data_18237
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18237
_Entry.PDB_ID 2LP7
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 18237
_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 2 2 TYR N N 2 120.470 120.470 119.718 0.752 18237
2 1 1 . 1 1 2 2 TYR C C 2 176.535 176.535 174.928 1.607 18237
3 1 1 . 1 1 2 2 TYR CA C 2 55.995 55.995 58.202 -2.207 18237
4 1 1 . 1 1 2 2 TYR CB C 2 37.313 37.313 40.929 -3.616 18237
5 1 1 . 1 1 2 2 TYR H H 2 7.951 7.951 8.219 -0.268 18237
6 1 1 . 1 1 3 3 ILE N N 3 118.307 118.307 118.496 -0.189 18237
7 1 1 . 1 1 3 3 ILE CA C 3 58.968 58.968 59.554 -0.586 18237
8 1 1 . 1 1 3 3 ILE CB C 3 38.074 38.074 38.234 -0.160 18237
9 1 1 . 1 1 3 3 ILE H H 3 8.381 8.381 8.118 0.263 18237
10 1 1 . 1 1 5 5 GLU N N 5 118.785 118.785 123.134 -4.349 18237
11 1 1 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.265 -0.010 18237
12 1 1 . 1 1 5 5 GLU C C 5 176.267 176.267 173.736 2.531 18237
13 1 1 . 1 1 5 5 GLU CA C 5 55.959 55.959 57.169 -1.210 18237
14 1 1 . 1 1 5 5 GLU CB C 5 30.034 30.034 31.058 -1.024 18237
15 1 1 . 1 1 5 5 GLU H H 5 7.710 7.710 8.717 -1.007 18237
16 1 1 . 1 1 6 6 ALA N N 6 131.546 131.546 126.213 5.333 18237
17 1 1 . 1 1 6 6 ALA HA H 6 3.575 3.575 3.698 -0.123 18237
18 1 1 . 1 1 6 6 ALA CA C 6 50.959 50.959 49.101 1.858 18237
19 1 1 . 1 1 6 6 ALA CB C 6 14.389 14.389 19.057 -4.668 18237
20 1 1 . 1 1 6 6 ALA H H 6 8.338 8.338 7.923 0.415 18237
21 1 1 . 1 1 8 8 ARG N N 8 126.915 126.915 121.598 5.317 18237
22 1 1 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.523 -0.453 18237
23 1 1 . 1 1 8 8 ARG C C 8 175.110 175.110 175.375 -0.265 18237
24 1 1 . 1 1 8 8 ARG CA C 8 54.699 54.699 56.117 -1.418 18237
25 1 1 . 1 1 8 8 ARG CB C 8 28.078 28.078 31.183 -3.105 18237
26 1 1 . 1 1 8 8 ARG H H 8 8.725 8.725 8.440 0.285 18237
27 1 1 . 1 1 9 9 ASP N N 9 123.653 123.653 124.403 -0.750 18237
28 1 1 . 1 1 9 9 ASP C C 9 178.015 178.015 177.267 0.748 18237
29 1 1 . 1 1 9 9 ASP CA C 9 52.747 52.747 54.273 -1.526 18237
30 1 1 . 1 1 9 9 ASP CB C 9 40.844 40.844 41.324 -0.480 18237
31 1 1 . 1 1 9 9 ASP H H 9 8.432 8.432 8.586 -0.154 18237
32 1 1 . 1 1 10 10 GLY N N 10 111.908 111.908 108.099 3.809 18237
33 1 1 . 1 1 10 10 GLY C C 10 174.822 174.822 174.831 -0.009 18237
34 1 1 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.092 0.152 18237
35 1 1 . 1 1 10 10 GLY H H 10 9.727 9.727 8.605 1.122 18237
36 1 1 . 1 1 11 11 GLN N N 11 118.395 118.395 119.053 -0.658 18237
37 1 1 . 1 1 11 11 GLN C C 11 174.711 174.711 174.025 0.686 18237
38 1 1 . 1 1 11 11 GLN CA C 11 53.398 53.398 54.789 -1.391 18237
39 1 1 . 1 1 11 11 GLN CB C 11 30.306 30.306 29.725 0.581 18237
40 1 1 . 1 1 11 11 GLN H H 11 8.416 8.416 7.727 0.689 18237
