3.902 18128
79 1 1 . 1 1 34 34 LEU C C 34 173.500 173.500 176.124 -2.624 18128
80 1 1 . 1 1 34 34 LEU CA C 34 53.800 53.800 54.363 -0.563 18128
81 1 1 . 1 1 34 34 LEU CB C 34 45.900 45.900 44.877 1.023 18128
82 1 1 . 1 1 35 35 MET N N 35 122.100 122.100 122.427 -0.327 18128
83 1 1 . 1 1 35 35 MET C C 35 173.300 173.300 175.543 -2.243 18128
84 1 1 . 1 1 35 35 MET CA C 35 54.400 54.400 55.217 -0.817 18128
85 1 1 . 1 1 35 35 MET CB C 35 37.100 37.100 33.161 3.939 18128
86 1 1 . 1 1 36 36 VAL N N 36 124.300 124.300 126.434 -2.134 18128
87 1 1 . 1 1 36 36 VAL C C 36 175.200 175.200 176.620 -1.420 18128
88 1 1 . 1 1 36 36 VAL CA C 36 59.700 59.700 61.884 -2.184 18128
89 1 1 . 1 1 36 36 VAL CB C 36 34.900 34.900 30.852 4.048 18128
90 1 1 . 1 1 37 37 GLY N N 37 116.500 116.500 113.352 3.148 18128
91 1 1 . 1 1 37 37 GLY C C 37 171.000 171.000 174.788 -3.788 18128
92 1 1 . 1 1 37 37 GLY CA C 37 44.900 44.900 45.103 -0.203 18128
93 1 1 . 1 1 38 38 GLY N N 38 104.200 104.200 107.132 -2.932 18128
94 1 1 . 1 1 38 38 GLY C C 38 170.400 170.400 173.094 -2.694 18128
95 1 1 . 1 1 38 38 GLY CA C 38 44.800 44.800 44.735 0.065 18128
96 1 1 . 1 1 39 39 VAL N N 39 114.700 114.700 120.551 -5.851 18128
97 1 1 . 1 1 39 39 VAL C C 39 173.200 173.200 176.406 -3.206 18128
98 1 1 . 1 1 39 39 VAL CA C 39 61.100 61.100 61.303 -0.203 18128
99 1 1 . 1 1 39 39 VAL CB C 39 35.200 35.200 34.422 0.778 18128
100 1 2 . 1 1 10 10 TYR C C 10 175.000 175.000 175.695 -0.695 18128
101 1 2 . 1 1 10 10 TYR CA C 10 57.300 57.300 57.599 -0.299 18128
102 1 2 . 1 1 10 10 TYR CB C 10 42.100 42.100 39.794 2.306 18128
103 1 2 . 1 1 12 12 VAL C C 12 174.600 174.600 175.188 -0.588 18128
104 1 2 . 1 1 12 12 VAL CA C 12 60.400 60.400 61.785 -1.385 18128
105 1 2 . 1 1 12 12 VAL CB C 12 35.300 35.300 32.860 2.440 18128
106 1 2 . 1 1 13 13 HIS C C 13 174.200 174.200 173.393 0.807 18128
107 1 2 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.132 -0.932 18128
108 1 2 . 1 1 13 13 HIS CB C 13 34.800 34.800 31.013 3.787 18128
109 1 2 . 1 1 14 14 HIS C C 14 174.200 174.200 174.822 -0.622 18128
110 1 2 . 1 1 14 14 HIS CA C 14 55.400 55.400 55.199 0.201 18128
111 1 2 . 1 1 14 14 HIS CB C 14 33.100 33.100 31.940 1.160 18128
112 1 2 . 1 1 15 15 GLN N N 15 123.800 123.800 120.141 3.659 18128
113 1 2 . 1 1 15 15 GLN C C 15 173.600 173.600 175.456 -1.856 18128
114 1 2 . 1 1 15 15 GLN CA C 15 55.000 55.000 55.190 -0.190 18128
115 1 2 . 1 1 15 15 GLN CB C 15 33.500 33.500 29.994 3.506 18128
116 1 2 . 1 1 16 16 LYS N N 16 126.400 126.400 120.906 5.494 18128
117 1 2 . 1 1 16 16 LYS C C 16 174.100 174.100 175.728 -1.628 18128
118 1 2 . 1 1 16 16 LYS CA C 16 54.700 54.700 55.769 -1.069 18128
119 1 2 . 1 1 16 16 LYS CB C 16 36.000 36.000 33.527 2.473 18128
120 1 2 . 1 1 17 17 LEU C C 17 174.600 174.600 175.919 -1.319 18128
121 1 2 . 1 1 17 17 LEU CA C 17 54.500 54.500 54.669 -0.169 18128
122 1 2 . 1 1 17 17 LEU CB C 17 46.400 46.400 43.047 3.353 18128
123 1 2 . 1 1 18 18 VAL C C 18 172.800 172.800 174.656 -1.856 18128
124 1 2 . 1 1 18 18 VAL CA C 18 60.900 60.900 61.984 -1.084 18128
125 1 2 . 1 1 18 18 VAL CB C 18 35.600 35.600 33.255 2.345 18128
126 1 2 . 1 1 19 19 PHE C C 19 171.900 171.900 174.217 -2.317 18128
127 1 2 . 1 1 19 19 PHE CA C 19 56.500 56.500 57.964 -1.464 18128
128 1 2 . 1 1 19 19 PHE CB C 19 42.600 42.600 40.978 1.622 18128
129 1 2 . 1 1 20 20 PHE C C 20 172.200 172.200 173.285 -1.085 18128
130 1 2 . 1 1 20 20 PHE CA C 20 56.000 56.000 56.736 -0.736 18128
131 1 2 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.795 2.105 18128
132 1 2 . 1 1 21 21 ALA C C 21 175.000 175.000 175.891 -0.891 18128
133 1 2 . 1 1 21 21 ALA CA C 21 50.100 50.100 51.735 -1.635 18128
134 1 2 . 1 1 21 21 ALA CB C 21 22.700 22.700 20.388 2.312 18128
135 1 2 . 1 1 22 22 GLU C C 22 174.900 174.900 174.740 0.160 18128
136 1 2 . 1 1 22 22 GLU CA C 22 53.900 53.900 55.546 -1.646 18128
137 1 2 . 1 1 22 22 GLU CB C 22 34.100 34.100 31.053 3.047 18128
138 1 2 . 1 1 23 23 ASP N N 23 126.900 126.900 121.945 4.955 18128
139 1 2 . 1 1 23 23 ASP C C 23 174.200 174.200 175.334 -1.134 18128
140 1 2 . 1 1 23 23 ASP CA C 23 56.800 56.800 53.739 3.061 18128
141 1 2 . 1 1 23 23 ASP CB C 23 39.200 39.200 41.502 -2.301 18128
142 1 2 . 1 1 24 24 VAL N N 24 121.200 121.200 120.445 0.755 18128
143 1 2 . 1 1 24 24 VAL C C 24 174.500 174.500 176.522 -2.022 18128
144 1 2 . 1 1 24 24 VAL CA C 24 60.300 60.300 62.160 -1.860 18128
145 1 2 . 1 1 24 24 VAL CB C 24 32.900 32.900 32.018 0.882 18128
146 1 2 . 1 1 25 25 GLY N N 25 118.000 118.000 116.950 1.050 18128
147 1 2 . 1 1 25 25 GLY C C 25 171.300 171.300 174.360 -3.060 18128
148 1 2 . 1 1 25 25 GLY CA C 25 47.000 47.000 46.444 0.556 18128
149 1 2 . 1 1 26 26 SER N N 26 112.600 112.600 117.020 -4.420 18128
150 1 2 . 1 1 26 26 SER C C 26 174.100 174.100 174.270 -0.170 18128
151 1 2 . 1 1 26 26 SER CA C 26 56.400 56.400 57.446 -1.046 18128
152 1 2 . 1 1 26 26 SER CB C 26 65.700 65.700 63.765 1.935 18128
153 1 2 . 1 1 27 27 ASN N N 27 124.000 124.000 119.737 4.263 18128
154 1 2 . 1 1 27 27 ASN C C 27 174.300 174.300 173.889 0.411 18128
155 1 2 . 1 1 27 27 ASN CA C 27 53.300 53.300 54.837 -1.537 18128
156 1 2 . 1 1 27 27 ASN CB C 27 40.400 40.400 38.980 1.420 18128
157 1 2 . 1 1 28 28 LYS N N 28 124.000 124.000 115.628 8.372 18128
158 1 2 . 1 1 28 28 LYS C C 28 173.600 173.600 175.661 -2.061 18128
159 1 2 . 1 1 28 28 LYS CA C 28 55.500 55.500 56.341 -0.841 18128
160 1 2 . 1 1 28 28 LYS CB C 28 35.000 35.000 31.001 3.999 18128
161 1 2 . 1 1 29 29 GLY N N 29 107.500 107.500 111.224 -3.724 18128
162 1 2 . 1 1 29 29 GLY C C 29 171.400 171.400 174.346 -2.946 18128
163 1 2 . 1 1 29 29 GLY CA C 29 44.000 44.000 45.393 -1.393 18128
164 1 2 . 1 1 30 30 ALA N N 30 127.800 127.800 124.783 3.017 18128
165 1 2 . 1 1 30 30 ALA C C 30 174.800 174.800 176.785 -1.985 18128
166 1 2 . 1 1 30 30 ALA CA C 30 49.900 49.900 51.788 -1.888 18128
167 1 2 . 1 1 30 30 ALA CB C 30 22.700 22.700 20.114 2.586 18128
168 1 2 . 1 1 31 31 ILE N N 31 117.900 117.900 122.106 -4.206 18128
169 1 2 . 1 1 31 31 ILE C C 31 174.100 174.100 174.806 -0.706 18128
170 1 2 . 1 1 31 31 ILE CA C 31 60.800 60.800 61.268 -0.468 18128
171 1 2 . 1 1 31 31 ILE CB C 31 40.200 40.200 39.965 0.235 18128
172 1 2 . 1 1 32 32 ILE C C 32 174.800 174.800 175.137 -0.337 18128
173 1 2 . 1 1 32 32 ILE CA C 32 58.200 58.200 60.848 -2.648 18128
174 1 2 . 1 1 32 32 ILE CB C 32 42.400 42.400 39.188 3.212 18128
175 1 2 . 1 1 33 33 GLY N N 33 110.800 110.800 115.578 -4.778 18128
176 1 2 . 1 1 33 33 GLY C C 33 171.600 171.600 173.518 -1.918 18128
177 1 2 . 1 1 33 33 GLY CA C 33 48.800 48.800 44.832 3.968 18128
178 1 2 . 1 1 34 34 LEU C C 34 173.500 173.500 176.218 -2.718 18128
179 1 2 . 1 1 34 34 LEU CA C 34 53.800 53.800 54.379 -0.579 18128
180 1 2 . 1 1 34 34 LEU CB C 34 45.900 45.900 44.510 1.391 18128
181 1 2 . 1 1 35 35 MET N N 35 122.100 122.100 122.997 -0.897 18128
182 1 2 . 1 1 35 35 MET C C 35 173.300 173.300 175.517 -2.217 18128
183 1 2 . 1 1 35 35 MET CA C 35 54.400 54.400 55.234 -0.834 18128
184 1 2 . 1 1 35 35 MET CB C 35 37.100 37.100 33.266 3.834 18128
185 1 2 . 1 1 36 36 VAL N N 36 124.300 124.300 123.691 0.609 18128
186 1 2 . 1 1 36 36 VAL C C 36 175.200 175.200 176.695 -1.495 18128
187 1 2 . 1 1 36 36 VAL CA C 36 59.700 59.700 61.865 -2.165 18128
188 1 2 . 1 1 36 36 VAL CB C 36 34.900 34.900 31.122 3.778 18128
189 1 2 . 1 1 37 37 GLY N N 37 116.500 116.500 113.838 2.662 18128
190 1 2 . 1 1 37 37 GLY C C 37 171.000 171.000 174.902 -3.902 18128
191 1 2 . 1 1 37 37 GLY CA C 37 44.900 44.900 45.207 -0.307 18128
192 1 2 . 1 1 38 38 GLY N N 38 104.200 104.200 106.872 -2.672 18128
193 1 2 . 1 1 38 38 GLY C C 38 170.400 170.400 173.137 -2.737 18128
194 1 2 . 1 1 38 38 GLY CA C 38 44.800 44.800 45.070 -0.270 18128
195 1 2 . 1 1 39 39 VAL N N 39 114.700 114.700 118.156 -3.456 18128
196 1 2 . 1 1 39 39 VAL C C 39 173.200 173.200 175.772 -2.572 18128
197 1 2 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.925 0.175 18128
198 1 2 . 1 1 39 39 VAL CB C 39 35.200 35.200 33.874 1.326 18128
199 1 3 . 1 1 10 10 TYR C C 10 175.000 175.000 175.523 -0.523 18128
200 1 3 . 1 1 10 10 TYR CA C 10 57.300 57.300 57.703 -0.403 18128
201 1 3 . 1 1 10 10 TYR CB C 10 42.100 42.100 40.325 1.775 18128
202 1 3 . 1 1 12 12 VAL C C 12 174.600 174.600 174.896 -0.296 18128
203 1 3 . 1 1 12 12 VAL CA C 12 60.400 60.400 61.986 -1.586 18128
204 1 3 . 1 1 12 12 VAL CB C 12 35.300 35.300 32.768 2.532 18128
205 1 3 . 1 1 13 13 HIS C C 13 174.200 174.200 174.524 -0.324 18128
206 1 3 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.154 -0.954 18128
207 1 3 . 1 1 13 13 HIS CB C 13 34.800 34.800 31.598 3.202 18128
208 1 3 . 1 1 14 14 HIS C C 14 174.200 174.200 174.416 -0.216 18128
209 1 3 . 1 1 14 14 HIS CA C 14 55.400 55.400 56.243 -0.843 18128
210 1 3 . 1 1 14 14 HIS CB C 14 33.100 33.100 31.064 2.036 18128
211 1 3 . 1 1 15 15 GLN N N 15 123.800 123.800 119.497 4.303 18128
