data_25033
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25033
_Entry.PDB_ID 2MQH
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 25033
_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 12 12 SER N N 12 116.112 116.112 115.558 0.554 25033
2 1 1 . 1 1 12 12 SER C C 12 175.271 175.271 176.064 -0.793 25033
3 1 1 . 1 1 12 12 SER CA C 12 58.570 58.570 58.793 -0.223 25033
4 1 1 . 1 1 12 12 SER CB C 12 63.984 63.984 63.444 0.540 25033
5 1 1 . 1 1 12 12 SER H H 12 8.422 8.422 8.208 0.214 25033
6 1 1 . 1 1 13 13 GLY N N 13 111.178 111.178 115.971 -4.793 25033
7 1 1 . 1 1 13 13 GLY C C 13 174.238 174.238 174.241 -0.003 25033
8 1 1 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.867 0.653 25033
9 1 1 . 1 1 13 13 GLY H H 13 8.537 8.537 8.628 -0.091 25033
10 1 1 . 1 1 14 14 GLU N N 14 120.547 120.547 123.718 -3.171 25033
11 1 1 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.281 -0.014 25033
12 1 1 . 1 1 14 14 GLU C C 14 176.455 176.455 175.496 0.959 25033
13 1 1 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.969 0.784 25033
14 1 1 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.346 1.119 25033
15 1 1 . 1 1 14 14 GLU H H 14 8.285 8.285 8.032 0.253 25033
16 1 1 . 1 1 15 15 GLN N N 15 121.185 121.185 124.842 -3.657 25033
17 1 1 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.401 -0.052 25033
18 1 1 . 1 1 15 15 GLN C C 15 175.494 175.494 175.133 0.361 25033
19 1 1 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.661 0.009 25033
20 1 1 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.299 0.111 25033
21 1 1 . 1 1 15 15 GLN H H 15 8.444 8.444 8.312 0.132 25033
22 1 1 . 1 1 16 16 LEU N N 16 123.934 123.934 129.019 -5.085 25033
23 1 1 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.546 -0.205 25033
24 1 1 . 1 1 16 16 LEU C C 16 176.942 176.942 175.072 1.870 25033
25 1 1 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.331 1.173 25033
26 1 1 . 1 1 16 16 LEU CB C 16 42.519 42.519 41.436 1.083 25033
27 1 1 . 1 1 16 16 LEU H H 16 8.289 8.289 8.649 -0.360 25033
28 1 1 . 1 1 17 17 ARG N N 17 122.044 122.044 120.614 1.430 25033
29 1 1 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.782 -0.318 25033
30 1 1 . 1 1 17 17 ARG C C 17 175.829 175.829 175.497 0.332 25033
31 1 1 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.541 1.131 25033
32 1 1 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.807 -0.977 25033
33 1 1 . 1 1 17 17 ARG H H 17 8.216 8.216 8.187 0.029 25033
34 1 1 . 1 1 18 18 GLN N N 18 122.488 122.488 124.089 -1.601 25033
35 1 1 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.474 -0.140 25033
36 1 1 . 1 1 18 18 GLN C C 18 172.958 172.958 173.719 -0.761 25033
37 1 1 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.079 0.821 25033
38 1 1 . 1 1 18 18 GLN CB C 18 32.620 32.620 31.921 0.699 25033
39 1 1 . 1 1 18 18 GLN H H 18 8.573 8.573 8.021 0.552 25033
40 1 1 . 1 1 19 19 GLN N N 19 116.301 116.301 119.021 -2.720 25033
41 1 1 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.381 -0.003 25033
42 1 1 . 1 1 19 19 GLN C C 19 176.902 176.902 174.655 2.247 25033
43 1 1 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.097 0.118 25033
44 1 1 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.087 1.551 25033
45 1 1 . 1 1 19 19 GLN H H 19 8.146 8.146 8.384 -0.238 25033
46 1 1 . 1 1 20 20 GLY N N 20 109.745 109.745 110.385 -0.640 25033
47 1 1 . 1 1 20 20 GLY C C 20 170.989 170.989 172.566 -1.577 25033
48 1 1 . 1 1 20 20 GLY CA C 20 45.935 45.935 43.973 1.962 25033
49 1 1 . 1 1 20 20 GLY H H 20 8.998 8.998 8.249 0.749 25033
50 1 1 . 1 1 21 21 THR N N 21 112.645 112.645 113.718 -1.073 25033
51 1 1 . 1 1 21 21 THR HA H 21 5.361 5.361 5.135 0.226 25033
52 1 1 . 1 1 21 21 THR C C 21 174.553 174.553 175.878 -1.325 25033
53 1 1 . 1 1 21 21 THR CA C 21 60.025 60.025 60.021 0.004 25033
54 1 1 . 1 1 21 21 THR CB C 21 71.720 71.720 71.794 -0.074 25033
55 1 1 . 1 1 21 21 THR H H 21 8.312 8.312 8.234 0.078 25033
56 1 1 . 1 1 22 22 VAL N N 22 125.915 125.915 122.283 3.632 25033
57 1 1 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.847 -0.198 25033
58 1 1 . 1 1 22 22 VAL C C 22 175.553 175.553 177.839 -2.286 25033
59 1 1 . 1 1 22 22 VAL CA C 22 64.618 64.618 65.558 -0.940 25033
60 1 1 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.788 -0.167 25033
61 1 1 . 1 1 22 22 VAL H H 22 9.092 9.092 8.201 0.891 25033
62 1 1 . 1 1 23 23 LYS N N 23 135.790 135.790 121.116 14.674 25033
63 1 1 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.169 0.132 25033
64 1 1 . 1 1 23 23 LYS C C 23 176.301 176.301 176.695 -0.394 25033
65 1 1 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.963 -0.353 25033
66 1 1 . 1 1 23 23 LYS CB C 23 34.300 34.300 32.347 1.953 25033
67 1 1 . 1 1 23 23 LYS H H 23 9.276 9.276 8.577 0.699 25033
68 1 1 . 1 1 24 24 TRP N N 24 111.651 111.651 118.469 -6.818 25033
69 1 1 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.868 -0.245 25033
70 1 1 . 1 1 24 24 TRP C C 24 173.628 173.628 174.809 -1.181 25033
71 1 1 . 1 1 24 24 TRP CA C 24 56.300 56.300 56.088 0.212 25033
72 1 1 . 1 1 24 24 TRP CB C 24 31.260 31.260 28.971 2.289 25033
73 1 1 . 1 1 24 24 TRP H H 24 7.455 7.455 7.834 -0.379 25033
74 1 1 . 1 1 25 25 PHE N N 25 121.305 121.305 120.881 0.424 25033
75 1 1 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.740 -0.455 25033
76 1 1 . 1 1 25 25 PHE C C 25 172.354 172.354 174.967 -2.613 25033
77 1 1 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.408 1.964 25033
78 1 1 . 1 1 25 25 PHE CB C 25 42.569 42.569 41.684 0.885 25033
79 1 1 . 1 1 25 25 PHE H H 25 9.074 9.074 8.038 1.036 25033
80 1 1 . 1 1 26 26 ASN N N 26 126.976 126.976 124.134 2.842 25033
81 1 1 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.884 -0.072 25033
82 1 1 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.277 -0.865 25033
83 1 1 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.170 -0.084 25033
84 1 1 . 1 1 26 26 ASN H H 26 8.159 8.159 8.117 0.042 25033
85 1 1 . 1 1 27 27 ALA N N 27 128.245 128.245 125.123 3.122 25033
86 1 1 . 1 1 27 27 ALA HA H 27 4.121 4.121 3.901 0.220 25033
87 1 1 . 1 1 27 27 ALA C C 27 179.031 179.031 178.698 0.333 25033
88 1 1 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.138 -0.713 25033
89 1 1 . 1 1 27 27 ALA CB C 27 18.374 18.374 19.030 -0.656 25033
90 1 1 . 1 1 27 27 ALA H H 27 9.036 9.036 8.419 0.617 25033
91 1 1 . 1 1 28 28 THR N N 28 113.994 113.994 113.530 0.464 25033
92 1 1 . 1 1 28 28 THR HA H 28 4.068 4.068 3.990 0.078 25033
93 1 1 . 1 1 28 28 THR C C 28 176.084 176.084 175.672 0.412 25033
94 1 1 . 1 1 28 28 THR CA C 28 65.820 65.820 65.445 0.375 25033
95 1 1 . 1 1 28 28 THR CB C 28 68.291 68.291 68.061 0.230 25033
96 1 1 . 1 1 28 28 THR H H 28 8.065 8.065 8.265 -0.200 25033
97 1 1 . 1 1 29 29 LYS N N 29 118.922 118.922 118.957 -0.035 25033
98 1 1 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.361 -0.105 25033
99 1 1 . 1 1 29 29 LYS C C 29 177.201 177.201 177.268 -0.067 25033
100 1 1 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.255 0.633 25033
101 1 1 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.603 1.137 25033
102 1 1 . 1 1 29 29 LYS H H 29 7.446 7.446 7.780 -0.334 25033
103 1 1 . 1 1 30 30 GLY N N 30 107.601 107.601 107.573 0.028 25033
104 1 1 . 1 1 30 30 GLY C C 30 172.004 172.004 172.921 -0.917 25033
105 1 1 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.096 1.308 25033
106 1 1 . 1 1 30 30 GLY H H 30 8.115 8.115 7.970 0.145 25033
107 1 1 . 1 1 31 31 PHE N N 31 112.488 112.488 119.014 -6.526 25033
108 1 1 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.934 0.073 25033
109 1 1 . 1 1 31 31 PHE CA C 31 55.278 55.278 56.937 -1.659 25033
110 1 1 . 1 1 31 31 PHE CB C 31 42.388 42.388 40.748 1.640 25033
111 1 1 . 1 1 31 31 PHE H H 31 6.594 6.594 7.451 -0.857 25033
112 1 1 . 1 1 32 32 GLY N N 32 105.986 105.986 109.387 -3.401 25033
113 1 1 . 1 1 32 32 GLY C C 32 170.292 170.292 172.077 -1.785 25033
114 1 1 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.513 1.856 25033
115 1 1 . 1 1 32 32 GLY H H 32 8.144 8.144 7.802 0.342 25033
116 1 1 . 1 1 33 33 PHE N N 33 115.319 115.319 116.288 -0.969 25033
117 1 1 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.420 0.043 25033
118 1 1 . 1 1 33 33 PHE C C 33 175.037 175.037 175.114 -0.077 25033
119 1 1 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.675 -1.380 25033
120 1 1 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.303 0.488 25033
121 1 1 . 1 1 33 33 PHE H H 33 7.971 7.971 7.969 0.002 25033
122 1 1 . 1 1 34 34 ILE N N 34 122.140 122.140 120.359 1.781 25033
123 1 1 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.643 -0.326 25033
124 1 1 . 1 1 34 34 ILE C C 34 174.526 174.526 175.223 -0.697 25033
125 1 1 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.547 0.250 25033
126 1 1 . 1 1 34 34 ILE CB C 34 42.583 42.583 41.340 1.242 25033
127 1 1 . 1 1 34 34 ILE H H 34 9.511 9.511 9.035 0.476 25033
128 1 1 . 1 1 35 35 THR N N 35 126.580 126.580 120.740 5.840 25033
129 1 1 . 1 1 35 35 THR HA H 35 5.143 5.143 4.957 0.186 25033
130 1 1 . 1 1 35 35 THR CA C 35 59.330 59.330 57.580 1.750 25033
131 1 1 . 1 1 35 35 THR CB C 35 70.258 70.258 68.471 1.787 25033
132 1 1 . 1 1 35 35 THR H H 35 9.416 9.416 8.613 0.803 25033
133 1 1 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.505 0.094 25033
134 1 1 . 1 1 36 36 PRO C C 36 177.390 177.390 177.719 -0.329 25033
135 1 1 . 1 1 36 36 PRO CA C 36 63.220 63.220 62.936 0.284 25033
136 1 1 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.149 0.321 25033
137 1 1 . 1 1 37 37 GLY N N 37 112.033 112.033 113.199 -1.166 25033
138 1 1 . 1 1 37 37 GLY C C 37 169.261 169.261 174.404 -5.143 25033
139 1 1 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.845 1.612 25033
140 1 1 . 1 1 37 37 GLY H H 37 9.349 9.349 8.694 0.655 25033
141 1 1 . 1 1 38 38 GLY N N 38 109.050 109.050 108.581 0.469 25033
142 1 1 . 1 1 38 38 GLY C C 38 175.177 175.177 174.560 0.617 25033
143 1 1 . 1 1 38 38 GLY H H 38 8.756 8.756 8.193 0.563 25033
144 1 1 . 1 1 39 39 GLY N N 39 107.730 107.730 106.538 1.192 25033
145 1 1 . 1 1 39 39 GLY C C 39 173.870 173.870 173.908 -0.038 25033
146 1 1 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.728 -1.470 25033
147 1 1 . 1 1 39 39 GLY H H 39 7.725 7.725 7.842 -0.117 25033
148 1 1 . 1 1 40 40 GLY N N 40 107.183 107.183 111.763 -4.580 25033
149 1 1 . 1 1 40 40 GLY C C 40 173.067 173.067 173.202 -0.135 25033
150 1 1 . 1 1 40 40 GLY CA C 40 43.760 43.760 45.951 -2.191 25033
151 1 1 . 1 1 40 40 GLY H H 40 8.096 8.096 8.241 -0.145 25033
152 1 1 . 1 1 41 41 GLU N N 41 119.455 119.455 122.209 -2.754 25033
153 1 1 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.500 -0.322 25033
154 1 1 . 1 1 41 41 GLU C C 41 175.900 175.900 175.287 0.613 25033
155 1 1 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.653 0.724 25033
156 1 1 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.441 0.159 25033
157 1 1 . 1 1 41 41 GLU H H 41 8.199 8.199 8.477 -0.278 25033
158 1 1 . 1 1 42 42 ASP N N 42 119.784 119.784 122.508 -2.724 25033
159 1 1 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.155 -0.298 25033
160 1 1 . 1 1 42 42 ASP C C 42 176.474 176.474 175.700 0.774 25033
161 1 1 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.550 1.891 25033
162 1 1 . 1 1 42 42 ASP CB C 42 41.488 41.488 42.758 -1.270 25033
163 1 1 . 1 1 42 42 ASP H H 42 8.277 8.277 8.367 -0.090 25033
164 1 1 . 1 1 43 43 LEU N N 43 122.515 122.515 119.753 2.762 25033
165 1 1 . 1 1 43 43 LEU HA H 43 4.687 4.687 5.021 -0.334 25033
166 1 1 . 1 1 43 43 LEU C C 43 175.759 175.759 175.199 0.560 25033
167 1 1 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.718 -0.414 25033
168 1 1 . 1 1 43 43 LEU CB C 43 45.449 45.449 44.267 1.183 25033
169 1 1 . 1 1 43 43 LEU H H 43 9.423 9.423 8.172 1.251 25033
170 1 1 . 1 1 44 44 PHE N N 44 125.962 125.962 118.136 7.826 25033
171 1 1 . 1 1 44 44 PHE HA H 44 3.922 3.922 5.301 -1.379 25033
172 1 1 . 1 1 44 44 PHE C C 44 172.844 172.844 174.439 -1.595 25033
173 1 1 . 1 1 44 44 PHE CA C 44 57.880 57.880 55.972 1.908 25033
174 1 1 . 1 1 44 44 PHE CB C 44 40.350 40.350 40.363 -0.013 25033
175 1 1 . 1 1 44 44 PHE H H 44 8.465 8.465 8.139 0.326 25033
176 1 1 . 1 1 45 45 VAL N N 45 123.552 123.552 122.022 1.530 25033
177 1 1 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.419 0.238 25033
178 1 1 . 1 1 45 45 VAL C C 45 177.433 177.433 173.723 3.710 25033
179 1 1 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.321 -1.861 25033
180 1 1 . 1 1 45 45 VAL CB C 45 34.884 34.884 35.274 -0.390 25033
181 1 1 . 1 1 45 45 VAL H H 45 7.715 7.715 8.004 -0.289 25033
182 1 1 . 1 1 46 46 HIS N N 46 127.300 127.300 126.153 1.147 25033
183 1 1 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.871 -0.046 25033
184 1 1 . 1 1 46 46 HIS C C 46 176.469 176.469 174.031 2.438 25033
185 1 1 . 1 1 46 46 HIS CA C 46 55.929 55.929 54.269 1.661 25033
186 1 1 . 1 1 46 46 HIS CB C 46 34.399 34.399 32.407 1.992 25033
187 1 1 . 1 1 46 46 HIS H H 46 9.104 9.104 8.570 0.534 25033
188 1 1 . 1 1 47 47 GLN N N 47 125.105 125.105 125.993 -0.888 25033
189 1 1 . 1 1 47 47 GLN H H 47 8.352 8.352 8.687 -0.335 25033
190 1 1 . 1 1 48 48 THR HA H 48 4.310 4.310 4.250 0.060 25033
191 1 1 . 1 1 48 48 THR C C 48 175.568 175.568 174.812 0.756 25033
192 1 1 . 1 1 48 48 THR CA C 48 64.770 64.770 63.171 1.599 25033
193 1 1 . 1 1 48 48 THR CB C 48 70.054 70.054 69.651 0.403 25033
194 1 1 . 1 1 49 49 ASN N N 49 118.142 118.142 118.632 -0.490 25033
195 1 1 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.887 0.273 25033
196 1 1 . 1 1 49 49 ASN C C 49 172.914 172.914 173.917 -1.003 25033
197 1 1 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.245 1.106 25033
198 1 1 . 1 1 49 49 ASN CB C 49 40.527 40.527 40.112 0.415 25033
199 1 1 . 1 1 49 49 ASN H H 49 8.452 8.452 8.398 0.054 25033
200 1 1 . 1 1 50 50 ILE N N 50 119.226 119.226 120.691 -1.465 25033
201 1 1 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.238 -0.126 25033
202 1 1 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.485 1.121 25033
203 1 1 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.673 1.689 25033
204 1 1 . 1 1 50 50 ILE H H 50 7.354 7.354 7.751 -0.397 25033
205 1 1 . 1 1 51 51 ASN N N 51 128.460 128.460 123.016 5.444 25033
206 1 1 . 1 1 51 51 ASN C C 51 174.614 174.614 173.486 1.128 25033
207 1 1 . 1 1 51 51 ASN H H 51 9.266 9.266 8.025 1.241 25033
208 1 1 . 1 1 52 52 SER N N 52 117.246 117.246 117.151 0.095 25033
209 1 1 . 1 1 52 52 SER HA H 52 4.413 4.413 4.616 -0.203 25033
210 1 1 . 1 1 52 52 SER C C 52 174.139 174.139 174.281 -0.142 25033
211 1 1 . 1 1 52 52 SER CA C 52 58.378 58.378 56.999 1.379 25033
212 1 1 . 1 1 52 52 SER CB C 52 64.371 64.371 64.231 0.140 25033
213 1 1 . 1 1 52 52 SER H H 52 7.973 7.973 8.498 -0.524 25033
214 1 1 . 1 1 53 53 GLU N N 53 123.628 123.628 121.047 2.581 25033
215 1 1 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.267 0.031 25033
216 1 1 . 1 1 53 53 GLU C C 53 176.960 176.960 176.941 0.019 25033
217 1 1 . 1 1 53 53 GLU CA C 53 57.270 57.270 57.644 -0.374 25033
218 1 1 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.913 -0.052 25033
219 1 1 . 1 1 53 53 GLU H H 53 8.641 8.641 8.619 0.022 25033
220 1 1 . 1 1 54 54 GLY N N 54 110.282 110.282 107.806 2.476 25033
221 1 1 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.708 -0.108 25033
222 1 1 . 1 1 54 54 GLY H H 54 8.225 8.225 7.813 0.412 25033
223 1 1 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.785 0.035 25033
224 1 1 . 1 1 55 55 PHE C C 55 175.836 175.836 174.399 1.437 25033
225 1 1 . 1 1 55 55 PHE CA C 55 52.690 52.690 56.615 -3.925 25033
226 1 1 . 1 1 55 55 PHE CB C 55 38.095 38.095 40.715 -2.620 25033
227 1 1 . 1 1 56 56 ARG N N 56 120.907 120.907 120.082 0.825 25033
228 1 1 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.689 -0.425 25033
229 1 1 . 1 1 56 56 ARG C C 56 175.618 175.618 175.305 0.313 25033
230 1 1 . 1 1 56 56 ARG CA C 56 55.510 55.510 56.111 -0.601 25033
231 1 1 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.364 0.655 25033
232 1 1 . 1 1 56 56 ARG H H 56 8.153 8.153 8.714 -0.561 25033
233 1 1 . 1 1 57 57 SER N N 57 123.117 123.117 120.401 2.716 25033
234 1 1 . 1 1 57 57 SER H H 57 7.834 7.834 8.591 -0.757 25033
235 1 1 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.812 -0.532 25033
236 1 1 . 1 1 58 58 LEU C C 58 174.842 174.842 176.759 -1.917 25033
237 1 1 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.759 -0.999 25033
238 1 1 . 1 1 58 58 LEU CB C 58 42.580 42.580 44.791 -2.211 25033
239 1 1 . 1 1 59 59 ARG N N 59 119.557 119.557 120.342 -0.785 25033
240 1 1 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.619 -0.034 25033
241 1 1 . 1 1 59 59 ARG C C 59 175.256 175.256 175.260 -0.004 25033
242 1 1 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.912 -0.800 25033
243 1 1 . 1 1 59 59 ARG CB C 59 32.970 32.970 32.486 0.484 25033
244 1 1 . 1 1 59 59 ARG H H 59 8.529 8.529 8.629 -0.100 25033
245 1 1 . 1 1 60 60 GLU N N 60 121.597 121.597 121.073 0.524 25033
246 1 1 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.248 -0.667 25033
247 1 1 . 1 1 60 60 GLU C C 60 177.281 177.281 176.759 0.522 25033
248 1 1 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.738 0.563 25033
249 1 1 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.738 -0.478 25033
250 1 1 . 1 1 60 60 GLU H H 60 8.691 8.691 8.636 0.055 25033
251 1 1 . 1 1 61 61 GLY N N 61 113.554 113.554 111.012 2.542 25033
252 1 1 . 1 1 61 61 GLY C C 61 174.068 174.068 174.488 -0.420 25033
253 1 1 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.763 0.480 25033
254 1 1 . 1 1 61 61 GLY H H 61 9.151 9.151 8.816 0.335 25033
255 1 1 . 1 1 62 62 GLU N N 62 121.639 121.639 122.438 -0.799 25033
256 1 1 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.330 -0.126 25033
257 1 1 . 1 1 62 62 GLU C C 62 175.439 175.439 175.987 -0.548 25033
258 1 1 . 1 1 62 62 GLU CA C 62 57.342 57.342 57.022 0.320 25033
259 1 1 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.696 0.229 25033
260 1 1 . 1 1 62 62 GLU H H 62 7.889 7.889 7.699 0.190 25033
261 1 1 . 1 1 63 63 VAL N N 63 125.003 125.003 125.097 -0.094 25033
262 1 1 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.771 -0.023 25033
263 1 1 . 1 1 63 63 VAL C C 63 176.639 176.639 175.811 0.828 25033
264 1 1 . 1 1 63 63 VAL CA C 63 62.631 62.631 60.631 2.000 25033
265 1 1 . 1 1 63 63 VAL CB C 63 32.357 32.357 33.153 -0.796 25033
266 1 1 . 1 1 63 63 VAL H H 63 8.477 8.477 8.260 0.217 25033
267 1 1 . 1 1 64 64 VAL N N 64 120.113 120.113 122.003 -1.890 25033
268 1 1 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.611 0.393 25033
269 1 1 . 1 1 64 64 VAL C C 64 173.790 173.790 173.901 -0.111 25033
270 1 1 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.245 -0.636 25033
271 1 1 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.601 0.759 25033
272 1 1 . 1 1 64 64 VAL H H 64 8.686 8.686 8.791 -0.105 25033
273 1 1 . 1 1 65 65 GLU N N 65 120.433 120.433 121.266 -0.833 25033
274 1 1 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.421 0.026 25033
275 1 1 . 1 1 65 65 GLU C C 65 175.584 175.584 175.688 -0.104 25033
276 1 1 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.537 -0.147 25033
277 1 1 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.037 0.966 25033
278 1 1 . 1 1 65 65 GLU H H 65 9.003 9.003 8.372 0.631 25033
279 1 1 . 1 1 66 66 PHE N N 66 116.104 116.104 119.359 -3.255 25033
280 1 1 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.071 -0.010 25033
281 1 1 . 1 1 66 66 PHE C C 66 173.001 173.001 172.766 0.235 25033
282 1 1 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.908 -0.051 25033
283 1 1 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.815 -0.383 25033
284 1 1 . 1 1 66 66 PHE H H 66 8.172 8.172 7.687 0.485 25033
285 1 1 . 1 1 67 67 GLU N N 67 117.574 117.574 118.820 -1.246 25033
286 1 1 . 1 1 67 67 GLU HA H 67 4.872 4.872 4.793 0.079 25033
287 1 1 . 1 1 67 67 GLU C C 67 175.327 175.327 174.861 0.466 25033
288 1 1 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.579 0.062 25033
289 1 1 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.640 -0.620 25033
290 1 1 . 1 1 67 67 GLU H H 67 8.668 8.668 8.636 0.032 25033
291 1 1 . 1 1 68 68 VAL N N 68 120.881 120.881 124.530 -3.649 25033
292 1 1 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.399 0.613 25033
293 1 1 . 1 1 68 68 VAL C C 68 176.140 176.140 175.670 0.470 25033
294 1 1 . 1 1 68 68 VAL CA C 68 62.338 62.338 61.960 0.378 25033
295 1 1 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.156 1.850 25033
296 1 1 . 1 1 68 68 VAL H H 68 8.748 8.748 8.614 0.134 25033
297 1 1 . 1 1 69 69 GLU N N 69 128.110 128.110 129.377 -1.267 25033
298 1 1 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.634 0.071 25033
299 1 1 . 1 1 69 69 GLU C C 69 174.573 174.573 174.816 -0.243 25033
300 1 1 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.666 0.286 25033
301 1 1 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.109 1.181 25033
302 1 1 . 1 1 69 69 GLU H H 69 9.070 9.070 9.117 -0.047 25033
303 1 1 . 1 1 70 70 ALA N N 70 127.944 127.944 128.129 -0.185 25033
304 1 1 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.201 -0.197 25033
305 1 1 . 1 1 70 70 ALA C C 70 178.073 178.073 177.103 0.970 25033
306 1 1 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.897 0.062 25033
307 1 1 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.622 -1.133 25033
308 1 1 . 1 1 70 70 ALA H H 70 8.671 8.671 8.574 0.097 25033
309 1 1 . 1 1 71 71 GLY N N 71 110.340 110.340 111.426 -1.086 25033
310 1 1 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.593 0.423 25033
311 1 1 . 1 1 71 71 GLY H H 71 8.445 8.445 8.225 0.220 25033
312 1 1 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.393 0.024 25033
313 1 1 . 1 1 72 72 PRO C C 72 176.835 176.835 176.695 0.140 25033
314 1 1 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.529 -0.369 25033
315 1 1 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.631 0.249 25033
316 1 1 . 1 1 73 73 ASP N N 73 116.498 116.498 118.007 -1.509 25033
317 1 1 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.562 -0.047 25033
318 1 1 . 1 1 73 73 ASP C C 73 176.775 176.775 177.391 -0.616 25033
319 1 1 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.438 -0.891 25033
320 1 1 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.442 -0.208 25033
321 1 1 . 1 1 73 73 ASP H H 73 8.248 8.248 8.215 0.033 25033
322 1 1 . 1 1 74 74 GLY N N 74 107.369 107.369 107.951 -0.582 25033
323 1 1 . 1 1 74 74 GLY C C 74 174.331 174.331 173.582 0.749 25033
324 1 1 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.880 0.698 25033
325 1 1 . 1 1 74 74 GLY H H 74 8.153 8.153 7.684 0.469 25033
326 1 1 . 1 1 75 75 ARG N N 75 120.942 120.942 119.738 1.204 25033
327 1 1 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.573 -0.031 25033
328 1 1 . 1 1 75 75 ARG C C 75 176.652 176.652 174.940 1.712 25033
329 1 1 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.812 -0.154 25033
330 1 1 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.067 -0.158 25033
331 1 1 . 1 1 75 75 ARG H H 75 7.670 7.670 8.130 -0.460 25033
332 1 1 . 1 1 76 76 SER N N 76 120.181 120.181 116.081 4.100 25033
333 1 1 . 1 1 76 76 SER HA H 76 5.035 5.035 5.628 -0.593 25033
334 1 1 . 1 1 76 76 SER C C 76 172.816 172.816 173.887 -1.071 25033
335 1 1 . 1 1 76 76 SER CA C 76 59.080 59.080 56.366 2.714 25033
336 1 1 . 1 1 76 76 SER CB C 76 64.850 64.850 66.221 -1.371 25033
337 1 1 . 1 1 76 76 SER H H 76 8.808 8.808 8.283 0.525 25033
338 1 1 . 1 1 77 77 LYS N N 77 121.202 121.202 119.494 1.708 25033
339 1 1 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.696 0.478 25033
340 1 1 . 1 1 77 77 LYS C C 77 173.706 173.706 174.079 -0.373 25033
341 1 1 . 1 1 77 77 LYS CA C 77 54.599 54.599 55.405 -0.806 25033
342 1 1 . 1 1 77 77 LYS CB C 77 36.035 36.035 35.276 0.759 25033
343 1 1 . 1 1 77 77 LYS H H 77 8.982 8.982 8.777 0.205 25033
344 1 1 . 1 1 78 78 ALA N N 78 124.064 124.064 123.390 0.674 25033
345 1 1 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.954 0.050 25033
346 1 1 . 1 1 78 78 ALA C C 78 175.979 175.979 176.362 -0.383 25033
347 1 1 . 1 1 78 78 ALA CA C 78 50.445 50.445 50.889 -0.445 25033
348 1 1 . 1 1 78 78 ALA CB C 78 20.136 20.136 19.969 0.167 25033
349 1 1 . 1 1 78 78 ALA H H 78 8.706 8.706 8.403 0.303 25033
350 1 1 . 1 1 79 79 VAL N N 79 113.264 113.264 116.742 -3.478 25033
351 1 1 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.422 0.421 25033
352 1 1 . 1 1 79 79 VAL C C 79 174.744 174.744 174.437 0.307 25033
353 1 1 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.754 -0.681 25033
354 1 1 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.644 -0.048 25033
355 1 1 . 1 1 79 79 VAL H H 79 9.165 9.165 7.721 1.444 25033
356 1 1 . 1 1 80 80 ASN N N 80 120.084 120.084 115.987 4.097 25033
357 1 1 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.330 0.026 25033
358 1 1 . 1 1 80 80 ASN C C 80 175.391 175.391 173.868 1.523 25033
359 1 1 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.706 0.028 25033
360 1 1 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.745 0.376 25033
361 1 1 . 1 1 80 80 ASN H H 80 8.923 8.923 8.571 0.352 25033
362 1 1 . 1 1 81 81 VAL N N 81 119.178 119.178 119.083 0.095 25033
363 1 1 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.575 0.172 25033
364 1 1 . 1 1 81 81 VAL C C 81 176.340 176.340 176.487 -0.147 25033
365 1 1 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.112 1.048 25033
366 1 1 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.305 0.825 25033
367 1 1 . 1 1 81 81 VAL H H 81 8.282 8.282 7.670 0.612 25033
368 1 2 . 1 1 12 12 SER N N 12 116.112 116.112 115.807 0.305 25033
369 1 2 . 1 1 12 12 SER C C 12 175.271 175.271 175.010 0.261 25033
370 1 2 . 1 1 12 12 SER CA C 12 58.570 58.570 59.039 -0.469 25033
371 1 2 . 1 1 12 12 SER CB C 12 63.984 63.984 63.549 0.435 25033
372 1 2 . 1 1 12 12 SER H H 12 8.422 8.422 8.418 0.004 25033
373 1 2 . 1 1 13 13 GLY N N 13 111.178 111.178 108.677 2.501 25033
374 1 2 . 1 1 13 13 GLY C C 13 174.238 174.238 173.833 0.405 25033
375 1 2 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.959 0.561 25033
376 1 2 . 1 1 13 13 GLY H H 13 8.537 8.537 7.979 0.558 25033
377 1 2 . 1 1 14 14 GLU N N 14 120.547 120.547 115.950 4.597 25033
378 1 2 . 1 1 14 14 GLU HA H 14 4.267 4.267 3.947 0.320 25033
379 1 2 . 1 1 14 14 GLU C C 14 176.455 176.455 175.532 0.923 25033
380 1 2 . 1 1 14 14 GLU CA C 14 56.753 56.753 56.985 -0.232 25033
381 1 2 . 1 1 14 14 GLU CB C 14 30.464 30.464 28.072 2.392 25033
382 1 2 . 1 1 14 14 GLU H H 14 8.285 8.285 8.589 -0.304 25033
383 1 2 . 1 1 15 15 GLN N N 15 121.185 121.185 117.927 3.258 25033
384 1 2 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.159 0.190 25033
385 1 2 . 1 1 15 15 GLN C C 15 175.494 175.494 175.703 -0.209 25033
386 1 2 . 1 1 15 15 GLN CA C 15 55.670 55.670 56.811 -1.141 25033
387 1 2 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.394 0.016 25033
388 1 2 . 1 1 15 15 GLN H H 15 8.444 8.444 7.996 0.448 25033
389 1 2 . 1 1 16 16 LEU N N 16 123.934 123.934 125.129 -1.195 25033
390 1 2 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.637 -0.296 25033
391 1 2 . 1 1 16 16 LEU C C 16 176.942 176.942 174.763 2.179 25033
392 1 2 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.314 1.190 25033
393 1 2 . 1 1 16 16 LEU CB C 16 42.519 42.519 45.187 -2.668 25033
394 1 2 . 1 1 16 16 LEU H H 16 8.289 8.289 8.508 -0.219 25033
395 1 2 . 1 1 17 17 ARG N N 17 122.044 122.044 121.912 0.132 25033
396 1 2 . 1 1 17 17 ARG HA H 17 4.464 4.464 5.020 -0.556 25033
397 1 2 . 1 1 17 17 ARG C C 17 175.829 175.829 175.172 0.657 25033
398 1 2 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.438 1.234 25033
399 1 2 . 1 1 17 17 ARG CB C 17 29.830 29.830 31.418 -1.588 25033
400 1 2 . 1 1 17 17 ARG H H 17 8.216 8.216 8.476 -0.260 25033
401 1 2 . 1 1 18 18 GLN N N 18 122.488 122.488 123.323 -0.835 25033
402 1 2 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.477 -0.143 25033
403 1 2 . 1 1 18 18 GLN C C 18 172.958 172.958 173.575 -0.617 25033
404 1 2 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.339 0.562 25033
405 1 2 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.436 0.184 25033
406 1 2 . 1 1 18 18 GLN H H 18 8.573 8.573 8.140 0.433 25033
407 1 2 . 1 1 19 19 GLN N N 19 116.301 116.301 118.530 -2.229 25033
408 1 2 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.294 0.084 25033
409 1 2 . 1 1 19 19 GLN C C 19 176.902 176.902 174.572 2.330 25033
410 1 2 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.267 -0.052 25033
411 1 2 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.143 1.495 25033
412 1 2 . 1 1 19 19 GLN H H 19 8.146 8.146 8.404 -0.258 25033
413 1 2 . 1 1 20 20 GLY N N 20 109.745 109.745 110.378 -0.633 25033
414 1 2 . 1 1 20 20 GLY C C 20 170.989 170.989 172.459 -1.470 25033
415 1 2 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.216 1.719 25033
416 1 2 . 1 1 20 20 GLY H H 20 8.998 8.998 8.582 0.416 25033
417 1 2 . 1 1 21 21 THR N N 21 112.645 112.645 113.729 -1.084 25033
418 1 2 . 1 1 21 21 THR HA H 21 5.361 5.361 5.232 0.129 25033
419 1 2 . 1 1 21 21 THR C C 21 174.553 174.553 175.538 -0.985 25033
420 1 2 . 1 1 21 21 THR CA C 21 60.025 60.025 59.805 0.220 25033
421 1 2 . 1 1 21 21 THR CB C 21 71.720 71.720 71.650 0.071 25033
422 1 2 . 1 1 21 21 THR H H 21 8.312 8.312 8.393 -0.081 25033
423 1 2 . 1 1 22 22 VAL N N 22 125.915 125.915 120.948 4.967 25033
424 1 2 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.934 -0.285 25033
425 1 2 . 1 1 22 22 VAL C C 22 175.553 175.553 177.911 -2.358 25033
426 1 2 . 1 1 22 22 VAL CA C 22 64.618 64.618 65.023 -0.405 25033
427 1 2 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.572 0.049 25033
428 1 2 . 1 1 22 22 VAL H H 22 9.092 9.092 8.275 0.817 25033
429 1 2 . 1 1 23 23 LYS N N 23 135.790 135.790 119.200 16.590 25033
430 1 2 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.048 0.253 25033
431 1 2 . 1 1 23 23 LYS C C 23 176.301 176.301 176.515 -0.214 25033
432 1 2 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.660 -0.050 25033
433 1 2 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.369 2.931 25033
434 1 2 . 1 1 23 23 LYS H H 23 9.276 9.276 8.558 0.718 25033
435 1 2 . 1 1 24 24 TRP N N 24 111.651 111.651 119.412 -7.761 25033
436 1 2 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.860 -0.237 25033
437 1 2 . 1 1 24 24 TRP C C 24 173.628 173.628 174.581 -0.953 25033
438 1 2 . 1 1 24 24 TRP CA C 24 56.300 56.300 56.062 0.238 25033
439 1 2 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.871 1.389 25033
440 1 2 . 1 1 24 24 TRP H H 24 7.455 7.455 7.658 -0.203 25033
441 1 2 . 1 1 25 25 PHE N N 25 121.305 121.305 120.397 0.908 25033
442 1 2 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.738 -0.453 25033
443 1 2 . 1 1 25 25 PHE C C 25 172.354 172.354 174.923 -2.569 25033
444 1 2 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.314 2.058 25033
445 1 2 . 1 1 25 25 PHE CB C 25 42.569 42.569 41.798 0.771 25033
446 1 2 . 1 1 25 25 PHE H H 25 9.074 9.074 7.980 1.094 25033
447 1 2 . 1 1 26 26 ASN N N 26 126.976 126.976 124.109 2.867 25033
448 1 2 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.908 -0.096 25033
449 1 2 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.449 -1.037 25033
450 1 2 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.373 -0.287 25033
451 1 2 . 1 1 26 26 ASN H H 26 8.159 8.159 8.120 0.039 25033
452 1 2 . 1 1 27 27 ALA N N 27 128.245 128.245 124.761 3.484 25033
453 1 2 . 1 1 27 27 ALA HA H 27 4.121 4.121 3.935 0.186 25033
454 1 2 . 1 1 27 27 ALA C C 27 179.031 179.031 178.754 0.277 25033
455 1 2 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.259 -0.834 25033
456 1 2 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.861 -0.487 25033
457 1 2 . 1 1 27 27 ALA H H 27 9.036 9.036 8.452 0.584 25033
458 1 2 . 1 1 28 28 THR N N 28 113.994 113.994 113.089 0.905 25033
459 1 2 . 1 1 28 28 THR HA H 28 4.068 4.068 4.023 0.045 25033
460 1 2 . 1 1 28 28 THR C C 28 176.084 176.084 175.845 0.239 25033
461 1 2 . 1 1 28 28 THR CA C 28 65.820 65.820 65.041 0.779 25033
462 1 2 . 1 1 28 28 THR CB C 28 68.291 68.291 68.043 0.248 25033
463 1 2 . 1 1 28 28 THR H H 28 8.065 8.065 8.070 -0.005 25033
464 1 2 . 1 1 29 29 LYS N N 29 118.922 118.922 118.933 -0.011 25033
465 1 2 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.308 -0.052 25033
466 1 2 . 1 1 29 29 LYS C C 29 177.201 177.201 177.474 -0.273 25033
467 1 2 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.305 0.583 25033
468 1 2 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.798 0.942 25033
469 1 2 . 1 1 29 29 LYS H H 29 7.446 7.446 7.566 -0.120 25033
470 1 2 . 1 1 30 30 GLY N N 30 107.601 107.601 107.642 -0.041 25033
471 1 2 . 1 1 30 30 GLY C C 30 172.004 172.004 173.217 -1.213 25033
472 1 2 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.168 1.236 25033
473 1 2 . 1 1 30 30 GLY H H 30 8.115 8.115 7.967 0.148 25033
474 1 2 . 1 1 31 31 PHE N N 31 112.488 112.488 119.220 -6.732 25033
475 1 2 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.598 0.409 25033
476 1 2 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.445 -2.167 25033
477 1 2 . 1 1 31 31 PHE CB C 31 42.388 42.388 41.075 1.313 25033
478 1 2 . 1 1 31 31 PHE H H 31 6.594 6.594 7.440 -0.846 25033
479 1 2 . 1 1 32 32 GLY N N 32 105.986 105.986 109.338 -3.352 25033
480 1 2 . 1 1 32 32 GLY C C 32 170.292 170.292 171.911 -1.619 25033
481 1 2 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.553 1.816 25033
482 1 2 . 1 1 32 32 GLY H H 32 8.144 8.144 7.640 0.504 25033
483 1 2 . 1 1 33 33 PHE N N 33 115.319 115.319 116.074 -0.755 25033
484 1 2 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.321 0.142 25033
485 1 2 . 1 1 33 33 PHE C C 33 175.037 175.037 175.058 -0.021 25033
486 1 2 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.561 -1.266 25033
487 1 2 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.175 0.617 25033
488 1 2 . 1 1 33 33 PHE H H 33 7.971 7.971 7.934 0.037 25033
489 1 2 . 1 1 34 34 ILE N N 34 122.140 122.140 120.687 1.453 25033
490 1 2 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.696 -0.379 25033
491 1 2 . 1 1 34 34 ILE C C 34 174.526 174.526 175.066 -0.540 25033
492 1 2 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.859 -0.062 25033
493 1 2 . 1 1 34 34 ILE CB C 34 42.583 42.583 41.383 1.200 25033
494 1 2 . 1 1 34 34 ILE H H 34 9.511 9.511 9.033 0.478 25033
495 1 2 . 1 1 35 35 THR N N 35 126.580 126.580 121.682 4.898 25033
496 1 2 . 1 1 35 35 THR HA H 35 5.143 5.143 4.992 0.151 25033
497 1 2 . 1 1 35 35 THR CA C 35 59.330 59.330 57.678 1.652 25033
498 1 2 . 1 1 35 35 THR CB C 35 70.258 70.258 69.434 0.824 25033
499 1 2 . 1 1 35 35 THR H H 35 9.416 9.416 8.769 0.647 25033
500 1 2 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.581 0.018 25033
501 1 2 . 1 1 36 36 PRO C C 36 177.390 177.390 177.563 -0.173 25033
502 1 2 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.031 0.189 25033
503 1 2 . 1 1 36 36 PRO CB C 36 32.470 32.470 31.535 0.935 25033
504 1 2 . 1 1 37 37 GLY N N 37 112.033 112.033 114.076 -2.043 25033
505 1 2 . 1 1 37 37 GLY C C 37 169.261 169.261 174.432 -5.171 25033
506 1 2 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.902 1.555 25033
507 1 2 . 1 1 37 37 GLY H H 37 9.349 9.349 8.466 0.883 25033
508 1 2 . 1 1 38 38 GLY N N 38 109.050 109.050 109.282 -0.232 25033
509 1 2 . 1 1 38 38 GLY C C 38 175.177 175.177 175.420 -0.243 25033
510 1 2 . 1 1 38 38 GLY H H 38 8.756 8.756 8.138 0.618 25033
511 1 2 . 1 1 39 39 GLY N N 39 107.730 107.730 107.986 -0.256 25033
512 1 2 . 1 1 39 39 GLY C C 39 173.870 173.870 175.200 -1.330 25033
513 1 2 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.214 -0.956 25033
514 1 2 . 1 1 39 39 GLY H H 39 7.725 7.725 8.485 -0.760 25033
515 1 2 . 1 1 40 40 GLY N N 40 107.183 107.183 107.906 -0.723 25033
516 1 2 . 1 1 40 40 GLY C C 40 173.067 173.067 174.129 -1.062 25033
517 1 2 . 1 1 40 40 GLY CA C 40 43.760 43.760 44.958 -1.198 25033
518 1 2 . 1 1 40 40 GLY H H 40 8.096 8.096 8.222 -0.126 25033
519 1 2 . 1 1 41 41 GLU N N 41 119.455 119.455 123.330 -3.875 25033
520 1 2 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.273 -0.095 25033
521 1 2 . 1 1 41 41 GLU C C 41 175.900 175.900 175.388 0.512 25033
522 1 2 . 1 1 41 41 GLU CA C 41 56.377 56.377 56.305 0.072 25033
523 1 2 . 1 1 41 41 GLU CB C 41 30.600 30.600 29.736 0.864 25033
524 1 2 . 1 1 41 41 GLU H H 41 8.199 8.199 8.206 -0.007 25033
525 1 2 . 1 1 42 42 ASP N N 42 119.784 119.784 122.412 -2.628 25033
526 1 2 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.178 -0.321 25033
527 1 2 . 1 1 42 42 ASP C C 42 176.474 176.474 175.375 1.099 25033
528 1 2 . 1 1 42 42 ASP CA C 42 55.441 55.441 52.638 2.803 25033
529 1 2 . 1 1 42 42 ASP CB C 42 41.488 41.488 42.002 -0.514 25033
530 1 2 . 1 1 42 42 ASP H H 42 8.277 8.277 8.273 0.004 25033
531 1 2 . 1 1 43 43 LEU N N 43 122.515 122.515 122.133 0.382 25033
532 1 2 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.642 0.045 25033
533 1 2 . 1 1 43 43 LEU C C 43 175.759 175.759 176.678 -0.919 25033
534 1 2 . 1 1 43 43 LEU CA C 43 53.304 53.304 54.031 -0.727 25033
535 1 2 . 1 1 43 43 LEU CB C 43 45.449 45.449 44.431 1.018 25033
536 1 2 . 1 1 43 43 LEU H H 43 9.423 9.423 8.927 0.496 25033
537 1 2 . 1 1 44 44 PHE N N 44 125.962 125.962 120.113 5.849 25033
538 1 2 . 1 1 44 44 PHE HA H 44 3.922 3.922 5.000 -1.078 25033
539 1 2 . 1 1 44 44 PHE C C 44 172.844 172.844 174.954 -2.110 25033
540 1 2 . 1 1 44 44 PHE CA C 44 57.880 57.880 56.488 1.392 25033
541 1 2 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.910 0.440 25033
542 1 2 . 1 1 44 44 PHE H H 44 8.465 8.465 7.897 0.568 25033
543 1 2 . 1 1 45 45 VAL N N 45 123.552 123.552 123.523 0.029 25033
544 1 2 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.626 0.031 25033
545 1 2 . 1 1 45 45 VAL C C 45 177.433 177.433 173.600 3.833 25033
546 1 2 . 1 1 45 45 VAL CA C 45 58.460 58.460 59.846 -1.386 25033
547 1 2 . 1 1 45 45 VAL CB C 45 34.884 34.884 35.918 -1.034 25033
548 1 2 . 1 1 45 45 VAL H H 45 7.715 7.715 8.215 -0.500 25033
549 1 2 . 1 1 46 46 HIS N N 46 127.300 127.300 122.747 4.553 25033
550 1 2 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.680 0.145 25033
551 1 2 . 1 1 46 46 HIS C C 46 176.469 176.469 174.441 2.028 25033
552 1 2 . 1 1 46 46 HIS CA C 46 55.929 55.929 53.661 2.268 25033
553 1 2 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.637 2.763 25033
554 1 2 . 1 1 46 46 HIS H H 46 9.104 9.104 8.353 0.751 25033
555 1 2 . 1 1 47 47 GLN N N 47 125.105 125.105 124.706 0.399 25033
556 1 2 . 1 1 47 47 GLN H H 47 8.352 8.352 8.695 -0.343 25033
557 1 2 . 1 1 48 48 THR HA H 48 4.310 4.310 4.379 -0.069 25033
558 1 2 . 1 1 48 48 THR C C 48 175.568 175.568 174.813 0.755 25033
559 1 2 . 1 1 48 48 THR CA C 48 64.770 64.770 62.626 2.144 25033
560 1 2 . 1 1 48 48 THR CB C 48 70.054 70.054 69.498 0.556 25033
561 1 2 . 1 1 49 49 ASN N N 49 118.142 118.142 118.708 -0.566 25033
562 1 2 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.815 0.345 25033
563 1 2 . 1 1 49 49 ASN C C 49 172.914 172.914 173.608 -0.694 25033
564 1 2 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.077 1.274 25033
565 1 2 . 1 1 49 49 ASN CB C 49 40.527 40.527 40.016 0.511 25033
566 1 2 . 1 1 49 49 ASN H H 49 8.452 8.452 8.381 0.071 25033
567 1 2 . 1 1 50 50 ILE N N 50 119.226 119.226 120.291 -1.065 25033
568 1 2 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.196 -0.084 25033
569 1 2 . 1 1 50 50 ILE CA C 50 61.606 61.606 61.133 0.473 25033
570 1 2 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.753 1.609 25033
571 1 2 . 1 1 50 50 ILE H H 50 7.354 7.354 7.955 -0.601 25033
572 1 2 . 1 1 51 51 ASN N N 51 128.460 128.460 123.172 5.288 25033
573 1 2 . 1 1 51 51 ASN C C 51 174.614 174.614 174.412 0.202 25033
574 1 2 . 1 1 51 51 ASN H H 51 9.266 9.266 7.898 1.368 25033
575 1 2 . 1 1 52 52 SER N N 52 117.246 117.246 114.233 3.013 25033
576 1 2 . 1 1 52 52 SER HA H 52 4.413 4.413 4.796 -0.383 25033
577 1 2 . 1 1 52 52 SER C C 52 174.139 174.139 174.331 -0.192 25033
578 1 2 . 1 1 52 52 SER CA C 52 58.378 58.378 57.688 0.690 25033
579 1 2 . 1 1 52 52 SER CB C 52 64.371 64.371 65.723 -1.352 25033
580 1 2 . 1 1 52 52 SER H H 52 7.973 7.973 8.335 -0.362 25033
581 1 2 . 1 1 53 53 GLU N N 53 123.628 123.628 119.567 4.061 25033
582 1 2 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.364 -0.066 25033
583 1 2 . 1 1 53 53 GLU C C 53 176.960 176.960 176.603 0.357 25033
584 1 2 . 1 1 53 53 GLU CA C 53 57.270 57.270 56.915 0.355 25033
585 1 2 . 1 1 53 53 GLU CB C 53 29.861 29.861 30.180 -0.319 25033
586 1 2 . 1 1 53 53 GLU H H 53 8.641 8.641 8.598 0.043 25033
587 1 2 . 1 1 54 54 GLY N N 54 110.282 110.282 108.109 2.173 25033
588 1 2 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.650 -0.050 25033
589 1 2 . 1 1 54 54 GLY H H 54 8.225 8.225 7.945 0.280 25033
590 1 2 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.882 -0.062 25033
591 1 2 . 1 1 55 55 PHE C C 55 175.836 175.836 174.901 0.935 25033
592 1 2 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.120 -4.430 25033
593 1 2 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.323 -3.228 25033
594 1 2 . 1 1 56 56 ARG N N 56 120.907 120.907 124.175 -3.268 25033
595 1 2 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.679 -0.415 25033
596 1 2 . 1 1 56 56 ARG C C 56 175.618 175.618 175.562 0.056 25033
597 1 2 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.575 -0.065 25033
598 1 2 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.006 1.014 25033
599 1 2 . 1 1 56 56 ARG H H 56 8.153 8.153 8.654 -0.501 25033
600 1 2 . 1 1 57 57 SER N N 57 123.117 123.117 117.807 5.310 25033
601 1 2 . 1 1 57 57 SER H H 57 7.834 7.834 8.327 -0.493 25033
602 1 2 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.667 -0.387 25033
603 1 2 . 1 1 58 58 LEU C C 58 174.842 174.842 176.352 -1.510 25033
604 1 2 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.760 -1.000 25033
605 1 2 . 1 1 58 58 LEU CB C 58 42.580 42.580 44.079 -1.499 25033
606 1 2 . 1 1 59 59 ARG N N 59 119.557 119.557 121.534 -1.977 25033
607 1 2 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.625 -0.040 25033
608 1 2 . 1 1 59 59 ARG C C 59 175.256 175.256 175.000 0.256 25033
609 1 2 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.518 -0.406 25033
610 1 2 . 1 1 59 59 ARG CB C 59 32.970 32.970 32.962 0.008 25033
611 1 2 . 1 1 59 59 ARG H H 59 8.529 8.529 8.459 0.070 25033
612 1 2 . 1 1 60 60 GLU N N 60 121.597 121.597 120.544 1.053 25033
613 1 2 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.197 -0.616 25033
614 1 2 . 1 1 60 60 GLU C C 60 177.281 177.281 176.865 0.416 25033
615 1 2 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.712 0.589 25033
616 1 2 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.557 -0.296 25033
617 1 2 . 1 1 60 60 GLU H H 60 8.691 8.691 8.596 0.095 25033
618 1 2 . 1 1 61 61 GLY N N 61 113.554 113.554 111.194 2.360 25033
619 1 2 . 1 1 61 61 GLY C C 61 174.068 174.068 174.545 -0.477 25033
620 1 2 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.805 0.438 25033
621 1 2 . 1 1 61 61 GLY H H 61 9.151 9.151 8.803 0.348 25033
622 1 2 . 1 1 62 62 GLU N N 62 121.639 121.639 122.688 -1.049 25033
623 1 2 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.256 -0.052 25033
624 1 2 . 1 1 62 62 GLU C C 62 175.439 175.439 176.099 -0.660 25033
625 1 2 . 1 1 62 62 GLU CA C 62 57.342 57.342 57.125 0.217 25033
626 1 2 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.599 0.326 25033
627 1 2 . 1 1 62 62 GLU H H 62 7.889 7.889 7.713 0.176 25033
628 1 2 . 1 1 63 63 VAL N N 63 125.003 125.003 125.590 -0.587 25033
629 1 2 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.773 -0.025 25033
630 1 2 . 1 1 63 63 VAL C C 63 176.639 176.639 176.487 0.152 25033
631 1 2 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.532 1.099 25033
632 1 2 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.320 0.037 25033
633 1 2 . 1 1 63 63 VAL H H 63 8.477 8.477 8.323 0.154 25033
634 1 2 . 1 1 64 64 VAL N N 64 120.113 120.113 120.812 -0.699 25033
635 1 2 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.620 0.384 25033
636 1 2 . 1 1 64 64 VAL C C 64 173.790 173.790 174.248 -0.458 25033
637 1 2 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.394 -0.785 25033
638 1 2 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.085 1.275 25033
639 1 2 . 1 1 64 64 VAL H H 64 8.686 8.686 9.079 -0.393 25033
640 1 2 . 1 1 65 65 GLU N N 65 120.433 120.433 122.474 -2.041 25033
641 1 2 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.093 0.354 25033
642 1 2 . 1 1 65 65 GLU C C 65 175.584 175.584 175.716 -0.132 25033
643 1 2 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.430 -0.040 25033
644 1 2 . 1 1 65 65 GLU CB C 65 34.003 34.003 32.919 1.084 25033
645 1 2 . 1 1 65 65 GLU H H 65 9.003 9.003 8.624 0.379 25033
646 1 2 . 1 1 66 66 PHE N N 66 116.104 116.104 121.283 -5.179 25033
647 1 2 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.150 -0.089 25033
648 1 2 . 1 1 66 66 PHE C C 66 173.001 173.001 173.331 -0.330 25033
649 1 2 . 1 1 66 66 PHE CA C 66 56.857 56.857 55.926 0.931 25033
650 1 2 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.988 -0.556 25033
651 1 2 . 1 1 66 66 PHE H H 66 8.172 8.172 7.494 0.678 25033
652 1 2 . 1 1 67 67 GLU N N 67 117.574 117.574 118.631 -1.057 25033
653 1 2 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.413 -0.541 25033
654 1 2 . 1 1 67 67 GLU C C 67 175.327 175.327 176.353 -1.026 25033
655 1 2 . 1 1 67 67 GLU CA C 67 54.641 54.641 53.942 0.699 25033
656 1 2 . 1 1 67 67 GLU CB C 67 33.020 33.020 32.688 0.332 25033
657 1 2 . 1 1 67 67 GLU H H 67 8.668 8.668 8.377 0.291 25033
658 1 2 . 1 1 68 68 VAL N N 68 120.881 120.881 123.296 -2.415 25033
659 1 2 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.483 0.529 25033
660 1 2 . 1 1 68 68 VAL C C 68 176.140 176.140 176.130 0.010 25033
661 1 2 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.699 -0.361 25033
662 1 2 . 1 1 68 68 VAL CB C 68 34.006 34.006 31.437 2.569 25033
663 1 2 . 1 1 68 68 VAL H H 68 8.748 8.748 8.107 0.641 25033
664 1 2 . 1 1 69 69 GLU N N 69 128.110 128.110 128.178 -0.068 25033
665 1 2 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.649 0.056 25033
666 1 2 . 1 1 69 69 GLU C C 69 174.573 174.573 174.872 -0.299 25033
667 1 2 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.492 0.461 25033
668 1 2 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.889 0.401 25033
669 1 2 . 1 1 69 69 GLU H H 69 9.070 9.070 9.049 0.021 25033
670 1 2 . 1 1 70 70 ALA N N 70 127.944 127.944 127.167 0.777 25033
671 1 2 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.198 -0.194 25033
672 1 2 . 1 1 70 70 ALA C C 70 178.073 178.073 177.455 0.618 25033
673 1 2 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.759 0.200 25033
674 1 2 . 1 1 70 70 ALA CB C 70 19.489 19.489 19.910 -0.421 25033
675 1 2 . 1 1 70 70 ALA H H 70 8.671 8.671 8.507 0.164 25033
676 1 2 . 1 1 71 71 GLY N N 71 110.340 110.340 111.756 -1.416 25033
677 1 2 . 1 1 71 71 GLY CA C 71 44.016 44.016 44.009 0.007 25033
678 1 2 . 1 1 71 71 GLY H H 71 8.445 8.445 8.113 0.332 25033
679 1 2 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.384 0.033 25033
680 1 2 . 1 1 72 72 PRO C C 72 176.835 176.835 176.565 0.270 25033
681 1 2 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.456 -0.296 25033
682 1 2 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.576 0.304 25033
683 1 2 . 1 1 73 73 ASP N N 73 116.498 116.498 117.518 -1.020 25033
684 1 2 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.572 -0.057 25033
685 1 2 . 1 1 73 73 ASP C C 73 176.775 176.775 177.332 -0.557 25033
686 1 2 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.527 -0.980 25033
687 1 2 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.648 -0.414 25033
688 1 2 . 1 1 73 73 ASP H H 73 8.248 8.248 8.272 -0.024 25033
689 1 2 . 1 1 74 74 GLY N N 74 107.369 107.369 108.648 -1.279 25033
690 1 2 . 1 1 74 74 GLY C C 74 174.331 174.331 174.226 0.105 25033
691 1 2 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.865 0.713 25033
692 1 2 . 1 1 74 74 GLY H H 74 8.153 8.153 7.727 0.426 25033
693 1 2 . 1 1 75 75 ARG N N 75 120.942 120.942 121.264 -0.322 25033
694 1 2 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.421 0.121 25033
695 1 2 . 1 1 75 75 ARG C C 75 176.652 176.652 175.763 0.889 25033
696 1 2 . 1 1 75 75 ARG CA C 75 55.658 55.658 56.145 -0.487 25033
697 1 2 . 1 1 75 75 ARG CB C 75 30.909 30.909 30.985 -0.076 25033
698 1 2 . 1 1 75 75 ARG H H 75 7.670 7.670 8.420 -0.750 25033
699 1 2 . 1 1 76 76 SER N N 76 120.181 120.181 116.838 3.343 25033
700 1 2 . 1 1 76 76 SER HA H 76 5.035 5.035 5.587 -0.552 25033
701 1 2 . 1 1 76 76 SER C C 76 172.816 172.816 174.334 -1.518 25033
702 1 2 . 1 1 76 76 SER CA C 76 59.080 59.080 56.862 2.218 25033
703 1 2 . 1 1 76 76 SER CB C 76 64.850 64.850 65.340 -0.490 25033
704 1 2 . 1 1 76 76 SER H H 76 8.808 8.808 8.425 0.383 25033
705 1 2 . 1 1 77 77 LYS N N 77 121.202 121.202 118.625 2.577 25033
706 1 2 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.795 0.379 25033
707 1 2 . 1 1 77 77 LYS C C 77 173.706 173.706 174.101 -0.395 25033
708 1 2 . 1 1 77 77 LYS CA C 77 54.599 54.599 55.303 -0.704 25033
709 1 2 . 1 1 77 77 LYS CB C 77 36.035 36.035 35.641 0.394 25033
710 1 2 . 1 1 77 77 LYS H H 77 8.982 8.982 8.537 0.445 25033
711 1 2 . 1 1 78 78 ALA N N 78 124.064 124.064 123.710 0.354 25033
712 1 2 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.862 0.142 25033
713 1 2 . 1 1 78 78 ALA C C 78 175.979 175.979 176.348 -0.369 25033
714 1 2 . 1 1 78 78 ALA CA C 78 50.445 50.445 50.736 -0.291 25033
715 1 2 . 1 1 78 78 ALA CB C 78 20.136 20.136 20.105 0.031 25033
716 1 2 . 1 1 78 78 ALA H H 78 8.706 8.706 8.652 0.054 25033
717 1 2 . 1 1 79 79 VAL N N 79 113.264 113.264 116.117 -2.853 25033
718 1 2 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.375 0.468 25033
719 1 2 . 1 1 79 79 VAL C C 79 174.744 174.744 174.407 0.337 25033
720 1 2 . 1 1 79 79 VAL CA C 79 59.073 59.073 60.262 -1.189 25033
721 1 2 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.918 -0.322 25033
722 1 2 . 1 1 79 79 VAL H H 79 9.165 9.165 7.628 1.537 25033
723 1 2 . 1 1 80 80 ASN N N 80 120.084 120.084 114.853 5.231 25033
724 1 2 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.330 0.026 25033
725 1 2 . 1 1 80 80 ASN C C 80 175.391 175.391 173.908 1.483 25033
726 1 2 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.658 0.076 25033
727 1 2 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.744 0.377 25033
728 1 2 . 1 1 80 80 ASN H H 80 8.923 8.923 8.598 0.325 25033
729 1 2 . 1 1 81 81 VAL N N 81 119.178 119.178 118.130 1.048 25033
730 1 2 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.289 0.458 25033
731 1 2 . 1 1 81 81 VAL C C 81 176.340 176.340 176.810 -0.470 25033
732 1 2 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.246 0.914 25033
733 1 2 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.203 0.927 25033
734 1 2 . 1 1 81 81 VAL H H 81 8.282 8.282 7.709 0.573 25033
735 1 3 . 1 1 12 12 SER N N 12 116.112 116.112 117.175 -1.063 25033
736 1 3 . 1 1 12 12 SER C C 12 175.271 175.271 175.838 -0.567 25033
737 1 3 . 1 1 12 12 SER CA C 12 58.570 58.570 58.218 0.352 25033
738 1 3 . 1 1 12 12 SER CB C 12 63.984 63.984 63.518 0.466 25033
739 1 3 . 1 1 12 12 SER H H 12 8.422 8.422 8.338 0.084 25033
740 1 3 . 1 1 13 13 GLY N N 13 111.178 111.178 109.552 1.626 25033
741 1 3 . 1 1 13 13 GLY C C 13 174.238 174.238 174.003 0.235 25033
742 1 3 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.992 0.528 25033
743 1 3 . 1 1 13 13 GLY H H 13 8.537 8.537 8.029 0.508 25033
744 1 3 . 1 1 14 14 GLU N N 14 120.547 120.547 119.444 1.103 25033
745 1 3 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.584 -0.317 25033
746 1 3 . 1 1 14 14 GLU C C 14 176.455 176.455 175.443 1.012 25033
747 1 3 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.555 1.198 25033
748 1 3 . 1 1 14 14 GLU CB C 14 30.464 30.464 30.982 -0.518 25033
749 1 3 . 1 1 14 14 GLU H H 14 8.285 8.285 8.052 0.233 25033
750 1 3 . 1 1 15 15 GLN N N 15 121.185 121.185 123.483 -2.298 25033
751 1 3 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.403 -0.054 25033
752 1 3 . 1 1 15 15 GLN C C 15 175.494 175.494 175.066 0.428 25033
753 1 3 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.920 -0.250 25033
754 1 3 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.218 0.192 25033
755 1 3 . 1 1 15 15 GLN H H 15 8.444 8.444 8.413 0.031 25033
756 1 3 . 1 1 16 16 LEU N N 16 123.934 123.934 123.814 0.120 25033
757 1 3 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.559 -0.218 25033
758 1 3 . 1 1 16 16 LEU C C 16 176.942 176.942 174.706 2.236 25033
759 1 3 . 1 1 16 16 LEU CA C 16 55.504 55.504 55.037 0.467 25033
760 1 3 . 1 1 16 16 LEU CB C 16 42.519 42.519 45.193 -2.674 25033
761 1 3 . 1 1 16 16 LEU H H 16 8.289 8.289 8.188 0.101 25033
762 1 3 . 1 1 17 17 ARG N N 17 122.044 122.044 121.631 0.413 25033
763 1 3 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.641 -0.177 25033
764 1 3 . 1 1 17 17 ARG C C 17 175.829 175.829 175.456 0.373 25033
765 1 3 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.643 1.029 25033
766 1 3 . 1 1 17 17 ARG CB C 17 29.830 29.830 31.120 -1.290 25033
767 1 3 . 1 1 17 17 ARG H H 17 8.216 8.216 8.218 -0.002 25033
768 1 3 . 1 1 18 18 GLN N N 18 122.488 122.488 123.607 -1.119 25033
769 1 3 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.476 -0.142 25033
770 1 3 . 1 1 18 18 GLN C C 18 172.958 172.958 173.669 -0.711 25033
771 1 3 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.517 0.383 25033
772 1 3 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.404 0.216 25033
773 1 3 . 1 1 18 18 GLN H H 18 8.573 8.573 7.930 0.643 25033
774 1 3 . 1 1 19 19 GLN N N 19 116.301 116.301 120.387 -4.086 25033
775 1 3 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.341 0.037 25033
776 1 3 . 1 1 19 19 GLN C C 19 176.902 176.902 174.568 2.334 25033
777 1 3 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.217 -0.002 25033
778 1 3 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.950 0.688 25033
779 1 3 . 1 1 19 19 GLN H H 19 8.146 8.146 8.375 -0.229 25033
780 1 3 . 1 1 20 20 GLY N N 20 109.745 109.745 109.396 0.349 25033
781 1 3 . 1 1 20 20 GLY C C 20 170.989 170.989 172.193 -1.204 25033
782 1 3 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.139 1.796 25033
783 1 3 . 1 1 20 20 GLY H H 20 8.998 8.998 8.244 0.754 25033
784 1 3 . 1 1 21 21 THR N N 21 112.645 112.645 113.213 -0.568 25033
785 1 3 . 1 1 21 21 THR HA H 21 5.361 5.361 5.329 0.032 25033
786 1 3 . 1 1 21 21 THR C C 21 174.553 174.553 176.267 -1.714 25033
787 1 3 . 1 1 21 21 THR CA C 21 60.025 60.025 59.854 0.171 25033
788 1 3 . 1 1 21 21 THR CB C 21 71.720 71.720 71.641 0.079 25033
789 1 3 . 1 1 21 21 THR H H 21 8.312 8.312 8.269 0.043 25033
790 1 3 . 1 1 22 22 VAL N N 22 125.915 125.915 122.476 3.439 25033
791 1 3 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.774 -0.125 25033
792 1 3 . 1 1 22 22 VAL C C 22 175.553 175.553 177.796 -2.243 25033
793 1 3 . 1 1 22 22 VAL CA C 22 64.618 64.618 66.180 -1.562 25033
794 1 3 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.340 0.281 25033
795 1 3 . 1 1 22 22 VAL H H 22 9.092 9.092 8.172 0.920 25033
796 1 3 . 1 1 23 23 LYS N N 23 135.790 135.790 119.148 16.642 25033
797 1 3 . 1 1 23 23 LYS HA H 23 4.301 4.301 3.993 0.308 25033
798 1 3 . 1 1 23 23 LYS C C 23 176.301 176.301 176.467 -0.166 25033
799 1 3 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.619 -0.009 25033
800 1 3 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.468 2.832 25033
801 1 3 . 1 1 23 23 LYS H H 23 9.276 9.276 8.456 0.820 25033
802 1 3 . 1 1 24 24 TRP N N 24 111.651 111.651 119.611 -7.960 25033
803 1 3 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.817 -0.194 25033
804 1 3 . 1 1 24 24 TRP C C 24 173.628 173.628 174.807 -1.179 25033
805 1 3 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.640 0.660 25033
806 1 3 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.738 1.522 25033
807 1 3 . 1 1 24 24 TRP H H 24 7.455 7.455 7.546 -0.091 25033
808 1 3 . 1 1 25 25 PHE N N 25 121.305 121.305 120.765 0.540 25033
809 1 3 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.806 -0.521 25033
810 1 3 . 1 1 25 25 PHE C C 25 172.354 172.354 174.586 -2.232 25033
811 1 3 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.198 2.174 25033
812 1 3 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.243 0.326 25033
813 1 3 . 1 1 25 25 PHE H H 25 9.074 9.074 8.054 1.020 25033
814 1 3 . 1 1 26 26 ASN N N 26 126.976 126.976 124.687 2.289 25033
815 1 3 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.893 -0.081 25033
816 1 3 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.050 -0.638 25033
817 1 3 . 1 1 26 26 ASN CB C 26 39.086 39.086 38.474 0.612 25033
818 1 3 . 1 1 26 26 ASN H H 26 8.159 8.159 8.234 -0.075 25033
819 1 3 . 1 1 27 27 ALA N N 27 128.245 128.245 126.715 1.530 25033
820 1 3 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.164 -0.043 25033
821 1 3 . 1 1 27 27 ALA C C 27 179.031 179.031 179.217 -0.186 25033
822 1 3 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.048 -0.623 25033
823 1 3 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.736 -0.362 25033
824 1 3 . 1 1 27 27 ALA H H 27 9.036 9.036 8.859 0.177 25033
825 1 3 . 1 1 28 28 THR N N 28 113.994 113.994 113.812 0.182 25033
826 1 3 . 1 1 28 28 THR HA H 28 4.068 4.068 4.021 0.046 25033
827 1 3 . 1 1 28 28 THR C C 28 176.084 176.084 176.327 -0.243 25033
828 1 3 . 1 1 28 28 THR CA C 28 65.820 65.820 64.760 1.060 25033
829 1 3 . 1 1 28 28 THR CB C 28 68.291 68.291 68.487 -0.196 25033
830 1 3 . 1 1 28 28 THR H H 28 8.065 8.065 8.088 -0.023 25033
831 1 3 . 1 1 29 29 LYS N N 29 118.922 118.922 119.277 -0.355 25033
832 1 3 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.336 -0.080 25033
833 1 3 . 1 1 29 29 LYS C C 29 177.201 177.201 177.661 -0.460 25033
834 1 3 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.491 0.397 25033
835 1 3 . 1 1 29 29 LYS CB C 29 33.740 33.740 33.003 0.737 25033
836 1 3 . 1 1 29 29 LYS H H 29 7.446 7.446 8.085 -0.639 25033
837 1 3 . 1 1 30 30 GLY N N 30 107.601 107.601 107.115 0.486 25033
838 1 3 . 1 1 30 30 GLY C C 30 172.004 172.004 172.838 -0.834 25033
839 1 3 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.141 1.263 25033
840 1 3 . 1 1 30 30 GLY H H 30 8.115 8.115 7.900 0.215 25033
841 1 3 . 1 1 31 31 PHE N N 31 112.488 112.488 118.773 -6.285 25033
842 1 3 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.707 0.300 25033
843 1 3 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.086 -1.808 25033
844 1 3 . 1 1 31 31 PHE CB C 31 42.388 42.388 40.888 1.500 25033
845 1 3 . 1 1 31 31 PHE H H 31 6.594 6.594 7.667 -1.073 25033
846 1 3 . 1 1 32 32 GLY N N 32 105.986 105.986 109.143 -3.157 25033
847 1 3 . 1 1 32 32 GLY C C 32 170.292 170.292 171.739 -1.447 25033
848 1 3 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.135 2.234 25033
849 1 3 . 1 1 32 32 GLY H H 32 8.144 8.144 7.566 0.578 25033
850 1 3 . 1 1 33 33 PHE N N 33 115.319 115.319 115.582 -0.263 25033
851 1 3 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.363 0.100 25033
852 1 3 . 1 1 33 33 PHE C C 33 175.037 175.037 175.100 -0.063 25033
853 1 3 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.423 -1.128 25033
854 1 3 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.248 0.544 25033
855 1 3 . 1 1 33 33 PHE H H 33 7.971 7.971 7.842 0.129 25033
856 1 3 . 1 1 34 34 ILE N N 34 122.140 122.140 120.735 1.405 25033
857 1 3 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.660 -0.343 25033
858 1 3 . 1 1 34 34 ILE C C 34 174.526 174.526 175.217 -0.691 25033
859 1 3 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.934 -0.138 25033
860 1 3 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.954 1.629 25033
861 1 3 . 1 1 34 34 ILE H H 34 9.511 9.511 9.034 0.477 25033
862 1 3 . 1 1 35 35 THR N N 35 126.580 126.580 122.227 4.353 25033
863 1 3 . 1 1 35 35 THR HA H 35 5.143 5.143 4.899 0.244 25033
864 1 3 . 1 1 35 35 THR CA C 35 59.330 59.330 57.882 1.448 25033
865 1 3 . 1 1 35 35 THR CB C 35 70.258 70.258 68.678 1.580 25033
866 1 3 . 1 1 35 35 THR H H 35 9.416 9.416 8.877 0.539 25033
867 1 3 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.727 -0.128 25033
868 1 3 . 1 1 36 36 PRO C C 36 177.390 177.390 177.144 0.246 25033
869 1 3 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.057 0.163 25033
870 1 3 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.264 0.206 25033
871 1 3 . 1 1 37 37 GLY N N 37 112.033 112.033 111.237 0.796 25033
872 1 3 . 1 1 37 37 GLY C C 37 169.261 169.261 174.957 -5.696 25033
873 1 3 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.863 1.594 25033
874 1 3 . 1 1 37 37 GLY H H 37 9.349 9.349 8.655 0.694 25033
875 1 3 . 1 1 38 38 GLY N N 38 109.050 109.050 108.289 0.761 25033
876 1 3 . 1 1 38 38 GLY C C 38 175.177 175.177 174.344 0.833 25033
877 1 3 . 1 1 38 38 GLY H H 38 8.756 8.756 8.233 0.523 25033
878 1 3 . 1 1 39 39 GLY N N 39 107.730 107.730 105.345 2.385 25033
879 1 3 . 1 1 39 39 GLY C C 39 173.870 173.870 173.658 0.212 25033
880 1 3 . 1 1 39 39 GLY CA C 39 44.258 44.258 44.776 -0.518 25033
881 1 3 . 1 1 39 39 GLY H H 39 7.725 7.725 7.584 0.141 25033
882 1 3 . 1 1 40 40 GLY N N 40 107.183 107.183 108.875 -1.692 25033
883 1 3 . 1 1 40 40 GLY C C 40 173.067 173.067 173.258 -0.191 25033
884 1 3 . 1 1 40 40 GLY CA C 40 43.760 43.760 44.691 -0.931 25033
885 1 3 . 1 1 40 40 GLY H H 40 8.096 8.096 7.582 0.514 25033
886 1 3 . 1 1 41 41 GLU N N 41 119.455 119.455 122.112 -2.657 25033
887 1 3 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.245 -0.067 25033
888 1 3 . 1 1 41 41 GLU C C 41 175.900 175.900 176.404 -0.504 25033
889 1 3 . 1 1 41 41 GLU CA C 41 56.377 56.377 56.715 -0.338 25033
890 1 3 . 1 1 41 41 GLU CB C 41 30.600 30.600 29.893 0.707 25033
891 1 3 . 1 1 41 41 GLU H H 41 8.199 8.199 8.559 -0.360 25033
892 1 3 . 1 1 42 42 ASP N N 42 119.784 119.784 122.621 -2.837 25033
893 1 3 . 1 1 42 42 ASP HA H 42 4.857 4.857 4.798 0.059 25033
894 1 3 . 1 1 42 42 ASP C C 42 176.474 176.474 175.511 0.963 25033
895 1 3 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.720 1.721 25033
896 1 3 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.434 0.054 25033
897 1 3 . 1 1 42 42 ASP H H 42 8.277 8.277 8.309 -0.032 25033
898 1 3 . 1 1 43 43 LEU N N 43 122.515 122.515 122.285 0.230 25033
899 1 3 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.907 -0.220 25033
900 1 3 . 1 1 43 43 LEU C C 43 175.759 175.759 176.302 -0.543 25033
901 1 3 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.608 -0.304 25033
902 1 3 . 1 1 43 43 LEU CB C 43 45.449 45.449 46.180 -0.731 25033
903 1 3 . 1 1 43 43 LEU H H 43 9.423 9.423 8.504 0.919 25033
904 1 3 . 1 1 44 44 PHE N N 44 125.962 125.962 121.098 4.864 25033
905 1 3 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.989 -1.067 25033
906 1 3 . 1 1 44 44 PHE C C 44 172.844 172.844 174.497 -1.653 25033
907 1 3 . 1 1 44 44 PHE CA C 44 57.880 57.880 56.318 1.562 25033
908 1 3 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.944 0.406 25033
909 1 3 . 1 1 44 44 PHE H H 44 8.465 8.465 8.700 -0.235 25033
910 1 3 . 1 1 45 45 VAL N N 45 123.552 123.552 124.225 -0.673 25033
911 1 3 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.266 0.391 25033
912 1 3 . 1 1 45 45 VAL C C 45 177.433 177.433 173.494 3.939 25033
913 1 3 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.782 -2.321 25033
914 1 3 . 1 1 45 45 VAL CB C 45 34.884 34.884 34.963 -0.079 25033
915 1 3 . 1 1 45 45 VAL H H 45 7.715 7.715 7.915 -0.200 25033
916 1 3 . 1 1 46 46 HIS N N 46 127.300 127.300 126.888 0.412 25033
917 1 3 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.797 0.028 25033
918 1 3 . 1 1 46 46 HIS C C 46 176.469 176.469 173.960 2.509 25033
919 1 3 . 1 1 46 46 HIS CA C 46 55.929 55.929 54.315 1.614 25033
920 1 3 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.668 2.731 25033
921 1 3 . 1 1 46 46 HIS H H 46 9.104 9.104 8.551 0.553 25033
922 1 3 . 1 1 47 47 GLN N N 47 125.105 125.105 125.539 -0.434 25033
923 1 3 . 1 1 47 47 GLN H H 47 8.352 8.352 8.693 -0.341 25033
924 1 3 . 1 1 48 48 THR HA H 48 4.310 4.310 4.340 -0.030 25033
925 1 3 . 1 1 48 48 THR C C 48 175.568 175.568 174.788 0.780 25033
926 1 3 . 1 1 48 48 THR CA C 48 64.770 64.770 63.024 1.746 25033
927 1 3 . 1 1 48 48 THR CB C 48 70.054 70.054 69.483 0.571 25033
928 1 3 . 1 1 49 49 ASN N N 49 118.142 118.142 118.610 -0.468 25033
929 1 3 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.828 0.332 25033
930 1 3 . 1 1 49 49 ASN C C 49 172.914 172.914 173.851 -0.937 25033
931 1 3 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.428 0.923 25033
932 1 3 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.458 1.069 25033
933 1 3 . 1 1 49 49 ASN H H 49 8.452 8.452 8.410 0.042 25033
934 1 3 . 1 1 50 50 ILE N N 50 119.226 119.226 119.604 -0.378 25033
935 1 3 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.167 -0.055 25033
936 1 3 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.833 0.773 25033
937 1 3 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.735 1.627 25033
938 1 3 . 1 1 50 50 ILE H H 50 7.354 7.354 7.900 -0.546 25033
939 1 3 . 1 1 51 51 ASN N N 51 128.460 128.460 123.412 5.048 25033
940 1 3 . 1 1 51 51 ASN C C 51 174.614 174.614 174.188 0.426 25033
941 1 3 . 1 1 51 51 ASN H H 51 9.266 9.266 7.877 1.389 25033
942 1 3 . 1 1 52 52 SER N N 52 117.246 117.246 116.964 0.282 25033
943 1 3 . 1 1 52 52 SER HA H 52 4.413 4.413 4.861 -0.448 25033
944 1 3 . 1 1 52 52 SER C C 52 174.139 174.139 174.334 -0.195 25033
945 1 3 . 1 1 52 52 SER CA C 52 58.378 58.378 57.289 1.089 25033
946 1 3 . 1 1 52 52 SER CB C 52 64.371 64.371 65.462 -1.091 25033
947 1 3 . 1 1 52 52 SER H H 52 7.973 7.973 8.532 -0.559 25033
948 1 3 . 1 1 53 53 GLU N N 53 123.628 123.628 120.070 3.558 25033
949 1 3 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.236 0.062 25033
950 1 3 . 1 1 53 53 GLU C C 53 176.960 176.960 176.832 0.128 25033
951 1 3 . 1 1 53 53 GLU CA C 53 57.270 57.270 56.837 0.433 25033
952 1 3 . 1 1 53 53 GLU CB C 53 29.861 29.861 30.035 -0.174 25033
953 1 3 . 1 1 53 53 GLU H H 53 8.641 8.641 8.605 0.036 25033
954 1 3 . 1 1 54 54 GLY N N 54 110.282 110.282 108.436 1.846 25033
955 1 3 . 1 1 54 54 GLY CA C 54 44.600 44.600 43.947 0.653 25033
956 1 3 . 1 1 54 54 GLY H H 54 8.225 8.225 7.676 0.549 25033
957 1 3 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.441 0.379 25033
958 1 3 . 1 1 55 55 PHE C C 55 175.836 175.836 175.897 -0.061 25033
959 1 3 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.380 -4.690 25033
960 1 3 . 1 1 55 55 PHE CB C 55 38.095 38.095 40.228 -2.133 25033
961 1 3 . 1 1 56 56 ARG N N 56 120.907 120.907 121.636 -0.729 25033
962 1 3 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.664 -0.400 25033
963 1 3 . 1 1 56 56 ARG C C 56 175.618 175.618 175.085 0.533 25033
964 1 3 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.337 0.173 25033
965 1 3 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.803 0.217 25033
966 1 3 . 1 1 56 56 ARG H H 56 8.153 8.153 8.614 -0.461 25033
967 1 3 . 1 1 57 57 SER N N 57 123.117 123.117 117.176 5.941 25033
968 1 3 . 1 1 57 57 SER H H 57 7.834 7.834 8.321 -0.487 25033
969 1 3 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.632 -0.352 25033
970 1 3 . 1 1 58 58 LEU C C 58 174.842 174.842 176.761 -1.919 25033
971 1 3 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.159 -0.399 25033
972 1 3 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.723 -1.143 25033
973 1 3 . 1 1 59 59 ARG N N 59 119.557 119.557 121.819 -2.262 25033
974 1 3 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.489 0.096 25033
975 1 3 . 1 1 59 59 ARG C C 59 175.256 175.256 175.598 -0.342 25033
976 1 3 . 1 1 59 59 ARG CA C 59 54.112 54.112 55.234 -1.122 25033
977 1 3 . 1 1 59 59 ARG CB C 59 32.970 32.970 32.003 0.967 25033
978 1 3 . 1 1 59 59 ARG H H 59 8.529 8.529 8.474 0.055 25033
979 1 3 . 1 1 60 60 GLU N N 60 121.597 121.597 119.568 2.029 25033
980 1 3 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.086 -0.505 25033
981 1 3 . 1 1 60 60 GLU C C 60 177.281 177.281 176.522 0.759 25033
982 1 3 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.147 1.154 25033
983 1 3 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.849 -0.588 25033
984 1 3 . 1 1 60 60 GLU H H 60 8.691 8.691 8.530 0.161 25033
985 1 3 . 1 1 61 61 GLY N N 61 113.554 113.554 111.436 2.118 25033
986 1 3 . 1 1 61 61 GLY C C 61 174.068 174.068 174.700 -0.632 25033
987 1 3 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.656 0.587 25033
988 1 3 . 1 1 61 61 GLY H H 61 9.151 9.151 8.680 0.471 25033
989 1 3 . 1 1 62 62 GLU N N 62 121.639 121.639 122.584 -0.945 25033
990 1 3 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.282 -0.078 25033
991 1 3 . 1 1 62 62 GLU C C 62 175.439 175.439 176.309 -0.870 25033
992 1 3 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.930 0.412 25033