41 1 1 . 1 1 12 12 ALA N N 12 121.020 121.020 123.125 -2.105 18237
42 1 1 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.210 0.733 18237
43 1 1 . 1 1 12 12 ALA C C 12 177.990 177.990 175.239 2.751 18237
44 1 1 . 1 1 12 12 ALA CA C 12 50.511 50.511 50.945 -0.434 18237
45 1 1 . 1 1 12 12 ALA CB C 12 20.147 20.147 20.720 -0.573 18237
46 1 1 . 1 1 12 12 ALA H H 12 7.933 7.933 8.126 -0.193 18237
47 1 1 . 1 1 13 13 TYR N N 13 121.755 121.755 119.844 1.911 18237
48 1 1 . 1 1 13 13 TYR C C 13 175.519 175.519 174.843 0.676 18237
49 1 1 . 1 1 13 13 TYR CA C 13 59.090 59.090 56.193 2.897 18237
50 1 1 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.192 1.988 18237
51 1 1 . 1 1 13 13 TYR H H 13 9.575 9.575 8.216 1.359 18237
52 1 1 . 1 1 14 14 VAL N N 14 112.251 112.251 120.512 -8.261 18237
53 1 1 . 1 1 14 14 VAL C C 14 174.074 174.074 174.767 -0.693 18237
54 1 1 . 1 1 14 14 VAL CA C 14 59.090 59.090 59.373 -0.283 18237
55 1 1 . 1 1 14 14 VAL CB C 14 32.750 32.750 34.968 -2.218 18237
56 1 1 . 1 1 14 14 VAL H H 14 9.659 9.659 9.023 0.636 18237
57 1 1 . 1 1 15 15 ARG N N 15 124.657 124.657 123.207 1.450 18237
58 1 1 . 1 1 15 15 ARG C C 15 174.948 174.948 175.238 -0.290 18237
59 1 1 . 1 1 15 15 ARG CA C 15 53.520 53.520 55.816 -2.296 18237
60 1 1 . 1 1 15 15 ARG CB C 15 32.533 32.533 30.182 2.351 18237
61 1 1 . 1 1 15 15 ARG H H 15 8.503 8.503 8.523 -0.020 18237
62 1 1 . 1 1 16 16 LYS N N 16 128.240 128.240 125.568 2.672 18237
63 1 1 . 1 1 16 16 LYS C C 16 175.974 175.974 175.483 0.491 18237
64 1 1 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.552 0.224 18237
65 1 1 . 1 1 16 16 LYS CB C 16 36.553 36.553 35.390 1.163 18237
66 1 1 . 1 1 16 16 LYS H H 16 9.052 9.052 8.582 0.470 18237
67 1 1 . 1 1 17 17 ASP N N 17 130.562 130.562 126.846 3.716 18237
68 1 1 . 1 1 17 17 ASP C C 17 175.822 175.822 176.300 -0.478 18237
69 1 1 . 1 1 17 17 ASP CA C 17 56.447 56.447 54.789 1.658 18237
70 1 1 . 1 1 17 17 ASP CB C 17 40.192 40.192 39.506 0.686 18237
71 1 1 . 1 1 17 17 ASP H H 17 10.886 10.886 9.094 1.792 18237
72 1 1 . 1 1 18 18 GLY N N 18 104.754 104.754 106.436 -1.682 18237
73 1 1 . 1 1 18 18 GLY C C 18 173.104 173.104 173.483 -0.379 18237
74 1 1 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.339 -0.095 18237
75 1 1 . 1 1 18 18 GLY H H 18 9.353 9.353 8.104 1.249 18237
76 1 1 . 1 1 19 19 GLU N N 19 117.501 117.501 118.028 -0.527 18237
77 1 1 . 1 1 19 19 GLU HA H 19 4.648 4.648 4.233 0.415 18237
78 1 1 . 1 1 19 19 GLU C C 19 176.166 176.166 174.645 1.521 18237
79 1 1 . 1 1 19 19 GLU CA C 19 53.865 53.865 54.571 -0.706 18237
80 1 1 . 1 1 19 19 GLU CB C 19 33.130 33.130 33.874 -0.744 18237
81 1 1 . 1 1 19 19 GLU H H 19 7.813 7.813 7.953 -0.140 18237
82 1 1 . 1 1 20 20 TRP N N 20 122.768 122.768 121.927 0.841 18237