212 1 3 . 1 1 15 15 GLN C C 15 173.600 173.600 174.548 -0.948 18128
213 1 3 . 1 1 15 15 GLN CA C 15 55.000 55.000 55.018 -0.018 18128
214 1 3 . 1 1 15 15 GLN CB C 15 33.500 33.500 31.394 2.106 18128
215 1 3 . 1 1 16 16 LYS N N 16 126.400 126.400 121.266 5.134 18128
216 1 3 . 1 1 16 16 LYS C C 16 174.100 174.100 175.259 -1.159 18128
217 1 3 . 1 1 16 16 LYS CA C 16 54.700 54.700 56.432 -1.732 18128
218 1 3 . 1 1 16 16 LYS CB C 16 36.000 36.000 33.825 2.175 18128
219 1 3 . 1 1 17 17 LEU C C 17 174.600 174.600 175.719 -1.119 18128
220 1 3 . 1 1 17 17 LEU CA C 17 54.500 54.500 54.584 -0.083 18128
221 1 3 . 1 1 17 17 LEU CB C 17 46.400 46.400 43.213 3.187 18128
222 1 3 . 1 1 18 18 VAL C C 18 172.800 172.800 174.575 -1.775 18128
223 1 3 . 1 1 18 18 VAL CA C 18 60.900 60.900 61.917 -1.017 18128
224 1 3 . 1 1 18 18 VAL CB C 18 35.600 35.600 33.644 1.956 18128
225 1 3 . 1 1 19 19 PHE C C 19 171.900 171.900 175.036 -3.136 18128
226 1 3 . 1 1 19 19 PHE CA C 19 56.500 56.500 57.978 -1.478 18128
227 1 3 . 1 1 19 19 PHE CB C 19 42.600 42.600 41.557 1.043 18128
228 1 3 . 1 1 20 20 PHE C C 20 172.200 172.200 174.047 -1.847 18128
229 1 3 . 1 1 20 20 PHE CA C 20 56.000 56.000 56.308 -0.308 18128
230 1 3 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.420 2.480 18128
231 1 3 . 1 1 21 21 ALA C C 21 175.000 175.000 176.171 -1.171 18128
232 1 3 . 1 1 21 21 ALA CA C 21 50.100 50.100 51.864 -1.764 18128
233 1 3 . 1 1 21 21 ALA CB C 21 22.700 22.700 20.460 2.240 18128
234 1 3 . 1 1 22 22 GLU C C 22 174.900 174.900 175.220 -0.320 18128
235 1 3 . 1 1 22 22 GLU CA C 22 53.900 53.900 55.641 -1.741 18128
236 1 3 . 1 1 22 22 GLU CB C 22 34.100 34.100 31.007 3.093 18128
237 1 3 . 1 1 23 23 ASP N N 23 126.900 126.900 119.902 6.998 18128
238 1 3 . 1 1 23 23 ASP C C 23 174.200 174.200 175.904 -1.704 18128
239 1 3 . 1 1 23 23 ASP CA C 23 56.800 56.800 54.578 2.222 18128
240 1 3 . 1 1 23 23 ASP CB C 23 39.200 39.200 41.300 -2.100 18128
241 1 3 . 1 1 24 24 VAL N N 24 121.200 121.200 118.785 2.415 18128
242 1 3 . 1 1 24 24 VAL C C 24 174.500 174.500 175.770 -1.270 18128
243 1 3 . 1 1 24 24 VAL CA C 24 60.300 60.300 62.374 -2.074 18128
244 1 3 . 1 1 24 24 VAL CB C 24 32.900 32.900 31.755 1.145 18128
245 1 3 . 1 1 25 25 GLY N N 25 118.000 118.000 115.410 2.590 18128
246 1 3 . 1 1 25 25 GLY C C 25 171.300 171.300 174.564 -3.264 18128
247 1 3 . 1 1 25 25 GLY CA C 25 47.000 47.000 45.958 1.042 18128
248 1 3 . 1 1 26 26 SER N N 26 112.600 112.600 115.612 -3.012 18128
249 1 3 . 1 1 26 26 SER C C 26 174.100 174.100 174.208 -0.108 18128
250 1 3 . 1 1 26 26 SER CA C 26 56.400 56.400 58.173 -1.773 18128
251 1 3 . 1 1 26 26 SER CB C 26 65.700 65.700 64.282 1.418 18128
252 1 3 . 1 1 27 27 ASN N N 27 124.000 124.000 118.107 5.893 18128
253 1 3 . 1 1 27 27 ASN C C 27 174.300 174.300 174.577 -0.277 18128
254 1 3 . 1 1 27 27 ASN CA C 27 53.300 53.300 53.185 0.114 18128
255 1 3 . 1 1 27 27 ASN CB C 27 40.400 40.400 39.058 1.342 18128
256 1 3 . 1 1 28 28 LYS N N 28 124.000 124.000 120.886 3.114 18128
257 1 3 . 1 1 28 28 LYS C C 28 173.600 173.600 177.205 -3.605 18128
258 1 3 . 1 1 28 28 LYS CA C 28 55.500 55.500 57.660 -2.160 18128
259 1 3 . 1 1 28 28 LYS CB C 28 35.000 35.000 31.072 3.929 18128
260 1 3 . 1 1 29 29 GLY N N 29 107.500 107.500 110.263 -2.763 18128
261 1 3 . 1 1 29 29 GLY C C 29 171.400 171.400 173.717 -2.317 18128
262 1 3 . 1 1 29 29 GLY CA C 29 44.000 44.000 44.340 -0.340 18128
263 1 3 . 1 1 30 30 ALA N N 30 127.800 127.800 127.539 0.261 18128
264 1 3 . 1 1 30 30 ALA C C 30 174.800 174.800 177.203 -2.403 18128
265 1 3 . 1 1 30 30 ALA CA C 30 49.900 49.900 51.979 -2.079 18128
266 1 3 . 1 1 30 30 ALA CB C 30 22.700 22.700 19.791 2.909 18128
267 1 3 . 1 1 31 31 ILE N N 31 117.900 117.900 118.571 -0.671 18128
268 1 3 . 1 1 31 31 ILE C C 31 174.100 174.100 174.915 -0.815 18128
269 1 3 . 1 1 31 31 ILE CA C 31 60.800 60.800 61.340 -0.540 18128
270 1 3 . 1 1 31 31 ILE CB C 31 40.200 40.200 38.774 1.426 18128
271 1 3 . 1 1 32 32 ILE C C 32 174.800 174.800 176.142 -1.342 18128
272 1 3 . 1 1 32 32 ILE CA C 32 58.200 58.200 61.168 -2.968 18128
273 1 3 . 1 1 32 32 ILE CB C 32 42.400 42.400 38.741 3.659 18128
274 1 3 . 1 1 33 33 GLY N N 33 110.800 110.800 115.527 -4.727 18128
275 1 3 . 1 1 33 33 GLY C C 33 171.600 171.600 173.474 -1.874 18128
276 1 3 . 1 1 33 33 GLY CA C 33 48.800 48.800 44.821 3.979 18128
277 1 3 . 1 1 34 34 LEU C C 34 173.500 173.500 175.975 -2.475 18128
278 1 3 . 1 1 34 34 LEU CA C 34 53.800 53.800 55.185 -1.385 18128
279 1 3 . 1 1 34 34 LEU CB C 34 45.900 45.900 45.213 0.687 18128
280 1 3 . 1 1 35 35 MET N N 35 122.100 122.100 123.865 -1.765 18128
281 1 3 . 1 1 35 35 MET C C 35 173.300 173.300 175.650 -2.350 18128
282 1 3 . 1 1 35 35 MET CA C 35 54.400 54.400 55.117 -0.717 18128
283 1 3 . 1 1 35 35 MET CB C 35 37.100 37.100 33.217 3.883 18128
284 1 3 . 1 1 36 36 VAL N N 36 124.300 124.300 125.159 -0.859 18128
285 1 3 . 1 1 36 36 VAL C C 36 175.200 175.200 176.290 -1.090 18128
286 1 3 . 1 1 36 36 VAL CA C 36 59.700 59.700 61.797 -2.097 18128
287 1 3 . 1 1 36 36 VAL CB C 36 34.900 34.900 30.089 4.811 18128
288 1 3 . 1 1 37 37 GLY N N 37 116.500 116.500 113.667 2.833 18128
289 1 3 . 1 1 37 37 GLY C C 37 171.000 171.000 174.803 -3.803 18128
290 1 3 . 1 1 37 37 GLY CA C 37 44.900 44.900 45.285 -0.385 18128
291 1 3 . 1 1 38 38 GLY N N 38 104.200 104.200 106.681 -2.481 18128
292 1 3 . 1 1 38 38 GLY C C 38 170.400 170.400 172.806 -2.406 18128
293 1 3 . 1 1 38 38 GLY CA C 38 44.800 44.800 45.229 -0.429 18128
294 1 3 . 1 1 39 39 VAL N N 39 114.700 114.700 118.388 -3.688 18128
295 1 3 . 1 1 39 39 VAL C C 39 173.200 173.200 176.301 -3.101 18128
296 1 3 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.909 0.191 18128
297 1 3 . 1 1 39 39 VAL CB C 39 35.200 35.200 33.675 1.525 18128
298 1 4 . 1 1 10 10 TYR C C 10 175.000 175.000 173.930 1.070 18128
299 1 4 . 1 1 10 10 TYR CA C 10 57.300 57.300 56.472 0.827 18128
300 1 4 . 1 1 10 10 TYR CB C 10 42.100 42.100 39.761 2.339 18128
301 1 4 . 1 1 12 12 VAL C C 12 174.600 174.600 175.296 -0.696 18128
302 1 4 . 1 1 12 12 VAL CA C 12 60.400 60.400 61.081 -0.681 18128
303 1 4 . 1 1 12 12 VAL CB C 12 35.300 35.300 33.656 1.644 18128
304 1 4 . 1 1 13 13 HIS C C 13 174.200 174.200 174.298 -0.098 18128
305 1 4 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.313 -1.113 18128
306 1 4 . 1 1 13 13 HIS CB C 13 34.800 34.800 31.253 3.547 18128
307 1 4 . 1 1 14 14 HIS C C 14 174.200 174.200 175.065 -0.865 18128
308 1 4 . 1 1 14 14 HIS CA C 14 55.400 55.400 56.022 -0.622 18128
309 1 4 . 1 1 14 14 HIS CB C 14 33.100 33.100 31.215 1.885 18128
310 1 4 . 1 1 15 15 GLN N N 15 123.800 123.800 119.476 4.324 18128
311 1 4 . 1 1 15 15 GLN C C 15 173.600 173.600 174.691 -1.091 18128
312 1 4 . 1 1 15 15 GLN CA C 15 55.000 55.000 55.089 -0.089 18128
313 1 4 . 1 1 15 15 GLN CB C 15 33.500 33.500 31.332 2.168 18128
314 1 4 . 1 1 16 16 LYS N N 16 126.400 126.400 121.126 5.274 18128
315 1 4 . 1 1 16 16 LYS C C 16 174.100 174.100 175.371 -1.271 18128
316 1 4 . 1 1 16 16 LYS CA C 16 54.700 54.700 56.449 -1.749 18128
317 1 4 . 1 1 16 16 LYS CB C 16 36.000 36.000 33.813 2.187 18128
318 1 4 . 1 1 17 17 LEU C C 17 174.600 174.600 175.795 -1.195 18128
319 1 4 . 1 1 17 17 LEU CA C 17 54.500 54.500 54.942 -0.442 18128
320 1 4 . 1 1 17 17 LEU CB C 17 46.400 46.400 43.662 2.738 18128
321 1 4 . 1 1 18 18 VAL C C 18 172.800 172.800 174.756 -1.956 18128
322 1 4 . 1 1 18 18 VAL CA C 18 60.900 60.900 61.976 -1.076 18128
323 1 4 . 1 1 18 18 VAL CB C 18 35.600 35.600 33.928 1.672 18128
324 1 4 . 1 1 19 19 PHE C C 19 171.900 171.900 175.046 -3.146 18128
325 1 4 . 1 1 19 19 PHE CA C 19 56.500 56.500 57.648 -1.148 18128
326 1 4 . 1 1 19 19 PHE CB C 19 42.600 42.600 41.671 0.929 18128
327 1 4 . 1 1 20 20 PHE C C 20 172.200 172.200 174.264 -2.064 18128
328 1 4 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.315 -1.315 18128
329 1 4 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.552 2.348 18128
330 1 4 . 1 1 21 21 ALA C C 21 175.000 175.000 176.651 -1.651 18128
331 1 4 . 1 1 21 21 ALA CA C 21 50.100 50.100 52.133 -2.034 18128
332 1 4 . 1 1 21 21 ALA CB C 21 22.700 22.700 20.380 2.320 18128
333 1 4 . 1 1 22 22 GLU C C 22 174.900 174.900 175.190 -0.290 18128
334 1 4 . 1 1 22 22 GLU CA C 22 53.900 53.900 56.432 -2.532 18128
335 1 4 . 1 1 22 22 GLU CB C 22 34.100 34.100 30.866 3.234 18128
336 1 4 . 1 1 23 23 ASP N N 23 126.900 126.900 125.732 1.168 18128
337 1 4 . 1 1 23 23 ASP C C 23 174.200 174.200 175.764 -1.564 18128
338 1 4 . 1 1 23 23 ASP CA C 23 56.800 56.800 53.618 3.182 18128
339 1 4 . 1 1 23 23 ASP CB C 23 39.200 39.200 41.384 -2.184 18128
340 1 4 . 1 1 24 24 VAL N N 24 121.200 121.200 126.852 -5.652 18128
341 1 4 . 1 1 24 24 VAL C C 24 174.500 174.500 177.617 -3.117 18128
342 1 4 . 1 1 24 24 VAL CA C 24 60.300 60.300 61.806 -1.506 18128
343 1 4 . 1 1 24 24 VAL CB C 24 32.900 32.900 32.308 0.592 18128