993 1 3 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.521 0.404 25033
994 1 3 . 1 1 62 62 GLU H H 62 7.889 7.889 7.722 0.167 25033
995 1 3 . 1 1 63 63 VAL N N 63 125.003 125.003 127.383 -2.380 25033
996 1 3 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.814 -0.066 25033
997 1 3 . 1 1 63 63 VAL C C 63 176.639 176.639 176.104 0.535 25033
998 1 3 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.778 0.853 25033
999 1 3 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.794 -0.437 25033
1000 1 3 . 1 1 63 63 VAL H H 63 8.477 8.477 8.389 0.088 25033
1001 1 3 . 1 1 64 64 VAL N N 64 120.113 120.113 122.956 -2.843 25033
1002 1 3 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.904 0.100 25033
1003 1 3 . 1 1 64 64 VAL C C 64 173.790 173.790 174.445 -0.655 25033
1004 1 3 . 1 1 64 64 VAL CA C 64 58.609 58.609 58.831 -0.222 25033
1005 1 3 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.355 1.004 25033
1006 1 3 . 1 1 64 64 VAL H H 64 8.686 8.686 8.993 -0.307 25033
1007 1 3 . 1 1 65 65 GLU N N 65 120.433 120.433 121.078 -0.645 25033
1008 1 3 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.318 0.129 25033
1009 1 3 . 1 1 65 65 GLU C C 65 175.584 175.584 175.281 0.303 25033
1010 1 3 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.481 -0.091 25033
1011 1 3 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.233 0.770 25033
1012 1 3 . 1 1 65 65 GLU H H 65 9.003 9.003 8.335 0.668 25033
1013 1 3 . 1 1 66 66 PHE N N 66 116.104 116.104 120.294 -4.190 25033
1014 1 3 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.091 -0.030 25033
1015 1 3 . 1 1 66 66 PHE C C 66 173.001 173.001 172.748 0.253 25033
1016 1 3 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.751 0.106 25033
1017 1 3 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.672 -0.240 25033
1018 1 3 . 1 1 66 66 PHE H H 66 8.172 8.172 7.954 0.218 25033
1019 1 3 . 1 1 67 67 GLU N N 67 117.574 117.574 118.452 -0.878 25033
1020 1 3 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.175 -0.303 25033
1021 1 3 . 1 1 67 67 GLU C C 67 175.327 175.327 175.708 -0.381 25033
1022 1 3 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.033 0.608 25033
1023 1 3 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.243 -0.223 25033
1024 1 3 . 1 1 67 67 GLU H H 67 8.668 8.668 8.618 0.050 25033
1025 1 3 . 1 1 68 68 VAL N N 68 120.881 120.881 122.752 -1.871 25033
1026 1 3 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.345 0.667 25033
1027 1 3 . 1 1 68 68 VAL C C 68 176.140 176.140 176.108 0.032 25033
1028 1 3 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.363 -0.025 25033
1029 1 3 . 1 1 68 68 VAL CB C 68 34.006 34.006 31.226 2.780 25033
1030 1 3 . 1 1 68 68 VAL H H 68 8.748 8.748 8.433 0.315 25033
1031 1 3 . 1 1 69 69 GLU N N 69 128.110 128.110 127.962 0.148 25033
1032 1 3 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.648 0.057 25033
1033 1 3 . 1 1 69 69 GLU C C 69 174.573 174.573 175.003 -0.430 25033
1034 1 3 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.234 0.719 25033
1035 1 3 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.656 0.634 25033
1036 1 3 . 1 1 69 69 GLU H H 69 9.070 9.070 9.191 -0.121 25033
1037 1 3 . 1 1 70 70 ALA N N 70 127.944 127.944 128.334 -0.390 25033
1038 1 3 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.071 -0.067 25033
1039 1 3 . 1 1 70 70 ALA C C 70 178.073 178.073 176.610 1.463 25033
1040 1 3 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.823 0.136 25033
1041 1 3 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.930 -1.441 25033
1042 1 3 . 1 1 70 70 ALA H H 70 8.671 8.671 8.621 0.050 25033
1043 1 3 . 1 1 71 71 GLY N N 71 110.340 110.340 110.046 0.294 25033
1044 1 3 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.432 0.584 25033
1045 1 3 . 1 1 71 71 GLY H H 71 8.445 8.445 8.044 0.401 25033
1046 1 3 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.392 0.025 25033
1047 1 3 . 1 1 72 72 PRO C C 72 176.835 176.835 176.745 0.090 25033
1048 1 3 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.444 -0.284 25033
1049 1 3 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.620 0.260 25033
1050 1 3 . 1 1 73 73 ASP N N 73 116.498 116.498 117.829 -1.331 25033
1051 1 3 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.542 -0.027 25033
1052 1 3 . 1 1 73 73 ASP C C 73 176.775 176.775 177.427 -0.652 25033
1053 1 3 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.658 -1.111 25033
1054 1 3 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.825 -0.591 25033
1055 1 3 . 1 1 73 73 ASP H H 73 8.248 8.248 8.314 -0.066 25033
1056 1 3 . 1 1 74 74 GLY N N 74 107.369 107.369 108.039 -0.670 25033
1057 1 3 . 1 1 74 74 GLY C C 74 174.331 174.331 173.442 0.889 25033
1058 1 3 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.979 0.599 25033
1059 1 3 . 1 1 74 74 GLY H H 74 8.153 8.153 7.708 0.445 25033
1060 1 3 . 1 1 75 75 ARG N N 75 120.942 120.942 119.910 1.032 25033
1061 1 3 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.605 -0.063 25033
1062 1 3 . 1 1 75 75 ARG C C 75 176.652 176.652 175.221 1.431 25033
1063 1 3 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.418 0.240 25033
1064 1 3 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.250 -0.341 25033
1065 1 3 . 1 1 75 75 ARG H H 75 7.670 7.670 8.030 -0.360 25033
1066 1 3 . 1 1 76 76 SER N N 76 120.181 120.181 118.308 1.873 25033
1067 1 3 . 1 1 76 76 SER HA H 76 5.035 5.035 5.484 -0.449 25033
1068 1 3 . 1 1 76 76 SER C C 76 172.816 172.816 174.278 -1.462 25033
1069 1 3 . 1 1 76 76 SER CA C 76 59.080 59.080 57.556 1.524 25033
1070 1 3 . 1 1 76 76 SER CB C 76 64.850 64.850 65.025 -0.174 25033
1071 1 3 . 1 1 76 76 SER H H 76 8.808 8.808 8.474 0.334 25033
1072 1 3 . 1 1 77 77 LYS N N 77 121.202 121.202 122.743 -1.541 25033
1073 1 3 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.751 0.423 25033
1074 1 3 . 1 1 77 77 LYS C C 77 173.706 173.706 174.651 -0.945 25033
1075 1 3 . 1 1 77 77 LYS CA C 77 54.599 54.599 54.226 0.373 25033
1076 1 3 . 1 1 77 77 LYS CB C 77 36.035 36.035 36.391 -0.356 25033
1077 1 3 . 1 1 77 77 LYS H H 77 8.982 8.982 9.021 -0.039 25033
1078 1 3 . 1 1 78 78 ALA N N 78 124.064 124.064 123.648 0.416 25033
1079 1 3 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.957 0.047 25033
1080 1 3 . 1 1 78 78 ALA C C 78 175.979 175.979 175.976 0.003 25033
1081 1 3 . 1 1 78 78 ALA CA C 78 50.445 50.445 50.905 -0.460 25033
1082 1 3 . 1 1 78 78 ALA CB C 78 20.136 20.136 20.046 0.090 25033
1083 1 3 . 1 1 78 78 ALA H H 78 8.706 8.706 8.463 0.243 25033
1084 1 3 . 1 1 79 79 VAL N N 79 113.264 113.264 117.992 -4.728 25033
1085 1 3 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.413 0.430 25033
1086 1 3 . 1 1 79 79 VAL C C 79 174.744 174.744 174.652 0.092 25033
1087 1 3 . 1 1 79 79 VAL CA C 79 59.073 59.073 60.364 -1.291 25033
1088 1 3 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.692 -0.096 25033
1089 1 3 . 1 1 79 79 VAL H H 79 9.165 9.165 7.639 1.526 25033
1090 1 3 . 1 1 80 80 ASN N N 80 120.084 120.084 115.277 4.807 25033
1091 1 3 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.348 0.008 25033
1092 1 3 . 1 1 80 80 ASN C C 80 175.391 175.391 173.913 1.478 25033
1093 1 3 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.715 0.019 25033
1094 1 3 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.854 0.267 25033
1095 1 3 . 1 1 80 80 ASN H H 80 8.923 8.923 8.572 0.351 25033
1096 1 3 . 1 1 81 81 VAL N N 81 119.178 119.178 118.637 0.541 25033
1097 1 3 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.417 0.330 25033
1098 1 3 . 1 1 81 81 VAL C C 81 176.340 176.340 177.172 -0.832 25033
1099 1 3 . 1 1 81 81 VAL CA C 81 63.160 63.160 61.695 1.465 25033
1100 1 3 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.782 0.348 25033
1101 1 3 . 1 1 81 81 VAL H H 81 8.282 8.282 7.763 0.519 25033
1102 1 4 . 1 1 12 12 SER N N 12 116.112 116.112 114.973 1.139 25033
1103 1 4 . 1 1 12 12 SER C C 12 175.271 175.271 175.212 0.059 25033
1104 1 4 . 1 1 12 12 SER CA C 12 58.570 58.570 58.655 -0.085 25033
1105 1 4 . 1 1 12 12 SER CB C 12 63.984 63.984 63.538 0.446 25033
1106 1 4 . 1 1 12 12 SER H H 12 8.422 8.422 8.413 0.009 25033
1107 1 4 . 1 1 13 13 GLY N N 13 111.178 111.178 111.889 -0.711 25033
1108 1 4 . 1 1 13 13 GLY C C 13 174.238 174.238 173.978 0.260 25033
1109 1 4 . 1 1 13 13 GLY CA C 13 45.520 45.520 45.129 0.391 25033
1110 1 4 . 1 1 13 13 GLY H H 13 8.537 8.537 8.619 -0.082 25033
1111 1 4 . 1 1 14 14 GLU N N 14 120.547 120.547 120.383 0.164 25033
1112 1 4 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.574 -0.307 25033
1113 1 4 . 1 1 14 14 GLU C C 14 176.455 176.455 175.995 0.460 25033
1114 1 4 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.972 0.781 25033
1115 1 4 . 1 1 14 14 GLU CB C 14 30.464 30.464 30.691 -0.227 25033
1116 1 4 . 1 1 14 14 GLU H H 14 8.285 8.285 8.095 0.190 25033
1117 1 4 . 1 1 15 15 GLN N N 15 121.185 121.185 120.619 0.566 25033
1118 1 4 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.586 -0.237 25033
1119 1 4 . 1 1 15 15 GLN C C 15 175.494 175.494 174.817 0.677 25033
1120 1 4 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.016 0.654 25033
1121 1 4 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.976 -0.566 25033
1122 1 4 . 1 1 15 15 GLN H H 15 8.444 8.444 8.458 -0.014 25033
1123 1 4 . 1 1 16 16 LEU N N 16 123.934 123.934 125.040 -1.106 25033
1124 1 4 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.555 -0.214 25033
1125 1 4 . 1 1 16 16 LEU C C 16 176.942 176.942 175.516 1.426 25033
1126 1 4 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.725 0.779 25033
1127 1 4 . 1 1 16 16 LEU CB C 16 42.519 42.519 41.301 1.218 25033
1128 1 4 . 1 1 16 16 LEU H H 16 8.289 8.289 8.542 -0.253 25033
1129 1 4 . 1 1 17 17 ARG N N 17 122.044 122.044 121.084 0.960 25033
1130 1 4 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.610 -0.146 25033
1131 1 4 . 1 1 17 17 ARG C C 17 175.829 175.829 175.693 0.136 25033
1132 1 4 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.527 1.145 25033
1133 1 4 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.182 -0.352 25033
1134 1 4 . 1 1 17 17 ARG H H 17 8.216 8.216 8.275 -0.059 25033
1135 1 4 . 1 1 18 18 GLN N N 18 122.488 122.488 123.823 -1.335 25033
1136 1 4 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.465 -0.131 25033
1137 1 4 . 1 1 18 18 GLN C C 18 172.958 172.958 173.747 -0.789 25033
1138 1 4 . 1 1 18 18 GLN CA C 18 54.900 54.900 53.962 0.938 25033
1139 1 4 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.023 0.597 25033
1140 1 4 . 1 1 18 18 GLN H H 18 8.573 8.573 7.802 0.771 25033
1141 1 4 . 1 1 19 19 GLN N N 19 116.301 116.301 121.048 -4.747 25033
1142 1 4 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.114 0.264 25033
1143 1 4 . 1 1 19 19 GLN C C 19 176.902 176.902 174.845 2.057 25033
1144 1 4 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.200 0.015 25033
1145 1 4 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.376 1.262 25033
1146 1 4 . 1 1 19 19 GLN H H 19 8.146 8.146 8.378 -0.232 25033
1147 1 4 . 1 1 20 20 GLY N N 20 109.745 109.745 110.027 -0.282 25033
1148 1 4 . 1 1 20 20 GLY C C 20 170.989 170.989 173.043 -2.054 25033
1149 1 4 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.141 1.794 25033
1150 1 4 . 1 1 20 20 GLY H H 20 8.998 8.998 8.122 0.876 25033
1151 1 4 . 1 1 21 21 THR N N 21 112.645 112.645 115.939 -3.294 25033
1152 1 4 . 1 1 21 21 THR HA H 21 5.361 5.361 5.260 0.101 25033
1153 1 4 . 1 1 21 21 THR C C 21 174.553 174.553 176.273 -1.720 25033
1154 1 4 . 1 1 21 21 THR CA C 21 60.025 60.025 59.819 0.206 25033
1155 1 4 . 1 1 21 21 THR CB C 21 71.720 71.720 71.203 0.517 25033
1156 1 4 . 1 1 21 21 THR H H 21 8.312 8.312 8.063 0.249 25033
1157 1 4 . 1 1 22 22 VAL N N 22 125.915 125.915 123.083 2.832 25033
1158 1 4 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.831 -0.182 25033
1159 1 4 . 1 1 22 22 VAL C C 22 175.553 175.553 177.866 -2.313 25033
1160 1 4 . 1 1 22 22 VAL CA C 22 64.618 64.618 65.327 -0.709 25033
1161 1 4 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.326 0.295 25033
1162 1 4 . 1 1 22 22 VAL H H 22 9.092 9.092 8.260 0.832 25033
1163 1 4 . 1 1 23 23 LYS N N 23 135.790 135.790 120.732 15.058 25033
1164 1 4 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.070 0.231 25033
1165 1 4 . 1 1 23 23 LYS C C 23 176.301 176.301 176.587 -0.286 25033
1166 1 4 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.906 -0.296 25033
1167 1 4 . 1 1 23 23 LYS CB C 23 34.300 34.300 32.053 2.247 25033
1168 1 4 . 1 1 23 23 LYS H H 23 9.276 9.276 8.532 0.744 25033
1169 1 4 . 1 1 24 24 TRP N N 24 111.651 111.651 118.944 -7.293 25033
1170 1 4 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.778 -0.155 25033
1171 1 4 . 1 1 24 24 TRP C C 24 173.628 173.628 175.169 -1.541 25033
1172 1 4 . 1 1 24 24 TRP CA C 24 56.300 56.300 56.278 0.022 25033
1173 1 4 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.593 1.667 25033
1174 1 4 . 1 1 24 24 TRP H H 24 7.455 7.455 7.647 -0.192 25033
1175 1 4 . 1 1 25 25 PHE N N 25 121.305 121.305 119.383 1.922 25033
1176 1 4 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.904 -0.619 25033
1177 1 4 . 1 1 25 25 PHE C C 25 172.354 172.354 174.512 -2.158 25033
1178 1 4 . 1 1 25 25 PHE CA C 25 59.372 59.372 56.891 2.481 25033
1179 1 4 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.510 0.060 25033
1180 1 4 . 1 1 25 25 PHE H H 25 9.074 9.074 7.971 1.103 25033
1181 1 4 . 1 1 26 26 ASN N N 26 126.976 126.976 124.433 2.543 25033
1182 1 4 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.889 -0.077 25033
1183 1 4 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.345 -0.933 25033
1184 1 4 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.153 -0.067 25033
1185 1 4 . 1 1 26 26 ASN H H 26 8.159 8.159 8.196 -0.037 25033
1186 1 4 . 1 1 27 27 ALA N N 27 128.245 128.245 126.571 1.674 25033
1187 1 4 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.115 0.006 25033
1188 1 4 . 1 1 27 27 ALA C C 27 179.031 179.031 179.217 -0.186 25033
1189 1 4 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.115 -0.690 25033
1190 1 4 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.708 -0.334 25033
1191 1 4 . 1 1 27 27 ALA H H 27 9.036 9.036 8.822 0.214 25033
1192 1 4 . 1 1 28 28 THR N N 28 113.994 113.994 113.108 0.886 25033
1193 1 4 . 1 1 28 28 THR HA H 28 4.068 4.068 4.034 0.034 25033
1194 1 4 . 1 1 28 28 THR C C 28 176.084 176.084 176.118 -0.034 25033
1195 1 4 . 1 1 28 28 THR CA C 28 65.820 65.820 64.809 1.010 25033
1196 1 4 . 1 1 28 28 THR CB C 28 68.291 68.291 68.444 -0.153 25033
1197 1 4 . 1 1 28 28 THR H H 28 8.065 8.065 8.148 -0.083 25033
1198 1 4 . 1 1 29 29 LYS N N 29 118.922 118.922 118.698 0.224 25033
1199 1 4 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.342 -0.086 25033
1200 1 4 . 1 1 29 29 LYS C C 29 177.201 177.201 177.358 -0.157 25033
1201 1 4 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.292 0.596 25033
1202 1 4 . 1 1 29 29 LYS CB C 29 33.740 33.740 33.327 0.413 25033
1203 1 4 . 1 1 29 29 LYS H H 29 7.446 7.446 7.911 -0.465 25033
1204 1 4 . 1 1 30 30 GLY N N 30 107.601 107.601 107.525 0.076 25033
1205 1 4 . 1 1 30 30 GLY C C 30 172.004 172.004 173.287 -1.283 25033
1206 1 4 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.101 1.303 25033
1207 1 4 . 1 1 30 30 GLY H H 30 8.115 8.115 8.047 0.068 25033
1208 1 4 . 1 1 31 31 PHE N N 31 112.488 112.488 119.371 -6.883 25033
1209 1 4 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.806 0.201 25033
1210 1 4 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.049 -1.771 25033
1211 1 4 . 1 1 31 31 PHE CB C 31 42.388 42.388 41.130 1.258 25033
1212 1 4 . 1 1 31 31 PHE H H 31 6.594 6.594 7.796 -1.202 25033
1213 1 4 . 1 1 32 32 GLY N N 32 105.986 105.986 109.793 -3.807 25033
1214 1 4 . 1 1 32 32 GLY C C 32 170.292 170.292 171.806 -1.514 25033
1215 1 4 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.001 2.368 25033
1216 1 4 . 1 1 32 32 GLY H H 32 8.144 8.144 8.508 -0.364 25033
1217 1 4 . 1 1 33 33 PHE N N 33 115.319 115.319 116.305 -0.986 25033
1218 1 4 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.219 0.244 25033
1219 1 4 . 1 1 33 33 PHE C C 33 175.037 175.037 175.037 0.000 25033
1220 1 4 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.639 -1.344 25033
1221 1 4 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.175 0.617 25033
1222 1 4 . 1 1 33 33 PHE H H 33 7.971 7.971 7.774 0.197 25033
1223 1 4 . 1 1 34 34 ILE N N 34 122.140 122.140 122.571 -0.431 25033
1224 1 4 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.657 -0.340 25033
1225 1 4 . 1 1 34 34 ILE C C 34 174.526 174.526 175.228 -0.702 25033
1226 1 4 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.446 0.351 25033
1227 1 4 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.042 2.541 25033
1228 1 4 . 1 1 34 34 ILE H H 34 9.511 9.511 8.527 0.984 25033
1229 1 4 . 1 1 35 35 THR N N 35 126.580 126.580 119.085 7.495 25033
1230 1 4 . 1 1 35 35 THR HA H 35 5.143 5.143 4.830 0.313 25033
1231 1 4 . 1 1 35 35 THR CA C 35 59.330 59.330 58.248 1.082 25033
1232 1 4 . 1 1 35 35 THR CB C 35 70.258 70.258 68.236 2.022 25033
1233 1 4 . 1 1 35 35 THR H H 35 9.416 9.416 8.731 0.685 25033
1234 1 4 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.524 0.075 25033
1235 1 4 . 1 1 36 36 PRO C C 36 177.390 177.390 177.842 -0.452 25033
1236 1 4 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.061 0.159 25033
1237 1 4 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.109 0.361 25033
1238 1 4 . 1 1 37 37 GLY N N 37 112.033 112.033 109.529 2.504 25033
1239 1 4 . 1 1 37 37 GLY C C 37 169.261 169.261 174.628 -5.367 25033
1240 1 4 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.639 1.818 25033
1241 1 4 . 1 1 37 37 GLY H H 37 9.349 9.349 8.561 0.788 25033
1242 1 4 . 1 1 38 38 GLY N N 38 109.050 109.050 108.651 0.399 25033
1243 1 4 . 1 1 38 38 GLY C C 38 175.177 175.177 174.706 0.471 25033
1244 1 4 . 1 1 38 38 GLY H H 38 8.756 8.756 7.907 0.849 25033
1245 1 4 . 1 1 39 39 GLY N N 39 107.730 107.730 106.613 1.117 25033
1246 1 4 . 1 1 39 39 GLY C C 39 173.870 173.870 173.990 -0.120 25033
1247 1 4 . 1 1 39 39 GLY CA C 39 44.258 44.258 44.541 -0.283 25033
1248 1 4 . 1 1 39 39 GLY H H 39 7.725 7.725 8.082 -0.357 25033
1249 1 4 . 1 1 40 40 GLY N N 40 107.183 107.183 108.696 -1.513 25033
1250 1 4 . 1 1 40 40 GLY C C 40 173.067 173.067 173.223 -0.156 25033
1251 1 4 . 1 1 40 40 GLY CA C 40 43.760 43.760 45.044 -1.284 25033
1252 1 4 . 1 1 40 40 GLY H H 40 8.096 8.096 7.929 0.167 25033
1253 1 4 . 1 1 41 41 GLU N N 41 119.455 119.455 122.434 -2.979 25033
1254 1 4 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.477 -0.299 25033
1255 1 4 . 1 1 41 41 GLU C C 41 175.900 175.900 176.212 -0.312 25033
1256 1 4 . 1 1 41 41 GLU CA C 41 56.377 56.377 56.215 0.162 25033
1257 1 4 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.213 0.387 25033
1258 1 4 . 1 1 41 41 GLU H H 41 8.199 8.199 8.440 -0.241 25033
1259 1 4 . 1 1 42 42 ASP N N 42 119.784 119.784 121.681 -1.897 25033
1260 1 4 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.412 -0.555 25033
1261 1 4 . 1 1 42 42 ASP C C 42 176.474 176.474 175.848 0.626 25033
1262 1 4 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.082 2.359 25033
1263 1 4 . 1 1 42 42 ASP CB C 42 41.488 41.488 42.072 -0.584 25033
1264 1 4 . 1 1 42 42 ASP H H 42 8.277 8.277 8.300 -0.023 25033
1265 1 4 . 1 1 43 43 LEU N N 43 122.515 122.515 117.444 5.071 25033
1266 1 4 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.979 -0.292 25033
1267 1 4 . 1 1 43 43 LEU C C 43 175.759 175.759 175.698 0.061 25033
1268 1 4 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.815 -0.511 25033
1269 1 4 . 1 1 43 43 LEU CB C 43 45.449 45.449 44.227 1.222 25033
1270 1 4 . 1 1 43 43 LEU H H 43 9.423 9.423 8.189 1.234 25033
1271 1 4 . 1 1 44 44 PHE N N 44 125.962 125.962 119.207 6.755 25033
1272 1 4 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.534 -0.612 25033
1273 1 4 . 1 1 44 44 PHE C C 44 172.844 172.844 176.231 -3.387 25033
1274 1 4 . 1 1 44 44 PHE CA C 44 57.880 57.880 58.180 -0.300 25033
1275 1 4 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.770 0.580 25033
1276 1 4 . 1 1 44 44 PHE H H 44 8.465 8.465 8.533 -0.068 25033
1277 1 4 . 1 1 45 45 VAL N N 45 123.552 123.552 123.932 -0.380 25033
1278 1 4 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.546 0.111 25033
1279 1 4 . 1 1 45 45 VAL C C 45 177.433 177.433 173.452 3.981 25033
1280 1 4 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.370 -1.910 25033
1281 1 4 . 1 1 45 45 VAL CB C 45 34.884 34.884 34.826 0.058 25033
1282 1 4 . 1 1 45 45 VAL H H 45 7.715 7.715 8.096 -0.381 25033
1283 1 4 . 1 1 46 46 HIS N N 46 127.300 127.300 123.983 3.317 25033
1284 1 4 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.872 -0.047 25033
1285 1 4 . 1 1 46 46 HIS C C 46 176.469 176.469 174.070 2.399 25033
1286 1 4 . 1 1 46 46 HIS CA C 46 55.929 55.929 53.546 2.383 25033
1287 1 4 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.520 2.879 25033
1288 1 4 . 1 1 46 46 HIS H H 46 9.104 9.104 8.100 1.004 25033
1289 1 4 . 1 1 47 47 GLN N N 47 125.105 125.105 123.595 1.510 25033
1290 1 4 . 1 1 47 47 GLN H H 47 8.352 8.352 8.574 -0.222 25033
1291 1 4 . 1 1 48 48 THR HA H 48 4.310 4.310 4.458 -0.148 25033
1292 1 4 . 1 1 48 48 THR C C 48 175.568 175.568 175.030 0.538 25033
1293 1 4 . 1 1 48 48 THR CA C 48 64.770 64.770 62.818 1.952 25033
1294 1 4 . 1 1 48 48 THR CB C 48 70.054 70.054 69.505 0.549 25033
1295 1 4 . 1 1 49 49 ASN N N 49 118.142 118.142 118.406 -0.264 25033
1296 1 4 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.894 0.266 25033
1297 1 4 . 1 1 49 49 ASN C C 49 172.914 172.914 173.812 -0.898 25033
1298 1 4 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.117 1.234 25033
1299 1 4 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.710 0.817 25033
1300 1 4 . 1 1 49 49 ASN H H 49 8.452 8.452 8.301 0.151 25033
1301 1 4 . 1 1 50 50 ILE N N 50 119.226 119.226 120.862 -1.636 25033
1302 1 4 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.156 -0.044 25033
1303 1 4 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.606 1.000 25033
1304 1 4 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.405 1.957 25033
1305 1 4 . 1 1 50 50 ILE H H 50 7.354 7.354 7.818 -0.464 25033
1306 1 4 . 1 1 51 51 ASN N N 51 128.460 128.460 123.815 4.645 25033
1307 1 4 . 1 1 51 51 ASN C C 51 174.614 174.614 174.391 0.223 25033
1308 1 4 . 1 1 51 51 ASN H H 51 9.266 9.266 8.004 1.262 25033
1309 1 4 . 1 1 52 52 SER N N 52 117.246 117.246 118.303 -1.057 25033
1310 1 4 . 1 1 52 52 SER HA H 52 4.413 4.413 4.810 -0.397 25033
1311 1 4 . 1 1 52 52 SER C C 52 174.139 174.139 174.343 -0.204 25033
1312 1 4 . 1 1 52 52 SER CA C 52 58.378 58.378 57.373 1.005 25033
1313 1 4 . 1 1 52 52 SER CB C 52 64.371 64.371 65.252 -0.881 25033
1314 1 4 . 1 1 52 52 SER H H 52 7.973 7.973 8.453 -0.480 25033
1315 1 4 . 1 1 53 53 GLU N N 53 123.628 123.628 121.351 2.277 25033
1316 1 4 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.340 -0.042 25033
1317 1 4 . 1 1 53 53 GLU C C 53 176.960 176.960 176.295 0.665 25033
1318 1 4 . 1 1 53 53 GLU CA C 53 57.270 57.270 56.950 0.320 25033
1319 1 4 . 1 1 53 53 GLU CB C 53 29.861 29.861 30.100 -0.239 25033
1320 1 4 . 1 1 53 53 GLU H H 53 8.641 8.641 8.574 0.067 25033
1321 1 4 . 1 1 54 54 GLY N N 54 110.282 110.282 108.382 1.900 25033
1322 1 4 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.658 -0.058 25033
1323 1 4 . 1 1 54 54 GLY H H 54 8.225 8.225 7.849 0.376 25033
1324 1 4 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.884 -0.064 25033
1325 1 4 . 1 1 55 55 PHE C C 55 175.836 175.836 174.460 1.376 25033
1326 1 4 . 1 1 55 55 PHE CA C 55 52.690 52.690 56.414 -3.724 25033
1327 1 4 . 1 1 55 55 PHE CB C 55 38.095 38.095 39.950 -1.855 25033
1328 1 4 . 1 1 56 56 ARG N N 56 120.907 120.907 121.881 -0.974 25033
1329 1 4 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.736 -0.472 25033
1330 1 4 . 1 1 56 56 ARG C C 56 175.618 175.618 175.784 -0.166 25033
1331 1 4 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.934 -0.424 25033
1332 1 4 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.851 0.169 25033
1333 1 4 . 1 1 56 56 ARG H H 56 8.153 8.153 8.680 -0.527 25033
1334 1 4 . 1 1 57 57 SER N N 57 123.117 123.117 120.114 3.003 25033
1335 1 4 . 1 1 57 57 SER H H 57 7.834 7.834 8.632 -0.798 25033
1336 1 4 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.698 -0.418 25033
1337 1 4 . 1 1 58 58 LEU C C 58 174.842 174.842 176.601 -1.759 25033
1338 1 4 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.590 -0.830 25033
1339 1 4 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.980 -1.399 25033
1340 1 4 . 1 1 59 59 ARG N N 59 119.557 119.557 122.360 -2.803 25033
1341 1 4 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.651 -0.066 25033
1342 1 4 . 1 1 59 59 ARG C C 59 175.256 175.256 175.138 0.118 25033
1343 1 4 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.527 -0.415 25033
1344 1 4 . 1 1 59 59 ARG CB C 59 32.970 32.970 32.101 0.869 25033
1345 1 4 . 1 1 59 59 ARG H H 59 8.529 8.529 8.474 0.055 25033
1346 1 4 . 1 1 60 60 GLU N N 60 121.597 121.597 120.549 1.048 25033
1347 1 4 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.117 -0.536 25033
1348 1 4 . 1 1 60 60 GLU C C 60 177.281 177.281 176.539 0.742 25033
1349 1 4 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.663 0.638 25033
1350 1 4 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.588 -0.327 25033
1351 1 4 . 1 1 60 60 GLU H H 60 8.691 8.691 8.622 0.069 25033
1352 1 4 . 1 1 61 61 GLY N N 61 113.554 113.554 111.988 1.566 25033
1353 1 4 . 1 1 61 61 GLY C C 61 174.068 174.068 174.301 -0.233 25033
1354 1 4 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.736 0.507 25033
1355 1 4 . 1 1 61 61 GLY H H 61 9.151 9.151 8.638 0.513 25033
1356 1 4 . 1 1 62 62 GLU N N 62 121.639 121.639 122.262 -0.623 25033
1357 1 4 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.293 -0.089 25033
1358 1 4 . 1 1 62 62 GLU C C 62 175.439 175.439 176.051 -0.612 25033
1359 1 4 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.656 0.686 25033
1360 1 4 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.490 0.435 25033
1361 1 4 . 1 1 62 62 GLU H H 62 7.889 7.889 7.729 0.160 25033
1362 1 4 . 1 1 63 63 VAL N N 63 125.003 125.003 126.119 -1.116 25033
1363 1 4 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.719 0.029 25033
1364 1 4 . 1 1 63 63 VAL C C 63 176.639 176.639 175.980 0.659 25033
1365 1 4 . 1 1 63 63 VAL CA C 63 62.631 62.631 60.898 1.733 25033
1366 1 4 . 1 1 63 63 VAL CB C 63 32.357 32.357 33.036 -0.679 25033
1367 1 4 . 1 1 63 63 VAL H H 63 8.477 8.477 8.225 0.252 25033
1368 1 4 . 1 1 64 64 VAL N N 64 120.113 120.113 124.334 -4.221 25033
1369 1 4 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.658 0.346 25033
1370 1 4 . 1 1 64 64 VAL C C 64 173.790 173.790 174.160 -0.370 25033
1371 1 4 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.463 -0.854 25033
1372 1 4 . 1 1 64 64 VAL CB C 64 36.360 36.360 34.998 1.363 25033
1373 1 4 . 1 1 64 64 VAL H H 64 8.686 8.686 8.925 -0.239 25033
1374 1 4 . 1 1 65 65 GLU N N 65 120.433 120.433 119.748 0.685 25033
1375 1 4 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.258 0.189 25033
1376 1 4 . 1 1 65 65 GLU C C 65 175.584 175.584 175.157 0.427 25033
1377 1 4 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.946 -0.556 25033
1378 1 4 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.344 0.659 25033
1379 1 4 . 1 1 65 65 GLU H H 65 9.003 9.003 7.923 1.080 25033
1380 1 4 . 1 1 66 66 PHE N N 66 116.104 116.104 120.416 -4.312 25033
1381 1 4 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.096 -0.035 25033
1382 1 4 . 1 1 66 66 PHE C C 66 173.001 173.001 172.836 0.165 25033
1383 1 4 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.826 0.031 25033
1384 1 4 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.657 -0.225 25033
1385 1 4 . 1 1 66 66 PHE H H 66 8.172 8.172 7.730 0.442 25033
1386 1 4 . 1 1 67 67 GLU N N 67 117.574 117.574 119.178 -1.604 25033
1387 1 4 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.027 -0.155 25033
1388 1 4 . 1 1 67 67 GLU C C 67 175.327 175.327 175.313 0.014 25033
1389 1 4 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.191 0.450 25033
1390 1 4 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.095 -0.075 25033
1391 1 4 . 1 1 67 67 GLU H H 67 8.668 8.668 8.611 0.057 25033
1392 1 4 . 1 1 68 68 VAL N N 68 120.881 120.881 122.656 -1.775 25033
1393 1 4 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.485 0.527 25033
1394 1 4 . 1 1 68 68 VAL C C 68 176.140 176.140 176.317 -0.177 25033
1395 1 4 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.212 0.126 25033
1396 1 4 . 1 1 68 68 VAL CB C 68 34.006 34.006 31.471 2.535 25033
1397 1 4 . 1 1 68 68 VAL H H 68 8.748 8.748 8.510 0.238 25033
1398 1 4 . 1 1 69 69 GLU N N 69 128.110 128.110 128.596 -0.486 25033
1399 1 4 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.698 0.007 25033
1400 1 4 . 1 1 69 69 GLU C C 69 174.573 174.573 174.635 -0.062 25033
1401 1 4 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.620 0.333 25033
1402 1 4 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.579 0.711 25033
1403 1 4 . 1 1 69 69 GLU H H 69 9.070 9.070 9.225 -0.155 25033
1404 1 4 . 1 1 70 70 ALA N N 70 127.944 127.944 127.855 0.089 25033
1405 1 4 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.210 -0.206 25033
1406 1 4 . 1 1 70 70 ALA C C 70 178.073 178.073 177.225 0.848 25033
1407 1 4 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.738 0.221 25033
1408 1 4 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.479 -0.990 25033
1409 1 4 . 1 1 70 70 ALA H H 70 8.671 8.671 8.546 0.125 25033
1410 1 4 . 1 1 71 71 GLY N N 71 110.340 110.340 111.578 -1.238 25033
1411 1 4 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.626 0.390 25033
1412 1 4 . 1 1 71 71 GLY H H 71 8.445 8.445 8.163 0.282 25033
1413 1 4 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.373 0.044 25033
1414 1 4 . 1 1 72 72 PRO C C 72 176.835 176.835 176.738 0.097 25033
1415 1 4 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.410 -0.250 25033
1416 1 4 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.613 0.267 25033
1417 1 4 . 1 1 73 73 ASP N N 73 116.498 116.498 117.221 -0.723 25033
1418 1 4 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.596 -0.081 25033
1419 1 4 . 1 1 73 73 ASP C C 73 176.775 176.775 177.556 -0.781 25033
1420 1 4 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.513 -0.966 25033
1421 1 4 . 1 1 73 73 ASP CB C 73 40.234 40.234 41.022 -0.788 25033
1422 1 4 . 1 1 73 73 ASP H H 73 8.248 8.248 8.493 -0.245 25033
1423 1 4 . 1 1 74 74 GLY N N 74 107.369 107.369 107.931 -0.562 25033
1424 1 4 . 1 1 74 74 GLY C C 74 174.331 174.331 173.793 0.538 25033
1425 1 4 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.782 0.795 25033
1426 1 4 . 1 1 74 74 GLY H H 74 8.153 8.153 7.514 0.639 25033
1427 1 4 . 1 1 75 75 ARG N N 75 120.942 120.942 121.157 -0.215 25033
1428 1 4 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.449 0.093 25033
1429 1 4 . 1 1 75 75 ARG C C 75 176.652 176.652 175.358 1.294 25033
1430 1 4 . 1 1 75 75 ARG CA C 75 55.658 55.658 56.013 -0.355 25033
1431 1 4 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.095 -0.186 25033
1432 1 4 . 1 1 75 75 ARG H H 75 7.670 7.670 8.394 -0.724 25033
1433 1 4 . 1 1 76 76 SER N N 76 120.181 120.181 116.590 3.591 25033
1434 1 4 . 1 1 76 76 SER HA H 76 5.035 5.035 5.587 -0.552 25033
1435 1 4 . 1 1 76 76 SER C C 76 172.816 172.816 174.181 -1.365 25033
1436 1 4 . 1 1 76 76 SER CA C 76 59.080 59.080 56.854 2.226 25033
1437 1 4 . 1 1 76 76 SER CB C 76 64.850 64.850 65.831 -0.981 25033
1438 1 4 . 1 1 76 76 SER H H 76 8.808 8.808 8.453 0.355 25033
1439 1 4 . 1 1 77 77 LYS N N 77 121.202 121.202 122.389 -1.187 25033
1440 1 4 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.805 0.369 25033
1441 1 4 . 1 1 77 77 LYS C C 77 173.706 173.706 174.303 -0.597 25033
1442 1 4 . 1 1 77 77 LYS CA C 77 54.599 54.599 54.684 -0.085 25033
1443 1 4 . 1 1 77 77 LYS CB C 77 36.035 36.035 37.461 -1.426 25033
1444 1 4 . 1 1 77 77 LYS H H 77 8.982 8.982 8.898 0.084 25033
1445 1 4 . 1 1 78 78 ALA N N 78 124.064 124.064 123.920 0.144 25033
1446 1 4 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.895 0.109 25033
1447 1 4 . 1 1 78 78 ALA C C 78 175.979 175.979 175.855 0.124 25033
1448 1 4 . 1 1 78 78 ALA CA C 78 50.445 50.445 50.719 -0.274 25033
1449 1 4 . 1 1 78 78 ALA CB C 78 20.136 20.136 20.003 0.133 25033
1450 1 4 . 1 1 78 78 ALA H H 78 8.706 8.706 8.449 0.257 25033
1451 1 4 . 1 1 79 79 VAL N N 79 113.264 113.264 117.300 -4.036 25033
1452 1 4 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.465 0.378 25033
1453 1 4 . 1 1 79 79 VAL C C 79 174.744 174.744 174.532 0.212 25033
1454 1 4 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.620 -0.547 25033
1455 1 4 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.338 0.258 25033
1456 1 4 . 1 1 79 79 VAL H H 79 9.165 9.165 7.701 1.464 25033
1457 1 4 . 1 1 80 80 ASN N N 80 120.084 120.084 114.861 5.223 25033
1458 1 4 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.302 0.054 25033
1459 1 4 . 1 1 80 80 ASN C C 80 175.391 175.391 173.919 1.472 25033
1460 1 4 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.782 -0.048 25033
1461 1 4 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.783 0.338 25033
1462 1 4 . 1 1 80 80 ASN H H 80 8.923 8.923 8.537 0.386 25033
1463 1 4 . 1 1 81 81 VAL N N 81 119.178 119.178 118.326 0.852 25033
1464 1 4 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.596 0.151 25033
1465 1 4 . 1 1 81 81 VAL C C 81 176.340 176.340 176.019 0.321 25033
1466 1 4 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.030 1.130 25033
1467 1 4 . 1 1 81 81 VAL CB C 81 32.130 32.130 32.059 0.071 25033
1468 1 4 . 1 1 81 81 VAL H H 81 8.282 8.282 7.594 0.688 25033
1469 1 5 . 1 1 12 12 SER N N 12 116.112 116.112 117.317 -1.205 25033
1470 1 5 . 1 1 12 12 SER C C 12 175.271 175.271 176.199 -0.928 25033
1471 1 5 . 1 1 12 12 SER CA C 12 58.570 58.570 58.888 -0.318 25033
1472 1 5 . 1 1 12 12 SER CB C 12 63.984 63.984 63.771 0.213 25033
1473 1 5 . 1 1 12 12 SER H H 12 8.422 8.422 8.421 0.001 25033
1474 1 5 . 1 1 13 13 GLY N N 13 111.178 111.178 110.446 0.732 25033
1475 1 5 . 1 1 13 13 GLY C C 13 174.238 174.238 174.495 -0.257 25033
1476 1 5 . 1 1 13 13 GLY CA C 13 45.520 45.520 45.537 -0.017 25033
1477 1 5 . 1 1 13 13 GLY H H 13 8.537 8.537 8.151 0.386 25033
1478 1 5 . 1 1 14 14 GLU N N 14 120.547 120.547 119.902 0.645 25033
1479 1 5 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.317 -0.050 25033
1480 1 5 . 1 1 14 14 GLU C C 14 176.455 176.455 175.587 0.868 25033
1481 1 5 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.966 0.787 25033
1482 1 5 . 1 1 14 14 GLU CB C 14 30.464 30.464 28.288 2.176 25033
1483 1 5 . 1 1 14 14 GLU H H 14 8.285 8.285 8.368 -0.083 25033
1484 1 5 . 1 1 15 15 GLN N N 15 121.185 121.185 122.483 -1.298 25033
1485 1 5 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.130 0.219 25033
1486 1 5 . 1 1 15 15 GLN C C 15 175.494 175.494 175.236 0.258 25033
1487 1 5 . 1 1 15 15 GLN CA C 15 55.670 55.670 56.796 -1.126 25033
1488 1 5 . 1 1 15 15 GLN CB C 15 29.410 29.410 28.812 0.598 25033
1489 1 5 . 1 1 15 15 GLN H H 15 8.444 8.444 8.161 0.283 25033
1490 1 5 . 1 1 16 16 LEU N N 16 123.934 123.934 126.539 -2.605 25033
1491 1 5 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.587 -0.246 25033
1492 1 5 . 1 1 16 16 LEU C C 16 176.942 176.942 174.550 2.392 25033
1493 1 5 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.717 0.787 25033
1494 1 5 . 1 1 16 16 LEU CB C 16 42.519 42.519 45.458 -2.939 25033
1495 1 5 . 1 1 16 16 LEU H H 16 8.289 8.289 7.974 0.315 25033
1496 1 5 . 1 1 17 17 ARG N N 17 122.044 122.044 121.811 0.233 25033
1497 1 5 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.598 -0.134 25033
1498 1 5 . 1 1 17 17 ARG C C 17 175.829 175.829 175.458 0.371 25033
1499 1 5 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.747 0.925 25033
1500 1 5 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.922 -1.092 25033
1501 1 5 . 1 1 17 17 ARG H H 17 8.216 8.216 8.498 -0.282 25033
1502 1 5 . 1 1 18 18 GLN N N 18 122.488 122.488 123.625 -1.137 25033
1503 1 5 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.483 -0.149 25033
1504 1 5 . 1 1 18 18 GLN C C 18 172.958 172.958 173.281 -0.323 25033
1505 1 5 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.383 0.517 25033
1506 1 5 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.514 0.106 25033
1507 1 5 . 1 1 18 18 GLN H H 18 8.573 8.573 8.296 0.277 25033
1508 1 5 . 1 1 19 19 GLN N N 19 116.301 116.301 118.589 -2.288 25033
1509 1 5 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.073 0.305 25033
1510 1 5 . 1 1 19 19 GLN C C 19 176.902 176.902 174.086 2.816 25033
1511 1 5 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.261 -0.046 25033
1512 1 5 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.291 1.347 25033
1513 1 5 . 1 1 19 19 GLN H H 19 8.146 8.146 8.358 -0.212 25033
1514 1 5 . 1 1 20 20 GLY N N 20 109.745 109.745 107.296 2.449 25033
1515 1 5 . 1 1 20 20 GLY C C 20 170.989 170.989 172.700 -1.711 25033
1516 1 5 . 1 1 20 20 GLY CA C 20 45.935 45.935 45.016 0.919 25033
1517 1 5 . 1 1 20 20 GLY H H 20 8.998 8.998 8.105 0.893 25033
1518 1 5 . 1 1 21 21 THR N N 21 112.645 112.645 114.820 -2.175 25033
1519 1 5 . 1 1 21 21 THR HA H 21 5.361 5.361 4.857 0.504 25033
1520 1 5 . 1 1 21 21 THR C C 21 174.553 174.553 176.141 -1.588 25033
1521 1 5 . 1 1 21 21 THR CA C 21 60.025 60.025 60.553 -0.528 25033
1522 1 5 . 1 1 21 21 THR CB C 21 71.720 71.720 70.646 1.074 25033
1523 1 5 . 1 1 21 21 THR H H 21 8.312 8.312 8.359 -0.047 25033
1524 1 5 . 1 1 22 22 VAL N N 22 125.915 125.915 122.448 3.467 25033
1525 1 5 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.916 -0.267 25033
1526 1 5 . 1 1 22 22 VAL C C 22 175.553 175.553 177.724 -2.171 25033
1527 1 5 . 1 1 22 22 VAL CA C 22 64.618 64.618 65.250 -0.632 25033
1528 1 5 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.585 0.036 25033
1529 1 5 . 1 1 22 22 VAL H H 22 9.092 9.092 8.193 0.899 25033
1530 1 5 . 1 1 23 23 LYS N N 23 135.790 135.790 118.607 17.183 25033
1531 1 5 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.042 0.259 25033
1532 1 5 . 1 1 23 23 LYS C C 23 176.301 176.301 176.600 -0.299 25033
1533 1 5 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.388 0.222 25033
1534 1 5 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.071 3.229 25033
1535 1 5 . 1 1 23 23 LYS H H 23 9.276 9.276 8.461 0.815 25033
1536 1 5 . 1 1 24 24 TRP N N 24 111.651 111.651 119.348 -7.697 25033
1537 1 5 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.669 -0.046 25033
1538 1 5 . 1 1 24 24 TRP C C 24 173.628 173.628 175.149 -1.521 25033
1539 1 5 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.902 0.398 25033
1540 1 5 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.762 1.498 25033
1541 1 5 . 1 1 24 24 TRP H H 24 7.455 7.455 7.456 -0.001 25033
1542 1 5 . 1 1 25 25 PHE N N 25 121.305 121.305 119.736 1.569 25033
1543 1 5 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.598 -0.313 25033
1544 1 5 . 1 1 25 25 PHE C C 25 172.354 172.354 174.043 -1.689 25033
1545 1 5 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.629 1.743 25033
1546 1 5 . 1 1 25 25 PHE CB C 25 42.569 42.569 41.150 1.419 25033
1547 1 5 . 1 1 25 25 PHE H H 25 9.074 9.074 7.782 1.292 25033
1548 1 5 . 1 1 26 26 ASN N N 26 126.976 126.976 125.178 1.798 25033
1549 1 5 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.906 -0.094 25033
1550 1 5 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.397 -0.985 25033
1551 1 5 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.316 -0.230 25033
1552 1 5 . 1 1 26 26 ASN H H 26 8.159 8.159 7.879 0.280 25033
1553 1 5 . 1 1 27 27 ALA N N 27 128.245 128.245 127.763 0.482 25033
1554 1 5 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.139 -0.018 25033
1555 1 5 . 1 1 27 27 ALA C C 27 179.031 179.031 178.461 0.570 25033
1556 1 5 . 1 1 27 27 ALA CA C 27 54.425 54.425 54.994 -0.569 25033
1557 1 5 . 1 1 27 27 ALA CB C 27 18.374 18.374 19.167 -0.793 25033
1558 1 5 . 1 1 27 27 ALA H H 27 9.036 9.036 8.642 0.394 25033
1559 1 5 . 1 1 28 28 THR N N 28 113.994 113.994 113.216 0.778 25033
1560 1 5 . 1 1 28 28 THR HA H 28 4.068 4.068 4.054 0.014 25033
1561 1 5 . 1 1 28 28 THR C C 28 176.084 176.084 175.672 0.412 25033
1562 1 5 . 1 1 28 28 THR CA C 28 65.820 65.820 65.469 0.351 25033
1563 1 5 . 1 1 28 28 THR CB C 28 68.291 68.291 68.656 -0.365 25033
1564 1 5 . 1 1 28 28 THR H H 28 8.065 8.065 7.938 0.127 25033
1565 1 5 . 1 1 29 29 LYS N N 29 118.922 118.922 118.604 0.318 25033
1566 1 5 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.182 0.074 25033
1567 1 5 . 1 1 29 29 LYS C C 29 177.201 177.201 176.718 0.483 25033
1568 1 5 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.442 0.446 25033
1569 1 5 . 1 1 29 29 LYS CB C 29 33.740 33.740 31.794 1.946 25033
1570 1 5 . 1 1 29 29 LYS H H 29 7.446 7.446 7.959 -0.513 25033
1571 1 5 . 1 1 30 30 GLY N N 30 107.601 107.601 107.732 -0.131 25033
1572 1 5 . 1 1 30 30 GLY C C 30 172.004 172.004 173.443 -1.439 25033
1573 1 5 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.291 1.113 25033
1574 1 5 . 1 1 30 30 GLY H H 30 8.115 8.115 7.824 0.291 25033
1575 1 5 . 1 1 31 31 PHE N N 31 112.488 112.488 114.838 -2.350 25033
1576 1 5 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.764 0.243 25033
1577 1 5 . 1 1 31 31 PHE CA C 31 55.278 55.278 55.991 -0.713 25033
1578 1 5 . 1 1 31 31 PHE CB C 31 42.388 42.388 39.306 3.082 25033
1579 1 5 . 1 1 31 31 PHE H H 31 6.594 6.594 7.199 -0.605 25033
1580 1 5 . 1 1 32 32 GLY N N 32 105.986 105.986 108.834 -2.848 25033
1581 1 5 . 1 1 32 32 GLY C C 32 170.292 170.292 171.930 -1.638 25033
1582 1 5 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.244 2.125 25033
1583 1 5 . 1 1 32 32 GLY H H 32 8.144 8.144 7.495 0.649 25033
1584 1 5 . 1 1 33 33 PHE N N 33 115.319 115.319 116.315 -0.996 25033
1585 1 5 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.184 0.279 25033
1586 1 5 . 1 1 33 33 PHE C C 33 175.037 175.037 174.697 0.340 25033
1587 1 5 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.517 -1.222 25033
1588 1 5 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.183 0.609 25033
1589 1 5 . 1 1 33 33 PHE H H 33 7.971 7.971 8.256 -0.285 25033
1590 1 5 . 1 1 34 34 ILE N N 34 122.140 122.140 121.134 1.006 25033
1591 1 5 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.612 -0.295 25033
1592 1 5 . 1 1 34 34 ILE C C 34 174.526 174.526 174.911 -0.385 25033
1593 1 5 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.735 0.062 25033
1594 1 5 . 1 1 34 34 ILE CB C 34 42.583 42.583 41.215 1.368 25033
1595 1 5 . 1 1 34 34 ILE H H 34 9.511 9.511 9.046 0.465 25033
1596 1 5 . 1 1 35 35 THR N N 35 126.580 126.580 122.944 3.636 25033
1597 1 5 . 1 1 35 35 THR HA H 35 5.143 5.143 5.214 -0.071 25033
1598 1 5 . 1 1 35 35 THR CA C 35 59.330 59.330 58.926 0.404 25033
1599 1 5 . 1 1 35 35 THR CB C 35 70.258 70.258 68.754 1.504 25033
1600 1 5 . 1 1 35 35 THR H H 35 9.416 9.416 8.815 0.601 25033
1601 1 5 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.590 0.009 25033
1602 1 5 . 1 1 36 36 PRO C C 36 177.390 177.390 177.856 -0.466 25033
1603 1 5 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.094 0.126 25033
1604 1 5 . 1 1 36 36 PRO CB C 36 32.470 32.470 31.489 0.981 25033
1605 1 5 . 1 1 37 37 GLY N N 37 112.033 112.033 113.504 -1.471 25033
1606 1 5 . 1 1 37 37 GLY C C 37 169.261 169.261 174.905 -5.644 25033
1607 1 5 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.831 1.627 25033
1608 1 5 . 1 1 37 37 GLY H H 37 9.349 9.349 8.474 0.875 25033
1609 1 5 . 1 1 38 38 GLY N N 38 109.050 109.050 109.227 -0.177 25033
1610 1 5 . 1 1 38 38 GLY C C 38 175.177 175.177 175.495 -0.318 25033
1611 1 5 . 1 1 38 38 GLY H H 38 8.756 8.756 7.909 0.847 25033
1612 1 5 . 1 1 39 39 GLY N N 39 107.730 107.730 107.907 -0.177 25033
1613 1 5 . 1 1 39 39 GLY C C 39 173.870 173.870 175.118 -1.248 25033
1614 1 5 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.412 -1.154 25033
1615 1 5 . 1 1 39 39 GLY H H 39 7.725 7.725 8.456 -0.731 25033
1616 1 5 . 1 1 40 40 GLY N N 40 107.183 107.183 107.326 -0.143 25033
1617 1 5 . 1 1 40 40 GLY C C 40 173.067 173.067 173.795 -0.728 25033
1618 1 5 . 1 1 40 40 GLY CA C 40 43.760 43.760 45.267 -1.507 25033
1619 1 5 . 1 1 40 40 GLY H H 40 8.096 8.096 7.959 0.137 25033
1620 1 5 . 1 1 41 41 GLU N N 41 119.455 119.455 123.309 -3.854 25033
1621 1 5 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.169 0.009 25033
1622 1 5 . 1 1 41 41 GLU C C 41 175.900 175.900 175.092 0.808 25033
1623 1 5 . 1 1 41 41 GLU CA C 41 56.377 56.377 56.831 -0.454 25033
1624 1 5 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.317 0.283 25033
1625 1 5 . 1 1 41 41 GLU H H 41 8.199 8.199 8.314 -0.115 25033
1626 1 5 . 1 1 42 42 ASP N N 42 119.784 119.784 123.205 -3.421 25033
1627 1 5 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.189 -0.332 25033
1628 1 5 . 1 1 42 42 ASP C C 42 176.474 176.474 175.730 0.744 25033
1629 1 5 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.141 2.300 25033
1630 1 5 . 1 1 42 42 ASP CB C 42 41.488 41.488 42.452 -0.964 25033
1631 1 5 . 1 1 42 42 ASP H H 42 8.277 8.277 8.332 -0.055 25033
1632 1 5 . 1 1 43 43 LEU N N 43 122.515 122.515 121.642 0.873 25033
1633 1 5 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.872 -0.185 25033
1634 1 5 . 1 1 43 43 LEU C C 43 175.759 175.759 175.952 -0.193 25033
1635 1 5 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.809 -0.505 25033
1636 1 5 . 1 1 43 43 LEU CB C 43 45.449 45.449 46.194 -0.745 25033
1637 1 5 . 1 1 43 43 LEU H H 43 9.423 9.423 8.692 0.731 25033
1638 1 5 . 1 1 44 44 PHE N N 44 125.962 125.962 121.215 4.747 25033
1639 1 5 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.328 -0.406 25033
1640 1 5 . 1 1 44 44 PHE C C 44 172.844 172.844 175.532 -2.688 25033
1641 1 5 . 1 1 44 44 PHE CA C 44 57.880 57.880 58.209 -0.328 25033
1642 1 5 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.620 0.730 25033
1643 1 5 . 1 1 44 44 PHE H H 44 8.465 8.465 8.754 -0.289 25033
1644 1 5 . 1 1 45 45 VAL N N 45 123.552 123.552 123.590 -0.038 25033
1645 1 5 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.290 0.367 25033
1646 1 5 . 1 1 45 45 VAL C C 45 177.433 177.433 173.370 4.063 25033
1647 1 5 . 1 1 45 45 VAL CA C 45 58.460 58.460 59.808 -1.348 25033
1648 1 5 . 1 1 45 45 VAL CB C 45 34.884 34.884 34.661 0.223 25033
1649 1 5 . 1 1 45 45 VAL H H 45 7.715 7.715 7.711 0.004 25033
1650 1 5 . 1 1 46 46 HIS N N 46 127.300 127.300 124.481 2.819 25033
1651 1 5 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.913 -0.088 25033
1652 1 5 . 1 1 46 46 HIS C C 46 176.469 176.469 174.387 2.082 25033
1653 1 5 . 1 1 46 46 HIS CA C 46 55.929 55.929 54.733 1.196 25033
1654 1 5 . 1 1 46 46 HIS CB C 46 34.399 34.399 32.151 2.248 25033
1655 1 5 . 1 1 46 46 HIS H H 46 9.104 9.104 8.343 0.761 25033
1656 1 5 . 1 1 47 47 GLN N N 47 125.105 125.105 124.654 0.451 25033
1657 1 5 . 1 1 47 47 GLN H H 47 8.352 8.352 8.845 -0.493 25033
1658 1 5 . 1 1 48 48 THR HA H 48 4.310 4.310 4.426 -0.116 25033
1659 1 5 . 1 1 48 48 THR C C 48 175.568 175.568 175.335 0.233 25033
1660 1 5 . 1 1 48 48 THR CA C 48 64.770 64.770 62.954 1.816 25033
1661 1 5 . 1 1 48 48 THR CB C 48 70.054 70.054 69.719 0.335 25033
1662 1 5 . 1 1 49 49 ASN N N 49 118.142 118.142 118.640 -0.498 25033
1663 1 5 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.916 0.244 25033
1664 1 5 . 1 1 49 49 ASN C C 49 172.914 172.914 173.959 -1.045 25033
1665 1 5 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.135 1.216 25033
1666 1 5 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.534 0.993 25033
1667 1 5 . 1 1 49 49 ASN H H 49 8.452 8.452 8.440 0.012 25033
1668 1 5 . 1 1 50 50 ILE N N 50 119.226 119.226 120.992 -1.766 25033
1669 1 5 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.229 -0.117 25033
1670 1 5 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.776 0.830 25033
1671 1 5 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.590 1.772 25033
1672 1 5 . 1 1 50 50 ILE H H 50 7.354 7.354 7.905 -0.551 25033
1673 1 5 . 1 1 51 51 ASN N N 51 128.460 128.460 122.760 5.700 25033
1674 1 5 . 1 1 51 51 ASN C C 51 174.614 174.614 174.247 0.367 25033
1675 1 5 . 1 1 51 51 ASN H H 51 9.266 9.266 7.989 1.277 25033
1676 1 5 . 1 1 52 52 SER N N 52 117.246 117.246 117.248 -0.002 25033
1677 1 5 . 1 1 52 52 SER HA H 52 4.413 4.413 4.796 -0.383 25033
1678 1 5 . 1 1 52 52 SER C C 52 174.139 174.139 174.091 0.048 25033
1679 1 5 . 1 1 52 52 SER CA C 52 58.378 58.378 57.597 0.780 25033
1680 1 5 . 1 1 52 52 SER CB C 52 64.371 64.371 64.863 -0.492 25033
1681 1 5 . 1 1 52 52 SER H H 52 7.973 7.973 8.333 -0.360 25033
1682 1 5 . 1 1 53 53 GLU N N 53 123.628 123.628 120.805 2.823 25033
1683 1 5 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.228 0.070 25033
1684 1 5 . 1 1 53 53 GLU C C 53 176.960 176.960 176.726 0.234 25033
1685 1 5 . 1 1 53 53 GLU CA C 53 57.270 57.270 57.820 -0.550 25033
1686 1 5 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.650 0.211 25033
1687 1 5 . 1 1 53 53 GLU H H 53 8.641 8.641 8.988 -0.347 25033
1688 1 5 . 1 1 54 54 GLY N N 54 110.282 110.282 107.406 2.876 25033
1689 1 5 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.696 -0.096 25033
1690 1 5 . 1 1 54 54 GLY H H 54 8.225 8.225 7.890 0.335 25033
1691 1 5 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.801 0.019 25033
1692 1 5 . 1 1 55 55 PHE C C 55 175.836 175.836 175.421 0.415 25033
1693 1 5 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.516 -4.826 25033
1694 1 5 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.778 -3.683 25033
1695 1 5 . 1 1 56 56 ARG N N 56 120.907 120.907 122.428 -1.521 25033
1696 1 5 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.700 -0.436 25033
1697 1 5 . 1 1 56 56 ARG C C 56 175.618 175.618 175.832 -0.214 25033
1698 1 5 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.350 0.160 25033
1699 1 5 . 1 1 56 56 ARG CB C 56 32.020 32.020 32.040 -0.020 25033
1700 1 5 . 1 1 56 56 ARG H H 56 8.153 8.153 8.749 -0.596 25033
1701 1 5 . 1 1 57 57 SER N N 57 123.117 123.117 119.247 3.870 25033
1702 1 5 . 1 1 57 57 SER H H 57 7.834 7.834 8.559 -0.725 25033
1703 1 5 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.698 -0.418 25033
1704 1 5 . 1 1 58 58 LEU C C 58 174.842 174.842 176.618 -1.776 25033
1705 1 5 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.387 -0.627 25033
1706 1 5 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.723 -1.143 25033
1707 1 5 . 1 1 59 59 ARG N N 59 119.557 119.557 124.912 -5.355 25033
1708 1 5 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.718 -0.133 25033
1709 1 5 . 1 1 59 59 ARG C C 59 175.256 175.256 175.828 -0.572 25033
1710 1 5 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.735 -0.623 25033
1711 1 5 . 1 1 59 59 ARG CB C 59 32.970 32.970 32.192 0.778 25033
1712 1 5 . 1 1 59 59 ARG H H 59 8.529 8.529 8.615 -0.086 25033
1713 1 5 . 1 1 60 60 GLU N N 60 121.597 121.597 120.360 1.237 25033
1714 1 5 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.055 -0.474 25033
1715 1 5 . 1 1 60 60 GLU C C 60 177.281 177.281 176.790 0.491 25033
1716 1 5 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.025 1.276 25033
1717 1 5 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.916 -0.655 25033
1718 1 5 . 1 1 60 60 GLU H H 60 8.691 8.691 8.627 0.064 25033
1719 1 5 . 1 1 61 61 GLY N N 61 113.554 113.554 110.203 3.351 25033
1720 1 5 . 1 1 61 61 GLY C C 61 174.068 174.068 174.113 -0.045 25033
1721 1 5 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.889 0.354 25033
1722 1 5 . 1 1 61 61 GLY H H 61 9.151 9.151 8.675 0.476 25033
1723 1 5 . 1 1 62 62 GLU N N 62 121.639 121.639 122.002 -0.363 25033
1724 1 5 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.328 -0.124 25033
1725 1 5 . 1 1 62 62 GLU C C 62 175.439 175.439 176.325 -0.886 25033
1726 1 5 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.346 0.996 25033
1727 1 5 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.605 0.320 25033
1728 1 5 . 1 1 62 62 GLU H H 62 7.889 7.889 7.580 0.309 25033
1729 1 5 . 1 1 63 63 VAL N N 63 125.003 125.003 125.306 -0.303 25033
1730 1 5 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.535 0.213 25033
1731 1 5 . 1 1 63 63 VAL C C 63 176.639 176.639 176.370 0.269 25033
1732 1 5 . 1 1 63 63 VAL CA C 63 62.631 62.631 62.762 -0.131 25033
1733 1 5 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.622 -0.265 25033
1734 1 5 . 1 1 63 63 VAL H H 63 8.477 8.477 8.361 0.116 25033
1735 1 5 . 1 1 64 64 VAL N N 64 120.113 120.113 122.302 -2.189 25033
1736 1 5 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.634 0.370 25033
1737 1 5 . 1 1 64 64 VAL C C 64 173.790 173.790 174.514 -0.724 25033
1738 1 5 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.723 -1.114 25033
1739 1 5 . 1 1 64 64 VAL CB C 64 36.360 36.360 34.791 1.569 25033
1740 1 5 . 1 1 64 64 VAL H H 64 8.686 8.686 8.812 -0.126 25033
1741 1 5 . 1 1 65 65 GLU N N 65 120.433 120.433 120.138 0.295 25033
1742 1 5 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.501 -0.054 25033
1743 1 5 . 1 1 65 65 GLU C C 65 175.584 175.584 175.195 0.389 25033
1744 1 5 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.919 -0.529 25033
1745 1 5 . 1 1 65 65 GLU CB C 65 34.003 34.003 32.951 1.052 25033
1746 1 5 . 1 1 65 65 GLU H H 65 9.003 9.003 8.358 0.645 25033
1747 1 5 . 1 1 66 66 PHE N N 66 116.104 116.104 120.295 -4.191 25033
1748 1 5 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.093 -0.032 25033
1749 1 5 . 1 1 66 66 PHE C C 66 173.001 173.001 172.722 0.279 25033
1750 1 5 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.841 0.016 25033
1751 1 5 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.501 -0.069 25033
1752 1 5 . 1 1 66 66 PHE H H 66 8.172 8.172 8.482 -0.310 25033
1753 1 5 . 1 1 67 67 GLU N N 67 117.574 117.574 118.134 -0.560 25033
1754 1 5 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.291 -0.419 25033
1755 1 5 . 1 1 67 67 GLU C C 67 175.327 175.327 175.952 -0.625 25033
1756 1 5 . 1 1 67 67 GLU CA C 67 54.641 54.641 53.696 0.945 25033
1757 1 5 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.262 -0.242 25033
1758 1 5 . 1 1 67 67 GLU H H 67 8.668 8.668 8.637 0.031 25033
1759 1 5 . 1 1 68 68 VAL N N 68 120.881 120.881 122.099 -1.218 25033
1760 1 5 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.224 0.788 25033
1761 1 5 . 1 1 68 68 VAL C C 68 176.140 176.140 175.760 0.380 25033
1762 1 5 . 1 1 68 68 VAL CA C 68 62.338 62.338 63.307 -0.969 25033
1763 1 5 . 1 1 68 68 VAL CB C 68 34.006 34.006 31.813 2.193 25033
1764 1 5 . 1 1 68 68 VAL H H 68 8.748 8.748 8.499 0.249 25033
1765 1 5 . 1 1 69 69 GLU N N 69 128.110 128.110 128.080 0.030 25033
1766 1 5 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.700 0.005 25033
1767 1 5 . 1 1 69 69 GLU C C 69 174.573 174.573 174.732 -0.159 25033
1768 1 5 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.365 0.588 25033
1769 1 5 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.803 0.486 25033
1770 1 5 . 1 1 69 69 GLU H H 69 9.070 9.070 9.214 -0.144 25033
1771 1 5 . 1 1 70 70 ALA N N 70 127.944 127.944 129.149 -1.205 25033
1772 1 5 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.243 -0.239 25033
1773 1 5 . 1 1 70 70 ALA C C 70 178.073 178.073 177.319 0.754 25033
1774 1 5 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.958 0.001 25033
1775 1 5 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.043 -0.554 25033
1776 1 5 . 1 1 70 70 ALA H H 70 8.671 8.671 8.621 0.050 25033
1777 1 5 . 1 1 71 71 GLY N N 71 110.340 110.340 111.609 -1.269 25033
1778 1 5 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.791 0.225 25033
1779 1 5 . 1 1 71 71 GLY H H 71 8.445 8.445 7.985 0.460 25033
1780 1 5 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.379 0.038 25033
1781 1 5 . 1 1 72 72 PRO C C 72 176.835 176.835 176.690 0.145 25033
1782 1 5 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.533 -0.373 25033
1783 1 5 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.587 0.293 25033
1784 1 5 . 1 1 73 73 ASP N N 73 116.498 116.498 117.848 -1.350 25033
1785 1 5 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.549 -0.034 25033
1786 1 5 . 1 1 73 73 ASP C C 73 176.775 176.775 177.354 -0.579 25033
1787 1 5 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.412 -0.865 25033
1788 1 5 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.544 -0.310 25033
1789 1 5 . 1 1 73 73 ASP H H 73 8.248 8.248 8.133 0.115 25033
1790 1 5 . 1 1 74 74 GLY N N 74 107.369 107.369 107.915 -0.546 25033
1791 1 5 . 1 1 74 74 GLY C C 74 174.331 174.331 174.331 0.000 25033
1792 1 5 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.834 0.744 25033
1793 1 5 . 1 1 74 74 GLY H H 74 8.153 8.153 7.656 0.497 25033
1794 1 5 . 1 1 75 75 ARG N N 75 120.942 120.942 120.831 0.111 25033
1795 1 5 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.479 0.063 25033
1796 1 5 . 1 1 75 75 ARG C C 75 176.652 176.652 175.052 1.600 25033
1797 1 5 . 1 1 75 75 ARG CA C 75 55.658 55.658 56.058 -0.400 25033
1798 1 5 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.206 -0.297 25033
1799 1 5 . 1 1 75 75 ARG H H 75 7.670 7.670 8.251 -0.581 25033
1800 1 5 . 1 1 76 76 SER N N 76 120.181 120.181 116.065 4.116 25033
1801 1 5 . 1 1 76 76 SER HA H 76 5.035 5.035 5.247 -0.212 25033
1802 1 5 . 1 1 76 76 SER C C 76 172.816 172.816 173.693 -0.877 25033
1803 1 5 . 1 1 76 76 SER CA C 76 59.080 59.080 57.228 1.852 25033
1804 1 5 . 1 1 76 76 SER CB C 76 64.850 64.850 65.276 -0.426 25033
1805 1 5 . 1 1 76 76 SER H H 76 8.808 8.808 8.372 0.436 25033
1806 1 5 . 1 1 77 77 LYS N N 77 121.202 121.202 121.851 -0.649 25033
1807 1 5 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.794 0.380 25033
1808 1 5 . 1 1 77 77 LYS C C 77 173.706 173.706 174.176 -0.470 25033
1809 1 5 . 1 1 77 77 LYS CA C 77 54.599 54.599 54.811 -0.212 25033
1810 1 5 . 1 1 77 77 LYS CB C 77 36.035 36.035 35.863 0.172 25033
1811 1 5 . 1 1 77 77 LYS H H 77 8.982 8.982 8.942 0.040 25033
1812 1 5 . 1 1 78 78 ALA N N 78 124.064 124.064 124.233 -0.169 25033
1813 1 5 . 1 1 78 78 ALA HA H 78 5.004 5.004 5.260 -0.256 25033
1814 1 5 . 1 1 78 78 ALA C C 78 175.979 175.979 176.241 -0.262 25033
1815 1 5 . 1 1 78 78 ALA CA C 78 50.445 50.445 50.776 -0.331 25033
1816 1 5 . 1 1 78 78 ALA CB C 78 20.136 20.136 20.113 0.023 25033
1817 1 5 . 1 1 78 78 ALA H H 78 8.706 8.706 8.572 0.134 25033
1818 1 5 . 1 1 79 79 VAL N N 79 113.264 113.264 115.884 -2.620 25033
1819 1 5 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.567 0.276 25033
1820 1 5 . 1 1 79 79 VAL C C 79 174.744 174.744 174.519 0.225 25033
1821 1 5 . 1 1 79 79 VAL CA C 79 59.073 59.073 60.290 -1.217 25033
1822 1 5 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.561 0.035 25033
1823 1 5 . 1 1 79 79 VAL H H 79 9.165 9.165 7.763 1.402 25033
1824 1 5 . 1 1 80 80 ASN N N 80 120.084 120.084 115.451 4.633 25033
1825 1 5 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.352 0.004 25033
1826 1 5 . 1 1 80 80 ASN C C 80 175.391 175.391 173.967 1.424 25033
1827 1 5 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.747 -0.013 25033
1828 1 5 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.615 0.506 25033
1829 1 5 . 1 1 80 80 ASN H H 80 8.923 8.923 8.609 0.314 25033
1830 1 5 . 1 1 81 81 VAL N N 81 119.178 119.178 118.264 0.914 25033
1831 1 5 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.506 0.241 25033
1832 1 5 . 1 1 81 81 VAL C C 81 176.340 176.340 176.434 -0.094 25033
1833 1 5 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.086 1.074 25033
1834 1 5 . 1 1 81 81 VAL CB C 81 32.130 32.130 32.629 -0.499 25033
1835 1 5 . 1 1 81 81 VAL H H 81 8.282 8.282 7.505 0.777 25033
1836 1 6 . 1 1 12 12 SER N N 12 116.112 116.112 114.495 1.617 25033
1837 1 6 . 1 1 12 12 SER C C 12 175.271 175.271 174.233 1.038 25033
1838 1 6 . 1 1 12 12 SER CA C 12 58.570 58.570 57.918 0.652 25033
1839 1 6 . 1 1 12 12 SER CB C 12 63.984 63.984 64.466 -0.482 25033
1840 1 6 . 1 1 12 12 SER H H 12 8.422 8.422 8.487 -0.065 25033
1841 1 6 . 1 1 13 13 GLY N N 13 111.178 111.178 108.021 3.157 25033
1842 1 6 . 1 1 13 13 GLY C C 13 174.238 174.238 174.361 -0.123 25033
1843 1 6 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.705 0.815 25033
1844 1 6 . 1 1 13 13 GLY H H 13 8.537 8.537 8.400 0.137 25033
1845 1 6 . 1 1 14 14 GLU N N 14 120.547 120.547 121.323 -0.776 25033
1846 1 6 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.230 0.037 25033
1847 1 6 . 1 1 14 14 GLU C C 14 176.455 176.455 176.191 0.264 25033
1848 1 6 . 1 1 14 14 GLU CA C 14 56.753 56.753 56.742 0.011 25033
1849 1 6 . 1 1 14 14 GLU CB C 14 30.464 30.464 28.964 1.500 25033
1850 1 6 . 1 1 14 14 GLU H H 14 8.285 8.285 8.474 -0.189 25033
1851 1 6 . 1 1 15 15 GLN N N 15 121.185 121.185 121.510 -0.325 25033
1852 1 6 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.606 -0.257 25033
1853 1 6 . 1 1 15 15 GLN C C 15 175.494 175.494 175.177 0.317 25033
1854 1 6 . 1 1 15 15 GLN CA C 15 55.670 55.670 54.966 0.704 25033
1855 1 6 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.931 -0.521 25033
1856 1 6 . 1 1 15 15 GLN H H 15 8.444 8.444 8.070 0.374 25033
1857 1 6 . 1 1 16 16 LEU N N 16 123.934 123.934 125.890 -1.956 25033
1858 1 6 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.641 -0.300 25033
1859 1 6 . 1 1 16 16 LEU C C 16 176.942 176.942 175.886 1.056 25033
1860 1 6 . 1 1 16 16 LEU CA C 16 55.504 55.504 53.970 1.534 25033
1861 1 6 . 1 1 16 16 LEU CB C 16 42.519 42.519 40.582 1.937 25033
1862 1 6 . 1 1 16 16 LEU H H 16 8.289 8.289 8.672 -0.383 25033
1863 1 6 . 1 1 17 17 ARG N N 17 122.044 122.044 120.695 1.349 25033
1864 1 6 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.531 -0.067 25033
1865 1 6 . 1 1 17 17 ARG C C 17 175.829 175.829 176.046 -0.217 25033
1866 1 6 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.554 1.118 25033
1867 1 6 . 1 1 17 17 ARG CB C 17 29.830 29.830 29.864 -0.034 25033
1868 1 6 . 1 1 17 17 ARG H H 17 8.216 8.216 8.149 0.067 25033
1869 1 6 . 1 1 18 18 GLN N N 18 122.488 122.488 123.867 -1.379 25033
1870 1 6 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.513 -0.179 25033
1871 1 6 . 1 1 18 18 GLN C C 18 172.958 172.958 173.517 -0.559 25033
1872 1 6 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.158 0.742 25033
1873 1 6 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.384 0.236 25033
1874 1 6 . 1 1 18 18 GLN H H 18 8.573 8.573 7.919 0.654 25033
1875 1 6 . 1 1 19 19 GLN N N 19 116.301 116.301 119.576 -3.275 25033
1876 1 6 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.542 -0.164 25033
1877 1 6 . 1 1 19 19 GLN C C 19 176.902 176.902 174.445 2.457 25033
1878 1 6 . 1 1 19 19 GLN CA C 19 54.215 54.215 53.431 0.784 25033
1879 1 6 . 1 1 19 19 GLN CB C 19 34.638 34.638 32.979 1.659 25033
1880 1 6 . 1 1 19 19 GLN H H 19 8.146 8.146 8.327 -0.181 25033
1881 1 6 . 1 1 20 20 GLY N N 20 109.745 109.745 109.430 0.315 25033
1882 1 6 . 1 1 20 20 GLY C C 20 170.989 170.989 172.963 -1.974 25033
1883 1 6 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.253 1.682 25033
1884 1 6 . 1 1 20 20 GLY H H 20 8.998 8.998 8.350 0.648 25033
1885 1 6 . 1 1 21 21 THR N N 21 112.645 112.645 114.884 -2.239 25033
1886 1 6 . 1 1 21 21 THR HA H 21 5.361 5.361 5.076 0.285 25033
1887 1 6 . 1 1 21 21 THR C C 21 174.553 174.553 175.809 -1.256 25033
1888 1 6 . 1 1 21 21 THR CA C 21 60.025 60.025 60.152 -0.127 25033
1889 1 6 . 1 1 21 21 THR CB C 21 71.720 71.720 71.194 0.526 25033
1890 1 6 . 1 1 21 21 THR H H 21 8.312 8.312 8.383 -0.071 25033
1891 1 6 . 1 1 22 22 VAL N N 22 125.915 125.915 121.940 3.975 25033
1892 1 6 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.889 -0.240 25033
1893 1 6 . 1 1 22 22 VAL C C 22 175.553 175.553 177.837 -2.284 25033
1894 1 6 . 1 1 22 22 VAL CA C 22 64.618 64.618 65.188 -0.570 25033
1895 1 6 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.340 0.281 25033
1896 1 6 . 1 1 22 22 VAL H H 22 9.092 9.092 8.218 0.874 25033
1897 1 6 . 1 1 23 23 LYS N N 23 135.790 135.790 118.561 17.229 25033
1898 1 6 . 1 1 23 23 LYS HA H 23 4.301 4.301 3.997 0.304 25033
1899 1 6 . 1 1 23 23 LYS C C 23 176.301 176.301 176.451 -0.150 25033
1900 1 6 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.591 0.019 25033
1901 1 6 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.242 3.058 25033
1902 1 6 . 1 1 23 23 LYS H H 23 9.276 9.276 8.512 0.764 25033
1903 1 6 . 1 1 24 24 TRP N N 24 111.651 111.651 119.540 -7.889 25033
1904 1 6 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.810 -0.187 25033
1905 1 6 . 1 1 24 24 TRP C C 24 173.628 173.628 174.550 -0.922 25033
1906 1 6 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.810 0.490 25033
1907 1 6 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.945 1.315 25033
1908 1 6 . 1 1 24 24 TRP H H 24 7.455 7.455 7.551 -0.096 25033
1909 1 6 . 1 1 25 25 PHE N N 25 121.305 121.305 120.658 0.647 25033
1910 1 6 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.770 -0.485 25033
1911 1 6 . 1 1 25 25 PHE C C 25 172.354 172.354 174.662 -2.308 25033
1912 1 6 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.246 2.126 25033
1913 1 6 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.125 0.444 25033
1914 1 6 . 1 1 25 25 PHE H H 25 9.074 9.074 8.037 1.037 25033
1915 1 6 . 1 1 26 26 ASN N N 26 126.976 126.976 124.376 2.600 25033
1916 1 6 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.998 -0.186 25033
1917 1 6 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.112 -0.700 25033
1918 1 6 . 1 1 26 26 ASN CB C 26 39.086 39.086 38.110 0.976 25033
1919 1 6 . 1 1 26 26 ASN H H 26 8.159 8.159 8.190 -0.031 25033
1920 1 6 . 1 1 27 27 ALA N N 27 128.245 128.245 124.876 3.369 25033
1921 1 6 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.080 0.041 25033
1922 1 6 . 1 1 27 27 ALA C C 27 179.031 179.031 178.867 0.164 25033
1923 1 6 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.603 -1.178 25033
1924 1 6 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.676 -0.302 25033
1925 1 6 . 1 1 27 27 ALA H H 27 9.036 9.036 8.587 0.449 25033
1926 1 6 . 1 1 28 28 THR N N 28 113.994 113.994 113.566 0.428 25033
1927 1 6 . 1 1 28 28 THR HA H 28 4.068 4.068 4.027 0.041 25033
1928 1 6 . 1 1 28 28 THR C C 28 176.084 176.084 176.173 -0.089 25033
1929 1 6 . 1 1 28 28 THR CA C 28 65.820 65.820 65.018 0.802 25033
1930 1 6 . 1 1 28 28 THR CB C 28 68.291 68.291 68.111 0.180 25033
1931 1 6 . 1 1 28 28 THR H H 28 8.065 8.065 8.487 -0.422 25033
1932 1 6 . 1 1 29 29 LYS N N 29 118.922 118.922 120.017 -1.095 25033
1933 1 6 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.307 -0.051 25033
1934 1 6 . 1 1 29 29 LYS C C 29 177.201 177.201 177.564 -0.363 25033
1935 1 6 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.646 0.242 25033
1936 1 6 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.654 1.086 25033
1937 1 6 . 1 1 29 29 LYS H H 29 7.446 7.446 7.960 -0.514 25033
1938 1 6 . 1 1 30 30 GLY N N 30 107.601 107.601 106.735 0.866 25033
1939 1 6 . 1 1 30 30 GLY C C 30 172.004 172.004 173.131 -1.127 25033
1940 1 6 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.062 1.342 25033
1941 1 6 . 1 1 30 30 GLY H H 30 8.115 8.115 8.090 0.025 25033
1942 1 6 . 1 1 31 31 PHE N N 31 112.488 112.488 119.060 -6.572 25033
1943 1 6 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.708 0.299 25033
1944 1 6 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.021 -1.743 25033
1945 1 6 . 1 1 31 31 PHE CB C 31 42.388 42.388 40.786 1.601 25033
1946 1 6 . 1 1 31 31 PHE H H 31 6.594 6.594 7.457 -0.863 25033
1947 1 6 . 1 1 32 32 GLY N N 32 105.986 105.986 109.133 -3.147 25033
1948 1 6 . 1 1 32 32 GLY C C 32 170.292 170.292 171.616 -1.324 25033
1949 1 6 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.056 2.313 25033
1950 1 6 . 1 1 32 32 GLY H H 32 8.144 8.144 7.512 0.632 25033
1951 1 6 . 1 1 33 33 PHE N N 33 115.319 115.319 115.853 -0.534 25033
1952 1 6 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.179 0.284 25033
1953 1 6 . 1 1 33 33 PHE C C 33 175.037 175.037 175.103 -0.066 25033
1954 1 6 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.204 -0.909 25033
1955 1 6 . 1 1 33 33 PHE CB C 33 44.792 44.792 43.835 0.957 25033
1956 1 6 . 1 1 33 33 PHE H H 33 7.971 7.971 7.781 0.190 25033
1957 1 6 . 1 1 34 34 ILE N N 34 122.140 122.140 121.236 0.904 25033
1958 1 6 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.660 -0.343 25033
1959 1 6 . 1 1 34 34 ILE C C 34 174.526 174.526 175.289 -0.763 25033
1960 1 6 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.827 -0.030 25033
1961 1 6 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.415 2.168 25033
1962 1 6 . 1 1 34 34 ILE H H 34 9.511 9.511 8.582 0.929 25033
1963 1 6 . 1 1 35 35 THR N N 35 126.580 126.580 121.929 4.651 25033
1964 1 6 . 1 1 35 35 THR HA H 35 5.143 5.143 5.257 -0.114 25033
1965 1 6 . 1 1 35 35 THR CA C 35 59.330 59.330 57.536 1.794 25033
1966 1 6 . 1 1 35 35 THR CB C 35 70.258 70.258 69.399 0.859 25033