83 1 1 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.536 -0.869 18237
84 1 1 . 1 1 20 20 TRP C C 20 176.302 176.302 176.732 -0.430 18237
85 1 1 . 1 1 20 20 TRP CA C 20 55.878 55.878 56.010 -0.132 18237
86 1 1 . 1 1 20 20 TRP CB C 20 29.545 29.545 29.995 -0.450 18237
87 1 1 . 1 1 20 20 TRP H H 20 9.094 9.094 8.164 0.930 18237
88 1 1 . 1 1 21 21 VAL N N 21 123.071 123.071 124.225 -1.154 18237
89 1 1 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.530 0.455 18237
90 1 1 . 1 1 21 21 VAL C C 21 175.640 175.640 175.896 -0.256 18237
91 1 1 . 1 1 21 21 VAL CA C 21 59.537 59.537 60.755 -1.218 18237
92 1 1 . 1 1 21 21 VAL CB C 21 34.651 34.651 35.347 -0.696 18237
93 1 1 . 1 1 21 21 VAL H H 21 9.868 9.868 8.632 1.236 18237
94 1 1 . 1 1 22 22 LEU N N 22 127.193 127.193 128.686 -1.493 18237
95 1 1 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.474 -0.052 18237
96 1 1 . 1 1 22 22 LEU C C 22 179.268 179.268 178.782 0.486 18237
97 1 1 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.898 -0.264 18237
98 1 1 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.590 -0.311 18237
99 1 1 . 1 1 22 22 LEU H H 22 8.812 8.812 8.984 -0.172 18237
100 1 1 . 1 1 23 23 LEU N N 23 126.386 126.386 128.331 -1.945 18237
101 1 1 . 1 1 23 23 LEU C C 23 178.844 178.844 178.524 0.320 18237
102 1 1 . 1 1 23 23 LEU CA C 23 57.403 57.403 58.224 -0.821 18237
103 1 1 . 1 1 23 23 LEU CB C 23 41.061 41.061 42.136 -1.075 18237
104 1 1 . 1 1 23 23 LEU H H 23 8.562 8.562 8.192 0.370 18237
105 1 1 . 1 1 24 24 SER N N 24 113.100 113.100 114.324 -1.224 18237
106 1 1 . 1 1 24 24 SER HA H 24 4.621 4.621 4.097 0.524 18237
107 1 1 . 1 1 24 24 SER C C 24 176.676 176.676 176.323 0.353 18237
108 1 1 . 1 1 24 24 SER CA C 24 60.960 60.960 61.730 -0.770 18237
109 1 1 . 1 1 24 24 SER CB C 24 61.650 61.650 62.718 -1.068 18237
110 1 1 . 1 1 24 24 SER H H 24 9.098 9.098 8.648 0.450 18237
111 1 1 . 1 1 25 25 THR N N 25 116.715 116.715 117.901 -1.186 18237
112 1 1 . 1 1 25 25 THR HA H 25 3.915 3.915 4.085 -0.170 18237
113 1 1 . 1 1 25 25 THR CA C 25 64.599 64.599 65.873 -1.274 18237
114 1 1 . 1 1 25 25 THR CB C 25 68.657 68.657 68.981 -0.325 18237
115 1 1 . 1 1 25 25 THR H H 25 7.238 7.238 8.238 -1.000 18237
116 1 1 . 1 1 26 26 PHE N N 26 118.488 118.488 119.908 -1.420 18237
117 1 1 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.435 -0.325 18237
118 1 1 . 1 1 26 26 PHE C C 26 176.181 176.181 176.648 -0.467 18237
119 1 1 . 1 1 26 26 PHE CA C 26 58.627 58.627 60.194 -1.567 18237
120 1 1 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.587 0.207 18237
121 1 1 . 1 1 26 26 PHE H H 26 7.945 7.945 8.384 -0.439 18237
122 1 1 . 1 1 27 27 LEU N N 27 118.525 118.525 120.421 -1.896 18237
123 1 1 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.317 0.206 18237