344 1 4 . 1 1 25 25 GLY N N 25 118.000 118.000 109.292 8.708 18128
345 1 4 . 1 1 25 25 GLY C C 25 171.300 171.300 174.237 -2.937 18128
346 1 4 . 1 1 25 25 GLY CA C 25 47.000 47.000 46.824 0.176 18128
347 1 4 . 1 1 26 26 SER N N 26 112.600 112.600 115.771 -3.171 18128
348 1 4 . 1 1 26 26 SER C C 26 174.100 174.100 172.907 1.193 18128
349 1 4 . 1 1 26 26 SER CA C 26 56.400 56.400 57.276 -0.876 18128
350 1 4 . 1 1 26 26 SER CB C 26 65.700 65.700 65.031 0.669 18128
351 1 4 . 1 1 27 27 ASN N N 27 124.000 124.000 120.600 3.400 18128
352 1 4 . 1 1 27 27 ASN C C 27 174.300 174.300 173.733 0.567 18128
353 1 4 . 1 1 27 27 ASN CA C 27 53.300 53.300 54.267 -0.967 18128
354 1 4 . 1 1 27 27 ASN CB C 27 40.400 40.400 38.806 1.594 18128
355 1 4 . 1 1 28 28 LYS N N 28 124.000 124.000 118.190 5.810 18128
356 1 4 . 1 1 28 28 LYS C C 28 173.600 173.600 176.125 -2.525 18128
357 1 4 . 1 1 28 28 LYS CA C 28 55.500 55.500 55.971 -0.471 18128
358 1 4 . 1 1 28 28 LYS CB C 28 35.000 35.000 33.375 1.625 18128
359 1 4 . 1 1 29 29 GLY N N 29 107.500 107.500 111.885 -4.385 18128
360 1 4 . 1 1 29 29 GLY C C 29 171.400 171.400 174.212 -2.812 18128
361 1 4 . 1 1 29 29 GLY CA C 29 44.000 44.000 44.951 -0.951 18128
362 1 4 . 1 1 30 30 ALA N N 30 127.800 127.800 124.858 2.942 18128
363 1 4 . 1 1 30 30 ALA C C 30 174.800 174.800 176.452 -1.652 18128
364 1 4 . 1 1 30 30 ALA CA C 30 49.900 49.900 51.256 -1.356 18128
365 1 4 . 1 1 30 30 ALA CB C 30 22.700 22.700 20.631 2.069 18128
366 1 4 . 1 1 31 31 ILE N N 31 117.900 117.900 118.984 -1.084 18128
367 1 4 . 1 1 31 31 ILE C C 31 174.100 174.100 175.018 -0.918 18128
368 1 4 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.735 0.065 18128
369 1 4 . 1 1 31 31 ILE CB C 31 40.200 40.200 39.587 0.613 18128
370 1 4 . 1 1 32 32 ILE C C 32 174.800 174.800 175.763 -0.963 18128
371 1 4 . 1 1 32 32 ILE CA C 32 58.200 58.200 61.138 -2.938 18128
372 1 4 . 1 1 32 32 ILE CB C 32 42.400 42.400 38.605 3.795 18128
373 1 4 . 1 1 33 33 GLY N N 33 110.800 110.800 115.471 -4.671 18128
374 1 4 . 1 1 33 33 GLY C C 33 171.600 171.600 173.339 -1.739 18128
375 1 4 . 1 1 33 33 GLY CA C 33 48.800 48.800 45.274 3.526 18128
376 1 4 . 1 1 34 34 LEU C C 34 173.500 173.500 175.153 -1.653 18128
377 1 4 . 1 1 34 34 LEU CA C 34 53.800 53.800 54.030 -0.230 18128
378 1 4 . 1 1 34 34 LEU CB C 34 45.900 45.900 42.990 2.910 18128
379 1 4 . 1 1 35 35 MET N N 35 122.100 122.100 121.399 0.701 18128
380 1 4 . 1 1 35 35 MET C C 35 173.300 173.300 175.636 -2.336 18128
381 1 4 . 1 1 35 35 MET CA C 35 54.400 54.400 54.907 -0.506 18128
382 1 4 . 1 1 35 35 MET CB C 35 37.100 37.100 34.349 2.751 18128
383 1 4 . 1 1 36 36 VAL N N 36 124.300 124.300 125.557 -1.257 18128
384 1 4 . 1 1 36 36 VAL C C 36 175.200 175.200 175.585 -0.385 18128
385 1 4 . 1 1 36 36 VAL CA C 36 59.700 59.700 62.344 -2.644 18128
386 1 4 . 1 1 36 36 VAL CB C 36 34.900 34.900 29.445 5.455 18128
387 1 4 . 1 1 37 37 GLY N N 37 116.500 116.500 112.841 3.659 18128
388 1 4 . 1 1 37 37 GLY C C 37 171.000 171.000 174.287 -3.287 18128
389 1 4 . 1 1 37 37 GLY CA C 37 44.900 44.900 44.875 0.025 18128
390 1 4 . 1 1 38 38 GLY N N 38 104.200 104.200 107.850 -3.650 18128
391 1 4 . 1 1 38 38 GLY C C 38 170.400 170.400 173.520 -3.120 18128
392 1 4 . 1 1 38 38 GLY CA C 38 44.800 44.800 44.309 0.491 18128
393 1 4 . 1 1 39 39 VAL N N 39 114.700 114.700 119.342 -4.642 18128
394 1 4 . 1 1 39 39 VAL C C 39 173.200 173.200 174.496 -1.296 18128
395 1 4 . 1 1 39 39 VAL CA C 39 61.100 61.100 61.796 -0.696 18128
396 1 4 . 1 1 39 39 VAL CB C 39 35.200 35.200 34.360 0.840 18128
397 1 5 . 1 1 10 10 TYR C C 10 175.000 175.000 175.435 -0.435 18128
398 1 5 . 1 1 10 10 TYR CA C 10 57.300 57.300 57.053 0.247 18128
399 1 5 . 1 1 10 10 TYR CB C 10 42.100 42.100 39.121 2.979 18128
400 1 5 . 1 1 12 12 VAL C C 12 174.600 174.600 175.259 -0.659 18128
401 1 5 . 1 1 12 12 VAL CA C 12 60.400 60.400 61.811 -1.411 18128
402 1 5 . 1 1 12 12 VAL CB C 12 35.300 35.300 33.100 2.200 18128
403 1 5 . 1 1 13 13 HIS C C 13 174.200 174.200 174.501 -0.301 18128
404 1 5 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.286 -1.087 18128
405 1 5 . 1 1 13 13 HIS CB C 13 34.800 34.800 30.573 4.228 18128
406 1 5 . 1 1 14 14 HIS C C 14 174.200 174.200 174.657 -0.457 18128
407 1 5 . 1 1 14 14 HIS CA C 14 55.400 55.400 56.421 -1.021 18128
408 1 5 . 1 1 14 14 HIS CB C 14 33.100 33.100 30.861 2.239 18128
409 1 5 . 1 1 15 15 GLN N N 15 123.800 123.800 119.334 4.466 18128
410 1 5 . 1 1 15 15 GLN C C 15 173.600 173.600 174.293 -0.693 18128
411 1 5 . 1 1 15 15 GLN CA C 15 55.000 55.000 55.055 -0.055 18128
412 1 5 . 1 1 15 15 GLN CB C 15 33.500 33.500 31.004 2.496 18128
413 1 5 . 1 1 16 16 LYS N N 16 126.400 126.400 121.410 4.990 18128
414 1 5 . 1 1 16 16 LYS C C 16 174.100 174.100 175.365 -1.265 18128
415 1 5 . 1 1 16 16 LYS CA C 16 54.700 54.700 56.442 -1.742 18128
416 1 5 . 1 1 16 16 LYS CB C 16 36.000 36.000 33.618 2.381 18128
417 1 5 . 1 1 17 17 LEU C C 17 174.600 174.600 175.711 -1.111 18128
418 1 5 . 1 1 17 17 LEU CA C 17 54.500 54.500 54.405 0.095 18128
419 1 5 . 1 1 17 17 LEU CB C 17 46.400 46.400 43.032 3.368 18128
420 1 5 . 1 1 18 18 VAL C C 18 172.800 172.800 174.340 -1.540 18128
421 1 5 . 1 1 18 18 VAL CA C 18 60.900 60.900 61.659 -0.759 18128
422 1 5 . 1 1 18 18 VAL CB C 18 35.600 35.600 34.005 1.595 18128
423 1 5 . 1 1 19 19 PHE C C 19 171.900 171.900 174.932 -3.032 18128
424 1 5 . 1 1 19 19 PHE CA C 19 56.500 56.500 57.636 -1.136 18128
425 1 5 . 1 1 19 19 PHE CB C 19 42.600 42.600 41.358 1.242 18128
426 1 5 . 1 1 20 20 PHE C C 20 172.200 172.200 174.343 -2.143 18128
427 1 5 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.252 -1.252 18128
428 1 5 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.597 2.303 18128
429 1 5 . 1 1 21 21 ALA C C 21 175.000 175.000 176.875 -1.875 18128
430 1 5 . 1 1 21 21 ALA CA C 21 50.100 50.100 52.140 -2.040 18128
431 1 5 . 1 1 21 21 ALA CB C 21 22.700 22.700 19.780 2.920 18128
432 1 5 . 1 1 22 22 GLU C C 22 174.900 174.900 174.460 0.440 18128
433 1 5 . 1 1 22 22 GLU CA C 22 53.900 53.900 57.181 -3.281 18128
434 1 5 . 1 1 22 22 GLU CB C 22 34.100 34.100 31.254 2.846 18128
435 1 5 . 1 1 23 23 ASP N N 23 126.900 126.900 125.227 1.673 18128
436 1 5 . 1 1 23 23 ASP C C 23 174.200 174.200 175.915 -1.715 18128
437 1 5 . 1 1 23 23 ASP CA C 23 56.800 56.800 53.705 3.095 18128
438 1 5 . 1 1 23 23 ASP CB C 23 39.200 39.200 42.331 -3.131 18128
439 1 5 . 1 1 24 24 VAL N N 24 121.200 121.200 123.988 -2.788 18128
440 1 5 . 1 1 24 24 VAL C C 24 174.500 174.500 176.422 -1.922 18128
441 1 5 . 1 1 24 24 VAL CA C 24 60.300 60.300 63.612 -3.312 18128
442 1 5 . 1 1 24 24 VAL CB C 24 32.900 32.900 32.245 0.655 18128
443 1 5 . 1 1 25 25 GLY N N 25 118.000 118.000 115.132 2.868 18128
444 1 5 . 1 1 25 25 GLY C C 25 171.300 171.300 173.169 -1.869 18128
445 1 5 . 1 1 25 25 GLY CA C 25 47.000 47.000 45.361 1.639 18128
446 1 5 . 1 1 26 26 SER N N 26 112.600 112.600 115.447 -2.847 18128
447 1 5 . 1 1 26 26 SER C C 26 174.100 174.100 173.253 0.847 18128
448 1 5 . 1 1 26 26 SER CA C 26 56.400 56.400 57.480 -1.080 18128
449 1 5 . 1 1 26 26 SER CB C 26 65.700 65.700 63.615 2.085 18128
450 1 5 . 1 1 27 27 ASN N N 27 124.000 124.000 120.946 3.054 18128
451 1 5 . 1 1 27 27 ASN C C 27 174.300 174.300 174.477 -0.177 18128
452 1 5 . 1 1 27 27 ASN CA C 27 53.300 53.300 54.014 -0.714 18128
453 1 5 . 1 1 27 27 ASN CB C 27 40.400 40.400 38.893 1.507 18128
454 1 5 . 1 1 28 28 LYS N N 28 124.000 124.000 118.671 5.329 18128
455 1 5 . 1 1 28 28 LYS C C 28 173.600 173.600 175.934 -2.334 18128
456 1 5 . 1 1 28 28 LYS CA C 28 55.500 55.500 56.246 -0.746 18128
457 1 5 . 1 1 28 28 LYS CB C 28 35.000 35.000 33.183 1.817 18128
458 1 5 . 1 1 29 29 GLY N N 29 107.500 107.500 112.325 -4.825 18128
459 1 5 . 1 1 29 29 GLY C C 29 171.400 171.400 174.239 -2.839 18128
460 1 5 . 1 1 29 29 GLY CA C 29 44.000 44.000 45.100 -1.100 18128
461 1 5 . 1 1 30 30 ALA N N 30 127.800 127.800 127.639 0.161 18128
462 1 5 . 1 1 30 30 ALA C C 30 174.800 174.800 176.905 -2.105 18128
463 1 5 . 1 1 30 30 ALA CA C 30 49.900 49.900 51.824 -1.924 18128
464 1 5 . 1 1 30 30 ALA CB C 30 22.700 22.700 20.164 2.536 18128
465 1 5 . 1 1 31 31 ILE N N 31 117.900 117.900 118.856 -0.956 18128
466 1 5 . 1 1 31 31 ILE C C 31 174.100 174.100 175.174 -1.074 18128
467 1 5 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.907 -0.107 18128
468 1 5 . 1 1 31 31 ILE CB C 31 40.200 40.200 38.908 1.292 18128
469 1 5 . 1 1 32 32 ILE C C 32 174.800 174.800 176.082 -1.282 18128
470 1 5 . 1 1 32 32 ILE CA C 32 58.200 58.200 61.133 -2.933 18128
471 1 5 . 1 1 32 32 ILE CB C 32 42.400 42.400 38.547 3.853 18128
472 1 5 . 1 1 33 33 GLY N N 33 110.800 110.800 115.604 -4.804 18128
473 1 5 . 1 1 33 33 GLY C C 33 171.600 171.600 173.544 -1.944 18128
474 1 5 . 1 1 33 33 GLY CA C 33 48.800 48.800 45.019 3.781 18128
475 1 5 . 1 1 34 34 LEU C C 34 173.500 173.500 176.788 -3.288 18128
476 1 5 . 1 1 34 34 LEU CA C 34 53.800 53.800 54.130 -0.330 18128