1967 1 6 . 1 1 35 35 THR H H 35 9.416 9.416 8.756 0.660 25033
1968 1 6 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.761 -0.162 25033
1969 1 6 . 1 1 36 36 PRO C C 36 177.390 177.390 177.815 -0.425 25033
1970 1 6 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.123 0.097 25033
1971 1 6 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.276 0.194 25033
1972 1 6 . 1 1 37 37 GLY N N 37 112.033 112.033 111.598 0.435 25033
1973 1 6 . 1 1 37 37 GLY C C 37 169.261 169.261 174.668 -5.407 25033
1974 1 6 . 1 1 37 37 GLY CA C 37 46.457 46.457 45.058 1.399 25033
1975 1 6 . 1 1 37 37 GLY H H 37 9.349 9.349 8.713 0.636 25033
1976 1 6 . 1 1 38 38 GLY N N 38 109.050 109.050 109.843 -0.793 25033
1977 1 6 . 1 1 38 38 GLY C C 38 175.177 175.177 175.094 0.083 25033
1978 1 6 . 1 1 38 38 GLY H H 38 8.756 8.756 8.024 0.732 25033
1979 1 6 . 1 1 39 39 GLY N N 39 107.730 107.730 109.495 -1.765 25033
1980 1 6 . 1 1 39 39 GLY C C 39 173.870 173.870 174.645 -0.775 25033
1981 1 6 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.374 -1.116 25033
1982 1 6 . 1 1 39 39 GLY H H 39 7.725 7.725 8.148 -0.423 25033
1983 1 6 . 1 1 40 40 GLY N N 40 107.183 107.183 109.552 -2.369 25033
1984 1 6 . 1 1 40 40 GLY C C 40 173.067 173.067 173.610 -0.543 25033
1985 1 6 . 1 1 40 40 GLY CA C 40 43.760 43.760 45.379 -1.619 25033
1986 1 6 . 1 1 40 40 GLY H H 40 8.096 8.096 8.412 -0.316 25033
1987 1 6 . 1 1 41 41 GLU N N 41 119.455 119.455 121.392 -1.937 25033
1988 1 6 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.553 -0.375 25033
1989 1 6 . 1 1 41 41 GLU C C 41 175.900 175.900 174.869 1.031 25033
1990 1 6 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.568 0.809 25033
1991 1 6 . 1 1 41 41 GLU CB C 41 30.600 30.600 31.672 -1.072 25033
1992 1 6 . 1 1 41 41 GLU H H 41 8.199 8.199 8.264 -0.065 25033
1993 1 6 . 1 1 42 42 ASP N N 42 119.784 119.784 123.736 -3.952 25033
1994 1 6 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.261 -0.404 25033
1995 1 6 . 1 1 42 42 ASP C C 42 176.474 176.474 175.526 0.948 25033
1996 1 6 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.423 2.018 25033
1997 1 6 . 1 1 42 42 ASP CB C 42 41.488 41.488 42.019 -0.531 25033
1998 1 6 . 1 1 42 42 ASP H H 42 8.277 8.277 8.383 -0.106 25033
1999 1 6 . 1 1 43 43 LEU N N 43 122.515 122.515 122.136 0.379 25033
2000 1 6 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.806 -0.119 25033
2001 1 6 . 1 1 43 43 LEU C C 43 175.759 175.759 176.483 -0.724 25033
2002 1 6 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.911 -0.607 25033
2003 1 6 . 1 1 43 43 LEU CB C 43 45.449 45.449 45.680 -0.231 25033
2004 1 6 . 1 1 43 43 LEU H H 43 9.423 9.423 8.423 1.000 25033
2005 1 6 . 1 1 44 44 PHE N N 44 125.962 125.962 120.555 5.407 25033
2006 1 6 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.705 -0.783 25033
2007 1 6 . 1 1 44 44 PHE C C 44 172.844 172.844 175.971 -3.127 25033
2008 1 6 . 1 1 44 44 PHE CA C 44 57.880 57.880 58.031 -0.151 25033
2009 1 6 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.932 0.418 25033
2010 1 6 . 1 1 44 44 PHE H H 44 8.465 8.465 8.701 -0.236 25033
2011 1 6 . 1 1 45 45 VAL N N 45 123.552 123.552 122.505 1.047 25033
2012 1 6 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.416 0.241 25033
2013 1 6 . 1 1 45 45 VAL C C 45 177.433 177.433 173.264 4.169 25033
2014 1 6 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.872 -2.412 25033
2015 1 6 . 1 1 45 45 VAL CB C 45 34.884 34.884 35.528 -0.644 25033
2016 1 6 . 1 1 45 45 VAL H H 45 7.715 7.715 8.330 -0.615 25033
2017 1 6 . 1 1 46 46 HIS N N 46 127.300 127.300 126.413 0.887 25033
2018 1 6 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.820 0.005 25033
2019 1 6 . 1 1 46 46 HIS C C 46 176.469 176.469 174.020 2.449 25033
2020 1 6 . 1 1 46 46 HIS CA C 46 55.929 55.929 54.324 1.605 25033
2021 1 6 . 1 1 46 46 HIS CB C 46 34.399 34.399 32.716 1.683 25033
2022 1 6 . 1 1 46 46 HIS H H 46 9.104 9.104 8.779 0.325 25033
2023 1 6 . 1 1 47 47 GLN N N 47 125.105 125.105 126.904 -1.799 25033
2024 1 6 . 1 1 47 47 GLN H H 47 8.352 8.352 8.770 -0.418 25033
2025 1 6 . 1 1 48 48 THR HA H 48 4.310 4.310 4.307 0.003 25033
2026 1 6 . 1 1 48 48 THR C C 48 175.568 175.568 174.794 0.774 25033
2027 1 6 . 1 1 48 48 THR CA C 48 64.770 64.770 63.047 1.723 25033
2028 1 6 . 1 1 48 48 THR CB C 48 70.054 70.054 69.589 0.465 25033
2029 1 6 . 1 1 49 49 ASN N N 49 118.142 118.142 118.216 -0.074 25033
2030 1 6 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.887 0.273 25033
2031 1 6 . 1 1 49 49 ASN C C 49 172.914 172.914 173.916 -1.002 25033
2032 1 6 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.128 1.223 25033
2033 1 6 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.623 0.904 25033
2034 1 6 . 1 1 49 49 ASN H H 49 8.452 8.452 8.276 0.176 25033
2035 1 6 . 1 1 50 50 ILE N N 50 119.226 119.226 121.297 -2.071 25033
2036 1 6 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.147 -0.035 25033
2037 1 6 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.498 1.108 25033
2038 1 6 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.504 1.858 25033
2039 1 6 . 1 1 50 50 ILE H H 50 7.354 7.354 7.807 -0.453 25033
2040 1 6 . 1 1 51 51 ASN N N 51 128.460 128.460 123.658 4.802 25033
2041 1 6 . 1 1 51 51 ASN C C 51 174.614 174.614 174.537 0.077 25033
2042 1 6 . 1 1 51 51 ASN H H 51 9.266 9.266 7.882 1.384 25033
2043 1 6 . 1 1 52 52 SER N N 52 117.246 117.246 117.886 -0.640 25033
2044 1 6 . 1 1 52 52 SER HA H 52 4.413 4.413 4.854 -0.441 25033
2045 1 6 . 1 1 52 52 SER C C 52 174.139 174.139 174.546 -0.407 25033
2046 1 6 . 1 1 52 52 SER CA C 52 58.378 58.378 57.303 1.075 25033
2047 1 6 . 1 1 52 52 SER CB C 52 64.371 64.371 64.666 -0.295 25033
2048 1 6 . 1 1 52 52 SER H H 52 7.973 7.973 8.095 -0.122 25033
2049 1 6 . 1 1 53 53 GLU N N 53 123.628 123.628 120.141 3.487 25033
2050 1 6 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.167 0.131 25033
2051 1 6 . 1 1 53 53 GLU C C 53 176.960 176.960 176.605 0.355 25033
2052 1 6 . 1 1 53 53 GLU CA C 53 57.270 57.270 56.322 0.948 25033
2053 1 6 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.820 0.041 25033
2054 1 6 . 1 1 53 53 GLU H H 53 8.641 8.641 8.721 -0.080 25033
2055 1 6 . 1 1 54 54 GLY N N 54 110.282 110.282 108.339 1.943 25033
2056 1 6 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.193 0.407 25033
2057 1 6 . 1 1 54 54 GLY H H 54 8.225 8.225 7.639 0.586 25033
2058 1 6 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.467 0.353 25033
2059 1 6 . 1 1 55 55 PHE C C 55 175.836 175.836 176.316 -0.480 25033
2060 1 6 . 1 1 55 55 PHE CA C 55 52.690 52.690 58.460 -5.770 25033
2061 1 6 . 1 1 55 55 PHE CB C 55 38.095 38.095 39.500 -1.405 25033
2062 1 6 . 1 1 56 56 ARG N N 56 120.907 120.907 124.146 -3.239 25033
2063 1 6 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.651 -0.387 25033
2064 1 6 . 1 1 56 56 ARG C C 56 175.618 175.618 175.415 0.203 25033
2065 1 6 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.094 0.416 25033
2066 1 6 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.849 0.171 25033
2067 1 6 . 1 1 56 56 ARG H H 56 8.153 8.153 8.594 -0.441 25033
2068 1 6 . 1 1 57 57 SER N N 57 123.117 123.117 117.960 5.157 25033
2069 1 6 . 1 1 57 57 SER H H 57 7.834 7.834 8.470 -0.636 25033
2070 1 6 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.659 -0.379 25033
2071 1 6 . 1 1 58 58 LEU C C 58 174.842 174.842 176.905 -2.063 25033
2072 1 6 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.290 -0.530 25033
2073 1 6 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.101 -0.521 25033
2074 1 6 . 1 1 59 59 ARG N N 59 119.557 119.557 123.483 -3.926 25033
2075 1 6 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.506 0.079 25033
2076 1 6 . 1 1 59 59 ARG C C 59 175.256 175.256 175.308 -0.052 25033
2077 1 6 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.098 0.014 25033
2078 1 6 . 1 1 59 59 ARG CB C 59 32.970 32.970 31.615 1.355 25033
2079 1 6 . 1 1 59 59 ARG H H 59 8.529 8.529 8.579 -0.050 25033
2080 1 6 . 1 1 60 60 GLU N N 60 121.597 121.597 120.680 0.917 25033
2081 1 6 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.156 -0.575 25033
2082 1 6 . 1 1 60 60 GLU C C 60 177.281 177.281 176.690 0.591 25033
2083 1 6 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.621 0.680 25033
2084 1 6 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.464 -0.203 25033
2085 1 6 . 1 1 60 60 GLU H H 60 8.691 8.691 8.566 0.125 25033
2086 1 6 . 1 1 61 61 GLY N N 61 113.554 113.554 111.639 1.915 25033
2087 1 6 . 1 1 61 61 GLY C C 61 174.068 174.068 174.438 -0.370 25033
2088 1 6 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.640 0.603 25033
2089 1 6 . 1 1 61 61 GLY H H 61 9.151 9.151 8.820 0.331 25033
2090 1 6 . 1 1 62 62 GLU N N 62 121.639 121.639 122.059 -0.420 25033
2091 1 6 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.297 -0.093 25033
2092 1 6 . 1 1 62 62 GLU C C 62 175.439 175.439 176.315 -0.876 25033
2093 1 6 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.415 0.927 25033
2094 1 6 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.477 0.448 25033
2095 1 6 . 1 1 62 62 GLU H H 62 7.889 7.889 7.617 0.272 25033
2096 1 6 . 1 1 63 63 VAL N N 63 125.003 125.003 126.129 -1.126 25033
2097 1 6 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.713 0.035 25033
2098 1 6 . 1 1 63 63 VAL C C 63 176.639 176.639 175.959 0.680 25033
2099 1 6 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.342 1.289 25033
2100 1 6 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.892 -0.536 25033
2101 1 6 . 1 1 63 63 VAL H H 63 8.477 8.477 8.332 0.145 25033
2102 1 6 . 1 1 64 64 VAL N N 64 120.113 120.113 123.357 -3.244 25033
2103 1 6 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.714 0.290 25033
2104 1 6 . 1 1 64 64 VAL C C 64 173.790 173.790 174.133 -0.343 25033
2105 1 6 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.617 -1.008 25033
2106 1 6 . 1 1 64 64 VAL CB C 64 36.360 36.360 34.581 1.779 25033
2107 1 6 . 1 1 64 64 VAL H H 64 8.686 8.686 8.976 -0.290 25033
2108 1 6 . 1 1 65 65 GLU N N 65 120.433 120.433 121.890 -1.457 25033
2109 1 6 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.314 0.133 25033
2110 1 6 . 1 1 65 65 GLU C C 65 175.584 175.584 175.485 0.099 25033
2111 1 6 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.147 0.243 25033
2112 1 6 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.299 0.704 25033
2113 1 6 . 1 1 65 65 GLU H H 65 9.003 9.003 8.028 0.975 25033
2114 1 6 . 1 1 66 66 PHE N N 66 116.104 116.104 119.839 -3.735 25033
2115 1 6 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.086 -0.025 25033
2116 1 6 . 1 1 66 66 PHE C C 66 173.001 173.001 172.876 0.125 25033
2117 1 6 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.784 0.073 25033
2118 1 6 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.453 -0.021 25033
2119 1 6 . 1 1 66 66 PHE H H 66 8.172 8.172 7.738 0.434 25033
2120 1 6 . 1 1 67 67 GLU N N 67 117.574 117.574 118.900 -1.326 25033
2121 1 6 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.133 -0.261 25033
2122 1 6 . 1 1 67 67 GLU C C 67 175.327 175.327 176.115 -0.788 25033
2123 1 6 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.012 0.629 25033
2124 1 6 . 1 1 67 67 GLU CB C 67 33.020 33.020 32.879 0.141 25033
2125 1 6 . 1 1 67 67 GLU H H 67 8.668 8.668 8.453 0.215 25033
2126 1 6 . 1 1 68 68 VAL N N 68 120.881 120.881 124.461 -3.580 25033
2127 1 6 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.063 0.949 25033
2128 1 6 . 1 1 68 68 VAL C C 68 176.140 176.140 175.640 0.500 25033
2129 1 6 . 1 1 68 68 VAL CA C 68 62.338 62.338 63.249 -0.911 25033
2130 1 6 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.151 1.855 25033
2131 1 6 . 1 1 68 68 VAL H H 68 8.748 8.748 8.742 0.006 25033
2132 1 6 . 1 1 69 69 GLU N N 69 128.110 128.110 129.077 -0.967 25033
2133 1 6 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.596 0.109 25033
2134 1 6 . 1 1 69 69 GLU C C 69 174.573 174.573 174.761 -0.188 25033
2135 1 6 . 1 1 69 69 GLU CA C 69 54.953 54.953 55.109 -0.156 25033
2136 1 6 . 1 1 69 69 GLU CB C 69 34.290 34.290 32.439 1.851 25033
2137 1 6 . 1 1 69 69 GLU H H 69 9.070 9.070 8.635 0.435 25033
2138 1 6 . 1 1 70 70 ALA N N 70 127.944 127.944 130.148 -2.204 25033
2139 1 6 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.132 -0.128 25033
2140 1 6 . 1 1 70 70 ALA C C 70 178.073 178.073 177.143 0.930 25033
2141 1 6 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.890 0.069 25033
2142 1 6 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.270 -0.781 25033
2143 1 6 . 1 1 70 70 ALA H H 70 8.671 8.671 8.680 -0.009 25033
2144 1 6 . 1 1 71 71 GLY N N 71 110.340 110.340 111.740 -1.400 25033
2145 1 6 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.652 0.364 25033
2146 1 6 . 1 1 71 71 GLY H H 71 8.445 8.445 8.192 0.253 25033
2147 1 6 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.388 0.029 25033
2148 1 6 . 1 1 72 72 PRO C C 72 176.835 176.835 176.815 0.020 25033
2149 1 6 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.565 -0.405 25033
2150 1 6 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.658 0.222 25033
2151 1 6 . 1 1 73 73 ASP N N 73 116.498 116.498 117.966 -1.468 25033
2152 1 6 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.569 -0.054 25033
2153 1 6 . 1 1 73 73 ASP C C 73 176.775 176.775 177.317 -0.542 25033
2154 1 6 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.453 -0.906 25033
2155 1 6 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.703 -0.469 25033
2156 1 6 . 1 1 73 73 ASP H H 73 8.248 8.248 8.207 0.041 25033
2157 1 6 . 1 1 74 74 GLY N N 74 107.369 107.369 107.451 -0.082 25033
2158 1 6 . 1 1 74 74 GLY C C 74 174.331 174.331 173.560 0.771 25033
2159 1 6 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.910 0.668 25033
2160 1 6 . 1 1 74 74 GLY H H 74 8.153 8.153 7.644 0.509 25033
2161 1 6 . 1 1 75 75 ARG N N 75 120.942 120.942 119.838 1.104 25033
2162 1 6 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.501 0.041 25033
2163 1 6 . 1 1 75 75 ARG C C 75 176.652 176.652 175.230 1.422 25033
2164 1 6 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.735 -0.077 25033
2165 1 6 . 1 1 75 75 ARG CB C 75 30.909 30.909 30.857 0.052 25033
2166 1 6 . 1 1 75 75 ARG H H 75 7.670 7.670 8.148 -0.478 25033
2167 1 6 . 1 1 76 76 SER N N 76 120.181 120.181 117.264 2.917 25033
2168 1 6 . 1 1 76 76 SER HA H 76 5.035 5.035 5.559 -0.524 25033
2169 1 6 . 1 1 76 76 SER C C 76 172.816 172.816 174.231 -1.415 25033
2170 1 6 . 1 1 76 76 SER CA C 76 59.080 59.080 56.868 2.212 25033
2171 1 6 . 1 1 76 76 SER CB C 76 64.850 64.850 65.929 -1.079 25033
2172 1 6 . 1 1 76 76 SER H H 76 8.808 8.808 8.383 0.425 25033
2173 1 6 . 1 1 77 77 LYS N N 77 121.202 121.202 121.723 -0.521 25033
2174 1 6 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.777 0.397 25033
2175 1 6 . 1 1 77 77 LYS C C 77 173.706 173.706 174.665 -0.959 25033
2176 1 6 . 1 1 77 77 LYS CA C 77 54.599 54.599 55.099 -0.500 25033
2177 1 6 . 1 1 77 77 LYS CB C 77 36.035 36.035 37.341 -1.306 25033
2178 1 6 . 1 1 77 77 LYS H H 77 8.982 8.982 8.756 0.226 25033
2179 1 6 . 1 1 78 78 ALA N N 78 124.064 124.064 125.760 -1.696 25033
2180 1 6 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.657 0.347 25033
2181 1 6 . 1 1 78 78 ALA C C 78 175.979 175.979 176.532 -0.553 25033
2182 1 6 . 1 1 78 78 ALA CA C 78 50.445 50.445 51.513 -1.068 25033
2183 1 6 . 1 1 78 78 ALA CB C 78 20.136 20.136 19.416 0.720 25033
2184 1 6 . 1 1 78 78 ALA H H 78 8.706 8.706 8.711 -0.005 25033
2185 1 6 . 1 1 79 79 VAL N N 79 113.264 113.264 117.867 -4.603 25033
2186 1 6 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.433 0.410 25033
2187 1 6 . 1 1 79 79 VAL C C 79 174.744 174.744 174.398 0.346 25033
2188 1 6 . 1 1 79 79 VAL CA C 79 59.073 59.073 60.467 -1.394 25033
2189 1 6 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.730 -0.134 25033
2190 1 6 . 1 1 79 79 VAL H H 79 9.165 9.165 7.729 1.436 25033
2191 1 6 . 1 1 80 80 ASN N N 80 120.084 120.084 113.951 6.133 25033
2192 1 6 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.367 -0.011 25033
2193 1 6 . 1 1 80 80 ASN C C 80 175.391 175.391 173.849 1.542 25033
2194 1 6 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.658 0.076 25033
2195 1 6 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.662 0.459 25033
2196 1 6 . 1 1 80 80 ASN H H 80 8.923 8.923 8.632 0.291 25033
2197 1 6 . 1 1 81 81 VAL N N 81 119.178 119.178 119.579 -0.401 25033
2198 1 6 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.533 0.214 25033
2199 1 6 . 1 1 81 81 VAL C C 81 176.340 176.340 176.042 0.298 25033
2200 1 6 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.600 0.560 25033
2201 1 6 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.274 0.856 25033
2202 1 6 . 1 1 81 81 VAL H H 81 8.282 8.282 7.704 0.578 25033
2203 1 7 . 1 1 12 12 SER N N 12 116.112 116.112 113.816 2.296 25033
2204 1 7 . 1 1 12 12 SER C C 12 175.271 175.271 174.135 1.136 25033
2205 1 7 . 1 1 12 12 SER CA C 12 58.570 58.570 59.081 -0.511 25033
2206 1 7 . 1 1 12 12 SER CB C 12 63.984 63.984 64.724 -0.740 25033
2207 1 7 . 1 1 12 12 SER H H 12 8.422 8.422 10.458 -2.036 25033
2208 1 7 . 1 1 13 13 GLY N N 13 111.178 111.178 110.694 0.484 25033
2209 1 7 . 1 1 13 13 GLY C C 13 174.238 174.238 174.140 0.098 25033
2210 1 7 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.931 0.589 25033
2211 1 7 . 1 1 13 13 GLY H H 13 8.537 8.537 8.503 0.034 25033
2212 1 7 . 1 1 14 14 GLU N N 14 120.547 120.547 120.375 0.172 25033
2213 1 7 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.545 -0.278 25033
2214 1 7 . 1 1 14 14 GLU C C 14 176.455 176.455 175.399 1.056 25033
2215 1 7 . 1 1 14 14 GLU CA C 14 56.753 56.753 56.242 0.511 25033
2216 1 7 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.749 0.715 25033
2217 1 7 . 1 1 14 14 GLU H H 14 8.285 8.285 8.651 -0.366 25033
2218 1 7 . 1 1 15 15 GLN N N 15 121.185 121.185 120.753 0.432 25033
2219 1 7 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.474 -0.125 25033
2220 1 7 . 1 1 15 15 GLN C C 15 175.494 175.494 175.352 0.142 25033
2221 1 7 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.443 0.227 25033
2222 1 7 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.498 -0.088 25033
2223 1 7 . 1 1 15 15 GLN H H 15 8.444 8.444 8.143 0.301 25033
2224 1 7 . 1 1 16 16 LEU N N 16 123.934 123.934 124.825 -0.891 25033
2225 1 7 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.628 -0.287 25033
2226 1 7 . 1 1 16 16 LEU C C 16 176.942 176.942 175.651 1.291 25033
2227 1 7 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.285 1.219 25033
2228 1 7 . 1 1 16 16 LEU CB C 16 42.519 42.519 42.136 0.383 25033
2229 1 7 . 1 1 16 16 LEU H H 16 8.289 8.289 8.556 -0.267 25033
2230 1 7 . 1 1 17 17 ARG N N 17 122.044 122.044 122.423 -0.379 25033
2231 1 7 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.351 0.113 25033
2232 1 7 . 1 1 17 17 ARG C C 17 175.829 175.829 175.697 0.132 25033
2233 1 7 . 1 1 17 17 ARG CA C 17 55.672 55.672 55.706 -0.034 25033
2234 1 7 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.261 -0.431 25033
2235 1 7 . 1 1 17 17 ARG H H 17 8.216 8.216 8.409 -0.193 25033
2236 1 7 . 1 1 18 18 GLN N N 18 122.488 122.488 124.775 -2.287 25033
2237 1 7 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.493 -0.159 25033
2238 1 7 . 1 1 18 18 GLN C C 18 172.958 172.958 173.472 -0.514 25033
2239 1 7 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.433 0.467 25033
2240 1 7 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.503 0.117 25033
2241 1 7 . 1 1 18 18 GLN H H 18 8.573 8.573 7.859 0.714 25033
2242 1 7 . 1 1 19 19 GLN N N 19 116.301 116.301 120.053 -3.752 25033
2243 1 7 . 1 1 19 19 GLN HA H 19 5.378 5.378 4.924 0.454 25033
2244 1 7 . 1 1 19 19 GLN C C 19 176.902 176.902 174.012 2.890 25033
2245 1 7 . 1 1 19 19 GLN CA C 19 54.215 54.215 53.985 0.230 25033
2246 1 7 . 1 1 19 19 GLN CB C 19 34.638 34.638 32.946 1.692 25033
2247 1 7 . 1 1 19 19 GLN H H 19 8.146 8.146 8.330 -0.184 25033
2248 1 7 . 1 1 20 20 GLY N N 20 109.745 109.745 108.545 1.200 25033
2249 1 7 . 1 1 20 20 GLY C C 20 170.989 170.989 172.971 -1.982 25033
2250 1 7 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.149 1.786 25033
2251 1 7 . 1 1 20 20 GLY H H 20 8.998 8.998 8.007 0.991 25033
2252 1 7 . 1 1 21 21 THR N N 21 112.645 112.645 113.353 -0.708 25033
2253 1 7 . 1 1 21 21 THR HA H 21 5.361 5.361 5.377 -0.016 25033
2254 1 7 . 1 1 21 21 THR C C 21 174.553 174.553 175.269 -0.716 25033
2255 1 7 . 1 1 21 21 THR CA C 21 60.025 60.025 59.776 0.249 25033
2256 1 7 . 1 1 21 21 THR CB C 21 71.720 71.720 71.458 0.262 25033
2257 1 7 . 1 1 21 21 THR H H 21 8.312 8.312 8.024 0.288 25033
2258 1 7 . 1 1 22 22 VAL N N 22 125.915 125.915 120.009 5.906 25033
2259 1 7 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.970 -0.321 25033
2260 1 7 . 1 1 22 22 VAL C C 22 175.553 175.553 178.044 -2.491 25033
2261 1 7 . 1 1 22 22 VAL CA C 22 64.618 64.618 64.948 -0.330 25033
2262 1 7 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.792 -0.171 25033
2263 1 7 . 1 1 22 22 VAL H H 22 9.092 9.092 8.202 0.890 25033
2264 1 7 . 1 1 23 23 LYS N N 23 135.790 135.790 118.399 17.391 25033
2265 1 7 . 1 1 23 23 LYS HA H 23 4.301 4.301 3.980 0.321 25033
2266 1 7 . 1 1 23 23 LYS C C 23 176.301 176.301 176.459 -0.158 25033
2267 1 7 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.480 0.130 25033
2268 1 7 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.198 3.102 25033
2269 1 7 . 1 1 23 23 LYS H H 23 9.276 9.276 8.457 0.819 25033
2270 1 7 . 1 1 24 24 TRP N N 24 111.651 111.651 119.037 -7.386 25033
2271 1 7 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.825 -0.202 25033
2272 1 7 . 1 1 24 24 TRP C C 24 173.628 173.628 174.924 -1.296 25033
2273 1 7 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.556 0.744 25033
2274 1 7 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.835 1.425 25033
2275 1 7 . 1 1 24 24 TRP H H 24 7.455 7.455 7.525 -0.070 25033
2276 1 7 . 1 1 25 25 PHE N N 25 121.305 121.305 119.932 1.373 25033
2277 1 7 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.832 -0.547 25033
2278 1 7 . 1 1 25 25 PHE C C 25 172.354 172.354 174.544 -2.190 25033
2279 1 7 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.247 2.125 25033
2280 1 7 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.093 0.476 25033
2281 1 7 . 1 1 25 25 PHE H H 25 9.074 9.074 7.924 1.150 25033
2282 1 7 . 1 1 26 26 ASN N N 26 126.976 126.976 123.557 3.419 25033
2283 1 7 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.941 -0.129 25033
2284 1 7 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.847 -1.435 25033
2285 1 7 . 1 1 26 26 ASN CB C 26 39.086 39.086 40.970 -1.884 25033
2286 1 7 . 1 1 26 26 ASN H H 26 8.159 8.159 8.231 -0.072 25033
2287 1 7 . 1 1 27 27 ALA N N 27 128.245 128.245 128.736 -0.491 25033
2288 1 7 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.240 -0.119 25033
2289 1 7 . 1 1 27 27 ALA C C 27 179.031 179.031 179.245 -0.214 25033
2290 1 7 . 1 1 27 27 ALA CA C 27 54.425 54.425 54.466 -0.041 25033
2291 1 7 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.741 -0.367 25033
2292 1 7 . 1 1 27 27 ALA H H 27 9.036 9.036 8.848 0.188 25033
2293 1 7 . 1 1 28 28 THR N N 28 113.994 113.994 113.398 0.596 25033
2294 1 7 . 1 1 28 28 THR HA H 28 4.068 4.068 4.059 0.009 25033
2295 1 7 . 1 1 28 28 THR C C 28 176.084 176.084 176.318 -0.234 25033
2296 1 7 . 1 1 28 28 THR CA C 28 65.820 65.820 64.925 0.895 25033
2297 1 7 . 1 1 28 28 THR CB C 28 68.291 68.291 68.454 -0.163 25033
2298 1 7 . 1 1 28 28 THR H H 28 8.065 8.065 8.216 -0.151 25033
2299 1 7 . 1 1 29 29 LYS N N 29 118.922 118.922 119.862 -0.940 25033
2300 1 7 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.291 -0.035 25033
2301 1 7 . 1 1 29 29 LYS C C 29 177.201 177.201 177.347 -0.146 25033
2302 1 7 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.731 0.157 25033
2303 1 7 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.520 1.220 25033
2304 1 7 . 1 1 29 29 LYS H H 29 7.446 7.446 8.057 -0.611 25033
2305 1 7 . 1 1 30 30 GLY N N 30 107.601 107.601 106.787 0.814 25033
2306 1 7 . 1 1 30 30 GLY C C 30 172.004 172.004 173.304 -1.300 25033
2307 1 7 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.278 1.127 25033
2308 1 7 . 1 1 30 30 GLY H H 30 8.115 8.115 7.716 0.399 25033
2309 1 7 . 1 1 31 31 PHE N N 31 112.488 112.488 118.955 -6.467 25033
2310 1 7 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.834 0.173 25033
2311 1 7 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.100 -1.822 25033
2312 1 7 . 1 1 31 31 PHE CB C 31 42.388 42.388 40.810 1.577 25033
2313 1 7 . 1 1 31 31 PHE H H 31 6.594 6.594 7.320 -0.726 25033
2314 1 7 . 1 1 32 32 GLY N N 32 105.986 105.986 109.498 -3.512 25033
2315 1 7 . 1 1 32 32 GLY C C 32 170.292 170.292 172.147 -1.855 25033
2316 1 7 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.604 1.765 25033
2317 1 7 . 1 1 32 32 GLY H H 32 8.144 8.144 7.497 0.647 25033
2318 1 7 . 1 1 33 33 PHE N N 33 115.319 115.319 116.686 -1.367 25033
2319 1 7 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.311 0.152 25033
2320 1 7 . 1 1 33 33 PHE C C 33 175.037 175.037 174.970 0.067 25033
2321 1 7 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.579 -1.284 25033
2322 1 7 . 1 1 33 33 PHE CB C 33 44.792 44.792 43.847 0.945 25033
2323 1 7 . 1 1 33 33 PHE H H 33 7.971 7.971 8.474 -0.503 25033
2324 1 7 . 1 1 34 34 ILE N N 34 122.140 122.140 123.018 -0.878 25033
2325 1 7 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.685 -0.368 25033
2326 1 7 . 1 1 34 34 ILE C C 34 174.526 174.526 175.493 -0.967 25033
2327 1 7 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.698 0.099 25033
2328 1 7 . 1 1 34 34 ILE CB C 34 42.583 42.583 39.741 2.842 25033
2329 1 7 . 1 1 34 34 ILE H H 34 9.511 9.511 8.506 1.005 25033
2330 1 7 . 1 1 35 35 THR N N 35 126.580 126.580 119.433 7.147 25033
2331 1 7 . 1 1 35 35 THR HA H 35 5.143 5.143 5.351 -0.208 25033
2332 1 7 . 1 1 35 35 THR CA C 35 59.330 59.330 58.539 0.791 25033
2333 1 7 . 1 1 35 35 THR CB C 35 70.258 70.258 68.710 1.548 25033
2334 1 7 . 1 1 35 35 THR H H 35 9.416 9.416 8.696 0.720 25033
2335 1 7 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.548 0.051 25033
2336 1 7 . 1 1 36 36 PRO C C 36 177.390 177.390 177.817 -0.427 25033
2337 1 7 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.081 0.139 25033
2338 1 7 . 1 1 36 36 PRO CB C 36 32.470 32.470 31.576 0.894 25033
2339 1 7 . 1 1 37 37 GLY N N 37 112.033 112.033 113.923 -1.890 25033
2340 1 7 . 1 1 37 37 GLY C C 37 169.261 169.261 174.435 -5.174 25033
2341 1 7 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.873 1.583 25033
2342 1 7 . 1 1 37 37 GLY H H 37 9.349 9.349 8.599 0.750 25033
2343 1 7 . 1 1 38 38 GLY N N 38 109.050 109.050 109.350 -0.300 25033
2344 1 7 . 1 1 38 38 GLY C C 38 175.177 175.177 175.166 0.011 25033
2345 1 7 . 1 1 38 38 GLY H H 38 8.756 8.756 8.103 0.653 25033
2346 1 7 . 1 1 39 39 GLY N N 39 107.730 107.730 109.418 -1.688 25033
2347 1 7 . 1 1 39 39 GLY C C 39 173.870 173.870 174.354 -0.484 25033
2348 1 7 . 1 1 39 39 GLY CA C 39 44.258 44.258 44.933 -0.675 25033
2349 1 7 . 1 1 39 39 GLY H H 39 7.725 7.725 8.331 -0.606 25033
2350 1 7 . 1 1 40 40 GLY N N 40 107.183 107.183 109.496 -2.313 25033
2351 1 7 . 1 1 40 40 GLY C C 40 173.067 173.067 173.687 -0.620 25033
2352 1 7 . 1 1 40 40 GLY CA C 40 43.760 43.760 44.518 -0.758 25033
2353 1 7 . 1 1 40 40 GLY H H 40 8.096 8.096 8.405 -0.309 25033
2354 1 7 . 1 1 41 41 GLU N N 41 119.455 119.455 121.068 -1.613 25033
2355 1 7 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.594 -0.416 25033
2356 1 7 . 1 1 41 41 GLU C C 41 175.900 175.900 174.911 0.989 25033
2357 1 7 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.100 1.277 25033
2358 1 7 . 1 1 41 41 GLU CB C 41 30.600 30.600 31.513 -0.913 25033
2359 1 7 . 1 1 41 41 GLU H H 41 8.199 8.199 8.099 0.100 25033
2360 1 7 . 1 1 42 42 ASP N N 42 119.784 119.784 121.826 -2.042 25033
2361 1 7 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.246 -0.389 25033
2362 1 7 . 1 1 42 42 ASP C C 42 176.474 176.474 175.646 0.828 25033
2363 1 7 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.010 2.432 25033
2364 1 7 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.899 -0.411 25033
2365 1 7 . 1 1 42 42 ASP H H 42 8.277 8.277 8.287 -0.010 25033
2366 1 7 . 1 1 43 43 LEU N N 43 122.515 122.515 122.042 0.473 25033
2367 1 7 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.549 0.138 25033
2368 1 7 . 1 1 43 43 LEU C C 43 175.759 175.759 176.469 -0.710 25033
2369 1 7 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.559 -0.255 25033
2370 1 7 . 1 1 43 43 LEU CB C 43 45.449 45.449 45.578 -0.129 25033
2371 1 7 . 1 1 43 43 LEU H H 43 9.423 9.423 8.349 1.074 25033
2372 1 7 . 1 1 44 44 PHE N N 44 125.962 125.962 120.727 5.235 25033
2373 1 7 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.474 -0.552 25033
2374 1 7 . 1 1 44 44 PHE C C 44 172.844 172.844 175.796 -2.952 25033
2375 1 7 . 1 1 44 44 PHE CA C 44 57.880 57.880 57.804 0.076 25033
2376 1 7 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.242 1.108 25033
2377 1 7 . 1 1 44 44 PHE H H 44 8.465 8.465 8.423 0.042 25033
2378 1 7 . 1 1 45 45 VAL N N 45 123.552 123.552 124.715 -1.163 25033
2379 1 7 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.503 0.154 25033
2380 1 7 . 1 1 45 45 VAL C C 45 177.433 177.433 173.564 3.869 25033
2381 1 7 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.349 -1.889 25033
2382 1 7 . 1 1 45 45 VAL CB C 45 34.884 34.884 34.507 0.377 25033
2383 1 7 . 1 1 45 45 VAL H H 45 7.715 7.715 8.292 -0.577 25033
2384 1 7 . 1 1 46 46 HIS N N 46 127.300 127.300 127.184 0.116 25033
2385 1 7 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.729 0.096 25033
2386 1 7 . 1 1 46 46 HIS C C 46 176.469 176.469 174.084 2.385 25033
2387 1 7 . 1 1 46 46 HIS CA C 46 55.929 55.929 53.664 2.265 25033
2388 1 7 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.474 2.925 25033
2389 1 7 . 1 1 46 46 HIS H H 46 9.104 9.104 8.587 0.517 25033
2390 1 7 . 1 1 47 47 GLN N N 47 125.105 125.105 126.192 -1.087 25033
2391 1 7 . 1 1 47 47 GLN H H 47 8.352 8.352 8.708 -0.356 25033
2392 1 7 . 1 1 48 48 THR HA H 48 4.310 4.310 4.143 0.167 25033
2393 1 7 . 1 1 48 48 THR C C 48 175.568 175.568 174.820 0.748 25033
2394 1 7 . 1 1 48 48 THR CA C 48 64.770 64.770 63.016 1.754 25033
2395 1 7 . 1 1 48 48 THR CB C 48 70.054 70.054 69.451 0.604 25033
2396 1 7 . 1 1 49 49 ASN N N 49 118.142 118.142 119.674 -1.532 25033
2397 1 7 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.806 0.354 25033
2398 1 7 . 1 1 49 49 ASN C C 49 172.914 172.914 173.595 -0.681 25033
2399 1 7 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.212 1.139 25033
2400 1 7 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.548 0.979 25033
2401 1 7 . 1 1 49 49 ASN H H 49 8.452 8.452 8.453 -0.001 25033
2402 1 7 . 1 1 50 50 ILE N N 50 119.226 119.226 121.144 -1.918 25033
2403 1 7 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.149 -0.037 25033
2404 1 7 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.610 0.996 25033
2405 1 7 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.324 2.038 25033
2406 1 7 . 1 1 50 50 ILE H H 50 7.354 7.354 7.855 -0.501 25033
2407 1 7 . 1 1 51 51 ASN N N 51 128.460 128.460 124.102 4.358 25033
2408 1 7 . 1 1 51 51 ASN C C 51 174.614 174.614 174.210 0.404 25033
2409 1 7 . 1 1 51 51 ASN H H 51 9.266 9.266 7.964 1.302 25033
2410 1 7 . 1 1 52 52 SER N N 52 117.246 117.246 117.637 -0.391 25033
2411 1 7 . 1 1 52 52 SER HA H 52 4.413 4.413 4.745 -0.332 25033
2412 1 7 . 1 1 52 52 SER C C 52 174.139 174.139 174.685 -0.546 25033
2413 1 7 . 1 1 52 52 SER CA C 52 58.378 58.378 57.330 1.048 25033
2414 1 7 . 1 1 52 52 SER CB C 52 64.371 64.371 65.546 -1.175 25033
2415 1 7 . 1 1 52 52 SER H H 52 7.973 7.973 8.455 -0.482 25033
2416 1 7 . 1 1 53 53 GLU N N 53 123.628 123.628 121.532 2.096 25033
2417 1 7 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.267 0.031 25033
2418 1 7 . 1 1 53 53 GLU C C 53 176.960 176.960 176.391 0.569 25033
2419 1 7 . 1 1 53 53 GLU CA C 53 57.270 57.270 57.608 -0.339 25033
2420 1 7 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.881 -0.020 25033
2421 1 7 . 1 1 53 53 GLU H H 53 8.641 8.641 8.603 0.038 25033
2422 1 7 . 1 1 54 54 GLY N N 54 110.282 110.282 107.279 3.003 25033
2423 1 7 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.689 -0.089 25033
2424 1 7 . 1 1 54 54 GLY H H 54 8.225 8.225 7.738 0.487 25033
2425 1 7 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.703 0.117 25033
2426 1 7 . 1 1 55 55 PHE C C 55 175.836 175.836 174.995 0.841 25033
2427 1 7 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.380 -4.690 25033
2428 1 7 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.117 -3.022 25033
2429 1 7 . 1 1 56 56 ARG N N 56 120.907 120.907 121.476 -0.569 25033
2430 1 7 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.663 -0.399 25033
2431 1 7 . 1 1 56 56 ARG C C 56 175.618 175.618 175.912 -0.294 25033
2432 1 7 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.717 -0.207 25033
2433 1 7 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.489 0.531 25033
2434 1 7 . 1 1 56 56 ARG H H 56 8.153 8.153 8.674 -0.521 25033
2435 1 7 . 1 1 57 57 SER N N 57 123.117 123.117 119.609 3.508 25033
2436 1 7 . 1 1 57 57 SER H H 57 7.834 7.834 8.533 -0.699 25033
2437 1 7 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.672 -0.392 25033
2438 1 7 . 1 1 58 58 LEU C C 58 174.842 174.842 176.282 -1.440 25033
2439 1 7 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.617 -0.857 25033
2440 1 7 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.874 -1.294 25033
2441 1 7 . 1 1 59 59 ARG N N 59 119.557 119.557 121.340 -1.783 25033
2442 1 7 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.568 0.017 25033
2443 1 7 . 1 1 59 59 ARG C C 59 175.256 175.256 175.227 0.029 25033
2444 1 7 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.543 -0.431 25033
2445 1 7 . 1 1 59 59 ARG CB C 59 32.970 32.970 32.477 0.492 25033
2446 1 7 . 1 1 59 59 ARG H H 59 8.529 8.529 8.507 0.022 25033
2447 1 7 . 1 1 60 60 GLU N N 60 121.597 121.597 120.142 1.455 25033
2448 1 7 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.163 -0.582 25033
2449 1 7 . 1 1 60 60 GLU C C 60 177.281 177.281 176.786 0.495 25033
2450 1 7 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.621 0.680 25033
2451 1 7 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.387 -0.126 25033
2452 1 7 . 1 1 60 60 GLU H H 60 8.691 8.691 8.583 0.108 25033
2453 1 7 . 1 1 61 61 GLY N N 61 113.554 113.554 111.789 1.765 25033
2454 1 7 . 1 1 61 61 GLY C C 61 174.068 174.068 174.571 -0.503 25033
2455 1 7 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.658 0.585 25033
2456 1 7 . 1 1 61 61 GLY H H 61 9.151 9.151 8.815 0.336 25033
2457 1 7 . 1 1 62 62 GLU N N 62 121.639 121.639 122.203 -0.564 25033
2458 1 7 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.228 -0.024 25033
2459 1 7 . 1 1 62 62 GLU C C 62 175.439 175.439 176.005 -0.566 25033
2460 1 7 . 1 1 62 62 GLU CA C 62 57.342 57.342 57.166 0.176 25033
2461 1 7 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.592 0.333 25033
2462 1 7 . 1 1 62 62 GLU H H 62 7.889 7.889 7.617 0.272 25033
2463 1 7 . 1 1 63 63 VAL N N 63 125.003 125.003 124.995 0.008 25033
2464 1 7 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.917 -0.169 25033
2465 1 7 . 1 1 63 63 VAL C C 63 176.639 176.639 175.922 0.717 25033
2466 1 7 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.546 1.085 25033
2467 1 7 . 1 1 63 63 VAL CB C 63 32.357 32.357 33.613 -1.256 25033
2468 1 7 . 1 1 63 63 VAL H H 63 8.477 8.477 8.212 0.265 25033
2469 1 7 . 1 1 64 64 VAL N N 64 120.113 120.113 124.127 -4.014 25033
2470 1 7 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.751 0.253 25033
2471 1 7 . 1 1 64 64 VAL C C 64 173.790 173.790 174.309 -0.519 25033
2472 1 7 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.687 -1.078 25033
2473 1 7 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.411 0.949 25033
2474 1 7 . 1 1 64 64 VAL H H 64 8.686 8.686 9.074 -0.388 25033
2475 1 7 . 1 1 65 65 GLU N N 65 120.433 120.433 119.119 1.314 25033
2476 1 7 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.393 0.054 25033
2477 1 7 . 1 1 65 65 GLU C C 65 175.584 175.584 175.185 0.399 25033
2478 1 7 . 1 1 65 65 GLU CA C 65 54.390 54.390 55.240 -0.851 25033
2479 1 7 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.224 0.779 25033
2480 1 7 . 1 1 65 65 GLU H H 65 9.003 9.003 8.325 0.678 25033
2481 1 7 . 1 1 66 66 PHE N N 66 116.104 116.104 118.745 -2.641 25033
2482 1 7 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.033 0.028 25033
2483 1 7 . 1 1 66 66 PHE C C 66 173.001 173.001 172.730 0.271 25033
2484 1 7 . 1 1 66 66 PHE CA C 66 56.857 56.857 57.119 -0.262 25033
2485 1 7 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.385 0.047 25033
2486 1 7 . 1 1 66 66 PHE H H 66 8.172 8.172 8.005 0.167 25033
2487 1 7 . 1 1 67 67 GLU N N 67 117.574 117.574 118.325 -0.751 25033
2488 1 7 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.195 -0.323 25033
2489 1 7 . 1 1 67 67 GLU C C 67 175.327 175.327 175.957 -0.630 25033
2490 1 7 . 1 1 67 67 GLU CA C 67 54.641 54.641 53.909 0.732 25033
2491 1 7 . 1 1 67 67 GLU CB C 67 33.020 33.020 32.890 0.130 25033
2492 1 7 . 1 1 67 67 GLU H H 67 8.668 8.668 8.713 -0.045 25033
2493 1 7 . 1 1 68 68 VAL N N 68 120.881 120.881 122.462 -1.581 25033
2494 1 7 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.063 0.949 25033
2495 1 7 . 1 1 68 68 VAL C C 68 176.140 176.140 175.858 0.282 25033
2496 1 7 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.598 -0.260 25033
2497 1 7 . 1 1 68 68 VAL CB C 68 34.006 34.006 31.341 2.665 25033
2498 1 7 . 1 1 68 68 VAL H H 68 8.748 8.748 8.603 0.145 25033
2499 1 7 . 1 1 69 69 GLU N N 69 128.110 128.110 128.614 -0.504 25033
2500 1 7 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.579 0.126 25033
2501 1 7 . 1 1 69 69 GLU C C 69 174.573 174.573 175.144 -0.571 25033
2502 1 7 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.920 0.033 25033
2503 1 7 . 1 1 69 69 GLU CB C 69 34.290 34.290 32.637 1.653 25033
2504 1 7 . 1 1 69 69 GLU H H 69 9.070 9.070 8.821 0.249 25033
2505 1 7 . 1 1 70 70 ALA N N 70 127.944 127.944 129.873 -1.929 25033
2506 1 7 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.274 -0.270 25033
2507 1 7 . 1 1 70 70 ALA C C 70 178.073 178.073 177.396 0.677 25033
2508 1 7 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.888 0.071 25033
2509 1 7 . 1 1 70 70 ALA CB C 70 19.489 19.489 19.899 -0.410 25033
2510 1 7 . 1 1 70 70 ALA H H 70 8.671 8.671 8.623 0.048 25033
2511 1 7 . 1 1 71 71 GLY N N 71 110.340 110.340 111.541 -1.201 25033
2512 1 7 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.665 0.351 25033
2513 1 7 . 1 1 71 71 GLY H H 71 8.445 8.445 7.964 0.481 25033
2514 1 7 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.400 0.017 25033
2515 1 7 . 1 1 72 72 PRO C C 72 176.835 176.835 176.656 0.179 25033
2516 1 7 . 1 1 72 72 PRO CA C 72 64.160 64.160 63.932 0.228 25033
2517 1 7 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.837 0.043 25033
2518 1 7 . 1 1 73 73 ASP N N 73 116.498 116.498 116.824 -0.326 25033
2519 1 7 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.583 -0.068 25033
2520 1 7 . 1 1 73 73 ASP C C 73 176.775 176.775 177.087 -0.312 25033
2521 1 7 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.505 -0.958 25033
2522 1 7 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.757 -0.523 25033
2523 1 7 . 1 1 73 73 ASP H H 73 8.248 8.248 8.442 -0.194 25033
2524 1 7 . 1 1 74 74 GLY N N 74 107.369 107.369 108.088 -0.719 25033
2525 1 7 . 1 1 74 74 GLY C C 74 174.331 174.331 173.694 0.637 25033
2526 1 7 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.896 0.682 25033
2527 1 7 . 1 1 74 74 GLY H H 74 8.153 8.153 7.671 0.482 25033
2528 1 7 . 1 1 75 75 ARG N N 75 120.942 120.942 120.300 0.642 25033
2529 1 7 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.387 0.155 25033
2530 1 7 . 1 1 75 75 ARG C C 75 176.652 176.652 175.202 1.450 25033
2531 1 7 . 1 1 75 75 ARG CA C 75 55.658 55.658 56.190 -0.532 25033
2532 1 7 . 1 1 75 75 ARG CB C 75 30.909 30.909 30.747 0.162 25033
2533 1 7 . 1 1 75 75 ARG H H 75 7.670 7.670 8.059 -0.389 25033
2534 1 7 . 1 1 76 76 SER N N 76 120.181 120.181 116.172 4.009 25033
2535 1 7 . 1 1 76 76 SER HA H 76 5.035 5.035 5.316 -0.281 25033
2536 1 7 . 1 1 76 76 SER C C 76 172.816 172.816 174.212 -1.396 25033
2537 1 7 . 1 1 76 76 SER CA C 76 59.080 59.080 56.900 2.180 25033
2538 1 7 . 1 1 76 76 SER CB C 76 64.850 64.850 65.437 -0.587 25033
2539 1 7 . 1 1 76 76 SER H H 76 8.808 8.808 8.424 0.384 25033
2540 1 7 . 1 1 77 77 LYS N N 77 121.202 121.202 123.003 -1.801 25033
2541 1 7 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.709 0.465 25033
2542 1 7 . 1 1 77 77 LYS C C 77 173.706 173.706 174.351 -0.645 25033
2543 1 7 . 1 1 77 77 LYS CA C 77 54.599 54.599 55.955 -1.355 25033
2544 1 7 . 1 1 77 77 LYS CB C 77 36.035 36.035 37.257 -1.222 25033
2545 1 7 . 1 1 77 77 LYS H H 77 8.982 8.982 8.602 0.380 25033
2546 1 7 . 1 1 78 78 ALA N N 78 124.064 124.064 127.605 -3.541 25033
2547 1 7 . 1 1 78 78 ALA HA H 78 5.004 5.004 5.036 -0.032 25033
2548 1 7 . 1 1 78 78 ALA C C 78 175.979 175.979 176.220 -0.241 25033
2549 1 7 . 1 1 78 78 ALA CA C 78 50.445 50.445 51.001 -0.556 25033
2550 1 7 . 1 1 78 78 ALA CB C 78 20.136 20.136 20.192 -0.056 25033
2551 1 7 . 1 1 78 78 ALA H H 78 8.706 8.706 8.521 0.185 25033
2552 1 7 . 1 1 79 79 VAL N N 79 113.264 113.264 118.049 -4.785 25033
2553 1 7 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.382 0.461 25033
2554 1 7 . 1 1 79 79 VAL C C 79 174.744 174.744 174.813 -0.069 25033
2555 1 7 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.506 -0.433 25033
2556 1 7 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.558 0.038 25033
2557 1 7 . 1 1 79 79 VAL H H 79 9.165 9.165 7.717 1.448 25033
2558 1 7 . 1 1 80 80 ASN N N 80 120.084 120.084 116.277 3.807 25033
2559 1 7 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.313 0.043 25033
2560 1 7 . 1 1 80 80 ASN C C 80 175.391 175.391 173.864 1.527 25033
2561 1 7 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.830 -0.096 25033
2562 1 7 . 1 1 80 80 ASN CB C 80 37.121 37.121 37.687 -0.566 25033
2563 1 7 . 1 1 80 80 ASN H H 80 8.923 8.923 8.481 0.442 25033
2564 1 7 . 1 1 81 81 VAL N N 81 119.178 119.178 118.365 0.813 25033
2565 1 7 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.599 0.148 25033
2566 1 7 . 1 1 81 81 VAL C C 81 176.340 176.340 177.352 -1.012 25033
2567 1 7 . 1 1 81 81 VAL CA C 81 63.160 63.160 61.979 1.181 25033
2568 1 7 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.529 0.601 25033
2569 1 7 . 1 1 81 81 VAL H H 81 8.282 8.282 7.843 0.439 25033
2570 1 8 . 1 1 12 12 SER N N 12 116.112 116.112 116.150 -0.038 25033
2571 1 8 . 1 1 12 12 SER C C 12 175.271 175.271 174.346 0.925 25033
2572 1 8 . 1 1 12 12 SER CA C 12 58.570 58.570 58.358 0.212 25033
2573 1 8 . 1 1 12 12 SER CB C 12 63.984 63.984 65.655 -1.671 25033
2574 1 8 . 1 1 12 12 SER H H 12 8.422 8.422 8.124 0.298 25033
2575 1 8 . 1 1 13 13 GLY N N 13 111.178 111.178 111.544 -0.366 25033
2576 1 8 . 1 1 13 13 GLY C C 13 174.238 174.238 174.077 0.161 25033
2577 1 8 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.927 0.593 25033
2578 1 8 . 1 1 13 13 GLY H H 13 8.537 8.537 8.584 -0.047 25033
2579 1 8 . 1 1 14 14 GLU N N 14 120.547 120.547 121.357 -0.810 25033
2580 1 8 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.452 -0.185 25033
2581 1 8 . 1 1 14 14 GLU C C 14 176.455 176.455 176.200 0.255 25033
2582 1 8 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.547 1.206 25033
2583 1 8 . 1 1 14 14 GLU CB C 14 30.464 30.464 28.304 2.160 25033
2584 1 8 . 1 1 14 14 GLU H H 14 8.285 8.285 8.492 -0.207 25033
2585 1 8 . 1 1 15 15 GLN N N 15 121.185 121.185 119.084 2.101 25033
2586 1 8 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.368 -0.019 25033
2587 1 8 . 1 1 15 15 GLN C C 15 175.494 175.494 175.867 -0.373 25033
2588 1 8 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.739 -0.069 25033
2589 1 8 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.630 -0.220 25033
2590 1 8 . 1 1 15 15 GLN H H 15 8.444 8.444 7.686 0.758 25033
2591 1 8 . 1 1 16 16 LEU N N 16 123.934 123.934 121.955 1.979 25033
2592 1 8 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.467 -0.126 25033
2593 1 8 . 1 1 16 16 LEU C C 16 176.942 176.942 176.089 0.853 25033
2594 1 8 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.253 1.251 25033
2595 1 8 . 1 1 16 16 LEU CB C 16 42.519 42.519 43.952 -1.433 25033
2596 1 8 . 1 1 16 16 LEU H H 16 8.289 8.289 8.373 -0.084 25033
2597 1 8 . 1 1 17 17 ARG N N 17 122.044 122.044 123.702 -1.658 25033
2598 1 8 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.082 0.382 25033
2599 1 8 . 1 1 17 17 ARG C C 17 175.829 175.829 175.662 0.167 25033
2600 1 8 . 1 1 17 17 ARG CA C 17 55.672 55.672 56.987 -1.315 25033
2601 1 8 . 1 1 17 17 ARG CB C 17 29.830 29.830 29.894 -0.064 25033
2602 1 8 . 1 1 17 17 ARG H H 17 8.216 8.216 8.472 -0.256 25033
2603 1 8 . 1 1 18 18 GLN N N 18 122.488 122.488 124.904 -2.416 25033
2604 1 8 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.457 -0.123 25033
2605 1 8 . 1 1 18 18 GLN C C 18 172.958 172.958 173.453 -0.495 25033
2606 1 8 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.242 0.658 25033
2607 1 8 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.358 0.262 25033
2608 1 8 . 1 1 18 18 GLN H H 18 8.573 8.573 7.757 0.816 25033
2609 1 8 . 1 1 19 19 GLN N N 19 116.301 116.301 120.610 -4.309 25033
2610 1 8 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.308 0.070 25033
2611 1 8 . 1 1 19 19 GLN C C 19 176.902 176.902 175.388 1.514 25033
2612 1 8 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.341 -0.126 25033
2613 1 8 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.212 1.426 25033
2614 1 8 . 1 1 19 19 GLN H H 19 8.146 8.146 8.331 -0.185 25033
2615 1 8 . 1 1 20 20 GLY N N 20 109.745 109.745 109.432 0.313 25033
2616 1 8 . 1 1 20 20 GLY C C 20 170.989 170.989 172.274 -1.285 25033
2617 1 8 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.420 1.515 25033
2618 1 8 . 1 1 20 20 GLY H H 20 8.998 8.998 8.027 0.971 25033
2619 1 8 . 1 1 21 21 THR N N 21 112.645 112.645 114.533 -1.888 25033
2620 1 8 . 1 1 21 21 THR HA H 21 5.361 5.361 5.038 0.323 25033
2621 1 8 . 1 1 21 21 THR C C 21 174.553 174.553 175.738 -1.185 25033
2622 1 8 . 1 1 21 21 THR CA C 21 60.025 60.025 60.066 -0.041 25033
2623 1 8 . 1 1 21 21 THR CB C 21 71.720 71.720 71.390 0.330 25033
2624 1 8 . 1 1 21 21 THR H H 21 8.312 8.312 8.302 0.010 25033
2625 1 8 . 1 1 22 22 VAL N N 22 125.915 125.915 121.382 4.533 25033
2626 1 8 . 1 1 22 22 VAL HA H 22 3.649 3.649 4.012 -0.363 25033
2627 1 8 . 1 1 22 22 VAL C C 22 175.553 175.553 177.946 -2.393 25033
2628 1 8 . 1 1 22 22 VAL CA C 22 64.618 64.618 63.492 1.126 25033
2629 1 8 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.485 0.136 25033
2630 1 8 . 1 1 22 22 VAL H H 22 9.092 9.092 8.427 0.665 25033
2631 1 8 . 1 1 23 23 LYS N N 23 135.790 135.790 121.264 14.526 25033
2632 1 8 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.064 0.237 25033
2633 1 8 . 1 1 23 23 LYS C C 23 176.301 176.301 176.536 -0.235 25033
2634 1 8 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.953 -0.343 25033
2635 1 8 . 1 1 23 23 LYS CB C 23 34.300 34.300 32.085 2.215 25033
2636 1 8 . 1 1 23 23 LYS H H 23 9.276 9.276 8.589 0.687 25033
2637 1 8 . 1 1 24 24 TRP N N 24 111.651 111.651 117.961 -6.310 25033
2638 1 8 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.814 -0.191 25033
2639 1 8 . 1 1 24 24 TRP C C 24 173.628 173.628 174.938 -1.310 25033
2640 1 8 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.732 0.568 25033
2641 1 8 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.234 2.026 25033
2642 1 8 . 1 1 24 24 TRP H H 24 7.455 7.455 7.703 -0.248 25033
2643 1 8 . 1 1 25 25 PHE N N 25 121.305 121.305 120.144 1.161 25033
2644 1 8 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.799 -0.514 25033
2645 1 8 . 1 1 25 25 PHE C C 25 172.354 172.354 174.470 -2.116 25033
2646 1 8 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.157 2.215 25033
2647 1 8 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.514 0.056 25033
2648 1 8 . 1 1 25 25 PHE H H 25 9.074 9.074 8.098 0.976 25033
2649 1 8 . 1 1 26 26 ASN N N 26 126.976 126.976 123.998 2.978 25033
2650 1 8 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.952 -0.140 25033
2651 1 8 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.278 -0.866 25033
2652 1 8 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.553 -0.467 25033
2653 1 8 . 1 1 26 26 ASN H H 26 8.159 8.159 8.157 0.002 25033
2654 1 8 . 1 1 27 27 ALA N N 27 128.245 128.245 126.549 1.696 25033
2655 1 8 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.104 0.017 25033
2656 1 8 . 1 1 27 27 ALA C C 27 179.031 179.031 178.715 0.316 25033
2657 1 8 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.285 -0.860 25033
2658 1 8 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.856 -0.482 25033
2659 1 8 . 1 1 27 27 ALA H H 27 9.036 9.036 8.678 0.358 25033
2660 1 8 . 1 1 28 28 THR N N 28 113.994 113.994 113.802 0.192 25033
2661 1 8 . 1 1 28 28 THR HA H 28 4.068 4.068 4.017 0.051 25033
2662 1 8 . 1 1 28 28 THR C C 28 176.084 176.084 176.097 -0.013 25033
2663 1 8 . 1 1 28 28 THR CA C 28 65.820 65.820 64.943 0.877 25033
2664 1 8 . 1 1 28 28 THR CB C 28 68.291 68.291 68.167 0.124 25033
2665 1 8 . 1 1 28 28 THR H H 28 8.065 8.065 8.513 -0.448 25033
2666 1 8 . 1 1 29 29 LYS N N 29 118.922 118.922 119.836 -0.914 25033
2667 1 8 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.306 -0.050 25033
2668 1 8 . 1 1 29 29 LYS C C 29 177.201 177.201 177.499 -0.298 25033
2669 1 8 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.554 0.334 25033
2670 1 8 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.473 1.267 25033
2671 1 8 . 1 1 29 29 LYS H H 29 7.446 7.446 8.017 -0.571 25033
2672 1 8 . 1 1 30 30 GLY N N 30 107.601 107.601 106.915 0.686 25033
2673 1 8 . 1 1 30 30 GLY C C 30 172.004 172.004 173.267 -1.263 25033
2674 1 8 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.061 1.343 25033
2675 1 8 . 1 1 30 30 GLY H H 30 8.115 8.115 7.773 0.342 25033
2676 1 8 . 1 1 31 31 PHE N N 31 112.488 112.488 119.054 -6.566 25033
2677 1 8 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.776 0.231 25033
2678 1 8 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.199 -1.921 25033
2679 1 8 . 1 1 31 31 PHE CB C 31 42.388 42.388 41.106 1.282 25033
2680 1 8 . 1 1 31 31 PHE H H 31 6.594 6.594 7.640 -1.046 25033
2681 1 8 . 1 1 32 32 GLY N N 32 105.986 105.986 109.270 -3.284 25033
2682 1 8 . 1 1 32 32 GLY C C 32 170.292 170.292 171.599 -1.307 25033
2683 1 8 . 1 1 32 32 GLY CA C 32 45.369 45.369 42.912 2.457 25033
2684 1 8 . 1 1 32 32 GLY H H 32 8.144 8.144 7.991 0.153 25033
2685 1 8 . 1 1 33 33 PHE N N 33 115.319 115.319 116.067 -0.748 25033
2686 1 8 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.177 0.286 25033
2687 1 8 . 1 1 33 33 PHE C C 33 175.037 175.037 175.099 -0.062 25033
2688 1 8 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.386 -1.091 25033
2689 1 8 . 1 1 33 33 PHE CB C 33 44.792 44.792 43.911 0.881 25033
2690 1 8 . 1 1 33 33 PHE H H 33 7.971 7.971 7.685 0.286 25033
2691 1 8 . 1 1 34 34 ILE N N 34 122.140 122.140 121.785 0.355 25033
2692 1 8 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.645 -0.328 25033
2693 1 8 . 1 1 34 34 ILE C C 34 174.526 174.526 175.014 -0.488 25033
2694 1 8 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.982 -0.185 25033
2695 1 8 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.270 2.313 25033
2696 1 8 . 1 1 34 34 ILE H H 34 9.511 9.511 8.597 0.914 25033
2697 1 8 . 1 1 35 35 THR N N 35 126.580 126.580 122.507 4.073 25033
2698 1 8 . 1 1 35 35 THR HA H 35 5.143 5.143 4.945 0.198 25033
2699 1 8 . 1 1 35 35 THR CA C 35 59.330 59.330 57.782 1.548 25033
2700 1 8 . 1 1 35 35 THR CB C 35 70.258 70.258 69.224 1.034 25033
2701 1 8 . 1 1 35 35 THR H H 35 9.416 9.416 8.840 0.576 25033
2702 1 8 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.628 -0.029 25033
2703 1 8 . 1 1 36 36 PRO C C 36 177.390 177.390 177.302 0.088 25033
2704 1 8 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.308 -0.088 25033
2705 1 8 . 1 1 36 36 PRO CB C 36 32.470 32.470 31.826 0.644 25033
2706 1 8 . 1 1 37 37 GLY N N 37 112.033 112.033 111.520 0.513 25033
2707 1 8 . 1 1 37 37 GLY C C 37 169.261 169.261 174.915 -5.654 25033
2708 1 8 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.673 1.784 25033
2709 1 8 . 1 1 37 37 GLY H H 37 9.349 9.349 8.566 0.783 25033
2710 1 8 . 1 1 38 38 GLY N N 38 109.050 109.050 108.759 0.291 25033
2711 1 8 . 1 1 38 38 GLY C C 38 175.177 175.177 174.809 0.368 25033
2712 1 8 . 1 1 38 38 GLY H H 38 8.756 8.756 7.834 0.922 25033
2713 1 8 . 1 1 39 39 GLY N N 39 107.730 107.730 105.956 1.774 25033
2714 1 8 . 1 1 39 39 GLY C C 39 173.870 173.870 173.642 0.228 25033
2715 1 8 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.556 -1.298 25033
2716 1 8 . 1 1 39 39 GLY H H 39 7.725 7.725 7.921 -0.196 25033
2717 1 8 . 1 1 40 40 GLY N N 40 107.183 107.183 110.036 -2.853 25033
2718 1 8 . 1 1 40 40 GLY C C 40 173.067 173.067 173.116 -0.049 25033
2719 1 8 . 1 1 40 40 GLY CA C 40 43.760 43.760 45.706 -1.946 25033
2720 1 8 . 1 1 40 40 GLY H H 40 8.096 8.096 8.104 -0.008 25033
2721 1 8 . 1 1 41 41 GLU N N 41 119.455 119.455 122.170 -2.715 25033
2722 1 8 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.443 -0.265 25033
2723 1 8 . 1 1 41 41 GLU C C 41 175.900 175.900 175.457 0.443 25033
2724 1 8 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.826 0.551 25033
2725 1 8 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.355 0.245 25033
2726 1 8 . 1 1 41 41 GLU H H 41 8.199 8.199 8.537 -0.338 25033
2727 1 8 . 1 1 42 42 ASP N N 42 119.784 119.784 123.314 -3.530 25033
2728 1 8 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.046 -0.189 25033
2729 1 8 . 1 1 42 42 ASP C C 42 176.474 176.474 176.114 0.360 25033
2730 1 8 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.644 1.798 25033
2731 1 8 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.835 -0.347 25033
2732 1 8 . 1 1 42 42 ASP H H 42 8.277 8.277 8.315 -0.038 25033
2733 1 8 . 1 1 43 43 LEU N N 43 122.515 122.515 117.340 5.175 25033
2734 1 8 . 1 1 43 43 LEU HA H 43 4.687 4.687 5.082 -0.395 25033
2735 1 8 . 1 1 43 43 LEU C C 43 175.759 175.759 176.378 -0.619 25033
2736 1 8 . 1 1 43 43 LEU CA C 43 53.304 53.304 54.131 -0.827 25033
2737 1 8 . 1 1 43 43 LEU CB C 43 45.449 45.449 44.026 1.423 25033
2738 1 8 . 1 1 43 43 LEU H H 43 9.423 9.423 8.287 1.136 25033
2739 1 8 . 1 1 44 44 PHE N N 44 125.962 125.962 119.333 6.629 25033
2740 1 8 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.893 -0.971 25033
2741 1 8 . 1 1 44 44 PHE C C 44 172.844 172.844 176.349 -3.505 25033
2742 1 8 . 1 1 44 44 PHE CA C 44 57.880 57.880 57.990 -0.110 25033
2743 1 8 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.913 0.437 25033
2744 1 8 . 1 1 44 44 PHE H H 44 8.465 8.465 8.658 -0.193 25033
2745 1 8 . 1 1 45 45 VAL N N 45 123.552 123.552 123.027 0.525 25033
2746 1 8 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.566 0.091 25033
2747 1 8 . 1 1 45 45 VAL C C 45 177.433 177.433 173.440 3.993 25033
2748 1 8 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.593 -2.133 25033
2749 1 8 . 1 1 45 45 VAL CB C 45 34.884 34.884 34.945 -0.061 25033
2750 1 8 . 1 1 45 45 VAL H H 45 7.715 7.715 8.128 -0.413 25033
2751 1 8 . 1 1 46 46 HIS N N 46 127.300 127.300 123.589 3.711 25033
2752 1 8 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.730 0.095 25033
2753 1 8 . 1 1 46 46 HIS C C 46 176.469 176.469 174.248 2.221 25033
2754 1 8 . 1 1 46 46 HIS CA C 46 55.929 55.929 52.555 3.374 25033
2755 1 8 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.193 3.206 25033
2756 1 8 . 1 1 46 46 HIS H H 46 9.104 9.104 8.142 0.962 25033
2757 1 8 . 1 1 47 47 GLN N N 47 125.105 125.105 123.043 2.062 25033
2758 1 8 . 1 1 47 47 GLN H H 47 8.352 8.352 8.522 -0.170 25033
2759 1 8 . 1 1 48 48 THR HA H 48 4.310 4.310 4.425 -0.115 25033
2760 1 8 . 1 1 48 48 THR C C 48 175.568 175.568 174.795 0.773 25033
2761 1 8 . 1 1 48 48 THR CA C 48 64.770 64.770 62.887 1.883 25033
2762 1 8 . 1 1 48 48 THR CB C 48 70.054 70.054 69.550 0.504 25033
2763 1 8 . 1 1 49 49 ASN N N 49 118.142 118.142 118.586 -0.444 25033
2764 1 8 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.892 0.268 25033
2765 1 8 . 1 1 49 49 ASN C C 49 172.914 172.914 173.846 -0.932 25033
2766 1 8 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.114 1.237 25033
2767 1 8 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.672 0.855 25033
2768 1 8 . 1 1 49 49 ASN H H 49 8.452 8.452 8.236 0.216 25033
2769 1 8 . 1 1 50 50 ILE N N 50 119.226 119.226 121.176 -1.950 25033
2770 1 8 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.183 -0.071 25033
2771 1 8 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.805 0.801 25033
2772 1 8 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.530 1.832 25033
2773 1 8 . 1 1 50 50 ILE H H 50 7.354 7.354 7.882 -0.528 25033
2774 1 8 . 1 1 51 51 ASN N N 51 128.460 128.460 123.416 5.044 25033
2775 1 8 . 1 1 51 51 ASN C C 51 174.614 174.614 174.094 0.520 25033
2776 1 8 . 1 1 51 51 ASN H H 51 9.266 9.266 7.972 1.294 25033
2777 1 8 . 1 1 52 52 SER N N 52 117.246 117.246 116.003 1.243 25033
2778 1 8 . 1 1 52 52 SER HA H 52 4.413 4.413 4.822 -0.408 25033
2779 1 8 . 1 1 52 52 SER C C 52 174.139 174.139 175.040 -0.901 25033
2780 1 8 . 1 1 52 52 SER CA C 52 58.378 58.378 56.771 1.607 25033
2781 1 8 . 1 1 52 52 SER CB C 52 64.371 64.371 64.380 -0.009 25033
2782 1 8 . 1 1 52 52 SER H H 52 7.973 7.973 8.437 -0.464 25033
2783 1 8 . 1 1 53 53 GLU N N 53 123.628 123.628 122.455 1.173 25033
2784 1 8 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.286 0.012 25033
2785 1 8 . 1 1 53 53 GLU C C 53 176.960 176.960 176.280 0.680 25033
2786 1 8 . 1 1 53 53 GLU CA C 53 57.270 57.270 56.706 0.564 25033
2787 1 8 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.755 0.106 25033
2788 1 8 . 1 1 53 53 GLU H H 53 8.641 8.641 8.696 -0.055 25033
2789 1 8 . 1 1 54 54 GLY N N 54 110.282 110.282 108.992 1.290 25033
2790 1 8 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.594 0.006 25033
2791 1 8 . 1 1 54 54 GLY H H 54 8.225 8.225 8.131 0.094 25033
2792 1 8 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.717 0.103 25033
2793 1 8 . 1 1 55 55 PHE C C 55 175.836 175.836 174.493 1.343 25033
2794 1 8 . 1 1 55 55 PHE CA C 55 52.690 52.690 56.938 -4.248 25033
2795 1 8 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.095 -3.000 25033
2796 1 8 . 1 1 56 56 ARG N N 56 120.907 120.907 121.581 -0.674 25033
2797 1 8 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.716 -0.452 25033
2798 1 8 . 1 1 56 56 ARG C C 56 175.618 175.618 175.726 -0.108 25033
2799 1 8 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.447 0.062 25033
2800 1 8 . 1 1 56 56 ARG CB C 56 32.020 32.020 30.703 1.317 25033
2801 1 8 . 1 1 56 56 ARG H H 56 8.153 8.153 8.593 -0.440 25033
2802 1 8 . 1 1 57 57 SER N N 57 123.117 123.117 120.370 2.747 25033
2803 1 8 . 1 1 57 57 SER H H 57 7.834 7.834 8.586 -0.752 25033
2804 1 8 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.551 -0.271 25033
2805 1 8 . 1 1 58 58 LEU C C 58 174.842 174.842 176.113 -1.271 25033
2806 1 8 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.581 -0.821 25033
2807 1 8 . 1 1 58 58 LEU CB C 58 42.580 42.580 44.144 -1.564 25033
2808 1 8 . 1 1 59 59 ARG N N 59 119.557 119.557 121.167 -1.610 25033
2809 1 8 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.756 -0.171 25033
2810 1 8 . 1 1 59 59 ARG C C 59 175.256 175.256 175.412 -0.156 25033
2811 1 8 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.784 -0.672 25033
2812 1 8 . 1 1 59 59 ARG CB C 59 32.970 32.970 32.853 0.117 25033
2813 1 8 . 1 1 59 59 ARG H H 59 8.529 8.529 8.676 -0.147 25033
2814 1 8 . 1 1 60 60 GLU N N 60 121.597 121.597 121.696 -0.099 25033
2815 1 8 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.271 -0.690 25033
2816 1 8 . 1 1 60 60 GLU C C 60 177.281 177.281 176.440 0.841 25033
2817 1 8 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.570 0.731 25033
2818 1 8 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.484 -0.223 25033
2819 1 8 . 1 1 60 60 GLU H H 60 8.691 8.691 8.739 -0.048 25033
2820 1 8 . 1 1 61 61 GLY N N 61 113.554 113.554 111.486 2.068 25033
2821 1 8 . 1 1 61 61 GLY C C 61 174.068 174.068 174.502 -0.434 25033
2822 1 8 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.779 0.464 25033
2823 1 8 . 1 1 61 61 GLY H H 61 9.151 9.151 8.763 0.388 25033
2824 1 8 . 1 1 62 62 GLU N N 62 121.639 121.639 122.440 -0.801 25033
2825 1 8 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.265 -0.061 25033
2826 1 8 . 1 1 62 62 GLU C C 62 175.439 175.439 176.068 -0.629 25033
2827 1 8 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.331 1.011 25033
2828 1 8 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.511 0.414 25033
2829 1 8 . 1 1 62 62 GLU H H 62 7.889 7.889 7.655 0.234 25033
2830 1 8 . 1 1 63 63 VAL N N 63 125.003 125.003 126.161 -1.158 25033
2831 1 8 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.597 0.151 25033
2832 1 8 . 1 1 63 63 VAL C C 63 176.639 176.639 176.160 0.479 25033
2833 1 8 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.506 1.125 25033
2834 1 8 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.794 -0.437 25033
2835 1 8 . 1 1 63 63 VAL H H 63 8.477 8.477 8.312 0.165 25033
2836 1 8 . 1 1 64 64 VAL N N 64 120.113 120.113 123.575 -3.462 25033
2837 1 8 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.646 0.358 25033
2838 1 8 . 1 1 64 64 VAL C C 64 173.790 173.790 173.947 -0.157 25033
2839 1 8 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.701 -1.092 25033
2840 1 8 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.309 1.051 25033
2841 1 8 . 1 1 64 64 VAL H H 64 8.686 8.686 8.870 -0.184 25033
2842 1 8 . 1 1 65 65 GLU N N 65 120.433 120.433 120.504 -0.071 25033
2843 1 8 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.287 0.160 25033
2844 1 8 . 1 1 65 65 GLU C C 65 175.584 175.584 175.330 0.254 25033
2845 1 8 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.430 -0.040 25033
2846 1 8 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.366 0.637 25033
2847 1 8 . 1 1 65 65 GLU H H 65 9.003 9.003 8.404 0.599 25033
2848 1 8 . 1 1 66 66 PHE N N 66 116.104 116.104 120.061 -3.957 25033
2849 1 8 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.087 -0.026 25033
2850 1 8 . 1 1 66 66 PHE C C 66 173.001 173.001 172.805 0.196 25033
2851 1 8 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.867 -0.010 25033
2852 1 8 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.609 -0.177 25033
2853 1 8 . 1 1 66 66 PHE H H 66 8.172 8.172 7.732 0.440 25033
2854 1 8 . 1 1 67 67 GLU N N 67 117.574 117.574 118.421 -0.847 25033
2855 1 8 . 1 1 67 67 GLU HA H 67 4.872 4.872 4.882 -0.010 25033
2856 1 8 . 1 1 67 67 GLU C C 67 175.327 175.327 175.324 0.003 25033
2857 1 8 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.181 0.459 25033
2858 1 8 . 1 1 67 67 GLU CB C 67 33.020 33.020 32.899 0.121 25033
2859 1 8 . 1 1 67 67 GLU H H 67 8.668 8.668 8.673 -0.005 25033
2860 1 8 . 1 1 68 68 VAL N N 68 120.881 120.881 123.169 -2.288 25033
2861 1 8 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.051 0.961 25033
2862 1 8 . 1 1 68 68 VAL C C 68 176.140 176.140 174.887 1.253 25033
2863 1 8 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.247 0.091 25033
2864 1 8 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.707 1.299 25033
2865 1 8 . 1 1 68 68 VAL H H 68 8.748 8.748 8.787 -0.039 25033
2866 1 8 . 1 1 69 69 GLU N N 69 128.110 128.110 129.066 -0.956 25033
2867 1 8 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.727 -0.022 25033
2868 1 8 . 1 1 69 69 GLU C C 69 174.573 174.573 174.710 -0.137 25033
2869 1 8 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.695 0.258 25033
2870 1 8 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.467 0.823 25033
2871 1 8 . 1 1 69 69 GLU H H 69 9.070 9.070 8.434 0.636 25033
2872 1 8 . 1 1 70 70 ALA N N 70 127.944 127.944 128.161 -0.217 25033
2873 1 8 . 1 1 70 70 ALA HA H 70 5.004 5.004 4.973 0.031 25033
2874 1 8 . 1 1 70 70 ALA C C 70 178.073 178.073 177.111 0.962 25033
2875 1 8 . 1 1 70 70 ALA CA C 70 50.959 50.959 51.113 -0.154 25033
2876 1 8 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.204 -0.715 25033
2877 1 8 . 1 1 70 70 ALA H H 70 8.671 8.671 8.596 0.075 25033
2878 1 8 . 1 1 71 71 GLY N N 71 110.340 110.340 111.293 -0.953 25033
2879 1 8 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.317 0.699 25033
2880 1 8 . 1 1 71 71 GLY H H 71 8.445 8.445 8.305 0.140 25033
2881 1 8 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.397 0.020 25033
2882 1 8 . 1 1 72 72 PRO C C 72 176.835 176.835 176.674 0.161 25033
2883 1 8 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.567 -0.406 25033
2884 1 8 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.683 0.197 25033
2885 1 8 . 1 1 73 73 ASP N N 73 116.498 116.498 117.162 -0.664 25033
2886 1 8 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.622 -0.107 25033
2887 1 8 . 1 1 73 73 ASP C C 73 176.775 176.775 177.617 -0.842 25033
2888 1 8 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.093 -0.546 25033
2889 1 8 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.525 -0.291 25033
2890 1 8 . 1 1 73 73 ASP H H 73 8.248 8.248 8.467 -0.219 25033
2891 1 8 . 1 1 74 74 GLY N N 74 107.369 107.369 107.526 -0.157 25033
2892 1 8 . 1 1 74 74 GLY C C 74 174.331 174.331 173.741 0.590 25033
2893 1 8 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.764 0.814 25033
2894 1 8 . 1 1 74 74 GLY H H 74 8.153 8.153 7.523 0.630 25033
2895 1 8 . 1 1 75 75 ARG N N 75 120.942 120.942 120.977 -0.035 25033
2896 1 8 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.543 -0.001 25033
2897 1 8 . 1 1 75 75 ARG C C 75 176.652 176.652 175.325 1.327 25033
2898 1 8 . 1 1 75 75 ARG CA C 75 55.658 55.658 56.001 -0.343 25033
2899 1 8 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.334 -0.425 25033
2900 1 8 . 1 1 75 75 ARG H H 75 7.670 7.670 8.259 -0.589 25033
2901 1 8 . 1 1 76 76 SER N N 76 120.181 120.181 117.789 2.392 25033
2902 1 8 . 1 1 76 76 SER HA H 76 5.035 5.035 5.598 -0.563 25033
2903 1 8 . 1 1 76 76 SER C C 76 172.816 172.816 174.060 -1.244 25033
2904 1 8 . 1 1 76 76 SER CA C 76 59.080 59.080 57.010 2.070 25033
2905 1 8 . 1 1 76 76 SER CB C 76 64.850 64.850 65.353 -0.503 25033
2906 1 8 . 1 1 76 76 SER H H 76 8.808 8.808 8.490 0.318 25033
2907 1 8 . 1 1 77 77 LYS N N 77 121.202 121.202 121.254 -0.052 25033
2908 1 8 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.785 0.389 25033
2909 1 8 . 1 1 77 77 LYS C C 77 173.706 173.706 174.357 -0.651 25033
2910 1 8 . 1 1 77 77 LYS CA C 77 54.599 54.599 55.011 -0.412 25033
2911 1 8 . 1 1 77 77 LYS CB C 77 36.035 36.035 35.674 0.361 25033
2912 1 8 . 1 1 77 77 LYS H H 77 8.982 8.982 8.737 0.245 25033
2913 1 8 . 1 1 78 78 ALA N N 78 124.064 124.064 126.386 -2.322 25033
2914 1 8 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.640 0.364 25033
2915 1 8 . 1 1 78 78 ALA C C 78 175.979 175.979 176.383 -0.404 25033
2916 1 8 . 1 1 78 78 ALA CA C 78 50.445 50.445 51.596 -1.151 25033
2917 1 8 . 1 1 78 78 ALA CB C 78 20.136 20.136 19.405 0.731 25033
2918 1 8 . 1 1 78 78 ALA H H 78 8.706 8.706 8.625 0.081 25033
2919 1 8 . 1 1 79 79 VAL N N 79 113.264 113.264 117.762 -4.498 25033
2920 1 8 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.358 0.485 25033
2921 1 8 . 1 1 79 79 VAL C C 79 174.744 174.744 174.504 0.240 25033
2922 1 8 . 1 1 79 79 VAL CA C 79 59.073 59.073 60.081 -1.008 25033
2923 1 8 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.533 0.063 25033
2924 1 8 . 1 1 79 79 VAL H H 79 9.165 9.165 7.662 1.503 25033
2925 1 8 . 1 1 80 80 ASN N N 80 120.084 120.084 114.701 5.383 25033
2926 1 8 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.333 0.023 25033
2927 1 8 . 1 1 80 80 ASN C C 80 175.391 175.391 173.857 1.534 25033
2928 1 8 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.622 0.112 25033
2929 1 8 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.633 0.488 25033
2930 1 8 . 1 1 80 80 ASN H H 80 8.923 8.923 8.532 0.391 25033
2931 1 8 . 1 1 81 81 VAL N N 81 119.178 119.178 119.713 -0.535 25033
2932 1 8 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.512 0.235 25033
2933 1 8 . 1 1 81 81 VAL C C 81 176.340 176.340 176.764 -0.424 25033
2934 1 8 . 1 1 81 81 VAL CA C 81 63.160 63.160 61.450 1.710 25033
2935 1 8 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.857 0.273 25033
2936 1 8 . 1 1 81 81 VAL H H 81 8.282 8.282 7.587 0.695 25033
2937 1 9 . 1 1 12 12 SER N N 12 116.112 116.112 113.483 2.629 25033
2938 1 9 . 1 1 12 12 SER C C 12 175.271 175.271 174.690 0.581 25033
2939 1 9 . 1 1 12 12 SER CA C 12 58.570 58.570 58.290 0.280 25033
2940 1 9 . 1 1 12 12 SER CB C 12 63.984 63.984 65.409 -1.425 25033
2941 1 9 . 1 1 12 12 SER H H 12 8.422 8.422 10.611 -2.189 25033