124 1 1 . 1 1 27 27 LEU C C 27 177.752 177.752 177.651 0.101 18237
125 1 1 . 1 1 27 27 LEU CA C 27 54.679 54.679 56.054 -1.375 18237
126 1 1 . 1 1 27 27 LEU CB C 27 41.333 41.333 42.944 -1.611 18237
127 1 1 . 1 1 27 27 LEU H H 27 7.290 7.290 7.669 -0.379 18237
128 1 1 . 1 1 28 28 GLY N N 28 108.823 108.823 105.964 2.859 18237
129 1 1 . 1 1 28 28 GLY C C 28 174.630 174.630 174.139 0.491 18237
130 1 1 . 1 1 28 28 GLY CA C 28 45.374 45.374 44.805 0.569 18237
131 1 1 . 1 1 28 28 GLY H H 28 8.242 8.242 7.782 0.460 18237
132 1 1 . 1 1 29 29 SER N N 29 116.210 116.210 116.145 0.065 18237
133 1 1 . 1 1 29 29 SER HA H 29 4.626 4.626 4.560 0.066 18237
134 1 1 . 1 1 29 29 SER C C 29 175.312 175.312 175.133 0.179 18237
135 1 1 . 1 1 29 29 SER CA C 29 57.992 57.992 58.666 -0.673 18237
136 1 1 . 1 1 29 29 SER CB C 29 63.605 63.605 64.464 -0.859 18237
137 1 1 . 1 1 29 29 SER H H 29 8.310 8.310 7.510 0.800 18237
138 1 1 . 1 1 30 30 SER N N 30 118.892 118.892 115.345 3.547 18237
139 1 1 . 1 1 30 30 SER HA H 30 4.597 4.597 4.367 0.230 18237
140 1 1 . 1 1 30 30 SER C C 30 175.479 175.479 174.415 1.064 18237
141 1 1 . 1 1 30 30 SER CA C 30 58.582 58.582 58.548 0.034 18237
142 1 1 . 1 1 30 30 SER CB C 30 63.605 63.605 61.921 1.684 18237
143 1 1 . 1 1 30 30 SER H H 30 8.593 8.593 8.740 -0.147 18237
144 1 1 . 1 1 31 31 GLY N N 31 111.354 111.354 107.967 3.387 18237
145 1 1 . 1 1 31 31 GLY C C 31 174.428 174.428 173.435 0.993 18237
146 1 1 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.278 0.178 18237
147 1 1 . 1 1 31 31 GLY H H 31 8.584 8.584 8.181 0.403 18237
148 1 1 . 1 1 32 32 ASN N N 32 119.486 119.486 117.259 2.227 18237
149 1 1 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.737 0.080 18237
150 1 1 . 1 1 32 32 ASN C C 32 175.928 175.928 175.856 0.072 18237
151 1 1 . 1 1 32 32 ASN CA C 32 53.215 53.215 53.494 -0.279 18237
152 1 1 . 1 1 32 32 ASN CB C 32 38.780 38.780 39.407 -0.627 18237
153 1 1 . 1 1 32 32 ASN H H 32 8.393 8.393 8.034 0.359 18237
154 1 1 . 1 1 33 33 GLU N N 33 122.031 122.031 121.132 0.899 18237
155 1 1 . 1 1 33 33 GLU HA H 33 4.271 4.271 3.958 0.313 18237
156 1 1 . 1 1 33 33 GLU CA C 33 57.426 57.426 59.075 -1.649 18237
157 1 1 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.349 -0.021 18237
158 1 1 . 1 1 33 33 GLU H H 33 8.711 8.711 8.668 0.043 18237
159 1 1 . 1 1 34 34 GLN N N 34 120.866 120.866 118.512 2.354 18237
160 1 1 . 1 1 34 34 GLN HA H 34 4.271 4.271 4.016 0.255 18237
161 1 1 . 1 1 34 34 GLN CA C 34 56.226 56.226 59.262 -3.036 18237
162 1 1 . 1 1 34 34 GLN CB C 34 28.839 28.839 28.269 0.570 18237
163 1 1 . 1 1 34 34 GLN H H 34 8.438 8.438 8.442 -0.004 18237
164 1 1 . 1 1 35 35 GLU N N 35 122.323 122.323 118.947 3.376 18237