477 1 5 . 1 1 34 34 LEU CB C 34 45.900 45.900 44.458 1.442 18128
478 1 5 . 1 1 35 35 MET N N 35 122.100 122.100 122.126 -0.026 18128
479 1 5 . 1 1 35 35 MET C C 35 173.300 173.300 175.769 -2.469 18128
480 1 5 . 1 1 35 35 MET CA C 35 54.400 54.400 54.635 -0.235 18128
481 1 5 . 1 1 35 35 MET CB C 35 37.100 37.100 31.849 5.251 18128
482 1 5 . 1 1 36 36 VAL N N 36 124.300 124.300 126.231 -1.931 18128
483 1 5 . 1 1 36 36 VAL C C 36 175.200 175.200 175.851 -0.651 18128
484 1 5 . 1 1 36 36 VAL CA C 36 59.700 59.700 61.882 -2.182 18128
485 1 5 . 1 1 36 36 VAL CB C 36 34.900 34.900 30.246 4.654 18128
486 1 5 . 1 1 37 37 GLY N N 37 116.500 116.500 112.630 3.870 18128
487 1 5 . 1 1 37 37 GLY C C 37 171.000 171.000 174.084 -3.084 18128
488 1 5 . 1 1 37 37 GLY CA C 37 44.900 44.900 45.117 -0.217 18128
489 1 5 . 1 1 38 38 GLY N N 38 104.200 104.200 110.372 -6.172 18128
490 1 5 . 1 1 38 38 GLY C C 38 170.400 170.400 172.763 -2.363 18128
491 1 5 . 1 1 38 38 GLY CA C 38 44.800 44.800 45.584 -0.784 18128
492 1 5 . 1 1 39 39 VAL N N 39 114.700 114.700 121.723 -7.023 18128
493 1 5 . 1 1 39 39 VAL C C 39 173.200 173.200 174.451 -1.251 18128
494 1 5 . 1 1 39 39 VAL CA C 39 61.100 61.100 61.469 -0.369 18128
495 1 5 . 1 1 39 39 VAL CB C 39 35.200 35.200 34.227 0.973 18128
496 1 6 . 1 1 10 10 TYR C C 10 175.000 175.000 174.710 0.290 18128
497 1 6 . 1 1 10 10 TYR CA C 10 57.300 57.300 57.288 0.012 18128
498 1 6 . 1 1 10 10 TYR CB C 10 42.100 42.100 40.518 1.582 18128
499 1 6 . 1 1 12 12 VAL C C 12 174.600 174.600 174.645 -0.045 18128
500 1 6 . 1 1 12 12 VAL CA C 12 60.400 60.400 61.448 -1.048 18128
501 1 6 . 1 1 12 12 VAL CB C 12 35.300 35.300 34.666 0.634 18128
502 1 6 . 1 1 13 13 HIS C C 13 174.200 174.200 174.061 0.139 18128
503 1 6 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.567 -1.367 18128
504 1 6 . 1 1 13 13 HIS CB C 13 34.800 34.800 31.738 3.062 18128
505 1 6 . 1 1 14 14 HIS C C 14 174.200 174.200 173.668 0.532 18128
506 1 6 . 1 1 14 14 HIS CA C 14 55.400 55.400 55.103 0.297 18128
507 1 6 . 1 1 14 14 HIS CB C 14 33.100 33.100 31.744 1.356 18128
508 1 6 . 1 1 15 15 GLN N N 15 123.800 123.800 118.822 4.978 18128
509 1 6 . 1 1 15 15 GLN C C 15 173.600 173.600 174.337 -0.737 18128
510 1 6 . 1 1 15 15 GLN CA C 15 55.000 55.000 55.163 -0.163 18128
511 1 6 . 1 1 15 15 GLN CB C 15 33.500 33.500 31.435 2.065 18128
512 1 6 . 1 1 16 16 LYS N N 16 126.400 126.400 121.106 5.294 18128
513 1 6 . 1 1 16 16 LYS C C 16 174.100 174.100 175.341 -1.241 18128
514 1 6 . 1 1 16 16 LYS CA C 16 54.700 54.700 56.210 -1.510 18128
515 1 6 . 1 1 16 16 LYS CB C 16 36.000 36.000 33.951 2.049 18128
516 1 6 . 1 1 17 17 LEU C C 17 174.600 174.600 175.912 -1.312 18128
517 1 6 . 1 1 17 17 LEU CA C 17 54.500 54.500 54.666 -0.166 18128
518 1 6 . 1 1 17 17 LEU CB C 17 46.400 46.400 43.287 3.113 18128
519 1 6 . 1 1 18 18 VAL C C 18 172.800 172.800 174.838 -2.038 18128
520 1 6 . 1 1 18 18 VAL CA C 18 60.900 60.900 61.774 -0.874 18128
521 1 6 . 1 1 18 18 VAL CB C 18 35.600 35.600 33.527 2.073 18128
522 1 6 . 1 1 19 19 PHE C C 19 171.900 171.900 175.172 -3.272 18128
523 1 6 . 1 1 19 19 PHE CA C 19 56.500 56.500 57.472 -0.972 18128
524 1 6 . 1 1 19 19 PHE CB C 19 42.600 42.600 41.431 1.169 18128
525 1 6 . 1 1 20 20 PHE C C 20 172.200 172.200 174.322 -2.122 18128
526 1 6 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.242 -1.242 18128
527 1 6 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.504 2.396 18128
528 1 6 . 1 1 21 21 ALA C C 21 175.000 175.000 176.609 -1.609 18128
529 1 6 . 1 1 21 21 ALA CA C 21 50.100 50.100 51.927 -1.827 18128
530 1 6 . 1 1 21 21 ALA CB C 21 22.700 22.700 20.608 2.092 18128
531 1 6 . 1 1 22 22 GLU C C 22 174.900 174.900 175.105 -0.205 18128
532 1 6 . 1 1 22 22 GLU CA C 22 53.900 53.900 55.412 -1.512 18128
533 1 6 . 1 1 22 22 GLU CB C 22 34.100 34.100 31.112 2.988 18128
534 1 6 . 1 1 23 23 ASP N N 23 126.900 126.900 121.770 5.130 18128
535 1 6 . 1 1 23 23 ASP C C 23 174.200 174.200 176.547 -2.347 18128
536 1 6 . 1 1 23 23 ASP CA C 23 56.800 56.800 53.746 3.054 18128
537 1 6 . 1 1 23 23 ASP CB C 23 39.200 39.200 40.898 -1.698 18128
538 1 6 . 1 1 24 24 VAL N N 24 121.200 121.200 126.123 -4.923 18128
539 1 6 . 1 1 24 24 VAL C C 24 174.500 174.500 176.945 -2.445 18128
540 1 6 . 1 1 24 24 VAL CA C 24 60.300 60.300 62.958 -2.658 18128
541 1 6 . 1 1 24 24 VAL CB C 24 32.900 32.900 31.654 1.246 18128
542 1 6 . 1 1 25 25 GLY N N 25 118.000 118.000 108.020 9.980 18128
543 1 6 . 1 1 25 25 GLY C C 25 171.300 171.300 175.017 -3.717 18128
544 1 6 . 1 1 25 25 GLY CA C 25 47.000 47.000 45.474 1.526 18128
545 1 6 . 1 1 26 26 SER N N 26 112.600 112.600 117.024 -4.424 18128
546 1 6 . 1 1 26 26 SER C C 26 174.100 174.100 174.146 -0.046 18128
547 1 6 . 1 1 26 26 SER CA C 26 56.400 56.400 57.970 -1.570 18128
548 1 6 . 1 1 26 26 SER CB C 26 65.700 65.700 63.536 2.164 18128
549 1 6 . 1 1 27 27 ASN N N 27 124.000 124.000 118.870 5.130 18128
550 1 6 . 1 1 27 27 ASN C C 27 174.300 174.300 175.286 -0.986 18128
551 1 6 . 1 1 27 27 ASN CA C 27 53.300 53.300 53.696 -0.396 18128
552 1 6 . 1 1 27 27 ASN CB C 27 40.400 40.400 39.084 1.316 18128
553 1 6 . 1 1 28 28 LYS N N 28 124.000 124.000 120.656 3.344 18128
554 1 6 . 1 1 28 28 LYS C C 28 173.600 173.600 176.932 -3.332 18128
555 1 6 . 1 1 28 28 LYS CA C 28 55.500 55.500 57.080 -1.580 18128
556 1 6 . 1 1 28 28 LYS CB C 28 35.000 35.000 32.734 2.266 18128
557 1 6 . 1 1 29 29 GLY N N 29 107.500 107.500 112.284 -4.784 18128
558 1 6 . 1 1 29 29 GLY C C 29 171.400 171.400 173.151 -1.751 18128
559 1 6 . 1 1 29 29 GLY CA C 29 44.000 44.000 44.836 -0.836 18128
560 1 6 . 1 1 30 30 ALA N N 30 127.800 127.800 126.404 1.396 18128
561 1 6 . 1 1 30 30 ALA C C 30 174.800 174.800 176.018 -1.218 18128
562 1 6 . 1 1 30 30 ALA CA C 30 49.900 49.900 51.784 -1.884 18128
563 1 6 . 1 1 30 30 ALA CB C 30 22.700 22.700 21.179 1.521 18128
564 1 6 . 1 1 31 31 ILE N N 31 117.900 117.900 120.148 -2.248 18128
565 1 6 . 1 1 31 31 ILE C C 31 174.100 174.100 174.930 -0.830 18128
566 1 6 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.930 -0.130 18128
567 1 6 . 1 1 31 31 ILE CB C 31 40.200 40.200 39.520 0.680 18128
568 1 6 . 1 1 32 32 ILE C C 32 174.800 174.800 175.856 -1.056 18128
569 1 6 . 1 1 32 32 ILE CA C 32 58.200 58.200 61.257 -3.057 18128
570 1 6 . 1 1 32 32 ILE CB C 32 42.400 42.400 39.201 3.199 18128
571 1 6 . 1 1 33 33 GLY N N 33 110.800 110.800 115.828 -5.028 18128
572 1 6 . 1 1 33 33 GLY C C 33 171.600 171.600 173.665 -2.065 18128
573 1 6 . 1 1 33 33 GLY CA C 33 48.800 48.800 44.979 3.821 18128
574 1 6 . 1 1 34 34 LEU C C 34 173.500 173.500 176.286 -2.786 18128
575 1 6 . 1 1 34 34 LEU CA C 34 53.800 53.800 54.698 -0.898 18128
576 1 6 . 1 1 34 34 LEU CB C 34 45.900 45.900 44.959 0.941 18128
577 1 6 . 1 1 35 35 MET N N 35 122.100 122.100 122.766 -0.666 18128
578 1 6 . 1 1 35 35 MET C C 35 173.300 173.300 175.959 -2.659 18128
579 1 6 . 1 1 35 35 MET CA C 35 54.400 54.400 54.995 -0.595 18128
580 1 6 . 1 1 35 35 MET CB C 35 37.100 37.100 33.691 3.409 18128
581 1 6 . 1 1 36 36 VAL N N 36 124.300 124.300 126.736 -2.436 18128
582 1 6 . 1 1 36 36 VAL C C 36 175.200 175.200 175.535 -0.335 18128
583 1 6 . 1 1 36 36 VAL CA C 36 59.700 59.700 61.633 -1.933 18128
584 1 6 . 1 1 36 36 VAL CB C 36 34.900 34.900 29.955 4.945 18128
585 1 6 . 1 1 37 37 GLY N N 37 116.500 116.500 111.469 5.031 18128
586 1 6 . 1 1 37 37 GLY C C 37 171.000 171.000 174.581 -3.581 18128
587 1 6 . 1 1 37 37 GLY CA C 37 44.900 44.900 44.935 -0.035 18128
588 1 6 . 1 1 38 38 GLY N N 38 104.200 104.200 110.330 -6.130 18128
589 1 6 . 1 1 38 38 GLY C C 38 170.400 170.400 173.615 -3.215 18128
590 1 6 . 1 1 38 38 GLY CA C 38 44.800 44.800 45.014 -0.214 18128
591 1 6 . 1 1 39 39 VAL N N 39 114.700 114.700 120.312 -5.612 18128
592 1 6 . 1 1 39 39 VAL C C 39 173.200 173.200 175.569 -2.369 18128
593 1 6 . 1 1 39 39 VAL CA C 39 61.100 61.100 61.109 -0.009 18128
594 1 6 . 1 1 39 39 VAL CB C 39 35.200 35.200 34.446 0.754 18128
595 1 7 . 1 1 10 10 TYR C C 10 175.000 175.000 175.226 -0.226 18128
596 1 7 . 1 1 10 10 TYR CA C 10 57.300 57.300 57.691 -0.391 18128
597 1 7 . 1 1 10 10 TYR CB C 10 42.100 42.100 39.242 2.858 18128
598 1 7 . 1 1 12 12 VAL C C 12 174.600 174.600 174.677 -0.077 18128
599 1 7 . 1 1 12 12 VAL CA C 12 60.400 60.400 61.266 -0.866 18128
600 1 7 . 1 1 12 12 VAL CB C 12 35.300 35.300 34.105 1.195 18128
601 1 7 . 1 1 13 13 HIS C C 13 174.200 174.200 173.972 0.228 18128
602 1 7 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.801 -1.601 18128
603 1 7 . 1 1 13 13 HIS CB C 13 34.800 34.800 30.896 3.904 18128
604 1 7 . 1 1 14 14 HIS C C 14 174.200 174.200 173.854 0.346 18128
605 1 7 . 1 1 14 14 HIS CA C 14 55.400 55.400 55.409 -0.009 18128
606 1 7 . 1 1 14 14 HIS CB C 14 33.100 33.100 31.255 1.845 18128
607 1 7 . 1 1 15 15 GLN N N 15 123.800 123.800 119.235 4.565 18128
608 1 7 . 1 1 15 15 GLN C C 15 173.600 173.600 174.327 -0.727 18128
609 1 7 . 1 1 15 15 GLN CA C 15 55.000 55.000 55.131 -0.131 18128