2942 1 9 . 1 1 13 13 GLY N N 13 111.178 111.178 109.457 1.721 25033
2943 1 9 . 1 1 13 13 GLY C C 13 174.238 174.238 174.242 -0.004 25033
2944 1 9 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.921 0.599 25033
2945 1 9 . 1 1 13 13 GLY H H 13 8.537 8.537 8.493 0.044 25033
2946 1 9 . 1 1 14 14 GLU N N 14 120.547 120.547 122.601 -2.054 25033
2947 1 9 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.447 -0.180 25033
2948 1 9 . 1 1 14 14 GLU C C 14 176.455 176.455 175.324 1.131 25033
2949 1 9 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.657 1.096 25033
2950 1 9 . 1 1 14 14 GLU CB C 14 30.464 30.464 28.302 2.162 25033
2951 1 9 . 1 1 14 14 GLU H H 14 8.285 8.285 8.633 -0.348 25033
2952 1 9 . 1 1 15 15 GLN N N 15 121.185 121.185 121.980 -0.795 25033
2953 1 9 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.494 -0.145 25033
2954 1 9 . 1 1 15 15 GLN C C 15 175.494 175.494 175.295 0.199 25033
2955 1 9 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.191 0.479 25033
2956 1 9 . 1 1 15 15 GLN CB C 15 29.410 29.410 28.933 0.477 25033
2957 1 9 . 1 1 15 15 GLN H H 15 8.444 8.444 7.945 0.499 25033
2958 1 9 . 1 1 16 16 LEU N N 16 123.934 123.934 129.169 -5.235 25033
2959 1 9 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.532 -0.191 25033
2960 1 9 . 1 1 16 16 LEU C C 16 176.942 176.942 175.358 1.584 25033
2961 1 9 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.130 1.374 25033
2962 1 9 . 1 1 16 16 LEU CB C 16 42.519 42.519 40.805 1.714 25033
2963 1 9 . 1 1 16 16 LEU H H 16 8.289 8.289 8.691 -0.402 25033
2964 1 9 . 1 1 17 17 ARG N N 17 122.044 122.044 120.880 1.164 25033
2965 1 9 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.590 -0.126 25033
2966 1 9 . 1 1 17 17 ARG C C 17 175.829 175.829 175.600 0.229 25033
2967 1 9 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.658 1.014 25033
2968 1 9 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.563 -0.733 25033
2969 1 9 . 1 1 17 17 ARG H H 17 8.216 8.216 8.086 0.130 25033
2970 1 9 . 1 1 18 18 GLN N N 18 122.488 122.488 123.862 -1.374 25033
2971 1 9 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.476 -0.142 25033
2972 1 9 . 1 1 18 18 GLN C C 18 172.958 172.958 173.593 -0.635 25033
2973 1 9 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.029 0.871 25033
2974 1 9 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.120 0.500 25033
2975 1 9 . 1 1 18 18 GLN H H 18 8.573 8.573 7.879 0.694 25033
2976 1 9 . 1 1 19 19 GLN N N 19 116.301 116.301 119.155 -2.854 25033
2977 1 9 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.367 0.011 25033
2978 1 9 . 1 1 19 19 GLN C C 19 176.902 176.902 174.258 2.644 25033
2979 1 9 . 1 1 19 19 GLN CA C 19 54.215 54.215 53.424 0.791 25033
2980 1 9 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.117 1.522 25033
2981 1 9 . 1 1 19 19 GLN H H 19 8.146 8.146 8.261 -0.115 25033
2982 1 9 . 1 1 20 20 GLY N N 20 109.745 109.745 109.398 0.347 25033
2983 1 9 . 1 1 20 20 GLY C C 20 170.989 170.989 172.688 -1.699 25033
2984 1 9 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.490 1.445 25033
2985 1 9 . 1 1 20 20 GLY H H 20 8.998 8.998 7.952 1.046 25033
2986 1 9 . 1 1 21 21 THR N N 21 112.645 112.645 114.349 -1.704 25033
2987 1 9 . 1 1 21 21 THR HA H 21 5.361 5.361 5.109 0.252 25033
2988 1 9 . 1 1 21 21 THR C C 21 174.553 174.553 175.416 -0.863 25033
2989 1 9 . 1 1 21 21 THR CA C 21 60.025 60.025 60.378 -0.353 25033
2990 1 9 . 1 1 21 21 THR CB C 21 71.720 71.720 71.100 0.620 25033
2991 1 9 . 1 1 21 21 THR H H 21 8.312 8.312 8.302 0.010 25033
2992 1 9 . 1 1 22 22 VAL N N 22 125.915 125.915 120.542 5.373 25033
2993 1 9 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.995 -0.346 25033
2994 1 9 . 1 1 22 22 VAL C C 22 175.553 175.553 178.001 -2.448 25033
2995 1 9 . 1 1 22 22 VAL CA C 22 64.618 64.618 64.744 -0.126 25033
2996 1 9 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.703 -0.082 25033
2997 1 9 . 1 1 22 22 VAL H H 22 9.092 9.092 8.390 0.702 25033
2998 1 9 . 1 1 23 23 LYS N N 23 135.790 135.790 119.106 16.684 25033
2999 1 9 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.011 0.290 25033
3000 1 9 . 1 1 23 23 LYS C C 23 176.301 176.301 176.527 -0.226 25033
3001 1 9 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.646 -0.036 25033
3002 1 9 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.250 3.050 25033
3003 1 9 . 1 1 23 23 LYS H H 23 9.276 9.276 8.482 0.794 25033
3004 1 9 . 1 1 24 24 TRP N N 24 111.651 111.651 119.239 -7.588 25033
3005 1 9 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.859 -0.236 25033
3006 1 9 . 1 1 24 24 TRP C C 24 173.628 173.628 174.613 -0.985 25033
3007 1 9 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.889 0.411 25033
3008 1 9 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.948 1.312 25033
3009 1 9 . 1 1 24 24 TRP H H 24 7.455 7.455 7.646 -0.191 25033
3010 1 9 . 1 1 25 25 PHE N N 25 121.305 121.305 120.238 1.067 25033
3011 1 9 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.832 -0.547 25033
3012 1 9 . 1 1 25 25 PHE C C 25 172.354 172.354 174.188 -1.834 25033
3013 1 9 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.046 2.326 25033
3014 1 9 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.411 0.158 25033
3015 1 9 . 1 1 25 25 PHE H H 25 9.074 9.074 8.232 0.842 25033
3016 1 9 . 1 1 26 26 ASN N N 26 126.976 126.976 124.163 2.813 25033
3017 1 9 . 1 1 26 26 ASN HA H 26 4.812 4.812 5.026 -0.214 25033
3018 1 9 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.235 -0.823 25033
3019 1 9 . 1 1 26 26 ASN CB C 26 39.086 39.086 38.283 0.803 25033
3020 1 9 . 1 1 26 26 ASN H H 26 8.159 8.159 7.931 0.228 25033
3021 1 9 . 1 1 27 27 ALA N N 27 128.245 128.245 125.902 2.343 25033
3022 1 9 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.133 -0.012 25033
3023 1 9 . 1 1 27 27 ALA C C 27 179.031 179.031 178.814 0.217 25033
3024 1 9 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.279 -0.854 25033
3025 1 9 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.750 -0.376 25033
3026 1 9 . 1 1 27 27 ALA H H 27 9.036 9.036 8.686 0.350 25033
3027 1 9 . 1 1 28 28 THR N N 28 113.994 113.994 113.788 0.206 25033
3028 1 9 . 1 1 28 28 THR HA H 28 4.068 4.068 4.014 0.054 25033
3029 1 9 . 1 1 28 28 THR C C 28 176.084 176.084 175.977 0.107 25033
3030 1 9 . 1 1 28 28 THR CA C 28 65.820 65.820 65.053 0.767 25033
3031 1 9 . 1 1 28 28 THR CB C 28 68.291 68.291 68.086 0.205 25033
3032 1 9 . 1 1 28 28 THR H H 28 8.065 8.065 8.395 -0.330 25033
3033 1 9 . 1 1 29 29 LYS N N 29 118.922 118.922 119.858 -0.936 25033
3034 1 9 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.353 -0.097 25033
3035 1 9 . 1 1 29 29 LYS C C 29 177.201 177.201 177.216 -0.015 25033
3036 1 9 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.472 0.416 25033
3037 1 9 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.805 0.935 25033
3038 1 9 . 1 1 29 29 LYS H H 29 7.446 7.446 8.067 -0.621 25033
3039 1 9 . 1 1 30 30 GLY N N 30 107.601 107.601 106.981 0.620 25033
3040 1 9 . 1 1 30 30 GLY C C 30 172.004 172.004 173.020 -1.016 25033
3041 1 9 . 1 1 30 30 GLY CA C 30 46.404 46.404 44.993 1.411 25033
3042 1 9 . 1 1 30 30 GLY H H 30 8.115 8.115 7.834 0.281 25033
3043 1 9 . 1 1 31 31 PHE N N 31 112.488 112.488 118.586 -6.098 25033
3044 1 9 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.672 0.335 25033
3045 1 9 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.058 -1.780 25033
3046 1 9 . 1 1 31 31 PHE CB C 31 42.388 42.388 41.517 0.871 25033
3047 1 9 . 1 1 31 31 PHE H H 31 6.594 6.594 7.524 -0.930 25033
3048 1 9 . 1 1 32 32 GLY N N 32 105.986 105.986 108.603 -2.617 25033
3049 1 9 . 1 1 32 32 GLY C C 32 170.292 170.292 171.590 -1.298 25033
3050 1 9 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.166 2.203 25033
3051 1 9 . 1 1 32 32 GLY H H 32 8.144 8.144 7.941 0.203 25033
3052 1 9 . 1 1 33 33 PHE N N 33 115.319 115.319 116.072 -0.753 25033
3053 1 9 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.375 0.088 25033
3054 1 9 . 1 1 33 33 PHE C C 33 175.037 175.037 175.040 -0.003 25033
3055 1 9 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.347 -1.052 25033
3056 1 9 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.236 0.556 25033
3057 1 9 . 1 1 33 33 PHE H H 33 7.971 7.971 7.824 0.147 25033
3058 1 9 . 1 1 34 34 ILE N N 34 122.140 122.140 119.881 2.259 25033
3059 1 9 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.706 -0.389 25033
3060 1 9 . 1 1 34 34 ILE C C 34 174.526 174.526 174.993 -0.467 25033
3061 1 9 . 1 1 34 34 ILE CA C 34 59.797 59.797 60.036 -0.239 25033
3062 1 9 . 1 1 34 34 ILE CB C 34 42.583 42.583 41.398 1.185 25033
3063 1 9 . 1 1 34 34 ILE H H 34 9.511 9.511 8.665 0.846 25033
3064 1 9 . 1 1 35 35 THR N N 35 126.580 126.580 121.856 4.724 25033
3065 1 9 . 1 1 35 35 THR HA H 35 5.143 5.143 5.001 0.142 25033
3066 1 9 . 1 1 35 35 THR CA C 35 59.330 59.330 57.622 1.708 25033
3067 1 9 . 1 1 35 35 THR CB C 35 70.258 70.258 69.456 0.802 25033
3068 1 9 . 1 1 35 35 THR H H 35 9.416 9.416 8.842 0.574 25033
3069 1 9 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.612 -0.013 25033
3070 1 9 . 1 1 36 36 PRO C C 36 177.390 177.390 177.882 -0.492 25033
3071 1 9 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.283 -0.063 25033
3072 1 9 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.199 0.271 25033
3073 1 9 . 1 1 37 37 GLY N N 37 112.033 112.033 110.780 1.253 25033
3074 1 9 . 1 1 37 37 GLY C C 37 169.261 169.261 174.751 -5.490 25033
3075 1 9 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.925 1.532 25033
3076 1 9 . 1 1 37 37 GLY H H 37 9.349 9.349 8.695 0.654 25033
3077 1 9 . 1 1 38 38 GLY N N 38 109.050 109.050 108.446 0.604 25033
3078 1 9 . 1 1 38 38 GLY C C 38 175.177 175.177 174.598 0.579 25033
3079 1 9 . 1 1 38 38 GLY H H 38 8.756 8.756 7.859 0.897 25033
3080 1 9 . 1 1 39 39 GLY N N 39 107.730 107.730 107.304 0.426 25033
3081 1 9 . 1 1 39 39 GLY C C 39 173.870 173.870 173.663 0.207 25033
3082 1 9 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.215 -0.957 25033
3083 1 9 . 1 1 39 39 GLY H H 39 7.725 7.725 7.707 0.018 25033
3084 1 9 . 1 1 40 40 GLY N N 40 107.183 107.183 112.864 -5.681 25033
3085 1 9 . 1 1 40 40 GLY C C 40 173.067 173.067 173.626 -0.559 25033
3086 1 9 . 1 1 40 40 GLY CA C 40 43.760 43.760 45.863 -2.103 25033
3087 1 9 . 1 1 40 40 GLY H H 40 8.096 8.096 8.548 -0.452 25033
3088 1 9 . 1 1 41 41 GLU N N 41 119.455 119.455 122.855 -3.400 25033
3089 1 9 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.574 -0.396 25033
3090 1 9 . 1 1 41 41 GLU C C 41 175.900 175.900 174.904 0.996 25033
3091 1 9 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.553 0.824 25033
3092 1 9 . 1 1 41 41 GLU CB C 41 30.600 30.600 31.734 -1.134 25033
3093 1 9 . 1 1 41 41 GLU H H 41 8.199 8.199 8.596 -0.397 25033
3094 1 9 . 1 1 42 42 ASP N N 42 119.784 119.784 123.251 -3.467 25033
3095 1 9 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.386 -0.528 25033
3096 1 9 . 1 1 42 42 ASP C C 42 176.474 176.474 176.158 0.316 25033
3097 1 9 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.795 1.646 25033
3098 1 9 . 1 1 42 42 ASP CB C 42 41.488 41.488 42.109 -0.621 25033
3099 1 9 . 1 1 42 42 ASP H H 42 8.277 8.277 8.385 -0.108 25033
3100 1 9 . 1 1 43 43 LEU N N 43 122.515 122.515 121.091 1.424 25033
3101 1 9 . 1 1 43 43 LEU HA H 43 4.687 4.687 5.012 -0.325 25033
3102 1 9 . 1 1 43 43 LEU C C 43 175.759 175.759 176.195 -0.436 25033
3103 1 9 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.524 -0.220 25033
3104 1 9 . 1 1 43 43 LEU CB C 43 45.449 45.449 44.188 1.261 25033
3105 1 9 . 1 1 43 43 LEU H H 43 9.423 9.423 8.125 1.298 25033
3106 1 9 . 1 1 44 44 PHE N N 44 125.962 125.962 119.324 6.638 25033
3107 1 9 . 1 1 44 44 PHE HA H 44 3.922 3.922 5.018 -1.096 25033
3108 1 9 . 1 1 44 44 PHE C C 44 172.844 172.844 174.602 -1.758 25033
3109 1 9 . 1 1 44 44 PHE CA C 44 57.880 57.880 56.100 1.780 25033
3110 1 9 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.818 0.532 25033
3111 1 9 . 1 1 44 44 PHE H H 44 8.465 8.465 8.220 0.245 25033
3112 1 9 . 1 1 45 45 VAL N N 45 123.552 123.552 124.599 -1.047 25033
3113 1 9 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.188 0.469 25033
3114 1 9 . 1 1 45 45 VAL C C 45 177.433 177.433 173.399 4.034 25033
3115 1 9 . 1 1 45 45 VAL CA C 45 58.460 58.460 59.676 -1.216 25033
3116 1 9 . 1 1 45 45 VAL CB C 45 34.884 34.884 36.100 -1.216 25033
3117 1 9 . 1 1 45 45 VAL H H 45 7.715 7.715 8.123 -0.408 25033
3118 1 9 . 1 1 46 46 HIS N N 46 127.300 127.300 123.453 3.847 25033
3119 1 9 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.930 -0.105 25033
3120 1 9 . 1 1 46 46 HIS C C 46 176.469 176.469 174.236 2.233 25033
3121 1 9 . 1 1 46 46 HIS CA C 46 55.929 55.929 53.208 2.721 25033
3122 1 9 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.592 2.807 25033
3123 1 9 . 1 1 46 46 HIS H H 46 9.104 9.104 7.873 1.231 25033
3124 1 9 . 1 1 47 47 GLN N N 47 125.105 125.105 122.224 2.881 25033
3125 1 9 . 1 1 47 47 GLN H H 47 8.352 8.352 8.895 -0.543 25033
3126 1 9 . 1 1 48 48 THR HA H 48 4.310 4.310 4.452 -0.142 25033
3127 1 9 . 1 1 48 48 THR C C 48 175.568 175.568 174.762 0.806 25033
3128 1 9 . 1 1 48 48 THR CA C 48 64.770 64.770 63.387 1.383 25033
3129 1 9 . 1 1 48 48 THR CB C 48 70.054 70.054 69.779 0.275 25033
3130 1 9 . 1 1 49 49 ASN N N 49 118.142 118.142 118.507 -0.365 25033
3131 1 9 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.936 0.224 25033
3132 1 9 . 1 1 49 49 ASN C C 49 172.914 172.914 173.827 -0.913 25033
3133 1 9 . 1 1 49 49 ASN CA C 49 54.351 54.351 52.964 1.387 25033
3134 1 9 . 1 1 49 49 ASN CB C 49 40.527 40.527 40.023 0.504 25033
3135 1 9 . 1 1 49 49 ASN H H 49 8.452 8.452 8.546 -0.094 25033
3136 1 9 . 1 1 50 50 ILE N N 50 119.226 119.226 121.497 -2.271 25033
3137 1 9 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.142 -0.030 25033
3138 1 9 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.615 0.991 25033
3139 1 9 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.400 1.962 25033
3140 1 9 . 1 1 50 50 ILE H H 50 7.354 7.354 7.943 -0.589 25033
3141 1 9 . 1 1 51 51 ASN N N 51 128.460 128.460 124.325 4.135 25033
3142 1 9 . 1 1 51 51 ASN C C 51 174.614 174.614 174.055 0.559 25033
3143 1 9 . 1 1 51 51 ASN H H 51 9.266 9.266 8.058 1.208 25033
3144 1 9 . 1 1 52 52 SER N N 52 117.246 117.246 119.597 -2.351 25033
3145 1 9 . 1 1 52 52 SER HA H 52 4.413 4.413 4.617 -0.204 25033
3146 1 9 . 1 1 52 52 SER C C 52 174.139 174.139 174.473 -0.334 25033
3147 1 9 . 1 1 52 52 SER CA C 52 58.378 58.378 56.965 1.413 25033
3148 1 9 . 1 1 52 52 SER CB C 52 64.371 64.371 65.321 -0.950 25033
3149 1 9 . 1 1 52 52 SER H H 52 7.973 7.973 8.443 -0.470 25033
3150 1 9 . 1 1 53 53 GLU N N 53 123.628 123.628 120.994 2.634 25033
3151 1 9 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.192 0.106 25033
3152 1 9 . 1 1 53 53 GLU C C 53 176.960 176.960 176.665 0.295 25033
3153 1 9 . 1 1 53 53 GLU CA C 53 57.270 57.270 57.382 -0.112 25033
3154 1 9 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.927 -0.066 25033
3155 1 9 . 1 1 53 53 GLU H H 53 8.641 8.641 8.569 0.072 25033
3156 1 9 . 1 1 54 54 GLY N N 54 110.282 110.282 108.073 2.209 25033
3157 1 9 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.759 -0.159 25033
3158 1 9 . 1 1 54 54 GLY H H 54 8.225 8.225 7.867 0.358 25033
3159 1 9 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.784 0.036 25033
3160 1 9 . 1 1 55 55 PHE C C 55 175.836 175.836 174.774 1.062 25033
3161 1 9 . 1 1 55 55 PHE CA C 55 52.690 52.690 56.926 -4.236 25033
3162 1 9 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.878 -3.783 25033
3163 1 9 . 1 1 56 56 ARG N N 56 120.907 120.907 122.161 -1.254 25033
3164 1 9 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.617 -0.353 25033
3165 1 9 . 1 1 56 56 ARG C C 56 175.618 175.618 175.529 0.089 25033
3166 1 9 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.428 0.082 25033
3167 1 9 . 1 1 56 56 ARG CB C 56 32.020 32.020 30.177 1.843 25033
3168 1 9 . 1 1 56 56 ARG H H 56 8.153 8.153 8.671 -0.518 25033
3169 1 9 . 1 1 57 57 SER N N 57 123.117 123.117 120.798 2.319 25033
3170 1 9 . 1 1 57 57 SER H H 57 7.834 7.834 8.625 -0.791 25033
3171 1 9 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.721 -0.441 25033
3172 1 9 . 1 1 58 58 LEU C C 58 174.842 174.842 176.525 -1.683 25033
3173 1 9 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.326 -0.566 25033
3174 1 9 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.666 -1.085 25033
3175 1 9 . 1 1 59 59 ARG N N 59 119.557 119.557 122.156 -2.599 25033
3176 1 9 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.566 0.019 25033
3177 1 9 . 1 1 59 59 ARG C C 59 175.256 175.256 175.952 -0.696 25033
3178 1 9 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.996 -0.884 25033
3179 1 9 . 1 1 59 59 ARG CB C 59 32.970 32.970 31.758 1.212 25033
3180 1 9 . 1 1 59 59 ARG H H 59 8.529 8.529 8.717 -0.188 25033
3181 1 9 . 1 1 60 60 GLU N N 60 121.597 121.597 120.406 1.191 25033
3182 1 9 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.051 -0.470 25033
3183 1 9 . 1 1 60 60 GLU C C 60 177.281 177.281 176.938 0.343 25033
3184 1 9 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.451 0.850 25033
3185 1 9 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.906 -0.645 25033
3186 1 9 . 1 1 60 60 GLU H H 60 8.691 8.691 8.536 0.155 25033
3187 1 9 . 1 1 61 61 GLY N N 61 113.554 113.554 110.371 3.183 25033
3188 1 9 . 1 1 61 61 GLY C C 61 174.068 174.068 174.184 -0.116 25033
3189 1 9 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.799 0.444 25033
3190 1 9 . 1 1 61 61 GLY H H 61 9.151 9.151 8.654 0.497 25033
3191 1 9 . 1 1 62 62 GLU N N 62 121.639 121.639 122.078 -0.439 25033
3192 1 9 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.273 -0.069 25033
3193 1 9 . 1 1 62 62 GLU C C 62 175.439 175.439 176.263 -0.824 25033
3194 1 9 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.774 0.568 25033
3195 1 9 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.579 0.346 25033
3196 1 9 . 1 1 62 62 GLU H H 62 7.889 7.889 7.609 0.280 25033
3197 1 9 . 1 1 63 63 VAL N N 63 125.003 125.003 124.996 0.007 25033
3198 1 9 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.789 -0.041 25033
3199 1 9 . 1 1 63 63 VAL C C 63 176.639 176.639 175.923 0.716 25033
3200 1 9 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.582 1.049 25033
3201 1 9 . 1 1 63 63 VAL CB C 63 32.357 32.357 33.542 -1.185 25033
3202 1 9 . 1 1 63 63 VAL H H 63 8.477 8.477 8.265 0.212 25033
3203 1 9 . 1 1 64 64 VAL N N 64 120.113 120.113 121.712 -1.599 25033
3204 1 9 . 1 1 64 64 VAL HA H 64 5.004 5.004 5.059 -0.055 25033
3205 1 9 . 1 1 64 64 VAL C C 64 173.790 173.790 174.250 -0.460 25033
3206 1 9 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.166 -0.557 25033
3207 1 9 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.738 0.622 25033
3208 1 9 . 1 1 64 64 VAL H H 64 8.686 8.686 8.946 -0.260 25033
3209 1 9 . 1 1 65 65 GLU N N 65 120.433 120.433 121.164 -0.731 25033
3210 1 9 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.272 0.175 25033
3211 1 9 . 1 1 65 65 GLU C C 65 175.584 175.584 175.376 0.208 25033
3212 1 9 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.350 0.040 25033
3213 1 9 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.307 0.696 25033
3214 1 9 . 1 1 65 65 GLU H H 65 9.003 9.003 8.048 0.955 25033
3215 1 9 . 1 1 66 66 PHE N N 66 116.104 116.104 120.642 -4.538 25033
3216 1 9 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.023 0.038 25033
3217 1 9 . 1 1 66 66 PHE C C 66 173.001 173.001 172.702 0.299 25033
3218 1 9 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.906 -0.049 25033
3219 1 9 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.707 -0.275 25033
3220 1 9 . 1 1 66 66 PHE H H 66 8.172 8.172 7.849 0.323 25033
3221 1 9 . 1 1 67 67 GLU N N 67 117.574 117.574 119.322 -1.748 25033
3222 1 9 . 1 1 67 67 GLU HA H 67 4.872 4.872 4.754 0.118 25033
3223 1 9 . 1 1 67 67 GLU C C 67 175.327 175.327 174.772 0.555 25033
3224 1 9 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.844 -0.203 25033
3225 1 9 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.180 -0.160 25033
3226 1 9 . 1 1 67 67 GLU H H 67 8.668 8.668 8.678 -0.010 25033
3227 1 9 . 1 1 68 68 VAL N N 68 120.881 120.881 124.429 -3.548 25033
3228 1 9 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.442 0.570 25033
3229 1 9 . 1 1 68 68 VAL C C 68 176.140 176.140 175.614 0.526 25033
3230 1 9 . 1 1 68 68 VAL CA C 68 62.338 62.338 61.581 0.756 25033
3231 1 9 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.364 1.642 25033
3232 1 9 . 1 1 68 68 VAL H H 68 8.748 8.748 8.610 0.138 25033
3233 1 9 . 1 1 69 69 GLU N N 69 128.110 128.110 129.424 -1.314 25033
3234 1 9 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.671 0.034 25033
3235 1 9 . 1 1 69 69 GLU C C 69 174.573 174.573 174.664 -0.091 25033
3236 1 9 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.864 0.089 25033
3237 1 9 . 1 1 69 69 GLU CB C 69 34.290 34.290 32.805 1.485 25033
3238 1 9 . 1 1 69 69 GLU H H 69 9.070 9.070 9.185 -0.115 25033
3239 1 9 . 1 1 70 70 ALA N N 70 127.944 127.944 130.115 -2.171 25033
3240 1 9 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.264 -0.260 25033
3241 1 9 . 1 1 70 70 ALA C C 70 178.073 178.073 177.221 0.852 25033
3242 1 9 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.908 0.050 25033
3243 1 9 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.018 -0.529 25033
3244 1 9 . 1 1 70 70 ALA H H 70 8.671 8.671 8.664 0.007 25033
3245 1 9 . 1 1 71 71 GLY N N 71 110.340 110.340 111.707 -1.367 25033
3246 1 9 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.767 0.249 25033
3247 1 9 . 1 1 71 71 GLY H H 71 8.445 8.445 8.155 0.290 25033
3248 1 9 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.372 0.045 25033
3249 1 9 . 1 1 72 72 PRO C C 72 176.835 176.835 176.785 0.050 25033
3250 1 9 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.608 -0.447 25033
3251 1 9 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.632 0.248 25033
3252 1 9 . 1 1 73 73 ASP N N 73 116.498 116.498 117.788 -1.290 25033
3253 1 9 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.625 -0.110 25033
3254 1 9 . 1 1 73 73 ASP C C 73 176.775 176.775 177.469 -0.694 25033
3255 1 9 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.295 -0.748 25033
3256 1 9 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.696 -0.462 25033
3257 1 9 . 1 1 73 73 ASP H H 73 8.248 8.248 8.394 -0.146 25033
3258 1 9 . 1 1 74 74 GLY N N 74 107.369 107.369 107.092 0.277 25033
3259 1 9 . 1 1 74 74 GLY C C 74 174.331 174.331 173.323 1.008 25033
3260 1 9 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.836 0.742 25033
3261 1 9 . 1 1 74 74 GLY H H 74 8.153 8.153 7.752 0.401 25033
3262 1 9 . 1 1 75 75 ARG N N 75 120.942 120.942 119.965 0.977 25033
3263 1 9 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.518 0.024 25033
3264 1 9 . 1 1 75 75 ARG C C 75 176.652 176.652 174.498 2.154 25033
3265 1 9 . 1 1 75 75 ARG CA C 75 55.658 55.658 56.165 -0.507 25033
3266 1 9 . 1 1 75 75 ARG CB C 75 30.909 30.909 30.840 0.069 25033
3267 1 9 . 1 1 75 75 ARG H H 75 7.670 7.670 8.080 -0.410 25033
3268 1 9 . 1 1 76 76 SER N N 76 120.181 120.181 118.875 1.306 25033
3269 1 9 . 1 1 76 76 SER HA H 76 5.035 5.035 5.466 -0.431 25033
3270 1 9 . 1 1 76 76 SER C C 76 172.816 172.816 173.872 -1.056 25033
3271 1 9 . 1 1 76 76 SER CA C 76 59.080 59.080 57.017 2.063 25033
3272 1 9 . 1 1 76 76 SER CB C 76 64.850 64.850 65.657 -0.807 25033
3273 1 9 . 1 1 76 76 SER H H 76 8.808 8.808 8.491 0.317 25033
3274 1 9 . 1 1 77 77 LYS N N 77 121.202 121.202 122.551 -1.349 25033
3275 1 9 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.679 0.495 25033
3276 1 9 . 1 1 77 77 LYS C C 77 173.706 173.706 174.176 -0.470 25033
3277 1 9 . 1 1 77 77 LYS CA C 77 54.599 54.599 54.182 0.417 25033
3278 1 9 . 1 1 77 77 LYS CB C 77 36.035 36.035 35.574 0.461 25033
3279 1 9 . 1 1 77 77 LYS H H 77 8.982 8.982 8.440 0.542 25033
3280 1 9 . 1 1 78 78 ALA N N 78 124.064 124.064 123.141 0.923 25033
3281 1 9 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.936 0.068 25033
3282 1 9 . 1 1 78 78 ALA C C 78 175.979 175.979 176.465 -0.486 25033
3283 1 9 . 1 1 78 78 ALA CA C 78 50.445 50.445 51.022 -0.577 25033
3284 1 9 . 1 1 78 78 ALA CB C 78 20.136 20.136 19.916 0.220 25033
3285 1 9 . 1 1 78 78 ALA H H 78 8.706 8.706 8.408 0.298 25033
3286 1 9 . 1 1 79 79 VAL N N 79 113.264 113.264 116.640 -3.376 25033
3287 1 9 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.405 0.438 25033
3288 1 9 . 1 1 79 79 VAL C C 79 174.744 174.744 174.497 0.247 25033
3289 1 9 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.656 -0.582 25033
3290 1 9 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.410 0.186 25033
3291 1 9 . 1 1 79 79 VAL H H 79 9.165 9.165 7.737 1.428 25033
3292 1 9 . 1 1 80 80 ASN N N 80 120.084 120.084 116.186 3.898 25033
3293 1 9 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.339 0.017 25033
3294 1 9 . 1 1 80 80 ASN C C 80 175.391 175.391 173.959 1.432 25033
3295 1 9 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.877 -0.143 25033
3296 1 9 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.935 0.186 25033
3297 1 9 . 1 1 80 80 ASN H H 80 8.923 8.923 8.622 0.301 25033
3298 1 9 . 1 1 81 81 VAL N N 81 119.178 119.178 117.869 1.309 25033
3299 1 9 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.430 0.317 25033
3300 1 9 . 1 1 81 81 VAL C C 81 176.340 176.340 177.009 -0.669 25033
3301 1 9 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.159 1.001 25033
3302 1 9 . 1 1 81 81 VAL CB C 81 32.130 32.130 32.117 0.013 25033
3303 1 9 . 1 1 81 81 VAL H H 81 8.282 8.282 7.708 0.574 25033
3304 1 10 . 1 1 12 12 SER N N 12 116.112 116.112 114.104 2.008 25033
3305 1 10 . 1 1 12 12 SER C C 12 175.271 175.271 175.527 -0.256 25033
3306 1 10 . 1 1 12 12 SER CA C 12 58.570 58.570 59.859 -1.289 25033
3307 1 10 . 1 1 12 12 SER CB C 12 63.984 63.984 64.022 -0.038 25033
3308 1 10 . 1 1 12 12 SER H H 12 8.422 8.422 9.963 -1.541 25033
3309 1 10 . 1 1 13 13 GLY N N 13 111.178 111.178 111.457 -0.279 25033
3310 1 10 . 1 1 13 13 GLY C C 13 174.238 174.238 173.701 0.537 25033
3311 1 10 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.884 0.636 25033
3312 1 10 . 1 1 13 13 GLY H H 13 8.537 8.537 8.009 0.528 25033
3313 1 10 . 1 1 14 14 GLU N N 14 120.547 120.547 120.346 0.201 25033
3314 1 10 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.487 -0.220 25033
3315 1 10 . 1 1 14 14 GLU C C 14 176.455 176.455 176.389 0.066 25033
3316 1 10 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.921 0.832 25033
3317 1 10 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.998 0.466 25033
3318 1 10 . 1 1 14 14 GLU H H 14 8.285 8.285 8.566 -0.281 25033
3319 1 10 . 1 1 15 15 GLN N N 15 121.185 121.185 124.341 -3.156 25033
3320 1 10 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.164 0.185 25033
3321 1 10 . 1 1 15 15 GLN C C 15 175.494 175.494 174.993 0.501 25033
3322 1 10 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.939 -0.269 25033
3323 1 10 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.349 0.061 25033
3324 1 10 . 1 1 15 15 GLN H H 15 8.444 8.444 8.550 -0.105 25033
3325 1 10 . 1 1 16 16 LEU N N 16 123.934 123.934 124.293 -0.359 25033
3326 1 10 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.569 -0.228 25033
3327 1 10 . 1 1 16 16 LEU C C 16 176.942 176.942 175.253 1.689 25033
3328 1 10 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.611 0.893 25033
3329 1 10 . 1 1 16 16 LEU CB C 16 42.519 42.519 42.570 -0.051 25033
3330 1 10 . 1 1 16 16 LEU H H 16 8.289 8.289 8.487 -0.198 25033
3331 1 10 . 1 1 17 17 ARG N N 17 122.044 122.044 121.637 0.407 25033
3332 1 10 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.397 0.067 25033
3333 1 10 . 1 1 17 17 ARG C C 17 175.829 175.829 175.575 0.254 25033
3334 1 10 . 1 1 17 17 ARG CA C 17 55.672 55.672 55.214 0.458 25033
3335 1 10 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.639 -0.809 25033
3336 1 10 . 1 1 17 17 ARG H H 17 8.216 8.216 8.395 -0.179 25033
3337 1 10 . 1 1 18 18 GLN N N 18 122.488 122.488 123.726 -1.238 25033
3338 1 10 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.464 -0.130 25033
3339 1 10 . 1 1 18 18 GLN C C 18 172.958 172.958 173.145 -0.187 25033
3340 1 10 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.522 0.379 25033
3341 1 10 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.643 -0.023 25033
3342 1 10 . 1 1 18 18 GLN H H 18 8.573 8.573 8.171 0.402 25033
3343 1 10 . 1 1 19 19 GLN N N 19 116.301 116.301 119.511 -3.210 25033
3344 1 10 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.024 0.354 25033
3345 1 10 . 1 1 19 19 GLN C C 19 176.902 176.902 174.120 2.782 25033
3346 1 10 . 1 1 19 19 GLN CA C 19 54.215 54.215 53.999 0.216 25033
3347 1 10 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.179 1.459 25033
3348 1 10 . 1 1 19 19 GLN H H 19 8.146 8.146 8.328 -0.182 25033
3349 1 10 . 1 1 20 20 GLY N N 20 109.745 109.745 107.118 2.627 25033
3350 1 10 . 1 1 20 20 GLY C C 20 170.989 170.989 173.051 -2.062 25033
3351 1 10 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.061 1.874 25033
3352 1 10 . 1 1 20 20 GLY H H 20 8.998 8.998 8.075 0.923 25033
3353 1 10 . 1 1 21 21 THR N N 21 112.645 112.645 113.468 -0.823 25033
3354 1 10 . 1 1 21 21 THR HA H 21 5.361 5.361 5.308 0.053 25033
3355 1 10 . 1 1 21 21 THR C C 21 174.553 174.553 176.325 -1.772 25033
3356 1 10 . 1 1 21 21 THR CA C 21 60.025 60.025 59.814 0.211 25033
3357 1 10 . 1 1 21 21 THR CB C 21 71.720 71.720 71.693 0.027 25033
3358 1 10 . 1 1 21 21 THR H H 21 8.312 8.312 7.994 0.318 25033
3359 1 10 . 1 1 22 22 VAL N N 22 125.915 125.915 123.419 2.496 25033
3360 1 10 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.796 -0.147 25033
3361 1 10 . 1 1 22 22 VAL C C 22 175.553 175.553 177.817 -2.264 25033
3362 1 10 . 1 1 22 22 VAL CA C 22 64.618 64.618 65.865 -1.247 25033
3363 1 10 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.607 0.014 25033
3364 1 10 . 1 1 22 22 VAL H H 22 9.092 9.092 8.245 0.847 25033
3365 1 10 . 1 1 23 23 LYS N N 23 135.790 135.790 121.033 14.757 25033
3366 1 10 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.143 0.158 25033
3367 1 10 . 1 1 23 23 LYS C C 23 176.301 176.301 176.726 -0.425 25033
3368 1 10 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.882 -0.272 25033
3369 1 10 . 1 1 23 23 LYS CB C 23 34.300 34.300 32.267 2.033 25033
3370 1 10 . 1 1 23 23 LYS H H 23 9.276 9.276 8.552 0.724 25033
3371 1 10 . 1 1 24 24 TRP N N 24 111.651 111.651 118.433 -6.782 25033
3372 1 10 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.817 -0.194 25033
3373 1 10 . 1 1 24 24 TRP C C 24 173.628 173.628 174.713 -1.085 25033
3374 1 10 . 1 1 24 24 TRP CA C 24 56.300 56.300 56.332 -0.032 25033
3375 1 10 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.184 2.076 25033
3376 1 10 . 1 1 24 24 TRP H H 24 7.455 7.455 7.786 -0.331 25033
3377 1 10 . 1 1 25 25 PHE N N 25 121.305 121.305 119.931 1.374 25033
3378 1 10 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.846 -0.561 25033
3379 1 10 . 1 1 25 25 PHE C C 25 172.354 172.354 174.502 -2.148 25033
3380 1 10 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.201 2.171 25033
3381 1 10 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.562 0.007 25033
3382 1 10 . 1 1 25 25 PHE H H 25 9.074 9.074 8.151 0.923 25033
3383 1 10 . 1 1 26 26 ASN N N 26 126.976 126.976 124.174 2.802 25033
3384 1 10 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.912 -0.100 25033
3385 1 10 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.488 -1.076 25033
3386 1 10 . 1 1 26 26 ASN CB C 26 39.086 39.086 40.109 -1.023 25033
3387 1 10 . 1 1 26 26 ASN H H 26 8.159 8.159 8.171 -0.012 25033
3388 1 10 . 1 1 27 27 ALA N N 27 128.245 128.245 126.542 1.703 25033
3389 1 10 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.027 0.094 25033
3390 1 10 . 1 1 27 27 ALA C C 27 179.031 179.031 178.901 0.130 25033
3391 1 10 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.059 -0.633 25033
3392 1 10 . 1 1 27 27 ALA CB C 27 18.374 18.374 19.141 -0.767 25033
3393 1 10 . 1 1 27 27 ALA H H 27 9.036 9.036 8.613 0.423 25033
3394 1 10 . 1 1 28 28 THR N N 28 113.994 113.994 113.722 0.272 25033
3395 1 10 . 1 1 28 28 THR HA H 28 4.068 4.068 4.017 0.051 25033
3396 1 10 . 1 1 28 28 THR C C 28 176.084 176.084 175.860 0.224 25033
3397 1 10 . 1 1 28 28 THR CA C 28 65.820 65.820 64.980 0.840 25033
3398 1 10 . 1 1 28 28 THR CB C 28 68.291 68.291 68.134 0.157 25033
3399 1 10 . 1 1 28 28 THR H H 28 8.065 8.065 8.374 -0.309 25033
3400 1 10 . 1 1 29 29 LYS N N 29 118.922 118.922 119.998 -1.076 25033
3401 1 10 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.340 -0.084 25033
3402 1 10 . 1 1 29 29 LYS C C 29 177.201 177.201 177.263 -0.062 25033
3403 1 10 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.504 0.384 25033
3404 1 10 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.680 1.060 25033
3405 1 10 . 1 1 29 29 LYS H H 29 7.446 7.446 8.001 -0.555 25033
3406 1 10 . 1 1 30 30 GLY N N 30 107.601 107.601 106.659 0.942 25033
3407 1 10 . 1 1 30 30 GLY C C 30 172.004 172.004 172.943 -0.939 25033
3408 1 10 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.122 1.282 25033
3409 1 10 . 1 1 30 30 GLY H H 30 8.115 8.115 7.802 0.313 25033
3410 1 10 . 1 1 31 31 PHE N N 31 112.488 112.488 118.857 -6.369 25033
3411 1 10 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.709 0.298 25033
3412 1 10 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.341 -2.063 25033
3413 1 10 . 1 1 31 31 PHE CB C 31 42.388 42.388 41.290 1.098 25033
3414 1 10 . 1 1 31 31 PHE H H 31 6.594 6.594 7.551 -0.957 25033
3415 1 10 . 1 1 32 32 GLY N N 32 105.986 105.986 109.278 -3.292 25033
3416 1 10 . 1 1 32 32 GLY C C 32 170.292 170.292 171.606 -1.314 25033
3417 1 10 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.063 2.306 25033
3418 1 10 . 1 1 32 32 GLY H H 32 8.144 8.144 7.858 0.286 25033
3419 1 10 . 1 1 33 33 PHE N N 33 115.319 115.319 115.669 -0.350 25033
3420 1 10 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.219 0.244 25033
3421 1 10 . 1 1 33 33 PHE C C 33 175.037 175.037 175.153 -0.116 25033
3422 1 10 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.324 -1.029 25033
3423 1 10 . 1 1 33 33 PHE CB C 33 44.792 44.792 43.989 0.803 25033
3424 1 10 . 1 1 33 33 PHE H H 33 7.971 7.971 7.894 0.077 25033
3425 1 10 . 1 1 34 34 ILE N N 34 122.140 122.140 121.914 0.226 25033
3426 1 10 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.653 -0.336 25033
3427 1 10 . 1 1 34 34 ILE C C 34 174.526 174.526 175.430 -0.904 25033
3428 1 10 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.708 0.089 25033
3429 1 10 . 1 1 34 34 ILE CB C 34 42.583 42.583 39.739 2.844 25033
3430 1 10 . 1 1 34 34 ILE H H 34 9.511 9.511 8.508 1.003 25033
3431 1 10 . 1 1 35 35 THR N N 35 126.580 126.580 119.173 7.407 25033
3432 1 10 . 1 1 35 35 THR HA H 35 5.143 5.143 4.856 0.287 25033
3433 1 10 . 1 1 35 35 THR CA C 35 59.330 59.330 58.674 0.656 25033
3434 1 10 . 1 1 35 35 THR CB C 35 70.258 70.258 68.729 1.529 25033
3435 1 10 . 1 1 35 35 THR H H 35 9.416 9.416 8.698 0.718 25033
3436 1 10 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.628 -0.029 25033
3437 1 10 . 1 1 36 36 PRO C C 36 177.390 177.390 177.854 -0.464 25033
3438 1 10 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.092 0.128 25033
3439 1 10 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.169 0.301 25033
3440 1 10 . 1 1 37 37 GLY N N 37 112.033 112.033 110.911 1.122 25033
3441 1 10 . 1 1 37 37 GLY C C 37 169.261 169.261 174.538 -5.277 25033
3442 1 10 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.719 1.738 25033
3443 1 10 . 1 1 37 37 GLY H H 37 9.349 9.349 8.694 0.655 25033
3444 1 10 . 1 1 38 38 GLY N N 38 109.050 109.050 108.968 0.082 25033
3445 1 10 . 1 1 38 38 GLY C C 38 175.177 175.177 174.575 0.602 25033
3446 1 10 . 1 1 38 38 GLY H H 38 8.756 8.756 7.990 0.766 25033
3447 1 10 . 1 1 39 39 GLY N N 39 107.730 107.730 106.660 1.070 25033
3448 1 10 . 1 1 39 39 GLY C C 39 173.870 173.870 173.854 0.016 25033
3449 1 10 . 1 1 39 39 GLY CA C 39 44.258 44.258 44.495 -0.237 25033
3450 1 10 . 1 1 39 39 GLY H H 39 7.725 7.725 8.078 -0.353 25033
3451 1 10 . 1 1 40 40 GLY N N 40 107.183 107.183 111.101 -3.918 25033
3452 1 10 . 1 1 40 40 GLY C C 40 173.067 173.067 173.726 -0.659 25033
3453 1 10 . 1 1 40 40 GLY CA C 40 43.760 43.760 45.871 -2.111 25033
3454 1 10 . 1 1 40 40 GLY H H 40 8.096 8.096 8.035 0.061 25033
3455 1 10 . 1 1 41 41 GLU N N 41 119.455 119.455 122.105 -2.650 25033
3456 1 10 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.617 -0.439 25033
3457 1 10 . 1 1 41 41 GLU C C 41 175.900 175.900 174.866 1.034 25033
3458 1 10 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.598 0.779 25033
3459 1 10 . 1 1 41 41 GLU CB C 41 30.600 30.600 32.042 -1.442 25033
3460 1 10 . 1 1 41 41 GLU H H 41 8.199 8.199 8.533 -0.334 25033
3461 1 10 . 1 1 42 42 ASP N N 42 119.784 119.784 122.099 -2.315 25033
3462 1 10 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.347 -0.490 25033
3463 1 10 . 1 1 42 42 ASP C C 42 176.474 176.474 175.903 0.571 25033
3464 1 10 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.148 2.293 25033
3465 1 10 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.582 -0.094 25033
3466 1 10 . 1 1 42 42 ASP H H 42 8.277 8.277 8.262 0.015 25033
3467 1 10 . 1 1 43 43 LEU N N 43 122.515 122.515 118.690 3.825 25033
3468 1 10 . 1 1 43 43 LEU HA H 43 4.687 4.687 5.022 -0.335 25033
3469 1 10 . 1 1 43 43 LEU C C 43 175.759 175.759 175.938 -0.179 25033
3470 1 10 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.849 -0.545 25033
3471 1 10 . 1 1 43 43 LEU CB C 43 45.449 45.449 44.016 1.433 25033
3472 1 10 . 1 1 43 43 LEU H H 43 9.423 9.423 8.196 1.227 25033
3473 1 10 . 1 1 44 44 PHE N N 44 125.962 125.962 119.066 6.896 25033
3474 1 10 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.890 -0.968 25033
3475 1 10 . 1 1 44 44 PHE C C 44 172.844 172.844 176.212 -3.368 25033
3476 1 10 . 1 1 44 44 PHE CA C 44 57.880 57.880 58.143 -0.263 25033
3477 1 10 . 1 1 44 44 PHE CB C 44 40.350 40.350 40.057 0.293 25033
3478 1 10 . 1 1 44 44 PHE H H 44 8.465 8.465 8.606 -0.141 25033
3479 1 10 . 1 1 45 45 VAL N N 45 123.552 123.552 123.234 0.318 25033
3480 1 10 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.462 0.195 25033
3481 1 10 . 1 1 45 45 VAL C C 45 177.433 177.433 173.497 3.936 25033
3482 1 10 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.306 -1.845 25033
3483 1 10 . 1 1 45 45 VAL CB C 45 34.884 34.884 36.359 -1.475 25033
3484 1 10 . 1 1 45 45 VAL H H 45 7.715 7.715 8.131 -0.416 25033
3485 1 10 . 1 1 46 46 HIS N N 46 127.300 127.300 126.381 0.919 25033
3486 1 10 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.654 0.171 25033
3487 1 10 . 1 1 46 46 HIS C C 46 176.469 176.469 174.274 2.195 25033
3488 1 10 . 1 1 46 46 HIS CA C 46 55.929 55.929 54.519 1.410 25033
3489 1 10 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.306 3.093 25033
3490 1 10 . 1 1 46 46 HIS H H 46 9.104 9.104 8.522 0.582 25033
3491 1 10 . 1 1 47 47 GLN N N 47 125.105 125.105 126.059 -0.954 25033
3492 1 10 . 1 1 47 47 GLN H H 47 8.352 8.352 8.206 0.146 25033
3493 1 10 . 1 1 48 48 THR HA H 48 4.310 4.310 4.352 -0.042 25033
3494 1 10 . 1 1 48 48 THR C C 48 175.568 175.568 174.825 0.743 25033
3495 1 10 . 1 1 48 48 THR CA C 48 64.770 64.770 62.893 1.877 25033
3496 1 10 . 1 1 48 48 THR CB C 48 70.054 70.054 69.669 0.385 25033
3497 1 10 . 1 1 49 49 ASN N N 49 118.142 118.142 118.353 -0.211 25033
3498 1 10 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.785 0.375 25033
3499 1 10 . 1 1 49 49 ASN C C 49 172.914 172.914 173.299 -0.385 25033
3500 1 10 . 1 1 49 49 ASN CA C 49 54.351 54.351 52.815 1.536 25033
3501 1 10 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.514 1.013 25033
3502 1 10 . 1 1 49 49 ASN H H 49 8.452 8.452 8.520 -0.068 25033
3503 1 10 . 1 1 50 50 ILE N N 50 119.226 119.226 121.662 -2.436 25033
3504 1 10 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.332 -0.220 25033
3505 1 10 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.275 1.331 25033
3506 1 10 . 1 1 50 50 ILE CB C 50 38.362 38.362 37.287 1.075 25033
3507 1 10 . 1 1 50 50 ILE H H 50 7.354 7.354 7.891 -0.537 25033
3508 1 10 . 1 1 51 51 ASN N N 51 128.460 128.460 122.812 5.648 25033
3509 1 10 . 1 1 51 51 ASN C C 51 174.614 174.614 173.800 0.814 25033
3510 1 10 . 1 1 51 51 ASN H H 51 9.266 9.266 8.082 1.184 25033
3511 1 10 . 1 1 52 52 SER N N 52 117.246 117.246 114.244 3.002 25033
3512 1 10 . 1 1 52 52 SER HA H 52 4.413 4.413 4.639 -0.226 25033
3513 1 10 . 1 1 52 52 SER C C 52 174.139 174.139 174.759 -0.620 25033
3514 1 10 . 1 1 52 52 SER CA C 52 58.378 58.378 57.351 1.027 25033
3515 1 10 . 1 1 52 52 SER CB C 52 64.371 64.371 65.125 -0.754 25033
3516 1 10 . 1 1 52 52 SER H H 52 7.973 7.973 8.148 -0.175 25033
3517 1 10 . 1 1 53 53 GLU N N 53 123.628 123.628 120.477 3.151 25033
3518 1 10 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.257 0.041 25033
3519 1 10 . 1 1 53 53 GLU C C 53 176.960 176.960 176.452 0.508 25033
3520 1 10 . 1 1 53 53 GLU CA C 53 57.270 57.270 57.168 0.102 25033
3521 1 10 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.846 0.015 25033
3522 1 10 . 1 1 53 53 GLU H H 53 8.641 8.641 8.953 -0.312 25033
3523 1 10 . 1 1 54 54 GLY N N 54 110.282 110.282 107.137 3.145 25033
3524 1 10 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.890 -0.290 25033
3525 1 10 . 1 1 54 54 GLY H H 54 8.225 8.225 7.854 0.371 25033
3526 1 10 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.787 0.033 25033
3527 1 10 . 1 1 55 55 PHE C C 55 175.836 175.836 174.964 0.872 25033
3528 1 10 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.445 -4.755 25033
3529 1 10 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.150 -3.055 25033
3530 1 10 . 1 1 56 56 ARG N N 56 120.907 120.907 125.181 -4.274 25033
3531 1 10 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.668 -0.404 25033
3532 1 10 . 1 1 56 56 ARG C C 56 175.618 175.618 176.041 -0.423 25033
3533 1 10 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.449 0.061 25033
3534 1 10 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.164 0.856 25033
3535 1 10 . 1 1 56 56 ARG H H 56 8.153 8.153 8.689 -0.536 25033
3536 1 10 . 1 1 57 57 SER N N 57 123.117 123.117 119.443 3.674 25033
3537 1 10 . 1 1 57 57 SER H H 57 7.834 7.834 8.531 -0.697 25033
3538 1 10 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.881 -0.601 25033
3539 1 10 . 1 1 58 58 LEU C C 58 174.842 174.842 175.574 -0.732 25033
3540 1 10 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.341 -0.581 25033
3541 1 10 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.847 -1.267 25033
3542 1 10 . 1 1 59 59 ARG N N 59 119.557 119.557 119.876 -0.319 25033
3543 1 10 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.564 0.021 25033
3544 1 10 . 1 1 59 59 ARG C C 59 175.256 175.256 175.082 0.174 25033
3545 1 10 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.570 -0.458 25033
3546 1 10 . 1 1 59 59 ARG CB C 59 32.970 32.970 33.886 -0.916 25033
3547 1 10 . 1 1 59 59 ARG H H 59 8.529 8.529 8.486 0.043 25033
3548 1 10 . 1 1 60 60 GLU N N 60 121.597 121.597 121.505 0.092 25033
3549 1 10 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.239 -0.658 25033
3550 1 10 . 1 1 60 60 GLU C C 60 177.281 177.281 176.780 0.501 25033
3551 1 10 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.715 0.586 25033
3552 1 10 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.477 -0.216 25033
3553 1 10 . 1 1 60 60 GLU H H 60 8.691 8.691 8.710 -0.019 25033
3554 1 10 . 1 1 61 61 GLY N N 61 113.554 113.554 111.988 1.566 25033
3555 1 10 . 1 1 61 61 GLY C C 61 174.068 174.068 174.605 -0.537 25033
3556 1 10 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.709 0.534 25033
3557 1 10 . 1 1 61 61 GLY H H 61 9.151 9.151 8.914 0.237 25033
3558 1 10 . 1 1 62 62 GLU N N 62 121.639 121.639 122.263 -0.624 25033
3559 1 10 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.273 -0.069 25033
3560 1 10 . 1 1 62 62 GLU C C 62 175.439 175.439 175.916 -0.477 25033
3561 1 10 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.937 0.405 25033
3562 1 10 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.530 0.395 25033
3563 1 10 . 1 1 62 62 GLU H H 62 7.889 7.889 7.664 0.225 25033
3564 1 10 . 1 1 63 63 VAL N N 63 125.003 125.003 125.727 -0.724 25033
3565 1 10 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.870 -0.122 25033
3566 1 10 . 1 1 63 63 VAL C C 63 176.639 176.639 175.669 0.970 25033
3567 1 10 . 1 1 63 63 VAL CA C 63 62.631 62.631 60.273 2.358 25033
3568 1 10 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.975 -0.618 25033
3569 1 10 . 1 1 63 63 VAL H H 63 8.477 8.477 8.175 0.302 25033
3570 1 10 . 1 1 64 64 VAL N N 64 120.113 120.113 122.787 -2.674 25033
3571 1 10 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.653 0.351 25033
3572 1 10 . 1 1 64 64 VAL C C 64 173.790 173.790 174.147 -0.357 25033
3573 1 10 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.150 -0.541 25033
3574 1 10 . 1 1 64 64 VAL CB C 64 36.360 36.360 34.994 1.366 25033
3575 1 10 . 1 1 64 64 VAL H H 64 8.686 8.686 8.969 -0.283 25033
3576 1 10 . 1 1 65 65 GLU N N 65 120.433 120.433 119.929 0.504 25033
3577 1 10 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.405 0.042 25033
3578 1 10 . 1 1 65 65 GLU C C 65 175.584 175.584 175.091 0.493 25033
3579 1 10 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.760 -0.370 25033
3580 1 10 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.680 0.323 25033
3581 1 10 . 1 1 65 65 GLU H H 65 9.003 9.003 7.761 1.242 25033
3582 1 10 . 1 1 66 66 PHE N N 66 116.104 116.104 118.890 -2.786 25033
3583 1 10 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.003 0.058 25033
3584 1 10 . 1 1 66 66 PHE C C 66 173.001 173.001 172.740 0.261 25033
3585 1 10 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.948 -0.091 25033
3586 1 10 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.236 0.196 25033
3587 1 10 . 1 1 66 66 PHE H H 66 8.172 8.172 8.186 -0.014 25033
3588 1 10 . 1 1 67 67 GLU N N 67 117.574 117.574 117.566 0.008 25033
3589 1 10 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.156 -0.284 25033
3590 1 10 . 1 1 67 67 GLU C C 67 175.327 175.327 175.786 -0.459 25033
3591 1 10 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.240 0.401 25033
3592 1 10 . 1 1 67 67 GLU CB C 67 33.020 33.020 32.909 0.111 25033
3593 1 10 . 1 1 67 67 GLU H H 67 8.668 8.668 8.646 0.022 25033
3594 1 10 . 1 1 68 68 VAL N N 68 120.881 120.881 121.727 -0.846 25033
3595 1 10 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.413 0.599 25033
3596 1 10 . 1 1 68 68 VAL C C 68 176.140 176.140 176.079 0.061 25033
3597 1 10 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.841 -0.503 25033
3598 1 10 . 1 1 68 68 VAL CB C 68 34.006 34.006 31.980 2.026 25033
3599 1 10 . 1 1 68 68 VAL H H 68 8.748 8.748 8.615 0.133 25033
3600 1 10 . 1 1 69 69 GLU N N 69 128.110 128.110 128.333 -0.223 25033
3601 1 10 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.666 0.039 25033
3602 1 10 . 1 1 69 69 GLU C C 69 174.573 174.573 174.845 -0.272 25033
3603 1 10 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.840 0.113 25033
3604 1 10 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.243 1.047 25033
3605 1 10 . 1 1 69 69 GLU H H 69 9.070 9.070 9.102 -0.032 25033
3606 1 10 . 1 1 70 70 ALA N N 70 127.944 127.944 129.834 -1.890 25033
3607 1 10 . 1 1 70 70 ALA HA H 70 5.004 5.004 4.772 0.232 25033
3608 1 10 . 1 1 70 70 ALA C C 70 178.073 178.073 177.092 0.981 25033
3609 1 10 . 1 1 70 70 ALA CA C 70 50.959 50.959 51.332 -0.373 25033
3610 1 10 . 1 1 70 70 ALA CB C 70 19.489 19.489 19.799 -0.310 25033
3611 1 10 . 1 1 70 70 ALA H H 70 8.671 8.671 8.686 -0.015 25033
3612 1 10 . 1 1 71 71 GLY N N 71 110.340 110.340 111.582 -1.242 25033
3613 1 10 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.364 0.652 25033
3614 1 10 . 1 1 71 71 GLY H H 71 8.445 8.445 8.219 0.226 25033
3615 1 10 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.430 -0.013 25033
3616 1 10 . 1 1 72 72 PRO C C 72 176.835 176.835 176.433 0.402 25033
3617 1 10 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.231 -0.070 25033
3618 1 10 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.745 0.134 25033
3619 1 10 . 1 1 73 73 ASP N N 73 116.498 116.498 118.128 -1.630 25033
3620 1 10 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.536 -0.021 25033
3621 1 10 . 1 1 73 73 ASP C C 73 176.775 176.775 177.241 -0.466 25033
3622 1 10 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.611 -1.064 25033
3623 1 10 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.648 -0.413 25033
3624 1 10 . 1 1 73 73 ASP H H 73 8.248 8.248 8.232 0.016 25033
3625 1 10 . 1 1 74 74 GLY N N 74 107.369 107.369 108.338 -0.969 25033
3626 1 10 . 1 1 74 74 GLY C C 74 174.331 174.331 173.223 1.108 25033
3627 1 10 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.930 0.648 25033
3628 1 10 . 1 1 74 74 GLY H H 74 8.153 8.153 7.767 0.386 25033
3629 1 10 . 1 1 75 75 ARG N N 75 120.942 120.942 119.884 1.058 25033
3630 1 10 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.663 -0.121 25033
3631 1 10 . 1 1 75 75 ARG C C 75 176.652 176.652 175.023 1.629 25033
3632 1 10 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.232 0.426 25033
3633 1 10 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.485 -0.576 25033
3634 1 10 . 1 1 75 75 ARG H H 75 7.670 7.670 8.009 -0.339 25033
3635 1 10 . 1 1 76 76 SER N N 76 120.181 120.181 117.763 2.418 25033
3636 1 10 . 1 1 76 76 SER HA H 76 5.035 5.035 5.474 -0.439 25033
3637 1 10 . 1 1 76 76 SER C C 76 172.816 172.816 174.136 -1.320 25033
3638 1 10 . 1 1 76 76 SER CA C 76 59.080 59.080 57.401 1.679 25033
3639 1 10 . 1 1 76 76 SER CB C 76 64.850 64.850 65.449 -0.599 25033
3640 1 10 . 1 1 76 76 SER H H 76 8.808 8.808 8.453 0.355 25033
3641 1 10 . 1 1 77 77 LYS N N 77 121.202 121.202 122.605 -1.403 25033
3642 1 10 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.765 0.409 25033
3643 1 10 . 1 1 77 77 LYS C C 77 173.706 173.706 174.713 -1.007 25033
3644 1 10 . 1 1 77 77 LYS CA C 77 54.599 54.599 54.444 0.155 25033
3645 1 10 . 1 1 77 77 LYS CB C 77 36.035 36.035 36.106 -0.071 25033
3646 1 10 . 1 1 77 77 LYS H H 77 8.982 8.982 8.809 0.173 25033
3647 1 10 . 1 1 78 78 ALA N N 78 124.064 124.064 123.725 0.339 25033
3648 1 10 . 1 1 78 78 ALA HA H 78 5.004 5.004 5.181 -0.177 25033
3649 1 10 . 1 1 78 78 ALA C C 78 175.979 175.979 176.499 -0.520 25033
3650 1 10 . 1 1 78 78 ALA CA C 78 50.445 50.445 51.333 -0.888 25033
3651 1 10 . 1 1 78 78 ALA CB C 78 20.136 20.136 19.637 0.498 25033
3652 1 10 . 1 1 78 78 ALA H H 78 8.706 8.706 8.594 0.112 25033
3653 1 10 . 1 1 79 79 VAL N N 79 113.264 113.264 117.836 -4.572 25033
3654 1 10 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.408 0.435 25033
3655 1 10 . 1 1 79 79 VAL C C 79 174.744 174.744 174.587 0.157 25033
3656 1 10 . 1 1 79 79 VAL CA C 79 59.073 59.073 60.220 -1.147 25033
3657 1 10 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.492 0.104 25033
3658 1 10 . 1 1 79 79 VAL H H 79 9.165 9.165 7.693 1.472 25033
3659 1 10 . 1 1 80 80 ASN N N 80 120.084 120.084 115.832 4.252 25033
3660 1 10 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.481 -0.125 25033
3661 1 10 . 1 1 80 80 ASN C C 80 175.391 175.391 174.035 1.356 25033
3662 1 10 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.770 -0.036 25033
3663 1 10 . 1 1 80 80 ASN CB C 80 37.121 37.121 37.525 -0.404 25033
3664 1 10 . 1 1 80 80 ASN H H 80 8.923 8.923 8.490 0.433 25033
3665 1 10 . 1 1 81 81 VAL N N 81 119.178 119.178 118.061 1.117 25033
3666 1 10 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.784 -0.037 25033
3667 1 10 . 1 1 81 81 VAL C C 81 176.340 176.340 176.625 -0.285 25033
3668 1 10 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.063 1.097 25033
3669 1 10 . 1 1 81 81 VAL CB C 81 32.130 32.130 32.631 -0.501 25033
3670 1 10 . 1 1 81 81 VAL H H 81 8.282 8.282 7.657 0.625 25033
3671 1 11 . 1 1 12 12 SER N N 12 116.112 116.112 116.399 -0.287 25033
3672 1 11 . 1 1 12 12 SER C C 12 175.271 175.271 175.701 -0.430 25033
3673 1 11 . 1 1 12 12 SER CA C 12 58.570 58.570 58.498 0.072 25033
3674 1 11 . 1 1 12 12 SER CB C 12 63.984 63.984 63.815 0.169 25033
3675 1 11 . 1 1 12 12 SER H H 12 8.422 8.422 8.080 0.342 25033
3676 1 11 . 1 1 13 13 GLY N N 13 111.178 111.178 110.652 0.526 25033
3677 1 11 . 1 1 13 13 GLY C C 13 174.238 174.238 173.980 0.258 25033
3678 1 11 . 1 1 13 13 GLY CA C 13 45.520 45.520 45.002 0.518 25033
3679 1 11 . 1 1 13 13 GLY H H 13 8.537 8.537 8.773 -0.236 25033
3680 1 11 . 1 1 14 14 GLU N N 14 120.547 120.547 121.700 -1.153 25033
3681 1 11 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.649 -0.382 25033
3682 1 11 . 1 1 14 14 GLU C C 14 176.455 176.455 175.408 1.047 25033
3683 1 11 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.591 1.162 25033
3684 1 11 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.679 0.785 25033
3685 1 11 . 1 1 14 14 GLU H H 14 8.285 8.285 8.503 -0.218 25033
3686 1 11 . 1 1 15 15 GLN N N 15 121.185 121.185 120.927 0.258 25033
3687 1 11 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.700 -0.351 25033
3688 1 11 . 1 1 15 15 GLN C C 15 175.494 175.494 174.331 1.163 25033
3689 1 11 . 1 1 15 15 GLN CA C 15 55.670 55.670 54.095 1.575 25033
3690 1 11 . 1 1 15 15 GLN CB C 15 29.410 29.410 30.326 -0.916 25033
3691 1 11 . 1 1 15 15 GLN H H 15 8.444 8.444 8.454 -0.010 25033
3692 1 11 . 1 1 16 16 LEU N N 16 123.934 123.934 121.756 2.178 25033
3693 1 11 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.479 -0.138 25033
3694 1 11 . 1 1 16 16 LEU C C 16 176.942 176.942 175.750 1.192 25033
3695 1 11 . 1 1 16 16 LEU CA C 16 55.504 55.504 55.209 0.295 25033
3696 1 11 . 1 1 16 16 LEU CB C 16 42.519 42.519 44.220 -1.701 25033
3697 1 11 . 1 1 16 16 LEU H H 16 8.289 8.289 8.354 -0.065 25033
3698 1 11 . 1 1 17 17 ARG N N 17 122.044 122.044 124.060 -2.016 25033
3699 1 11 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.279 0.185 25033
3700 1 11 . 1 1 17 17 ARG C C 17 175.829 175.829 175.992 -0.163 25033
3701 1 11 . 1 1 17 17 ARG CA C 17 55.672 55.672 55.824 -0.152 25033
3702 1 11 . 1 1 17 17 ARG CB C 17 29.830 29.830 29.080 0.750 25033
3703 1 11 . 1 1 17 17 ARG H H 17 8.216 8.216 8.402 -0.186 25033
3704 1 11 . 1 1 18 18 GLN N N 18 122.488 122.488 124.413 -1.925 25033
3705 1 11 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.418 -0.084 25033
3706 1 11 . 1 1 18 18 GLN C C 18 172.958 172.958 173.599 -0.641 25033
3707 1 11 . 1 1 18 18 GLN CA C 18 54.900 54.900 53.802 1.098 25033
3708 1 11 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.221 0.399 25033
3709 1 11 . 1 1 18 18 GLN H H 18 8.573 8.573 7.770 0.803 25033
3710 1 11 . 1 1 19 19 GLN N N 19 116.301 116.301 120.365 -4.064 25033
3711 1 11 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.349 0.029 25033
3712 1 11 . 1 1 19 19 GLN C C 19 176.902 176.902 174.692 2.210 25033
3713 1 11 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.178 0.037 25033
3714 1 11 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.649 0.989 25033
3715 1 11 . 1 1 19 19 GLN H H 19 8.146 8.146 8.331 -0.185 25033
3716 1 11 . 1 1 20 20 GLY N N 20 109.745 109.745 109.616 0.129 25033
3717 1 11 . 1 1 20 20 GLY C C 20 170.989 170.989 172.592 -1.603 25033
3718 1 11 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.206 1.729 25033
3719 1 11 . 1 1 20 20 GLY H H 20 8.998 8.998 8.477 0.521 25033
3720 1 11 . 1 1 21 21 THR N N 21 112.645 112.645 113.851 -1.206 25033
3721 1 11 . 1 1 21 21 THR HA H 21 5.361 5.361 5.280 0.081 25033
3722 1 11 . 1 1 21 21 THR C C 21 174.553 174.553 175.576 -1.023 25033
3723 1 11 . 1 1 21 21 THR CA C 21 60.025 60.025 59.780 0.245 25033
3724 1 11 . 1 1 21 21 THR CB C 21 71.720 71.720 71.372 0.348 25033
3725 1 11 . 1 1 21 21 THR H H 21 8.312 8.312 8.095 0.217 25033
3726 1 11 . 1 1 22 22 VAL N N 22 125.915 125.915 120.454 5.461 25033
3727 1 11 . 1 1 22 22 VAL HA H 22 3.649 3.649 4.007 -0.358 25033
3728 1 11 . 1 1 22 22 VAL C C 22 175.553 175.553 177.952 -2.399 25033
3729 1 11 . 1 1 22 22 VAL CA C 22 64.618 64.618 63.192 1.426 25033
3730 1 11 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.364 0.257 25033
3731 1 11 . 1 1 22 22 VAL H H 22 9.092 9.092 8.341 0.751 25033
3732 1 11 . 1 1 23 23 LYS N N 23 135.790 135.790 119.755 16.035 25033
3733 1 11 . 1 1 23 23 LYS HA H 23 4.301 4.301 3.960 0.341 25033
3734 1 11 . 1 1 23 23 LYS C C 23 176.301 176.301 176.516 -0.215 25033
3735 1 11 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.894 -0.284 25033
3736 1 11 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.348 2.952 25033
3737 1 11 . 1 1 23 23 LYS H H 23 9.276 9.276 8.471 0.805 25033
3738 1 11 . 1 1 24 24 TRP N N 24 111.651 111.651 119.020 -7.369 25033
3739 1 11 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.867 -0.244 25033
3740 1 11 . 1 1 24 24 TRP C C 24 173.628 173.628 174.742 -1.114 25033
3741 1 11 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.390 0.910 25033
3742 1 11 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.982 1.278 25033
3743 1 11 . 1 1 24 24 TRP H H 24 7.455 7.455 7.596 -0.141 25033
3744 1 11 . 1 1 25 25 PHE N N 25 121.305 121.305 119.843 1.462 25033
3745 1 11 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.804 -0.519 25033
3746 1 11 . 1 1 25 25 PHE C C 25 172.354 172.354 173.976 -1.622 25033
3747 1 11 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.075 2.297 25033
3748 1 11 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.597 -0.028 25033
3749 1 11 . 1 1 25 25 PHE H H 25 9.074 9.074 8.131 0.943 25033
3750 1 11 . 1 1 26 26 ASN N N 26 126.976 126.976 123.831 3.145 25033
3751 1 11 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.750 0.062 25033
3752 1 11 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.264 -0.852 25033
3753 1 11 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.614 -0.527 25033
3754 1 11 . 1 1 26 26 ASN H H 26 8.159 8.159 7.962 0.197 25033
3755 1 11 . 1 1 27 27 ALA N N 27 128.245 128.245 127.537 0.708 25033
3756 1 11 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.022 0.099 25033
3757 1 11 . 1 1 27 27 ALA C C 27 179.031 179.031 178.979 0.052 25033
3758 1 11 . 1 1 27 27 ALA CA C 27 54.425 54.425 54.909 -0.484 25033
3759 1 11 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.811 -0.437 25033
3760 1 11 . 1 1 27 27 ALA H H 27 9.036 9.036 8.748 0.288 25033
3761 1 11 . 1 1 28 28 THR N N 28 113.994 113.994 113.319 0.675 25033
3762 1 11 . 1 1 28 28 THR HA H 28 4.068 4.068 3.900 0.168 25033
3763 1 11 . 1 1 28 28 THR C C 28 176.084 176.084 176.272 -0.188 25033
3764 1 11 . 1 1 28 28 THR CA C 28 65.820 65.820 64.820 1.000 25033
3765 1 11 . 1 1 28 28 THR CB C 28 68.291 68.291 68.609 -0.318 25033
3766 1 11 . 1 1 28 28 THR H H 28 8.065 8.065 8.065 0.000 25033
3767 1 11 . 1 1 29 29 LYS N N 29 118.922 118.922 118.351 0.571 25033
3768 1 11 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.035 0.221 25033
3769 1 11 . 1 1 29 29 LYS C C 29 177.201 177.201 177.078 0.123 25033
3770 1 11 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.082 0.806 25033
3771 1 11 . 1 1 29 29 LYS CB C 29 33.740 33.740 31.878 1.862 25033
3772 1 11 . 1 1 29 29 LYS H H 29 7.446 7.446 7.639 -0.193 25033
3773 1 11 . 1 1 30 30 GLY N N 30 107.601 107.601 107.161 0.440 25033
3774 1 11 . 1 1 30 30 GLY C C 30 172.004 172.004 173.170 -1.166 25033
3775 1 11 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.023 1.381 25033
3776 1 11 . 1 1 30 30 GLY H H 30 8.115 8.115 7.640 0.475 25033
3777 1 11 . 1 1 31 31 PHE N N 31 112.488 112.488 114.413 -1.925 25033
3778 1 11 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.477 0.530 25033
3779 1 11 . 1 1 31 31 PHE CA C 31 55.278 55.278 56.004 -0.726 25033
3780 1 11 . 1 1 31 31 PHE CB C 31 42.388 42.388 39.366 3.022 25033
3781 1 11 . 1 1 31 31 PHE H H 31 6.594 6.594 7.014 -0.420 25033
3782 1 11 . 1 1 32 32 GLY N N 32 105.986 105.986 107.860 -1.874 25033
3783 1 11 . 1 1 32 32 GLY C C 32 170.292 170.292 171.527 -1.235 25033
3784 1 11 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.233 2.136 25033
3785 1 11 . 1 1 32 32 GLY H H 32 8.144 8.144 7.784 0.360 25033
3786 1 11 . 1 1 33 33 PHE N N 33 115.319 115.319 116.458 -1.139 25033
3787 1 11 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.340 0.123 25033
3788 1 11 . 1 1 33 33 PHE C C 33 175.037 175.037 175.076 -0.039 25033
3789 1 11 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.351 -1.056 25033
3790 1 11 . 1 1 33 33 PHE CB C 33 44.792 44.792 43.973 0.819 25033
3791 1 11 . 1 1 33 33 PHE H H 33 7.971 7.971 7.959 0.012 25033
3792 1 11 . 1 1 34 34 ILE N N 34 122.140 122.140 122.627 -0.487 25033
3793 1 11 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.660 -0.343 25033
3794 1 11 . 1 1 34 34 ILE C C 34 174.526 174.526 175.571 -1.045 25033
3795 1 11 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.447 0.350 25033
3796 1 11 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.209 2.374 25033
3797 1 11 . 1 1 34 34 ILE H H 34 9.511 9.511 8.737 0.774 25033
3798 1 11 . 1 1 35 35 THR N N 35 126.580 126.580 119.168 7.412 25033
3799 1 11 . 1 1 35 35 THR HA H 35 5.143 5.143 4.913 0.230 25033
3800 1 11 . 1 1 35 35 THR CA C 35 59.330 59.330 58.443 0.888 25033
3801 1 11 . 1 1 35 35 THR CB C 35 70.258 70.258 68.263 1.995 25033
3802 1 11 . 1 1 35 35 THR H H 35 9.416 9.416 8.816 0.600 25033
3803 1 11 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.703 -0.104 25033
3804 1 11 . 1 1 36 36 PRO C C 36 177.390 177.390 177.755 -0.365 25033
3805 1 11 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.361 -0.141 25033
3806 1 11 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.050 0.420 25033
3807 1 11 . 1 1 37 37 GLY N N 37 112.033 112.033 110.407 1.626 25033
3808 1 11 . 1 1 37 37 GLY C C 37 169.261 169.261 174.880 -5.619 25033
3809 1 11 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.693 1.764 25033
3810 1 11 . 1 1 37 37 GLY H H 37 9.349 9.349 8.633 0.716 25033
3811 1 11 . 1 1 38 38 GLY N N 38 109.050 109.050 108.878 0.172 25033
3812 1 11 . 1 1 38 38 GLY C C 38 175.177 175.177 174.815 0.362 25033
3813 1 11 . 1 1 38 38 GLY H H 38 8.756 8.756 7.959 0.797 25033
3814 1 11 . 1 1 39 39 GLY N N 39 107.730 107.730 105.977 1.753 25033
3815 1 11 . 1 1 39 39 GLY C C 39 173.870 173.870 174.205 -0.335 25033
3816 1 11 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.210 -0.952 25033
3817 1 11 . 1 1 39 39 GLY H H 39 7.725 7.725 8.059 -0.334 25033
3818 1 11 . 1 1 40 40 GLY N N 40 107.183 107.183 109.697 -2.514 25033
3819 1 11 . 1 1 40 40 GLY C C 40 173.067 173.067 173.554 -0.487 25033
3820 1 11 . 1 1 40 40 GLY CA C 40 43.760 43.760 44.948 -1.188 25033
3821 1 11 . 1 1 40 40 GLY H H 40 8.096 8.096 8.117 -0.021 25033
3822 1 11 . 1 1 41 41 GLU N N 41 119.455 119.455 122.025 -2.570 25033
3823 1 11 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.548 -0.370 25033
3824 1 11 . 1 1 41 41 GLU C C 41 175.900 175.900 175.983 -0.083 25033
3825 1 11 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.164 1.213 25033
3826 1 11 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.379 0.221 25033
3827 1 11 . 1 1 41 41 GLU H H 41 8.199 8.199 8.554 -0.355 25033
3828 1 11 . 1 1 42 42 ASP N N 42 119.784 119.784 123.886 -4.102 25033
3829 1 11 . 1 1 42 42 ASP HA H 42 4.857 4.857 4.853 0.004 25033
3830 1 11 . 1 1 42 42 ASP C C 42 176.474 176.474 176.001 0.473 25033
3831 1 11 . 1 1 42 42 ASP CA C 42 55.441 55.441 54.565 0.876 25033
3832 1 11 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.460 0.028 25033
3833 1 11 . 1 1 42 42 ASP H H 42 8.277 8.277 8.468 -0.191 25033
3834 1 11 . 1 1 43 43 LEU N N 43 122.515 122.515 121.101 1.414 25033
3835 1 11 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.830 -0.143 25033
3836 1 11 . 1 1 43 43 LEU C C 43 175.759 175.759 176.434 -0.675 25033
3837 1 11 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.582 -0.278 25033
3838 1 11 . 1 1 43 43 LEU CB C 43 45.449 45.449 45.913 -0.463 25033
3839 1 11 . 1 1 43 43 LEU H H 43 9.423 9.423 8.684 0.739 25033
3840 1 11 . 1 1 44 44 PHE N N 44 125.962 125.962 120.168 5.794 25033
3841 1 11 . 1 1 44 44 PHE HA H 44 3.922 3.922 5.058 -1.136 25033
3842 1 11 . 1 1 44 44 PHE C C 44 172.844 172.844 174.631 -1.787 25033
3843 1 11 . 1 1 44 44 PHE CA C 44 57.880 57.880 56.744 1.136 25033
3844 1 11 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.961 0.389 25033
3845 1 11 . 1 1 44 44 PHE H H 44 8.465 8.465 8.288 0.177 25033
3846 1 11 . 1 1 45 45 VAL N N 45 123.552 123.552 123.009 0.543 25033
3847 1 11 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.413 0.244 25033
3848 1 11 . 1 1 45 45 VAL C C 45 177.433 177.433 173.586 3.847 25033
3849 1 11 . 1 1 45 45 VAL CA C 45 58.460 58.460 61.037 -2.577 25033
3850 1 11 . 1 1 45 45 VAL CB C 45 34.884 34.884 35.166 -0.282 25033
3851 1 11 . 1 1 45 45 VAL H H 45 7.715 7.715 8.158 -0.443 25033
3852 1 11 . 1 1 46 46 HIS N N 46 127.300 127.300 126.718 0.582 25033
3853 1 11 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.875 -0.050 25033
3854 1 11 . 1 1 46 46 HIS C C 46 176.469 176.469 173.967 2.502 25033
3855 1 11 . 1 1 46 46 HIS CA C 46 55.929 55.929 55.060 0.869 25033
3856 1 11 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.373 3.026 25033
3857 1 11 . 1 1 46 46 HIS H H 46 9.104 9.104 8.551 0.553 25033
3858 1 11 . 1 1 47 47 GLN N N 47 125.105 125.105 126.286 -1.181 25033
3859 1 11 . 1 1 47 47 GLN H H 47 8.352 8.352 8.507 -0.155 25033
3860 1 11 . 1 1 48 48 THR HA H 48 4.310 4.310 4.567 -0.257 25033
3861 1 11 . 1 1 48 48 THR C C 48 175.568 175.568 175.016 0.552 25033
3862 1 11 . 1 1 48 48 THR CA C 48 64.770 64.770 62.978 1.792 25033
3863 1 11 . 1 1 48 48 THR CB C 48 70.054 70.054 69.971 0.083 25033
3864 1 11 . 1 1 49 49 ASN N N 49 118.142 118.142 119.172 -1.030 25033
3865 1 11 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.934 0.226 25033
3866 1 11 . 1 1 49 49 ASN C C 49 172.914 172.914 173.967 -1.053 25033
3867 1 11 . 1 1 49 49 ASN CA C 49 54.351 54.351 52.885 1.466 25033
3868 1 11 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.805 0.722 25033
3869 1 11 . 1 1 49 49 ASN H H 49 8.452 8.452 8.507 -0.055 25033
3870 1 11 . 1 1 50 50 ILE N N 50 119.226 119.226 122.682 -3.456 25033
3871 1 11 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.230 -0.118 25033
3872 1 11 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.648 0.958 25033
3873 1 11 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.736 1.626 25033
3874 1 11 . 1 1 50 50 ILE H H 50 7.354 7.354 7.731 -0.377 25033
3875 1 11 . 1 1 51 51 ASN N N 51 128.460 128.460 123.405 5.055 25033
3876 1 11 . 1 1 51 51 ASN C C 51 174.614 174.614 174.307 0.307 25033
3877 1 11 . 1 1 51 51 ASN H H 51 9.266 9.266 7.952 1.314 25033
3878 1 11 . 1 1 52 52 SER N N 52 117.246 117.246 119.091 -1.845 25033
3879 1 11 . 1 1 52 52 SER HA H 52 4.413 4.413 4.446 -0.033 25033
3880 1 11 . 1 1 52 52 SER C C 52 174.139 174.139 175.417 -1.278 25033
3881 1 11 . 1 1 52 52 SER CA C 52 58.378 58.378 58.408 -0.030 25033
3882 1 11 . 1 1 52 52 SER CB C 52 64.371 64.371 64.284 0.087 25033
3883 1 11 . 1 1 52 52 SER H H 52 7.973 7.973 8.416 -0.443 25033
3884 1 11 . 1 1 53 53 GLU N N 53 123.628 123.628 124.684 -1.056 25033
3885 1 11 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.205 0.093 25033
3886 1 11 . 1 1 53 53 GLU C C 53 176.960 176.960 176.568 0.392 25033
3887 1 11 . 1 1 53 53 GLU CA C 53 57.270 57.270 57.620 -0.350 25033
3888 1 11 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.924 -0.063 25033
3889 1 11 . 1 1 53 53 GLU H H 53 8.641 8.641 8.630 0.011 25033
3890 1 11 . 1 1 54 54 GLY N N 54 110.282 110.282 107.940 2.342 25033
3891 1 11 . 1 1 54 54 GLY CA C 54 44.600 44.600 45.053 -0.453 25033
3892 1 11 . 1 1 54 54 GLY H H 54 8.225 8.225 7.676 0.549 25033
3893 1 11 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.751 0.069 25033
3894 1 11 . 1 1 55 55 PHE C C 55 175.836 175.836 174.801 1.035 25033
3895 1 11 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.364 -4.674 25033
3896 1 11 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.840 -3.745 25033
3897 1 11 . 1 1 56 56 ARG N N 56 120.907 120.907 122.282 -1.375 25033
3898 1 11 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.690 -0.426 25033
3899 1 11 . 1 1 56 56 ARG C C 56 175.618 175.618 175.259 0.359 25033
3900 1 11 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.779 -0.269 25033
3901 1 11 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.588 0.432 25033
3902 1 11 . 1 1 56 56 ARG H H 56 8.153 8.153 8.657 -0.504 25033
3903 1 11 . 1 1 57 57 SER N N 57 123.117 123.117 119.121 3.996 25033
3904 1 11 . 1 1 57 57 SER H H 57 7.834 7.834 8.469 -0.635 25033
3905 1 11 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.611 -0.331 25033
3906 1 11 . 1 1 58 58 LEU C C 58 174.842 174.842 176.522 -1.680 25033
3907 1 11 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.220 -0.460 25033
3908 1 11 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.466 -0.886 25033
3909 1 11 . 1 1 59 59 ARG N N 59 119.557 119.557 122.600 -3.043 25033
3910 1 11 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.515 0.070 25033
3911 1 11 . 1 1 59 59 ARG C C 59 175.256 175.256 176.034 -0.778 25033