165 1 1 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.387 -0.068 18237
166 1 1 . 1 1 35 35 GLU C C 35 177.176 177.176 179.122 -1.946 18237
167 1 1 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.796 -1.800 18237
168 1 1 . 1 1 35 35 GLU CB C 35 29.545 29.545 29.347 0.198 18237
169 1 1 . 1 1 35 35 GLU H H 35 8.424 8.424 7.964 0.460 18237
170 1 1 . 1 1 36 36 LEU N N 36 122.904 122.904 119.681 3.223 18237
171 1 1 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.193 0.126 18237
172 1 1 . 1 1 36 36 LEU CA C 36 55.898 55.898 57.455 -1.557 18237
173 1 1 . 1 1 36 36 LEU CB C 36 41.496 41.496 42.232 -0.736 18237
174 1 1 . 1 1 36 36 LEU H H 36 8.342 8.342 7.352 0.990 18237
175 1 1 . 1 1 38 38 GLU N N 38 121.931 121.931 121.299 0.632 18237
176 1 1 . 1 1 38 38 GLU HA H 38 4.396 4.396 3.919 0.477 18237
177 1 1 . 1 1 38 38 GLU C C 38 177.318 177.318 178.482 -1.164 18237
178 1 1 . 1 1 38 38 GLU CA C 38 56.366 56.366 60.025 -3.659 18237
179 1 1 . 1 1 38 38 GLU CB C 38 29.328 29.328 29.638 -0.310 18237
180 1 1 . 1 1 38 38 GLU H H 38 8.342 8.342 8.237 0.105 18237
181 1 1 . 1 1 39 39 LEU N N 39 123.317 123.317 120.104 3.213 18237
182 1 1 . 1 1 39 39 LEU HA H 39 4.348 4.348 4.188 0.160 18237
183 1 1 . 1 1 39 39 LEU CA C 39 56.833 56.833 58.727 -1.894 18237
184 1 1 . 1 1 39 39 LEU CB C 39 41.387 41.387 42.036 -0.649 18237
185 1 1 . 1 1 39 39 LEU H H 39 8.342 8.342 8.151 0.191 18237
186 1 1 . 1 1 40 40 ASP N N 40 119.726 119.726 117.112 2.614 18237
187 1 1 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.350 0.221 18237
188 1 1 . 1 1 40 40 ASP CA C 40 55.589 55.589 57.848 -2.259 18237
189 1 1 . 1 1 40 40 ASP H H 40 8.530 8.530 8.614 -0.084 18237
190 1 1 . 1 1 41 41 LYS N N 41 121.200 121.200 120.809 0.391 18237
191 1 1 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.037 0.127 18237
192 1 1 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.720 -0.500 18237
193 1 1 . 1 1 41 41 LYS H H 41 8.145 8.145 7.677 0.468 18237
194 1 1 . 1 1 42 42 TRP N N 42 120.615 120.615 119.783 0.832 18237
195 1 1 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.385 0.212 18237
196 1 1 . 1 1 42 42 TRP C C 42 177.641 177.641 178.454 -0.813 18237
197 1 1 . 1 1 42 42 TRP CA C 42 58.561 58.561 59.375 -0.814 18237
198 1 1 . 1 1 42 42 TRP CB C 42 28.839 28.839 29.214 -0.375 18237
199 1 1 . 1 1 42 42 TRP H H 42 8.025 8.025 8.069 -0.045 18237
200 1 1 . 1 1 43 43 ALA N N 43 122.056 122.056 121.007 1.049 18237
201 1 1 . 1 1 43 43 ALA HA H 43 4.140 4.140 4.084 0.056 18237
202 1 1 . 1 1 43 43 ALA C C 43 172.776 172.776 179.762 -6.986 18237
203 1 1 . 1 1 43 43 ALA CA C 43 54.864 54.864 55.431 -0.568 18237
204 1 1 . 1 1 43 43 ALA CB C 43 17.974 17.974 17.951 0.023 18237
205 1 1 . 1 1 43 43 ALA H H 43 8.199 8.199 8.709 -0.510 18237