610 1 7 . 1 1 15 15 GLN CB C 15 33.500 33.500 31.637 1.863 18128
611 1 7 . 1 1 16 16 LYS N N 16 126.400 126.400 121.503 4.897 18128
612 1 7 . 1 1 16 16 LYS C C 16 174.100 174.100 175.162 -1.062 18128
613 1 7 . 1 1 16 16 LYS CA C 16 54.700 54.700 56.763 -2.063 18128
614 1 7 . 1 1 16 16 LYS CB C 16 36.000 36.000 33.590 2.410 18128
615 1 7 . 1 1 17 17 LEU C C 17 174.600 174.600 176.235 -1.635 18128
616 1 7 . 1 1 17 17 LEU CA C 17 54.500 54.500 54.659 -0.159 18128
617 1 7 . 1 1 17 17 LEU CB C 17 46.400 46.400 43.301 3.099 18128
618 1 7 . 1 1 18 18 VAL C C 18 172.800 172.800 175.192 -2.392 18128
619 1 7 . 1 1 18 18 VAL CA C 18 60.900 60.900 62.227 -1.327 18128
620 1 7 . 1 1 18 18 VAL CB C 18 35.600 35.600 33.436 2.164 18128
621 1 7 . 1 1 19 19 PHE C C 19 171.900 171.900 174.596 -2.696 18128
622 1 7 . 1 1 19 19 PHE CA C 19 56.500 56.500 57.915 -1.415 18128
623 1 7 . 1 1 19 19 PHE CB C 19 42.600 42.600 40.876 1.724 18128
624 1 7 . 1 1 20 20 PHE C C 20 172.200 172.200 173.594 -1.394 18128
625 1 7 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.675 -1.675 18128
626 1 7 . 1 1 20 20 PHE CB C 20 42.900 42.900 41.147 1.753 18128
627 1 7 . 1 1 21 21 ALA C C 21 175.000 175.000 175.289 -0.289 18128
628 1 7 . 1 1 21 21 ALA CA C 21 50.100 50.100 51.469 -1.369 18128
629 1 7 . 1 1 21 21 ALA CB C 21 22.700 22.700 20.352 2.348 18128
630 1 7 . 1 1 22 22 GLU C C 22 174.900 174.900 174.847 0.053 18128
631 1 7 . 1 1 22 22 GLU CA C 22 53.900 53.900 56.526 -2.626 18128
632 1 7 . 1 1 22 22 GLU CB C 22 34.100 34.100 30.994 3.106 18128
633 1 7 . 1 1 23 23 ASP N N 23 126.900 126.900 126.063 0.837 18128
634 1 7 . 1 1 23 23 ASP C C 23 174.200 174.200 176.751 -2.551 18128
635 1 7 . 1 1 23 23 ASP CA C 23 56.800 56.800 53.471 3.329 18128
636 1 7 . 1 1 23 23 ASP CB C 23 39.200 39.200 42.535 -3.335 18128
637 1 7 . 1 1 24 24 VAL N N 24 121.200 121.200 121.087 0.113 18128
638 1 7 . 1 1 24 24 VAL C C 24 174.500 174.500 177.736 -3.236 18128
639 1 7 . 1 1 24 24 VAL CA C 24 60.300 60.300 63.230 -2.930 18128
640 1 7 . 1 1 24 24 VAL CB C 24 32.900 32.900 31.640 1.260 18128
641 1 7 . 1 1 25 25 GLY N N 25 118.000 118.000 109.539 8.461 18128
642 1 7 . 1 1 25 25 GLY C C 25 171.300 171.300 174.561 -3.261 18128
643 1 7 . 1 1 25 25 GLY CA C 25 47.000 47.000 46.227 0.773 18128
644 1 7 . 1 1 26 26 SER N N 26 112.600 112.600 115.220 -2.620 18128
645 1 7 . 1 1 26 26 SER C C 26 174.100 174.100 172.963 1.137 18128
646 1 7 . 1 1 26 26 SER CA C 26 56.400 56.400 57.529 -1.129 18128
647 1 7 . 1 1 26 26 SER CB C 26 65.700 65.700 63.969 1.731 18128
648 1 7 . 1 1 27 27 ASN N N 27 124.000 124.000 120.489 3.511 18128
649 1 7 . 1 1 27 27 ASN C C 27 174.300 174.300 173.579 0.721 18128
650 1 7 . 1 1 27 27 ASN CA C 27 53.300 53.300 54.562 -1.262 18128
651 1 7 . 1 1 27 27 ASN CB C 27 40.400 40.400 38.757 1.643 18128
652 1 7 . 1 1 28 28 LYS N N 28 124.000 124.000 116.429 7.571 18128
653 1 7 . 1 1 28 28 LYS C C 28 173.600 173.600 175.783 -2.183 18128
654 1 7 . 1 1 28 28 LYS CA C 28 55.500 55.500 56.066 -0.566 18128
655 1 7 . 1 1 28 28 LYS CB C 28 35.000 35.000 32.917 2.083 18128
656 1 7 . 1 1 29 29 GLY N N 29 107.500 107.500 111.860 -4.360 18128
657 1 7 . 1 1 29 29 GLY C C 29 171.400 171.400 174.267 -2.867 18128
658 1 7 . 1 1 29 29 GLY CA C 29 44.000 44.000 45.187 -1.187 18128
659 1 7 . 1 1 30 30 ALA N N 30 127.800 127.800 127.774 0.026 18128
660 1 7 . 1 1 30 30 ALA C C 30 174.800 174.800 176.847 -2.047 18128
661 1 7 . 1 1 30 30 ALA CA C 30 49.900 49.900 51.818 -1.918 18128
662 1 7 . 1 1 30 30 ALA CB C 30 22.700 22.700 20.167 2.533 18128
663 1 7 . 1 1 31 31 ILE N N 31 117.900 117.900 118.676 -0.776 18128
664 1 7 . 1 1 31 31 ILE C C 31 174.100 174.100 174.910 -0.810 18128
665 1 7 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.915 -0.115 18128
666 1 7 . 1 1 31 31 ILE CB C 31 40.200 40.200 38.886 1.313 18128
667 1 7 . 1 1 32 32 ILE C C 32 174.800 174.800 175.467 -0.667 18128
668 1 7 . 1 1 32 32 ILE CA C 32 58.200 58.200 61.311 -3.111 18128
669 1 7 . 1 1 32 32 ILE CB C 32 42.400 42.400 38.733 3.667 18128
670 1 7 . 1 1 33 33 GLY N N 33 110.800 110.800 115.666 -4.866 18128
671 1 7 . 1 1 33 33 GLY C C 33 171.600 171.600 173.374 -1.774 18128
672 1 7 . 1 1 33 33 GLY CA C 33 48.800 48.800 45.050 3.751 18128
673 1 7 . 1 1 34 34 LEU C C 34 173.500 173.500 175.187 -1.687 18128
674 1 7 . 1 1 34 34 LEU CA C 34 53.800 53.800 54.261 -0.461 18128
675 1 7 . 1 1 34 34 LEU CB C 34 45.900 45.900 42.904 2.997 18128
676 1 7 . 1 1 35 35 MET N N 35 122.100 122.100 119.776 2.324 18128
677 1 7 . 1 1 35 35 MET C C 35 173.300 173.300 174.214 -0.914 18128
678 1 7 . 1 1 35 35 MET CA C 35 54.400 54.400 54.788 -0.388 18128
679 1 7 . 1 1 35 35 MET CB C 35 37.100 37.100 35.189 1.911 18128
680 1 7 . 1 1 36 36 VAL N N 36 124.300 124.300 122.709 1.591 18128
681 1 7 . 1 1 36 36 VAL C C 36 175.200 175.200 175.540 -0.340 18128
682 1 7 . 1 1 36 36 VAL CA C 36 59.700 59.700 61.953 -2.253 18128
683 1 7 . 1 1 36 36 VAL CB C 36 34.900 34.900 30.122 4.778 18128
684 1 7 . 1 1 37 37 GLY N N 37 116.500 116.500 112.586 3.914 18128
685 1 7 . 1 1 37 37 GLY C C 37 171.000 171.000 174.757 -3.757 18128
686 1 7 . 1 1 37 37 GLY CA C 37 44.900 44.900 44.882 0.018 18128
687 1 7 . 1 1 38 38 GLY N N 38 104.200 104.200 110.547 -6.347 18128
688 1 7 . 1 1 38 38 GLY C C 38 170.400 170.400 173.262 -2.862 18128
689 1 7 . 1 1 38 38 GLY CA C 38 44.800 44.800 44.345 0.455 18128
690 1 7 . 1 1 39 39 VAL N N 39 114.700 114.700 116.940 -2.240 18128
691 1 7 . 1 1 39 39 VAL C C 39 173.200 173.200 175.593 -2.393 18128
692 1 7 . 1 1 39 39 VAL CA C 39 61.100 61.100 61.184 -0.084 18128
693 1 7 . 1 1 39 39 VAL CB C 39 35.200 35.200 33.512 1.688 18128
694 1 8 . 1 1 10 10 TYR C C 10 175.000 175.000 175.080 -0.080 18128
695 1 8 . 1 1 10 10 TYR CA C 10 57.300 57.300 57.481 -0.181 18128
696 1 8 . 1 1 10 10 TYR CB C 10 42.100 42.100 39.785 2.315 18128
697 1 8 . 1 1 12 12 VAL C C 12 174.600 174.600 174.108 0.492 18128
698 1 8 . 1 1 12 12 VAL CA C 12 60.400 60.400 61.591 -1.191 18128
699 1 8 . 1 1 12 12 VAL CB C 12 35.300 35.300 34.093 1.208 18128
700 1 8 . 1 1 13 13 HIS C C 13 174.200 174.200 173.198 1.002 18128
701 1 8 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.353 -1.153 18128
702 1 8 . 1 1 13 13 HIS CB C 13 34.800 34.800 31.575 3.225 18128
703 1 8 . 1 1 14 14 HIS C C 14 174.200 174.200 174.357 -0.157 18128
704 1 8 . 1 1 14 14 HIS CA C 14 55.400 55.400 55.227 0.173 18128
705 1 8 . 1 1 14 14 HIS CB C 14 33.100 33.100 32.989 0.111 18128
706 1 8 . 1 1 15 15 GLN N N 15 123.800 123.800 119.926 3.874 18128
707 1 8 . 1 1 15 15 GLN C C 15 173.600 173.600 175.187 -1.587 18128
708 1 8 . 1 1 15 15 GLN CA C 15 55.000 55.000 55.157 -0.157 18128
709 1 8 . 1 1 15 15 GLN CB C 15 33.500 33.500 30.308 3.192 18128
710 1 8 . 1 1 16 16 LYS N N 16 126.400 126.400 120.982 5.418 18128
711 1 8 . 1 1 16 16 LYS C C 16 174.100 174.100 175.736 -1.636 18128
712 1 8 . 1 1 16 16 LYS CA C 16 54.700 54.700 55.812 -1.111 18128
713 1 8 . 1 1 16 16 LYS CB C 16 36.000 36.000 33.541 2.459 18128
714 1 8 . 1 1 17 17 LEU C C 17 174.600 174.600 176.205 -1.605 18128
715 1 8 . 1 1 17 17 LEU CA C 17 54.500 54.500 54.448 0.052 18128
716 1 8 . 1 1 17 17 LEU CB C 17 46.400 46.400 42.963 3.437 18128
717 1 8 . 1 1 18 18 VAL C C 18 172.800 172.800 174.895 -2.095 18128
718 1 8 . 1 1 18 18 VAL CA C 18 60.900 60.900 61.946 -1.046 18128
719 1 8 . 1 1 18 18 VAL CB C 18 35.600 35.600 33.419 2.181 18128
720 1 8 . 1 1 19 19 PHE C C 19 171.900 171.900 175.077 -3.177 18128
721 1 8 . 1 1 19 19 PHE CA C 19 56.500 56.500 57.689 -1.189 18128
722 1 8 . 1 1 19 19 PHE CB C 19 42.600 42.600 41.208 1.392 18128
723 1 8 . 1 1 20 20 PHE C C 20 172.200 172.200 174.186 -1.986 18128
724 1 8 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.194 -1.194 18128
725 1 8 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.917 1.983 18128
726 1 8 . 1 1 21 21 ALA C C 21 175.000 175.000 176.406 -1.406 18128
727 1 8 . 1 1 21 21 ALA CA C 21 50.100 50.100 52.241 -2.141 18128
728 1 8 . 1 1 21 21 ALA CB C 21 22.700 22.700 20.194 2.506 18128
729 1 8 . 1 1 22 22 GLU C C 22 174.900 174.900 174.972 -0.072 18128
730 1 8 . 1 1 22 22 GLU CA C 22 53.900 53.900 57.006 -3.106 18128
731 1 8 . 1 1 22 22 GLU CB C 22 34.100 34.100 30.566 3.534 18128
732 1 8 . 1 1 23 23 ASP N N 23 126.900 126.900 125.382 1.518 18128
733 1 8 . 1 1 23 23 ASP C C 23 174.200 174.200 175.304 -1.104 18128
734 1 8 . 1 1 23 23 ASP CA C 23 56.800 56.800 53.713 3.087 18128
735 1 8 . 1 1 23 23 ASP CB C 23 39.200 39.200 42.617 -3.417 18128
736 1 8 . 1 1 24 24 VAL N N 24 121.200 121.200 122.893 -1.693 18128
737 1 8 . 1 1 24 24 VAL C C 24 174.500 174.500 176.848 -2.348 18128
738 1 8 . 1 1 24 24 VAL CA C 24 60.300 60.300 62.604 -2.304 18128
739 1 8 . 1 1 24 24 VAL CB C 24 32.900 32.900 32.373 0.527 18128
740 1 8 . 1 1 25 25 GLY N N 25 118.000 118.000 115.144 2.856 18128
741 1 8 . 1 1 25 25 GLY C C 25 171.300 171.300 173.584 -2.284 18128