3912 1 11 . 1 1 59 59 ARG CA C 59 54.112 54.112 55.191 -1.079 25033
3913 1 11 . 1 1 59 59 ARG CB C 59 32.970 32.970 32.557 0.413 25033
3914 1 11 . 1 1 59 59 ARG H H 59 8.529 8.529 8.742 -0.213 25033
3915 1 11 . 1 1 60 60 GLU N N 60 121.597 121.597 119.796 1.801 25033
3916 1 11 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.095 -0.514 25033
3917 1 11 . 1 1 60 60 GLU C C 60 177.281 177.281 176.593 0.688 25033
3918 1 11 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.115 1.186 25033
3919 1 11 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.904 -0.643 25033
3920 1 11 . 1 1 60 60 GLU H H 60 8.691 8.691 8.523 0.168 25033
3921 1 11 . 1 1 61 61 GLY N N 61 113.554 113.554 110.939 2.615 25033
3922 1 11 . 1 1 61 61 GLY C C 61 174.068 174.068 174.149 -0.081 25033
3923 1 11 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.695 0.548 25033
3924 1 11 . 1 1 61 61 GLY H H 61 9.151 9.151 8.630 0.521 25033
3925 1 11 . 1 1 62 62 GLU N N 62 121.639 121.639 122.312 -0.673 25033
3926 1 11 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.191 0.013 25033
3927 1 11 . 1 1 62 62 GLU C C 62 175.439 175.439 175.870 -0.431 25033
3928 1 11 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.555 0.787 25033
3929 1 11 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.511 0.414 25033
3930 1 11 . 1 1 62 62 GLU H H 62 7.889 7.889 7.620 0.269 25033
3931 1 11 . 1 1 63 63 VAL N N 63 125.003 125.003 124.539 0.464 25033
3932 1 11 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.704 0.044 25033
3933 1 11 . 1 1 63 63 VAL C C 63 176.639 176.639 176.597 0.042 25033
3934 1 11 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.476 1.155 25033
3935 1 11 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.491 -0.134 25033
3936 1 11 . 1 1 63 63 VAL H H 63 8.477 8.477 8.254 0.223 25033
3937 1 11 . 1 1 64 64 VAL N N 64 120.113 120.113 119.858 0.255 25033
3938 1 11 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.815 0.189 25033
3939 1 11 . 1 1 64 64 VAL C C 64 173.790 173.790 174.588 -0.798 25033
3940 1 11 . 1 1 64 64 VAL CA C 64 58.609 58.609 58.811 -0.202 25033
3941 1 11 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.243 1.117 25033
3942 1 11 . 1 1 64 64 VAL H H 64 8.686 8.686 8.991 -0.305 25033
3943 1 11 . 1 1 65 65 GLU N N 65 120.433 120.433 121.597 -1.164 25033
3944 1 11 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.330 0.117 25033
3945 1 11 . 1 1 65 65 GLU C C 65 175.584 175.584 175.401 0.183 25033
3946 1 11 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.518 -0.128 25033
3947 1 11 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.403 0.600 25033
3948 1 11 . 1 1 65 65 GLU H H 65 9.003 9.003 8.373 0.630 25033
3949 1 11 . 1 1 66 66 PHE N N 66 116.104 116.104 119.449 -3.345 25033
3950 1 11 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.052 0.009 25033
3951 1 11 . 1 1 66 66 PHE C C 66 173.001 173.001 172.847 0.154 25033
3952 1 11 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.747 0.110 25033
3953 1 11 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.761 -0.329 25033
3954 1 11 . 1 1 66 66 PHE H H 66 8.172 8.172 7.738 0.434 25033
3955 1 11 . 1 1 67 67 GLU N N 67 117.574 117.574 118.374 -0.800 25033
3956 1 11 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.092 -0.220 25033
3957 1 11 . 1 1 67 67 GLU C C 67 175.327 175.327 175.901 -0.574 25033
3958 1 11 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.177 0.464 25033
3959 1 11 . 1 1 67 67 GLU CB C 67 33.020 33.020 32.705 0.316 25033
3960 1 11 . 1 1 67 67 GLU H H 67 8.668 8.668 8.739 -0.071 25033
3961 1 11 . 1 1 68 68 VAL N N 68 120.881 120.881 123.596 -2.715 25033
3962 1 11 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.585 0.427 25033
3963 1 11 . 1 1 68 68 VAL C C 68 176.140 176.140 175.486 0.654 25033
3964 1 11 . 1 1 68 68 VAL CA C 68 62.338 62.338 63.043 -0.705 25033
3965 1 11 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.016 1.990 25033
3966 1 11 . 1 1 68 68 VAL H H 68 8.748 8.748 8.431 0.317 25033
3967 1 11 . 1 1 69 69 GLU N N 69 128.110 128.110 127.643 0.467 25033
3968 1 11 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.767 -0.062 25033
3969 1 11 . 1 1 69 69 GLU C C 69 174.573 174.573 174.935 -0.362 25033
3970 1 11 . 1 1 69 69 GLU CA C 69 54.953 54.953 53.818 1.135 25033
3971 1 11 . 1 1 69 69 GLU CB C 69 34.290 34.290 34.236 0.054 25033
3972 1 11 . 1 1 69 69 GLU H H 69 9.070 9.070 8.866 0.204 25033
3973 1 11 . 1 1 70 70 ALA N N 70 127.944 127.944 126.884 1.060 25033
3974 1 11 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.151 -0.147 25033
3975 1 11 . 1 1 70 70 ALA C C 70 178.073 178.073 177.439 0.634 25033
3976 1 11 . 1 1 70 70 ALA CA C 70 50.959 50.959 51.044 -0.085 25033
3977 1 11 . 1 1 70 70 ALA CB C 70 19.489 19.489 19.956 -0.467 25033
3978 1 11 . 1 1 70 70 ALA H H 70 8.671 8.671 8.536 0.135 25033
3979 1 11 . 1 1 71 71 GLY N N 71 110.340 110.340 111.327 -0.987 25033
3980 1 11 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.685 0.330 25033
3981 1 11 . 1 1 71 71 GLY H H 71 8.445 8.445 8.105 0.340 25033
3982 1 11 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.349 0.068 25033
3983 1 11 . 1 1 72 72 PRO C C 72 176.835 176.835 176.725 0.110 25033
3984 1 11 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.398 -0.238 25033
3985 1 11 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.689 0.191 25033
3986 1 11 . 1 1 73 73 ASP N N 73 116.498 116.498 117.417 -0.919 25033
3987 1 11 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.537 -0.022 25033
3988 1 11 . 1 1 73 73 ASP C C 73 176.775 176.775 177.207 -0.432 25033
3989 1 11 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.092 -0.545 25033
3990 1 11 . 1 1 73 73 ASP CB C 73 40.234 40.234 41.008 -0.774 25033
3991 1 11 . 1 1 73 73 ASP H H 73 8.248 8.248 8.072 0.176 25033
3992 1 11 . 1 1 74 74 GLY N N 74 107.369 107.369 108.345 -0.976 25033
3993 1 11 . 1 1 74 74 GLY C C 74 174.331 174.331 174.268 0.063 25033
3994 1 11 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.865 0.713 25033
3995 1 11 . 1 1 74 74 GLY H H 74 8.153 8.153 7.679 0.474 25033
3996 1 11 . 1 1 75 75 ARG N N 75 120.942 120.942 121.298 -0.356 25033
3997 1 11 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.410 0.132 25033
3998 1 11 . 1 1 75 75 ARG C C 75 176.652 176.652 175.842 0.810 25033
3999 1 11 . 1 1 75 75 ARG CA C 75 55.658 55.658 56.199 -0.541 25033
4000 1 11 . 1 1 75 75 ARG CB C 75 30.909 30.909 30.891 0.018 25033
4001 1 11 . 1 1 75 75 ARG H H 75 7.670 7.670 8.408 -0.738 25033
4002 1 11 . 1 1 76 76 SER N N 76 120.181 120.181 116.302 3.879 25033
4003 1 11 . 1 1 76 76 SER HA H 76 5.035 5.035 5.294 -0.259 25033
4004 1 11 . 1 1 76 76 SER C C 76 172.816 172.816 174.305 -1.489 25033
4005 1 11 . 1 1 76 76 SER CA C 76 59.080 59.080 56.999 2.080 25033
4006 1 11 . 1 1 76 76 SER CB C 76 64.850 64.850 65.083 -0.233 25033
4007 1 11 . 1 1 76 76 SER H H 76 8.808 8.808 8.440 0.368 25033
4008 1 11 . 1 1 77 77 LYS N N 77 121.202 121.202 119.908 1.294 25033
4009 1 11 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.763 0.411 25033
4010 1 11 . 1 1 77 77 LYS C C 77 173.706 173.706 174.105 -0.399 25033
4011 1 11 . 1 1 77 77 LYS CA C 77 54.599 54.599 54.997 -0.398 25033
4012 1 11 . 1 1 77 77 LYS CB C 77 36.035 36.035 35.332 0.703 25033
4013 1 11 . 1 1 77 77 LYS H H 77 8.982 8.982 8.459 0.523 25033
4014 1 11 . 1 1 78 78 ALA N N 78 124.064 124.064 123.308 0.756 25033
4015 1 11 . 1 1 78 78 ALA HA H 78 5.004 5.004 5.149 -0.145 25033
4016 1 11 . 1 1 78 78 ALA C C 78 175.979 175.979 175.968 0.011 25033
4017 1 11 . 1 1 78 78 ALA CA C 78 50.445 50.445 50.714 -0.269 25033
4018 1 11 . 1 1 78 78 ALA CB C 78 20.136 20.136 20.658 -0.522 25033
4019 1 11 . 1 1 78 78 ALA H H 78 8.706 8.706 8.459 0.247 25033
4020 1 11 . 1 1 79 79 VAL N N 79 113.264 113.264 117.760 -4.496 25033
4021 1 11 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.495 0.348 25033
4022 1 11 . 1 1 79 79 VAL C C 79 174.744 174.744 174.452 0.292 25033
4023 1 11 . 1 1 79 79 VAL CA C 79 59.073 59.073 60.679 -1.606 25033
4024 1 11 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.479 0.117 25033
4025 1 11 . 1 1 79 79 VAL H H 79 9.165 9.165 7.650 1.515 25033
4026 1 11 . 1 1 80 80 ASN N N 80 120.084 120.084 115.460 4.624 25033
4027 1 11 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.351 0.005 25033
4028 1 11 . 1 1 80 80 ASN C C 80 175.391 175.391 174.155 1.236 25033
4029 1 11 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.498 0.236 25033
4030 1 11 . 1 1 80 80 ASN CB C 80 37.121 37.121 37.140 -0.019 25033
4031 1 11 . 1 1 80 80 ASN H H 80 8.923 8.923 8.862 0.061 25033
4032 1 11 . 1 1 81 81 VAL N N 81 119.178 119.178 118.414 0.764 25033
4033 1 11 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.402 0.345 25033
4034 1 11 . 1 1 81 81 VAL C C 81 176.340 176.340 176.466 -0.126 25033
4035 1 11 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.295 0.865 25033
4036 1 11 . 1 1 81 81 VAL CB C 81 32.130 32.130 32.410 -0.280 25033
4037 1 11 . 1 1 81 81 VAL H H 81 8.282 8.282 7.588 0.694 25033
4038 1 12 . 1 1 12 12 SER N N 12 116.112 116.112 117.399 -1.287 25033
4039 1 12 . 1 1 12 12 SER C C 12 175.271 175.271 174.883 0.388 25033
4040 1 12 . 1 1 12 12 SER CA C 12 58.570 58.570 57.726 0.844 25033
4041 1 12 . 1 1 12 12 SER CB C 12 63.984 63.984 62.267 1.717 25033
4042 1 12 . 1 1 12 12 SER H H 12 8.422 8.422 8.342 0.080 25033
4043 1 12 . 1 1 13 13 GLY N N 13 111.178 111.178 111.923 -0.745 25033
4044 1 12 . 1 1 13 13 GLY C C 13 174.238 174.238 173.823 0.415 25033
4045 1 12 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.700 0.820 25033
4046 1 12 . 1 1 13 13 GLY H H 13 8.537 8.537 7.999 0.538 25033
4047 1 12 . 1 1 14 14 GLU N N 14 120.547 120.547 121.883 -1.336 25033
4048 1 12 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.255 0.012 25033
4049 1 12 . 1 1 14 14 GLU C C 14 176.455 176.455 176.728 -0.273 25033
4050 1 12 . 1 1 14 14 GLU CA C 14 56.753 56.753 56.709 0.044 25033
4051 1 12 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.968 0.496 25033
4052 1 12 . 1 1 14 14 GLU H H 14 8.285 8.285 8.345 -0.060 25033
4053 1 12 . 1 1 15 15 GLN N N 15 121.185 121.185 121.767 -0.582 25033
4054 1 12 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.207 0.142 25033
4055 1 12 . 1 1 15 15 GLN C C 15 175.494 175.494 175.273 0.221 25033
4056 1 12 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.832 -0.162 25033
4057 1 12 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.313 0.097 25033
4058 1 12 . 1 1 15 15 GLN H H 15 8.444 8.444 8.411 0.033 25033
4059 1 12 . 1 1 16 16 LEU N N 16 123.934 123.934 122.890 1.044 25033
4060 1 12 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.622 -0.281 25033
4061 1 12 . 1 1 16 16 LEU C C 16 176.942 176.942 175.564 1.378 25033
4062 1 12 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.451 1.053 25033
4063 1 12 . 1 1 16 16 LEU CB C 16 42.519 42.519 41.635 0.884 25033
4064 1 12 . 1 1 16 16 LEU H H 16 8.289 8.289 8.550 -0.261 25033
4065 1 12 . 1 1 17 17 ARG N N 17 122.044 122.044 122.004 0.040 25033
4066 1 12 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.588 -0.124 25033
4067 1 12 . 1 1 17 17 ARG C C 17 175.829 175.829 175.503 0.326 25033
4068 1 12 . 1 1 17 17 ARG CA C 17 55.672 55.672 55.140 0.532 25033
4069 1 12 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.974 -1.144 25033
4070 1 12 . 1 1 17 17 ARG H H 17 8.216 8.216 8.302 -0.086 25033
4071 1 12 . 1 1 18 18 GLN N N 18 122.488 122.488 124.092 -1.604 25033
4072 1 12 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.454 -0.120 25033
4073 1 12 . 1 1 18 18 GLN C C 18 172.958 172.958 173.605 -0.647 25033
4074 1 12 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.666 0.234 25033
4075 1 12 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.339 0.281 25033
4076 1 12 . 1 1 18 18 GLN H H 18 8.573 8.573 7.880 0.693 25033
4077 1 12 . 1 1 19 19 GLN N N 19 116.301 116.301 120.474 -4.173 25033
4078 1 12 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.381 -0.003 25033
4079 1 12 . 1 1 19 19 GLN C C 19 176.902 176.902 175.184 1.718 25033
4080 1 12 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.508 -0.293 25033
4081 1 12 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.602 1.036 25033
4082 1 12 . 1 1 19 19 GLN H H 19 8.146 8.146 8.334 -0.188 25033
4083 1 12 . 1 1 20 20 GLY N N 20 109.745 109.745 109.587 0.158 25033
4084 1 12 . 1 1 20 20 GLY C C 20 170.989 170.989 172.316 -1.327 25033
4085 1 12 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.261 1.674 25033
4086 1 12 . 1 1 20 20 GLY H H 20 8.998 8.998 8.288 0.710 25033
4087 1 12 . 1 1 21 21 THR N N 21 112.645 112.645 113.770 -1.125 25033
4088 1 12 . 1 1 21 21 THR HA H 21 5.361 5.361 5.197 0.164 25033
4089 1 12 . 1 1 21 21 THR C C 21 174.553 174.553 176.048 -1.495 25033
4090 1 12 . 1 1 21 21 THR CA C 21 60.025 60.025 60.037 -0.012 25033
4091 1 12 . 1 1 21 21 THR CB C 21 71.720 71.720 71.963 -0.243 25033
4092 1 12 . 1 1 21 21 THR H H 21 8.312 8.312 8.335 -0.023 25033
4093 1 12 . 1 1 22 22 VAL N N 22 125.915 125.915 121.666 4.249 25033
4094 1 12 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.815 -0.166 25033
4095 1 12 . 1 1 22 22 VAL C C 22 175.553 175.553 177.791 -2.238 25033
4096 1 12 . 1 1 22 22 VAL CA C 22 64.618 64.618 65.823 -1.205 25033
4097 1 12 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.494 0.127 25033
4098 1 12 . 1 1 22 22 VAL H H 22 9.092 9.092 8.195 0.897 25033
4099 1 12 . 1 1 23 23 LYS N N 23 135.790 135.790 118.707 17.083 25033
4100 1 12 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.016 0.285 25033
4101 1 12 . 1 1 23 23 LYS C C 23 176.301 176.301 176.576 -0.275 25033
4102 1 12 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.637 -0.027 25033
4103 1 12 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.636 2.664 25033
4104 1 12 . 1 1 23 23 LYS H H 23 9.276 9.276 8.463 0.813 25033
4105 1 12 . 1 1 24 24 TRP N N 24 111.651 111.651 119.294 -7.643 25033
4106 1 12 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.868 -0.245 25033
4107 1 12 . 1 1 24 24 TRP C C 24 173.628 173.628 174.523 -0.895 25033
4108 1 12 . 1 1 24 24 TRP CA C 24 56.300 56.300 56.156 0.144 25033
4109 1 12 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.888 1.372 25033
4110 1 12 . 1 1 24 24 TRP H H 24 7.455 7.455 7.660 -0.205 25033
4111 1 12 . 1 1 25 25 PHE N N 25 121.305 121.305 120.099 1.206 25033
4112 1 12 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.891 -0.606 25033
4113 1 12 . 1 1 25 25 PHE C C 25 172.354 172.354 174.177 -1.823 25033
4114 1 12 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.062 2.310 25033
4115 1 12 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.363 0.206 25033
4116 1 12 . 1 1 25 25 PHE H H 25 9.074 9.074 8.205 0.869 25033
4117 1 12 . 1 1 26 26 ASN N N 26 126.976 126.976 124.740 2.236 25033
4118 1 12 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.964 -0.152 25033
4119 1 12 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.408 -0.996 25033
4120 1 12 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.332 -0.246 25033
4121 1 12 . 1 1 26 26 ASN H H 26 8.159 8.159 8.216 -0.057 25033
4122 1 12 . 1 1 27 27 ALA N N 27 128.245 128.245 125.636 2.609 25033
4123 1 12 . 1 1 27 27 ALA HA H 27 4.121 4.121 3.998 0.123 25033
4124 1 12 . 1 1 27 27 ALA C C 27 179.031 179.031 178.829 0.202 25033
4125 1 12 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.322 -0.897 25033
4126 1 12 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.909 -0.535 25033
4127 1 12 . 1 1 27 27 ALA H H 27 9.036 9.036 8.507 0.529 25033
4128 1 12 . 1 1 28 28 THR N N 28 113.994 113.994 114.014 -0.020 25033
4129 1 12 . 1 1 28 28 THR HA H 28 4.068 4.068 3.976 0.092 25033
4130 1 12 . 1 1 28 28 THR C C 28 176.084 176.084 176.261 -0.177 25033
4131 1 12 . 1 1 28 28 THR CA C 28 65.820 65.820 65.330 0.490 25033
4132 1 12 . 1 1 28 28 THR CB C 28 68.291 68.291 68.451 -0.160 25033
4133 1 12 . 1 1 28 28 THR H H 28 8.065 8.065 8.328 -0.263 25033
4134 1 12 . 1 1 29 29 LYS N N 29 118.922 118.922 119.695 -0.773 25033
4135 1 12 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.289 -0.033 25033
4136 1 12 . 1 1 29 29 LYS C C 29 177.201 177.201 177.014 0.187 25033
4137 1 12 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.946 -0.058 25033
4138 1 12 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.413 1.327 25033
4139 1 12 . 1 1 29 29 LYS H H 29 7.446 7.446 8.098 -0.652 25033
4140 1 12 . 1 1 30 30 GLY N N 30 107.601 107.601 105.946 1.655 25033
4141 1 12 . 1 1 30 30 GLY C C 30 172.004 172.004 173.604 -1.600 25033
4142 1 12 . 1 1 30 30 GLY CA C 30 46.404 46.404 44.944 1.460 25033
4143 1 12 . 1 1 30 30 GLY H H 30 8.115 8.115 7.413 0.702 25033
4144 1 12 . 1 1 31 31 PHE N N 31 112.488 112.488 119.298 -6.810 25033
4145 1 12 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.586 0.421 25033
4146 1 12 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.440 -2.162 25033
4147 1 12 . 1 1 31 31 PHE CB C 31 42.388 42.388 41.064 1.324 25033
4148 1 12 . 1 1 31 31 PHE H H 31 6.594 6.594 7.568 -0.974 25033
4149 1 12 . 1 1 32 32 GLY N N 32 105.986 105.986 109.261 -3.275 25033
4150 1 12 . 1 1 32 32 GLY C C 32 170.292 170.292 171.726 -1.434 25033
4151 1 12 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.151 2.218 25033
4152 1 12 . 1 1 32 32 GLY H H 32 8.144 8.144 8.079 0.065 25033
4153 1 12 . 1 1 33 33 PHE N N 33 115.319 115.319 115.893 -0.574 25033
4154 1 12 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.340 0.123 25033
4155 1 12 . 1 1 33 33 PHE C C 33 175.037 175.037 175.175 -0.138 25033
4156 1 12 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.356 -1.061 25033
4157 1 12 . 1 1 33 33 PHE CB C 33 44.792 44.792 43.996 0.796 25033
4158 1 12 . 1 1 33 33 PHE H H 33 7.971 7.971 7.987 -0.016 25033
4159 1 12 . 1 1 34 34 ILE N N 34 122.140 122.140 122.129 0.011 25033
4160 1 12 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.607 -0.290 25033
4161 1 12 . 1 1 34 34 ILE C C 34 174.526 174.526 175.321 -0.795 25033
4162 1 12 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.779 0.018 25033
4163 1 12 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.258 2.325 25033
4164 1 12 . 1 1 34 34 ILE H H 34 9.511 9.511 8.730 0.781 25033
4165 1 12 . 1 1 35 35 THR N N 35 126.580 126.580 122.768 3.812 25033
4166 1 12 . 1 1 35 35 THR HA H 35 5.143 5.143 5.239 -0.096 25033
4167 1 12 . 1 1 35 35 THR CA C 35 59.330 59.330 57.700 1.630 25033
4168 1 12 . 1 1 35 35 THR CB C 35 70.258 70.258 68.877 1.381 25033
4169 1 12 . 1 1 35 35 THR H H 35 9.416 9.416 8.837 0.579 25033
4170 1 12 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.703 -0.104 25033
4171 1 12 . 1 1 36 36 PRO C C 36 177.390 177.390 178.012 -0.622 25033
4172 1 12 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.208 0.012 25033
4173 1 12 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.219 0.251 25033
4174 1 12 . 1 1 37 37 GLY N N 37 112.033 112.033 111.558 0.475 25033
4175 1 12 . 1 1 37 37 GLY C C 37 169.261 169.261 174.882 -5.621 25033
4176 1 12 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.987 1.470 25033
4177 1 12 . 1 1 37 37 GLY H H 37 9.349 9.349 8.662 0.687 25033
4178 1 12 . 1 1 38 38 GLY N N 38 109.050 109.050 109.539 -0.489 25033
4179 1 12 . 1 1 38 38 GLY C C 38 175.177 175.177 175.183 -0.006 25033
4180 1 12 . 1 1 38 38 GLY H H 38 8.756 8.756 7.718 1.038 25033
4181 1 12 . 1 1 39 39 GLY N N 39 107.730 107.730 107.349 0.381 25033
4182 1 12 . 1 1 39 39 GLY C C 39 173.870 173.870 174.785 -0.915 25033
4183 1 12 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.113 -0.855 25033
4184 1 12 . 1 1 39 39 GLY H H 39 7.725 7.725 8.280 -0.555 25033
4185 1 12 . 1 1 40 40 GLY N N 40 107.183 107.183 108.013 -0.830 25033
4186 1 12 . 1 1 40 40 GLY C C 40 173.067 173.067 173.995 -0.928 25033
4187 1 12 . 1 1 40 40 GLY CA C 40 43.760 43.760 45.360 -1.600 25033
4188 1 12 . 1 1 40 40 GLY H H 40 8.096 8.096 8.089 0.007 25033
4189 1 12 . 1 1 41 41 GLU N N 41 119.455 119.455 123.285 -3.830 25033
4190 1 12 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.116 0.062 25033
4191 1 12 . 1 1 41 41 GLU C C 41 175.900 175.900 174.773 1.127 25033
4192 1 12 . 1 1 41 41 GLU CA C 41 56.377 56.377 56.956 -0.580 25033
4193 1 12 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.206 0.394 25033
4194 1 12 . 1 1 41 41 GLU H H 41 8.199 8.199 8.432 -0.233 25033
4195 1 12 . 1 1 42 42 ASP N N 42 119.784 119.784 122.970 -3.186 25033
4196 1 12 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.064 -0.207 25033
4197 1 12 . 1 1 42 42 ASP C C 42 176.474 176.474 175.662 0.812 25033
4198 1 12 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.306 2.135 25033
4199 1 12 . 1 1 42 42 ASP CB C 42 41.488 41.488 42.309 -0.820 25033
4200 1 12 . 1 1 42 42 ASP H H 42 8.277 8.277 8.357 -0.080 25033
4201 1 12 . 1 1 43 43 LEU N N 43 122.515 122.515 121.337 1.178 25033
4202 1 12 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.860 -0.173 25033
4203 1 12 . 1 1 43 43 LEU C C 43 175.759 175.759 176.181 -0.422 25033
4204 1 12 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.487 -0.183 25033
4205 1 12 . 1 1 43 43 LEU CB C 43 45.449 45.449 46.299 -0.850 25033
4206 1 12 . 1 1 43 43 LEU H H 43 9.423 9.423 8.607 0.816 25033
4207 1 12 . 1 1 44 44 PHE N N 44 125.962 125.962 120.584 5.378 25033
4208 1 12 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.967 -1.045 25033
4209 1 12 . 1 1 44 44 PHE C C 44 172.844 172.844 174.356 -1.512 25033
4210 1 12 . 1 1 44 44 PHE CA C 44 57.880 57.880 56.865 1.014 25033
4211 1 12 . 1 1 44 44 PHE CB C 44 40.350 40.350 40.007 0.343 25033
4212 1 12 . 1 1 44 44 PHE H H 44 8.465 8.465 8.483 -0.018 25033
4213 1 12 . 1 1 45 45 VAL N N 45 123.552 123.552 124.172 -0.620 25033
4214 1 12 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.254 0.403 25033
4215 1 12 . 1 1 45 45 VAL C C 45 177.433 177.433 173.273 4.160 25033
4216 1 12 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.332 -1.872 25033
4217 1 12 . 1 1 45 45 VAL CB C 45 34.884 34.884 36.147 -1.263 25033
4218 1 12 . 1 1 45 45 VAL H H 45 7.715 7.715 8.148 -0.433 25033
4219 1 12 . 1 1 46 46 HIS N N 46 127.300 127.300 123.004 4.296 25033
4220 1 12 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.750 0.075 25033
4221 1 12 . 1 1 46 46 HIS C C 46 176.469 176.469 174.227 2.242 25033
4222 1 12 . 1 1 46 46 HIS CA C 46 55.929 55.929 52.943 2.986 25033
4223 1 12 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.529 2.870 25033
4224 1 12 . 1 1 46 46 HIS H H 46 9.104 9.104 7.918 1.186 25033
4225 1 12 . 1 1 47 47 GLN N N 47 125.105 125.105 123.356 1.749 25033
4226 1 12 . 1 1 47 47 GLN H H 47 8.352 8.352 8.626 -0.274 25033
4227 1 12 . 1 1 48 48 THR HA H 48 4.310 4.310 4.432 -0.122 25033
4228 1 12 . 1 1 48 48 THR C C 48 175.568 175.568 174.866 0.702 25033
4229 1 12 . 1 1 48 48 THR CA C 48 64.770 64.770 62.897 1.873 25033
4230 1 12 . 1 1 48 48 THR CB C 48 70.054 70.054 69.610 0.444 25033
4231 1 12 . 1 1 49 49 ASN N N 49 118.142 118.142 118.582 -0.440 25033
4232 1 12 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.889 0.271 25033
4233 1 12 . 1 1 49 49 ASN C C 49 172.914 172.914 173.207 -0.293 25033
4234 1 12 . 1 1 49 49 ASN CA C 49 54.351 54.351 52.880 1.471 25033
4235 1 12 . 1 1 49 49 ASN CB C 49 40.527 40.527 40.036 0.491 25033
4236 1 12 . 1 1 49 49 ASN H H 49 8.452 8.452 8.410 0.042 25033
4237 1 12 . 1 1 50 50 ILE N N 50 119.226 119.226 120.367 -1.141 25033
4238 1 12 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.216 -0.104 25033
4239 1 12 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.318 1.288 25033
4240 1 12 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.912 1.450 25033
4241 1 12 . 1 1 50 50 ILE H H 50 7.354 7.354 7.869 -0.515 25033
4242 1 12 . 1 1 51 51 ASN N N 51 128.460 128.460 122.204 6.256 25033
4243 1 12 . 1 1 51 51 ASN C C 51 174.614 174.614 173.950 0.664 25033
4244 1 12 . 1 1 51 51 ASN H H 51 9.266 9.266 8.071 1.195 25033
4245 1 12 . 1 1 52 52 SER N N 52 117.246 117.246 115.377 1.869 25033
4246 1 12 . 1 1 52 52 SER HA H 52 4.413 4.413 4.612 -0.199 25033
4247 1 12 . 1 1 52 52 SER C C 52 174.139 174.139 174.728 -0.589 25033
4248 1 12 . 1 1 52 52 SER CA C 52 58.378 58.378 57.212 1.166 25033
4249 1 12 . 1 1 52 52 SER CB C 52 64.371 64.371 64.157 0.214 25033
4250 1 12 . 1 1 52 52 SER H H 52 7.973 7.973 8.453 -0.480 25033
4251 1 12 . 1 1 53 53 GLU N N 53 123.628 123.628 124.796 -1.168 25033
4252 1 12 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.326 -0.028 25033
4253 1 12 . 1 1 53 53 GLU C C 53 176.960 176.960 176.785 0.175 25033
4254 1 12 . 1 1 53 53 GLU CA C 53 57.270 57.270 57.252 0.019 25033
4255 1 12 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.891 -0.030 25033
4256 1 12 . 1 1 53 53 GLU H H 53 8.641 8.641 8.717 -0.076 25033
4257 1 12 . 1 1 54 54 GLY N N 54 110.282 110.282 108.400 1.882 25033
4258 1 12 . 1 1 54 54 GLY CA C 54 44.600 44.600 45.107 -0.507 25033
4259 1 12 . 1 1 54 54 GLY H H 54 8.225 8.225 7.837 0.388 25033
4260 1 12 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.675 0.145 25033
4261 1 12 . 1 1 55 55 PHE C C 55 175.836 175.836 174.433 1.403 25033
4262 1 12 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.294 -4.604 25033
4263 1 12 . 1 1 55 55 PHE CB C 55 38.095 38.095 42.048 -3.953 25033
4264 1 12 . 1 1 56 56 ARG N N 56 120.907 120.907 121.816 -0.909 25033
4265 1 12 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.629 -0.365 25033
4266 1 12 . 1 1 56 56 ARG C C 56 175.618 175.618 175.363 0.255 25033
4267 1 12 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.798 -0.288 25033
4268 1 12 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.830 0.190 25033
4269 1 12 . 1 1 56 56 ARG H H 56 8.153 8.153 8.660 -0.507 25033
4270 1 12 . 1 1 57 57 SER N N 57 123.117 123.117 120.172 2.945 25033
4271 1 12 . 1 1 57 57 SER H H 57 7.834 7.834 8.554 -0.720 25033
4272 1 12 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.868 -0.588 25033
4273 1 12 . 1 1 58 58 LEU C C 58 174.842 174.842 176.024 -1.182 25033
4274 1 12 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.690 -0.930 25033
4275 1 12 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.862 -1.282 25033
4276 1 12 . 1 1 59 59 ARG N N 59 119.557 119.557 120.463 -0.906 25033
4277 1 12 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.605 -0.020 25033
4278 1 12 . 1 1 59 59 ARG C C 59 175.256 175.256 175.438 -0.182 25033
4279 1 12 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.692 -0.580 25033
4280 1 12 . 1 1 59 59 ARG CB C 59 32.970 32.970 32.973 -0.003 25033
4281 1 12 . 1 1 59 59 ARG H H 59 8.529 8.529 8.596 -0.067 25033
4282 1 12 . 1 1 60 60 GLU N N 60 121.597 121.597 119.820 1.777 25033
4283 1 12 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.079 -0.498 25033
4284 1 12 . 1 1 60 60 GLU C C 60 177.281 177.281 176.656 0.625 25033
4285 1 12 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.497 0.804 25033
4286 1 12 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.807 -0.546 25033
4287 1 12 . 1 1 60 60 GLU H H 60 8.691 8.691 8.588 0.103 25033
4288 1 12 . 1 1 61 61 GLY N N 61 113.554 113.554 111.563 1.991 25033
4289 1 12 . 1 1 61 61 GLY C C 61 174.068 174.068 174.188 -0.120 25033
4290 1 12 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.626 0.617 25033
4291 1 12 . 1 1 61 61 GLY H H 61 9.151 9.151 8.613 0.538 25033
4292 1 12 . 1 1 62 62 GLU N N 62 121.639 121.639 122.363 -0.724 25033
4293 1 12 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.257 -0.053 25033
4294 1 12 . 1 1 62 62 GLU C C 62 175.439 175.439 175.806 -0.367 25033
4295 1 12 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.679 0.663 25033
4296 1 12 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.658 0.267 25033
4297 1 12 . 1 1 62 62 GLU H H 62 7.889 7.889 7.671 0.218 25033
4298 1 12 . 1 1 63 63 VAL N N 63 125.003 125.003 125.578 -0.575 25033
4299 1 12 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.774 -0.026 25033
4300 1 12 . 1 1 63 63 VAL C C 63 176.639 176.639 175.703 0.936 25033
4301 1 12 . 1 1 63 63 VAL CA C 63 62.631 62.631 60.747 1.884 25033
4302 1 12 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.781 -0.424 25033
4303 1 12 . 1 1 63 63 VAL H H 63 8.477 8.477 8.212 0.265 25033
4304 1 12 . 1 1 64 64 VAL N N 64 120.113 120.113 123.197 -3.084 25033
4305 1 12 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.814 0.190 25033
4306 1 12 . 1 1 64 64 VAL C C 64 173.790 173.790 173.945 -0.155 25033
4307 1 12 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.728 -1.119 25033
4308 1 12 . 1 1 64 64 VAL CB C 64 36.360 36.360 34.910 1.450 25033
4309 1 12 . 1 1 64 64 VAL H H 64 8.686 8.686 9.047 -0.361 25033
4310 1 12 . 1 1 65 65 GLU N N 65 120.433 120.433 121.233 -0.800 25033
4311 1 12 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.375 0.072 25033
4312 1 12 . 1 1 65 65 GLU C C 65 175.584 175.584 175.068 0.516 25033
4313 1 12 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.226 0.164 25033
4314 1 12 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.852 0.151 25033
4315 1 12 . 1 1 65 65 GLU H H 65 9.003 9.003 8.898 0.105 25033
4316 1 12 . 1 1 66 66 PHE N N 66 116.104 116.104 119.848 -3.744 25033
4317 1 12 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.070 -0.009 25033
4318 1 12 . 1 1 66 66 PHE C C 66 173.001 173.001 172.871 0.130 25033
4319 1 12 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.657 0.200 25033
4320 1 12 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.681 -0.249 25033
4321 1 12 . 1 1 66 66 PHE H H 66 8.172 8.172 7.745 0.427 25033
4322 1 12 . 1 1 67 67 GLU N N 67 117.574 117.574 118.346 -0.772 25033
4323 1 12 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.207 -0.335 25033
4324 1 12 . 1 1 67 67 GLU C C 67 175.327 175.327 175.603 -0.276 25033
4325 1 12 . 1 1 67 67 GLU CA C 67 54.641 54.641 53.963 0.678 25033
4326 1 12 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.163 -0.143 25033
4327 1 12 . 1 1 67 67 GLU H H 67 8.668 8.668 8.557 0.111 25033
4328 1 12 . 1 1 68 68 VAL N N 68 120.881 120.881 123.027 -2.146 25033
4329 1 12 . 1 1 68 68 VAL HA H 68 5.012 5.012 3.990 1.022 25033
4330 1 12 . 1 1 68 68 VAL C C 68 176.140 176.140 175.884 0.256 25033
4331 1 12 . 1 1 68 68 VAL CA C 68 62.338 62.338 63.981 -1.643 25033
4332 1 12 . 1 1 68 68 VAL CB C 68 34.006 34.006 31.950 2.056 25033
4333 1 12 . 1 1 68 68 VAL H H 68 8.748 8.748 8.594 0.154 25033
4334 1 12 . 1 1 69 69 GLU N N 69 128.110 128.110 128.772 -0.662 25033
4335 1 12 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.689 0.016 25033
4336 1 12 . 1 1 69 69 GLU C C 69 174.573 174.573 174.611 -0.038 25033
4337 1 12 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.116 0.837 25033
4338 1 12 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.870 0.420 25033
4339 1 12 . 1 1 69 69 GLU H H 69 9.070 9.070 8.862 0.208 25033
4340 1 12 . 1 1 70 70 ALA N N 70 127.944 127.944 126.445 1.499 25033
4341 1 12 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.160 -0.156 25033
4342 1 12 . 1 1 70 70 ALA C C 70 178.073 178.073 177.434 0.639 25033
4343 1 12 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.783 0.176 25033
4344 1 12 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.012 -0.523 25033
4345 1 12 . 1 1 70 70 ALA H H 70 8.671 8.671 8.500 0.171 25033
4346 1 12 . 1 1 71 71 GLY N N 71 110.340 110.340 111.570 -1.230 25033
4347 1 12 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.793 0.223 25033
4348 1 12 . 1 1 71 71 GLY H H 71 8.445 8.445 8.122 0.323 25033
4349 1 12 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.335 0.082 25033
4350 1 12 . 1 1 72 72 PRO C C 72 176.835 176.835 177.114 -0.279 25033
4351 1 12 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.561 -0.401 25033
4352 1 12 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.783 0.097 25033
4353 1 12 . 1 1 73 73 ASP N N 73 116.498 116.498 117.575 -1.077 25033
4354 1 12 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.549 -0.034 25033
4355 1 12 . 1 1 73 73 ASP C C 73 176.775 176.775 177.184 -0.409 25033
4356 1 12 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.181 -0.634 25033
4357 1 12 . 1 1 73 73 ASP CB C 73 40.234 40.234 41.075 -0.841 25033
4358 1 12 . 1 1 73 73 ASP H H 73 8.248 8.248 8.142 0.106 25033
4359 1 12 . 1 1 74 74 GLY N N 74 107.369 107.369 107.649 -0.280 25033
4360 1 12 . 1 1 74 74 GLY C C 74 174.331 174.331 173.657 0.674 25033
4361 1 12 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.863 0.715 25033
4362 1 12 . 1 1 74 74 GLY H H 74 8.153 8.153 7.592 0.561 25033
4363 1 12 . 1 1 75 75 ARG N N 75 120.942 120.942 120.251 0.691 25033
4364 1 12 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.487 0.055 25033
4365 1 12 . 1 1 75 75 ARG C C 75 176.652 176.652 175.300 1.352 25033
4366 1 12 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.898 -0.239 25033
4367 1 12 . 1 1 75 75 ARG CB C 75 30.909 30.909 30.821 0.088 25033
4368 1 12 . 1 1 75 75 ARG H H 75 7.670 7.670 8.075 -0.405 25033
4369 1 12 . 1 1 76 76 SER N N 76 120.181 120.181 117.147 3.034 25033
4370 1 12 . 1 1 76 76 SER HA H 76 5.035 5.035 5.465 -0.430 25033
4371 1 12 . 1 1 76 76 SER C C 76 172.816 172.816 174.446 -1.630 25033
4372 1 12 . 1 1 76 76 SER CA C 76 59.080 59.080 57.033 2.047 25033
4373 1 12 . 1 1 76 76 SER CB C 76 64.850 64.850 65.102 -0.252 25033
4374 1 12 . 1 1 76 76 SER H H 76 8.808 8.808 8.440 0.368 25033
4375 1 12 . 1 1 77 77 LYS N N 77 121.202 121.202 120.188 1.014 25033
4376 1 12 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.684 0.490 25033
4377 1 12 . 1 1 77 77 LYS C C 77 173.706 173.706 174.161 -0.455 25033
4378 1 12 . 1 1 77 77 LYS CA C 77 54.599 54.599 55.438 -0.839 25033
4379 1 12 . 1 1 77 77 LYS CB C 77 36.035 36.035 35.465 0.570 25033
4380 1 12 . 1 1 77 77 LYS H H 77 8.982 8.982 8.886 0.096 25033
4381 1 12 . 1 1 78 78 ALA N N 78 124.064 124.064 125.151 -1.087 25033
4382 1 12 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.955 0.049 25033
4383 1 12 . 1 1 78 78 ALA C C 78 175.979 175.979 176.469 -0.490 25033
4384 1 12 . 1 1 78 78 ALA CA C 78 50.445 50.445 51.122 -0.677 25033
4385 1 12 . 1 1 78 78 ALA CB C 78 20.136 20.136 19.474 0.662 25033
4386 1 12 . 1 1 78 78 ALA H H 78 8.706 8.706 8.474 0.232 25033
4387 1 12 . 1 1 79 79 VAL N N 79 113.264 113.264 116.773 -3.509 25033
4388 1 12 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.423 0.420 25033
4389 1 12 . 1 1 79 79 VAL C C 79 174.744 174.744 174.337 0.407 25033
4390 1 12 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.658 -0.585 25033
4391 1 12 . 1 1 79 79 VAL CB C 79 35.596 35.596 36.008 -0.412 25033
4392 1 12 . 1 1 79 79 VAL H H 79 9.165 9.165 7.602 1.563 25033
4393 1 12 . 1 1 80 80 ASN N N 80 120.084 120.084 116.392 3.692 25033
4394 1 12 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.343 0.013 25033
4395 1 12 . 1 1 80 80 ASN C C 80 175.391 175.391 174.056 1.335 25033
4396 1 12 . 1 1 80 80 ASN CA C 80 53.734 53.734 54.059 -0.326 25033
4397 1 12 . 1 1 80 80 ASN CB C 80 37.121 37.121 37.036 0.084 25033
4398 1 12 . 1 1 80 80 ASN H H 80 8.923 8.923 8.712 0.211 25033
4399 1 12 . 1 1 81 81 VAL N N 81 119.178 119.178 118.250 0.928 25033
4400 1 12 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.417 0.330 25033
4401 1 12 . 1 1 81 81 VAL C C 81 176.340 176.340 175.450 0.890 25033
4402 1 12 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.609 0.551 25033
4403 1 12 . 1 1 81 81 VAL CB C 81 32.130 32.130 32.703 -0.573 25033
4404 1 12 . 1 1 81 81 VAL H H 81 8.282 8.282 7.778 0.504 25033
4405 1 13 . 1 1 12 12 SER N N 12 116.112 116.112 115.544 0.568 25033
4406 1 13 . 1 1 12 12 SER C C 12 175.271 175.271 174.331 0.940 25033
4407 1 13 . 1 1 12 12 SER CA C 12 58.570 58.570 58.140 0.430 25033
4408 1 13 . 1 1 12 12 SER CB C 12 63.984 63.984 63.984 0.000 25033
4409 1 13 . 1 1 12 12 SER H H 12 8.422 8.422 7.803 0.619 25033
4410 1 13 . 1 1 13 13 GLY N N 13 111.178 111.178 110.973 0.205 25033
4411 1 13 . 1 1 13 13 GLY C C 13 174.238 174.238 174.204 0.034 25033
4412 1 13 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.791 0.729 25033
4413 1 13 . 1 1 13 13 GLY H H 13 8.537 8.537 8.751 -0.214 25033
4414 1 13 . 1 1 14 14 GLU N N 14 120.547 120.547 121.806 -1.259 25033
4415 1 13 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.361 -0.094 25033
4416 1 13 . 1 1 14 14 GLU C C 14 176.455 176.455 176.298 0.157 25033
4417 1 13 . 1 1 14 14 GLU CA C 14 56.753 56.753 56.236 0.516 25033
4418 1 13 . 1 1 14 14 GLU CB C 14 30.464 30.464 30.078 0.386 25033
4419 1 13 . 1 1 14 14 GLU H H 14 8.285 8.285 8.590 -0.305 25033
4420 1 13 . 1 1 15 15 GLN N N 15 121.185 121.185 117.696 3.489 25033
4421 1 13 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.530 -0.181 25033
4422 1 13 . 1 1 15 15 GLN C C 15 175.494 175.494 175.218 0.276 25033
4423 1 13 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.228 0.442 25033
4424 1 13 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.788 -0.378 25033
4425 1 13 . 1 1 15 15 GLN H H 15 8.444 8.444 8.435 0.009 25033
4426 1 13 . 1 1 16 16 LEU N N 16 123.934 123.934 125.179 -1.245 25033
4427 1 13 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.518 -0.177 25033
4428 1 13 . 1 1 16 16 LEU C C 16 176.942 176.942 175.606 1.336 25033
4429 1 13 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.227 1.277 25033
4430 1 13 . 1 1 16 16 LEU CB C 16 42.519 42.519 40.593 1.926 25033
4431 1 13 . 1 1 16 16 LEU H H 16 8.289 8.289 8.615 -0.326 25033
4432 1 13 . 1 1 17 17 ARG N N 17 122.044 122.044 120.761 1.283 25033
4433 1 13 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.558 -0.094 25033
4434 1 13 . 1 1 17 17 ARG C C 17 175.829 175.829 175.803 0.026 25033
4435 1 13 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.574 1.098 25033
4436 1 13 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.404 -0.574 25033
4437 1 13 . 1 1 17 17 ARG H H 17 8.216 8.216 8.161 0.055 25033
4438 1 13 . 1 1 18 18 GLN N N 18 122.488 122.488 124.202 -1.714 25033
4439 1 13 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.495 -0.161 25033
4440 1 13 . 1 1 18 18 GLN C C 18 172.958 172.958 173.545 -0.587 25033
4441 1 13 . 1 1 18 18 GLN CA C 18 54.900 54.900 53.843 1.058 25033
4442 1 13 . 1 1 18 18 GLN CB C 18 32.620 32.620 31.799 0.821 25033
4443 1 13 . 1 1 18 18 GLN H H 18 8.573 8.573 7.964 0.609 25033
4444 1 13 . 1 1 19 19 GLN N N 19 116.301 116.301 118.774 -2.473 25033
4445 1 13 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.502 -0.124 25033
4446 1 13 . 1 1 19 19 GLN C C 19 176.902 176.902 174.395 2.507 25033
4447 1 13 . 1 1 19 19 GLN CA C 19 54.215 54.215 53.900 0.315 25033
4448 1 13 . 1 1 19 19 GLN CB C 19 34.638 34.638 32.863 1.775 25033
4449 1 13 . 1 1 19 19 GLN H H 19 8.146 8.146 8.311 -0.165 25033
4450 1 13 . 1 1 20 20 GLY N N 20 109.745 109.745 109.818 -0.073 25033
4451 1 13 . 1 1 20 20 GLY C C 20 170.989 170.989 173.106 -2.117 25033
4452 1 13 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.485 1.450 25033
4453 1 13 . 1 1 20 20 GLY H H 20 8.998 8.998 8.313 0.685 25033
4454 1 13 . 1 1 21 21 THR N N 21 112.645 112.645 115.422 -2.777 25033
4455 1 13 . 1 1 21 21 THR HA H 21 5.361 5.361 5.226 0.135 25033
4456 1 13 . 1 1 21 21 THR C C 21 174.553 174.553 176.100 -1.547 25033
4457 1 13 . 1 1 21 21 THR CA C 21 60.025 60.025 60.077 -0.052 25033
4458 1 13 . 1 1 21 21 THR CB C 21 71.720 71.720 71.150 0.570 25033
4459 1 13 . 1 1 21 21 THR H H 21 8.312 8.312 7.953 0.359 25033
4460 1 13 . 1 1 22 22 VAL N N 22 125.915 125.915 121.152 4.763 25033
4461 1 13 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.915 -0.266 25033
4462 1 13 . 1 1 22 22 VAL C C 22 175.553 175.553 177.929 -2.376 25033
4463 1 13 . 1 1 22 22 VAL CA C 22 64.618 64.618 65.510 -0.892 25033
4464 1 13 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.852 -0.231 25033
4465 1 13 . 1 1 22 22 VAL H H 22 9.092 9.092 8.381 0.711 25033
4466 1 13 . 1 1 23 23 LYS N N 23 135.790 135.790 121.069 14.721 25033
4467 1 13 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.097 0.204 25033
4468 1 13 . 1 1 23 23 LYS C C 23 176.301 176.301 176.633 -0.332 25033
4469 1 13 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.942 -0.332 25033
4470 1 13 . 1 1 23 23 LYS CB C 23 34.300 34.300 32.237 2.062 25033
4471 1 13 . 1 1 23 23 LYS H H 23 9.276 9.276 8.566 0.710 25033
4472 1 13 . 1 1 24 24 TRP N N 24 111.651 111.651 118.487 -6.836 25033
4473 1 13 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.811 -0.188 25033
4474 1 13 . 1 1 24 24 TRP C C 24 173.628 173.628 174.835 -1.207 25033
4475 1 13 . 1 1 24 24 TRP CA C 24 56.300 56.300 56.071 0.229 25033
4476 1 13 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.626 1.634 25033
4477 1 13 . 1 1 24 24 TRP H H 24 7.455 7.455 7.727 -0.272 25033
4478 1 13 . 1 1 25 25 PHE N N 25 121.305 121.305 120.437 0.868 25033
4479 1 13 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.748 -0.463 25033
4480 1 13 . 1 1 25 25 PHE C C 25 172.354 172.354 174.307 -1.953 25033
4481 1 13 . 1 1 25 25 PHE CA C 25 59.372 59.372 56.874 2.498 25033
4482 1 13 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.369 0.200 25033
4483 1 13 . 1 1 25 25 PHE H H 25 9.074 9.074 8.013 1.061 25033
4484 1 13 . 1 1 26 26 ASN N N 26 126.976 126.976 123.421 3.555 25033
4485 1 13 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.794 0.018 25033
4486 1 13 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.181 -0.769 25033
4487 1 13 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.519 -0.433 25033
4488 1 13 . 1 1 26 26 ASN H H 26 8.159 8.159 7.941 0.218 25033
4489 1 13 . 1 1 27 27 ALA N N 27 128.245 128.245 127.009 1.236 25033
4490 1 13 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.046 0.075 25033
4491 1 13 . 1 1 27 27 ALA C C 27 179.031 179.031 178.664 0.367 25033
4492 1 13 . 1 1 27 27 ALA CA C 27 54.425 54.425 54.920 -0.495 25033
4493 1 13 . 1 1 27 27 ALA CB C 27 18.374 18.374 19.171 -0.797 25033
4494 1 13 . 1 1 27 27 ALA H H 27 9.036 9.036 8.466 0.570 25033
4495 1 13 . 1 1 28 28 THR N N 28 113.994 113.994 113.579 0.415 25033
4496 1 13 . 1 1 28 28 THR HA H 28 4.068 4.068 3.966 0.102 25033
4497 1 13 . 1 1 28 28 THR C C 28 176.084 176.084 175.757 0.327 25033
4498 1 13 . 1 1 28 28 THR CA C 28 65.820 65.820 65.069 0.751 25033
4499 1 13 . 1 1 28 28 THR CB C 28 68.291 68.291 68.147 0.144 25033
4500 1 13 . 1 1 28 28 THR H H 28 8.065 8.065 8.110 -0.045 25033
4501 1 13 . 1 1 29 29 LYS N N 29 118.922 118.922 118.833 0.089 25033
4502 1 13 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.242 0.014 25033
4503 1 13 . 1 1 29 29 LYS C C 29 177.201 177.201 176.848 0.353 25033
4504 1 13 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.373 0.515 25033
4505 1 13 . 1 1 29 29 LYS CB C 29 33.740 33.740 31.915 1.825 25033
4506 1 13 . 1 1 29 29 LYS H H 29 7.446 7.446 7.875 -0.429 25033
4507 1 13 . 1 1 30 30 GLY N N 30 107.601 107.601 107.826 -0.225 25033
4508 1 13 . 1 1 30 30 GLY C C 30 172.004 172.004 173.236 -1.232 25033
4509 1 13 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.168 1.236 25033
4510 1 13 . 1 1 30 30 GLY H H 30 8.115 8.115 7.836 0.279 25033
4511 1 13 . 1 1 31 31 PHE N N 31 112.488 112.488 114.857 -2.369 25033
4512 1 13 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.437 0.570 25033
4513 1 13 . 1 1 31 31 PHE CA C 31 55.278 55.278 56.481 -1.203 25033
4514 1 13 . 1 1 31 31 PHE CB C 31 42.388 42.388 39.560 2.828 25033
4515 1 13 . 1 1 31 31 PHE H H 31 6.594 6.594 7.392 -0.798 25033
4516 1 13 . 1 1 32 32 GLY N N 32 105.986 105.986 108.422 -2.436 25033
4517 1 13 . 1 1 32 32 GLY C C 32 170.292 170.292 171.615 -1.323 25033
4518 1 13 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.291 2.078 25033
4519 1 13 . 1 1 32 32 GLY H H 32 8.144 8.144 7.510 0.634 25033
4520 1 13 . 1 1 33 33 PHE N N 33 115.319 115.319 116.099 -0.780 25033
4521 1 13 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.385 0.078 25033
4522 1 13 . 1 1 33 33 PHE C C 33 175.037 175.037 175.006 0.031 25033
4523 1 13 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.514 -1.219 25033
4524 1 13 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.299 0.493 25033
4525 1 13 . 1 1 33 33 PHE H H 33 7.971 7.971 8.065 -0.094 25033
4526 1 13 . 1 1 34 34 ILE N N 34 122.140 122.140 121.306 0.834 25033
4527 1 13 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.662 -0.345 25033
4528 1 13 . 1 1 34 34 ILE C C 34 174.526 174.526 175.536 -1.010 25033
4529 1 13 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.561 0.236 25033
4530 1 13 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.572 2.011 25033
4531 1 13 . 1 1 34 34 ILE H H 34 9.511 9.511 9.008 0.503 25033
4532 1 13 . 1 1 35 35 THR N N 35 126.580 126.580 119.022 7.558 25033
4533 1 13 . 1 1 35 35 THR HA H 35 5.143 5.143 5.265 -0.122 25033
4534 1 13 . 1 1 35 35 THR CA C 35 59.330 59.330 58.302 1.028 25033
4535 1 13 . 1 1 35 35 THR CB C 35 70.258 70.258 68.757 1.501 25033
4536 1 13 . 1 1 35 35 THR H H 35 9.416 9.416 8.682 0.734 25033
4537 1 13 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.584 0.015 25033
4538 1 13 . 1 1 36 36 PRO C C 36 177.390 177.390 177.670 -0.280 25033
4539 1 13 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.452 -0.232 25033
4540 1 13 . 1 1 36 36 PRO CB C 36 32.470 32.470 31.816 0.655 25033
4541 1 13 . 1 1 37 37 GLY N N 37 112.033 112.033 110.818 1.215 25033
4542 1 13 . 1 1 37 37 GLY C C 37 169.261 169.261 174.523 -5.262 25033
4543 1 13 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.623 1.834 25033
4544 1 13 . 1 1 37 37 GLY H H 37 9.349 9.349 8.676 0.673 25033
4545 1 13 . 1 1 38 38 GLY N N 38 109.050 109.050 108.949 0.101 25033
4546 1 13 . 1 1 38 38 GLY C C 38 175.177 175.177 174.656 0.521 25033
4547 1 13 . 1 1 38 38 GLY H H 38 8.756 8.756 7.743 1.013 25033
4548 1 13 . 1 1 39 39 GLY N N 39 107.730 107.730 107.737 -0.007 25033
4549 1 13 . 1 1 39 39 GLY C C 39 173.870 173.870 174.273 -0.403 25033
4550 1 13 . 1 1 39 39 GLY CA C 39 44.258 44.258 44.437 -0.179 25033
4551 1 13 . 1 1 39 39 GLY H H 39 7.725 7.725 7.699 0.026 25033
4552 1 13 . 1 1 40 40 GLY N N 40 107.183 107.183 111.917 -4.734 25033
4553 1 13 . 1 1 40 40 GLY C C 40 173.067 173.067 173.982 -0.915 25033
4554 1 13 . 1 1 40 40 GLY CA C 40 43.760 43.760 44.925 -1.165 25033
4555 1 13 . 1 1 40 40 GLY H H 40 8.096 8.096 8.292 -0.196 25033
4556 1 13 . 1 1 41 41 GLU N N 41 119.455 119.455 122.332 -2.877 25033
4557 1 13 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.607 -0.429 25033
4558 1 13 . 1 1 41 41 GLU C C 41 175.900 175.900 174.496 1.404 25033
4559 1 13 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.143 1.234 25033
4560 1 13 . 1 1 41 41 GLU CB C 41 30.600 30.600 31.967 -1.367 25033
4561 1 13 . 1 1 41 41 GLU H H 41 8.199 8.199 8.232 -0.033 25033
4562 1 13 . 1 1 42 42 ASP N N 42 119.784 119.784 121.951 -2.167 25033
4563 1 13 . 1 1 42 42 ASP HA H 42 4.857 4.857 4.958 -0.101 25033
4564 1 13 . 1 1 42 42 ASP C C 42 176.474 176.474 175.083 1.391 25033
4565 1 13 . 1 1 42 42 ASP CA C 42 55.441 55.441 52.894 2.547 25033
4566 1 13 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.928 -0.440 25033
4567 1 13 . 1 1 42 42 ASP H H 42 8.277 8.277 8.294 -0.017 25033
4568 1 13 . 1 1 43 43 LEU N N 43 122.515 122.515 120.529 1.986 25033
4569 1 13 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.870 -0.183 25033
4570 1 13 . 1 1 43 43 LEU C C 43 175.759 175.759 176.319 -0.560 25033
4571 1 13 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.515 -0.211 25033
4572 1 13 . 1 1 43 43 LEU CB C 43 45.449 45.449 46.351 -0.902 25033
4573 1 13 . 1 1 43 43 LEU H H 43 9.423 9.423 8.567 0.856 25033
4574 1 13 . 1 1 44 44 PHE N N 44 125.962 125.962 120.541 5.421 25033
4575 1 13 . 1 1 44 44 PHE HA H 44 3.922 3.922 5.064 -1.142 25033
4576 1 13 . 1 1 44 44 PHE C C 44 172.844 172.844 174.692 -1.848 25033
4577 1 13 . 1 1 44 44 PHE CA C 44 57.880 57.880 56.822 1.058 25033
4578 1 13 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.911 0.439 25033
4579 1 13 . 1 1 44 44 PHE H H 44 8.465 8.465 8.494 -0.029 25033
4580 1 13 . 1 1 45 45 VAL N N 45 123.552 123.552 124.001 -0.449 25033
4581 1 13 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.421 0.236 25033
4582 1 13 . 1 1 45 45 VAL C C 45 177.433 177.433 173.845 3.588 25033
4583 1 13 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.679 -2.219 25033
4584 1 13 . 1 1 45 45 VAL CB C 45 34.884 34.884 35.486 -0.602 25033
4585 1 13 . 1 1 45 45 VAL H H 45 7.715 7.715 7.960 -0.245 25033
4586 1 13 . 1 1 46 46 HIS N N 46 127.300 127.300 125.090 2.210 25033
4587 1 13 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.949 -0.124 25033
4588 1 13 . 1 1 46 46 HIS C C 46 176.469 176.469 174.625 1.844 25033
4589 1 13 . 1 1 46 46 HIS CA C 46 55.929 55.929 55.031 0.898 25033
4590 1 13 . 1 1 46 46 HIS CB C 46 34.399 34.399 32.463 1.936 25033
4591 1 13 . 1 1 46 46 HIS H H 46 9.104 9.104 8.666 0.438 25033
4592 1 13 . 1 1 47 47 GLN N N 47 125.105 125.105 122.016 3.089 25033
4593 1 13 . 1 1 47 47 GLN H H 47 8.352 8.352 8.773 -0.421 25033
4594 1 13 . 1 1 48 48 THR HA H 48 4.310 4.310 4.429 -0.119 25033
4595 1 13 . 1 1 48 48 THR C C 48 175.568 175.568 175.036 0.532 25033
4596 1 13 . 1 1 48 48 THR CA C 48 64.770 64.770 62.965 1.805 25033
4597 1 13 . 1 1 48 48 THR CB C 48 70.054 70.054 69.231 0.823 25033
4598 1 13 . 1 1 49 49 ASN N N 49 118.142 118.142 118.536 -0.394 25033
4599 1 13 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.818 0.342 25033
4600 1 13 . 1 1 49 49 ASN C C 49 172.914 172.914 174.363 -1.449 25033
4601 1 13 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.431 0.920 25033
4602 1 13 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.665 0.862 25033
4603 1 13 . 1 1 49 49 ASN H H 49 8.452 8.452 8.437 0.015 25033
4604 1 13 . 1 1 50 50 ILE N N 50 119.226 119.226 121.392 -2.166 25033
4605 1 13 . 1 1 50 50 ILE HA H 50 4.112 4.112 3.858 0.254 25033
4606 1 13 . 1 1 50 50 ILE CA C 50 61.606 61.606 62.648 -1.042 25033
4607 1 13 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.078 2.284 25033
4608 1 13 . 1 1 50 50 ILE H H 50 7.354 7.354 8.061 -0.707 25033
4609 1 13 . 1 1 51 51 ASN N N 51 128.460 128.460 123.975 4.485 25033
4610 1 13 . 1 1 51 51 ASN C C 51 174.614 174.614 173.669 0.945 25033
4611 1 13 . 1 1 51 51 ASN H H 51 9.266 9.266 8.007 1.259 25033
4612 1 13 . 1 1 52 52 SER N N 52 117.246 117.246 115.077 2.169 25033
4613 1 13 . 1 1 52 52 SER HA H 52 4.413 4.413 4.795 -0.382 25033
4614 1 13 . 1 1 52 52 SER C C 52 174.139 174.139 174.576 -0.437 25033
4615 1 13 . 1 1 52 52 SER CA C 52 58.378 58.378 57.797 0.580 25033
4616 1 13 . 1 1 52 52 SER CB C 52 64.371 64.371 65.426 -1.055 25033
4617 1 13 . 1 1 52 52 SER H H 52 7.973 7.973 8.328 -0.355 25033
4618 1 13 . 1 1 53 53 GLU N N 53 123.628 123.628 122.146 1.482 25033
4619 1 13 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.298 -0.000 25033
4620 1 13 . 1 1 53 53 GLU C C 53 176.960 176.960 177.036 -0.076 25033
4621 1 13 . 1 1 53 53 GLU CA C 53 57.270 57.270 57.485 -0.215 25033
4622 1 13 . 1 1 53 53 GLU CB C 53 29.861 29.861 30.191 -0.330 25033
4623 1 13 . 1 1 53 53 GLU H H 53 8.641 8.641 8.710 -0.069 25033
4624 1 13 . 1 1 54 54 GLY N N 54 110.282 110.282 106.630 3.652 25033
4625 1 13 . 1 1 54 54 GLY CA C 54 44.600 44.600 45.067 -0.467 25033
4626 1 13 . 1 1 54 54 GLY H H 54 8.225 8.225 8.051 0.174 25033
4627 1 13 . 1 1 55 55 PHE HA H 55 4.820 4.820 5.115 -0.295 25033
4628 1 13 . 1 1 55 55 PHE C C 55 175.836 175.836 174.321 1.515 25033
4629 1 13 . 1 1 55 55 PHE CA C 55 52.690 52.690 56.596 -3.905 25033
4630 1 13 . 1 1 55 55 PHE CB C 55 38.095 38.095 40.521 -2.426 25033
4631 1 13 . 1 1 56 56 ARG N N 56 120.907 120.907 120.776 0.131 25033
4632 1 13 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.574 -0.310 25033
4633 1 13 . 1 1 56 56 ARG C C 56 175.618 175.618 175.843 -0.225 25033
4634 1 13 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.493 0.017 25033
4635 1 13 . 1 1 56 56 ARG CB C 56 32.020 32.020 32.038 -0.018 25033
4636 1 13 . 1 1 56 56 ARG H H 56 8.153 8.153 8.702 -0.549 25033
4637 1 13 . 1 1 57 57 SER N N 57 123.117 123.117 118.215 4.902 25033
4638 1 13 . 1 1 57 57 SER H H 57 7.834 7.834 8.590 -0.756 25033
4639 1 13 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.972 -0.692 25033
4640 1 13 . 1 1 58 58 LEU C C 58 174.842 174.842 175.630 -0.788 25033
4641 1 13 . 1 1 58 58 LEU CA C 58 53.760 53.760 53.855 -0.095 25033
4642 1 13 . 1 1 58 58 LEU CB C 58 42.580 42.580 44.504 -1.924 25033
4643 1 13 . 1 1 59 59 ARG N N 59 119.557 119.557 119.235 0.322 25033
4644 1 13 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.534 0.051 25033
4645 1 13 . 1 1 59 59 ARG C C 59 175.256 175.256 174.684 0.572 25033
4646 1 13 . 1 1 59 59 ARG CA C 59 54.112 54.112 55.050 -0.938 25033
4647 1 13 . 1 1 59 59 ARG CB C 59 32.970 32.970 34.475 -1.505 25033
4648 1 13 . 1 1 59 59 ARG H H 59 8.529 8.529 8.698 -0.169 25033
4649 1 13 . 1 1 60 60 GLU N N 60 121.597 121.597 121.869 -0.272 25033
4650 1 13 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.140 -0.559 25033
4651 1 13 . 1 1 60 60 GLU C C 60 177.281 177.281 176.670 0.611 25033
4652 1 13 . 1 1 60 60 GLU CA C 60 58.301 58.301 58.088 0.213 25033
4653 1 13 . 1 1 60 60 GLU CB C 60 29.261 29.261 28.986 0.275 25033
4654 1 13 . 1 1 60 60 GLU H H 60 8.691 8.691 8.825 -0.134 25033
4655 1 13 . 1 1 61 61 GLY N N 61 113.554 113.554 113.420 0.134 25033
4656 1 13 . 1 1 61 61 GLY C C 61 174.068 174.068 174.826 -0.758 25033
4657 1 13 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.665 0.578 25033
4658 1 13 . 1 1 61 61 GLY H H 61 9.151 9.151 8.843 0.308 25033
4659 1 13 . 1 1 62 62 GLU N N 62 121.639 121.639 122.680 -1.041 25033
4660 1 13 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.314 -0.110 25033
4661 1 13 . 1 1 62 62 GLU C C 62 175.439 175.439 176.530 -1.091 25033
4662 1 13 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.442 0.900 25033
4663 1 13 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.396 0.529 25033
4664 1 13 . 1 1 62 62 GLU H H 62 7.889 7.889 7.920 -0.031 25033
4665 1 13 . 1 1 63 63 VAL N N 63 125.003 125.003 126.470 -1.467 25033
4666 1 13 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.702 0.046 25033
4667 1 13 . 1 1 63 63 VAL C C 63 176.639 176.639 176.463 0.176 25033
4668 1 13 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.614 1.017 25033
4669 1 13 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.410 -0.053 25033
4670 1 13 . 1 1 63 63 VAL H H 63 8.477 8.477 8.329 0.148 25033
4671 1 13 . 1 1 64 64 VAL N N 64 120.113 120.113 122.621 -2.508 25033
4672 1 13 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.662 0.342 25033
4673 1 13 . 1 1 64 64 VAL C C 64 173.790 173.790 174.425 -0.635 25033
4674 1 13 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.444 -0.835 25033
4675 1 13 . 1 1 64 64 VAL CB C 64 36.360 36.360 34.851 1.509 25033
4676 1 13 . 1 1 64 64 VAL H H 64 8.686 8.686 8.955 -0.269 25033
4677 1 13 . 1 1 65 65 GLU N N 65 120.433 120.433 123.146 -2.713 25033
4678 1 13 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.182 0.265 25033
4679 1 13 . 1 1 65 65 GLU C C 65 175.584 175.584 175.800 -0.216 25033
4680 1 13 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.410 -0.020 25033
4681 1 13 . 1 1 65 65 GLU CB C 65 34.003 34.003 32.542 1.461 25033
4682 1 13 . 1 1 65 65 GLU H H 65 9.003 9.003 8.633 0.370 25033
4683 1 13 . 1 1 66 66 PHE N N 66 116.104 116.104 120.469 -4.365 25033
4684 1 13 . 1 1 66 66 PHE HA H 66 5.061 5.061 4.955 0.106 25033
4685 1 13 . 1 1 66 66 PHE C C 66 173.001 173.001 172.718 0.283 25033
4686 1 13 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.917 -0.060 25033
4687 1 13 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.184 0.248 25033
4688 1 13 . 1 1 66 66 PHE H H 66 8.172 8.172 7.732 0.440 25033
4689 1 13 . 1 1 67 67 GLU N N 67 117.574 117.574 119.006 -1.432 25033
4690 1 13 . 1 1 67 67 GLU HA H 67 4.872 4.872 4.847 0.025 25033
4691 1 13 . 1 1 67 67 GLU C C 67 175.327 175.327 175.101 0.226 25033
4692 1 13 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.641 -0.000 25033
4693 1 13 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.493 -0.473 25033
4694 1 13 . 1 1 67 67 GLU H H 67 8.668 8.668 8.705 -0.037 25033
4695 1 13 . 1 1 68 68 VAL N N 68 120.881 120.881 124.903 -4.022 25033
4696 1 13 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.346 0.666 25033
4697 1 13 . 1 1 68 68 VAL C C 68 176.140 176.140 175.637 0.503 25033
4698 1 13 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.704 -0.366 25033
4699 1 13 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.491 1.515 25033
4700 1 13 . 1 1 68 68 VAL H H 68 8.748 8.748 8.638 0.110 25033
4701 1 13 . 1 1 69 69 GLU N N 69 128.110 128.110 129.151 -1.041 25033
4702 1 13 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.685 0.020 25033
4703 1 13 . 1 1 69 69 GLU C C 69 174.573 174.573 174.564 0.009 25033
4704 1 13 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.330 0.623 25033
4705 1 13 . 1 1 69 69 GLU CB C 69 34.290 34.290 34.082 0.208 25033
4706 1 13 . 1 1 69 69 GLU H H 69 9.070 9.070 8.893 0.177 25033
4707 1 13 . 1 1 70 70 ALA N N 70 127.944 127.944 125.401 2.543 25033
4708 1 13 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.251 -0.247 25033
4709 1 13 . 1 1 70 70 ALA C C 70 178.073 178.073 177.492 0.581 25033
4710 1 13 . 1 1 70 70 ALA CA C 70 50.959 50.959 51.023 -0.064 25033
4711 1 13 . 1 1 70 70 ALA CB C 70 19.489 19.489 19.788 -0.299 25033
4712 1 13 . 1 1 70 70 ALA H H 70 8.671 8.671 8.528 0.143 25033
4713 1 13 . 1 1 71 71 GLY N N 71 110.340 110.340 111.612 -1.272 25033
4714 1 13 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.896 0.120 25033
4715 1 13 . 1 1 71 71 GLY H H 71 8.445 8.445 8.042 0.403 25033
4716 1 13 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.364 0.053 25033
4717 1 13 . 1 1 72 72 PRO C C 72 176.835 176.835 176.765 0.070 25033
4718 1 13 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.618 -0.458 25033
4719 1 13 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.607 0.273 25033
4720 1 13 . 1 1 73 73 ASP N N 73 116.498 116.498 117.948 -1.450 25033
4721 1 13 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.561 -0.046 25033
4722 1 13 . 1 1 73 73 ASP C C 73 176.775 176.775 177.243 -0.468 25033
4723 1 13 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.419 -0.871 25033
4724 1 13 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.642 -0.408 25033
4725 1 13 . 1 1 73 73 ASP H H 73 8.248 8.248 8.234 0.014 25033
4726 1 13 . 1 1 74 74 GLY N N 74 107.369 107.369 107.893 -0.524 25033
4727 1 13 . 1 1 74 74 GLY C C 74 174.331 174.331 174.138 0.193 25033
4728 1 13 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.795 0.783 25033
4729 1 13 . 1 1 74 74 GLY H H 74 8.153 8.153 7.695 0.458 25033
4730 1 13 . 1 1 75 75 ARG N N 75 120.942 120.942 120.963 -0.021 25033
4731 1 13 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.466 0.076 25033
4732 1 13 . 1 1 75 75 ARG C C 75 176.652 176.652 175.252 1.400 25033
4733 1 13 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.638 0.020 25033
4734 1 13 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.174 -0.265 25033
4735 1 13 . 1 1 75 75 ARG H H 75 7.670 7.670 8.350 -0.680 25033
4736 1 13 . 1 1 76 76 SER N N 76 120.181 120.181 115.641 4.540 25033
4737 1 13 . 1 1 76 76 SER HA H 76 5.035 5.035 5.436 -0.401 25033
4738 1 13 . 1 1 76 76 SER C C 76 172.816 172.816 174.019 -1.203 25033
4739 1 13 . 1 1 76 76 SER CA C 76 59.080 59.080 56.973 2.107 25033
4740 1 13 . 1 1 76 76 SER CB C 76 64.850 64.850 65.635 -0.785 25033
4741 1 13 . 1 1 76 76 SER H H 76 8.808 8.808 8.383 0.425 25033
4742 1 13 . 1 1 77 77 LYS N N 77 121.202 121.202 122.202 -1.000 25033
4743 1 13 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.735 0.439 25033
4744 1 13 . 1 1 77 77 LYS C C 77 173.706 173.706 174.117 -0.411 25033
4745 1 13 . 1 1 77 77 LYS CA C 77 54.599 54.599 54.374 0.225 25033
4746 1 13 . 1 1 77 77 LYS CB C 77 36.035 36.035 35.784 0.251 25033
4747 1 13 . 1 1 77 77 LYS H H 77 8.982 8.982 8.814 0.168 25033
4748 1 13 . 1 1 78 78 ALA N N 78 124.064 124.064 122.633 1.431 25033
4749 1 13 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.748 0.256 25033
4750 1 13 . 1 1 78 78 ALA C C 78 175.979 175.979 176.183 -0.204 25033
4751 1 13 . 1 1 78 78 ALA CA C 78 50.445 50.445 50.809 -0.364 25033
4752 1 13 . 1 1 78 78 ALA CB C 78 20.136 20.136 19.757 0.379 25033
4753 1 13 . 1 1 78 78 ALA H H 78 8.706 8.706 8.474 0.232 25033
4754 1 13 . 1 1 79 79 VAL N N 79 113.264 113.264 116.542 -3.278 25033
4755 1 13 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.575 0.268 25033
4756 1 13 . 1 1 79 79 VAL C C 79 174.744 174.744 174.604 0.140 25033
4757 1 13 . 1 1 79 79 VAL CA C 79 59.073 59.073 60.047 -0.974 25033
4758 1 13 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.510 0.086 25033
4759 1 13 . 1 1 79 79 VAL H H 79 9.165 9.165 7.674 1.491 25033
4760 1 13 . 1 1 80 80 ASN N N 80 120.084 120.084 115.506 4.578 25033
4761 1 13 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.373 -0.017 25033
4762 1 13 . 1 1 80 80 ASN C C 80 175.391 175.391 173.971 1.420 25033
4763 1 13 . 1 1 80 80 ASN CA C 80 53.734 53.734 54.099 -0.365 25033
4764 1 13 . 1 1 80 80 ASN CB C 80 37.121 37.121 37.364 -0.243 25033
4765 1 13 . 1 1 80 80 ASN H H 80 8.923 8.923 8.642 0.281 25033
4766 1 13 . 1 1 81 81 VAL N N 81 119.178 119.178 117.510 1.668 25033
4767 1 13 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.289 0.458 25033
4768 1 13 . 1 1 81 81 VAL C C 81 176.340 176.340 177.239 -0.899 25033
4769 1 13 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.871 0.289 25033
4770 1 13 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.327 0.803 25033
4771 1 13 . 1 1 81 81 VAL H H 81 8.282 8.282 7.700 0.582 25033
4772 1 14 . 1 1 12 12 SER N N 12 116.112 116.112 116.006 0.106 25033
4773 1 14 . 1 1 12 12 SER C C 12 175.271 175.271 175.454 -0.183 25033
4774 1 14 . 1 1 12 12 SER CA C 12 58.570 58.570 58.024 0.546 25033
4775 1 14 . 1 1 12 12 SER CB C 12 63.984 63.984 64.377 -0.393 25033
4776 1 14 . 1 1 12 12 SER H H 12 8.422 8.422 8.308 0.114 25033
4777 1 14 . 1 1 13 13 GLY N N 13 111.178 111.178 112.749 -1.571 25033
4778 1 14 . 1 1 13 13 GLY C C 13 174.238 174.238 174.462 -0.224 25033
4779 1 14 . 1 1 13 13 GLY CA C 13 45.520 45.520 45.025 0.495 25033
4780 1 14 . 1 1 13 13 GLY H H 13 8.537 8.537 8.580 -0.043 25033
4781 1 14 . 1 1 14 14 GLU N N 14 120.547 120.547 120.101 0.446 25033
4782 1 14 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.459 -0.192 25033
4783 1 14 . 1 1 14 14 GLU C C 14 176.455 176.455 175.772 0.683 25033
4784 1 14 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.409 1.344 25033
4785 1 14 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.881 0.583 25033
4786 1 14 . 1 1 14 14 GLU H H 14 8.285 8.285 8.371 -0.086 25033
4787 1 14 . 1 1 15 15 GLN N N 15 121.185 121.185 125.342 -4.157 25033
4788 1 14 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.305 0.044 25033
4789 1 14 . 1 1 15 15 GLN C C 15 175.494 175.494 175.153 0.341 25033
4790 1 14 . 1 1 15 15 GLN CA C 15 55.670 55.670 56.224 -0.554 25033
4791 1 14 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.397 0.013 25033
4792 1 14 . 1 1 15 15 GLN H H 15 8.444 8.444 8.278 0.166 25033
4793 1 14 . 1 1 16 16 LEU N N 16 123.934 123.934 127.603 -3.669 25033
4794 1 14 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.570 -0.229 25033
4795 1 14 . 1 1 16 16 LEU C C 16 176.942 176.942 175.145 1.797 25033
4796 1 14 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.662 0.842 25033
4797 1 14 . 1 1 16 16 LEU CB C 16 42.519 42.519 43.455 -0.936 25033
4798 1 14 . 1 1 16 16 LEU H H 16 8.289 8.289 8.604 -0.315 25033
4799 1 14 . 1 1 17 17 ARG N N 17 122.044 122.044 122.411 -0.367 25033
4800 1 14 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.921 -0.457 25033
4801 1 14 . 1 1 17 17 ARG C C 17 175.829 175.829 175.774 0.055 25033
4802 1 14 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.910 0.762 25033
4803 1 14 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.730 -0.900 25033
4804 1 14 . 1 1 17 17 ARG H H 17 8.216 8.216 8.392 -0.176 25033
4805 1 14 . 1 1 18 18 GLN N N 18 122.488 122.488 123.431 -0.943 25033
4806 1 14 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.488 -0.154 25033
4807 1 14 . 1 1 18 18 GLN C C 18 172.958 172.958 173.404 -0.446 25033
4808 1 14 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.086 0.814 25033
4809 1 14 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.799 -0.179 25033
4810 1 14 . 1 1 18 18 GLN H H 18 8.573 8.573 8.044 0.529 25033
4811 1 14 . 1 1 19 19 GLN N N 19 116.301 116.301 119.987 -3.686 25033
4812 1 14 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.260 0.118 25033
4813 1 14 . 1 1 19 19 GLN C C 19 176.902 176.902 174.772 2.130 25033
4814 1 14 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.140 0.075 25033
4815 1 14 . 1 1 19 19 GLN CB C 19 34.638 34.638 32.786 1.852 25033
4816 1 14 . 1 1 19 19 GLN H H 19 8.146 8.146 8.410 -0.264 25033
4817 1 14 . 1 1 20 20 GLY N N 20 109.745 109.745 110.219 -0.474 25033
4818 1 14 . 1 1 20 20 GLY C C 20 170.989 170.989 172.532 -1.543 25033
4819 1 14 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.197 1.738 25033
4820 1 14 . 1 1 20 20 GLY H H 20 8.998 8.998 8.129 0.869 25033
4821 1 14 . 1 1 21 21 THR N N 21 112.645 112.645 114.490 -1.845 25033
4822 1 14 . 1 1 21 21 THR HA H 21 5.361 5.361 5.140 0.221 25033
4823 1 14 . 1 1 21 21 THR C C 21 174.553 174.553 175.642 -1.089 25033
4824 1 14 . 1 1 21 21 THR CA C 21 60.025 60.025 59.770 0.255 25033
4825 1 14 . 1 1 21 21 THR CB C 21 71.720 71.720 70.965 0.755 25033
4826 1 14 . 1 1 21 21 THR H H 21 8.312 8.312 8.359 -0.047 25033
4827 1 14 . 1 1 22 22 VAL N N 22 125.915 125.915 120.823 5.092 25033
4828 1 14 . 1 1 22 22 VAL HA H 22 3.649 3.649 4.010 -0.361 25033
4829 1 14 . 1 1 22 22 VAL C C 22 175.553 175.553 177.919 -2.366 25033
4830 1 14 . 1 1 22 22 VAL CA C 22 64.618 64.618 63.347 1.271 25033
4831 1 14 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.247 0.374 25033
4832 1 14 . 1 1 22 22 VAL H H 22 9.092 9.092 8.345 0.747 25033
4833 1 14 . 1 1 23 23 LYS N N 23 135.790 135.790 119.394 16.396 25033
4834 1 14 . 1 1 23 23 LYS HA H 23 4.301 4.301 3.975 0.326 25033
4835 1 14 . 1 1 23 23 LYS C C 23 176.301 176.301 176.547 -0.246 25033
4836 1 14 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.895 -0.284 25033
4837 1 14 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.343 2.957 25033
4838 1 14 . 1 1 23 23 LYS H H 23 9.276 9.276 8.469 0.807 25033
4839 1 14 . 1 1 24 24 TRP N N 24 111.651 111.651 119.242 -7.591 25033
4840 1 14 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.832 -0.209 25033
4841 1 14 . 1 1 24 24 TRP C C 24 173.628 173.628 174.791 -1.163 25033
4842 1 14 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.488 0.812 25033
4843 1 14 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.895 1.365 25033
4844 1 14 . 1 1 24 24 TRP H H 24 7.455 7.455 7.597 -0.142 25033
4845 1 14 . 1 1 25 25 PHE N N 25 121.305 121.305 120.340 0.965 25033
4846 1 14 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.820 -0.535 25033
4847 1 14 . 1 1 25 25 PHE C C 25 172.354 172.354 174.041 -1.687 25033
4848 1 14 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.159 2.213 25033
4849 1 14 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.568 0.001 25033
4850 1 14 . 1 1 25 25 PHE H H 25 9.074 9.074 8.175 0.899 25033
4851 1 14 . 1 1 26 26 ASN N N 26 126.976 126.976 123.188 3.788 25033
4852 1 14 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.936 -0.124 25033
4853 1 14 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.379 -0.967 25033
4854 1 14 . 1 1 26 26 ASN CB C 26 39.086 39.086 40.101 -1.015 25033
4855 1 14 . 1 1 26 26 ASN H H 26 8.159 8.159 7.682 0.477 25033
4856 1 14 . 1 1 27 27 ALA N N 27 128.245 128.245 127.237 1.008 25033
4857 1 14 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.414 -0.293 25033
4858 1 14 . 1 1 27 27 ALA C C 27 179.031 179.031 179.053 -0.022 25033
4859 1 14 . 1 1 27 27 ALA CA C 27 54.425 54.425 54.552 -0.127 25033
4860 1 14 . 1 1 27 27 ALA CB C 27 18.374 18.374 19.093 -0.719 25033
4861 1 14 . 1 1 27 27 ALA H H 27 9.036 9.036 8.657 0.379 25033
4862 1 14 . 1 1 28 28 THR N N 28 113.994 113.994 114.581 -0.587 25033
4863 1 14 . 1 1 28 28 THR HA H 28 4.068 4.068 3.955 0.113 25033
4864 1 14 . 1 1 28 28 THR C C 28 176.084 176.084 175.695 0.389 25033
4865 1 14 . 1 1 28 28 THR CA C 28 65.820 65.820 65.020 0.800 25033
4866 1 14 . 1 1 28 28 THR CB C 28 68.291 68.291 68.238 0.053 25033
4867 1 14 . 1 1 28 28 THR H H 28 8.065 8.065 8.302 -0.237 25033
4868 1 14 . 1 1 29 29 LYS N N 29 118.922 118.922 118.416 0.506 25033
4869 1 14 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.059 0.197 25033
4870 1 14 . 1 1 29 29 LYS C C 29 177.201 177.201 176.920 0.281 25033
4871 1 14 . 1 1 29 29 LYS CA C 29 56.888 56.888 55.909 0.979 25033
4872 1 14 . 1 1 29 29 LYS CB C 29 33.740 33.740 31.234 2.506 25033
4873 1 14 . 1 1 29 29 LYS H H 29 7.446 7.446 7.846 -0.400 25033
4874 1 14 . 1 1 30 30 GLY N N 30 107.601 107.601 107.542 0.059 25033
4875 1 14 . 1 1 30 30 GLY C C 30 172.004 172.004 173.389 -1.385 25033
4876 1 14 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.092 1.312 25033
4877 1 14 . 1 1 30 30 GLY H H 30 8.115 8.115 7.731 0.384 25033
4878 1 14 . 1 1 31 31 PHE N N 31 112.488 112.488 113.588 -1.100 25033