206 1 1 . 1 1 44 44 SER N N 44 113.378 113.378 114.693 -1.315 18237
207 1 1 . 1 1 44 44 SER HA H 44 4.376 4.376 4.307 0.069 18237
208 1 1 . 1 1 44 44 SER C C 44 176.767 176.767 176.772 -0.005 18237
209 1 1 . 1 1 44 44 SER CA C 44 60.980 60.980 61.457 -0.477 18237
210 1 1 . 1 1 44 44 SER CB C 44 62.410 62.410 62.630 -0.220 18237
211 1 1 . 1 1 44 44 SER H H 44 8.210 8.210 7.670 0.540 18237
212 1 1 . 1 1 45 45 LEU N N 45 123.425 123.425 121.819 1.606 18237
213 1 1 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.333 -0.139 18237
214 1 1 . 1 1 45 45 LEU CA C 45 57.606 57.606 58.336 -0.730 18237
215 1 1 . 1 1 45 45 LEU CB C 45 41.170 41.170 41.891 -0.721 18237
216 1 1 . 1 1 45 45 LEU H H 45 7.906 7.906 7.537 0.369 18237
217 1 1 . 1 1 46 46 TRP N N 46 118.572 118.572 119.910 -1.338 18237
218 1 1 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.266 0.389 18237
219 1 1 . 1 1 46 46 TRP C C 46 177.838 177.838 176.927 0.911 18237
220 1 1 . 1 1 46 46 TRP CA C 46 58.907 58.907 60.630 -1.723 18237
221 1 1 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.360 -0.141 18237
222 1 1 . 1 1 46 46 TRP H H 46 8.043 8.043 8.327 -0.284 18237
223 1 1 . 1 1 47 47 ASN N N 47 116.564 116.564 116.999 -0.435 18237
224 1 1 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.700 -0.074 18237
225 1 1 . 1 1 47 47 ASN C C 47 176.904 176.904 177.246 -0.342 18237
226 1 1 . 1 1 47 47 ASN CA C 47 55.045 55.045 55.550 -0.505 18237
227 1 1 . 1 1 47 47 ASN CB C 47 38.563 38.563 39.139 -0.576 18237
228 1 1 . 1 1 47 47 ASN H H 47 8.174 8.174 8.440 -0.266 18237
229 1 1 . 1 1 48 48 TRP N N 48 121.421 121.421 121.096 0.325 18237
230 1 1 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.617 -0.250 18237
231 1 1 . 1 1 48 48 TRP CA C 48 59.517 59.517 58.398 1.119 18237
232 1 1 . 1 1 48 48 TRP CB C 48 28.893 28.893 29.984 -1.091 18237
233 1 1 . 1 1 48 48 TRP H H 48 8.145 8.145 7.695 0.450 18237
234 1 1 . 1 1 49 49 PHE N N 49 118.299 118.299 120.188 -1.889 18237
235 1 1 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.358 0.894 18237
236 1 1 . 1 1 49 49 PHE C C 49 175.565 175.565 175.556 0.009 18237
237 1 1 . 1 1 49 49 PHE CA C 49 58.887 58.887 58.728 0.159 18237
238 1 1 . 1 1 49 49 PHE CB C 49 38.671 38.671 38.044 0.627 18237
239 1 1 . 1 1 49 49 PHE H H 49 8.036 8.036 8.232 -0.196 18237
240 1 1 . 1 1 50 50 ASN N N 50 118.836 118.836 119.015 -0.179 18237
241 1 1 . 1 1 50 50 ASN HA H 50 4.626 4.626 3.926 0.700 18237
242 1 1 . 1 1 50 50 ASN C C 50 176.439 176.439 176.717 -0.278 18237
243 1 1 . 1 1 50 50 ASN CA C 50 53.215 53.215 55.121 -1.906 18237
244 1 1 . 1 1 50 50 ASN CB C 50 38.128 38.128 37.540 0.588 18237
245 1 1 . 1 1 50 50 ASN H H 50 7.795 7.795 7.567 0.228 18237
246 1 1 . 1 1 51 51 ILE N N 51 120.218 120.218 116.536 3.682 18237