742 1 8 . 1 1 25 25 GLY CA C 25 47.000 47.000 45.408 1.592 18128
743 1 8 . 1 1 26 26 SER N N 26 112.600 112.600 115.949 -3.349 18128
744 1 8 . 1 1 26 26 SER C C 26 174.100 174.100 174.244 -0.144 18128
745 1 8 . 1 1 26 26 SER CA C 26 56.400 56.400 56.770 -0.370 18128
746 1 8 . 1 1 26 26 SER CB C 26 65.700 65.700 65.360 0.340 18128
747 1 8 . 1 1 27 27 ASN N N 27 124.000 124.000 120.448 3.552 18128
748 1 8 . 1 1 27 27 ASN C C 27 174.300 174.300 174.801 -0.501 18128
749 1 8 . 1 1 27 27 ASN CA C 27 53.300 53.300 54.414 -1.114 18128
750 1 8 . 1 1 27 27 ASN CB C 27 40.400 40.400 38.833 1.567 18128
751 1 8 . 1 1 28 28 LYS N N 28 124.000 124.000 120.840 3.160 18128
752 1 8 . 1 1 28 28 LYS C C 28 173.600 173.600 176.742 -3.142 18128
753 1 8 . 1 1 28 28 LYS CA C 28 55.500 55.500 55.861 -0.361 18128
754 1 8 . 1 1 28 28 LYS CB C 28 35.000 35.000 33.743 1.257 18128
755 1 8 . 1 1 29 29 GLY N N 29 107.500 107.500 112.978 -5.478 18128
756 1 8 . 1 1 29 29 GLY C C 29 171.400 171.400 174.578 -3.178 18128
757 1 8 . 1 1 29 29 GLY CA C 29 44.000 44.000 45.988 -1.988 18128
758 1 8 . 1 1 30 30 ALA N N 30 127.800 127.800 123.006 4.794 18128
759 1 8 . 1 1 30 30 ALA C C 30 174.800 174.800 176.453 -1.653 18128
760 1 8 . 1 1 30 30 ALA CA C 30 49.900 49.900 51.683 -1.783 18128
761 1 8 . 1 1 30 30 ALA CB C 30 22.700 22.700 18.615 4.085 18128
762 1 8 . 1 1 31 31 ILE N N 31 117.900 117.900 123.117 -5.217 18128
763 1 8 . 1 1 31 31 ILE C C 31 174.100 174.100 175.611 -1.511 18128
764 1 8 . 1 1 31 31 ILE CA C 31 60.800 60.800 62.351 -1.551 18128
765 1 8 . 1 1 31 31 ILE CB C 31 40.200 40.200 37.791 2.409 18128
766 1 8 . 1 1 32 32 ILE C C 32 174.800 174.800 175.211 -0.411 18128
767 1 8 . 1 1 32 32 ILE CA C 32 58.200 58.200 61.271 -3.071 18128
768 1 8 . 1 1 32 32 ILE CB C 32 42.400 42.400 39.303 3.097 18128
769 1 8 . 1 1 33 33 GLY N N 33 110.800 110.800 116.188 -5.388 18128
770 1 8 . 1 1 33 33 GLY C C 33 171.600 171.600 173.418 -1.818 18128
771 1 8 . 1 1 33 33 GLY CA C 33 48.800 48.800 44.689 4.111 18128
772 1 8 . 1 1 34 34 LEU C C 34 173.500 173.500 176.107 -2.607 18128
773 1 8 . 1 1 34 34 LEU CA C 34 53.800 53.800 54.845 -1.045 18128
774 1 8 . 1 1 34 34 LEU CB C 34 45.900 45.900 44.807 1.093 18128
775 1 8 . 1 1 35 35 MET N N 35 122.100 122.100 124.535 -2.435 18128
776 1 8 . 1 1 35 35 MET C C 35 173.300 173.300 175.670 -2.370 18128
777 1 8 . 1 1 35 35 MET CA C 35 54.400 54.400 55.121 -0.721 18128
778 1 8 . 1 1 35 35 MET CB C 35 37.100 37.100 33.303 3.797 18128
779 1 8 . 1 1 36 36 VAL N N 36 124.300 124.300 123.541 0.759 18128
780 1 8 . 1 1 36 36 VAL C C 36 175.200 175.200 175.491 -0.291 18128
781 1 8 . 1 1 36 36 VAL CA C 36 59.700 59.700 61.493 -1.793 18128
782 1 8 . 1 1 36 36 VAL CB C 36 34.900 34.900 30.541 4.359 18128
783 1 8 . 1 1 37 37 GLY N N 37 116.500 116.500 111.667 4.833 18128
784 1 8 . 1 1 37 37 GLY C C 37 171.000 171.000 174.045 -3.045 18128
785 1 8 . 1 1 37 37 GLY CA C 37 44.900 44.900 45.238 -0.338 18128
786 1 8 . 1 1 38 38 GLY N N 38 104.200 104.200 110.801 -6.601 18128
787 1 8 . 1 1 38 38 GLY C C 38 170.400 170.400 173.012 -2.612 18128
788 1 8 . 1 1 38 38 GLY CA C 38 44.800 44.800 45.462 -0.662 18128
789 1 8 . 1 1 39 39 VAL N N 39 114.700 114.700 121.068 -6.368 18128
790 1 8 . 1 1 39 39 VAL C C 39 173.200 173.200 176.061 -2.861 18128
791 1 8 . 1 1 39 39 VAL CA C 39 61.100 61.100 61.544 -0.444 18128
792 1 8 . 1 1 39 39 VAL CB C 39 35.200 35.200 34.199 1.001 18128
793 1 9 . 1 1 10 10 TYR C C 10 175.000 175.000 175.923 -0.923 18128
794 1 9 . 1 1 10 10 TYR CA C 10 57.300 57.300 57.296 0.004 18128
795 1 9 . 1 1 10 10 TYR CB C 10 42.100 42.100 40.279 1.821 18128
796 1 9 . 1 1 12 12 VAL C C 12 174.600 174.600 175.210 -0.610 18128
797 1 9 . 1 1 12 12 VAL CA C 12 60.400 60.400 61.215 -0.814 18128
798 1 9 . 1 1 12 12 VAL CB C 12 35.300 35.300 33.924 1.376 18128
799 1 9 . 1 1 13 13 HIS C C 13 174.200 174.200 175.228 -1.028 18128
800 1 9 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.171 -0.971 18128
801 1 9 . 1 1 13 13 HIS CB C 13 34.800 34.800 30.366 4.434 18128
802 1 9 . 1 1 14 14 HIS C C 14 174.200 174.200 174.866 -0.666 18128
803 1 9 . 1 1 14 14 HIS CA C 14 55.400 55.400 56.650 -1.250 18128
804 1 9 . 1 1 14 14 HIS CB C 14 33.100 33.100 30.575 2.525 18128
805 1 9 . 1 1 15 15 GLN N N 15 123.800 123.800 119.637 4.163 18128
806 1 9 . 1 1 15 15 GLN C C 15 173.600 173.600 174.218 -0.618 18128
807 1 9 . 1 1 15 15 GLN CA C 15 55.000 55.000 54.756 0.244 18128
808 1 9 . 1 1 15 15 GLN CB C 15 33.500 33.500 31.087 2.413 18128
809 1 9 . 1 1 16 16 LYS N N 16 126.400 126.400 120.935 5.465 18128
810 1 9 . 1 1 16 16 LYS C C 16 174.100 174.100 174.999 -0.899 18128
811 1 9 . 1 1 16 16 LYS CA C 16 54.700 54.700 56.775 -2.075 18128
812 1 9 . 1 1 16 16 LYS CB C 16 36.000 36.000 33.887 2.113 18128
813 1 9 . 1 1 17 17 LEU C C 17 174.600 174.600 176.077 -1.477 18128
814 1 9 . 1 1 17 17 LEU CA C 17 54.500 54.500 54.654 -0.154 18128
815 1 9 . 1 1 17 17 LEU CB C 17 46.400 46.400 43.329 3.071 18128
816 1 9 . 1 1 18 18 VAL C C 18 172.800 172.800 174.967 -2.167 18128
817 1 9 . 1 1 18 18 VAL CA C 18 60.900 60.900 61.917 -1.017 18128
818 1 9 . 1 1 18 18 VAL CB C 18 35.600 35.600 33.545 2.055 18128
819 1 9 . 1 1 19 19 PHE C C 19 171.900 171.900 175.072 -3.172 18128
820 1 9 . 1 1 19 19 PHE CA C 19 56.500 56.500 57.676 -1.176 18128
821 1 9 . 1 1 19 19 PHE CB C 19 42.600 42.600 40.881 1.719 18128
822 1 9 . 1 1 20 20 PHE C C 20 172.200 172.200 174.170 -1.970 18128
823 1 9 . 1 1 20 20 PHE CA C 20 56.000 56.000 58.074 -2.074 18128
824 1 9 . 1 1 20 20 PHE CB C 20 42.900 42.900 41.251 1.649 18128
825 1 9 . 1 1 21 21 ALA C C 21 175.000 175.000 175.416 -0.416 18128
826 1 9 . 1 1 21 21 ALA CA C 21 50.100 50.100 51.408 -1.308 18128
827 1 9 . 1 1 21 21 ALA CB C 21 22.700 22.700 20.440 2.260 18128
828 1 9 . 1 1 22 22 GLU C C 22 174.900 174.900 175.430 -0.530 18128
829 1 9 . 1 1 22 22 GLU CA C 22 53.900 53.900 56.169 -2.269 18128
830 1 9 . 1 1 22 22 GLU CB C 22 34.100 34.100 31.476 2.624 18128
831 1 9 . 1 1 23 23 ASP N N 23 126.900 126.900 126.827 0.073 18128
832 1 9 . 1 1 23 23 ASP C C 23 174.200 174.200 176.333 -2.133 18128
833 1 9 . 1 1 23 23 ASP CA C 23 56.800 56.800 53.394 3.406 18128
834 1 9 . 1 1 23 23 ASP CB C 23 39.200 39.200 41.253 -2.053 18128
835 1 9 . 1 1 24 24 VAL N N 24 121.200 121.200 125.099 -3.899 18128
836 1 9 . 1 1 24 24 VAL C C 24 174.500 174.500 175.786 -1.286 18128
837 1 9 . 1 1 24 24 VAL CA C 24 60.300 60.300 63.387 -3.087 18128
838 1 9 . 1 1 24 24 VAL CB C 24 32.900 32.900 32.766 0.134 18128
839 1 9 . 1 1 25 25 GLY N N 25 118.000 118.000 115.044 2.956 18128
840 1 9 . 1 1 25 25 GLY C C 25 171.300 171.300 173.668 -2.368 18128
841 1 9 . 1 1 25 25 GLY CA C 25 47.000 47.000 44.994 2.006 18128
842 1 9 . 1 1 26 26 SER N N 26 112.600 112.600 117.135 -4.535 18128
843 1 9 . 1 1 26 26 SER C C 26 174.100 174.100 173.741 0.359 18128
844 1 9 . 1 1 26 26 SER CA C 26 56.400 56.400 57.381 -0.981 18128
845 1 9 . 1 1 26 26 SER CB C 26 65.700 65.700 65.803 -0.103 18128
846 1 9 . 1 1 27 27 ASN N N 27 124.000 124.000 120.004 3.996 18128
847 1 9 . 1 1 27 27 ASN C C 27 174.300 174.300 173.812 0.488 18128
848 1 9 . 1 1 27 27 ASN CA C 27 53.300 53.300 54.601 -1.301 18128
849 1 9 . 1 1 27 27 ASN CB C 27 40.400 40.400 38.816 1.584 18128
850 1 9 . 1 1 28 28 LYS N N 28 124.000 124.000 119.824 4.176 18128
851 1 9 . 1 1 28 28 LYS C C 28 173.600 173.600 175.321 -1.721 18128
852 1 9 . 1 1 28 28 LYS CA C 28 55.500 55.500 56.272 -0.772 18128
853 1 9 . 1 1 28 28 LYS CB C 28 35.000 35.000 33.187 1.813 18128
854 1 9 . 1 1 29 29 GLY N N 29 107.500 107.500 111.658 -4.158 18128
855 1 9 . 1 1 29 29 GLY C C 29 171.400 171.400 173.705 -2.305 18128
856 1 9 . 1 1 29 29 GLY CA C 29 44.000 44.000 44.997 -0.997 18128
857 1 9 . 1 1 30 30 ALA N N 30 127.800 127.800 125.306 2.494 18128
858 1 9 . 1 1 30 30 ALA C C 30 174.800 174.800 176.672 -1.872 18128
859 1 9 . 1 1 30 30 ALA CA C 30 49.900 49.900 51.380 -1.480 18128
860 1 9 . 1 1 30 30 ALA CB C 30 22.700 22.700 20.189 2.511 18128
861 1 9 . 1 1 31 31 ILE N N 31 117.900 117.900 120.697 -2.797 18128
862 1 9 . 1 1 31 31 ILE C C 31 174.100 174.100 175.043 -0.943 18128
863 1 9 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.945 -0.145 18128
864 1 9 . 1 1 31 31 ILE CB C 31 40.200 40.200 39.005 1.195 18128
865 1 9 . 1 1 32 32 ILE C C 32 174.800 174.800 175.685 -0.885 18128
866 1 9 . 1 1 32 32 ILE CA C 32 58.200 58.200 60.895 -2.695 18128
867 1 9 . 1 1 32 32 ILE CB C 32 42.400 42.400 38.759 3.641 18128
868 1 9 . 1 1 33 33 GLY N N 33 110.800 110.800 115.976 -5.176 18128
869 1 9 . 1 1 33 33 GLY C C 33 171.600 171.600 173.308 -1.708 18128
870 1 9 . 1 1 33 33 GLY CA C 33 48.800 48.800 44.791 4.009 18128
871 1 9 . 1 1 34 34 LEU C C 34 173.500 173.500 175.968 -2.468 18128
872 1 9 . 1 1 34 34 LEU CA C 34 53.800 53.800 55.164 -1.364 18128
873 1 9 . 1 1 34 34 LEU CB C 34 45.900 45.900 45.103 0.797 18128
874 1 9 . 1 1 35 35 MET N N 35 122.100 122.100 124.046 -1.946 18128