4879 1 14 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.764 0.243 25033
4880 1 14 . 1 1 31 31 PHE CA C 31 55.278 55.278 55.966 -0.688 25033
4881 1 14 . 1 1 31 31 PHE CB C 31 42.388 42.388 39.318 3.070 25033
4882 1 14 . 1 1 31 31 PHE H H 31 6.594 6.594 7.241 -0.647 25033
4883 1 14 . 1 1 32 32 GLY N N 32 105.986 105.986 107.602 -1.616 25033
4884 1 14 . 1 1 32 32 GLY C C 32 170.292 170.292 171.513 -1.221 25033
4885 1 14 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.010 2.359 25033
4886 1 14 . 1 1 32 32 GLY H H 32 8.144 8.144 8.273 -0.129 25033
4887 1 14 . 1 1 33 33 PHE N N 33 115.319 115.319 116.520 -1.201 25033
4888 1 14 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.508 -0.045 25033
4889 1 14 . 1 1 33 33 PHE C C 33 175.037 175.037 175.082 -0.045 25033
4890 1 14 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.475 -1.180 25033
4891 1 14 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.303 0.489 25033
4892 1 14 . 1 1 33 33 PHE H H 33 7.971 7.971 7.928 0.043 25033
4893 1 14 . 1 1 34 34 ILE N N 34 122.140 122.140 120.239 1.901 25033
4894 1 14 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.715 -0.398 25033
4895 1 14 . 1 1 34 34 ILE C C 34 174.526 174.526 175.281 -0.755 25033
4896 1 14 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.485 0.312 25033
4897 1 14 . 1 1 34 34 ILE CB C 34 42.583 42.583 42.045 0.538 25033
4898 1 14 . 1 1 34 34 ILE H H 34 9.511 9.511 8.667 0.844 25033
4899 1 14 . 1 1 35 35 THR N N 35 126.580 126.580 120.830 5.750 25033
4900 1 14 . 1 1 35 35 THR HA H 35 5.143 5.143 5.039 0.104 25033
4901 1 14 . 1 1 35 35 THR CA C 35 59.330 59.330 57.668 1.662 25033
4902 1 14 . 1 1 35 35 THR CB C 35 70.258 70.258 69.103 1.155 25033
4903 1 14 . 1 1 35 35 THR H H 35 9.416 9.416 8.762 0.654 25033
4904 1 14 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.577 0.022 25033
4905 1 14 . 1 1 36 36 PRO C C 36 177.390 177.390 178.080 -0.690 25033
4906 1 14 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.310 -0.090 25033
4907 1 14 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.129 0.341 25033
4908 1 14 . 1 1 37 37 GLY N N 37 112.033 112.033 113.194 -1.161 25033
4909 1 14 . 1 1 37 37 GLY C C 37 169.261 169.261 174.945 -5.684 25033
4910 1 14 . 1 1 37 37 GLY CA C 37 46.457 46.457 45.239 1.218 25033
4911 1 14 . 1 1 37 37 GLY H H 37 9.349 9.349 8.729 0.620 25033
4912 1 14 . 1 1 38 38 GLY N N 38 109.050 109.050 109.955 -0.905 25033
4913 1 14 . 1 1 38 38 GLY C C 38 175.177 175.177 175.995 -0.818 25033
4914 1 14 . 1 1 38 38 GLY H H 38 8.756 8.756 7.994 0.762 25033
4915 1 14 . 1 1 39 39 GLY N N 39 107.730 107.730 109.995 -2.265 25033
4916 1 14 . 1 1 39 39 GLY C C 39 173.870 173.870 174.912 -1.042 25033
4917 1 14 . 1 1 39 39 GLY CA C 39 44.258 44.258 46.402 -2.144 25033
4918 1 14 . 1 1 39 39 GLY H H 39 7.725 7.725 8.391 -0.666 25033
4919 1 14 . 1 1 40 40 GLY N N 40 107.183 107.183 109.233 -2.050 25033
4920 1 14 . 1 1 40 40 GLY C C 40 173.067 173.067 173.371 -0.304 25033
4921 1 14 . 1 1 40 40 GLY CA C 40 43.760 43.760 45.076 -1.316 25033
4922 1 14 . 1 1 40 40 GLY H H 40 8.096 8.096 8.415 -0.319 25033
4923 1 14 . 1 1 41 41 GLU N N 41 119.455 119.455 121.090 -1.635 25033
4924 1 14 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.679 -0.501 25033
4925 1 14 . 1 1 41 41 GLU C C 41 175.900 175.900 175.099 0.801 25033
4926 1 14 . 1 1 41 41 GLU CA C 41 56.377 56.377 54.679 1.698 25033
4927 1 14 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.700 -0.100 25033
4928 1 14 . 1 1 41 41 GLU H H 41 8.199 8.199 8.218 -0.019 25033
4929 1 14 . 1 1 42 42 ASP N N 42 119.784 119.784 123.199 -3.415 25033
4930 1 14 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.477 -0.620 25033
4931 1 14 . 1 1 42 42 ASP C C 42 176.474 176.474 175.920 0.554 25033
4932 1 14 . 1 1 42 42 ASP CA C 42 55.441 55.441 52.821 2.620 25033
4933 1 14 . 1 1 42 42 ASP CB C 42 41.488 41.488 42.612 -1.124 25033
4934 1 14 . 1 1 42 42 ASP H H 42 8.277 8.277 8.413 -0.136 25033
4935 1 14 . 1 1 43 43 LEU N N 43 122.515 122.515 117.548 4.967 25033
4936 1 14 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.999 -0.312 25033
4937 1 14 . 1 1 43 43 LEU C C 43 175.759 175.759 175.726 0.033 25033
4938 1 14 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.952 -0.648 25033
4939 1 14 . 1 1 43 43 LEU CB C 43 45.449 45.449 45.320 0.129 25033
4940 1 14 . 1 1 43 43 LEU H H 43 9.423 9.423 8.132 1.291 25033
4941 1 14 . 1 1 44 44 PHE N N 44 125.962 125.962 120.814 5.148 25033
4942 1 14 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.861 -0.939 25033
4943 1 14 . 1 1 44 44 PHE C C 44 172.844 172.844 174.518 -1.674 25033
4944 1 14 . 1 1 44 44 PHE CA C 44 57.880 57.880 56.049 1.831 25033
4945 1 14 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.800 0.549 25033
4946 1 14 . 1 1 44 44 PHE H H 44 8.465 8.465 8.379 0.086 25033
4947 1 14 . 1 1 45 45 VAL N N 45 123.552 123.552 123.963 -0.411 25033
4948 1 14 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.265 0.392 25033
4949 1 14 . 1 1 45 45 VAL C C 45 177.433 177.433 173.637 3.796 25033
4950 1 14 . 1 1 45 45 VAL CA C 45 58.460 58.460 59.693 -1.233 25033
4951 1 14 . 1 1 45 45 VAL CB C 45 34.884 34.884 35.801 -0.917 25033
4952 1 14 . 1 1 45 45 VAL H H 45 7.715 7.715 8.049 -0.334 25033
4953 1 14 . 1 1 46 46 HIS N N 46 127.300 127.300 127.743 -0.443 25033
4954 1 14 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.872 -0.047 25033
4955 1 14 . 1 1 46 46 HIS C C 46 176.469 176.469 174.238 2.231 25033
4956 1 14 . 1 1 46 46 HIS CA C 46 55.929 55.929 53.791 2.138 25033
4957 1 14 . 1 1 46 46 HIS CB C 46 34.399 34.399 30.585 3.814 25033
4958 1 14 . 1 1 46 46 HIS H H 46 9.104 9.104 8.760 0.344 25033
4959 1 14 . 1 1 47 47 GLN N N 47 125.105 125.105 126.774 -1.669 25033
4960 1 14 . 1 1 47 47 GLN H H 47 8.352 8.352 8.918 -0.566 25033
4961 1 14 . 1 1 48 48 THR HA H 48 4.310 4.310 4.442 -0.132 25033
4962 1 14 . 1 1 48 48 THR C C 48 175.568 175.568 175.353 0.215 25033
4963 1 14 . 1 1 48 48 THR CA C 48 64.770 64.770 62.455 2.315 25033
4964 1 14 . 1 1 48 48 THR CB C 48 70.054 70.054 69.547 0.507 25033
4965 1 14 . 1 1 49 49 ASN N N 49 118.142 118.142 119.452 -1.310 25033
4966 1 14 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.933 0.227 25033
4967 1 14 . 1 1 49 49 ASN C C 49 172.914 172.914 173.848 -0.934 25033
4968 1 14 . 1 1 49 49 ASN CA C 49 54.351 54.351 52.877 1.474 25033
4969 1 14 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.690 0.837 25033
4970 1 14 . 1 1 49 49 ASN H H 49 8.452 8.452 8.479 -0.027 25033
4971 1 14 . 1 1 50 50 ILE N N 50 119.226 119.226 122.166 -2.940 25033
4972 1 14 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.271 -0.159 25033
4973 1 14 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.476 1.130 25033
4974 1 14 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.780 1.582 25033
4975 1 14 . 1 1 50 50 ILE H H 50 7.354 7.354 7.996 -0.642 25033
4976 1 14 . 1 1 51 51 ASN N N 51 128.460 128.460 124.739 3.721 25033
4977 1 14 . 1 1 51 51 ASN C C 51 174.614 174.614 173.683 0.931 25033
4978 1 14 . 1 1 51 51 ASN H H 51 9.266 9.266 8.096 1.170 25033
4979 1 14 . 1 1 52 52 SER N N 52 117.246 117.246 114.160 3.086 25033
4980 1 14 . 1 1 52 52 SER HA H 52 4.413 4.413 4.591 -0.178 25033
4981 1 14 . 1 1 52 52 SER C C 52 174.139 174.139 174.897 -0.758 25033
4982 1 14 . 1 1 52 52 SER CA C 52 58.378 58.378 57.785 0.593 25033
4983 1 14 . 1 1 52 52 SER CB C 52 64.371 64.371 65.602 -1.230 25033
4984 1 14 . 1 1 52 52 SER H H 52 7.973 7.973 8.082 -0.109 25033
4985 1 14 . 1 1 53 53 GLU N N 53 123.628 123.628 122.019 1.609 25033
4986 1 14 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.326 -0.028 25033
4987 1 14 . 1 1 53 53 GLU C C 53 176.960 176.960 176.456 0.504 25033
4988 1 14 . 1 1 53 53 GLU CA C 53 57.270 57.270 56.970 0.300 25033
4989 1 14 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.725 0.136 25033
4990 1 14 . 1 1 53 53 GLU H H 53 8.641 8.641 8.686 -0.045 25033
4991 1 14 . 1 1 54 54 GLY N N 54 110.282 110.282 109.235 1.047 25033
4992 1 14 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.830 -0.230 25033
4993 1 14 . 1 1 54 54 GLY H H 54 8.225 8.225 8.063 0.162 25033
4994 1 14 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.898 -0.078 25033
4995 1 14 . 1 1 55 55 PHE C C 55 175.836 175.836 174.167 1.669 25033
4996 1 14 . 1 1 55 55 PHE CA C 55 52.690 52.690 56.681 -3.991 25033
4997 1 14 . 1 1 55 55 PHE CB C 55 38.095 38.095 40.440 -2.345 25033
4998 1 14 . 1 1 56 56 ARG N N 56 120.907 120.907 121.407 -0.500 25033
4999 1 14 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.407 -0.143 25033
5000 1 14 . 1 1 56 56 ARG C C 56 175.618 175.618 175.481 0.137 25033
5001 1 14 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.889 -0.379 25033
5002 1 14 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.450 0.570 25033
5003 1 14 . 1 1 56 56 ARG H H 56 8.153 8.153 8.635 -0.482 25033
5004 1 14 . 1 1 57 57 SER N N 57 123.117 123.117 120.647 2.470 25033
5005 1 14 . 1 1 57 57 SER H H 57 7.834 7.834 8.552 -0.718 25033
5006 1 14 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.684 -0.404 25033
5007 1 14 . 1 1 58 58 LEU C C 58 174.842 174.842 176.380 -1.538 25033
5008 1 14 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.380 -0.620 25033
5009 1 14 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.903 -1.323 25033
5010 1 14 . 1 1 59 59 ARG N N 59 119.557 119.557 121.635 -2.078 25033
5011 1 14 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.577 0.008 25033
5012 1 14 . 1 1 59 59 ARG C C 59 175.256 175.256 175.604 -0.348 25033
5013 1 14 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.749 -0.637 25033
5014 1 14 . 1 1 59 59 ARG CB C 59 32.970 32.970 31.982 0.988 25033
5015 1 14 . 1 1 59 59 ARG H H 59 8.529 8.529 8.528 0.001 25033
5016 1 14 . 1 1 60 60 GLU N N 60 121.597 121.597 119.904 1.693 25033
5017 1 14 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.104 -0.523 25033
5018 1 14 . 1 1 60 60 GLU C C 60 177.281 177.281 176.871 0.410 25033
5019 1 14 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.139 1.162 25033
5020 1 14 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.985 -0.724 25033
5021 1 14 . 1 1 60 60 GLU H H 60 8.691 8.691 8.512 0.179 25033
5022 1 14 . 1 1 61 61 GLY N N 61 113.554 113.554 110.779 2.775 25033
5023 1 14 . 1 1 61 61 GLY C C 61 174.068 174.068 174.118 -0.050 25033
5024 1 14 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.694 0.549 25033
5025 1 14 . 1 1 61 61 GLY H H 61 9.151 9.151 8.605 0.546 25033
5026 1 14 . 1 1 62 62 GLU N N 62 121.639 121.639 122.151 -0.512 25033
5027 1 14 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.211 -0.007 25033
5028 1 14 . 1 1 62 62 GLU C C 62 175.439 175.439 176.195 -0.756 25033
5029 1 14 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.923 0.419 25033
5030 1 14 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.593 0.332 25033
5031 1 14 . 1 1 62 62 GLU H H 62 7.889 7.889 7.668 0.221 25033
5032 1 14 . 1 1 63 63 VAL N N 63 125.003 125.003 126.091 -1.088 25033
5033 1 14 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.731 0.017 25033
5034 1 14 . 1 1 63 63 VAL C C 63 176.639 176.639 176.303 0.336 25033
5035 1 14 . 1 1 63 63 VAL CA C 63 62.631 62.631 62.053 0.578 25033
5036 1 14 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.684 -0.327 25033
5037 1 14 . 1 1 63 63 VAL H H 63 8.477 8.477 8.349 0.128 25033
5038 1 14 . 1 1 64 64 VAL N N 64 120.113 120.113 122.838 -2.725 25033
5039 1 14 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.611 0.393 25033
5040 1 14 . 1 1 64 64 VAL C C 64 173.790 173.790 174.318 -0.528 25033
5041 1 14 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.080 -0.471 25033
5042 1 14 . 1 1 64 64 VAL CB C 64 36.360 36.360 34.841 1.519 25033
5043 1 14 . 1 1 64 64 VAL H H 64 8.686 8.686 9.112 -0.426 25033
5044 1 14 . 1 1 65 65 GLU N N 65 120.433 120.433 119.755 0.678 25033
5045 1 14 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.392 0.055 25033
5046 1 14 . 1 1 65 65 GLU C C 65 175.584 175.584 175.002 0.582 25033
5047 1 14 . 1 1 65 65 GLU CA C 65 54.390 54.390 55.100 -0.710 25033
5048 1 14 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.226 0.777 25033
5049 1 14 . 1 1 65 65 GLU H H 65 9.003 9.003 8.260 0.743 25033
5050 1 14 . 1 1 66 66 PHE N N 66 116.104 116.104 119.764 -3.660 25033
5051 1 14 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.135 -0.074 25033
5052 1 14 . 1 1 66 66 PHE C C 66 173.001 173.001 173.122 -0.121 25033
5053 1 14 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.229 0.628 25033
5054 1 14 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.937 -0.505 25033
5055 1 14 . 1 1 66 66 PHE H H 66 8.172 8.172 7.724 0.448 25033
5056 1 14 . 1 1 67 67 GLU N N 67 117.574 117.574 116.870 0.704 25033
5057 1 14 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.246 -0.374 25033
5058 1 14 . 1 1 67 67 GLU C C 67 175.327 175.327 175.245 0.082 25033
5059 1 14 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.307 0.334 25033
5060 1 14 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.977 -0.957 25033
5061 1 14 . 1 1 67 67 GLU H H 67 8.668 8.668 8.429 0.239 25033
5062 1 14 . 1 1 68 68 VAL N N 68 120.881 120.881 122.737 -1.856 25033
5063 1 14 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.199 0.813 25033
5064 1 14 . 1 1 68 68 VAL C C 68 176.140 176.140 175.628 0.512 25033
5065 1 14 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.668 -0.330 25033
5066 1 14 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.852 1.154 25033
5067 1 14 . 1 1 68 68 VAL H H 68 8.748 8.748 8.658 0.090 25033
5068 1 14 . 1 1 69 69 GLU N N 69 128.110 128.110 128.667 -0.557 25033
5069 1 14 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.642 0.063 25033
5070 1 14 . 1 1 69 69 GLU C C 69 174.573 174.573 174.696 -0.123 25033
5071 1 14 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.714 0.239 25033
5072 1 14 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.581 0.709 25033
5073 1 14 . 1 1 69 69 GLU H H 69 9.070 9.070 8.922 0.148 25033
5074 1 14 . 1 1 70 70 ALA N N 70 127.944 127.944 129.463 -1.519 25033
5075 1 14 . 1 1 70 70 ALA HA H 70 5.004 5.004 4.689 0.315 25033
5076 1 14 . 1 1 70 70 ALA C C 70 178.073 178.073 177.339 0.734 25033
5077 1 14 . 1 1 70 70 ALA CA C 70 50.959 50.959 51.720 -0.761 25033
5078 1 14 . 1 1 70 70 ALA CB C 70 19.489 19.489 19.133 0.356 25033
5079 1 14 . 1 1 70 70 ALA H H 70 8.671 8.671 8.645 0.026 25033
5080 1 14 . 1 1 71 71 GLY N N 71 110.340 110.340 111.983 -1.643 25033
5081 1 14 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.613 0.403 25033
5082 1 14 . 1 1 71 71 GLY H H 71 8.445 8.445 8.187 0.258 25033
5083 1 14 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.326 0.091 25033
5084 1 14 . 1 1 72 72 PRO C C 72 176.835 176.835 177.044 -0.209 25033
5085 1 14 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.679 -0.519 25033
5086 1 14 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.649 0.231 25033
5087 1 14 . 1 1 73 73 ASP N N 73 116.498 116.498 118.061 -1.563 25033
5088 1 14 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.488 0.027 25033
5089 1 14 . 1 1 73 73 ASP C C 73 176.775 176.775 177.274 -0.499 25033
5090 1 14 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.134 -0.587 25033
5091 1 14 . 1 1 73 73 ASP CB C 73 40.234 40.234 41.104 -0.870 25033
5092 1 14 . 1 1 73 73 ASP H H 73 8.248 8.248 8.184 0.064 25033
5093 1 14 . 1 1 74 74 GLY N N 74 107.369 107.369 107.728 -0.359 25033
5094 1 14 . 1 1 74 74 GLY C C 74 174.331 174.331 173.825 0.506 25033
5095 1 14 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.800 0.778 25033
5096 1 14 . 1 1 74 74 GLY H H 74 8.153 8.153 7.791 0.362 25033
5097 1 14 . 1 1 75 75 ARG N N 75 120.942 120.942 121.109 -0.167 25033
5098 1 14 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.642 -0.100 25033
5099 1 14 . 1 1 75 75 ARG C C 75 176.652 176.652 175.010 1.642 25033
5100 1 14 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.260 0.399 25033
5101 1 14 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.615 -0.706 25033
5102 1 14 . 1 1 75 75 ARG H H 75 7.670 7.670 7.709 -0.039 25033
5103 1 14 . 1 1 76 76 SER N N 76 120.181 120.181 117.076 3.105 25033
5104 1 14 . 1 1 76 76 SER HA H 76 5.035 5.035 5.464 -0.429 25033
5105 1 14 . 1 1 76 76 SER C C 76 172.816 172.816 173.991 -1.175 25033
5106 1 14 . 1 1 76 76 SER CA C 76 59.080 59.080 56.926 2.154 25033
5107 1 14 . 1 1 76 76 SER CB C 76 64.850 64.850 65.371 -0.521 25033
5108 1 14 . 1 1 76 76 SER H H 76 8.808 8.808 8.369 0.439 25033
5109 1 14 . 1 1 77 77 LYS N N 77 121.202 121.202 120.491 0.711 25033
5110 1 14 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.648 0.526 25033
5111 1 14 . 1 1 77 77 LYS C C 77 173.706 173.706 174.246 -0.540 25033
5112 1 14 . 1 1 77 77 LYS CA C 77 54.599 54.599 55.299 -0.700 25033
5113 1 14 . 1 1 77 77 LYS CB C 77 36.035 36.035 35.689 0.346 25033
5114 1 14 . 1 1 77 77 LYS H H 77 8.982 8.982 8.420 0.562 25033
5115 1 14 . 1 1 78 78 ALA N N 78 124.064 124.064 124.444 -0.380 25033
5116 1 14 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.805 0.199 25033
5117 1 14 . 1 1 78 78 ALA C C 78 175.979 175.979 176.450 -0.471 25033
5118 1 14 . 1 1 78 78 ALA CA C 78 50.445 50.445 51.376 -0.931 25033
5119 1 14 . 1 1 78 78 ALA CB C 78 20.136 20.136 18.872 1.264 25033
5120 1 14 . 1 1 78 78 ALA H H 78 8.706 8.706 8.488 0.218 25033
5121 1 14 . 1 1 79 79 VAL N N 79 113.264 113.264 116.706 -3.442 25033
5122 1 14 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.481 0.362 25033
5123 1 14 . 1 1 79 79 VAL C C 79 174.744 174.744 174.588 0.156 25033
5124 1 14 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.637 -0.564 25033
5125 1 14 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.466 0.130 25033
5126 1 14 . 1 1 79 79 VAL H H 79 9.165 9.165 7.661 1.504 25033
5127 1 14 . 1 1 80 80 ASN N N 80 120.084 120.084 116.264 3.820 25033
5128 1 14 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.352 0.004 25033
5129 1 14 . 1 1 80 80 ASN C C 80 175.391 175.391 174.433 0.958 25033
5130 1 14 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.948 -0.214 25033
5131 1 14 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.731 0.390 25033
5132 1 14 . 1 1 80 80 ASN H H 80 8.923 8.923 8.772 0.151 25033
5133 1 14 . 1 1 81 81 VAL N N 81 119.178 119.178 118.769 0.409 25033
5134 1 14 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.334 0.413 25033
5135 1 14 . 1 1 81 81 VAL C C 81 176.340 176.340 176.979 -0.639 25033
5136 1 14 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.358 0.801 25033
5137 1 14 . 1 1 81 81 VAL CB C 81 32.130 32.130 32.248 -0.118 25033
5138 1 14 . 1 1 81 81 VAL H H 81 8.282 8.282 7.692 0.590 25033
5139 1 15 . 1 1 12 12 SER N N 12 116.112 116.112 114.634 1.478 25033
5140 1 15 . 1 1 12 12 SER C C 12 175.271 175.271 174.771 0.500 25033
5141 1 15 . 1 1 12 12 SER CA C 12 58.570 58.570 58.899 -0.329 25033
5142 1 15 . 1 1 12 12 SER CB C 12 63.984 63.984 64.434 -0.450 25033
5143 1 15 . 1 1 12 12 SER H H 12 8.422 8.422 10.266 -1.844 25033
5144 1 15 . 1 1 13 13 GLY N N 13 111.178 111.178 110.866 0.312 25033
5145 1 15 . 1 1 13 13 GLY C C 13 174.238 174.238 174.010 0.228 25033
5146 1 15 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.961 0.560 25033
5147 1 15 . 1 1 13 13 GLY H H 13 8.537 8.537 8.467 0.070 25033
5148 1 15 . 1 1 14 14 GLU N N 14 120.547 120.547 122.225 -1.678 25033
5149 1 15 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.601 -0.334 25033
5150 1 15 . 1 1 14 14 GLU C C 14 176.455 176.455 175.029 1.426 25033
5151 1 15 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.766 0.987 25033
5152 1 15 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.383 1.081 25033
5153 1 15 . 1 1 14 14 GLU H H 14 8.285 8.285 8.439 -0.154 25033
5154 1 15 . 1 1 15 15 GLN N N 15 121.185 121.185 123.195 -2.010 25033
5155 1 15 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.600 -0.251 25033
5156 1 15 . 1 1 15 15 GLN C C 15 175.494 175.494 174.639 0.855 25033
5157 1 15 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.239 0.431 25033
5158 1 15 . 1 1 15 15 GLN CB C 15 29.410 29.410 30.095 -0.685 25033
5159 1 15 . 1 1 15 15 GLN H H 15 8.444 8.444 8.233 0.211 25033
5160 1 15 . 1 1 16 16 LEU N N 16 123.934 123.934 123.514 0.420 25033
5161 1 15 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.646 -0.305 25033
5162 1 15 . 1 1 16 16 LEU C C 16 176.942 176.942 175.458 1.484 25033
5163 1 15 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.497 1.007 25033
5164 1 15 . 1 1 16 16 LEU CB C 16 42.519 42.519 42.122 0.397 25033
5165 1 15 . 1 1 16 16 LEU H H 16 8.289 8.289 8.528 -0.239 25033
5166 1 15 . 1 1 17 17 ARG N N 17 122.044 122.044 122.149 -0.105 25033
5167 1 15 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.528 -0.064 25033
5168 1 15 . 1 1 17 17 ARG C C 17 175.829 175.829 175.576 0.253 25033
5169 1 15 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.897 0.775 25033
5170 1 15 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.954 -1.124 25033
5171 1 15 . 1 1 17 17 ARG H H 17 8.216 8.216 8.384 -0.168 25033
5172 1 15 . 1 1 18 18 GLN N N 18 122.488 122.488 122.693 -0.205 25033
5173 1 15 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.439 -0.105 25033
5174 1 15 . 1 1 18 18 GLN C C 18 172.958 172.958 173.550 -0.592 25033
5175 1 15 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.501 0.399 25033
5176 1 15 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.690 -0.070 25033
5177 1 15 . 1 1 18 18 GLN H H 18 8.573 8.573 8.039 0.534 25033
5178 1 15 . 1 1 19 19 GLN N N 19 116.301 116.301 119.649 -3.348 25033
5179 1 15 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.021 0.357 25033
5180 1 15 . 1 1 19 19 GLN C C 19 176.902 176.902 174.335 2.567 25033
5181 1 15 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.319 -0.103 25033
5182 1 15 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.642 0.996 25033
5183 1 15 . 1 1 19 19 GLN H H 19 8.146 8.146 8.398 -0.252 25033
5184 1 15 . 1 1 20 20 GLY N N 20 109.745 109.745 107.976 1.769 25033
5185 1 15 . 1 1 20 20 GLY C C 20 170.989 170.989 172.676 -1.687 25033
5186 1 15 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.055 1.880 25033
5187 1 15 . 1 1 20 20 GLY H H 20 8.998 8.998 8.183 0.815 25033
5188 1 15 . 1 1 21 21 THR N N 21 112.645 112.645 113.146 -0.501 25033
5189 1 15 . 1 1 21 21 THR HA H 21 5.361 5.361 5.234 0.127 25033
5190 1 15 . 1 1 21 21 THR C C 21 174.553 174.553 176.034 -1.481 25033
5191 1 15 . 1 1 21 21 THR CA C 21 60.025 60.025 59.842 0.183 25033
5192 1 15 . 1 1 21 21 THR CB C 21 71.720 71.720 71.873 -0.153 25033
5193 1 15 . 1 1 21 21 THR H H 21 8.312 8.312 8.320 -0.008 25033
5194 1 15 . 1 1 22 22 VAL N N 22 125.915 125.915 122.018 3.897 25033
5195 1 15 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.871 -0.222 25033
5196 1 15 . 1 1 22 22 VAL C C 22 175.553 175.553 177.775 -2.222 25033
5197 1 15 . 1 1 22 22 VAL CA C 22 64.618 64.618 63.616 1.002 25033
5198 1 15 . 1 1 22 22 VAL CB C 22 31.621 31.621 30.909 0.712 25033
5199 1 15 . 1 1 22 22 VAL H H 22 9.092 9.092 8.271 0.821 25033
5200 1 15 . 1 1 23 23 LYS N N 23 135.790 135.790 118.073 17.717 25033
5201 1 15 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.036 0.265 25033
5202 1 15 . 1 1 23 23 LYS C C 23 176.301 176.301 176.601 -0.300 25033
5203 1 15 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.839 -0.229 25033
5204 1 15 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.498 2.801 25033
5205 1 15 . 1 1 23 23 LYS H H 23 9.276 9.276 8.451 0.825 25033
5206 1 15 . 1 1 24 24 TRP N N 24 111.651 111.651 119.498 -7.847 25033
5207 1 15 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.831 -0.208 25033
5208 1 15 . 1 1 24 24 TRP C C 24 173.628 173.628 174.571 -0.943 25033
5209 1 15 . 1 1 24 24 TRP CA C 24 56.300 56.300 56.270 0.030 25033
5210 1 15 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.760 1.500 25033
5211 1 15 . 1 1 24 24 TRP H H 24 7.455 7.455 7.636 -0.181 25033
5212 1 15 . 1 1 25 25 PHE N N 25 121.305 121.305 120.698 0.607 25033
5213 1 15 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.828 -0.543 25033
5214 1 15 . 1 1 25 25 PHE C C 25 172.354 172.354 174.578 -2.224 25033
5215 1 15 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.168 2.204 25033
5216 1 15 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.048 0.521 25033
5217 1 15 . 1 1 25 25 PHE H H 25 9.074 9.074 8.049 1.025 25033
5218 1 15 . 1 1 26 26 ASN N N 26 126.976 126.976 123.991 2.985 25033
5219 1 15 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.963 -0.151 25033
5220 1 15 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.435 -1.023 25033
5221 1 15 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.121 -0.035 25033
5222 1 15 . 1 1 26 26 ASN H H 26 8.159 8.159 8.143 0.016 25033
5223 1 15 . 1 1 27 27 ALA N N 27 128.245 128.245 125.318 2.927 25033
5224 1 15 . 1 1 27 27 ALA HA H 27 4.121 4.121 3.992 0.129 25033
5225 1 15 . 1 1 27 27 ALA C C 27 179.031 179.031 178.914 0.117 25033
5226 1 15 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.297 -0.873 25033
5227 1 15 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.689 -0.315 25033
5228 1 15 . 1 1 27 27 ALA H H 27 9.036 9.036 8.547 0.489 25033
5229 1 15 . 1 1 28 28 THR N N 28 113.994 113.994 113.255 0.739 25033
5230 1 15 . 1 1 28 28 THR HA H 28 4.068 4.068 4.023 0.045 25033
5231 1 15 . 1 1 28 28 THR C C 28 176.084 176.084 175.747 0.337 25033
5232 1 15 . 1 1 28 28 THR CA C 28 65.820 65.820 64.961 0.859 25033
5233 1 15 . 1 1 28 28 THR CB C 28 68.291 68.291 68.127 0.164 25033
5234 1 15 . 1 1 28 28 THR H H 28 8.065 8.065 8.435 -0.370 25033
5235 1 15 . 1 1 29 29 LYS N N 29 118.922 118.922 119.680 -0.758 25033
5236 1 15 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.373 -0.117 25033
5237 1 15 . 1 1 29 29 LYS C C 29 177.201 177.201 177.139 0.062 25033
5238 1 15 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.338 0.550 25033
5239 1 15 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.892 0.848 25033
5240 1 15 . 1 1 29 29 LYS H H 29 7.446 7.446 7.777 -0.331 25033
5241 1 15 . 1 1 30 30 GLY N N 30 107.601 107.601 107.139 0.462 25033
5242 1 15 . 1 1 30 30 GLY C C 30 172.004 172.004 173.189 -1.185 25033
5243 1 15 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.053 1.351 25033
5244 1 15 . 1 1 30 30 GLY H H 30 8.115 8.115 7.922 0.193 25033
5245 1 15 . 1 1 31 31 PHE N N 31 112.488 112.488 119.154 -6.666 25033
5246 1 15 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.654 0.353 25033
5247 1 15 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.239 -1.962 25033
5248 1 15 . 1 1 31 31 PHE CB C 31 42.388 42.388 40.924 1.464 25033
5249 1 15 . 1 1 31 31 PHE H H 31 6.594 6.594 7.529 -0.935 25033
5250 1 15 . 1 1 32 32 GLY N N 32 105.986 105.986 109.232 -3.246 25033
5251 1 15 . 1 1 32 32 GLY C C 32 170.292 170.292 171.858 -1.566 25033
5252 1 15 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.380 1.989 25033
5253 1 15 . 1 1 32 32 GLY H H 32 8.144 8.144 7.649 0.495 25033
5254 1 15 . 1 1 33 33 PHE N N 33 115.319 115.319 115.958 -0.639 25033
5255 1 15 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.342 0.121 25033
5256 1 15 . 1 1 33 33 PHE C C 33 175.037 175.037 175.053 -0.016 25033
5257 1 15 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.483 -1.188 25033
5258 1 15 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.194 0.598 25033
5259 1 15 . 1 1 33 33 PHE H H 33 7.971 7.971 7.961 0.010 25033
5260 1 15 . 1 1 34 34 ILE N N 34 122.140 122.140 121.031 1.109 25033
5261 1 15 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.636 -0.319 25033
5262 1 15 . 1 1 34 34 ILE C C 34 174.526 174.526 175.450 -0.924 25033
5263 1 15 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.251 0.546 25033
5264 1 15 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.630 1.953 25033
5265 1 15 . 1 1 34 34 ILE H H 34 9.511 9.511 9.133 0.378 25033
5266 1 15 . 1 1 35 35 THR N N 35 126.580 126.580 122.975 3.605 25033
5267 1 15 . 1 1 35 35 THR HA H 35 5.143 5.143 4.972 0.171 25033
5268 1 15 . 1 1 35 35 THR CA C 35 59.330 59.330 59.341 -0.011 25033
5269 1 15 . 1 1 35 35 THR CB C 35 70.258 70.258 68.490 1.768 25033
5270 1 15 . 1 1 35 35 THR H H 35 9.416 9.416 8.809 0.607 25033
5271 1 15 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.614 -0.015 25033
5272 1 15 . 1 1 36 36 PRO C C 36 177.390 177.390 178.156 -0.766 25033
5273 1 15 . 1 1 36 36 PRO CA C 36 63.220 63.220 62.855 0.365 25033
5274 1 15 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.307 0.163 25033
5275 1 15 . 1 1 37 37 GLY N N 37 112.033 112.033 109.013 3.020 25033
5276 1 15 . 1 1 37 37 GLY C C 37 169.261 169.261 175.286 -6.025 25033
5277 1 15 . 1 1 37 37 GLY CA C 37 46.457 46.457 45.244 1.213 25033
5278 1 15 . 1 1 37 37 GLY H H 37 9.349 9.349 8.734 0.615 25033
5279 1 15 . 1 1 38 38 GLY N N 38 109.050 109.050 106.958 2.092 25033
5280 1 15 . 1 1 38 38 GLY C C 38 175.177 175.177 174.703 0.474 25033
5281 1 15 . 1 1 38 38 GLY H H 38 8.756 8.756 7.919 0.837 25033
5282 1 15 . 1 1 39 39 GLY N N 39 107.730 107.730 106.780 0.950 25033
5283 1 15 . 1 1 39 39 GLY C C 39 173.870 173.870 173.604 0.266 25033
5284 1 15 . 1 1 39 39 GLY CA C 39 44.258 44.258 44.314 -0.056 25033
5285 1 15 . 1 1 39 39 GLY H H 39 7.725 7.725 7.591 0.134 25033
5286 1 15 . 1 1 40 40 GLY N N 40 107.183 107.183 108.232 -1.049 25033
5287 1 15 . 1 1 40 40 GLY C C 40 173.067 173.067 173.932 -0.865 25033
5288 1 15 . 1 1 40 40 GLY CA C 40 43.760 43.760 44.863 -1.103 25033
5289 1 15 . 1 1 40 40 GLY H H 40 8.096 8.096 8.231 -0.135 25033
5290 1 15 . 1 1 41 41 GLU N N 41 119.455 119.455 124.925 -5.470 25033
5291 1 15 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.433 -0.255 25033
5292 1 15 . 1 1 41 41 GLU C C 41 175.900 175.900 175.511 0.389 25033
5293 1 15 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.235 1.142 25033
5294 1 15 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.255 0.345 25033
5295 1 15 . 1 1 41 41 GLU H H 41 8.199 8.199 8.550 -0.351 25033
5296 1 15 . 1 1 42 42 ASP N N 42 119.784 119.784 123.674 -3.890 25033
5297 1 15 . 1 1 42 42 ASP HA H 42 4.857 4.857 4.789 0.068 25033
5298 1 15 . 1 1 42 42 ASP C C 42 176.474 176.474 176.005 0.469 25033
5299 1 15 . 1 1 42 42 ASP CA C 42 55.441 55.441 54.162 1.279 25033
5300 1 15 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.262 0.226 25033
5301 1 15 . 1 1 42 42 ASP H H 42 8.277 8.277 8.317 -0.040 25033
5302 1 15 . 1 1 43 43 LEU N N 43 122.515 122.515 122.864 -0.349 25033
5303 1 15 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.796 -0.109 25033
5304 1 15 . 1 1 43 43 LEU C C 43 175.759 175.759 176.866 -1.107 25033
5305 1 15 . 1 1 43 43 LEU CA C 43 53.304 53.304 54.150 -0.846 25033
5306 1 15 . 1 1 43 43 LEU CB C 43 45.449 45.449 44.566 0.883 25033
5307 1 15 . 1 1 43 43 LEU H H 43 9.423 9.423 8.900 0.523 25033
5308 1 15 . 1 1 44 44 PHE N N 44 125.962 125.962 120.377 5.585 25033
5309 1 15 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.886 -0.964 25033
5310 1 15 . 1 1 44 44 PHE C C 44 172.844 172.844 174.516 -1.672 25033
5311 1 15 . 1 1 44 44 PHE CA C 44 57.880 57.880 56.432 1.448 25033
5312 1 15 . 1 1 44 44 PHE CB C 44 40.350 40.350 40.053 0.297 25033
5313 1 15 . 1 1 44 44 PHE H H 44 8.465 8.465 8.516 -0.051 25033
5314 1 15 . 1 1 45 45 VAL N N 45 123.552 123.552 124.207 -0.655 25033
5315 1 15 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.309 0.348 25033
5316 1 15 . 1 1 45 45 VAL C C 45 177.433 177.433 173.460 3.973 25033
5317 1 15 . 1 1 45 45 VAL CA C 45 58.460 58.460 59.894 -1.433 25033
5318 1 15 . 1 1 45 45 VAL CB C 45 34.884 34.884 35.838 -0.954 25033
5319 1 15 . 1 1 45 45 VAL H H 45 7.715 7.715 8.044 -0.329 25033
5320 1 15 . 1 1 46 46 HIS N N 46 127.300 127.300 123.470 3.830 25033
5321 1 15 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.870 -0.045 25033
5322 1 15 . 1 1 46 46 HIS C C 46 176.469 176.469 174.415 2.054 25033
5323 1 15 . 1 1 46 46 HIS CA C 46 55.929 55.929 53.403 2.526 25033
5324 1 15 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.435 2.964 25033
5325 1 15 . 1 1 46 46 HIS H H 46 9.104 9.104 7.946 1.158 25033
5326 1 15 . 1 1 47 47 GLN N N 47 125.105 125.105 124.086 1.019 25033
5327 1 15 . 1 1 47 47 GLN H H 47 8.352 8.352 8.859 -0.507 25033
5328 1 15 . 1 1 48 48 THR HA H 48 4.310 4.310 4.499 -0.189 25033
5329 1 15 . 1 1 48 48 THR C C 48 175.568 175.568 174.752 0.816 25033
5330 1 15 . 1 1 48 48 THR CA C 48 64.770 64.770 63.265 1.505 25033
5331 1 15 . 1 1 48 48 THR CB C 48 70.054 70.054 69.630 0.424 25033
5332 1 15 . 1 1 49 49 ASN N N 49 118.142 118.142 119.460 -1.318 25033
5333 1 15 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.843 0.317 25033
5334 1 15 . 1 1 49 49 ASN C C 49 172.914 172.914 173.604 -0.690 25033
5335 1 15 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.141 1.210 25033
5336 1 15 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.659 0.868 25033
5337 1 15 . 1 1 49 49 ASN H H 49 8.452 8.452 8.538 -0.086 25033
5338 1 15 . 1 1 50 50 ILE N N 50 119.226 119.226 121.136 -1.910 25033
5339 1 15 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.174 -0.062 25033
5340 1 15 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.981 0.625 25033
5341 1 15 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.572 1.790 25033
5342 1 15 . 1 1 50 50 ILE H H 50 7.354 7.354 7.924 -0.570 25033
5343 1 15 . 1 1 51 51 ASN N N 51 128.460 128.460 123.362 5.098 25033
5344 1 15 . 1 1 51 51 ASN C C 51 174.614 174.614 173.628 0.986 25033
5345 1 15 . 1 1 51 51 ASN H H 51 9.266 9.266 7.779 1.487 25033
5346 1 15 . 1 1 52 52 SER N N 52 117.246 117.246 115.553 1.693 25033
5347 1 15 . 1 1 52 52 SER HA H 52 4.413 4.413 4.690 -0.277 25033
5348 1 15 . 1 1 52 52 SER C C 52 174.139 174.139 175.112 -0.973 25033
5349 1 15 . 1 1 52 52 SER CA C 52 58.378 58.378 56.987 1.391 25033
5350 1 15 . 1 1 52 52 SER CB C 52 64.371 64.371 64.631 -0.260 25033
5351 1 15 . 1 1 52 52 SER H H 52 7.973 7.973 8.315 -0.342 25033
5352 1 15 . 1 1 53 53 GLU N N 53 123.628 123.628 125.313 -1.685 25033
5353 1 15 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.199 0.099 25033
5354 1 15 . 1 1 53 53 GLU C C 53 176.960 176.960 176.538 0.422 25033
5355 1 15 . 1 1 53 53 GLU CA C 53 57.270 57.270 56.949 0.321 25033
5356 1 15 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.707 0.154 25033
5357 1 15 . 1 1 53 53 GLU H H 53 8.641 8.641 8.779 -0.138 25033
5358 1 15 . 1 1 54 54 GLY N N 54 110.282 110.282 108.950 1.332 25033
5359 1 15 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.849 -0.249 25033
5360 1 15 . 1 1 54 54 GLY H H 54 8.225 8.225 7.684 0.541 25033
5361 1 15 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.684 0.136 25033
5362 1 15 . 1 1 55 55 PHE C C 55 175.836 175.836 174.564 1.272 25033
5363 1 15 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.243 -4.553 25033
5364 1 15 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.685 -3.590 25033
5365 1 15 . 1 1 56 56 ARG N N 56 120.907 120.907 121.461 -0.554 25033
5366 1 15 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.626 -0.362 25033
5367 1 15 . 1 1 56 56 ARG C C 56 175.618 175.618 175.225 0.393 25033
5368 1 15 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.816 -0.306 25033
5369 1 15 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.675 0.345 25033
5370 1 15 . 1 1 56 56 ARG H H 56 8.153 8.153 8.658 -0.505 25033
5371 1 15 . 1 1 57 57 SER N N 57 123.117 123.117 120.670 2.447 25033
5372 1 15 . 1 1 57 57 SER H H 57 7.834 7.834 8.563 -0.729 25033
5373 1 15 . 1 1 58 58 LEU HA H 58 4.280 4.280 5.106 -0.826 25033
5374 1 15 . 1 1 58 58 LEU C C 58 174.842 174.842 175.885 -1.043 25033
5375 1 15 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.349 -0.589 25033
5376 1 15 . 1 1 58 58 LEU CB C 58 42.580 42.580 44.462 -1.881 25033
5377 1 15 . 1 1 59 59 ARG N N 59 119.557 119.557 120.852 -1.295 25033
5378 1 15 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.663 -0.078 25033
5379 1 15 . 1 1 59 59 ARG C C 59 175.256 175.256 175.130 0.126 25033
5380 1 15 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.342 -0.230 25033
5381 1 15 . 1 1 59 59 ARG CB C 59 32.970 32.970 33.928 -0.958 25033
5382 1 15 . 1 1 59 59 ARG H H 59 8.529 8.529 8.946 -0.417 25033
5383 1 15 . 1 1 60 60 GLU N N 60 121.597 121.597 120.073 1.524 25033
5384 1 15 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.093 -0.512 25033
5385 1 15 . 1 1 60 60 GLU C C 60 177.281 177.281 176.441 0.840 25033
5386 1 15 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.546 0.755 25033
5387 1 15 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.734 -0.473 25033
5388 1 15 . 1 1 60 60 GLU H H 60 8.691 8.691 8.602 0.089 25033
5389 1 15 . 1 1 61 61 GLY N N 61 113.554 113.554 111.995 1.559 25033
5390 1 15 . 1 1 61 61 GLY C C 61 174.068 174.068 174.216 -0.148 25033
5391 1 15 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.635 0.608 25033
5392 1 15 . 1 1 61 61 GLY H H 61 9.151 9.151 8.627 0.524 25033
5393 1 15 . 1 1 62 62 GLU N N 62 121.639 121.639 122.516 -0.877 25033
5394 1 15 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.205 -0.001 25033
5395 1 15 . 1 1 62 62 GLU C C 62 175.439 175.439 175.889 -0.450 25033
5396 1 15 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.610 0.732 25033
5397 1 15 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.566 0.359 25033
5398 1 15 . 1 1 62 62 GLU H H 62 7.889 7.889 7.691 0.198 25033
5399 1 15 . 1 1 63 63 VAL N N 63 125.003 125.003 125.410 -0.407 25033
5400 1 15 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.827 -0.079 25033
5401 1 15 . 1 1 63 63 VAL C C 63 176.639 176.639 176.403 0.236 25033
5402 1 15 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.770 0.861 25033
5403 1 15 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.475 -0.118 25033
5404 1 15 . 1 1 63 63 VAL H H 63 8.477 8.477 8.293 0.184 25033
5405 1 15 . 1 1 64 64 VAL N N 64 120.113 120.113 123.302 -3.189 25033
5406 1 15 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.674 0.330 25033
5407 1 15 . 1 1 64 64 VAL C C 64 173.790 173.790 174.200 -0.410 25033
5408 1 15 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.344 -0.736 25033
5409 1 15 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.137 1.223 25033
5410 1 15 . 1 1 64 64 VAL H H 64 8.686 8.686 9.034 -0.348 25033
5411 1 15 . 1 1 65 65 GLU N N 65 120.433 120.433 120.079 0.354 25033
5412 1 15 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.323 0.124 25033
5413 1 15 . 1 1 65 65 GLU C C 65 175.584 175.584 175.100 0.484 25033
5414 1 15 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.880 -0.490 25033
5415 1 15 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.047 0.956 25033
5416 1 15 . 1 1 65 65 GLU H H 65 9.003 9.003 8.286 0.717 25033
5417 1 15 . 1 1 66 66 PHE N N 66 116.104 116.104 120.665 -4.561 25033
5418 1 15 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.061 -0.000 25033
5419 1 15 . 1 1 66 66 PHE C C 66 173.001 173.001 172.687 0.314 25033
5420 1 15 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.679 0.178 25033
5421 1 15 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.665 -0.233 25033
5422 1 15 . 1 1 66 66 PHE H H 66 8.172 8.172 8.322 -0.150 25033
5423 1 15 . 1 1 67 67 GLU N N 67 117.574 117.574 117.967 -0.393 25033
5424 1 15 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.184 -0.312 25033
5425 1 15 . 1 1 67 67 GLU C C 67 175.327 175.327 175.983 -0.656 25033
5426 1 15 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.103 0.538 25033
5427 1 15 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.481 -0.461 25033
5428 1 15 . 1 1 67 67 GLU H H 67 8.668 8.668 8.516 0.152 25033
5429 1 15 . 1 1 68 68 VAL N N 68 120.881 120.881 123.657 -2.776 25033
5430 1 15 . 1 1 68 68 VAL HA H 68 5.012 5.012 3.978 1.034 25033
5431 1 15 . 1 1 68 68 VAL C C 68 176.140 176.140 175.795 0.345 25033
5432 1 15 . 1 1 68 68 VAL CA C 68 62.338 62.338 63.656 -1.318 25033
5433 1 15 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.005 2.001 25033
5434 1 15 . 1 1 68 68 VAL H H 68 8.748 8.748 8.648 0.100 25033
5435 1 15 . 1 1 69 69 GLU N N 69 128.110 128.110 129.193 -1.083 25033
5436 1 15 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.610 0.095 25033
5437 1 15 . 1 1 69 69 GLU C C 69 174.573 174.573 175.059 -0.486 25033
5438 1 15 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.805 0.148 25033
5439 1 15 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.090 1.200 25033
5440 1 15 . 1 1 69 69 GLU H H 69 9.070 9.070 8.882 0.188 25033
5441 1 15 . 1 1 70 70 ALA N N 70 127.944 127.944 129.475 -1.531 25033
5442 1 15 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.163 -0.159 25033
5443 1 15 . 1 1 70 70 ALA C C 70 178.073 178.073 177.474 0.599 25033
5444 1 15 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.699 0.260 25033
5445 1 15 . 1 1 70 70 ALA CB C 70 19.489 19.489 19.416 0.073 25033
5446 1 15 . 1 1 70 70 ALA H H 70 8.671 8.671 8.564 0.107 25033
5447 1 15 . 1 1 71 71 GLY N N 71 110.340 110.340 111.753 -1.413 25033
5448 1 15 . 1 1 71 71 GLY CA C 71 44.016 44.016 44.083 -0.067 25033
5449 1 15 . 1 1 71 71 GLY H H 71 8.445 8.445 8.513 -0.068 25033
5450 1 15 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.351 0.066 25033
5451 1 15 . 1 1 72 72 PRO C C 72 176.835 176.835 176.759 0.076 25033
5452 1 15 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.491 -0.331 25033
5453 1 15 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.770 0.110 25033
5454 1 15 . 1 1 73 73 ASP N N 73 116.498 116.498 118.168 -1.670 25033
5455 1 15 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.632 -0.117 25033
5456 1 15 . 1 1 73 73 ASP C C 73 176.775 176.775 177.058 -0.283 25033
5457 1 15 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.510 -0.963 25033
5458 1 15 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.844 -0.610 25033
5459 1 15 . 1 1 73 73 ASP H H 73 8.248 8.248 8.226 0.022 25033
5460 1 15 . 1 1 74 74 GLY N N 74 107.369 107.369 107.010 0.359 25033
5461 1 15 . 1 1 74 74 GLY C C 74 174.331 174.331 173.556 0.775 25033
5462 1 15 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.748 0.830 25033
5463 1 15 . 1 1 74 74 GLY H H 74 8.153 8.153 7.685 0.468 25033
5464 1 15 . 1 1 75 75 ARG N N 75 120.942 120.942 118.645 2.297 25033
5465 1 15 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.685 -0.143 25033
5466 1 15 . 1 1 75 75 ARG C C 75 176.652 176.652 175.196 1.456 25033
5467 1 15 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.011 0.646 25033
5468 1 15 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.658 -0.749 25033
5469 1 15 . 1 1 75 75 ARG H H 75 7.670 7.670 7.992 -0.322 25033
5470 1 15 . 1 1 76 76 SER N N 76 120.181 120.181 117.431 2.750 25033
5471 1 15 . 1 1 76 76 SER HA H 76 5.035 5.035 5.331 -0.296 25033
5472 1 15 . 1 1 76 76 SER C C 76 172.816 172.816 174.287 -1.471 25033
5473 1 15 . 1 1 76 76 SER CA C 76 59.080 59.080 57.622 1.458 25033
5474 1 15 . 1 1 76 76 SER CB C 76 64.850 64.850 64.560 0.290 25033
5475 1 15 . 1 1 76 76 SER H H 76 8.808 8.808 8.476 0.332 25033
5476 1 15 . 1 1 77 77 LYS N N 77 121.202 121.202 121.463 -0.261 25033
5477 1 15 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.780 0.394 25033
5478 1 15 . 1 1 77 77 LYS C C 77 173.706 173.706 174.212 -0.506 25033
5479 1 15 . 1 1 77 77 LYS CA C 77 54.599 54.599 54.930 -0.331 25033
5480 1 15 . 1 1 77 77 LYS CB C 77 36.035 36.035 36.130 -0.095 25033
5481 1 15 . 1 1 77 77 LYS H H 77 8.982 8.982 8.783 0.199 25033
5482 1 15 . 1 1 78 78 ALA N N 78 124.064 124.064 126.036 -1.972 25033
5483 1 15 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.686 0.318 25033
5484 1 15 . 1 1 78 78 ALA C C 78 175.979 175.979 176.421 -0.442 25033
5485 1 15 . 1 1 78 78 ALA CA C 78 50.445 50.445 51.027 -0.582 25033
5486 1 15 . 1 1 78 78 ALA CB C 78 20.136 20.136 19.587 0.549 25033
5487 1 15 . 1 1 78 78 ALA H H 78 8.706 8.706 8.508 0.198 25033
5488 1 15 . 1 1 79 79 VAL N N 79 113.264 113.264 117.713 -4.449 25033
5489 1 15 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.299 0.544 25033
5490 1 15 . 1 1 79 79 VAL C C 79 174.744 174.744 174.504 0.240 25033
5491 1 15 . 1 1 79 79 VAL CA C 79 59.073 59.073 60.279 -1.206 25033
5492 1 15 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.426 0.170 25033
5493 1 15 . 1 1 79 79 VAL H H 79 9.165 9.165 7.605 1.560 25033
5494 1 15 . 1 1 80 80 ASN N N 80 120.084 120.084 114.043 6.041 25033
5495 1 15 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.342 0.014 25033
5496 1 15 . 1 1 80 80 ASN C C 80 175.391 175.391 173.854 1.537 25033
5497 1 15 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.815 -0.081 25033
5498 1 15 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.952 0.169 25033
5499 1 15 . 1 1 80 80 ASN H H 80 8.923 8.923 8.564 0.359 25033
5500 1 15 . 1 1 81 81 VAL N N 81 119.178 119.178 118.443 0.735 25033
5501 1 15 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.344 0.403 25033
5502 1 15 . 1 1 81 81 VAL C C 81 176.340 176.340 177.038 -0.698 25033
5503 1 15 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.298 0.862 25033
5504 1 15 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.491 0.639 25033
5505 1 15 . 1 1 81 81 VAL H H 81 8.282 8.282 7.583 0.699 25033
5506 1 16 . 1 1 12 12 SER N N 12 116.112 116.112 115.730 0.382 25033
5507 1 16 . 1 1 12 12 SER C C 12 175.271 175.271 175.326 -0.055 25033
5508 1 16 . 1 1 12 12 SER CA C 12 58.570 58.570 58.802 -0.232 25033
5509 1 16 . 1 1 12 12 SER CB C 12 63.984 63.984 63.406 0.578 25033
5510 1 16 . 1 1 12 12 SER H H 12 8.422 8.422 8.515 -0.093 25033
5511 1 16 . 1 1 13 13 GLY N N 13 111.178 111.178 108.621 2.557 25033
5512 1 16 . 1 1 13 13 GLY C C 13 174.238 174.238 174.042 0.196 25033
5513 1 16 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.908 0.612 25033
5514 1 16 . 1 1 13 13 GLY H H 13 8.537 8.537 8.834 -0.297 25033
5515 1 16 . 1 1 14 14 GLU N N 14 120.547 120.547 122.751 -2.204 25033
5516 1 16 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.572 -0.305 25033
5517 1 16 . 1 1 14 14 GLU C C 14 176.455 176.455 176.123 0.332 25033
5518 1 16 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.774 0.979 25033
5519 1 16 . 1 1 14 14 GLU CB C 14 30.464 30.464 28.409 2.055 25033
5520 1 16 . 1 1 14 14 GLU H H 14 8.285 8.285 8.538 -0.253 25033
5521 1 16 . 1 1 15 15 GLN N N 15 121.185 121.185 120.991 0.194 25033
5522 1 16 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.608 -0.259 25033
5523 1 16 . 1 1 15 15 GLN C C 15 175.494 175.494 174.863 0.631 25033
5524 1 16 . 1 1 15 15 GLN CA C 15 55.670 55.670 54.056 1.614 25033
5525 1 16 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.881 -0.471 25033
5526 1 16 . 1 1 15 15 GLN H H 15 8.444 8.444 8.284 0.160 25033
5527 1 16 . 1 1 16 16 LEU N N 16 123.934 123.934 124.575 -0.641 25033
5528 1 16 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.631 -0.290 25033
5529 1 16 . 1 1 16 16 LEU C C 16 176.942 176.942 175.419 1.523 25033
5530 1 16 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.984 0.520 25033
5531 1 16 . 1 1 16 16 LEU CB C 16 42.519 42.519 42.393 0.126 25033
5532 1 16 . 1 1 16 16 LEU H H 16 8.289 8.289 8.641 -0.352 25033
5533 1 16 . 1 1 17 17 ARG N N 17 122.044 122.044 122.402 -0.358 25033
5534 1 16 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.373 0.091 25033
5535 1 16 . 1 1 17 17 ARG C C 17 175.829 175.829 175.780 0.049 25033
5536 1 16 . 1 1 17 17 ARG CA C 17 55.672 55.672 55.610 0.062 25033
5537 1 16 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.509 -0.679 25033
5538 1 16 . 1 1 17 17 ARG H H 17 8.216 8.216 8.365 -0.149 25033
5539 1 16 . 1 1 18 18 GLN N N 18 122.488 122.488 123.988 -1.500 25033
5540 1 16 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.422 -0.088 25033
5541 1 16 . 1 1 18 18 GLN C C 18 172.958 172.958 173.544 -0.586 25033
5542 1 16 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.815 0.085 25033
5543 1 16 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.004 0.616 25033
5544 1 16 . 1 1 18 18 GLN H H 18 8.573 8.573 7.919 0.654 25033
5545 1 16 . 1 1 19 19 GLN N N 19 116.301 116.301 122.329 -6.028 25033
5546 1 16 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.123 0.255 25033
5547 1 16 . 1 1 19 19 GLN C C 19 176.902 176.902 174.604 2.298 25033
5548 1 16 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.217 -0.002 25033
5549 1 16 . 1 1 19 19 GLN CB C 19 34.638 34.638 34.006 0.632 25033
5550 1 16 . 1 1 19 19 GLN H H 19 8.146 8.146 8.408 -0.262 25033
5551 1 16 . 1 1 20 20 GLY N N 20 109.745 109.745 108.742 1.003 25033
5552 1 16 . 1 1 20 20 GLY C C 20 170.989 170.989 172.634 -1.645 25033
5553 1 16 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.181 1.754 25033
5554 1 16 . 1 1 20 20 GLY H H 20 8.998 8.998 8.119 0.879 25033
5555 1 16 . 1 1 21 21 THR N N 21 112.645 112.645 113.801 -1.156 25033
5556 1 16 . 1 1 21 21 THR HA H 21 5.361 5.361 5.461 -0.100 25033
5557 1 16 . 1 1 21 21 THR C C 21 174.553 174.553 176.462 -1.909 25033
5558 1 16 . 1 1 21 21 THR CA C 21 60.025 60.025 59.509 0.516 25033
5559 1 16 . 1 1 21 21 THR CB C 21 71.720 71.720 71.579 0.141 25033
5560 1 16 . 1 1 21 21 THR H H 21 8.312 8.312 8.061 0.251 25033
5561 1 16 . 1 1 22 22 VAL N N 22 125.915 125.915 123.665 2.250 25033
5562 1 16 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.765 -0.116 25033
5563 1 16 . 1 1 22 22 VAL C C 22 175.553 175.553 177.746 -2.193 25033
5564 1 16 . 1 1 22 22 VAL CA C 22 64.618 64.618 66.212 -1.594 25033
5565 1 16 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.504 0.117 25033
5566 1 16 . 1 1 22 22 VAL H H 22 9.092 9.092 8.238 0.854 25033
5567 1 16 . 1 1 23 23 LYS N N 23 135.790 135.790 120.987 14.803 25033
5568 1 16 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.042 0.259 25033
5569 1 16 . 1 1 23 23 LYS C C 23 176.301 176.301 176.565 -0.264 25033
5570 1 16 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.667 -0.057 25033
5571 1 16 . 1 1 23 23 LYS CB C 23 34.300 34.300 32.035 2.265 25033
5572 1 16 . 1 1 23 23 LYS H H 23 9.276 9.276 8.493 0.783 25033
5573 1 16 . 1 1 24 24 TRP N N 24 111.651 111.651 118.235 -6.584 25033
5574 1 16 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.844 -0.221 25033
5575 1 16 . 1 1 24 24 TRP C C 24 173.628 173.628 174.809 -1.181 25033
5576 1 16 . 1 1 24 24 TRP CA C 24 56.300 56.300 56.152 0.148 25033
5577 1 16 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.230 2.030 25033
5578 1 16 . 1 1 24 24 TRP H H 24 7.455 7.455 7.715 -0.260 25033
5579 1 16 . 1 1 25 25 PHE N N 25 121.305 121.305 120.513 0.792 25033
5580 1 16 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.793 -0.508 25033
5581 1 16 . 1 1 25 25 PHE C C 25 172.354 172.354 174.852 -2.498 25033
5582 1 16 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.127 2.245 25033
5583 1 16 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.147 0.422 25033
5584 1 16 . 1 1 25 25 PHE H H 25 9.074 9.074 8.018 1.056 25033
5585 1 16 . 1 1 26 26 ASN N N 26 126.976 126.976 124.160 2.816 25033
5586 1 16 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.937 -0.125 25033
5587 1 16 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.239 -0.827 25033
5588 1 16 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.440 -0.354 25033
5589 1 16 . 1 1 26 26 ASN H H 26 8.159 8.159 8.119 0.040 25033
5590 1 16 . 1 1 27 27 ALA N N 27 128.245 128.245 126.137 2.108 25033
5591 1 16 . 1 1 27 27 ALA HA H 27 4.121 4.121 3.935 0.186 25033
5592 1 16 . 1 1 27 27 ALA C C 27 179.031 179.031 178.890 0.141 25033
5593 1 16 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.302 -0.877 25033
5594 1 16 . 1 1 27 27 ALA CB C 27 18.374 18.374 19.177 -0.803 25033
5595 1 16 . 1 1 27 27 ALA H H 27 9.036 9.036 8.587 0.449 25033
5596 1 16 . 1 1 28 28 THR N N 28 113.994 113.994 111.738 2.256 25033
5597 1 16 . 1 1 28 28 THR HA H 28 4.068 4.068 3.994 0.074 25033
5598 1 16 . 1 1 28 28 THR C C 28 176.084 176.084 175.870 0.214 25033
5599 1 16 . 1 1 28 28 THR CA C 28 65.820 65.820 65.095 0.725 25033
5600 1 16 . 1 1 28 28 THR CB C 28 68.291 68.291 68.133 0.158 25033
5601 1 16 . 1 1 28 28 THR H H 28 8.065 8.065 8.191 -0.126 25033
5602 1 16 . 1 1 29 29 LYS N N 29 118.922 118.922 120.269 -1.347 25033
5603 1 16 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.279 -0.023 25033
5604 1 16 . 1 1 29 29 LYS C C 29 177.201 177.201 177.333 -0.132 25033
5605 1 16 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.385 0.503 25033
5606 1 16 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.454 1.286 25033
5607 1 16 . 1 1 29 29 LYS H H 29 7.446 7.446 7.877 -0.431 25033
5608 1 16 . 1 1 30 30 GLY N N 30 107.601 107.601 107.592 0.009 25033
5609 1 16 . 1 1 30 30 GLY C C 30 172.004 172.004 173.096 -1.092 25033
5610 1 16 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.193 1.211 25033
5611 1 16 . 1 1 30 30 GLY H H 30 8.115 8.115 7.903 0.212 25033
5612 1 16 . 1 1 31 31 PHE N N 31 112.488 112.488 119.090 -6.602 25033
5613 1 16 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.458 0.549 25033
5614 1 16 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.352 -2.074 25033
5615 1 16 . 1 1 31 31 PHE CB C 31 42.388 42.388 40.840 1.548 25033
5616 1 16 . 1 1 31 31 PHE H H 31 6.594 6.594 7.514 -0.920 25033
5617 1 16 . 1 1 32 32 GLY N N 32 105.986 105.986 109.262 -3.276 25033
5618 1 16 . 1 1 32 32 GLY C C 32 170.292 170.292 172.012 -1.720 25033
5619 1 16 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.554 1.815 25033
5620 1 16 . 1 1 32 32 GLY H H 32 8.144 8.144 7.972 0.172 25033
5621 1 16 . 1 1 33 33 PHE N N 33 115.319 115.319 115.843 -0.524 25033
5622 1 16 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.373 0.090 25033
5623 1 16 . 1 1 33 33 PHE C C 33 175.037 175.037 175.045 -0.008 25033
5624 1 16 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.515 -1.220 25033
5625 1 16 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.303 0.488 25033
5626 1 16 . 1 1 33 33 PHE H H 33 7.971 7.971 7.944 0.027 25033
5627 1 16 . 1 1 34 34 ILE N N 34 122.140 122.140 120.807 1.333 25033
5628 1 16 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.712 -0.395 25033
5629 1 16 . 1 1 34 34 ILE C C 34 174.526 174.526 175.322 -0.796 25033
5630 1 16 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.708 0.089 25033
5631 1 16 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.601 1.982 25033
5632 1 16 . 1 1 34 34 ILE H H 34 9.511 9.511 9.213 0.298 25033
5633 1 16 . 1 1 35 35 THR N N 35 126.580 126.580 118.897 7.683 25033
5634 1 16 . 1 1 35 35 THR HA H 35 5.143 5.143 5.091 0.052 25033
5635 1 16 . 1 1 35 35 THR CA C 35 59.330 59.330 58.413 0.917 25033
5636 1 16 . 1 1 35 35 THR CB C 35 70.258 70.258 68.780 1.478 25033
5637 1 16 . 1 1 35 35 THR H H 35 9.416 9.416 8.724 0.692 25033
5638 1 16 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.588 0.011 25033
5639 1 16 . 1 1 36 36 PRO C C 36 177.390 177.390 177.817 -0.427 25033
5640 1 16 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.199 0.021 25033
5641 1 16 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.044 0.426 25033
5642 1 16 . 1 1 37 37 GLY N N 37 112.033 112.033 110.321 1.712 25033
5643 1 16 . 1 1 37 37 GLY C C 37 169.261 169.261 174.521 -5.260 25033
5644 1 16 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.638 1.819 25033
5645 1 16 . 1 1 37 37 GLY H H 37 9.349 9.349 8.681 0.668 25033
5646 1 16 . 1 1 38 38 GLY N N 38 109.050 109.050 108.810 0.240 25033
5647 1 16 . 1 1 38 38 GLY C C 38 175.177 175.177 174.666 0.511 25033
5648 1 16 . 1 1 38 38 GLY H H 38 8.756 8.756 7.798 0.958 25033
5649 1 16 . 1 1 39 39 GLY N N 39 107.730 107.730 106.657 1.073 25033
5650 1 16 . 1 1 39 39 GLY C C 39 173.870 173.870 173.819 0.051 25033
5651 1 16 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.193 -0.935 25033
5652 1 16 . 1 1 39 39 GLY H H 39 7.725 7.725 7.757 -0.032 25033
5653 1 16 . 1 1 40 40 GLY N N 40 107.183 107.183 111.386 -4.203 25033
5654 1 16 . 1 1 40 40 GLY C C 40 173.067 173.067 173.656 -0.589 25033
5655 1 16 . 1 1 40 40 GLY CA C 40 43.760 43.760 45.514 -1.754 25033
5656 1 16 . 1 1 40 40 GLY H H 40 8.096 8.096 8.037 0.059 25033
5657 1 16 . 1 1 41 41 GLU N N 41 119.455 119.455 123.516 -4.061 25033
5658 1 16 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.527 -0.349 25033
5659 1 16 . 1 1 41 41 GLU C C 41 175.900 175.900 175.079 0.821 25033
5660 1 16 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.184 1.193 25033
5661 1 16 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.830 -0.230 25033
5662 1 16 . 1 1 41 41 GLU H H 41 8.199 8.199 8.501 -0.302 25033
5663 1 16 . 1 1 42 42 ASP N N 42 119.784 119.784 123.708 -3.924 25033
5664 1 16 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.108 -0.251 25033
5665 1 16 . 1 1 42 42 ASP C C 42 176.474 176.474 176.261 0.213 25033
5666 1 16 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.588 1.853 25033
5667 1 16 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.087 0.400 25033
5668 1 16 . 1 1 42 42 ASP H H 42 8.277 8.277 8.390 -0.113 25033
5669 1 16 . 1 1 43 43 LEU N N 43 122.515 122.515 120.063 2.452 25033
5670 1 16 . 1 1 43 43 LEU HA H 43 4.687 4.687 5.038 -0.351 25033
5671 1 16 . 1 1 43 43 LEU C C 43 175.759 175.759 175.937 -0.178 25033
5672 1 16 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.304 0.000 25033
5673 1 16 . 1 1 43 43 LEU CB C 43 45.449 45.449 44.425 1.024 25033
5674 1 16 . 1 1 43 43 LEU H H 43 9.423 9.423 8.555 0.868 25033
5675 1 16 . 1 1 44 44 PHE N N 44 125.962 125.962 117.805 8.157 25033
5676 1 16 . 1 1 44 44 PHE HA H 44 3.922 3.922 5.076 -1.154 25033
5677 1 16 . 1 1 44 44 PHE C C 44 172.844 172.844 174.674 -1.830 25033
5678 1 16 . 1 1 44 44 PHE CA C 44 57.880 57.880 55.941 1.939 25033
5679 1 16 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.999 0.351 25033
5680 1 16 . 1 1 44 44 PHE H H 44 8.465 8.465 8.044 0.421 25033
5681 1 16 . 1 1 45 45 VAL N N 45 123.552 123.552 123.256 0.296 25033
5682 1 16 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.378 0.279 25033
5683 1 16 . 1 1 45 45 VAL C C 45 177.433 177.433 174.120 3.313 25033
5684 1 16 . 1 1 45 45 VAL CA C 45 58.460 58.460 59.943 -1.483 25033
5685 1 16 . 1 1 45 45 VAL CB C 45 34.884 34.884 35.261 -0.377 25033
5686 1 16 . 1 1 45 45 VAL H H 45 7.715 7.715 7.998 -0.283 25033
5687 1 16 . 1 1 46 46 HIS N N 46 127.300 127.300 126.318 0.982 25033
5688 1 16 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.827 -0.002 25033
5689 1 16 . 1 1 46 46 HIS C C 46 176.469 176.469 174.269 2.200 25033
5690 1 16 . 1 1 46 46 HIS CA C 46 55.929 55.929 55.330 0.599 25033
5691 1 16 . 1 1 46 46 HIS CB C 46 34.399 34.399 32.079 2.320 25033
5692 1 16 . 1 1 46 46 HIS H H 46 9.104 9.104 8.565 0.539 25033
5693 1 16 . 1 1 47 47 GLN N N 47 125.105 125.105 123.106 1.999 25033
5694 1 16 . 1 1 47 47 GLN H H 47 8.352 8.352 7.985 0.367 25033
5695 1 16 . 1 1 48 48 THR HA H 48 4.310 4.310 4.319 -0.010 25033
5696 1 16 . 1 1 48 48 THR C C 48 175.568 175.568 174.989 0.579 25033
5697 1 16 . 1 1 48 48 THR CA C 48 64.770 64.770 63.166 1.604 25033
5698 1 16 . 1 1 48 48 THR CB C 48 70.054 70.054 69.770 0.284 25033
5699 1 16 . 1 1 49 49 ASN N N 49 118.142 118.142 119.275 -1.133 25033
5700 1 16 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.829 0.331 25033
5701 1 16 . 1 1 49 49 ASN C C 49 172.914 172.914 173.710 -0.796 25033
5702 1 16 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.311 1.040 25033
5703 1 16 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.450 1.077 25033
5704 1 16 . 1 1 49 49 ASN H H 49 8.452 8.452 8.456 -0.004 25033
5705 1 16 . 1 1 50 50 ILE N N 50 119.226 119.226 121.559 -2.333 25033
5706 1 16 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.193 -0.081 25033
5707 1 16 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.518 1.088 25033
5708 1 16 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.651 1.711 25033
5709 1 16 . 1 1 50 50 ILE H H 50 7.354 7.354 7.788 -0.434 25033
5710 1 16 . 1 1 51 51 ASN N N 51 128.460 128.460 122.521 5.939 25033
5711 1 16 . 1 1 51 51 ASN C C 51 174.614 174.614 174.254 0.360 25033
5712 1 16 . 1 1 51 51 ASN H H 51 9.266 9.266 7.948 1.318 25033
5713 1 16 . 1 1 52 52 SER N N 52 117.246 117.246 115.910 1.336 25033
5714 1 16 . 1 1 52 52 SER HA H 52 4.413 4.413 4.626 -0.213 25033
5715 1 16 . 1 1 52 52 SER C C 52 174.139 174.139 174.311 -0.172 25033
5716 1 16 . 1 1 52 52 SER CA C 52 58.378 58.378 57.987 0.391 25033
5717 1 16 . 1 1 52 52 SER CB C 52 64.371 64.371 64.376 -0.005 25033
5718 1 16 . 1 1 52 52 SER H H 52 7.973 7.973 8.319 -0.346 25033
5719 1 16 . 1 1 53 53 GLU N N 53 123.628 123.628 120.213 3.415 25033
5720 1 16 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.310 -0.012 25033
5721 1 16 . 1 1 53 53 GLU C C 53 176.960 176.960 175.683 1.277 25033
5722 1 16 . 1 1 53 53 GLU CA C 53 57.270 57.270 56.386 0.884 25033
5723 1 16 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.819 0.042 25033
5724 1 16 . 1 1 53 53 GLU H H 53 8.641 8.641 8.441 0.200 25033
5725 1 16 . 1 1 54 54 GLY N N 54 110.282 110.282 108.427 1.855 25033
5726 1 16 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.564 0.036 25033
5727 1 16 . 1 1 54 54 GLY H H 54 8.225 8.225 7.883 0.342 25033
5728 1 16 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.836 -0.016 25033
5729 1 16 . 1 1 55 55 PHE C C 55 175.836 175.836 175.124 0.712 25033
5730 1 16 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.303 -4.613 25033
5731 1 16 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.187 -3.092 25033
5732 1 16 . 1 1 56 56 ARG N N 56 120.907 120.907 123.456 -2.549 25033
5733 1 16 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.605 -0.341 25033
5734 1 16 . 1 1 56 56 ARG C C 56 175.618 175.618 176.255 -0.637 25033
5735 1 16 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.662 -0.152 25033
5736 1 16 . 1 1 56 56 ARG CB C 56 32.020 32.020 30.831 1.189 25033
5737 1 16 . 1 1 56 56 ARG H H 56 8.153 8.153 8.850 -0.697 25033
5738 1 16 . 1 1 57 57 SER N N 57 123.117 123.117 121.576 1.541 25033
5739 1 16 . 1 1 57 57 SER H H 57 7.834 7.834 8.684 -0.850 25033
5740 1 16 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.822 -0.542 25033
5741 1 16 . 1 1 58 58 LEU C C 58 174.842 174.842 175.881 -1.039 25033
5742 1 16 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.633 -0.873 25033
5743 1 16 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.752 -1.172 25033
5744 1 16 . 1 1 59 59 ARG N N 59 119.557 119.557 121.425 -1.868 25033
5745 1 16 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.653 -0.068 25033
5746 1 16 . 1 1 59 59 ARG C C 59 175.256 175.256 175.547 -0.291 25033
5747 1 16 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.731 -0.619 25033
5748 1 16 . 1 1 59 59 ARG CB C 59 32.970 32.970 32.509 0.461 25033
5749 1 16 . 1 1 59 59 ARG H H 59 8.529 8.529 8.899 -0.370 25033
5750 1 16 . 1 1 60 60 GLU N N 60 121.597 121.597 120.591 1.006 25033
5751 1 16 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.077 -0.496 25033
5752 1 16 . 1 1 60 60 GLU C C 60 177.281 177.281 176.928 0.353 25033
5753 1 16 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.511 0.790 25033
5754 1 16 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.969 -0.708 25033
5755 1 16 . 1 1 60 60 GLU H H 60 8.691 8.691 8.578 0.113 25033
5756 1 16 . 1 1 61 61 GLY N N 61 113.554 113.554 111.337 2.217 25033
5757 1 16 . 1 1 61 61 GLY C C 61 174.068 174.068 174.555 -0.487 25033
5758 1 16 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.748 0.495 25033
5759 1 16 . 1 1 61 61 GLY H H 61 9.151 9.151 8.717 0.434 25033
5760 1 16 . 1 1 62 62 GLU N N 62 121.639 121.639 122.451 -0.812 25033
5761 1 16 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.263 -0.059 25033
5762 1 16 . 1 1 62 62 GLU C C 62 175.439 175.439 176.327 -0.888 25033
5763 1 16 . 1 1 62 62 GLU CA C 62 57.342 57.342 57.029 0.313 25033
5764 1 16 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.562 0.363 25033
5765 1 16 . 1 1 62 62 GLU H H 62 7.889 7.889 7.698 0.191 25033
5766 1 16 . 1 1 63 63 VAL N N 63 125.003 125.003 127.382 -2.379 25033
5767 1 16 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.850 -0.102 25033
5768 1 16 . 1 1 63 63 VAL C C 63 176.639 176.639 176.205 0.434 25033
5769 1 16 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.876 0.755 25033
5770 1 16 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.707 -0.350 25033
5771 1 16 . 1 1 63 63 VAL H H 63 8.477 8.477 8.458 0.019 25033
5772 1 16 . 1 1 64 64 VAL N N 64 120.113 120.113 121.731 -1.618 25033
5773 1 16 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.937 0.067 25033
5774 1 16 . 1 1 64 64 VAL C C 64 173.790 173.790 174.607 -0.817 25033
5775 1 16 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.050 -0.441 25033
5776 1 16 . 1 1 64 64 VAL CB C 64 36.360 36.360 34.962 1.398 25033
5777 1 16 . 1 1 64 64 VAL H H 64 8.686 8.686 9.078 -0.392 25033
5778 1 16 . 1 1 65 65 GLU N N 65 120.433 120.433 119.459 0.974 25033
5779 1 16 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.560 -0.113 25033
5780 1 16 . 1 1 65 65 GLU C C 65 175.584 175.584 175.147 0.437 25033
5781 1 16 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.920 -0.530 25033
5782 1 16 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.508 0.495 25033
5783 1 16 . 1 1 65 65 GLU H H 65 9.003 9.003 8.381 0.622 25033
5784 1 16 . 1 1 66 66 PHE N N 66 116.104 116.104 118.050 -1.946 25033
5785 1 16 . 1 1 66 66 PHE HA H 66 5.061 5.061 4.986 0.075 25033
5786 1 16 . 1 1 66 66 PHE C C 66 173.001 173.001 172.637 0.364 25033
5787 1 16 . 1 1 66 66 PHE CA C 66 56.857 56.857 57.222 -0.365 25033
5788 1 16 . 1 1 66 66 PHE CB C 66 41.432 41.432 40.919 0.513 25033
5789 1 16 . 1 1 66 66 PHE H H 66 8.172 8.172 8.019 0.153 25033
5790 1 16 . 1 1 67 67 GLU N N 67 117.574 117.574 117.938 -0.364 25033
5791 1 16 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.190 -0.318 25033
5792 1 16 . 1 1 67 67 GLU C C 67 175.327 175.327 175.662 -0.335 25033
5793 1 16 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.022 0.619 25033
5794 1 16 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.724 -0.703 25033
5795 1 16 . 1 1 67 67 GLU H H 67 8.668 8.668 8.541 0.127 25033
5796 1 16 . 1 1 68 68 VAL N N 68 120.881 120.881 122.306 -1.425 25033
5797 1 16 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.267 0.745 25033
5798 1 16 . 1 1 68 68 VAL C C 68 176.140 176.140 175.684 0.456 25033
5799 1 16 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.708 -0.370 25033
5800 1 16 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.237 1.769 25033
5801 1 16 . 1 1 68 68 VAL H H 68 8.748 8.748 8.667 0.081 25033
5802 1 16 . 1 1 69 69 GLU N N 69 128.110 128.110 128.825 -0.715 25033
5803 1 16 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.555 0.150 25033
5804 1 16 . 1 1 69 69 GLU C C 69 174.573 174.573 175.142 -0.569 25033
5805 1 16 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.812 0.141 25033
5806 1 16 . 1 1 69 69 GLU CB C 69 34.290 34.290 32.381 1.909 25033
5807 1 16 . 1 1 69 69 GLU H H 69 9.070 9.070 8.861 0.209 25033
5808 1 16 . 1 1 70 70 ALA N N 70 127.944 127.944 130.628 -2.684 25033
5809 1 16 . 1 1 70 70 ALA HA H 70 5.004 5.004 4.985 0.019 25033
5810 1 16 . 1 1 70 70 ALA C C 70 178.073 178.073 177.606 0.467 25033
5811 1 16 . 1 1 70 70 ALA CA C 70 50.959 50.959 51.292 -0.333 25033
5812 1 16 . 1 1 70 70 ALA CB C 70 19.489 19.489 19.226 0.263 25033
5813 1 16 . 1 1 70 70 ALA H H 70 8.671 8.671 8.649 0.022 25033
5814 1 16 . 1 1 71 71 GLY N N 71 110.340 110.340 111.692 -1.352 25033
5815 1 16 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.943 0.073 25033
5816 1 16 . 1 1 71 71 GLY H H 71 8.445 8.445 8.665 -0.220 25033
5817 1 16 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.380 0.037 25033
5818 1 16 . 1 1 72 72 PRO C C 72 176.835 176.835 176.693 0.142 25033
5819 1 16 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.088 0.072 25033
5820 1 16 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.961 -0.081 25033
5821 1 16 . 1 1 73 73 ASP N N 73 116.498 116.498 117.154 -0.656 25033
5822 1 16 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.671 -0.156 25033
5823 1 16 . 1 1 73 73 ASP C C 73 176.775 176.775 176.911 -0.136 25033
5824 1 16 . 1 1 73 73 ASP CA C 73 53.547 53.547 55.938 -2.391 25033
5825 1 16 . 1 1 73 73 ASP CB C 73 40.234 40.234 41.201 -0.967 25033
5826 1 16 . 1 1 73 73 ASP H H 73 8.248 8.248 8.219 0.029 25033
5827 1 16 . 1 1 74 74 GLY N N 74 107.369 107.369 107.037 0.332 25033
5828 1 16 . 1 1 74 74 GLY C C 74 174.331 174.331 173.795 0.536 25033
5829 1 16 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.824 0.754 25033
5830 1 16 . 1 1 74 74 GLY H H 74 8.153 8.153 7.875 0.279 25033
5831 1 16 . 1 1 75 75 ARG N N 75 120.942 120.942 119.058 1.884 25033
5832 1 16 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.604 -0.062 25033
5833 1 16 . 1 1 75 75 ARG C C 75 176.652 176.652 175.291 1.361 25033
5834 1 16 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.279 0.379 25033
5835 1 16 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.439 -0.530 25033
5836 1 16 . 1 1 75 75 ARG H H 75 7.670 7.670 8.097 -0.427 25033
5837 1 16 . 1 1 76 76 SER N N 76 120.181 120.181 116.553 3.628 25033
5838 1 16 . 1 1 76 76 SER HA H 76 5.035 5.035 5.093 -0.058 25033
5839 1 16 . 1 1 76 76 SER C C 76 172.816 172.816 174.396 -1.580 25033
5840 1 16 . 1 1 76 76 SER CA C 76 59.080 59.080 57.207 1.873 25033