247 1 1 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.858 -0.067 18237
248 1 1 . 1 1 51 51 ILE C C 51 177.202 177.202 177.152 0.050 18237
249 1 1 . 1 1 51 51 ILE CA C 51 63.102 63.102 65.076 -1.974 18237
250 1 1 . 1 1 51 51 ILE CB C 51 37.367 37.367 37.044 0.323 18237
251 1 1 . 1 1 51 51 ILE H H 51 8.147 8.147 7.105 1.042 18237
252 1 1 . 1 1 52 52 THR N N 52 115.352 115.352 114.508 0.844 18237
253 1 1 . 1 1 52 52 THR HA H 52 4.031 4.031 4.096 -0.065 18237
254 1 1 . 1 1 52 52 THR C C 52 176.095 176.095 176.021 0.074 18237
255 1 1 . 1 1 52 52 THR CA C 52 65.148 65.148 66.210 -1.062 18237
256 1 1 . 1 1 52 52 THR CB C 52 68.277 68.277 67.806 0.471 18237
257 1 1 . 1 1 52 52 THR H H 52 8.009 8.009 7.177 0.832 18237
258 1 1 . 1 1 53 53 ASN N N 53 119.874 119.874 120.893 -1.019 18237
259 1 1 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.181 0.455 18237
260 1 1 . 1 1 53 53 ASN C C 53 176.530 176.530 176.928 -0.398 18237
261 1 1 . 1 1 53 53 ASN CA C 53 54.457 54.457 55.485 -1.028 18237
262 1 1 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.426 0.376 18237
263 1 1 . 1 1 53 53 ASN H H 53 7.972 7.972 6.919 1.053 18237
264 1 1 . 1 1 54 54 TRP N N 54 120.192 120.192 119.792 0.400 18237
265 1 1 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.512 0.143 18237
266 1 1 . 1 1 54 54 TRP CA C 54 58.643 58.643 59.556 -0.913 18237
267 1 1 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.049 0.116 18237
268 1 1 . 1 1 54 54 TRP H H 54 7.897 7.897 7.046 0.851 18237
269 1 1 . 1 1 55 55 LEU N N 55 118.354 118.354 120.116 -1.762 18237
270 1 1 . 1 1 55 55 LEU HA H 55 4.088 4.088 3.872 0.216 18237
271 1 1 . 1 1 55 55 LEU C C 55 177.975 177.975 179.342 -1.367 18237
272 1 1 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.061 -1.591 18237
273 1 1 . 1 1 55 55 LEU CB C 55 40.898 40.898 41.830 -0.932 18237
274 1 1 . 1 1 55 55 LEU H H 55 7.931 7.931 7.681 0.250 18237
275 1 1 . 1 1 56 56 TRP N N 56 118.335 118.335 117.367 0.968 18237
276 1 1 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.339 0.028 18237
277 1 1 . 1 1 56 56 TRP C C 56 176.863 176.863 178.393 -1.530 18237
278 1 1 . 1 1 56 56 TRP CA C 56 59.070 59.070 61.058 -1.988 18237
279 1 1 . 1 1 56 56 TRP CB C 56 28.839 28.839 28.817 0.022 18237
280 1 1 . 1 1 56 56 TRP H H 56 7.665 7.665 7.886 -0.221 18237
281 1 1 . 1 1 57 57 TYR N N 57 116.808 116.808 119.402 -2.594 18237
282 1 1 . 1 1 57 57 TYR HA H 57 4.172 4.172 4.366 -0.194 18237
283 1 1 . 1 1 57 57 TYR C C 57 176.085 176.085 177.143 -1.058 18237
284 1 1 . 1 1 57 57 TYR CA C 57 59.865 59.865 60.948 -1.083 18237
285 1 1 . 1 1 57 57 TYR CB C 57 38.563 38.563 39.006 -0.443 18237
286 1 1 . 1 1 57 57 TYR H H 57 7.578 7.578 7.481 0.097 18237