875 1 9 . 1 1 35 35 MET C C 35 173.300 173.300 175.710 -2.410 18128
876 1 9 . 1 1 35 35 MET CA C 35 54.400 54.400 55.208 -0.808 18128
877 1 9 . 1 1 35 35 MET CB C 35 37.100 37.100 33.198 3.902 18128
878 1 9 . 1 1 36 36 VAL N N 36 124.300 124.300 126.116 -1.816 18128
879 1 9 . 1 1 36 36 VAL C C 36 175.200 175.200 175.510 -0.310 18128
880 1 9 . 1 1 36 36 VAL CA C 36 59.700 59.700 61.812 -2.112 18128
881 1 9 . 1 1 36 36 VAL CB C 36 34.900 34.900 30.544 4.356 18128
882 1 9 . 1 1 37 37 GLY N N 37 116.500 116.500 111.677 4.823 18128
883 1 9 . 1 1 37 37 GLY C C 37 171.000 171.000 173.978 -2.978 18128
884 1 9 . 1 1 37 37 GLY CA C 37 44.900 44.900 45.348 -0.448 18128
885 1 9 . 1 1 38 38 GLY N N 38 104.200 104.200 110.448 -6.248 18128
886 1 9 . 1 1 38 38 GLY C C 38 170.400 170.400 172.672 -2.272 18128
887 1 9 . 1 1 38 38 GLY CA C 38 44.800 44.800 45.274 -0.474 18128
888 1 9 . 1 1 39 39 VAL N N 39 114.700 114.700 118.681 -3.981 18128
889 1 9 . 1 1 39 39 VAL C C 39 173.200 173.200 175.288 -2.088 18128
890 1 9 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.916 0.184 18128
891 1 9 . 1 1 39 39 VAL CB C 39 35.200 35.200 34.359 0.841 18128
892 1 10 . 1 1 10 10 TYR C C 10 175.000 175.000 175.095 -0.095 18128
893 1 10 . 1 1 10 10 TYR CA C 10 57.300 57.300 57.330 -0.029 18128
894 1 10 . 1 1 10 10 TYR CB C 10 42.100 42.100 39.398 2.702 18128
895 1 10 . 1 1 12 12 VAL C C 12 174.600 174.600 174.976 -0.376 18128
896 1 10 . 1 1 12 12 VAL CA C 12 60.400 60.400 61.761 -1.361 18128
897 1 10 . 1 1 12 12 VAL CB C 12 35.300 35.300 33.519 1.781 18128
898 1 10 . 1 1 13 13 HIS C C 13 174.200 174.200 174.431 -0.231 18128
899 1 10 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.829 -1.629 18128
900 1 10 . 1 1 13 13 HIS CB C 13 34.800 34.800 29.968 4.832 18128
901 1 10 . 1 1 14 14 HIS C C 14 174.200 174.200 174.158 0.042 18128
902 1 10 . 1 1 14 14 HIS CA C 14 55.400 55.400 55.523 -0.123 18128
903 1 10 . 1 1 14 14 HIS CB C 14 33.100 33.100 31.416 1.684 18128
904 1 10 . 1 1 15 15 GLN N N 15 123.800 123.800 120.578 3.222 18128
905 1 10 . 1 1 15 15 GLN C C 15 173.600 173.600 173.522 0.078 18128
906 1 10 . 1 1 15 15 GLN CA C 15 55.000 55.000 54.491 0.509 18128
907 1 10 . 1 1 15 15 GLN CB C 15 33.500 33.500 32.568 0.932 18128
908 1 10 . 1 1 16 16 LYS N N 16 126.400 126.400 120.558 5.842 18128
909 1 10 . 1 1 16 16 LYS C C 16 174.100 174.100 174.763 -0.663 18128
910 1 10 . 1 1 16 16 LYS CA C 16 54.700 54.700 56.044 -1.344 18128
911 1 10 . 1 1 16 16 LYS CB C 16 36.000 36.000 33.883 2.117 18128
912 1 10 . 1 1 17 17 LEU C C 17 174.600 174.600 175.896 -1.296 18128
913 1 10 . 1 1 17 17 LEU CA C 17 54.500 54.500 54.542 -0.042 18128
914 1 10 . 1 1 17 17 LEU CB C 17 46.400 46.400 43.102 3.298 18128
915 1 10 . 1 1 18 18 VAL C C 18 172.800 172.800 174.991 -2.191 18128
916 1 10 . 1 1 18 18 VAL CA C 18 60.900 60.900 61.888 -0.988 18128
917 1 10 . 1 1 18 18 VAL CB C 18 35.600 35.600 33.526 2.075 18128
918 1 10 . 1 1 19 19 PHE C C 19 171.900 171.900 175.247 -3.347 18128
919 1 10 . 1 1 19 19 PHE CA C 19 56.500 56.500 57.565 -1.065 18128
920 1 10 . 1 1 19 19 PHE CB C 19 42.600 42.600 41.040 1.560 18128
921 1 10 . 1 1 20 20 PHE C C 20 172.200 172.200 174.208 -2.008 18128
922 1 10 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.357 -1.357 18128
923 1 10 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.447 2.454 18128
924 1 10 . 1 1 21 21 ALA C C 21 175.000 175.000 176.586 -1.586 18128
925 1 10 . 1 1 21 21 ALA CA C 21 50.100 50.100 51.994 -1.894 18128
926 1 10 . 1 1 21 21 ALA CB C 21 22.700 22.700 19.845 2.855 18128
927 1 10 . 1 1 22 22 GLU C C 22 174.900 174.900 174.998 -0.098 18128
928 1 10 . 1 1 22 22 GLU CA C 22 53.900 53.900 56.268 -2.368 18128
929 1 10 . 1 1 22 22 GLU CB C 22 34.100 34.100 32.166 1.934 18128
930 1 10 . 1 1 23 23 ASP N N 23 126.900 126.900 121.591 5.309 18128
931 1 10 . 1 1 23 23 ASP C C 23 174.200 174.200 174.649 -0.449 18128
932 1 10 . 1 1 23 23 ASP CA C 23 56.800 56.800 53.581 3.219 18128
933 1 10 . 1 1 23 23 ASP CB C 23 39.200 39.200 41.672 -2.472 18128
934 1 10 . 1 1 24 24 VAL N N 24 121.200 121.200 122.792 -1.592 18128
935 1 10 . 1 1 24 24 VAL C C 24 174.500 174.500 176.561 -2.061 18128
936 1 10 . 1 1 24 24 VAL CA C 24 60.300 60.300 62.352 -2.052 18128
937 1 10 . 1 1 24 24 VAL CB C 24 32.900 32.900 32.004 0.896 18128
938 1 10 . 1 1 25 25 GLY N N 25 118.000 118.000 116.988 1.012 18128
939 1 10 . 1 1 25 25 GLY C C 25 171.300 171.300 173.861 -2.561 18128
940 1 10 . 1 1 25 25 GLY CA C 25 47.000 47.000 45.881 1.119 18128
941 1 10 . 1 1 26 26 SER N N 26 112.600 112.600 118.901 -6.301 18128
942 1 10 . 1 1 26 26 SER C C 26 174.100 174.100 173.830 0.270 18128
943 1 10 . 1 1 26 26 SER CA C 26 56.400 56.400 56.825 -0.425 18128
944 1 10 . 1 1 26 26 SER CB C 26 65.700 65.700 65.339 0.361 18128
945 1 10 . 1 1 27 27 ASN N N 27 124.000 124.000 119.458 4.542 18128
946 1 10 . 1 1 27 27 ASN C C 27 174.300 174.300 174.367 -0.067 18128
947 1 10 . 1 1 27 27 ASN CA C 27 53.300 53.300 54.148 -0.848 18128
948 1 10 . 1 1 27 27 ASN CB C 27 40.400 40.400 38.703 1.698 18128
949 1 10 . 1 1 28 28 LYS N N 28 124.000 124.000 117.408 6.592 18128
950 1 10 . 1 1 28 28 LYS C C 28 173.600 173.600 175.835 -2.235 18128
951 1 10 . 1 1 28 28 LYS CA C 28 55.500 55.500 55.963 -0.463 18128
952 1 10 . 1 1 28 28 LYS CB C 28 35.000 35.000 33.128 1.872 18128
953 1 10 . 1 1 29 29 GLY N N 29 107.500 107.500 111.699 -4.199 18128
954 1 10 . 1 1 29 29 GLY C C 29 171.400 171.400 174.079 -2.679 18128
955 1 10 . 1 1 29 29 GLY CA C 29 44.000 44.000 45.190 -1.190 18128
956 1 10 . 1 1 30 30 ALA N N 30 127.800 127.800 124.996 2.804 18128
957 1 10 . 1 1 30 30 ALA C C 30 174.800 174.800 176.731 -1.931 18128
958 1 10 . 1 1 30 30 ALA CA C 30 49.900 49.900 51.322 -1.423 18128
959 1 10 . 1 1 30 30 ALA CB C 30 22.700 22.700 20.431 2.269 18128
960 1 10 . 1 1 31 31 ILE N N 31 117.900 117.900 120.257 -2.357 18128
961 1 10 . 1 1 31 31 ILE C C 31 174.100 174.100 175.248 -1.148 18128
962 1 10 . 1 1 31 31 ILE CA C 31 60.800 60.800 60.719 0.080 18128
963 1 10 . 1 1 31 31 ILE CB C 31 40.200 40.200 39.181 1.019 18128
964 1 10 . 1 1 32 32 ILE C C 32 174.800 174.800 176.298 -1.498 18128
965 1 10 . 1 1 32 32 ILE CA C 32 58.200 58.200 61.078 -2.878 18128
966 1 10 . 1 1 32 32 ILE CB C 32 42.400 42.400 38.609 3.791 18128
967 1 10 . 1 1 33 33 GLY N N 33 110.800 110.800 116.555 -5.755 18128
968 1 10 . 1 1 33 33 GLY C C 33 171.600 171.600 173.413 -1.813 18128
969 1 10 . 1 1 33 33 GLY CA C 33 48.800 48.800 44.862 3.938 18128
970 1 10 . 1 1 34 34 LEU C C 34 173.500 173.500 175.951 -2.451 18128
971 1 10 . 1 1 34 34 LEU CA C 34 53.800 53.800 54.987 -1.187 18128
972 1 10 . 1 1 34 34 LEU CB C 34 45.900 45.900 44.783 1.117 18128
973 1 10 . 1 1 35 35 MET N N 35 122.100 122.100 122.971 -0.871 18128
974 1 10 . 1 1 35 35 MET C C 35 173.300 173.300 176.029 -2.729 18128
975 1 10 . 1 1 35 35 MET CA C 35 54.400 54.400 54.964 -0.564 18128
976 1 10 . 1 1 35 35 MET CB C 35 37.100 37.100 33.148 3.953 18128
977 1 10 . 1 1 36 36 VAL N N 36 124.300 124.300 124.808 -0.508 18128
978 1 10 . 1 1 36 36 VAL C C 36 175.200 175.200 176.172 -0.972 18128
979 1 10 . 1 1 36 36 VAL CA C 36 59.700 59.700 62.388 -2.688 18128
980 1 10 . 1 1 36 36 VAL CB C 36 34.900 34.900 30.125 4.775 18128
981 1 10 . 1 1 37 37 GLY N N 37 116.500 116.500 113.454 3.046 18128
982 1 10 . 1 1 37 37 GLY C C 37 171.000 171.000 174.745 -3.745 18128
983 1 10 . 1 1 37 37 GLY CA C 37 44.900 44.900 45.071 -0.171 18128
984 1 10 . 1 1 38 38 GLY N N 38 104.200 104.200 107.074 -2.874 18128
985 1 10 . 1 1 38 38 GLY C C 38 170.400 170.400 172.924 -2.524 18128
986 1 10 . 1 1 38 38 GLY CA C 38 44.800 44.800 45.218 -0.418 18128
987 1 10 . 1 1 39 39 VAL N N 39 114.700 114.700 118.267 -3.567 18128
988 1 10 . 1 1 39 39 VAL C C 39 173.200 173.200 175.987 -2.787 18128
989 1 10 . 1 1 39 39 VAL CA C 39 61.100 61.100 61.081 0.019 18128
990 1 10 . 1 1 39 39 VAL CB C 39 35.200 35.200 33.710 1.490 18128
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 17 4.394 -0.683 4.474 18128
2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 18128
3 1 1 "Average Difference" C 29 2.033 1.675 1.172 18128
4 1 1 "Average Difference" CA 29 1.477 0.536 1.400 18128
5 1 1 "Average Difference" CB 24 2.399 -1.972 1.396 18128
6 1 1 "Average Difference" HN 0 0.000 0.000 0.000 18128
7 1 2 "Average Difference" N 17 3.974 -0.628 4.044 18128
8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 18128
9 1 2 "Average Difference" C 29 1.861 1.499 1.124 18128
10 1 2 "Average Difference" CA 29 1.498 0.637 1.379 18128
11 1 2 "Average Difference" CB 24 2.593 -2.198 1.405 18128
12 1 2 "Average Difference" HN 0 0.000 0.000 0.000 18128
13 1 3 "Average Difference" N 17 3.614 -0.799 3.633 18128
14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 18128
15 1 3 "Average Difference" C 29 1.947 1.622 1.096 18128
16 1 3 "Average Difference" CA 29 1.570 0.735 1.412 18128
17 1 3 "Average Difference" CB 24 2.572 -2.186 1.385 18128