5841 1 16 . 1 1 76 76 SER CB C 76 64.850 64.850 64.735 0.115 25033
5842 1 16 . 1 1 76 76 SER H H 76 8.808 8.808 8.452 0.356 25033
5843 1 16 . 1 1 77 77 LYS N N 77 121.202 121.202 123.542 -2.340 25033
5844 1 16 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.696 0.478 25033
5845 1 16 . 1 1 77 77 LYS C C 77 173.706 173.706 174.435 -0.729 25033
5846 1 16 . 1 1 77 77 LYS CA C 77 54.599 54.599 56.078 -1.479 25033
5847 1 16 . 1 1 77 77 LYS CB C 77 36.035 36.035 37.099 -1.063 25033
5848 1 16 . 1 1 77 77 LYS H H 77 8.982 8.982 8.020 0.962 25033
5849 1 16 . 1 1 78 78 ALA N N 78 124.064 124.064 127.807 -3.743 25033
5850 1 16 . 1 1 78 78 ALA HA H 78 5.004 5.004 5.175 -0.171 25033
5851 1 16 . 1 1 78 78 ALA C C 78 175.979 175.979 176.326 -0.347 25033
5852 1 16 . 1 1 78 78 ALA CA C 78 50.445 50.445 50.801 -0.356 25033
5853 1 16 . 1 1 78 78 ALA CB C 78 20.136 20.136 20.297 -0.161 25033
5854 1 16 . 1 1 78 78 ALA H H 78 8.706 8.706 8.491 0.215 25033
5855 1 16 . 1 1 79 79 VAL N N 79 113.264 113.264 117.001 -3.737 25033
5856 1 16 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.441 0.402 25033
5857 1 16 . 1 1 79 79 VAL C C 79 174.744 174.744 174.426 0.318 25033
5858 1 16 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.824 -0.751 25033
5859 1 16 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.371 0.225 25033
5860 1 16 . 1 1 79 79 VAL H H 79 9.165 9.165 7.682 1.483 25033
5861 1 16 . 1 1 80 80 ASN N N 80 120.084 120.084 114.688 5.396 25033
5862 1 16 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.323 0.033 25033
5863 1 16 . 1 1 80 80 ASN C C 80 175.391 175.391 174.332 1.059 25033
5864 1 16 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.666 0.068 25033
5865 1 16 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.474 0.647 25033
5866 1 16 . 1 1 80 80 ASN H H 80 8.923 8.923 8.636 0.287 25033
5867 1 16 . 1 1 81 81 VAL N N 81 119.178 119.178 119.005 0.173 25033
5868 1 16 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.558 0.189 25033
5869 1 16 . 1 1 81 81 VAL C C 81 176.340 176.340 176.213 0.127 25033
5870 1 16 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.926 0.234 25033
5871 1 16 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.890 0.240 25033
5872 1 16 . 1 1 81 81 VAL H H 81 8.282 8.282 7.804 0.478 25033
5873 1 17 . 1 1 12 12 SER N N 12 116.112 116.112 117.716 -1.604 25033
5874 1 17 . 1 1 12 12 SER C C 12 175.271 175.271 175.680 -0.409 25033
5875 1 17 . 1 1 12 12 SER CA C 12 58.570 58.570 57.958 0.612 25033
5876 1 17 . 1 1 12 12 SER CB C 12 63.984 63.984 63.565 0.419 25033
5877 1 17 . 1 1 12 12 SER H H 12 8.422 8.422 8.324 0.098 25033
5878 1 17 . 1 1 13 13 GLY N N 13 111.178 111.178 115.486 -4.308 25033
5879 1 17 . 1 1 13 13 GLY C C 13 174.238 174.238 174.858 -0.620 25033
5880 1 17 . 1 1 13 13 GLY CA C 13 45.520 45.520 45.064 0.456 25033
5881 1 17 . 1 1 13 13 GLY H H 13 8.537 8.537 8.976 -0.439 25033
5882 1 17 . 1 1 14 14 GLU N N 14 120.547 120.547 119.660 0.887 25033
5883 1 17 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.531 -0.264 25033
5884 1 17 . 1 1 14 14 GLU C C 14 176.455 176.455 175.894 0.561 25033
5885 1 17 . 1 1 14 14 GLU CA C 14 56.753 56.753 56.236 0.517 25033
5886 1 17 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.359 1.105 25033
5887 1 17 . 1 1 14 14 GLU H H 14 8.285 8.285 8.806 -0.521 25033
5888 1 17 . 1 1 15 15 GLN N N 15 121.185 121.185 118.678 2.507 25033
5889 1 17 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.413 -0.064 25033
5890 1 17 . 1 1 15 15 GLN C C 15 175.494 175.494 175.304 0.190 25033
5891 1 17 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.264 0.406 25033
5892 1 17 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.707 -0.297 25033
5893 1 17 . 1 1 15 15 GLN H H 15 8.444 8.444 7.444 1.000 25033
5894 1 17 . 1 1 16 16 LEU N N 16 123.934 123.934 124.666 -0.732 25033
5895 1 17 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.504 -0.163 25033
5896 1 17 . 1 1 16 16 LEU C C 16 176.942 176.942 175.512 1.430 25033
5897 1 17 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.154 1.350 25033
5898 1 17 . 1 1 16 16 LEU CB C 16 42.519 42.519 40.488 2.031 25033
5899 1 17 . 1 1 16 16 LEU H H 16 8.289 8.289 8.511 -0.222 25033
5900 1 17 . 1 1 17 17 ARG N N 17 122.044 122.044 120.999 1.045 25033
5901 1 17 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.623 -0.159 25033
5902 1 17 . 1 1 17 17 ARG C C 17 175.829 175.829 175.724 0.105 25033
5903 1 17 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.479 1.193 25033
5904 1 17 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.365 -0.535 25033
5905 1 17 . 1 1 17 17 ARG H H 17 8.216 8.216 8.201 0.015 25033
5906 1 17 . 1 1 18 18 GLN N N 18 122.488 122.488 123.756 -1.268 25033
5907 1 17 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.485 -0.151 25033
5908 1 17 . 1 1 18 18 GLN C C 18 172.958 172.958 173.365 -0.407 25033
5909 1 17 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.111 0.789 25033
5910 1 17 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.476 0.144 25033
5911 1 17 . 1 1 18 18 GLN H H 18 8.573 8.573 7.879 0.694 25033
5912 1 17 . 1 1 19 19 GLN N N 19 116.301 116.301 119.267 -2.966 25033
5913 1 17 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.415 -0.037 25033
5914 1 17 . 1 1 19 19 GLN C C 19 176.902 176.902 174.316 2.586 25033
5915 1 17 . 1 1 19 19 GLN CA C 19 54.215 54.215 53.451 0.764 25033
5916 1 17 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.186 1.452 25033
5917 1 17 . 1 1 19 19 GLN H H 19 8.146 8.146 8.274 -0.128 25033
5918 1 17 . 1 1 20 20 GLY N N 20 109.745 109.745 107.792 1.953 25033
5919 1 17 . 1 1 20 20 GLY C C 20 170.989 170.989 172.898 -1.909 25033
5920 1 17 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.251 1.684 25033
5921 1 17 . 1 1 20 20 GLY H H 20 8.998 8.998 8.400 0.598 25033
5922 1 17 . 1 1 21 21 THR N N 21 112.645 112.645 112.585 0.060 25033
5923 1 17 . 1 1 21 21 THR HA H 21 5.361 5.361 5.298 0.063 25033
5924 1 17 . 1 1 21 21 THR C C 21 174.553 174.553 175.568 -1.015 25033
5925 1 17 . 1 1 21 21 THR CA C 21 60.025 60.025 59.754 0.271 25033
5926 1 17 . 1 1 21 21 THR CB C 21 71.720 71.720 72.077 -0.357 25033
5927 1 17 . 1 1 21 21 THR H H 21 8.312 8.312 8.196 0.116 25033
5928 1 17 . 1 1 22 22 VAL N N 22 125.915 125.915 121.838 4.077 25033
5929 1 17 . 1 1 22 22 VAL HA H 22 3.649 3.649 4.025 -0.376 25033
5930 1 17 . 1 1 22 22 VAL C C 22 175.553 175.553 177.783 -2.230 25033
5931 1 17 . 1 1 22 22 VAL CA C 22 64.618 64.618 63.391 1.227 25033
5932 1 17 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.197 0.424 25033
5933 1 17 . 1 1 22 22 VAL H H 22 9.092 9.092 8.251 0.841 25033
5934 1 17 . 1 1 23 23 LYS N N 23 135.790 135.790 119.536 16.254 25033
5935 1 17 . 1 1 23 23 LYS HA H 23 4.301 4.301 3.955 0.346 25033
5936 1 17 . 1 1 23 23 LYS C C 23 176.301 176.301 176.478 -0.177 25033
5937 1 17 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.868 -0.258 25033
5938 1 17 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.311 2.989 25033
5939 1 17 . 1 1 23 23 LYS H H 23 9.276 9.276 8.488 0.788 25033
5940 1 17 . 1 1 24 24 TRP N N 24 111.651 111.651 119.288 -7.637 25033
5941 1 17 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.816 -0.193 25033
5942 1 17 . 1 1 24 24 TRP C C 24 173.628 173.628 174.786 -1.158 25033
5943 1 17 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.437 0.863 25033
5944 1 17 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.843 1.417 25033
5945 1 17 . 1 1 24 24 TRP H H 24 7.455 7.455 7.523 -0.068 25033
5946 1 17 . 1 1 25 25 PHE N N 25 121.305 121.305 121.499 -0.194 25033
5947 1 17 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.868 -0.583 25033
5948 1 17 . 1 1 25 25 PHE C C 25 172.354 172.354 174.310 -1.956 25033
5949 1 17 . 1 1 25 25 PHE CA C 25 59.372 59.372 56.395 2.977 25033
5950 1 17 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.807 -0.238 25033
5951 1 17 . 1 1 25 25 PHE H H 25 9.074 9.074 8.179 0.895 25033
5952 1 17 . 1 1 26 26 ASN N N 26 126.976 126.976 123.140 3.836 25033
5953 1 17 . 1 1 26 26 ASN HA H 26 4.812 4.812 5.163 -0.351 25033
5954 1 17 . 1 1 26 26 ASN CA C 26 51.412 51.412 51.881 -0.469 25033
5955 1 17 . 1 1 26 26 ASN CB C 26 39.086 39.086 38.547 0.539 25033
5956 1 17 . 1 1 26 26 ASN H H 26 8.159 8.159 8.509 -0.350 25033
5957 1 17 . 1 1 27 27 ALA N N 27 128.245 128.245 127.791 0.454 25033
5958 1 17 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.249 -0.128 25033
5959 1 17 . 1 1 27 27 ALA C C 27 179.031 179.031 178.908 0.123 25033
5960 1 17 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.218 -0.793 25033
5961 1 17 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.913 -0.539 25033
5962 1 17 . 1 1 27 27 ALA H H 27 9.036 9.036 8.701 0.335 25033
5963 1 17 . 1 1 28 28 THR N N 28 113.994 113.994 113.428 0.566 25033
5964 1 17 . 1 1 28 28 THR HA H 28 4.068 4.068 4.048 0.020 25033
5965 1 17 . 1 1 28 28 THR C C 28 176.084 176.084 175.737 0.347 25033
5966 1 17 . 1 1 28 28 THR CA C 28 65.820 65.820 65.161 0.659 25033
5967 1 17 . 1 1 28 28 THR CB C 28 68.291 68.291 68.235 0.056 25033
5968 1 17 . 1 1 28 28 THR H H 28 8.065 8.065 8.335 -0.270 25033
5969 1 17 . 1 1 29 29 LYS N N 29 118.922 118.922 118.980 -0.058 25033
5970 1 17 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.456 -0.200 25033
5971 1 17 . 1 1 29 29 LYS C C 29 177.201 177.201 177.030 0.171 25033
5972 1 17 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.499 0.389 25033
5973 1 17 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.658 1.082 25033
5974 1 17 . 1 1 29 29 LYS H H 29 7.446 7.446 8.067 -0.621 25033
5975 1 17 . 1 1 30 30 GLY N N 30 107.601 107.601 106.926 0.675 25033
5976 1 17 . 1 1 30 30 GLY C C 30 172.004 172.004 173.184 -1.180 25033
5977 1 17 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.227 1.177 25033
5978 1 17 . 1 1 30 30 GLY H H 30 8.115 8.115 7.584 0.531 25033
5979 1 17 . 1 1 31 31 PHE N N 31 112.488 112.488 117.810 -5.322 25033
5980 1 17 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.732 0.275 25033
5981 1 17 . 1 1 31 31 PHE CA C 31 55.278 55.278 56.935 -1.657 25033
5982 1 17 . 1 1 31 31 PHE CB C 31 42.388 42.388 42.683 -0.295 25033
5983 1 17 . 1 1 31 31 PHE H H 31 6.594 6.594 8.009 -1.415 25033
5984 1 17 . 1 1 32 32 GLY N N 32 105.986 105.986 105.202 0.784 25033
5985 1 17 . 1 1 32 32 GLY C C 32 170.292 170.292 171.356 -1.064 25033
5986 1 17 . 1 1 32 32 GLY CA C 32 45.369 45.369 45.049 0.320 25033
5987 1 17 . 1 1 32 32 GLY H H 32 8.144 8.144 7.438 0.706 25033
5988 1 17 . 1 1 33 33 PHE N N 33 115.319 115.319 116.444 -1.125 25033
5989 1 17 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.252 0.211 25033
5990 1 17 . 1 1 33 33 PHE C C 33 175.037 175.037 174.735 0.302 25033
5991 1 17 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.303 -1.008 25033
5992 1 17 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.203 0.589 25033
5993 1 17 . 1 1 33 33 PHE H H 33 7.971 7.971 7.722 0.249 25033
5994 1 17 . 1 1 34 34 ILE N N 34 122.140 122.140 120.809 1.331 25033
5995 1 17 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.725 -0.408 25033
5996 1 17 . 1 1 34 34 ILE C C 34 174.526 174.526 175.393 -0.867 25033
5997 1 17 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.717 0.080 25033
5998 1 17 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.700 1.883 25033
5999 1 17 . 1 1 34 34 ILE H H 34 9.511 9.511 9.156 0.355 25033
6000 1 17 . 1 1 35 35 THR N N 35 126.580 126.580 118.954 7.626 25033
6001 1 17 . 1 1 35 35 THR HA H 35 5.143 5.143 4.963 0.180 25033
6002 1 17 . 1 1 35 35 THR CA C 35 59.330 59.330 58.846 0.484 25033
6003 1 17 . 1 1 35 35 THR CB C 35 70.258 70.258 68.918 1.340 25033
6004 1 17 . 1 1 35 35 THR H H 35 9.416 9.416 8.830 0.586 25033
6005 1 17 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.623 -0.024 25033
6006 1 17 . 1 1 36 36 PRO C C 36 177.390 177.390 177.568 -0.178 25033
6007 1 17 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.256 -0.036 25033
6008 1 17 . 1 1 36 36 PRO CB C 36 32.470 32.470 31.965 0.505 25033
6009 1 17 . 1 1 37 37 GLY N N 37 112.033 112.033 110.777 1.256 25033
6010 1 17 . 1 1 37 37 GLY C C 37 169.261 169.261 174.725 -5.464 25033
6011 1 17 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.735 1.722 25033
6012 1 17 . 1 1 37 37 GLY H H 37 9.349 9.349 8.613 0.736 25033
6013 1 17 . 1 1 38 38 GLY N N 38 109.050 109.050 108.359 0.691 25033
6014 1 17 . 1 1 38 38 GLY C C 38 175.177 175.177 174.871 0.306 25033
6015 1 17 . 1 1 38 38 GLY H H 38 8.756 8.756 7.925 0.831 25033
6016 1 17 . 1 1 39 39 GLY N N 39 107.730 107.730 106.517 1.213 25033
6017 1 17 . 1 1 39 39 GLY C C 39 173.870 173.870 175.264 -1.394 25033
6018 1 17 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.265 -1.007 25033
6019 1 17 . 1 1 39 39 GLY H H 39 7.725 7.725 8.278 -0.553 25033
6020 1 17 . 1 1 40 40 GLY N N 40 107.183 107.183 109.441 -2.258 25033
6021 1 17 . 1 1 40 40 GLY C C 40 173.067 173.067 174.538 -1.471 25033
6022 1 17 . 1 1 40 40 GLY CA C 40 43.760 43.760 44.627 -0.867 25033
6023 1 17 . 1 1 40 40 GLY H H 40 8.096 8.096 8.055 0.041 25033
6024 1 17 . 1 1 41 41 GLU N N 41 119.455 119.455 119.725 -0.270 25033
6025 1 17 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.130 0.048 25033
6026 1 17 . 1 1 41 41 GLU C C 41 175.900 175.900 176.452 -0.552 25033
6027 1 17 . 1 1 41 41 GLU CA C 41 56.377 56.377 56.533 -0.156 25033
6028 1 17 . 1 1 41 41 GLU CB C 41 30.600 30.600 29.924 0.676 25033
6029 1 17 . 1 1 41 41 GLU H H 41 8.199 8.199 8.370 -0.171 25033
6030 1 17 . 1 1 42 42 ASP N N 42 119.784 119.784 120.837 -1.053 25033
6031 1 17 . 1 1 42 42 ASP HA H 42 4.857 4.857 4.993 -0.136 25033
6032 1 17 . 1 1 42 42 ASP C C 42 176.474 176.474 175.230 1.244 25033
6033 1 17 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.279 2.162 25033
6034 1 17 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.602 -0.114 25033
6035 1 17 . 1 1 42 42 ASP H H 42 8.277 8.277 8.263 0.014 25033
6036 1 17 . 1 1 43 43 LEU N N 43 122.515 122.515 120.954 1.561 25033
6037 1 17 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.751 -0.064 25033
6038 1 17 . 1 1 43 43 LEU C C 43 175.759 175.759 176.227 -0.468 25033
6039 1 17 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.420 -0.116 25033
6040 1 17 . 1 1 43 43 LEU CB C 43 45.449 45.449 45.965 -0.516 25033
6041 1 17 . 1 1 43 43 LEU H H 43 9.423 9.423 8.583 0.840 25033
6042 1 17 . 1 1 44 44 PHE N N 44 125.962 125.962 120.116 5.846 25033
6043 1 17 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.920 -0.998 25033
6044 1 17 . 1 1 44 44 PHE C C 44 172.844 172.844 174.626 -1.782 25033
6045 1 17 . 1 1 44 44 PHE CA C 44 57.880 57.880 56.485 1.395 25033
6046 1 17 . 1 1 44 44 PHE CB C 44 40.350 40.350 40.054 0.296 25033
6047 1 17 . 1 1 44 44 PHE H H 44 8.465 8.465 8.185 0.280 25033
6048 1 17 . 1 1 45 45 VAL N N 45 123.552 123.552 124.257 -0.705 25033
6049 1 17 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.419 0.238 25033
6050 1 17 . 1 1 45 45 VAL C C 45 177.433 177.433 173.643 3.790 25033
6051 1 17 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.462 -2.002 25033
6052 1 17 . 1 1 45 45 VAL CB C 45 34.884 34.884 35.244 -0.360 25033
6053 1 17 . 1 1 45 45 VAL H H 45 7.715 7.715 8.021 -0.306 25033
6054 1 17 . 1 1 46 46 HIS N N 46 127.300 127.300 124.916 2.384 25033
6055 1 17 . 1 1 46 46 HIS HA H 46 4.825 4.825 5.128 -0.303 25033
6056 1 17 . 1 1 46 46 HIS C C 46 176.469 176.469 173.989 2.480 25033
6057 1 17 . 1 1 46 46 HIS CA C 46 55.929 55.929 53.533 2.396 25033
6058 1 17 . 1 1 46 46 HIS CB C 46 34.399 34.399 30.172 4.227 25033
6059 1 17 . 1 1 46 46 HIS H H 46 9.104 9.104 8.062 1.042 25033
6060 1 17 . 1 1 47 47 GLN N N 47 125.105 125.105 123.937 1.168 25033
6061 1 17 . 1 1 47 47 GLN H H 47 8.352 8.352 8.664 -0.312 25033
6062 1 17 . 1 1 48 48 THR HA H 48 4.310 4.310 4.416 -0.106 25033
6063 1 17 . 1 1 48 48 THR C C 48 175.568 175.568 174.995 0.573 25033
6064 1 17 . 1 1 48 48 THR CA C 48 64.770 64.770 63.454 1.316 25033
6065 1 17 . 1 1 48 48 THR CB C 48 70.054 70.054 69.532 0.522 25033
6066 1 17 . 1 1 49 49 ASN N N 49 118.142 118.142 118.878 -0.736 25033
6067 1 17 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.835 0.325 25033
6068 1 17 . 1 1 49 49 ASN C C 49 172.914 172.914 173.864 -0.950 25033
6069 1 17 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.358 0.993 25033
6070 1 17 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.438 1.089 25033
6071 1 17 . 1 1 49 49 ASN H H 49 8.452 8.452 8.493 -0.041 25033
6072 1 17 . 1 1 50 50 ILE N N 50 119.226 119.226 120.105 -0.879 25033
6073 1 17 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.163 -0.051 25033
6074 1 17 . 1 1 50 50 ILE CA C 50 61.606 61.606 61.154 0.452 25033
6075 1 17 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.946 1.416 25033
6076 1 17 . 1 1 50 50 ILE H H 50 7.354 7.354 7.823 -0.469 25033
6077 1 17 . 1 1 51 51 ASN N N 51 128.460 128.460 123.741 4.719 25033
6078 1 17 . 1 1 51 51 ASN C C 51 174.614 174.614 174.321 0.293 25033
6079 1 17 . 1 1 51 51 ASN H H 51 9.266 9.266 8.060 1.206 25033
6080 1 17 . 1 1 52 52 SER N N 52 117.246 117.246 117.654 -0.408 25033
6081 1 17 . 1 1 52 52 SER HA H 52 4.413 4.413 4.771 -0.358 25033
6082 1 17 . 1 1 52 52 SER C C 52 174.139 174.139 174.110 0.029 25033
6083 1 17 . 1 1 52 52 SER CA C 52 58.378 58.378 57.871 0.507 25033
6084 1 17 . 1 1 52 52 SER CB C 52 64.371 64.371 64.614 -0.243 25033
6085 1 17 . 1 1 52 52 SER H H 52 7.973 7.973 8.472 -0.499 25033
6086 1 17 . 1 1 53 53 GLU N N 53 123.628 123.628 121.705 1.923 25033
6087 1 17 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.227 0.071 25033
6088 1 17 . 1 1 53 53 GLU C C 53 176.960 176.960 176.753 0.207 25033
6089 1 17 . 1 1 53 53 GLU CA C 53 57.270 57.270 57.278 -0.008 25033
6090 1 17 . 1 1 53 53 GLU CB C 53 29.861 29.861 30.217 -0.356 25033
6091 1 17 . 1 1 53 53 GLU H H 53 8.641 8.641 8.696 -0.055 25033
6092 1 17 . 1 1 54 54 GLY N N 54 110.282 110.282 107.500 2.782 25033
6093 1 17 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.803 -0.204 25033
6094 1 17 . 1 1 54 54 GLY H H 54 8.225 8.225 7.918 0.307 25033
6095 1 17 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.825 -0.005 25033
6096 1 17 . 1 1 55 55 PHE C C 55 175.836 175.836 174.705 1.131 25033
6097 1 17 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.272 -4.582 25033
6098 1 17 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.712 -3.617 25033
6099 1 17 . 1 1 56 56 ARG N N 56 120.907 120.907 123.021 -2.114 25033
6100 1 17 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.640 -0.376 25033
6101 1 17 . 1 1 56 56 ARG C C 56 175.618 175.618 175.878 -0.260 25033
6102 1 17 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.476 0.034 25033
6103 1 17 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.554 0.466 25033
6104 1 17 . 1 1 56 56 ARG H H 56 8.153 8.153 8.647 -0.494 25033
6105 1 17 . 1 1 57 57 SER N N 57 123.117 123.117 119.662 3.455 25033
6106 1 17 . 1 1 57 57 SER H H 57 7.834 7.834 8.536 -0.702 25033
6107 1 17 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.603 -0.323 25033
6108 1 17 . 1 1 58 58 LEU C C 58 174.842 174.842 176.370 -1.528 25033
6109 1 17 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.843 -1.083 25033
6110 1 17 . 1 1 58 58 LEU CB C 58 42.580 42.580 44.397 -1.817 25033
6111 1 17 . 1 1 59 59 ARG N N 59 119.557 119.557 121.272 -1.715 25033
6112 1 17 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.662 -0.077 25033
6113 1 17 . 1 1 59 59 ARG C C 59 175.256 175.256 175.215 0.041 25033
6114 1 17 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.578 -0.466 25033
6115 1 17 . 1 1 59 59 ARG CB C 59 32.970 32.970 33.581 -0.611 25033
6116 1 17 . 1 1 59 59 ARG H H 59 8.529 8.529 8.661 -0.132 25033
6117 1 17 . 1 1 60 60 GLU N N 60 121.597 121.597 120.795 0.802 25033
6118 1 17 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.027 -0.446 25033
6119 1 17 . 1 1 60 60 GLU C C 60 177.281 177.281 176.787 0.494 25033
6120 1 17 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.733 0.567 25033
6121 1 17 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.856 -0.595 25033
6122 1 17 . 1 1 60 60 GLU H H 60 8.691 8.691 8.607 0.084 25033
6123 1 17 . 1 1 61 61 GLY N N 61 113.554 113.554 110.480 3.074 25033
6124 1 17 . 1 1 61 61 GLY C C 61 174.068 174.068 174.183 -0.115 25033
6125 1 17 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.808 0.435 25033
6126 1 17 . 1 1 61 61 GLY H H 61 9.151 9.151 8.628 0.523 25033
6127 1 17 . 1 1 62 62 GLU N N 62 121.639 121.639 122.410 -0.771 25033
6128 1 17 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.213 -0.009 25033
6129 1 17 . 1 1 62 62 GLU C C 62 175.439 175.439 176.334 -0.895 25033
6130 1 17 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.875 0.467 25033
6131 1 17 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.178 0.747 25033
6132 1 17 . 1 1 62 62 GLU H H 62 7.889 7.889 7.702 0.187 25033
6133 1 17 . 1 1 63 63 VAL N N 63 125.003 125.003 125.685 -0.682 25033
6134 1 17 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.960 -0.212 25033
6135 1 17 . 1 1 63 63 VAL C C 63 176.639 176.639 176.286 0.353 25033
6136 1 17 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.773 0.858 25033
6137 1 17 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.358 -0.001 25033
6138 1 17 . 1 1 63 63 VAL H H 63 8.477 8.477 8.217 0.260 25033
6139 1 17 . 1 1 64 64 VAL N N 64 120.113 120.113 122.307 -2.194 25033
6140 1 17 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.859 0.145 25033
6141 1 17 . 1 1 64 64 VAL C C 64 173.790 173.790 173.770 0.020 25033
6142 1 17 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.682 -1.073 25033
6143 1 17 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.573 0.787 25033
6144 1 17 . 1 1 64 64 VAL H H 64 8.686 8.686 8.933 -0.247 25033
6145 1 17 . 1 1 65 65 GLU N N 65 120.433 120.433 120.908 -0.475 25033
6146 1 17 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.460 -0.013 25033
6147 1 17 . 1 1 65 65 GLU C C 65 175.584 175.584 175.309 0.275 25033
6148 1 17 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.293 0.097 25033
6149 1 17 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.184 0.818 25033
6150 1 17 . 1 1 65 65 GLU H H 65 9.003 9.003 8.454 0.549 25033
6151 1 17 . 1 1 66 66 PHE N N 66 116.104 116.104 117.887 -1.783 25033
6152 1 17 . 1 1 66 66 PHE HA H 66 5.061 5.061 4.952 0.109 25033
6153 1 17 . 1 1 66 66 PHE C C 66 173.001 173.001 172.727 0.274 25033
6154 1 17 . 1 1 66 66 PHE CA C 66 56.857 56.857 57.170 -0.313 25033
6155 1 17 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.277 0.155 25033
6156 1 17 . 1 1 66 66 PHE H H 66 8.172 8.172 7.996 0.176 25033
6157 1 17 . 1 1 67 67 GLU N N 67 117.574 117.574 119.292 -1.718 25033
6158 1 17 . 1 1 67 67 GLU HA H 67 4.872 4.872 4.815 0.057 25033
6159 1 17 . 1 1 67 67 GLU C C 67 175.327 175.327 175.016 0.311 25033
6160 1 17 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.994 -0.353 25033
6161 1 17 . 1 1 67 67 GLU CB C 67 33.020 33.020 32.994 0.026 25033
6162 1 17 . 1 1 67 67 GLU H H 67 8.668 8.668 8.691 -0.023 25033
6163 1 17 . 1 1 68 68 VAL N N 68 120.881 120.881 124.729 -3.848 25033
6164 1 17 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.485 0.527 25033
6165 1 17 . 1 1 68 68 VAL C C 68 176.140 176.140 175.643 0.497 25033
6166 1 17 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.430 -0.092 25033
6167 1 17 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.686 1.320 25033
6168 1 17 . 1 1 68 68 VAL H H 68 8.748 8.748 8.662 0.086 25033
6169 1 17 . 1 1 69 69 GLU N N 69 128.110 128.110 129.401 -1.291 25033
6170 1 17 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.666 0.039 25033
6171 1 17 . 1 1 69 69 GLU C C 69 174.573 174.573 174.643 -0.070 25033
6172 1 17 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.705 0.248 25033
6173 1 17 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.338 0.952 25033
6174 1 17 . 1 1 69 69 GLU H H 69 9.070 9.070 9.046 0.024 25033
6175 1 17 . 1 1 70 70 ALA N N 70 127.944 127.944 128.274 -0.330 25033
6176 1 17 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.095 -0.091 25033
6177 1 17 . 1 1 70 70 ALA C C 70 178.073 178.073 177.088 0.985 25033
6178 1 17 . 1 1 70 70 ALA CA C 70 50.959 50.959 51.097 -0.138 25033
6179 1 17 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.384 -0.895 25033
6180 1 17 . 1 1 70 70 ALA H H 70 8.671 8.671 8.604 0.067 25033
6181 1 17 . 1 1 71 71 GLY N N 71 110.340 110.340 111.209 -0.869 25033
6182 1 17 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.563 0.453 25033
6183 1 17 . 1 1 71 71 GLY H H 71 8.445 8.445 8.437 0.008 25033
6184 1 17 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.391 0.026 25033
6185 1 17 . 1 1 72 72 PRO C C 72 176.835 176.835 176.788 0.047 25033
6186 1 17 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.507 -0.347 25033
6187 1 17 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.647 0.233 25033
6188 1 17 . 1 1 73 73 ASP N N 73 116.498 116.498 117.318 -0.820 25033
6189 1 17 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.591 -0.076 25033
6190 1 17 . 1 1 73 73 ASP C C 73 176.775 176.775 177.649 -0.874 25033
6191 1 17 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.357 -0.810 25033
6192 1 17 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.738 -0.504 25033
6193 1 17 . 1 1 73 73 ASP H H 73 8.248 8.248 8.518 -0.270 25033
6194 1 17 . 1 1 74 74 GLY N N 74 107.369 107.369 107.631 -0.262 25033
6195 1 17 . 1 1 74 74 GLY C C 74 174.331 174.331 173.405 0.926 25033
6196 1 17 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.921 0.657 25033
6197 1 17 . 1 1 74 74 GLY H H 74 8.153 8.153 7.665 0.488 25033
6198 1 17 . 1 1 75 75 ARG N N 75 120.942 120.942 120.029 0.913 25033
6199 1 17 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.728 -0.186 25033
6200 1 17 . 1 1 75 75 ARG C C 75 176.652 176.652 174.912 1.740 25033
6201 1 17 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.496 0.162 25033
6202 1 17 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.371 -0.462 25033
6203 1 17 . 1 1 75 75 ARG H H 75 7.670 7.670 7.982 -0.312 25033
6204 1 17 . 1 1 76 76 SER N N 76 120.181 120.181 116.983 3.198 25033
6205 1 17 . 1 1 76 76 SER HA H 76 5.035 5.035 5.667 -0.632 25033
6206 1 17 . 1 1 76 76 SER C C 76 172.816 172.816 174.061 -1.245 25033
6207 1 17 . 1 1 76 76 SER CA C 76 59.080 59.080 56.849 2.231 25033
6208 1 17 . 1 1 76 76 SER CB C 76 64.850 64.850 66.109 -1.259 25033
6209 1 17 . 1 1 76 76 SER H H 76 8.808 8.808 8.460 0.348 25033
6210 1 17 . 1 1 77 77 LYS N N 77 121.202 121.202 118.991 2.211 25033
6211 1 17 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.818 0.356 25033
6212 1 17 . 1 1 77 77 LYS C C 77 173.706 173.706 173.865 -0.159 25033
6213 1 17 . 1 1 77 77 LYS CA C 77 54.599 54.599 55.054 -0.455 25033
6214 1 17 . 1 1 77 77 LYS CB C 77 36.035 36.035 35.646 0.389 25033
6215 1 17 . 1 1 77 77 LYS H H 77 8.982 8.982 8.931 0.051 25033
6216 1 17 . 1 1 78 78 ALA N N 78 124.064 124.064 123.380 0.684 25033
6217 1 17 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.852 0.152 25033
6218 1 17 . 1 1 78 78 ALA C C 78 175.979 175.979 175.960 0.019 25033
6219 1 17 . 1 1 78 78 ALA CA C 78 50.445 50.445 50.369 0.076 25033
6220 1 17 . 1 1 78 78 ALA CB C 78 20.136 20.136 20.304 -0.168 25033
6221 1 17 . 1 1 78 78 ALA H H 78 8.706 8.706 8.342 0.364 25033
6222 1 17 . 1 1 79 79 VAL N N 79 113.264 113.264 118.355 -5.091 25033
6223 1 17 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.348 0.495 25033
6224 1 17 . 1 1 79 79 VAL C C 79 174.744 174.744 174.740 0.004 25033
6225 1 17 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.927 -0.854 25033
6226 1 17 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.541 0.055 25033
6227 1 17 . 1 1 79 79 VAL H H 79 9.165 9.165 7.645 1.520 25033
6228 1 17 . 1 1 80 80 ASN N N 80 120.084 120.084 114.807 5.277 25033
6229 1 17 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.363 -0.007 25033
6230 1 17 . 1 1 80 80 ASN C C 80 175.391 175.391 173.968 1.423 25033
6231 1 17 . 1 1 80 80 ASN CA C 80 53.734 53.734 54.163 -0.429 25033
6232 1 17 . 1 1 80 80 ASN CB C 80 37.121 37.121 37.467 -0.346 25033
6233 1 17 . 1 1 80 80 ASN H H 80 8.923 8.923 8.524 0.399 25033
6234 1 17 . 1 1 81 81 VAL N N 81 119.178 119.178 118.154 1.024 25033
6235 1 17 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.280 0.467 25033
6236 1 17 . 1 1 81 81 VAL C C 81 176.340 176.340 177.121 -0.781 25033
6237 1 17 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.944 0.216 25033
6238 1 17 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.880 0.250 25033
6239 1 17 . 1 1 81 81 VAL H H 81 8.282 8.282 7.750 0.532 25033
6240 1 18 . 1 1 12 12 SER N N 12 116.112 116.112 114.671 1.441 25033
6241 1 18 . 1 1 12 12 SER C C 12 175.271 175.271 175.802 -0.531 25033
6242 1 18 . 1 1 12 12 SER CA C 12 58.570 58.570 60.371 -1.801 25033
6243 1 18 . 1 1 12 12 SER CB C 12 63.984 63.984 63.636 0.348 25033
6244 1 18 . 1 1 12 12 SER H H 12 8.422 8.422 10.037 -1.615 25033
6245 1 18 . 1 1 13 13 GLY N N 13 111.178 111.178 109.576 1.602 25033
6246 1 18 . 1 1 13 13 GLY C C 13 174.238 174.238 174.476 -0.238 25033
6247 1 18 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.995 0.525 25033
6248 1 18 . 1 1 13 13 GLY H H 13 8.537 8.537 8.454 0.083 25033
6249 1 18 . 1 1 14 14 GLU N N 14 120.547 120.547 119.684 0.863 25033
6250 1 18 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.429 -0.162 25033
6251 1 18 . 1 1 14 14 GLU C C 14 176.455 176.455 176.102 0.353 25033
6252 1 18 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.920 0.833 25033
6253 1 18 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.775 0.689 25033
6254 1 18 . 1 1 14 14 GLU H H 14 8.285 8.285 8.429 -0.144 25033
6255 1 18 . 1 1 15 15 GLN N N 15 121.185 121.185 118.847 2.338 25033
6256 1 18 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.229 0.120 25033
6257 1 18 . 1 1 15 15 GLN C C 15 175.494 175.494 174.960 0.534 25033
6258 1 18 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.772 -0.102 25033
6259 1 18 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.385 0.025 25033
6260 1 18 . 1 1 15 15 GLN H H 15 8.444 8.444 7.810 0.634 25033
6261 1 18 . 1 1 16 16 LEU N N 16 123.934 123.934 125.373 -1.439 25033
6262 1 18 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.574 -0.233 25033
6263 1 18 . 1 1 16 16 LEU C C 16 176.942 176.942 175.246 1.696 25033
6264 1 18 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.563 0.941 25033
6265 1 18 . 1 1 16 16 LEU CB C 16 42.519 42.519 44.290 -1.771 25033
6266 1 18 . 1 1 16 16 LEU H H 16 8.289 8.289 8.428 -0.139 25033
6267 1 18 . 1 1 17 17 ARG N N 17 122.044 122.044 123.578 -1.534 25033
6268 1 18 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.278 0.186 25033
6269 1 18 . 1 1 17 17 ARG C C 17 175.829 175.829 175.689 0.140 25033
6270 1 18 . 1 1 17 17 ARG CA C 17 55.672 55.672 55.826 -0.154 25033
6271 1 18 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.135 -0.305 25033
6272 1 18 . 1 1 17 17 ARG H H 17 8.216 8.216 8.491 -0.275 25033
6273 1 18 . 1 1 18 18 GLN N N 18 122.488 122.488 124.360 -1.872 25033
6274 1 18 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.464 -0.130 25033
6275 1 18 . 1 1 18 18 GLN C C 18 172.958 172.958 173.506 -0.548 25033
6276 1 18 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.392 0.508 25033
6277 1 18 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.398 0.222 25033
6278 1 18 . 1 1 18 18 GLN H H 18 8.573 8.573 8.185 0.388 25033
6279 1 18 . 1 1 19 19 GLN N N 19 116.301 116.301 120.587 -4.286 25033
6280 1 18 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.368 0.010 25033
6281 1 18 . 1 1 19 19 GLN C C 19 176.902 176.902 174.766 2.136 25033
6282 1 18 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.080 0.135 25033
6283 1 18 . 1 1 19 19 GLN CB C 19 34.638 34.638 32.919 1.719 25033
6284 1 18 . 1 1 19 19 GLN H H 19 8.146 8.146 8.396 -0.250 25033
6285 1 18 . 1 1 20 20 GLY N N 20 109.745 109.745 109.543 0.202 25033
6286 1 18 . 1 1 20 20 GLY C C 20 170.989 170.989 172.603 -1.614 25033
6287 1 18 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.163 1.772 25033
6288 1 18 . 1 1 20 20 GLY H H 20 8.998 8.998 8.518 0.480 25033
6289 1 18 . 1 1 21 21 THR N N 21 112.645 112.645 113.129 -0.484 25033
6290 1 18 . 1 1 21 21 THR HA H 21 5.361 5.361 5.415 -0.054 25033
6291 1 18 . 1 1 21 21 THR C C 21 174.553 174.553 176.169 -1.616 25033
6292 1 18 . 1 1 21 21 THR CA C 21 60.025 60.025 59.435 0.590 25033
6293 1 18 . 1 1 21 21 THR CB C 21 71.720 71.720 71.979 -0.259 25033
6294 1 18 . 1 1 21 21 THR H H 21 8.312 8.312 8.079 0.233 25033
6295 1 18 . 1 1 22 22 VAL N N 22 125.915 125.915 123.947 1.968 25033
6296 1 18 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.843 -0.194 25033
6297 1 18 . 1 1 22 22 VAL C C 22 175.553 175.553 177.952 -2.399 25033
6298 1 18 . 1 1 22 22 VAL CA C 22 64.618 64.618 63.796 0.822 25033
6299 1 18 . 1 1 22 22 VAL CB C 22 31.621 31.621 30.931 0.690 25033
6300 1 18 . 1 1 22 22 VAL H H 22 9.092 9.092 8.342 0.750 25033
6301 1 18 . 1 1 23 23 LYS N N 23 135.790 135.790 121.056 14.734 25033
6302 1 18 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.037 0.264 25033
6303 1 18 . 1 1 23 23 LYS C C 23 176.301 176.301 176.673 -0.372 25033
6304 1 18 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.992 -0.382 25033
6305 1 18 . 1 1 23 23 LYS CB C 23 34.300 34.300 32.083 2.217 25033
6306 1 18 . 1 1 23 23 LYS H H 23 9.276 9.276 8.489 0.787 25033
6307 1 18 . 1 1 24 24 TRP N N 24 111.651 111.651 117.674 -6.023 25033
6308 1 18 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.835 -0.212 25033
6309 1 18 . 1 1 24 24 TRP C C 24 173.628 173.628 174.792 -1.164 25033
6310 1 18 . 1 1 24 24 TRP CA C 24 56.300 56.300 56.336 -0.036 25033
6311 1 18 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.636 1.624 25033
6312 1 18 . 1 1 24 24 TRP H H 24 7.455 7.455 7.735 -0.280 25033
6313 1 18 . 1 1 25 25 PHE N N 25 121.305 121.305 120.282 1.023 25033
6314 1 18 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.900 -0.615 25033
6315 1 18 . 1 1 25 25 PHE C C 25 172.354 172.354 174.109 -1.755 25033
6316 1 18 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.241 2.131 25033
6317 1 18 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.384 0.185 25033
6318 1 18 . 1 1 25 25 PHE H H 25 9.074 9.074 8.252 0.822 25033
6319 1 18 . 1 1 26 26 ASN N N 26 126.976 126.976 124.390 2.586 25033
6320 1 18 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.989 -0.177 25033
6321 1 18 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.413 -1.001 25033
6322 1 18 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.757 -0.671 25033
6323 1 18 . 1 1 26 26 ASN H H 26 8.159 8.159 8.230 -0.071 25033
6324 1 18 . 1 1 27 27 ALA N N 27 128.245 128.245 126.192 2.053 25033
6325 1 18 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.070 0.051 25033
6326 1 18 . 1 1 27 27 ALA C C 27 179.031 179.031 178.826 0.205 25033
6327 1 18 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.170 -0.745 25033
6328 1 18 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.903 -0.529 25033
6329 1 18 . 1 1 27 27 ALA H H 27 9.036 9.036 8.587 0.449 25033
6330 1 18 . 1 1 28 28 THR N N 28 113.994 113.994 114.197 -0.203 25033
6331 1 18 . 1 1 28 28 THR HA H 28 4.068 4.068 3.977 0.091 25033
6332 1 18 . 1 1 28 28 THR C C 28 176.084 176.084 176.266 -0.182 25033
6333 1 18 . 1 1 28 28 THR CA C 28 65.820 65.820 64.837 0.983 25033
6334 1 18 . 1 1 28 28 THR CB C 28 68.291 68.291 68.457 -0.166 25033
6335 1 18 . 1 1 28 28 THR H H 28 8.065 8.065 8.317 -0.252 25033
6336 1 18 . 1 1 29 29 LYS N N 29 118.922 118.922 119.593 -0.671 25033
6337 1 18 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.281 -0.025 25033
6338 1 18 . 1 1 29 29 LYS C C 29 177.201 177.201 177.006 0.195 25033
6339 1 18 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.857 0.031 25033
6340 1 18 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.464 1.276 25033
6341 1 18 . 1 1 29 29 LYS H H 29 7.446 7.446 8.129 -0.683 25033
6342 1 18 . 1 1 30 30 GLY N N 30 107.601 107.601 106.163 1.438 25033
6343 1 18 . 1 1 30 30 GLY C C 30 172.004 172.004 173.704 -1.700 25033
6344 1 18 . 1 1 30 30 GLY CA C 30 46.404 46.404 44.853 1.551 25033
6345 1 18 . 1 1 30 30 GLY H H 30 8.115 8.115 7.461 0.654 25033
6346 1 18 . 1 1 31 31 PHE N N 31 112.488 112.488 119.395 -6.907 25033
6347 1 18 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.322 0.685 25033
6348 1 18 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.219 -1.942 25033
6349 1 18 . 1 1 31 31 PHE CB C 31 42.388 42.388 40.840 1.548 25033
6350 1 18 . 1 1 31 31 PHE H H 31 6.594 6.594 7.602 -1.008 25033
6351 1 18 . 1 1 32 32 GLY N N 32 105.986 105.986 109.077 -3.091 25033
6352 1 18 . 1 1 32 32 GLY C C 32 170.292 170.292 171.866 -1.574 25033
6353 1 18 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.159 2.210 25033
6354 1 18 . 1 1 32 32 GLY H H 32 8.144 8.144 7.554 0.590 25033
6355 1 18 . 1 1 33 33 PHE N N 33 115.319 115.319 116.044 -0.725 25033
6356 1 18 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.442 0.021 25033
6357 1 18 . 1 1 33 33 PHE C C 33 175.037 175.037 175.217 -0.180 25033
6358 1 18 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.192 -0.897 25033
6359 1 18 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.174 0.618 25033
6360 1 18 . 1 1 33 33 PHE H H 33 7.971 7.971 8.013 -0.042 25033
6361 1 18 . 1 1 34 34 ILE N N 34 122.140 122.140 121.081 1.059 25033
6362 1 18 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.698 -0.381 25033
6363 1 18 . 1 1 34 34 ILE C C 34 174.526 174.526 175.614 -1.088 25033
6364 1 18 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.277 0.520 25033
6365 1 18 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.648 1.935 25033
6366 1 18 . 1 1 34 34 ILE H H 34 9.511 9.511 8.314 1.197 25033
6367 1 18 . 1 1 35 35 THR N N 35 126.580 126.580 117.720 8.860 25033
6368 1 18 . 1 1 35 35 THR HA H 35 5.143 5.143 5.302 -0.159 25033
6369 1 18 . 1 1 35 35 THR CA C 35 59.330 59.330 58.218 1.112 25033
6370 1 18 . 1 1 35 35 THR CB C 35 70.258 70.258 68.763 1.495 25033
6371 1 18 . 1 1 35 35 THR H H 35 9.416 9.416 8.539 0.878 25033
6372 1 18 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.579 0.020 25033
6373 1 18 . 1 1 36 36 PRO C C 36 177.390 177.390 178.036 -0.646 25033
6374 1 18 . 1 1 36 36 PRO CA C 36 63.220 63.220 62.902 0.318 25033
6375 1 18 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.213 0.257 25033
6376 1 18 . 1 1 37 37 GLY N N 37 112.033 112.033 111.667 0.366 25033
6377 1 18 . 1 1 37 37 GLY C C 37 169.261 169.261 174.541 -5.280 25033
6378 1 18 . 1 1 37 37 GLY CA C 37 46.457 46.457 45.149 1.308 25033
6379 1 18 . 1 1 37 37 GLY H H 37 9.349 9.349 8.699 0.650 25033
6380 1 18 . 1 1 38 38 GLY N N 38 109.050 109.050 109.046 0.004 25033
6381 1 18 . 1 1 38 38 GLY C C 38 175.177 175.177 175.167 0.010 25033
6382 1 18 . 1 1 38 38 GLY H H 38 8.756 8.756 7.992 0.764 25033
6383 1 18 . 1 1 39 39 GLY N N 39 107.730 107.730 108.465 -0.735 25033
6384 1 18 . 1 1 39 39 GLY C C 39 173.870 173.870 174.741 -0.871 25033
6385 1 18 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.087 -0.829 25033
6386 1 18 . 1 1 39 39 GLY H H 39 7.725 7.725 8.536 -0.811 25033
6387 1 18 . 1 1 40 40 GLY N N 40 107.183 107.183 108.662 -1.479 25033
6388 1 18 . 1 1 40 40 GLY C C 40 173.067 173.067 173.771 -0.704 25033
6389 1 18 . 1 1 40 40 GLY CA C 40 43.760 43.760 44.665 -0.905 25033
6390 1 18 . 1 1 40 40 GLY H H 40 8.096 8.096 8.164 -0.068 25033
6391 1 18 . 1 1 41 41 GLU N N 41 119.455 119.455 119.977 -0.522 25033
6392 1 18 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.445 -0.267 25033
6393 1 18 . 1 1 41 41 GLU C C 41 175.900 175.900 174.588 1.312 25033
6394 1 18 . 1 1 41 41 GLU CA C 41 56.377 56.377 54.309 2.068 25033
6395 1 18 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.560 0.040 25033
6396 1 18 . 1 1 41 41 GLU H H 41 8.199 8.199 8.138 0.061 25033
6397 1 18 . 1 1 42 42 ASP N N 42 119.784 119.784 124.977 -5.193 25033
6398 1 18 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.267 -0.410 25033
6399 1 18 . 1 1 42 42 ASP C C 42 176.474 176.474 175.583 0.891 25033
6400 1 18 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.940 1.501 25033
6401 1 18 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.878 -0.390 25033
6402 1 18 . 1 1 42 42 ASP H H 42 8.277 8.277 8.327 -0.050 25033
6403 1 18 . 1 1 43 43 LEU N N 43 122.515 122.515 122.933 -0.418 25033
6404 1 18 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.445 0.242 25033
6405 1 18 . 1 1 43 43 LEU C C 43 175.759 175.759 175.885 -0.126 25033
6406 1 18 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.481 -0.177 25033
6407 1 18 . 1 1 43 43 LEU CB C 43 45.449 45.449 45.425 0.024 25033
6408 1 18 . 1 1 43 43 LEU H H 43 9.423 9.423 8.125 1.298 25033
6409 1 18 . 1 1 44 44 PHE N N 44 125.962 125.962 119.538 6.424 25033
6410 1 18 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.651 -0.729 25033
6411 1 18 . 1 1 44 44 PHE C C 44 172.844 172.844 176.183 -3.339 25033
6412 1 18 . 1 1 44 44 PHE CA C 44 57.880 57.880 56.944 0.936 25033
6413 1 18 . 1 1 44 44 PHE CB C 44 40.350 40.350 38.862 1.488 25033
6414 1 18 . 1 1 44 44 PHE H H 44 8.465 8.465 8.143 0.322 25033
6415 1 18 . 1 1 45 45 VAL N N 45 123.552 123.552 125.431 -1.879 25033
6416 1 18 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.468 0.189 25033
6417 1 18 . 1 1 45 45 VAL C C 45 177.433 177.433 174.021 3.412 25033
6418 1 18 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.350 -1.890 25033
6419 1 18 . 1 1 45 45 VAL CB C 45 34.884 34.884 34.377 0.507 25033
6420 1 18 . 1 1 45 45 VAL H H 45 7.715 7.715 8.168 -0.453 25033
6421 1 18 . 1 1 46 46 HIS N N 46 127.300 127.300 127.314 -0.014 25033
6422 1 18 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.722 0.103 25033
6423 1 18 . 1 1 46 46 HIS C C 46 176.469 176.469 174.245 2.224 25033
6424 1 18 . 1 1 46 46 HIS CA C 46 55.929 55.929 55.696 0.233 25033
6425 1 18 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.928 2.471 25033
6426 1 18 . 1 1 46 46 HIS H H 46 9.104 9.104 8.599 0.505 25033
6427 1 18 . 1 1 47 47 GLN N N 47 125.105 125.105 123.069 2.036 25033
6428 1 18 . 1 1 47 47 GLN H H 47 8.352 8.352 7.871 0.481 25033
6429 1 18 . 1 1 48 48 THR HA H 48 4.310 4.310 4.409 -0.099 25033
6430 1 18 . 1 1 48 48 THR C C 48 175.568 175.568 174.914 0.654 25033
6431 1 18 . 1 1 48 48 THR CA C 48 64.770 64.770 63.543 1.227 25033
6432 1 18 . 1 1 48 48 THR CB C 48 70.054 70.054 69.624 0.430 25033
6433 1 18 . 1 1 49 49 ASN N N 49 118.142 118.142 119.881 -1.739 25033
6434 1 18 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.890 0.270 25033
6435 1 18 . 1 1 49 49 ASN C C 49 172.914 172.914 173.896 -0.982 25033
6436 1 18 . 1 1 49 49 ASN CA C 49 54.351 54.351 52.903 1.448 25033
6437 1 18 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.359 1.168 25033
6438 1 18 . 1 1 49 49 ASN H H 49 8.452 8.452 8.408 0.044 25033
6439 1 18 . 1 1 50 50 ILE N N 50 119.226 119.226 121.144 -1.918 25033
6440 1 18 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.232 -0.120 25033
6441 1 18 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.445 1.161 25033
6442 1 18 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.846 1.516 25033
6443 1 18 . 1 1 50 50 ILE H H 50 7.354 7.354 7.893 -0.539 25033
6444 1 18 . 1 1 51 51 ASN N N 51 128.460 128.460 124.277 4.183 25033
6445 1 18 . 1 1 51 51 ASN C C 51 174.614 174.614 173.877 0.737 25033
6446 1 18 . 1 1 51 51 ASN H H 51 9.266 9.266 8.058 1.208 25033
6447 1 18 . 1 1 52 52 SER N N 52 117.246 117.246 114.612 2.634 25033
6448 1 18 . 1 1 52 52 SER HA H 52 4.413 4.413 4.557 -0.144 25033
6449 1 18 . 1 1 52 52 SER C C 52 174.139 174.139 174.454 -0.315 25033
6450 1 18 . 1 1 52 52 SER CA C 52 58.378 58.378 58.120 0.258 25033
6451 1 18 . 1 1 52 52 SER CB C 52 64.371 64.371 64.345 0.026 25033
6452 1 18 . 1 1 52 52 SER H H 52 7.973 7.973 8.113 -0.140 25033
6453 1 18 . 1 1 53 53 GLU N N 53 123.628 123.628 124.932 -1.304 25033
6454 1 18 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.298 -0.000 25033
6455 1 18 . 1 1 53 53 GLU C C 53 176.960 176.960 176.327 0.633 25033
6456 1 18 . 1 1 53 53 GLU CA C 53 57.270 57.270 56.904 0.366 25033
6457 1 18 . 1 1 53 53 GLU CB C 53 29.861 29.861 30.047 -0.186 25033
6458 1 18 . 1 1 53 53 GLU H H 53 8.641 8.641 8.688 -0.047 25033
6459 1 18 . 1 1 54 54 GLY N N 54 110.282 110.282 108.127 2.155 25033
6460 1 18 . 1 1 54 54 GLY CA C 54 44.600 44.600 45.124 -0.524 25033
6461 1 18 . 1 1 54 54 GLY H H 54 8.225 8.225 7.560 0.665 25033
6462 1 18 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.726 0.094 25033
6463 1 18 . 1 1 55 55 PHE C C 55 175.836 175.836 175.113 0.723 25033
6464 1 18 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.545 -4.855 25033
6465 1 18 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.696 -3.601 25033
6466 1 18 . 1 1 56 56 ARG N N 56 120.907 120.907 122.735 -1.828 25033
6467 1 18 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.632 -0.368 25033
6468 1 18 . 1 1 56 56 ARG C C 56 175.618 175.618 175.692 -0.074 25033
6469 1 18 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.663 -0.153 25033
6470 1 18 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.118 0.902 25033
6471 1 18 . 1 1 56 56 ARG H H 56 8.153 8.153 8.887 -0.734 25033
6472 1 18 . 1 1 57 57 SER N N 57 123.117 123.117 121.542 1.575 25033
6473 1 18 . 1 1 57 57 SER H H 57 7.834 7.834 8.780 -0.946 25033
6474 1 18 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.729 -0.449 25033
6475 1 18 . 1 1 58 58 LEU C C 58 174.842 174.842 176.044 -1.202 25033
6476 1 18 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.222 -0.462 25033
6477 1 18 . 1 1 58 58 LEU CB C 58 42.580 42.580 44.386 -1.806 25033
6478 1 18 . 1 1 59 59 ARG N N 59 119.557 119.557 121.139 -1.582 25033
6479 1 18 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.602 -0.017 25033
6480 1 18 . 1 1 59 59 ARG C C 59 175.256 175.256 175.090 0.166 25033
6481 1 18 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.480 -0.368 25033
6482 1 18 . 1 1 59 59 ARG CB C 59 32.970 32.970 33.283 -0.313 25033
6483 1 18 . 1 1 59 59 ARG H H 59 8.529 8.529 8.429 0.100 25033
6484 1 18 . 1 1 60 60 GLU N N 60 121.597 121.597 120.048 1.549 25033
6485 1 18 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.311 -0.730 25033
6486 1 18 . 1 1 60 60 GLU C C 60 177.281 177.281 176.468 0.813 25033
6487 1 18 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.823 0.478 25033
6488 1 18 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.616 -0.355 25033
6489 1 18 . 1 1 60 60 GLU H H 60 8.691 8.691 8.585 0.106 25033
6490 1 18 . 1 1 61 61 GLY N N 61 113.554 113.554 112.655 0.899 25033
6491 1 18 . 1 1 61 61 GLY C C 61 174.068 174.068 174.959 -0.891 25033
6492 1 18 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.757 0.486 25033
6493 1 18 . 1 1 61 61 GLY H H 61 9.151 9.151 8.780 0.371 25033
6494 1 18 . 1 1 62 62 GLU N N 62 121.639 121.639 122.790 -1.151 25033
6495 1 18 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.248 -0.044 25033
6496 1 18 . 1 1 62 62 GLU C C 62 175.439 175.439 176.462 -1.023 25033
6497 1 18 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.855 0.487 25033
6498 1 18 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.401 0.524 25033
6499 1 18 . 1 1 62 62 GLU H H 62 7.889 7.889 7.682 0.207 25033
6500 1 18 . 1 1 63 63 VAL N N 63 125.003 125.003 127.364 -2.361 25033
6501 1 18 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.832 -0.084 25033
6502 1 18 . 1 1 63 63 VAL C C 63 176.639 176.639 176.150 0.489 25033
6503 1 18 . 1 1 63 63 VAL CA C 63 62.631 62.631 62.458 0.173 25033
6504 1 18 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.736 -0.379 25033
6505 1 18 . 1 1 63 63 VAL H H 63 8.477 8.477 8.438 0.039 25033
6506 1 18 . 1 1 64 64 VAL N N 64 120.113 120.113 122.988 -2.875 25033
6507 1 18 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.794 0.210 25033
6508 1 18 . 1 1 64 64 VAL C C 64 173.790 173.790 173.810 -0.020 25033
6509 1 18 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.365 -0.756 25033
6510 1 18 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.654 0.706 25033
6511 1 18 . 1 1 64 64 VAL H H 64 8.686 8.686 9.061 -0.375 25033
6512 1 18 . 1 1 65 65 GLU N N 65 120.433 120.433 122.837 -2.404 25033
6513 1 18 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.282 0.165 25033
6514 1 18 . 1 1 65 65 GLU C C 65 175.584 175.584 175.182 0.402 25033
6515 1 18 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.461 -0.071 25033
6516 1 18 . 1 1 65 65 GLU CB C 65 34.003 34.003 32.945 1.058 25033
6517 1 18 . 1 1 65 65 GLU H H 65 9.003 9.003 8.479 0.524 25033
6518 1 18 . 1 1 66 66 PHE N N 66 116.104 116.104 119.870 -3.766 25033
6519 1 18 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.052 0.009 25033
6520 1 18 . 1 1 66 66 PHE C C 66 173.001 173.001 172.832 0.169 25033
6521 1 18 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.790 0.067 25033
6522 1 18 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.542 -0.110 25033
6523 1 18 . 1 1 66 66 PHE H H 66 8.172 8.172 7.660 0.512 25033
6524 1 18 . 1 1 67 67 GLU N N 67 117.574 117.574 117.915 -0.341 25033
6525 1 18 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.082 -0.210 25033
6526 1 18 . 1 1 67 67 GLU C C 67 175.327 175.327 175.304 0.023 25033
6527 1 18 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.173 0.468 25033
6528 1 18 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.578 -0.558 25033
6529 1 18 . 1 1 67 67 GLU H H 67 8.668 8.668 8.702 -0.034 25033
6530 1 18 . 1 1 68 68 VAL N N 68 120.881 120.881 122.213 -1.332 25033
6531 1 18 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.128 0.884 25033
6532 1 18 . 1 1 68 68 VAL C C 68 176.140 176.140 175.305 0.835 25033
6533 1 18 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.869 -0.531 25033
6534 1 18 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.727 1.280 25033
6535 1 18 . 1 1 68 68 VAL H H 68 8.748 8.748 8.690 0.058 25033
6536 1 18 . 1 1 69 69 GLU N N 69 128.110 128.110 129.659 -1.549 25033
6537 1 18 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.668 0.037 25033
6538 1 18 . 1 1 69 69 GLU C C 69 174.573 174.573 174.600 -0.027 25033
6539 1 18 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.814 0.139 25033
6540 1 18 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.273 1.018 25033
6541 1 18 . 1 1 69 69 GLU H H 69 9.070 9.070 8.936 0.134 25033
6542 1 18 . 1 1 70 70 ALA N N 70 127.944 127.944 129.140 -1.196 25033
6543 1 18 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.010 -0.006 25033
6544 1 18 . 1 1 70 70 ALA C C 70 178.073 178.073 177.024 1.049 25033
6545 1 18 . 1 1 70 70 ALA CA C 70 50.959 50.959 51.085 -0.126 25033
6546 1 18 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.386 -0.897 25033
6547 1 18 . 1 1 70 70 ALA H H 70 8.671 8.671 8.640 0.031 25033
6548 1 18 . 1 1 71 71 GLY N N 71 110.340 110.340 111.242 -0.902 25033
6549 1 18 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.427 0.589 25033
6550 1 18 . 1 1 71 71 GLY H H 71 8.445 8.445 8.299 0.146 25033
6551 1 18 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.414 0.003 25033
6552 1 18 . 1 1 72 72 PRO C C 72 176.835 176.835 176.645 0.190 25033
6553 1 18 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.384 -0.224 25033
6554 1 18 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.793 0.087 25033
6555 1 18 . 1 1 73 73 ASP N N 73 116.498 116.498 118.457 -1.959 25033
6556 1 18 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.553 -0.038 25033
6557 1 18 . 1 1 73 73 ASP C C 73 176.775 176.775 177.201 -0.426 25033
6558 1 18 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.862 -1.315 25033
6559 1 18 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.919 -0.685 25033
6560 1 18 . 1 1 73 73 ASP H H 73 8.248 8.248 8.120 0.128 25033
6561 1 18 . 1 1 74 74 GLY N N 74 107.369 107.369 107.269 0.100 25033
6562 1 18 . 1 1 74 74 GLY C C 74 174.331 174.331 173.509 0.822 25033
6563 1 18 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.827 0.751 25033
6564 1 18 . 1 1 74 74 GLY H H 74 8.153 8.153 7.677 0.476 25033
6565 1 18 . 1 1 75 75 ARG N N 75 120.942 120.942 120.020 0.922 25033
6566 1 18 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.566 -0.024 25033
6567 1 18 . 1 1 75 75 ARG C C 75 176.652 176.652 174.978 1.674 25033
6568 1 18 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.516 0.142 25033
6569 1 18 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.120 -0.211 25033
6570 1 18 . 1 1 75 75 ARG H H 75 7.670 7.670 8.126 -0.456 25033
6571 1 18 . 1 1 76 76 SER N N 76 120.181 120.181 117.449 2.732 25033
6572 1 18 . 1 1 76 76 SER HA H 76 5.035 5.035 5.475 -0.440 25033
6573 1 18 . 1 1 76 76 SER C C 76 172.816 172.816 174.040 -1.224 25033
6574 1 18 . 1 1 76 76 SER CA C 76 59.080 59.080 57.014 2.066 25033
6575 1 18 . 1 1 76 76 SER CB C 76 64.850 64.850 65.776 -0.926 25033
6576 1 18 . 1 1 76 76 SER H H 76 8.808 8.808 8.446 0.362 25033
6577 1 18 . 1 1 77 77 LYS N N 77 121.202 121.202 122.430 -1.228 25033
6578 1 18 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.780 0.394 25033
6579 1 18 . 1 1 77 77 LYS C C 77 173.706 173.706 174.766 -1.060 25033
6580 1 18 . 1 1 77 77 LYS CA C 77 54.599 54.599 54.626 -0.027 25033
6581 1 18 . 1 1 77 77 LYS CB C 77 36.035 36.035 37.383 -1.348 25033
6582 1 18 . 1 1 77 77 LYS H H 77 8.982 8.982 8.816 0.166 25033
6583 1 18 . 1 1 78 78 ALA N N 78 124.064 124.064 124.309 -0.245 25033
6584 1 18 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.975 0.029 25033
6585 1 18 . 1 1 78 78 ALA C C 78 175.979 175.979 176.349 -0.370 25033
6586 1 18 . 1 1 78 78 ALA CA C 78 50.445 50.445 51.282 -0.837 25033
6587 1 18 . 1 1 78 78 ALA CB C 78 20.136 20.136 19.829 0.307 25033
6588 1 18 . 1 1 78 78 ALA H H 78 8.706 8.706 8.583 0.123 25033
6589 1 18 . 1 1 79 79 VAL N N 79 113.264 113.264 116.728 -3.464 25033
6590 1 18 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.438 0.405 25033
6591 1 18 . 1 1 79 79 VAL C C 79 174.744 174.744 174.695 0.049 25033
6592 1 18 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.871 -0.798 25033
6593 1 18 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.502 0.094 25033
6594 1 18 . 1 1 79 79 VAL H H 79 9.165 9.165 7.631 1.534 25033
6595 1 18 . 1 1 80 80 ASN N N 80 120.084 120.084 115.618 4.466 25033
6596 1 18 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.310 0.046 25033
6597 1 18 . 1 1 80 80 ASN C C 80 175.391 175.391 174.052 1.339 25033
6598 1 18 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.913 -0.179 25033
6599 1 18 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.946 0.175 25033
6600 1 18 . 1 1 80 80 ASN H H 80 8.923 8.923 8.579 0.344 25033
6601 1 18 . 1 1 81 81 VAL N N 81 119.178 119.178 118.675 0.503 25033
6602 1 18 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.390 0.357 25033
6603 1 18 . 1 1 81 81 VAL C C 81 176.340 176.340 176.589 -0.249 25033
6604 1 18 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.343 0.817 25033
6605 1 18 . 1 1 81 81 VAL CB C 81 32.130 32.130 32.325 -0.195 25033
6606 1 18 . 1 1 81 81 VAL H H 81 8.282 8.282 7.597 0.685 25033
6607 1 19 . 1 1 12 12 SER N N 12 116.112 116.112 116.044 0.068 25033
6608 1 19 . 1 1 12 12 SER C C 12 175.271 175.271 176.007 -0.736 25033
6609 1 19 . 1 1 12 12 SER CA C 12 58.570 58.570 59.662 -1.092 25033
6610 1 19 . 1 1 12 12 SER CB C 12 63.984 63.984 65.761 -1.777 25033
6611 1 19 . 1 1 12 12 SER H H 12 8.422 8.422 9.083 -0.661 25033
6612 1 19 . 1 1 13 13 GLY N N 13 111.178 111.178 109.711 1.467 25033
6613 1 19 . 1 1 13 13 GLY C C 13 174.238 174.238 174.425 -0.187 25033
6614 1 19 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.926 0.594 25033
6615 1 19 . 1 1 13 13 GLY H H 13 8.537 8.537 8.005 0.532 25033
6616 1 19 . 1 1 14 14 GLU N N 14 120.547 120.547 122.351 -1.804 25033
6617 1 19 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.367 -0.100 25033
6618 1 19 . 1 1 14 14 GLU C C 14 176.455 176.455 175.298 1.157 25033
6619 1 19 . 1 1 14 14 GLU CA C 14 56.753 56.753 55.916 0.837 25033
6620 1 19 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.454 1.010 25033
6621 1 19 . 1 1 14 14 GLU H H 14 8.285 8.285 8.357 -0.072 25033
6622 1 19 . 1 1 15 15 GLN N N 15 121.185 121.185 125.151 -3.966 25033
6623 1 19 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.529 -0.180 25033
6624 1 19 . 1 1 15 15 GLN C C 15 175.494 175.494 175.082 0.412 25033
6625 1 19 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.260 0.410 25033
6626 1 19 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.096 0.314 25033
6627 1 19 . 1 1 15 15 GLN H H 15 8.444 8.444 8.254 0.190 25033
6628 1 19 . 1 1 16 16 LEU N N 16 123.934 123.934 128.869 -4.935 25033
6629 1 19 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.562 -0.221 25033
6630 1 19 . 1 1 16 16 LEU C C 16 176.942 176.942 175.363 1.579 25033
6631 1 19 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.280 1.224 25033
6632 1 19 . 1 1 16 16 LEU CB C 16 42.519 42.519 42.225 0.294 25033
6633 1 19 . 1 1 16 16 LEU H H 16 8.289 8.289 8.536 -0.247 25033
6634 1 19 . 1 1 17 17 ARG N N 17 122.044 122.044 122.362 -0.318 25033
6635 1 19 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.358 0.106 25033
6636 1 19 . 1 1 17 17 ARG C C 17 175.829 175.829 175.777 0.052 25033
6637 1 19 . 1 1 17 17 ARG CA C 17 55.672 55.672 56.056 -0.384 25033
6638 1 19 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.724 -0.894 25033
6639 1 19 . 1 1 17 17 ARG H H 17 8.216 8.216 8.497 -0.281 25033
6640 1 19 . 1 1 18 18 GLN N N 18 122.488 122.488 124.752 -2.264 25033
6641 1 19 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.435 -0.101 25033
6642 1 19 . 1 1 18 18 GLN C C 18 172.958 172.958 173.263 -0.305 25033
6643 1 19 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.512 0.388 25033
6644 1 19 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.367 0.253 25033
6645 1 19 . 1 1 18 18 GLN H H 18 8.573 8.573 7.895 0.678 25033
6646 1 19 . 1 1 19 19 GLN N N 19 116.301 116.301 121.535 -5.234 25033
6647 1 19 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.469 -0.091 25033
6648 1 19 . 1 1 19 19 GLN C C 19 176.902 176.902 174.907 1.995 25033
6649 1 19 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.017 0.197 25033
6650 1 19 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.802 0.836 25033
6651 1 19 . 1 1 19 19 GLN H H 19 8.146 8.146 8.375 -0.229 25033
6652 1 19 . 1 1 20 20 GLY N N 20 109.745 109.745 108.985 0.760 25033
6653 1 19 . 1 1 20 20 GLY C C 20 170.989 170.989 172.410 -1.421 25033
6654 1 19 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.319 1.616 25033
6655 1 19 . 1 1 20 20 GLY H H 20 8.998 8.998 8.580 0.418 25033
6656 1 19 . 1 1 21 21 THR N N 21 112.645 112.645 112.263 0.382 25033
6657 1 19 . 1 1 21 21 THR HA H 21 5.361 5.361 5.200 0.161 25033
6658 1 19 . 1 1 21 21 THR C C 21 174.553 174.553 175.083 -0.530 25033
6659 1 19 . 1 1 21 21 THR CA C 21 60.025 60.025 60.008 0.017 25033
6660 1 19 . 1 1 21 21 THR CB C 21 71.720 71.720 71.920 -0.200 25033
6661 1 19 . 1 1 21 21 THR H H 21 8.312 8.312 8.294 0.018 25033
6662 1 19 . 1 1 22 22 VAL N N 22 125.915 125.915 120.200 5.715 25033
6663 1 19 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.953 -0.304 25033
6664 1 19 . 1 1 22 22 VAL C C 22 175.553 175.553 177.975 -2.422 25033
6665 1 19 . 1 1 22 22 VAL CA C 22 64.618 64.618 65.261 -0.643 25033
6666 1 19 . 1 1 22 22 VAL CB C 22 31.621 31.621 32.019 -0.398 25033
6667 1 19 . 1 1 22 22 VAL H H 22 9.092 9.092 8.164 0.928 25033
6668 1 19 . 1 1 23 23 LYS N N 23 135.790 135.790 119.851 15.939 25033
6669 1 19 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.201 0.100 25033
6670 1 19 . 1 1 23 23 LYS C C 23 176.301 176.301 176.869 -0.568 25033
6671 1 19 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.988 -0.378 25033
6672 1 19 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.723 2.577 25033
6673 1 19 . 1 1 23 23 LYS H H 23 9.276 9.276 8.511 0.765 25033
6674 1 19 . 1 1 24 24 TRP N N 24 111.651 111.651 119.044 -7.393 25033
6675 1 19 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.875 -0.252 25033
6676 1 19 . 1 1 24 24 TRP C C 24 173.628 173.628 174.675 -1.047 25033
6677 1 19 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.145 1.155 25033
6678 1 19 . 1 1 24 24 TRP CB C 24 31.260 31.260 28.860 2.400 25033
6679 1 19 . 1 1 24 24 TRP H H 24 7.455 7.455 7.752 -0.297 25033
6680 1 19 . 1 1 25 25 PHE N N 25 121.305 121.305 120.409 0.896 25033
6681 1 19 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.899 -0.614 25033
6682 1 19 . 1 1 25 25 PHE C C 25 172.354 172.354 174.231 -1.877 25033
6683 1 19 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.141 2.231 25033
6684 1 19 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.331 0.238 25033
6685 1 19 . 1 1 25 25 PHE H H 25 9.074 9.074 8.319 0.755 25033
6686 1 19 . 1 1 26 26 ASN N N 26 126.976 126.976 125.711 1.265 25033
6687 1 19 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.981 -0.169 25033
6688 1 19 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.530 -1.118 25033
6689 1 19 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.453 -0.367 25033
6690 1 19 . 1 1 26 26 ASN H H 26 8.159 8.159 8.427 -0.268 25033
6691 1 19 . 1 1 27 27 ALA N N 27 128.245 128.245 126.109 2.136 25033
6692 1 19 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.029 0.092 25033
6693 1 19 . 1 1 27 27 ALA C C 27 179.031 179.031 178.777 0.254 25033
6694 1 19 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.373 -0.948 25033
6695 1 19 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.774 -0.400 25033
6696 1 19 . 1 1 27 27 ALA H H 27 9.036 9.036 8.674 0.362 25033
6697 1 19 . 1 1 28 28 THR N N 28 113.994 113.994 113.531 0.463 25033
6698 1 19 . 1 1 28 28 THR HA H 28 4.068 4.068 4.004 0.064 25033
6699 1 19 . 1 1 28 28 THR C C 28 176.084 176.084 175.924 0.160 25033
6700 1 19 . 1 1 28 28 THR CA C 28 65.820 65.820 65.052 0.768 25033
6701 1 19 . 1 1 28 28 THR CB C 28 68.291 68.291 67.948 0.343 25033
6702 1 19 . 1 1 28 28 THR H H 28 8.065 8.065 8.407 -0.342 25033
6703 1 19 . 1 1 29 29 LYS N N 29 118.922 118.922 120.150 -1.228 25033
6704 1 19 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.350 -0.094 25033
6705 1 19 . 1 1 29 29 LYS C C 29 177.201 177.201 176.919 0.282 25033
6706 1 19 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.648 0.240 25033
6707 1 19 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.617 1.123 25033
6708 1 19 . 1 1 29 29 LYS H H 29 7.446 7.446 8.031 -0.585 25033
6709 1 19 . 1 1 30 30 GLY N N 30 107.601 107.601 106.182 1.419 25033
6710 1 19 . 1 1 30 30 GLY C C 30 172.004 172.004 173.494 -1.490 25033
6711 1 19 . 1 1 30 30 GLY CA C 30 46.404 46.404 44.855 1.549 25033
6712 1 19 . 1 1 30 30 GLY H H 30 8.115 8.115 7.413 0.702 25033
6713 1 19 . 1 1 31 31 PHE N N 31 112.488 112.488 119.183 -6.695 25033
6714 1 19 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.802 0.205 25033
6715 1 19 . 1 1 31 31 PHE CA C 31 55.278 55.278 57.093 -1.815 25033
6716 1 19 . 1 1 31 31 PHE CB C 31 42.388 42.388 40.873 1.514 25033
6717 1 19 . 1 1 31 31 PHE H H 31 6.594 6.594 7.549 -0.955 25033
6718 1 19 . 1 1 32 32 GLY N N 32 105.986 105.986 109.462 -3.476 25033
6719 1 19 . 1 1 32 32 GLY C C 32 170.292 170.292 172.075 -1.783 25033
6720 1 19 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.310 2.059 25033
6721 1 19 . 1 1 32 32 GLY H H 32 8.144 8.144 8.515 -0.371 25033
6722 1 19 . 1 1 33 33 PHE N N 33 115.319 115.319 116.351 -1.032 25033
6723 1 19 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.307 0.156 25033
6724 1 19 . 1 1 33 33 PHE C C 33 175.037 175.037 175.241 -0.204 25033
6725 1 19 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.607 -1.312 25033
6726 1 19 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.314 0.478 25033
6727 1 19 . 1 1 33 33 PHE H H 33 7.971 7.971 8.027 -0.056 25033
6728 1 19 . 1 1 34 34 ILE N N 34 122.140 122.140 122.200 -0.060 25033
6729 1 19 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.640 -0.323 25033
6730 1 19 . 1 1 34 34 ILE C C 34 174.526 174.526 175.068 -0.542 25033
6731 1 19 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.929 -0.132 25033
6732 1 19 . 1 1 34 34 ILE CB C 34 42.583 42.583 39.528 3.055 25033
6733 1 19 . 1 1 34 34 ILE H H 34 9.511 9.511 8.552 0.959 25033
6734 1 19 . 1 1 35 35 THR N N 35 126.580 126.580 122.716 3.864 25033
6735 1 19 . 1 1 35 35 THR HA H 35 5.143 5.143 4.787 0.356 25033
6736 1 19 . 1 1 35 35 THR CA C 35 59.330 59.330 57.691 1.639 25033
6737 1 19 . 1 1 35 35 THR CB C 35 70.258 70.258 69.127 1.131 25033
6738 1 19 . 1 1 35 35 THR H H 35 9.416 9.416 8.783 0.633 25033
6739 1 19 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.608 -0.009 25033
6740 1 19 . 1 1 36 36 PRO C C 36 177.390 177.390 177.416 -0.026 25033
6741 1 19 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.367 -0.147 25033
6742 1 19 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.161 0.309 25033
6743 1 19 . 1 1 37 37 GLY N N 37 112.033 112.033 110.374 1.659 25033
6744 1 19 . 1 1 37 37 GLY C C 37 169.261 169.261 174.870 -5.609 25033
6745 1 19 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.971 1.486 25033
6746 1 19 . 1 1 37 37 GLY H H 37 9.349 9.349 8.627 0.722 25033
6747 1 19 . 1 1 38 38 GLY N N 38 109.050 109.050 109.062 -0.012 25033
6748 1 19 . 1 1 38 38 GLY C C 38 175.177 175.177 174.537 0.640 25033
6749 1 19 . 1 1 38 38 GLY H H 38 8.756 8.756 7.902 0.854 25033
6750 1 19 . 1 1 39 39 GLY N N 39 107.730 107.730 109.227 -1.497 25033
6751 1 19 . 1 1 39 39 GLY C C 39 173.870 173.870 174.293 -0.423 25033
6752 1 19 . 1 1 39 39 GLY CA C 39 44.258 44.258 44.511 -0.253 25033
6753 1 19 . 1 1 39 39 GLY H H 39 7.725 7.725 8.088 -0.363 25033
6754 1 19 . 1 1 40 40 GLY N N 40 107.183 107.183 108.842 -1.659 25033
6755 1 19 . 1 1 40 40 GLY C C 40 173.067 173.067 173.887 -0.820 25033
6756 1 19 . 1 1 40 40 GLY CA C 40 43.760 43.760 43.894 -0.134 25033
6757 1 19 . 1 1 40 40 GLY H H 40 8.096 8.096 7.578 0.518 25033
6758 1 19 . 1 1 41 41 GLU N N 41 119.455 119.455 119.613 -0.158 25033
6759 1 19 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.189 -0.011 25033
6760 1 19 . 1 1 41 41 GLU C C 41 175.900 175.900 175.584 0.316 25033
6761 1 19 . 1 1 41 41 GLU CA C 41 56.377 56.377 56.160 0.217 25033
6762 1 19 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.063 0.537 25033
6763 1 19 . 1 1 41 41 GLU H H 41 8.199 8.199 8.484 -0.285 25033
6764 1 19 . 1 1 42 42 ASP N N 42 119.784 119.784 121.933 -2.149 25033
6765 1 19 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.000 -0.143 25033
6766 1 19 . 1 1 42 42 ASP C C 42 176.474 176.474 175.936 0.538 25033
6767 1 19 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.700 1.741 25033
6768 1 19 . 1 1 42 42 ASP CB C 42 41.488 41.488 42.189 -0.701 25033
6769 1 19 . 1 1 42 42 ASP H H 42 8.277 8.277 8.441 -0.164 25033
6770 1 19 . 1 1 43 43 LEU N N 43 122.515 122.515 117.309 5.206 25033
6771 1 19 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.901 -0.214 25033
6772 1 19 . 1 1 43 43 LEU C C 43 175.759 175.759 175.897 -0.138 25033
6773 1 19 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.640 -0.336 25033
6774 1 19 . 1 1 43 43 LEU CB C 43 45.449 45.449 44.274 1.175 25033
6775 1 19 . 1 1 43 43 LEU H H 43 9.423 9.423 8.112 1.311 25033
6776 1 19 . 1 1 44 44 PHE N N 44 125.962 125.962 118.608 7.354 25033
6777 1 19 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.374 -0.452 25033
6778 1 19 . 1 1 44 44 PHE C C 44 172.844 172.844 176.243 -3.399 25033
6779 1 19 . 1 1 44 44 PHE CA C 44 57.880 57.880 58.311 -0.431 25033
6780 1 19 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.644 0.706 25033
6781 1 19 . 1 1 44 44 PHE H H 44 8.465 8.465 8.438 0.028 25033
6782 1 19 . 1 1 45 45 VAL N N 45 123.552 123.552 123.398 0.154 25033
6783 1 19 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.509 0.148 25033
6784 1 19 . 1 1 45 45 VAL C C 45 177.433 177.433 173.534 3.899 25033
6785 1 19 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.739 -2.279 25033
6786 1 19 . 1 1 45 45 VAL CB C 45 34.884 34.884 36.132 -1.248 25033
6787 1 19 . 1 1 45 45 VAL H H 45 7.715 7.715 8.101 -0.386 25033
6788 1 19 . 1 1 46 46 HIS N N 46 127.300 127.300 124.085 3.215 25033
6789 1 19 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.990 -0.165 25033
6790 1 19 . 1 1 46 46 HIS C C 46 176.469 176.469 174.116 2.353 25033
6791 1 19 . 1 1 46 46 HIS CA C 46 55.929 55.929 53.143 2.786 25033
6792 1 19 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.284 3.115 25033
6793 1 19 . 1 1 46 46 HIS H H 46 9.104 9.104 8.288 0.816 25033
6794 1 19 . 1 1 47 47 GLN N N 47 125.105 125.105 124.604 0.501 25033
6795 1 19 . 1 1 47 47 GLN H H 47 8.352 8.352 8.790 -0.438 25033
6796 1 19 . 1 1 48 48 THR HA H 48 4.310 4.310 4.470 -0.160 25033
6797 1 19 . 1 1 48 48 THR C C 48 175.568 175.568 174.852 0.716 25033
6798 1 19 . 1 1 48 48 THR CA C 48 64.770 64.770 62.762 2.008 25033
6799 1 19 . 1 1 48 48 THR CB C 48 70.054 70.054 69.517 0.537 25033
6800 1 19 . 1 1 49 49 ASN N N 49 118.142 118.142 119.529 -1.387 25033
6801 1 19 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.952 0.208 25033
6802 1 19 . 1 1 49 49 ASN C C 49 172.914 172.914 173.788 -0.874 25033
6803 1 19 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.174 1.177 25033
6804 1 19 . 1 1 49 49 ASN CB C 49 40.527 40.527 40.231 0.296 25033
6805 1 19 . 1 1 49 49 ASN H H 49 8.452 8.452 8.408 0.044 25033
6806 1 19 . 1 1 50 50 ILE N N 50 119.226 119.226 121.803 -2.577 25033
6807 1 19 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.221 -0.109 25033
6808 1 19 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.831 0.775 25033
6809 1 19 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.958 1.404 25033
6810 1 19 . 1 1 50 50 ILE H H 50 7.354 7.354 8.038 -0.684 25033
6811 1 19 . 1 1 51 51 ASN N N 51 128.460 128.460 124.585 3.875 25033
6812 1 19 . 1 1 51 51 ASN C C 51 174.614 174.614 174.567 0.047 25033
6813 1 19 . 1 1 51 51 ASN H H 51 9.266 9.266 7.850 1.416 25033
6814 1 19 . 1 1 52 52 SER N N 52 117.246 117.246 115.079 2.167 25033
6815 1 19 . 1 1 52 52 SER HA H 52 4.413 4.413 4.719 -0.306 25033
6816 1 19 . 1 1 52 52 SER C C 52 174.139 174.139 175.056 -0.917 25033
6817 1 19 . 1 1 52 52 SER CA C 52 58.378 58.378 57.063 1.315 25033
6818 1 19 . 1 1 52 52 SER CB C 52 64.371 64.371 64.904 -0.533 25033
6819 1 19 . 1 1 52 52 SER H H 52 7.973 7.973 8.407 -0.434 25033
6820 1 19 . 1 1 53 53 GLU N N 53 123.628 123.628 121.456 2.172 25033
6821 1 19 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.332 -0.034 25033
6822 1 19 . 1 1 53 53 GLU C C 53 176.960 176.960 177.004 -0.044 25033
6823 1 19 . 1 1 53 53 GLU CA C 53 57.270 57.270 56.721 0.549 25033
6824 1 19 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.860 0.001 25033
6825 1 19 . 1 1 53 53 GLU H H 53 8.641 8.641 8.628 0.013 25033
6826 1 19 . 1 1 54 54 GLY N N 54 110.282 110.282 106.908 3.374 25033
6827 1 19 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.678 -0.078 25033
6828 1 19 . 1 1 54 54 GLY H H 54 8.225 8.225 7.392 0.833 25033
6829 1 19 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.645 0.175 25033
6830 1 19 . 1 1 55 55 PHE C C 55 175.836 175.836 175.856 -0.020 25033
6831 1 19 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.737 -5.047 25033
6832 1 19 . 1 1 55 55 PHE CB C 55 38.095 38.095 39.944 -1.849 25033
6833 1 19 . 1 1 56 56 ARG N N 56 120.907 120.907 124.584 -3.677 25033
6834 1 19 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.668 -0.404 25033
6835 1 19 . 1 1 56 56 ARG C C 56 175.618 175.618 175.407 0.211 25033
6836 1 19 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.596 -0.086 25033
6837 1 19 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.580 0.440 25033
6838 1 19 . 1 1 56 56 ARG H H 56 8.153 8.153 8.606 -0.453 25033
6839 1 19 . 1 1 57 57 SER N N 57 123.117 123.117 119.559 3.558 25033
6840 1 19 . 1 1 57 57 SER H H 57 7.834 7.834 8.501 -0.667 25033
6841 1 19 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.684 -0.404 25033
6842 1 19 . 1 1 58 58 LEU C C 58 174.842 174.842 176.304 -1.462 25033
6843 1 19 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.641 -0.881 25033
6844 1 19 . 1 1 58 58 LEU CB C 58 42.580 42.580 43.438 -0.858 25033
6845 1 19 . 1 1 59 59 ARG N N 59 119.557 119.557 122.019 -2.462 25033
6846 1 19 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.581 0.004 25033
6847 1 19 . 1 1 59 59 ARG C C 59 175.256 175.256 175.294 -0.038 25033
6848 1 19 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.410 -0.298 25033
6849 1 19 . 1 1 59 59 ARG CB C 59 32.970 32.970 33.451 -0.481 25033
6850 1 19 . 1 1 59 59 ARG H H 59 8.529 8.529 8.458 0.071 25033
6851 1 19 . 1 1 60 60 GLU N N 60 121.597 121.597 121.494 0.103 25033
6852 1 19 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.128 -0.547 25033
6853 1 19 . 1 1 60 60 GLU C C 60 177.281 177.281 176.913 0.368 25033
6854 1 19 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.489 0.812 25033
6855 1 19 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.916 -0.655 25033
6856 1 19 . 1 1 60 60 GLU H H 60 8.691 8.691 8.633 0.058 25033
6857 1 19 . 1 1 61 61 GLY N N 61 113.554 113.554 111.351 2.203 25033
6858 1 19 . 1 1 61 61 GLY C C 61 174.068 174.068 174.118 -0.050 25033
6859 1 19 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.747 0.496 25033
6860 1 19 . 1 1 61 61 GLY H H 61 9.151 9.151 8.642 0.509 25033
6861 1 19 . 1 1 62 62 GLU N N 62 121.639 121.639 122.612 -0.973 25033
6862 1 19 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.256 -0.052 25033
6863 1 19 . 1 1 62 62 GLU C C 62 175.439 175.439 176.074 -0.635 25033
6864 1 19 . 1 1 62 62 GLU CA C 62 57.342 57.342 57.020 0.321 25033
6865 1 19 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.740 0.185 25033
6866 1 19 . 1 1 62 62 GLU H H 62 7.889 7.889 7.755 0.134 25033
6867 1 19 . 1 1 63 63 VAL N N 63 125.003 125.003 125.706 -0.703 25033
6868 1 19 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.784 -0.036 25033
6869 1 19 . 1 1 63 63 VAL C C 63 176.639 176.639 175.524 1.115 25033
6870 1 19 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.732 0.899 25033
6871 1 19 . 1 1 63 63 VAL CB C 63 32.357 32.357 33.658 -1.302 25033
6872 1 19 . 1 1 63 63 VAL H H 63 8.477 8.477 8.309 0.168 25033
6873 1 19 . 1 1 64 64 VAL N N 64 120.113 120.113 121.878 -1.765 25033
6874 1 19 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.689 0.315 25033
6875 1 19 . 1 1 64 64 VAL C C 64 173.790 173.790 174.106 -0.316 25033
6876 1 19 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.004 -0.395 25033
6877 1 19 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.758 0.602 25033
6878 1 19 . 1 1 64 64 VAL H H 64 8.686 8.686 9.026 -0.340 25033
6879 1 19 . 1 1 65 65 GLU N N 65 120.433 120.433 120.970 -0.537 25033
6880 1 19 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.494 -0.047 25033
6881 1 19 . 1 1 65 65 GLU C C 65 175.584 175.584 175.466 0.118 25033
6882 1 19 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.486 -0.096 25033
6883 1 19 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.510 0.493 25033
6884 1 19 . 1 1 65 65 GLU H H 65 9.003 9.003 7.843 1.160 25033
6885 1 19 . 1 1 66 66 PHE N N 66 116.104 116.104 118.523 -2.419 25033
6886 1 19 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.127 -0.066 25033
6887 1 19 . 1 1 66 66 PHE C C 66 173.001 173.001 172.796 0.205 25033
6888 1 19 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.785 0.072 25033
6889 1 19 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.511 -0.080 25033
6890 1 19 . 1 1 66 66 PHE H H 66 8.172 8.172 7.994 0.178 25033
6891 1 19 . 1 1 67 67 GLU N N 67 117.574 117.574 117.704 -0.130 25033
6892 1 19 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.354 -0.482 25033
6893 1 19 . 1 1 67 67 GLU C C 67 175.327 175.327 175.941 -0.614 25033
6894 1 19 . 1 1 67 67 GLU CA C 67 54.641 54.641 53.722 0.919 25033
6895 1 19 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.471 -0.451 25033
6896 1 19 . 1 1 67 67 GLU H H 67 8.668 8.668 8.387 0.281 25033
6897 1 19 . 1 1 68 68 VAL N N 68 120.881 120.881 122.009 -1.128 25033
6898 1 19 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.321 0.691 25033
6899 1 19 . 1 1 68 68 VAL C C 68 176.140 176.140 175.826 0.314 25033
6900 1 19 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.549 -0.211 25033
6901 1 19 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.435 1.571 25033
6902 1 19 . 1 1 68 68 VAL H H 68 8.748 8.748 8.504 0.244 25033
6903 1 19 . 1 1 69 69 GLU N N 69 128.110 128.110 127.921 0.189 25033
6904 1 19 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.648 0.057 25033
6905 1 19 . 1 1 69 69 GLU C C 69 174.573 174.573 174.830 -0.257 25033
6906 1 19 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.422 0.531 25033
6907 1 19 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.646 0.644 25033
6908 1 19 . 1 1 69 69 GLU H H 69 9.070 9.070 8.945 0.125 25033
6909 1 19 . 1 1 70 70 ALA N N 70 127.944 127.944 129.328 -1.384 25033
6910 1 19 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.247 -0.243 25033
6911 1 19 . 1 1 70 70 ALA C C 70 178.073 178.073 177.585 0.488 25033
6912 1 19 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.916 0.043 25033
6913 1 19 . 1 1 70 70 ALA CB C 70 19.489 19.489 19.482 0.007 25033
6914 1 19 . 1 1 70 70 ALA H H 70 8.671 8.671 8.611 0.060 25033
6915 1 19 . 1 1 71 71 GLY N N 71 110.340 110.340 111.683 -1.343 25033
6916 1 19 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.851 0.165 25033
6917 1 19 . 1 1 71 71 GLY H H 71 8.445 8.445 7.952 0.493 25033
6918 1 19 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.395 0.022 25033
6919 1 19 . 1 1 72 72 PRO C C 72 176.835 176.835 176.550 0.285 25033
6920 1 19 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.010 0.150 25033
6921 1 19 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.791 0.089 25033
6922 1 19 . 1 1 73 73 ASP N N 73 116.498 116.498 116.671 -0.173 25033
6923 1 19 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.581 -0.066 25033
6924 1 19 . 1 1 73 73 ASP C C 73 176.775 176.775 177.182 -0.407 25033
6925 1 19 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.510 -0.963 25033
6926 1 19 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.812 -0.578 25033
6927 1 19 . 1 1 73 73 ASP H H 73 8.248 8.248 8.480 -0.232 25033
6928 1 19 . 1 1 74 74 GLY N N 74 107.369 107.369 108.624 -1.255 25033
6929 1 19 . 1 1 74 74 GLY C C 74 174.331 174.331 174.392 -0.061 25033
6930 1 19 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.842 0.736 25033
6931 1 19 . 1 1 74 74 GLY H H 74 8.153 8.153 7.711 0.442 25033
6932 1 19 . 1 1 75 75 ARG N N 75 120.942 120.942 121.058 -0.116 25033
6933 1 19 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.400 0.142 25033
6934 1 19 . 1 1 75 75 ARG C C 75 176.652 176.652 175.321 1.331 25033
6935 1 19 . 1 1 75 75 ARG CA C 75 55.658 55.658 56.206 -0.548 25033
6936 1 19 . 1 1 75 75 ARG CB C 75 30.909 30.909 30.767 0.142 25033
6937 1 19 . 1 1 75 75 ARG H H 75 7.670 7.670 8.287 -0.617 25033
6938 1 19 . 1 1 76 76 SER N N 76 120.181 120.181 115.956 4.225 25033
6939 1 19 . 1 1 76 76 SER HA H 76 5.035 5.035 5.424 -0.389 25033
6940 1 19 . 1 1 76 76 SER C C 76 172.816 172.816 174.533 -1.717 25033
6941 1 19 . 1 1 76 76 SER CA C 76 59.080 59.080 57.068 2.012 25033
6942 1 19 . 1 1 76 76 SER CB C 76 64.850 64.850 65.335 -0.485 25033
6943 1 19 . 1 1 76 76 SER H H 76 8.808 8.808 8.354 0.454 25033
6944 1 19 . 1 1 77 77 LYS N N 77 121.202 121.202 123.181 -1.979 25033
6945 1 19 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.746 0.428 25033
6946 1 19 . 1 1 77 77 LYS C C 77 173.706 173.706 174.713 -1.007 25033
6947 1 19 . 1 1 77 77 LYS CA C 77 54.599 54.599 55.171 -0.572 25033
6948 1 19 . 1 1 77 77 LYS CB C 77 36.035 36.035 37.410 -1.375 25033
6949 1 19 . 1 1 77 77 LYS H H 77 8.982 8.982 8.633 0.349 25033
6950 1 19 . 1 1 78 78 ALA N N 78 124.064 124.064 126.574 -2.510 25033
6951 1 19 . 1 1 78 78 ALA HA H 78 5.004 5.004 5.005 -0.001 25033
6952 1 19 . 1 1 78 78 ALA C C 78 175.979 175.979 176.026 -0.047 25033
6953 1 19 . 1 1 78 78 ALA CA C 78 50.445 50.445 51.048 -0.604 25033
6954 1 19 . 1 1 78 78 ALA CB C 78 20.136 20.136 20.210 -0.074 25033
6955 1 19 . 1 1 78 78 ALA H H 78 8.706 8.706 8.543 0.163 25033
6956 1 19 . 1 1 79 79 VAL N N 79 113.264 113.264 117.876 -4.612 25033
6957 1 19 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.406 0.437 25033
6958 1 19 . 1 1 79 79 VAL C C 79 174.744 174.744 174.612 0.132 25033
6959 1 19 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.821 -0.748 25033
6960 1 19 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.600 -0.004 25033
6961 1 19 . 1 1 79 79 VAL H H 79 9.165 9.165 7.660 1.506 25033
6962 1 19 . 1 1 80 80 ASN N N 80 120.084 120.084 115.570 4.514 25033
6963 1 19 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.322 0.034 25033
6964 1 19 . 1 1 80 80 ASN C C 80 175.391 175.391 173.930 1.461 25033
6965 1 19 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.658 0.076 25033
6966 1 19 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.977 0.143 25033
6967 1 19 . 1 1 80 80 ASN H H 80 8.923 8.923 8.584 0.339 25033
6968 1 19 . 1 1 81 81 VAL N N 81 119.178 119.178 118.670 0.508 25033
6969 1 19 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.712 0.035 25033
6970 1 19 . 1 1 81 81 VAL C C 81 176.340 176.340 176.316 0.024 25033
6971 1 19 . 1 1 81 81 VAL CA C 81 63.160 63.160 61.801 1.359 25033
6972 1 19 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.859 0.271 25033
6973 1 19 . 1 1 81 81 VAL H H 81 8.282 8.282 7.760 0.522 25033
6974 1 20 . 1 1 12 12 SER N N 12 116.112 116.112 114.706 1.406 25033
6975 1 20 . 1 1 12 12 SER C C 12 175.271 175.271 174.302 0.969 25033
6976 1 20 . 1 1 12 12 SER CA C 12 58.570 58.570 58.853 -0.283 25033
6977 1 20 . 1 1 12 12 SER CB C 12 63.984 63.984 64.135 -0.151 25033
6978 1 20 . 1 1 12 12 SER H H 12 8.422 8.422 8.425 -0.003 25033
6979 1 20 . 1 1 13 13 GLY N N 13 111.178 111.178 111.152 0.026 25033
6980 1 20 . 1 1 13 13 GLY C C 13 174.238 174.238 174.478 -0.240 25033
6981 1 20 . 1 1 13 13 GLY CA C 13 45.520 45.520 45.355 0.165 25033
6982 1 20 . 1 1 13 13 GLY H H 13 8.537 8.537 8.676 -0.139 25033
6983 1 20 . 1 1 14 14 GLU N N 14 120.547 120.547 119.923 0.624 25033
6984 1 20 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.332 -0.065 25033
6985 1 20 . 1 1 14 14 GLU C C 14 176.455 176.455 175.970 0.485 25033
6986 1 20 . 1 1 14 14 GLU CA C 14 56.753 56.753 56.024 0.729 25033
6987 1 20 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.650 0.814 25033
6988 1 20 . 1 1 14 14 GLU H H 14 8.285 8.285 8.319 -0.034 25033
6989 1 20 . 1 1 15 15 GLN N N 15 121.185 121.185 123.787 -2.602 25033
6990 1 20 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.394 -0.045 25033
6991 1 20 . 1 1 15 15 GLN C C 15 175.494 175.494 175.040 0.454 25033
6992 1 20 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.987 -0.317 25033
6993 1 20 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.206 0.204 25033
6994 1 20 . 1 1 15 15 GLN H H 15 8.444 8.444 8.474 -0.030 25033
6995 1 20 . 1 1 16 16 LEU N N 16 123.934 123.934 127.480 -3.546 25033
6996 1 20 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.583 -0.242 25033
6997 1 20 . 1 1 16 16 LEU C C 16 176.942 176.942 174.726 2.216 25033
6998 1 20 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.812 0.692 25033
6999 1 20 . 1 1 16 16 LEU CB C 16 42.519 42.519 44.396 -1.877 25033
7000 1 20 . 1 1 16 16 LEU H H 16 8.289 8.289 8.622 -0.333 25033
7001 1 20 . 1 1 17 17 ARG N N 17 122.044 122.044 121.795 0.249 25033
7002 1 20 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.630 -0.166 25033
7003 1 20 . 1 1 17 17 ARG C C 17 175.829 175.829 175.205 0.624 25033
7004 1 20 . 1 1 17 17 ARG CA C 17 55.672 55.672 54.950 0.722 25033
7005 1 20 . 1 1 17 17 ARG CB C 17 29.830 29.830 31.203 -1.373 25033
7006 1 20 . 1 1 17 17 ARG H H 17 8.216 8.216 8.366 -0.150 25033
7007 1 20 . 1 1 18 18 GLN N N 18 122.488 122.488 123.897 -1.409 25033
7008 1 20 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.463 -0.129 25033
7009 1 20 . 1 1 18 18 GLN C C 18 172.958 172.958 173.434 -0.476 25033
7010 1 20 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.569 0.331 25033
7011 1 20 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.194 0.425 25033
7012 1 20 . 1 1 18 18 GLN H H 18 8.573 8.573 8.132 0.441 25033
7013 1 20 . 1 1 19 19 GLN N N 19 116.301 116.301 119.369 -3.068 25033
7014 1 20 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.005 0.373 25033
7015 1 20 . 1 1 19 19 GLN C C 19 176.902 176.902 174.310 2.592 25033
7016 1 20 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.595 -0.380 25033
7017 1 20 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.290 1.348 25033
7018 1 20 . 1 1 19 19 GLN H H 19 8.146 8.146 8.469 -0.323 25033
7019 1 20 . 1 1 20 20 GLY N N 20 109.745 109.745 109.384 0.361 25033
7020 1 20 . 1 1 20 20 GLY C C 20 170.989 170.989 173.130 -2.141 25033
7021 1 20 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.466 1.469 25033
7022 1 20 . 1 1 20 20 GLY H H 20 8.998 8.998 8.136 0.862 25033
7023 1 20 . 1 1 21 21 THR N N 21 112.645 112.645 114.958 -2.313 25033
7024 1 20 . 1 1 21 21 THR HA H 21 5.361 5.361 4.930 0.431 25033
7025 1 20 . 1 1 21 21 THR C C 21 174.553 174.553 176.196 -1.643 25033
7026 1 20 . 1 1 21 21 THR CA C 21 60.025 60.025 60.689 -0.664 25033
7027 1 20 . 1 1 21 21 THR CB C 21 71.720 71.720 70.998 0.722 25033
7028 1 20 . 1 1 21 21 THR H H 21 8.312 8.312 8.047 0.265 25033
7029 1 20 . 1 1 22 22 VAL N N 22 125.915 125.915 122.222 3.693 25033
7030 1 20 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.748 -0.099 25033
7031 1 20 . 1 1 22 22 VAL C C 22 175.553 175.553 177.769 -2.216 25033
7032 1 20 . 1 1 22 22 VAL CA C 22 64.618 64.618 65.998 -1.380 25033
7033 1 20 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.563 0.058 25033
7034 1 20 . 1 1 22 22 VAL H H 22 9.092 9.092 8.144 0.948 25033
7035 1 20 . 1 1 23 23 LYS N N 23 135.790 135.790 119.045 16.745 25033
7036 1 20 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.025 0.276 25033
7037 1 20 . 1 1 23 23 LYS C C 23 176.301 176.301 176.439 -0.138 25033
7038 1 20 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.382 0.228 25033
7039 1 20 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.225 3.075 25033
7040 1 20 . 1 1 23 23 LYS H H 23 9.276 9.276 8.427 0.849 25033
7041 1 20 . 1 1 24 24 TRP N N 24 111.651 111.651 119.711 -8.060 25033
7042 1 20 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.831 -0.208 25033
7043 1 20 . 1 1 24 24 TRP C C 24 173.628 173.628 174.902 -1.274 25033
7044 1 20 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.681 0.619 25033
7045 1 20 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.699 1.561 25033
7046 1 20 . 1 1 24 24 TRP H H 24 7.455 7.455 7.552 -0.097 25033
7047 1 20 . 1 1 25 25 PHE N N 25 121.305 121.305 119.975 1.330 25033
7048 1 20 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.882 -0.597 25033
7049 1 20 . 1 1 25 25 PHE C C 25 172.354 172.354 174.442 -2.088 25033
7050 1 20 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.236 2.136 25033
7051 1 20 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.350 0.219 25033
7052 1 20 . 1 1 25 25 PHE H H 25 9.074 9.074 8.112 0.962 25033
7053 1 20 . 1 1 26 26 ASN N N 26 126.976 126.976 124.368 2.608 25033
7054 1 20 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.881 -0.069 25033
7055 1 20 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.272 -0.860 25033
7056 1 20 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.181 -0.095 25033
7057 1 20 . 1 1 26 26 ASN H H 26 8.159 8.159 8.170 -0.011 25033
7058 1 20 . 1 1 27 27 ALA N N 27 128.245 128.245 126.854 1.391 25033
7059 1 20 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.071 0.050 25033
7060 1 20 . 1 1 27 27 ALA C C 27 179.031 179.031 179.195 -0.164 25033
7061 1 20 . 1 1 27 27 ALA CA C 27 54.425 54.425 54.972 -0.547 25033
7062 1 20 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.719 -0.345 25033
7063 1 20 . 1 1 27 27 ALA H H 27 9.036 9.036 8.829 0.207 25033
7064 1 20 . 1 1 28 28 THR N N 28 113.994 113.994 113.968 0.026 25033
7065 1 20 . 1 1 28 28 THR HA H 28 4.068 4.068 3.984 0.084 25033
7066 1 20 . 1 1 28 28 THR C C 28 176.084 176.084 176.500 -0.416 25033
7067 1 20 . 1 1 28 28 THR CA C 28 65.820 65.820 65.071 0.749 25033
7068 1 20 . 1 1 28 28 THR CB C 28 68.291 68.291 68.462 -0.171 25033
7069 1 20 . 1 1 28 28 THR H H 28 8.065 8.065 8.133 -0.068 25033
7070 1 20 . 1 1 29 29 LYS N N 29 118.922 118.922 118.989 -0.067 25033
7071 1 20 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.253 0.003 25033
7072 1 20 . 1 1 29 29 LYS C C 29 177.201 177.201 177.784 -0.583 25033
7073 1 20 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.608 0.280 25033
7074 1 20 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.815 0.925 25033
7075 1 20 . 1 1 29 29 LYS H H 29 7.446 7.446 8.223 -0.777 25033
7076 1 20 . 1 1 30 30 GLY N N 30 107.601 107.601 106.614 0.987 25033
7077 1 20 . 1 1 30 30 GLY C C 30 172.004 172.004 172.730 -0.726 25033
7078 1 20 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.063 1.341 25033
7079 1 20 . 1 1 30 30 GLY H H 30 8.115 8.115 7.744 0.371 25033
7080 1 20 . 1 1 31 31 PHE N N 31 112.488 112.488 118.671 -6.183 25033
7081 1 20 . 1 1 31 31 PHE HA H 31 5.007 5.007 5.011 -0.004 25033
7082 1 20 . 1 1 31 31 PHE CA C 31 55.278 55.278 56.970 -1.692 25033
7083 1 20 . 1 1 31 31 PHE CB C 31 42.388 42.388 41.130 1.258 25033
7084 1 20 . 1 1 31 31 PHE H H 31 6.594 6.594 7.565 -0.971 25033
7085 1 20 . 1 1 32 32 GLY N N 32 105.986 105.986 109.317 -3.331 25033
7086 1 20 . 1 1 32 32 GLY C C 32 170.292 170.292 172.047 -1.755 25033
7087 1 20 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.255 2.114 25033
7088 1 20 . 1 1 32 32 GLY H H 32 8.144 8.144 8.118 0.026 25033
7089 1 20 . 1 1 33 33 PHE N N 33 115.319 115.319 116.174 -0.855 25033
7090 1 20 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.434 0.029 25033
7091 1 20 . 1 1 33 33 PHE C C 33 175.037 175.037 175.222 -0.185 25033
7092 1 20 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.522 -1.227 25033
7093 1 20 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.305 0.487 25033
7094 1 20 . 1 1 33 33 PHE H H 33 7.971 7.971 7.892 0.079 25033
7095 1 20 . 1 1 34 34 ILE N N 34 122.140 122.140 121.800 0.340 25033
7096 1 20 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.718 -0.401 25033
7097 1 20 . 1 1 34 34 ILE C C 34 174.526 174.526 175.345 -0.819 25033
7098 1 20 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.664 0.133 25033
7099 1 20 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.582 2.001 25033
7100 1 20 . 1 1 34 34 ILE H H 34 9.511 9.511 9.006 0.505 25033
7101 1 20 . 1 1 35 35 THR N N 35 126.580 126.580 118.681 7.899 25033
7102 1 20 . 1 1 35 35 THR HA H 35 5.143 5.143 4.950 0.193 25033
7103 1 20 . 1 1 35 35 THR CA C 35 59.330 59.330 58.852 0.478 25033
7104 1 20 . 1 1 35 35 THR CB C 35 70.258 70.258 68.560 1.698 25033
7105 1 20 . 1 1 35 35 THR H H 35 9.416 9.416 8.828 0.588 25033
7106 1 20 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.666 -0.067 25033
7107 1 20 . 1 1 36 36 PRO C C 36 177.390 177.390 177.707 -0.317 25033
7108 1 20 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.374 -0.154 25033
7109 1 20 . 1 1 36 36 PRO CB C 36 32.470 32.470 31.536 0.934 25033
7110 1 20 . 1 1 37 37 GLY N N 37 112.033 112.033 111.748 0.285 25033
7111 1 20 . 1 1 37 37 GLY C C 37 169.261 169.261 174.873 -5.612 25033
7112 1 20 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.835 1.622 25033
7113 1 20 . 1 1 37 37 GLY H H 37 9.349 9.349 8.601 0.748 25033
7114 1 20 . 1 1 38 38 GLY N N 38 109.050 109.050 110.052 -1.002 25033
7115 1 20 . 1 1 38 38 GLY C C 38 175.177 175.177 174.154 1.023 25033
7116 1 20 . 1 1 38 38 GLY H H 38 8.756 8.756 8.043 0.713 25033
7117 1 20 . 1 1 39 39 GLY N N 39 107.730 107.730 108.025 -0.295 25033
7118 1 20 . 1 1 39 39 GLY C C 39 173.870 173.870 173.518 0.352 25033
7119 1 20 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.177 -0.919 25033
7120 1 20 . 1 1 39 39 GLY H H 39 7.725 7.725 7.757 -0.032 25033
7121 1 20 . 1 1 40 40 GLY N N 40 107.183 107.183 111.270 -4.087 25033
7122 1 20 . 1 1 40 40 GLY C C 40 173.067 173.067 173.800 -0.733 25033
7123 1 20 . 1 1 40 40 GLY CA C 40 43.760 43.760 46.087 -2.327 25033
7124 1 20 . 1 1 40 40 GLY H H 40 8.096 8.096 8.503 -0.407 25033
7125 1 20 . 1 1 41 41 GLU N N 41 119.455 119.455 122.260 -2.805 25033
7126 1 20 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.566 -0.388 25033
7127 1 20 . 1 1 41 41 GLU C C 41 175.900 175.900 175.068 0.832 25033
7128 1 20 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.235 1.142 25033
7129 1 20 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.559 0.041 25033
7130 1 20 . 1 1 41 41 GLU H H 41 8.199 8.199 8.499 -0.300 25033
7131 1 20 . 1 1 42 42 ASP N N 42 119.784 119.784 124.499 -4.715 25033
7132 1 20 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.119 -0.262 25033
7133 1 20 . 1 1 42 42 ASP C C 42 176.474 176.474 176.140 0.334 25033
7134 1 20 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.530 1.911 25033
7135 1 20 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.379 0.109 25033
7136 1 20 . 1 1 42 42 ASP H H 42 8.277 8.277 8.453 -0.176 25033
7137 1 20 . 1 1 43 43 LEU N N 43 122.515 122.515 120.000 2.515 25033
7138 1 20 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.993 -0.306 25033
7139 1 20 . 1 1 43 43 LEU C C 43 175.759 175.759 175.996 -0.237 25033
7140 1 20 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.464 -0.160 25033
7141 1 20 . 1 1 43 43 LEU CB C 43 45.449 45.449 44.375 1.074 25033
7142 1 20 . 1 1 43 43 LEU H H 43 9.423 9.423 8.130 1.293 25033
7143 1 20 . 1 1 44 44 PHE N N 44 125.962 125.962 118.859 7.103 25033
7144 1 20 . 1 1 44 44 PHE HA H 44 3.922 3.922 5.156 -1.234 25033
7145 1 20 . 1 1 44 44 PHE C C 44 172.844 172.844 174.832 -1.988 25033
7146 1 20 . 1 1 44 44 PHE CA C 44 57.880 57.880 55.963 1.917 25033
7147 1 20 . 1 1 44 44 PHE CB C 44 40.350 40.350 40.085 0.265 25033
7148 1 20 . 1 1 44 44 PHE H H 44 8.465 8.465 8.113 0.352 25033
7149 1 20 . 1 1 45 45 VAL N N 45 123.552 123.552 122.707 0.845 25033
7150 1 20 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.413 0.244 25033
7151 1 20 . 1 1 45 45 VAL C C 45 177.433 177.433 173.571 3.862 25033
7152 1 20 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.772 -2.312 25033
7153 1 20 . 1 1 45 45 VAL CB C 45 34.884 34.884 36.160 -1.276 25033
7154 1 20 . 1 1 45 45 VAL H H 45 7.715 7.715 8.094 -0.379 25033
7155 1 20 . 1 1 46 46 HIS N N 46 127.300 127.300 125.868 1.432 25033
7156 1 20 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.835 -0.010 25033
7157 1 20 . 1 1 46 46 HIS C C 46 176.469 176.469 174.597 1.872 25033
7158 1 20 . 1 1 46 46 HIS CA C 46 55.929 55.929 54.239 1.690 25033
7159 1 20 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.702 2.697 25033
7160 1 20 . 1 1 46 46 HIS H H 46 9.104 9.104 8.639 0.465 25033
7161 1 20 . 1 1 47 47 GLN N N 47 125.105 125.105 125.684 -0.579 25033
7162 1 20 . 1 1 47 47 GLN H H 47 8.352 8.352 8.489 -0.138 25033
7163 1 20 . 1 1 48 48 THR HA H 48 4.310 4.310 4.379 -0.069 25033
7164 1 20 . 1 1 48 48 THR C C 48 175.568 175.568 174.907 0.661 25033
7165 1 20 . 1 1 48 48 THR CA C 48 64.770 64.770 62.887 1.883 25033
7166 1 20 . 1 1 48 48 THR CB C 48 70.054 70.054 69.691 0.363 25033
7167 1 20 . 1 1 49 49 ASN N N 49 118.142 118.142 119.283 -1.141 25033
7168 1 20 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.893 0.267 25033
7169 1 20 . 1 1 49 49 ASN C C 49 172.914 172.914 173.796 -0.882 25033
7170 1 20 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.231 1.120 25033
7171 1 20 . 1 1 49 49 ASN CB C 49 40.527 40.527 40.197 0.330 25033
7172 1 20 . 1 1 49 49 ASN H H 49 8.452 8.452 8.394 0.058 25033
7173 1 20 . 1 1 50 50 ILE N N 50 119.226 119.226 122.485 -3.259 25033
7174 1 20 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.116 -0.004 25033
7175 1 20 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.622 0.984 25033
7176 1 20 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.775 1.587 25033
7177 1 20 . 1 1 50 50 ILE H H 50 7.354 7.354 7.892 -0.538 25033
7178 1 20 . 1 1 51 51 ASN N N 51 128.460 128.460 123.208 5.252 25033
7179 1 20 . 1 1 51 51 ASN C C 51 174.614 174.614 173.859 0.755 25033
7180 1 20 . 1 1 51 51 ASN H H 51 9.266 9.266 7.962 1.304 25033
7181 1 20 . 1 1 52 52 SER N N 52 117.246 117.246 116.762 0.484 25033
7182 1 20 . 1 1 52 52 SER HA H 52 4.413 4.413 4.788 -0.375 25033
7183 1 20 . 1 1 52 52 SER C C 52 174.139 174.139 174.437 -0.298 25033
7184 1 20 . 1 1 52 52 SER CA C 52 58.378 58.378 57.074 1.304 25033
7185 1 20 . 1 1 52 52 SER CB C 52 64.371 64.371 65.018 -0.647 25033
7186 1 20 . 1 1 52 52 SER H H 52 7.973 7.973 8.291 -0.318 25033
7187 1 20 . 1 1 53 53 GLU N N 53 123.628 123.628 121.401 2.227 25033
7188 1 20 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.262 0.036 25033
7189 1 20 . 1 1 53 53 GLU C C 53 176.960 176.960 176.895 0.065 25033
7190 1 20 . 1 1 53 53 GLU CA C 53 57.270 57.270 57.200 0.070 25033
7191 1 20 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.998 -0.137 25033
7192 1 20 . 1 1 53 53 GLU H H 53 8.641 8.641 8.576 0.065 25033
7193 1 20 . 1 1 54 54 GLY N N 54 110.282 110.282 108.612 1.670 25033
7194 1 20 . 1 1 54 54 GLY CA C 54 44.600 44.600 45.104 -0.504 25033
7195 1 20 . 1 1 54 54 GLY H H 54 8.225 8.225 8.104 0.121 25033
7196 1 20 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.746 0.074 25033
7197 1 20 . 1 1 55 55 PHE C C 55 175.836 175.836 174.563 1.273 25033
7198 1 20 . 1 1 55 55 PHE CA C 55 52.690 52.690 55.540 -2.850 25033
7199 1 20 . 1 1 55 55 PHE CB C 55 38.095 38.095 40.336 -2.241 25033
7200 1 20 . 1 1 56 56 ARG N N 56 120.907 120.907 122.512 -1.605 25033
7201 1 20 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.555 -0.291 25033
7202 1 20 . 1 1 56 56 ARG C C 56 175.618 175.618 175.992 -0.374 25033
7203 1 20 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.598 -0.088 25033
7204 1 20 . 1 1 56 56 ARG CB C 56 32.020 32.020 30.515 1.504 25033
7205 1 20 . 1 1 56 56 ARG H H 56 8.153 8.153 8.708 -0.555 25033
7206 1 20 . 1 1 57 57 SER N N 57 123.117 123.117 121.117 2.000 25033
7207 1 20 . 1 1 57 57 SER H H 57 7.834 7.834 8.596 -0.762 25033
7208 1 20 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.859 -0.579 25033
7209 1 20 . 1 1 58 58 LEU C C 58 174.842 174.842 176.447 -1.605 25033
7210 1 20 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.668 -0.908 25033
7211 1 20 . 1 1 58 58 LEU CB C 58 42.580 42.580 45.283 -2.703 25033
7212 1 20 . 1 1 59 59 ARG N N 59 119.557 119.557 120.958 -1.401 25033
7213 1 20 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.634 -0.049 25033
7214 1 20 . 1 1 59 59 ARG C C 59 175.256 175.256 174.893 0.363 25033
7215 1 20 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.580 -0.468 25033
7216 1 20 . 1 1 59 59 ARG CB C 59 32.970 32.970 33.977 -1.007 25033
7217 1 20 . 1 1 59 59 ARG H H 59 8.529 8.529 8.771 -0.242 25033
7218 1 20 . 1 1 60 60 GLU N N 60 121.597 121.597 121.040 0.557 25033
7219 1 20 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.116 -0.535 25033
7220 1 20 . 1 1 60 60 GLU C C 60 177.281 177.281 176.667 0.614 25033
7221 1 20 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.478 0.823 25033
7222 1 20 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.852 -0.591 25033
7223 1 20 . 1 1 60 60 GLU H H 60 8.691 8.691 8.595 0.096 25033
7224 1 20 . 1 1 61 61 GLY N N 61 113.554 113.554 111.797 1.757 25033
7225 1 20 . 1 1 61 61 GLY C C 61 174.068 174.068 173.936 0.132 25033
7226 1 20 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.838 0.405 25033
7227 1 20 . 1 1 61 61 GLY H H 61 9.151 9.151 8.644 0.507 25033
7228 1 20 . 1 1 62 62 GLU N N 62 121.639 121.639 122.573 -0.934 25033
7229 1 20 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.308 -0.104 25033
7230 1 20 . 1 1 62 62 GLU C C 62 175.439 175.439 176.181 -0.742 25033
7231 1 20 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.339 1.004 25033
7232 1 20 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.460 0.464 25033
7233 1 20 . 1 1 62 62 GLU H H 62 7.889 7.889 7.701 0.188 25033
7234 1 20 . 1 1 63 63 VAL N N 63 125.003 125.003 125.749 -0.746 25033
7235 1 20 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.551 0.197 25033
7236 1 20 . 1 1 63 63 VAL C C 63 176.639 176.639 175.900 0.739 25033
7237 1 20 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.626 1.005 25033
7238 1 20 . 1 1 63 63 VAL CB C 63 32.357 32.357 33.048 -0.691 25033
7239 1 20 . 1 1 63 63 VAL H H 63 8.477 8.477 8.393 0.084 25033
7240 1 20 . 1 1 64 64 VAL N N 64 120.113 120.113 121.996 -1.883 25033
7241 1 20 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.705 0.299 25033
7242 1 20 . 1 1 64 64 VAL C C 64 173.790 173.790 173.960 -0.170 25033
7243 1 20 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.817 -1.208 25033
7244 1 20 . 1 1 64 64 VAL CB C 64 36.360 36.360 34.594 1.766 25033
7245 1 20 . 1 1 64 64 VAL H H 64 8.686 8.686 8.843 -0.157 25033
7246 1 20 . 1 1 65 65 GLU N N 65 120.433 120.433 120.217 0.216 25033
7247 1 20 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.279 0.168 25033
7248 1 20 . 1 1 65 65 GLU C C 65 175.584 175.584 175.121 0.463 25033
7249 1 20 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.918 -0.528 25033
7250 1 20 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.127 0.876 25033
7251 1 20 . 1 1 65 65 GLU H H 65 9.003 9.003 8.461 0.542 25033
7252 1 20 . 1 1 66 66 PHE N N 66 116.104 116.104 119.647 -3.543 25033
7253 1 20 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.071 -0.010 25033
7254 1 20 . 1 1 66 66 PHE C C 66 173.001 173.001 172.780 0.221 25033
7255 1 20 . 1 1 66 66 PHE CA C 66 56.857 56.857 57.001 -0.144 25033
7256 1 20 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.419 0.013 25033
7257 1 20 . 1 1 66 66 PHE H H 66 8.172 8.172 7.781 0.391 25033
7258 1 20 . 1 1 67 67 GLU N N 67 117.574 117.574 118.184 -0.610 25033
7259 1 20 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.314 -0.442 25033
7260 1 20 . 1 1 67 67 GLU C C 67 175.327 175.327 176.062 -0.735 25033
7261 1 20 . 1 1 67 67 GLU CA C 67 54.641 54.641 53.826 0.815 25033
7262 1 20 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.171 -0.151 25033
7263 1 20 . 1 1 67 67 GLU H H 67 8.668 8.668 8.513 0.155 25033
7264 1 20 . 1 1 68 68 VAL N N 68 120.881 120.881 123.154 -2.273 25033
7265 1 20 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.365 0.647 25033
7266 1 20 . 1 1 68 68 VAL C C 68 176.140 176.140 175.902 0.238 25033
7267 1 20 . 1 1 68 68 VAL CA C 68 62.338 62.338 63.469 -1.131 25033
7268 1 20 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.158 1.848 25033
7269 1 20 . 1 1 68 68 VAL H H 68 8.748 8.748 8.260 0.488 25033
7270 1 20 . 1 1 69 69 GLU N N 69 128.110 128.110 129.044 -0.934 25033
7271 1 20 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.692 0.013 25033
7272 1 20 . 1 1 69 69 GLU C C 69 174.573 174.573 174.871 -0.298 25033
7273 1 20 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.433 0.520 25033
7274 1 20 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.771 0.519 25033
7275 1 20 . 1 1 69 69 GLU H H 69 9.070 9.070 8.992 0.078 25033
7276 1 20 . 1 1 70 70 ALA N N 70 127.944 127.944 128.156 -0.212 25033
7277 1 20 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.067 -0.063 25033
7278 1 20 . 1 1 70 70 ALA C C 70 178.073 178.073 177.283 0.790 25033
7279 1 20 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.949 0.010 25033
7280 1 20 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.099 -0.610 25033
7281 1 20 . 1 1 70 70 ALA H H 70 8.671 8.671 8.569 0.102 25033
7282 1 20 . 1 1 71 71 GLY N N 71 110.340 110.340 111.552 -1.212 25033
7283 1 20 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.717 0.299 25033
7284 1 20 . 1 1 71 71 GLY H H 71 8.445 8.445 8.143 0.302 25033
7285 1 20 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.359 0.058 25033
7286 1 20 . 1 1 72 72 PRO C C 72 176.835 176.835 176.993 -0.158 25033
7287 1 20 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.693 -0.533 25033
7288 1 20 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.657 0.223 25033
7289 1 20 . 1 1 73 73 ASP N N 73 116.498 116.498 117.857 -1.359 25033
7290 1 20 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.525 -0.010 25033
7291 1 20 . 1 1 73 73 ASP C C 73 176.775 176.775 177.283 -0.508 25033
7292 1 20 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.169 -0.622 25033
7293 1 20 . 1 1 73 73 ASP CB C 73 40.234 40.234 41.054 -0.820 25033
7294 1 20 . 1 1 73 73 ASP H H 73 8.248 8.248 8.125 0.123 25033
7295 1 20 . 1 1 74 74 GLY N N 74 107.369 107.369 107.693 -0.324 25033
7296 1 20 . 1 1 74 74 GLY C C 74 174.331 174.331 173.543 0.788 25033
7297 1 20 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.942 0.636 25033
7298 1 20 . 1 1 74 74 GLY H H 74 8.153 8.153 7.661 0.492 25033
7299 1 20 . 1 1 75 75 ARG N N 75 120.942 120.942 119.684 1.258 25033
7300 1 20 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.565 -0.023 25033
7301 1 20 . 1 1 75 75 ARG C C 75 176.652 176.652 175.321 1.331 25033
7302 1 20 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.380 0.278 25033
7303 1 20 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.307 -0.398 25033
7304 1 20 . 1 1 75 75 ARG H H 75 7.670 7.670 8.018 -0.348 25033
7305 1 20 . 1 1 76 76 SER N N 76 120.181 120.181 117.083 3.098 25033
7306 1 20 . 1 1 76 76 SER HA H 76 5.035 5.035 5.283 -0.248 25033
7307 1 20 . 1 1 76 76 SER C C 76 172.816 172.816 174.309 -1.493 25033
7308 1 20 . 1 1 76 76 SER CA C 76 59.080 59.080 57.038 2.042 25033
7309 1 20 . 1 1 76 76 SER CB C 76 64.850 64.850 64.871 -0.021 25033
7310 1 20 . 1 1 76 76 SER H H 76 8.808 8.808 8.392 0.416 25033
7311 1 20 . 1 1 77 77 LYS N N 77 121.202 121.202 121.588 -0.386 25033
7312 1 20 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.678 0.496 25033
7313 1 20 . 1 1 77 77 LYS C C 77 173.706 173.706 174.083 -0.377 25033
7314 1 20 . 1 1 77 77 LYS CA C 77 54.599 54.599 55.229 -0.630 25033
7315 1 20 . 1 1 77 77 LYS CB C 77 36.035 36.035 37.258 -1.222 25033
7316 1 20 . 1 1 77 77 LYS H H 77 8.982 8.982 8.922 0.060 25033
7317 1 20 . 1 1 78 78 ALA N N 78 124.064 124.064 123.974 0.090 25033
7318 1 20 . 1 1 78 78 ALA HA H 78 5.004 5.004 5.031 -0.027 25033
7319 1 20 . 1 1 78 78 ALA C C 78 175.979 175.979 176.077 -0.098 25033
7320 1 20 . 1 1 78 78 ALA CA C 78 50.445 50.445 50.669 -0.224 25033
7321 1 20 . 1 1 78 78 ALA CB C 78 20.136 20.136 20.295 -0.159 25033
7322 1 20 . 1 1 78 78 ALA H H 78 8.706 8.706 8.502 0.204 25033
7323 1 20 . 1 1 79 79 VAL N N 79 113.264 113.264 118.333 -5.069 25033
7324 1 20 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.467 0.376 25033
7325 1 20 . 1 1 79 79 VAL C C 79 174.744 174.744 174.638 0.106 25033
7326 1 20 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.865 -0.792 25033
7327 1 20 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.621 -0.025 25033
7328 1 20 . 1 1 79 79 VAL H H 79 9.165 9.165 7.655 1.510 25033
7329 1 20 . 1 1 80 80 ASN N N 80 120.084 120.084 114.572 5.512 25033
7330 1 20 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.346 0.010 25033
7331 1 20 . 1 1 80 80 ASN C C 80 175.391 175.391 173.869 1.522 25033
7332 1 20 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.610 0.124 25033
7333 1 20 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.680 0.441 25033
7334 1 20 . 1 1 80 80 ASN H H 80 8.923 8.923 8.618 0.305 25033
7335 1 20 . 1 1 81 81 VAL N N 81 119.178 119.178 118.634 0.544 25033
7336 1 20 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.480 0.267 25033
7337 1 20 . 1 1 81 81 VAL C C 81 176.340 176.340 176.575 -0.235 25033
7338 1 20 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.051 1.109 25033
7339 1 20 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.164 0.966 25033
7340 1 20 . 1 1 81 81 VAL H H 81 8.282 8.282 7.764 0.518 25033
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 65 3.353 -0.055 3.378 25033
2 1 1 "Average Difference" HA 76 0.386 0.003 0.389 25033
3 1 1 "Average Difference" C 62 1.292 0.032 1.302 25033
4 1 1 "Average Difference" CA 66 1.186 -0.217 1.175 25033
5 1 1 "Average Difference" CB 55 1.055 -0.325 1.014 25033
6 1 1 "Average Difference" HN 65 0.502 -0.181 0.472 25033
7 1 2 "Average Difference" N 65 3.515 -0.514 3.504 25033
8 1 2 "Average Difference" HA 76 0.375 -0.014 0.378 25033
9 1 2 "Average Difference" C 62 1.281 0.186 1.278 25033
10 1 2 "Average Difference" CA 66 1.186 -0.190 1.180 25033
11 1 2 "Average Difference" CB 55 1.184 -0.311 1.153 25033
12 1 2 "Average Difference" HN 65 0.515 -0.184 0.485 25033
13 1 3 "Average Difference" N 65 3.265 -0.187 3.285 25033
14 1 3 "Average Difference" HA 76 0.358 0.005 0.360 25033
15 1 3 "Average Difference" C 62 1.341 0.134 1.345 25033
16 1 3 "Average Difference" CA 66 1.159 -0.253 1.140 25033
17 1 3 "Average Difference" CB 55 1.075 -0.244 1.057 25033
18 1 3 "Average Difference" HN 65 0.506 -0.192 0.472 25033
19 1 4 "Average Difference" N 65 3.349 -0.227 3.367 25033
20 1 4 "Average Difference" HA 76 0.354 0.020 0.356 25033
21 1 4 "Average Difference" C 62 1.338 0.150 1.340 25033
22 1 4 "Average Difference" CA 66 1.148 -0.274 1.124 25033
23 1 4 "Average Difference" CB 55 1.067 -0.353 1.016 25033
24 1 4 "Average Difference" HN 65 0.565 -0.186 0.538 25033
25 1 5 "Average Difference" N 65 3.228 -0.205 3.247 25033
26 1 5 "Average Difference" HA 76 0.322 -0.033 0.323 25033
27 1 5 "Average Difference" C 62 1.359 0.163 1.360 25033
28 1 5 "Average Difference" CA 66 1.089 -0.070 1.095 25033
29 1 5 "Average Difference" CB 55 1.279 -0.357 1.240 25033
30 1 5 "Average Difference" HN 65 0.524 -0.177 0.497 25033
31 1 6 "Average Difference" N 65 3.501 0.036 3.528 25033
32 1 6 "Average Difference" HA 76 0.351 0.001 0.353 25033
33 1 6 "Average Difference" C 62 1.357 0.191 1.355 25033
34 1 6 "Average Difference" CA 66 1.279 -0.220 1.269 25033
35 1 6 "Average Difference" CB 55 1.062 -0.444 0.974 25033
36 1 6 "Average Difference" HN 65 0.523 -0.176 0.497 25033
37 1 7 "Average Difference" N 65 3.411 -0.033 3.438 25033
38 1 7 "Average Difference" HA 76 0.346 0.007 0.348 25033
39 1 7 "Average Difference" C 62 1.340 0.157 1.342 25033
40 1 7 "Average Difference" CA 66 1.157 -0.178 1.152 25033
41 1 7 "Average Difference" CB 55 1.216 -0.329 1.181 25033
42 1 7 "Average Difference" HN 65 0.597 -0.144 0.584 25033
43 1 8 "Average Difference" N 65 3.198 -0.161 3.219 25033
44 1 8 "Average Difference" HA 76 0.357 -0.010 0.359 25033
45 1 8 "Average Difference" C 62 1.316 0.127 1.321 25033
46 1 8 "Average Difference" CA 66 1.259 -0.227 1.248 25033
47 1 8 "Average Difference" CB 55 1.118 -0.374 1.063 25033
48 1 8 "Average Difference" HN 65 0.550 -0.182 0.523 25033
49 1 9 "Average Difference" N 65 3.477 -0.084 3.503 25033
50 1 9 "Average Difference" HA 76 0.365 0.009 0.367 25033
51 1 9 "Average Difference" C 62 1.302 0.040 1.312 25033
52 1 9 "Average Difference" CA 66 1.170 -0.298 1.140 25033
53 1 9 "Average Difference" CB 55 1.183 -0.330 1.147 25033
54 1 9 "Average Difference" HN 65 0.618 -0.146 0.605 25033
55 1 10 "Average Difference" N 65 3.270 -0.274 3.284 25033
56 1 10 "Average Difference" HA 76 0.369 0.014 0.372 25033
57 1 10 "Average Difference" C 62 1.340 0.093 1.348 25033
58 1 10 "Average Difference" CA 66 1.205 -0.159 1.204 25033
59 1 10 "Average Difference" CB 55 1.107 -0.234 1.092 25033
60 1 10 "Average Difference" HN 65 0.561 -0.147 0.546 25033
61 1 11 "Average Difference" N 65 3.269 -0.280 3.282 25033
62 1 11 "Average Difference" HA 76 0.361 -0.001 0.364 25033
63 1 11 "Average Difference" C 62 1.266 0.177 1.264 25033
64 1 11 "Average Difference" CA 66 1.165 -0.256 1.146 25033
65 1 11 "Average Difference" CB 55 1.179 -0.331 1.142 25033
66 1 11 "Average Difference" HN 65 0.497 -0.196 0.460 25033
67 1 12 "Average Difference" N 65 3.288 -0.184 3.308 25033
68 1 12 "Average Difference" HA 76 0.365 -0.020 0.367 25033
69 1 12 "Average Difference" C 62 1.272 0.088 1.279 25033
70 1 12 "Average Difference" CA 66 1.248 -0.169 1.247 25033
71 1 12 "Average Difference" CB 55 1.115 -0.255 1.095 25033
72 1 12 "Average Difference" HN 65 0.531 -0.175 0.505 25033
73 1 13 "Average Difference" N 65 3.243 -0.373 3.246 25033
74 1 13 "Average Difference" HA 76 0.384 0.001 0.387 25033
75 1 13 "Average Difference" C 62 1.281 0.122 1.286 25033
76 1 13 "Average Difference" CA 66 1.091 -0.207 1.080 25033
77 1 13 "Average Difference" CB 55 1.135 -0.313 1.101 25033
78 1 13 "Average Difference" HN 65 0.504 -0.163 0.480 25033
79 1 14 "Average Difference" N 65 3.218 -0.045 3.243 25033
80 1 14 "Average Difference" HA 76 0.382 0.012 0.384 25033
81 1 14 "Average Difference" C 62 1.275 0.142 1.277 25033
82 1 14 "Average Difference" CA 66 1.205 -0.325 1.169 25033
83 1 14 "Average Difference" CB 55 1.183 -0.299 1.155 25033
84 1 14 "Average Difference" HN 65 0.508 -0.173 0.481 25033
85 1 15 "Average Difference" N 65 3.475 -0.168 3.498 25033
86 1 15 "Average Difference" HA 76 0.395 -0.032 0.397 25033
87 1 15 "Average Difference" C 62 1.347 0.088 1.355 25033
88 1 15 "Average Difference" CA 66 1.125 -0.219 1.112 25033
89 1 15 "Average Difference" CB 55 1.114 -0.323 1.075 25033
90 1 15 "Average Difference" HN 65 0.568 -0.128 0.558 25033
91 1 16 "Average Difference" N 65 3.441 -0.165 3.464 25033
92 1 16 "Average Difference" HA 76 0.384 -0.007 0.387 25033
93 1 16 "Average Difference" C 62 1.239 0.157 1.239 25033
94 1 16 "Average Difference" CA 66 1.175 -0.129 1.177 25033
95 1 16 "Average Difference" CB 55 1.079 -0.389 1.015 25033
96 1 16 "Average Difference" HN 65 0.516 -0.165 0.493 25033
97 1 17 "Average Difference" N 65 3.303 -0.473 3.295 25033
98 1 17 "Average Difference" HA 76 0.354 0.007 0.356 25033
99 1 17 "Average Difference" C 62 1.299 0.127 1.303 25033
100 1 17 "Average Difference" CA 66 1.126 -0.213 1.115 25033
101 1 17 "Average Difference" CB 55 1.166 -0.296 1.138 25033
102 1 17 "Average Difference" HN 65 0.543 -0.156 0.524 25033
103 1 18 "Average Difference" N 65 3.192 -0.001 3.217 25033
104 1 18 "Average Difference" HA 76 0.382 -0.000 0.384 25033
105 1 18 "Average Difference" C 62 1.320 0.160 1.321 25033
106 1 18 "Average Difference" CA 66 1.133 -0.152 1.132 25033
107 1 18 "Average Difference" CB 55 1.089 -0.237 1.073 25033
108 1 18 "Average Difference" HN 65 0.590 -0.163 0.571 25033
109 1 19 "Average Difference" N 65 3.457 -0.067 3.483 25033
110 1 19 "Average Difference" HA 76 0.345 0.014 0.347 25033
111 1 19 "Average Difference" C 62 1.321 0.186 1.319 25033
112 1 19 "Average Difference" CA 66 1.206 -0.207 1.198 25033
113 1 19 "Average Difference" CB 55 1.071 -0.246 1.052 25033
114 1 19 "Average Difference" HN 65 0.576 -0.174 0.553 25033
115 1 20 "Average Difference" N 65 3.473 -0.042 3.500 25033
116 1 20 "Average Difference" HA 76 0.376 0.016 0.378 25033
117 1 20 "Average Difference" C 62 1.333 0.098 1.340 25033
118 1 20 "Average Difference" CA 66 1.110 -0.167 1.106 25033
119 1 20 "Average Difference" CB 55 1.149 -0.257 1.131 25033
120 1 20 "Average Difference" HN 65 0.513 -0.161 0.491 25033
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 25033
_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 12 12 SER N N 12 116.112 116.112 115.586 0.526 25033
2 1 . 1 1 12 12 SER C C 12 175.271 175.271 175.176 0.095 25033
3 1 . 1 1 12 12 SER CA C 12 58.570 58.570 58.702 -0.132 25033
4 1 . 1 1 12 12 SER CB C 12 63.984 63.984 64.074 -0.090 25033
5 1 . 1 1 12 12 SER H H 12 8.422 8.422 8.831 -0.409 25033
6 1 . 1 1 13 13 GLY N N 13 111.178 111.178 110.971 0.207 25033
7 1 . 1 1 13 13 GLY C C 13 174.238 174.238 174.191 0.047 25033
8 1 . 1 1 13 13 GLY CA C 13 45.520 45.520 44.979 0.541 25033
9 1 . 1 1 13 13 GLY H H 13 8.537 8.537 8.445 0.091 25033
10 1 . 1 1 14 14 GLU N N 14 120.547 120.547 120.874 -0.327 25033
11 1 . 1 1 14 14 GLU HA H 14 4.267 4.267 4.421 -0.154 25033
12 1 . 1 1 14 14 GLU C C 14 176.455 176.455 175.809 0.646 25033
13 1 . 1 1 14 14 GLU CA C 14 56.753 56.753 56.007 0.746 25033
14 1 . 1 1 14 14 GLU CB C 14 30.464 30.464 29.417 1.047 25033
15 1 . 1 1 14 14 GLU H H 14 8.285 8.285 8.432 -0.147 25033
16 1 . 1 1 15 15 GLN N N 15 121.185 121.185 121.670 -0.485 25033
17 1 . 1 1 15 15 GLN HA H 15 4.349 4.349 4.415 -0.066 25033
18 1 . 1 1 15 15 GLN C C 15 175.494 175.494 175.125 0.369 25033
19 1 . 1 1 15 15 GLN CA C 15 55.670 55.670 55.522 0.148 25033
20 1 . 1 1 15 15 GLN CB C 15 29.410 29.410 29.512 -0.102 25033
21 1 . 1 1 15 15 GLN H H 15 8.444 8.444 8.191 0.254 25033
22 1 . 1 1 16 16 LEU N N 16 123.934 123.934 125.379 -1.445 25033
23 1 . 1 1 16 16 LEU HA H 16 4.341 4.341 4.571 -0.229 25033
24 1 . 1 1 16 16 LEU C C 16 176.942 176.942 175.332 1.610 25033
25 1 . 1 1 16 16 LEU CA C 16 55.504 55.504 54.511 0.993 25033
26 1 . 1 1 16 16 LEU CB C 16 42.519 42.519 42.722 -0.203 25033
27 1 . 1 1 16 16 LEU H H 16 8.289 8.289 8.501 -0.212 25033
28 1 . 1 1 17 17 ARG N N 17 122.044 122.044 121.945 0.098 25033
29 1 . 1 1 17 17 ARG HA H 17 4.464 4.464 4.537 -0.073 25033
30 1 . 1 1 17 17 ARG C C 17 175.829 175.829 175.634 0.195 25033
31 1 . 1 1 17 17 ARG CA C 17 55.672 55.672 55.114 0.558 25033
32 1 . 1 1 17 17 ARG CB C 17 29.830 29.830 30.537 -0.707 25033
33 1 . 1 1 17 17 ARG H H 17 8.216 8.216 8.336 -0.120 25033
34 1 . 1 1 18 18 GLN N N 18 122.488 122.488 123.959 -1.471 25033
35 1 . 1 1 18 18 GLN HA H 18 4.334 4.334 4.467 -0.133 25033
36 1 . 1 1 18 18 GLN C C 18 172.958 172.958 173.499 -0.541 25033
37 1 . 1 1 18 18 GLN CA C 18 54.900 54.900 54.298 0.602 25033
38 1 . 1 1 18 18 GLN CB C 18 32.620 32.620 32.330 0.290 25033
39 1 . 1 1 18 18 GLN H H 18 8.573 8.573 7.974 0.599 25033
40 1 . 1 1 19 19 GLN N N 19 116.301 116.301 119.941 -3.640 25033
41 1 . 1 1 19 19 GLN HA H 19 5.378 5.378 5.263 0.115 25033
42 1 . 1 1 19 19 GLN C C 19 176.902 176.902 174.561 2.341 25033
43 1 . 1 1 19 19 GLN CA C 19 54.215 54.215 54.081 0.134 25033
44 1 . 1 1 19 19 GLN CB C 19 34.638 34.638 33.301 1.337 25033
45 1 . 1 1 19 19 GLN H H 19 8.146 8.146 8.359 -0.213 25033
46 1 . 1 1 20 20 GLY N N 20 109.745 109.745 109.153 0.592 25033
47 1 . 1 1 20 20 GLY C C 20 170.989 170.989 172.690 -1.701 25033
48 1 . 1 1 20 20 GLY CA C 20 45.935 45.935 44.272 1.663 25033
49 1 . 1 1 20 20 GLY H H 20 8.998 8.998 8.243 0.755 25033
50 1 . 1 1 21 21 THR N N 21 112.645 112.645 113.971 -1.326 25033
51 1 . 1 1 21 21 THR HA H 21 5.361 5.361 5.205 0.156 25033
52 1 . 1 1 21 21 THR C C 21 174.553 174.553 175.877 -1.324 25033
53 1 . 1 1 21 21 THR CA C 21 60.025 60.025 59.957 0.068 25033
54 1 . 1 1 21 21 THR CB C 21 71.720 71.720 71.482 0.238 25033
55 1 . 1 1 21 21 THR H H 21 8.312 8.312 8.203 0.109 25033
56 1 . 1 1 22 22 VAL N N 22 125.915 125.915 121.826 4.089 25033
57 1 . 1 1 22 22 VAL HA H 22 3.649 3.649 3.896 -0.247 25033
58 1 . 1 1 22 22 VAL C C 22 175.553 175.553 177.869 -2.316 25033
59 1 . 1 1 22 22 VAL CA C 22 64.618 64.618 64.886 -0.268 25033
60 1 . 1 1 22 22 VAL CB C 22 31.621 31.621 31.481 0.140 25033
61 1 . 1 1 22 22 VAL H H 22 9.092 9.092 8.263 0.829 25033
62 1 . 1 1 23 23 LYS N N 23 135.790 135.790 119.732 16.058 25033
63 1 . 1 1 23 23 LYS HA H 23 4.301 4.301 4.043 0.258 25033
64 1 . 1 1 23 23 LYS C C 23 176.301 176.301 176.573 -0.272 25033
65 1 . 1 1 23 23 LYS CA C 23 58.610 58.610 58.760 -0.150 25033
66 1 . 1 1 23 23 LYS CB C 23 34.300 34.300 31.639 2.660 25033
67 1 . 1 1 23 23 LYS H H 23 9.276 9.276 8.500 0.776 25033
68 1 . 1 1 24 24 TRP N N 24 111.651 111.651 118.974 -7.323 25033
69 1 . 1 1 24 24 TRP HA H 24 4.623 4.623 4.826 -0.203 25033
70 1 . 1 1 24 24 TRP C C 24 173.628 173.628 174.784 -1.156 25033
71 1 . 1 1 24 24 TRP CA C 24 56.300 56.300 55.871 0.429 25033
72 1 . 1 1 24 24 TRP CB C 24 31.260 31.260 29.625 1.635 25033
73 1 . 1 1 24 24 TRP H H 24 7.455 7.455 7.642 -0.187 25033
74 1 . 1 1 25 25 PHE N N 25 121.305 121.305 120.308 0.997 25033
75 1 . 1 1 25 25 PHE HA H 25 4.285 4.285 4.815 -0.530 25033
76 1 . 1 1 25 25 PHE C C 25 172.354 172.354 174.421 -2.067 25033
77 1 . 1 1 25 25 PHE CA C 25 59.372 59.372 57.141 2.231 25033
78 1 . 1 1 25 25 PHE CB C 25 42.569 42.569 42.253 0.316 25033
79 1 . 1 1 25 25 PHE H H 25 9.074 9.074 8.086 0.988 25033
80 1 . 1 1 26 26 ASN N N 26 126.976 126.976 124.187 2.789 25033
81 1 . 1 1 26 26 ASN HA H 26 4.812 4.812 4.933 -0.121 25033
82 1 . 1 1 26 26 ASN CA C 26 51.412 51.412 52.324 -0.912 25033
83 1 . 1 1 26 26 ASN CB C 26 39.086 39.086 39.329 -0.243 25033
84 1 . 1 1 26 26 ASN H H 26 8.159 8.159 8.131 0.028 25033
85 1 . 1 1 27 27 ALA N N 27 128.245 128.245 126.468 1.777 25033
86 1 . 1 1 27 27 ALA HA H 27 4.121 4.121 4.083 0.038 25033
87 1 . 1 1 27 27 ALA C C 27 179.031 179.031 178.896 0.135 25033
88 1 . 1 1 27 27 ALA CA C 27 54.425 54.425 55.114 -0.689 25033
89 1 . 1 1 27 27 ALA CB C 27 18.374 18.374 18.891 -0.517 25033
90 1 . 1 1 27 27 ALA H H 27 9.036 9.036 8.645 0.391 25033
91 1 . 1 1 28 28 THR N N 28 113.994 113.994 113.532 0.462 25033
92 1 . 1 1 28 28 THR HA H 28 4.068 4.068 4.004 0.064 25033
93 1 . 1 1 28 28 THR C C 28 176.084 176.084 176.004 0.080 25033
94 1 . 1 1 28 28 THR CA C 28 65.820 65.820 65.043 0.777 25033
95 1 . 1 1 28 28 THR CB C 28 68.291 68.291 68.273 0.018 25033
96 1 . 1 1 28 28 THR H H 28 8.065 8.065 8.256 -0.191 25033
97 1 . 1 1 29 29 LYS N N 29 118.922 118.922 119.350 -0.428 25033
98 1 . 1 1 29 29 LYS HA H 29 4.256 4.256 4.287 -0.031 25033
99 1 . 1 1 29 29 LYS C C 29 177.201 177.201 177.222 -0.021 25033
100 1 . 1 1 29 29 LYS CA C 29 56.888 56.888 56.467 0.421 25033
101 1 . 1 1 29 29 LYS CB C 29 33.740 33.740 32.500 1.240 25033
102 1 . 1 1 29 29 LYS H H 29 7.446 7.446 7.948 -0.502 25033
103 1 . 1 1 30 30 GLY N N 30 107.601 107.601 107.038 0.563 25033
104 1 . 1 1 30 30 GLY C C 30 172.004 172.004 173.208 -1.204 25033
105 1 . 1 1 30 30 GLY CA C 30 46.404 46.404 45.089 1.315 25033
106 1 . 1 1 30 30 GLY H H 30 8.115 8.115 7.779 0.336 25033
107 1 . 1 1 31 31 PHE N N 31 112.488 112.488 118.059 -5.571 25033
108 1 . 1 1 31 31 PHE HA H 31 5.007 5.007 4.688 0.319 25033
109 1 . 1 1 31 31 PHE CA C 31 55.278 55.278 56.946 -1.668 25033
110 1 . 1 1 31 31 PHE CB C 31 42.388 42.388 40.763 1.625 25033
111 1 . 1 1 31 31 PHE H H 31 6.594 6.594 7.501 -0.907 25033
112 1 . 1 1 32 32 GLY N N 32 105.986 105.986 108.849 -2.863 25033
113 1 . 1 1 32 32 GLY C C 32 170.292 170.292 171.781 -1.489 25033
114 1 . 1 1 32 32 GLY CA C 32 45.369 45.369 43.332 2.037 25033
115 1 . 1 1 32 32 GLY H H 32 8.144 8.144 7.835 0.309 25033
116 1 . 1 1 33 33 PHE N N 33 115.319 115.319 116.135 -0.816 25033
117 1 . 1 1 33 33 PHE HA H 33 5.463 5.463 5.325 0.138 25033
118 1 . 1 1 33 33 PHE C C 33 175.037 175.037 175.061 -0.024 25033
119 1 . 1 1 33 33 PHE CA C 33 56.295 56.295 57.449 -1.154 25033
120 1 . 1 1 33 33 PHE CB C 33 44.792 44.792 44.148 0.644 25033
121 1 . 1 1 33 33 PHE H H 33 7.971 7.971 7.947 0.024 25033
122 1 . 1 1 34 34 ILE N N 34 122.140 122.140 121.367 0.773 25033
123 1 . 1 1 34 34 ILE HA H 34 4.317 4.317 4.669 -0.352 25033
124 1 . 1 1 34 34 ILE C C 34 174.526 174.526 175.288 -0.762 25033
125 1 . 1 1 34 34 ILE CA C 34 59.797 59.797 59.680 0.117 25033
126 1 . 1 1 34 34 ILE CB C 34 42.583 42.583 40.614 1.969 25033
127 1 . 1 1 34 34 ILE H H 34 9.511 9.511 8.802 0.709 25033
128 1 . 1 1 35 35 THR N N 35 126.580 126.580 120.665 5.915 25033
129 1 . 1 1 35 35 THR HA H 35 5.143 5.143 5.041 0.102 25033
130 1 . 1 1 35 35 THR CA C 35 59.330 59.330 58.197 1.133 25033
131 1 . 1 1 35 35 THR CB C 35 70.258 70.258 68.836 1.422 25033
132 1 . 1 1 35 35 THR H H 35 9.416 9.416 8.762 0.654 25033
133 1 . 1 1 36 36 PRO HA H 36 4.599 4.599 4.617 -0.018 25033
134 1 . 1 1 36 36 PRO C C 36 177.390 177.390 177.751 -0.361 25033
135 1 . 1 1 36 36 PRO CA C 36 63.220 63.220 63.167 0.053 25033
136 1 . 1 1 36 36 PRO CB C 36 32.470 32.470 32.002 0.468 25033
137 1 . 1 1 37 37 GLY N N 37 112.033 112.033 111.508 0.525 25033
138 1 . 1 1 37 37 GLY C C 37 169.261 169.261 174.734 -5.473 25033
139 1 . 1 1 37 37 GLY CA C 37 46.457 46.457 44.872 1.585 25033
140 1 . 1 1 37 37 GLY H H 37 9.349 9.349 8.639 0.710 25033
141 1 . 1 1 38 38 GLY N N 38 109.050 109.050 108.950 0.100 25033
142 1 . 1 1 38 38 GLY C C 38 175.177 175.177 174.876 0.301 25033
143 1 . 1 1 38 38 GLY H H 38 8.756 8.756 7.959 0.797 25033
144 1 . 1 1 39 39 GLY N N 39 107.730 107.730 107.498 0.232 25033
145 1 . 1 1 39 39 GLY C C 39 173.870 173.870 174.272 -0.402 25033
146 1 . 1 1 39 39 GLY CA C 39 44.258 44.258 45.098 -0.840 25033
147 1 . 1 1 39 39 GLY H H 39 7.725 7.725 8.053 -0.329 25033
148 1 . 1 1 40 40 GLY N N 40 107.183 107.183 109.715 -2.532 25033
149 1 . 1 1 40 40 GLY C C 40 173.067 173.067 173.693 -0.626 25033
150 1 . 1 1 40 40 GLY CA C 40 43.760 43.760 45.160 -1.400 25033
151 1 . 1 1 40 40 GLY H H 40 8.096 8.096 8.146 -0.050 25033
152 1 . 1 1 41 41 GLU N N 41 119.455 119.455 122.087 -2.632 25033
153 1 . 1 1 41 41 GLU HA H 41 4.178 4.178 4.434 -0.256 25033
154 1 . 1 1 41 41 GLU C C 41 175.900 175.900 175.301 0.599 25033
155 1 . 1 1 41 41 GLU CA C 41 56.377 56.377 55.698 0.679 25033
156 1 . 1 1 41 41 GLU CB C 41 30.600 30.600 30.668 -0.068 25033
157 1 . 1 1 41 41 GLU H H 41 8.199 8.199 8.400 -0.201 25033
158 1 . 1 1 42 42 ASP N N 42 119.784 119.784 122.914 -3.130 25033
159 1 . 1 1 42 42 ASP HA H 42 4.857 4.857 5.132 -0.275 25033
160 1 . 1 1 42 42 ASP C C 42 176.474 176.474 175.767 0.707 25033
161 1 . 1 1 42 42 ASP CA C 42 55.441 55.441 53.447 1.994 25033
162 1 . 1 1 42 42 ASP CB C 42 41.488 41.488 41.893 -0.405 25033
163 1 . 1 1 42 42 ASP H H 42 8.277 8.277 8.347 -0.070 25033
164 1 . 1 1 43 43 LEU N N 43 122.515 122.515 120.460 2.055 25033
165 1 . 1 1 43 43 LEU HA H 43 4.687 4.687 4.869 -0.182 25033
166 1 . 1 1 43 43 LEU C C 43 175.759 175.759 176.138 -0.379 25033
167 1 . 1 1 43 43 LEU CA C 43 53.304 53.304 53.697 -0.393 25033
168 1 . 1 1 43 43 LEU CB C 43 45.449 45.449 45.085 0.364 25033
169 1 . 1 1 43 43 LEU H H 43 9.423 9.423 8.413 1.010 25033
170 1 . 1 1 44 44 PHE N N 44 125.962 125.962 119.809 6.153 25033
171 1 . 1 1 44 44 PHE HA H 44 3.922 3.922 4.857 -0.935 25033
172 1 . 1 1 44 44 PHE C C 44 172.844 172.844 175.193 -2.349 25033
173 1 . 1 1 44 44 PHE CA C 44 57.880 57.880 56.990 0.890 25033
174 1 . 1 1 44 44 PHE CB C 44 40.350 40.350 39.847 0.503 25033
175 1 . 1 1 44 44 PHE H H 44 8.465 8.465 8.386 0.079 25033
176 1 . 1 1 45 45 VAL N N 45 123.552 123.552 123.689 -0.137 25033
177 1 . 1 1 45 45 VAL HA H 45 4.657 4.657 4.407 0.250 25033
178 1 . 1 1 45 45 VAL C C 45 177.433 177.433 173.575 3.858 25033
179 1 . 1 1 45 45 VAL CA C 45 58.460 58.460 60.341 -1.881 25033
180 1 . 1 1 45 45 VAL CB C 45 34.884 34.884 35.435 -0.551 25033
181 1 . 1 1 45 45 VAL H H 45 7.715 7.715 8.084 -0.369 25033
182 1 . 1 1 46 46 HIS N N 46 127.300 127.300 125.290 2.010 25033
183 1 . 1 1 46 46 HIS HA H 46 4.825 4.825 4.841 -0.016 25033
184 1 . 1 1 46 46 HIS C C 46 176.469 176.469 174.222 2.247 25033
185 1 . 1 1 46 46 HIS CA C 46 55.929 55.929 54.048 1.881 25033
186 1 . 1 1 46 46 HIS CB C 46 34.399 34.399 31.611 2.788 25033
187 1 . 1 1 46 46 HIS H H 46 9.104 9.104 8.391 0.713 25033
188 1 . 1 1 47 47 GLN N N 47 125.105 125.105 124.591 0.514 25033
189 1 . 1 1 47 47 GLN H H 47 8.352 8.352 8.604 -0.252 25033
190 1 . 1 1 48 48 THR HA H 48 4.310 4.310 4.395 -0.085 25033
191 1 . 1 1 48 48 THR C C 48 175.568 175.568 174.923 0.645 25033
192 1 . 1 1 48 48 THR CA C 48 64.770 64.770 63.010 1.760 25033
193 1 . 1 1 48 48 THR CB C 48 70.054 70.054 69.601 0.453 25033
194 1 . 1 1 49 49 ASN N N 49 118.142 118.142 118.919 -0.777 25033
195 1 . 1 1 49 49 ASN HA H 49 5.160 5.160 4.873 0.287 25033
196 1 . 1 1 49 49 ASN C C 49 172.914 172.914 173.784 -0.870 25033
197 1 . 1 1 49 49 ASN CA C 49 54.351 54.351 53.121 1.230 25033
198 1 . 1 1 49 49 ASN CB C 49 40.527 40.527 39.737 0.790 25033
199 1 . 1 1 49 49 ASN H H 49 8.452 8.452 8.425 0.027 25033
200 1 . 1 1 50 50 ILE N N 50 119.226 119.226 121.203 -1.977 25033
201 1 . 1 1 50 50 ILE HA H 50 4.112 4.112 4.181 -0.069 25033
202 1 . 1 1 50 50 ILE CA C 50 61.606 61.606 60.764 0.842 25033
203 1 . 1 1 50 50 ILE CB C 50 38.362 38.362 36.673 1.689 25033
204 1 . 1 1 50 50 ILE H H 50 7.354 7.354 7.886 -0.532 25033
205 1 . 1 1 51 51 ASN N N 51 128.460 128.460 123.525 4.935 25033
206 1 . 1 1 51 51 ASN C C 51 174.614 174.614 174.077 0.537 25033
207 1 . 1 1 51 51 ASN H H 51 9.266 9.266 7.977 1.289 25033
208 1 . 1 1 52 52 SER N N 52 117.246 117.246 116.427 0.819 25033
209 1 . 1 1 52 52 SER HA H 52 4.413 4.413 4.708 -0.294 25033
210 1 . 1 1 52 52 SER C C 52 174.139 174.139 174.599 -0.460 25033
211 1 . 1 1 52 52 SER CA C 52 58.378 58.378 57.449 0.929 25033
212 1 . 1 1 52 52 SER CB C 52 64.371 64.371 64.896 -0.525 25033
213 1 . 1 1 52 52 SER H H 52 7.973 7.973 8.346 -0.373 25033
214 1 . 1 1 53 53 GLU N N 53 123.628 123.628 121.855 1.773 25033
215 1 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.269 0.029 25033
216 1 . 1 1 53 53 GLU C C 53 176.960 176.960 176.592 0.368 25033
217 1 . 1 1 53 53 GLU CA C 53 57.270 57.270 57.106 0.164 25033
218 1 . 1 1 53 53 GLU CB C 53 29.861 29.861 29.924 -0.063 25033
219 1 . 1 1 53 53 GLU H H 53 8.641 8.641 8.674 -0.033 25033
220 1 . 1 1 54 54 GLY N N 54 110.282 110.282 108.034 2.248 25033
221 1 . 1 1 54 54 GLY CA C 54 44.600 44.600 44.748 -0.148 25033
222 1 . 1 1 54 54 GLY H H 54 8.225 8.225 7.829 0.397 25033
223 1 . 1 1 55 55 PHE HA H 55 4.820 4.820 4.758 0.062 25033
224 1 . 1 1 55 55 PHE C C 55 175.836 175.836 174.913 0.923 25033
225 1 . 1 1 55 55 PHE CA C 55 52.690 52.690 57.138 -4.448 25033
226 1 . 1 1 55 55 PHE CB C 55 38.095 38.095 41.007 -2.912 25033
227 1 . 1 1 56 56 ARG N N 56 120.907 120.907 122.440 -1.533 25033
228 1 . 1 1 56 56 ARG HA H 56 4.264 4.264 4.640 -0.376 25033
229 1 . 1 1 56 56 ARG C C 56 175.618 175.618 175.629 -0.011 25033
230 1 . 1 1 56 56 ARG CA C 56 55.510 55.510 55.611 -0.101 25033
231 1 . 1 1 56 56 ARG CB C 56 32.020 32.020 31.381 0.639 25033
232 1 . 1 1 56 56 ARG H H 56 8.153 8.153 8.682 -0.529 25033
233 1 . 1 1 57 57 SER N N 57 123.117 123.117 119.760 3.357 25033
234 1 . 1 1 57 57 SER H H 57 7.834 7.834 8.550 -0.716 25033
235 1 . 1 1 58 58 LEU HA H 58 4.280 4.280 4.746 -0.466 25033
236 1 . 1 1 58 58 LEU C C 58 174.842 174.842 176.299 -1.457 25033
237 1 . 1 1 58 58 LEU CA C 58 53.760 53.760 54.466 -0.706 25033
238 1 . 1 1 58 58 LEU CB C 58 42.580 42.580 44.019 -1.439 25033
239 1 . 1 1 59 59 ARG N N 59 119.557 119.557 121.529 -1.972 25033
240 1 . 1 1 59 59 ARG HA H 59 4.585 4.585 4.604 -0.019 25033
241 1 . 1 1 59 59 ARG C C 59 175.256 175.256 175.337 -0.081 25033
242 1 . 1 1 59 59 ARG CA C 59 54.112 54.112 54.686 -0.574 25033
243 1 . 1 1 59 59 ARG CB C 59 32.970 32.970 32.852 0.118 25033
244 1 . 1 1 59 59 ARG H H 59 8.529 8.529 8.617 -0.088 25033
245 1 . 1 1 60 60 GLU N N 60 121.597 121.597 120.598 0.999 25033
246 1 . 1 1 60 60 GLU HA H 60 3.581 3.581 4.138 -0.557 25033
247 1 . 1 1 60 60 GLU C C 60 177.281 177.281 176.705 0.576 25033
248 1 . 1 1 60 60 GLU CA C 60 58.301 58.301 57.534 0.767 25033
249 1 . 1 1 60 60 GLU CB C 60 29.261 29.261 29.700 -0.439 25033
250 1 . 1 1 60 60 GLU H H 60 8.691 8.691 8.610 0.081 25033
251 1 . 1 1 61 61 GLY N N 61 113.554 113.554 111.471 2.083 25033
252 1 . 1 1 61 61 GLY C C 61 174.068 174.068 174.385 -0.317 25033
253 1 . 1 1 61 61 GLY CA C 61 45.243 45.243 44.732 0.511 25033
254 1 . 1 1 61 61 GLY H H 61 9.151 9.151 8.715 0.436 25033
255 1 . 1 1 62 62 GLU N N 62 121.639 121.639 122.394 -0.755 25033
256 1 . 1 1 62 62 GLU HA H 62 4.204 4.204 4.265 -0.061 25033
257 1 . 1 1 62 62 GLU C C 62 175.439 175.439 176.150 -0.711 25033
258 1 . 1 1 62 62 GLU CA C 62 57.342 57.342 56.751 0.591 25033
259 1 . 1 1 62 62 GLU CB C 62 30.925 30.925 30.533 0.392 25033
260 1 . 1 1 62 62 GLU H H 62 7.889 7.889 7.686 0.203 25033
261 1 . 1 1 63 63 VAL N N 63 125.003 125.003 125.874 -0.871 25033
262 1 . 1 1 63 63 VAL HA H 63 4.748 4.748 4.761 -0.013 25033
263 1 . 1 1 63 63 VAL C C 63 176.639 176.639 176.096 0.543 25033
264 1 . 1 1 63 63 VAL CA C 63 62.631 62.631 61.549 1.082 25033
265 1 . 1 1 63 63 VAL CB C 63 32.357 32.357 32.854 -0.498 25033
266 1 . 1 1 63 63 VAL H H 63 8.477 8.477 8.305 0.172 25033
267 1 . 1 1 64 64 VAL N N 64 120.113 120.113 122.534 -2.421 25033
268 1 . 1 1 64 64 VAL HA H 64 5.004 5.004 4.740 0.264 25033
269 1 . 1 1 64 64 VAL C C 64 173.790 173.790 174.189 -0.399 25033
270 1 . 1 1 64 64 VAL CA C 64 58.609 58.609 59.365 -0.756 25033
271 1 . 1 1 64 64 VAL CB C 64 36.360 36.360 35.169 1.191 25033
272 1 . 1 1 64 64 VAL H H 64 8.686 8.686 8.976 -0.290 25033
273 1 . 1 1 65 65 GLU N N 65 120.433 120.433 120.876 -0.443 25033
274 1 . 1 1 65 65 GLU HA H 65 5.447 5.447 5.347 0.100 25033
275 1 . 1 1 65 65 GLU C C 65 175.584 175.584 175.305 0.279 25033
276 1 . 1 1 65 65 GLU CA C 65 54.390 54.390 54.623 -0.233 25033
277 1 . 1 1 65 65 GLU CB C 65 34.003 34.003 33.235 0.768 25033
278 1 . 1 1 65 65 GLU H H 65 9.003 9.003 8.312 0.691 25033
279 1 . 1 1 66 66 PHE N N 66 116.104 116.104 119.700 -3.596 25033
280 1 . 1 1 66 66 PHE HA H 66 5.061 5.061 5.060 0.001 25033
281 1 . 1 1 66 66 PHE C C 66 173.001 173.001 172.814 0.187 25033
282 1 . 1 1 66 66 PHE CA C 66 56.857 56.857 56.804 0.053 25033
283 1 . 1 1 66 66 PHE CB C 66 41.432 41.432 41.546 -0.114 25033
284 1 . 1 1 66 66 PHE H H 66 8.172 8.172 7.878 0.294 25033
285 1 . 1 1 67 67 GLU N N 67 117.574 117.574 118.367 -0.793 25033
286 1 . 1 1 67 67 GLU HA H 67 4.872 4.872 5.107 -0.235 25033
287 1 . 1 1 67 67 GLU C C 67 175.327 175.327 175.598 -0.271 25033
288 1 . 1 1 67 67 GLU CA C 67 54.641 54.641 54.178 0.463 25033
289 1 . 1 1 67 67 GLU CB C 67 33.020 33.020 33.222 -0.202 25033
290 1 . 1 1 67 67 GLU H H 67 8.668 8.668 8.591 0.077 25033
291 1 . 1 1 68 68 VAL N N 68 120.881 120.881 123.196 -2.315 25033
292 1 . 1 1 68 68 VAL HA H 68 5.012 5.012 4.282 0.730 25033
293 1 . 1 1 68 68 VAL C C 68 176.140 176.140 175.743 0.397 25033
294 1 . 1 1 68 68 VAL CA C 68 62.338 62.338 62.757 -0.419 25033
295 1 . 1 1 68 68 VAL CB C 68 34.006 34.006 32.110 1.896 25033
296 1 . 1 1 68 68 VAL H H 68 8.748 8.748 8.564 0.184 25033
297 1 . 1 1 69 69 GLU N N 69 128.110 128.110 128.749 -0.639 25033
298 1 . 1 1 69 69 GLU HA H 69 4.705 4.705 4.659 0.045 25033
299 1 . 1 1 69 69 GLU C C 69 174.573 174.573 174.807 -0.234 25033
300 1 . 1 1 69 69 GLU CA C 69 54.953 54.953 54.589 0.364 25033
301 1 . 1 1 69 69 GLU CB C 69 34.290 34.290 33.395 0.895 25033
302 1 . 1 1 69 69 GLU H H 69 9.070 9.070 8.959 0.111 25033
303 1 . 1 1 70 70 ALA N N 70 127.944 127.944 128.598 -0.654 25033
304 1 . 1 1 70 70 ALA HA H 70 5.004 5.004 5.108 -0.104 25033
305 1 . 1 1 70 70 ALA C C 70 178.073 178.073 177.272 0.801 25033
306 1 . 1 1 70 70 ALA CA C 70 50.959 50.959 50.996 -0.037 25033
307 1 . 1 1 70 70 ALA CB C 70 19.489 19.489 20.003 -0.514 25033
308 1 . 1 1 70 70 ALA H H 70 8.671 8.671 8.598 0.073 25033
309 1 . 1 1 71 71 GLY N N 71 110.340 110.340 111.495 -1.155 25033
310 1 . 1 1 71 71 GLY CA C 71 44.016 44.016 43.689 0.327 25033
311 1 . 1 1 71 71 GLY H H 71 8.445 8.445 8.192 0.254 25033
312 1 . 1 1 72 72 PRO HA H 72 4.417 4.417 4.379 0.038 25033
313 1 . 1 1 72 72 PRO C C 72 176.835 176.835 176.744 0.091 25033
314 1 . 1 1 72 72 PRO CA C 72 64.160 64.160 64.435 -0.275 25033
315 1 . 1 1 72 72 PRO CB C 72 31.880 31.880 31.696 0.183 25033
316 1 . 1 1 73 73 ASP N N 73 116.498 116.498 117.646 -1.148 25033
317 1 . 1 1 73 73 ASP HA H 73 4.515 4.515 4.572 -0.057 25033
318 1 . 1 1 73 73 ASP C C 73 176.775 176.775 177.299 -0.524 25033
319 1 . 1 1 73 73 ASP CA C 73 53.547 53.547 54.484 -0.937 25033
320 1 . 1 1 73 73 ASP CB C 73 40.234 40.234 40.810 -0.576 25033
321 1 . 1 1 73 73 ASP H H 73 8.248 8.248 8.274 -0.026 25033
322 1 . 1 1 74 74 GLY N N 74 107.369 107.369 107.793 -0.424 25033
323 1 . 1 1 74 74 GLY C C 74 174.331 174.331 173.750 0.581 25033
324 1 . 1 1 74 74 GLY CA C 74 45.578 45.578 44.855 0.723 25033
325 1 . 1 1 74 74 GLY H H 74 8.153 8.153 7.684 0.469 25033
326 1 . 1 1 75 75 ARG N N 75 120.942 120.942 120.299 0.643 25033
327 1 . 1 1 75 75 ARG HA H 75 4.542 4.542 4.535 0.007 25033
328 1 . 1 1 75 75 ARG C C 75 176.652 176.652 175.202 1.450 25033
329 1 . 1 1 75 75 ARG CA C 75 55.658 55.658 55.733 -0.075 25033
330 1 . 1 1 75 75 ARG CB C 75 30.909 30.909 31.151 -0.242 25033
331 1 . 1 1 75 75 ARG H H 75 7.670 7.670 8.141 -0.471 25033
332 1 . 1 1 76 76 SER N N 76 120.181 120.181 116.968 3.213 25033
333 1 . 1 1 76 76 SER HA H 76 5.035 5.035 5.444 -0.409 25033
334 1 . 1 1 76 76 SER C C 76 172.816 172.816 174.164 -1.348 25033
335 1 . 1 1 76 76 SER CA C 76 59.080 59.080 57.040 2.040 25033
336 1 . 1 1 76 76 SER CB C 76 64.850 64.850 65.405 -0.555 25033
337 1 . 1 1 76 76 SER H H 76 8.808 8.808 8.423 0.385 25033
338 1 . 1 1 77 77 LYS N N 77 121.202 121.202 121.511 -0.309 25033
339 1 . 1 1 77 77 LYS HA H 77 5.174 5.174 4.744 0.430 25033
340 1 . 1 1 77 77 LYS C C 77 173.706 173.706 174.314 -0.608 25033
341 1 . 1 1 77 77 LYS CA C 77 54.599 54.599 55.016 -0.417 25033
342 1 . 1 1 77 77 LYS CB C 77 36.035 36.035 36.289 -0.254 25033
343 1 . 1 1 77 77 LYS H H 77 8.982 8.982 8.710 0.272 25033
344 1 . 1 1 78 78 ALA N N 78 124.064 124.064 124.657 -0.593 25033
345 1 . 1 1 78 78 ALA HA H 78 5.004 5.004 4.938 0.066 25033
346 1 . 1 1 78 78 ALA C C 78 175.979 175.979 176.255 -0.276 25033
347 1 . 1 1 78 78 ALA CA C 78 50.445 50.445 50.985 -0.540 25033
348 1 . 1 1 78 78 ALA CB C 78 20.136 20.136 19.904 0.232 25033
349 1 . 1 1 78 78 ALA H H 78 8.706 8.706 8.513 0.193 25033
350 1 . 1 1 79 79 VAL N N 79 113.264 113.264 117.299 -4.035 25033
351 1 . 1 1 79 79 VAL HA H 79 4.843 4.843 4.430 0.413 25033
352 1 . 1 1 79 79 VAL C C 79 174.744 174.744 174.547 0.197 25033
353 1 . 1 1 79 79 VAL CA C 79 59.073 59.073 59.991 -0.918 25033
354 1 . 1 1 79 79 VAL CB C 79 35.596 35.596 35.570 0.026 25033
355 1 . 1 1 79 79 VAL H H 79 9.165 9.165 7.673 1.492 25033
356 1 . 1 1 80 80 ASN N N 80 120.084 120.084 115.315 4.769 25033
357 1 . 1 1 80 80 ASN HA H 80 4.356 4.356 4.346 0.010 25033
358 1 . 1 1 80 80 ASN C C 80 175.391 175.391 173.988 1.403 25033
359 1 . 1 1 80 80 ASN CA C 80 53.734 53.734 53.790 -0.056 25033
360 1 . 1 1 80 80 ASN CB C 80 37.121 37.121 36.947 0.173 25033
361 1 . 1 1 80 80 ASN H H 80 8.923 8.923 8.607 0.316 25033
362 1 . 1 1 81 81 VAL N N 81 119.178 119.178 118.528 0.650 25033
363 1 . 1 1 81 81 VAL HA H 81 4.747 4.747 4.472 0.275 25033
364 1 . 1 1 81 81 VAL C C 81 176.340 176.340 176.635 -0.295 25033
365 1 . 1 1 81 81 VAL CA C 81 63.160 63.160 62.246 0.914 25033
366 1 . 1 1 81 81 VAL CB C 81 32.130 32.130 31.884 0.246 25033
367 1 . 1 1 81 81 VAL H H 81 8.282 8.282 7.688 0.594 25033
stop_
save_