18 1 3 "Average Difference" HN 0 0.000 0.000 0.000 18128
19 1 4 "Average Difference" N 17 4.286 -0.440 4.394 18128
20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 18128
21 1 4 "Average Difference" C 29 1.878 1.441 1.226 18128
22 1 4 "Average Difference" CA 29 1.520 0.609 1.417 18128
23 1 4 "Average Difference" CB 24 2.438 -1.989 1.439 18128
24 1 4 "Average Difference" HN 0 0.000 0.000 0.000 18128
25 1 5 "Average Difference" N 17 3.932 0.292 4.042 18128
26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 18128
27 1 5 "Average Difference" C 29 1.795 1.469 1.051 18128
28 1 5 "Average Difference" CA 29 1.709 0.723 1.576 18128
29 1 5 "Average Difference" CB 24 2.748 -2.239 1.627 18128
30 1 5 "Average Difference" HN 0 0.000 0.000 0.000 18128
31 1 6 "Average Difference" N 17 4.947 -0.237 5.093 18128
32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 18128
33 1 6 "Average Difference" C 29 2.016 1.599 1.251 18128
34 1 6 "Average Difference" CA 29 1.568 0.613 1.468 18128
35 1 6 "Average Difference" CB 24 2.268 -1.888 1.284 18128
36 1 6 "Average Difference" HN 0 0.000 0.000 0.000 18128
37 1 7 "Average Difference" N 17 4.239 -0.977 4.252 18128
38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 18128
39 1 7 "Average Difference" C 29 1.878 1.357 1.321 18128
40 1 7 "Average Difference" CA 29 1.672 0.714 1.538 18128
41 1 7 "Average Difference" CB 24 2.547 -2.106 1.463 18128
42 1 7 "Average Difference" HN 0 0.000 0.000 0.000 18128
43 1 8 "Average Difference" N 17 4.303 0.339 4.421 18128
44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 18128
45 1 8 "Average Difference" C 29 1.920 1.524 1.189 18128
46 1 8 "Average Difference" CA 29 1.687 0.724 1.551 18128
47 1 8 "Average Difference" CB 24 2.570 -1.986 1.666 18128
48 1 8 "Average Difference" HN 0 0.000 0.000 0.000 18128
49 1 9 "Average Difference" N 17 3.974 0.377 4.078 18128
50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 18128
51 1 9 "Average Difference" C 29 1.703 1.427 0.947 18128
52 1 9 "Average Difference" CA 29 1.697 0.687 1.579 18128
53 1 9 "Average Difference" CB 24 2.410 -1.945 1.454 18128
54 1 9 "Average Difference" HN 0 0.000 0.000 0.000 18128
55 1 10 "Average Difference" N 17 4.026 -0.256 4.141 18128
56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 18128
57 1 10 "Average Difference" C 29 1.869 1.488 1.151 18128
58 1 10 "Average Difference" CA 29 1.587 0.608 1.492 18128
59 1 10 "Average Difference" CB 24 2.528 -2.041 1.524 18128
60 1 10 "Average Difference" HN 0 0.000 0.000 0.000 18128
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 18128
_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 10 175.000 175.000 175.228 -0.228 18128
2 1 . 1 1 10 10 TYR CA C 10 57.300 57.300 57.338 -0.038 18128
3 1 . 1 1 10 10 TYR CB C 10 42.100 42.100 39.867 2.233 18128
4 1 . 1 1 12 12 VAL C C 12 174.600 174.600 174.922 -0.322 18128
5 1 . 1 1 12 12 VAL CA C 12 60.400 60.400 61.566 -1.166 18128
6 1 . 1 1 12 12 VAL CB C 12 35.300 35.300 33.612 1.688 18128
7 1 . 1 1 13 13 HIS C C 13 174.200 174.200 174.196 0.004 18128
8 1 . 1 1 13 13 HIS CA C 13 54.200 54.200 55.375 -1.175 18128
9 1 . 1 1 13 13 HIS CB C 13 34.800 34.800 31.035 3.765 18128
10 1 . 1 1 14 14 HIS C C 14 174.200 174.200 174.450 -0.250 18128
11 1 . 1 1 14 14 HIS CA C 14 55.400 55.400 55.733 -0.333 18128
12 1 . 1 1 14 14 HIS CB C 14 33.100 33.100 31.419 1.681 18128
13 1 . 1 1 15 15 GLN N N 15 123.800 123.800 119.507 4.293 18128
14 1 . 1 1 15 15 GLN C C 15 173.600 173.600 174.542 -0.942 18128
15 1 . 1 1 15 15 GLN CA C 15 55.000 55.000 55.006 -0.006 18128
16 1 . 1 1 15 15 GLN CB C 15 33.500 33.500 31.244 2.256 18128
17 1 . 1 1 16 16 LYS N N 16 126.400 126.400 121.163 5.237 18128
18 1 . 1 1 16 16 LYS C C 16 174.100 174.100 175.324 -1.224 18128
19 1 . 1 1 16 16 LYS CA C 16 54.700 54.700 56.290 -1.590 18128
20 1 . 1 1 16 16 LYS CB C 16 36.000 36.000 33.685 2.315 18128
21 1 . 1 1 17 17 LEU C C 17 174.600 174.600 175.921 -1.321 18128
22 1 . 1 1 17 17 LEU CA C 17 54.500 54.500 54.582 -0.082 18128
23 1 . 1 1 17 17 LEU CB C 17 46.400 46.400 43.197 3.203 18128
24 1 . 1 1 18 18 VAL C C 18 172.800 172.800 174.771 -1.971 18128
25 1 . 1 1 18 18 VAL CA C 18 60.900 60.900 61.895 -0.995 18128
26 1 . 1 1 18 18 VAL CB C 18 35.600 35.600 33.616 1.984 18128
27 1 . 1 1 19 19 PHE C C 19 171.900 171.900 174.942 -3.042 18128
28 1 . 1 1 19 19 PHE CA C 19 56.500 56.500 57.705 -1.205 18128
29 1 . 1 1 19 19 PHE CB C 19 42.600 42.600 41.214 1.386 18128
30 1 . 1 1 20 20 PHE C C 20 172.200 172.200 174.083 -1.883 18128
31 1 . 1 1 20 20 PHE CA C 20 56.000 56.000 57.222 -1.222 18128
32 1 . 1 1 20 20 PHE CB C 20 42.900 42.900 40.692 2.208 18128
33 1 . 1 1 21 21 ALA C C 21 175.000 175.000 176.246 -1.246 18128
34 1 . 1 1 21 21 ALA CA C 21 50.100 50.100 51.859 -1.759 18128
35 1 . 1 1 21 21 ALA CB C 21 22.700 22.700 20.276 2.424 18128
36 1 . 1 1 22 22 GLU C C 22 174.900 174.900 174.986 -0.086 18128
37 1 . 1 1 22 22 GLU CA C 22 53.900 53.900 56.193 -2.293 18128
38 1 . 1 1 22 22 GLU CB C 22 34.100 34.100 31.225 2.875 18128
39 1 . 1 1 23 23 ASP N N 23 126.900 126.900 123.612 3.288 18128
40 1 . 1 1 23 23 ASP C C 23 174.200 174.200 175.876 -1.676 18128
41 1 . 1 1 23 23 ASP CA C 23 56.800 56.800 53.688 3.112 18128
42 1 . 1 1 23 23 ASP CB C 23 39.200 39.200 41.737 -2.537 18128
43 1 . 1 1 24 24 VAL N N 24 121.200 121.200 123.110 -1.910 18128
44 1 . 1 1 24 24 VAL C C 24 174.500 174.500 176.738 -2.238 18128
45 1 . 1 1 24 24 VAL CA C 24 60.300 60.300 62.626 -2.326 18128
46 1 . 1 1 24 24 VAL CB C 24 32.900 32.900 32.068 0.832 18128
47 1 . 1 1 25 25 GLY N N 25 118.000 118.000 113.053 4.947 18128
48 1 . 1 1 25 25 GLY C C 25 171.300 171.300 174.163 -2.863 18128
49 1 . 1 1 25 25 GLY CA C 25 47.000 47.000 45.932 1.067 18128
50 1 . 1 1 26 26 SER N N 26 112.600 112.600 116.293 -3.693 18128
51 1 . 1 1 26 26 SER C C 26 174.100 174.100 173.706 0.394 18128
52 1 . 1 1 26 26 SER CA C 26 56.400 56.400 57.357 -0.957 18128
53 1 . 1 1 26 26 SER CB C 26 65.700 65.700 64.457 1.243 18128
54 1 . 1 1 27 27 ASN N N 27 124.000 124.000 119.733 4.267 18128
55 1 . 1 1 27 27 ASN C C 27 174.300 174.300 174.232 0.068 18128
56 1 . 1 1 27 27 ASN CA C 27 53.300 53.300 54.226 -0.926 18128
57 1 . 1 1 27 27 ASN CB C 27 40.400 40.400 38.875 1.525 18128
58 1 . 1 1 28 28 LYS N N 28 124.000 124.000 118.875 5.125 18128
59 1 . 1 1 28 28 LYS C C 28 173.600 173.600 176.207 -2.607 18128
60 1 . 1 1 28 28 LYS CA C 28 55.500 55.500 56.342 -0.842 18128
61 1 . 1 1 28 28 LYS CB C 28 35.000 35.000 32.820 2.180 18128
62 1 . 1 1 29 29 GLY N N 29 107.500 107.500 111.885 -4.385 18128
63 1 . 1 1 29 29 GLY C C 29 171.400 171.400 174.019 -2.619 18128
64 1 . 1 1 29 29 GLY CA C 29 44.000 44.000 45.076 -1.076 18128
65 1 . 1 1 30 30 ALA N N 30 127.800 127.800 125.721 2.079 18128
66 1 . 1 1 30 30 ALA C C 30 174.800 174.800 176.693 -1.893 18128
67 1 . 1 1 30 30 ALA CA C 30 49.900 49.900 51.645 -1.745 18128
68 1 . 1 1 30 30 ALA CB C 30 22.700 22.700 20.118 2.582 18128
69 1 . 1 1 31 31 ILE N N 31 117.900 117.900 120.218 -2.318 18128
70 1 . 1 1 31 31 ILE C C 31 174.100 174.100 175.084 -0.984 18128
71 1 . 1 1 31 31 ILE CA C 31 60.800 60.800 61.111 -0.311 18128
72 1 . 1 1 31 31 ILE CB C 31 40.200 40.200 39.102 1.097 18128
73 1 . 1 1 32 32 ILE C C 32 174.800 174.800 175.750 -0.950 18128
74 1 . 1 1 32 32 ILE CA C 32 58.200 58.200 61.127 -2.928 18128
75 1 . 1 1 32 32 ILE CB C 32 42.400 42.400 38.841 3.558 18128
76 1 . 1 1 33 33 GLY N N 33 110.800 110.800 115.751 -4.951 18128
77 1 . 1 1 33 33 GLY C C 33 171.600 171.600 173.466 -1.866 18128
78 1 . 1 1 33 33 GLY CA C 33 48.800 48.800 44.922 3.879 18128
79 1 . 1 1 34 34 LEU C C 34 173.500 173.500 175.976 -2.476 18128
80 1 . 1 1 34 34 LEU CA C 34 53.800 53.800 54.604 -0.804 18128
81 1 . 1 1 34 34 LEU CB C 34 45.900 45.900 44.460 1.440 18128
82 1 . 1 1 35 35 MET N N 35 122.100 122.100 122.691 -0.591 18128
83 1 . 1 1 35 35 MET C C 35 173.300 173.300 175.570 -2.270 18128
84 1 . 1 1 35 35 MET CA C 35 54.400 54.400 55.019 -0.618 18128
85 1 . 1 1 35 35 MET CB C 35 37.100 37.100 33.437 3.663 18128
86 1 . 1 1 36 36 VAL N N 36 124.300 124.300 125.098 -0.798 18128
87 1 . 1 1 36 36 VAL C C 36 175.200 175.200 175.929 -0.729 18128
88 1 . 1 1 36 36 VAL CA C 36 59.700 59.700 61.905 -2.205 18128
89 1 . 1 1 36 36 VAL CB C 36 34.900 34.900 30.304 4.596 18128
90 1 . 1 1 37 37 GLY N N 37 116.500 116.500 112.718 3.782 18128
91 1 . 1 1 37 37 GLY C C 37 171.000 171.000 174.497 -3.497 18128
92 1 . 1 1 37 37 GLY CA C 37 44.900 44.900 45.106 -0.206 18128
93 1 . 1 1 38 38 GLY N N 38 104.200 104.200 108.811 -4.611 18128
94 1 . 1 1 38 38 GLY C C 38 170.400 170.400 173.080 -2.680 18128
95 1 . 1 1 38 38 GLY CA C 38 44.800 44.800 45.024 -0.224 18128
96 1 . 1 1 39 39 VAL N N 39 114.700 114.700 119.343 -4.643 18128
97 1 . 1 1 39 39 VAL C C 39 173.200 173.200 175.592 -2.392 18128
98 1 . 1 1 39 39 VAL CA C 39 61.100 61.100 61.224 -0.124 18128
99 1 . 1 1 39 39 VAL CB C 39 35.200 35.200 34.078 1.122 18128
stop_
save_