287 1 1 . 1 1 58 58 ILE N N 58 115.526 115.526 113.546 1.980 18237
288 1 1 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.318 -0.053 18237
289 1 1 . 1 1 58 58 ILE C C 58 174.782 174.782 176.742 -1.960 18237
290 1 1 . 1 1 58 58 ILE CA C 58 60.940 60.940 61.312 -0.372 18237
291 1 1 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.107 0.075 18237
292 1 1 . 1 1 58 58 ILE H H 58 7.586 7.586 8.585 -0.999 18237
293 1 2 . 1 1 2 2 TYR N N 2 120.470 120.470 120.323 0.147 18237
294 1 2 . 1 1 2 2 TYR C C 2 176.535 176.535 176.794 -0.259 18237
295 1 2 . 1 1 2 2 TYR CA C 2 55.995 55.995 57.329 -1.334 18237
296 1 2 . 1 1 2 2 TYR CB C 2 37.313 37.313 39.370 -2.057 18237
297 1 2 . 1 1 2 2 TYR H H 2 7.951 7.951 7.993 -0.042 18237
298 1 2 . 1 1 3 3 ILE N N 3 118.307 118.307 120.178 -1.871 18237
299 1 2 . 1 1 3 3 ILE CA C 3 58.968 58.968 60.512 -1.544 18237
300 1 2 . 1 1 3 3 ILE CB C 3 38.074 38.074 37.594 0.480 18237
301 1 2 . 1 1 3 3 ILE H H 3 8.381 8.381 8.534 -0.153 18237
302 1 2 . 1 1 5 5 GLU N N 5 118.785 118.785 115.962 2.823 18237
303 1 2 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.270 -0.015 18237
304 1 2 . 1 1 5 5 GLU C C 5 176.267 176.267 174.041 2.226 18237
305 1 2 . 1 1 5 5 GLU CA C 5 55.959 55.959 56.246 -0.287 18237
306 1 2 . 1 1 5 5 GLU CB C 5 30.034 30.034 29.963 0.071 18237
307 1 2 . 1 1 5 5 GLU H H 5 7.710 7.710 8.256 -0.546 18237
308 1 2 . 1 1 6 6 ALA N N 6 131.546 131.546 127.445 4.101 18237
309 1 2 . 1 1 6 6 ALA HA H 6 3.575 3.575 3.937 -0.362 18237
310 1 2 . 1 1 6 6 ALA CA C 6 50.959 50.959 50.258 0.701 18237
311 1 2 . 1 1 6 6 ALA CB C 6 14.389 14.389 19.020 -4.631 18237
312 1 2 . 1 1 6 6 ALA H H 6 8.338 8.338 8.086 0.252 18237
313 1 2 . 1 1 8 8 ARG N N 8 126.915 126.915 120.980 5.935 18237
314 1 2 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.503 -0.433 18237
315 1 2 . 1 1 8 8 ARG C C 8 175.110 175.110 175.149 -0.039 18237
316 1 2 . 1 1 8 8 ARG CA C 8 54.699 54.699 55.980 -1.281 18237
317 1 2 . 1 1 8 8 ARG CB C 8 28.078 28.078 31.014 -2.936 18237
318 1 2 . 1 1 8 8 ARG H H 8 8.725 8.725 8.392 0.333 18237
319 1 2 . 1 1 9 9 ASP N N 9 123.653 123.653 124.491 -0.838 18237
320 1 2 . 1 1 9 9 ASP C C 9 178.015 178.015 176.929 1.086 18237
321 1 2 . 1 1 9 9 ASP CA C 9 52.747 52.747 54.543 -1.796 18237
322 1 2 . 1 1 9 9 ASP CB C 9 40.844 40.844 41.394 -0.550 18237
323 1 2 . 1 1 9 9 ASP H H 9 8.432 8.432 8.755 -0.323 18237
324 1 2 . 1 1 10 10 GLY N N 10 111.908 111.908 108.295 3.613 18237
325 1 2 . 1 1 10 10 GLY C C 10 174.822 174.822 174.622 0.200 18237
326 1 2 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.145 0.099 18237
327 1 2 . 1 1 10 10 GLY H H 10 9.727 9.727 8.636 1.091 18237
328 1 2 . 1 1 11 11 GLN N N 11 118.395 118.395 120.267 -1.872 18237
329 1 2 . 1 1 11 11 GLN C C 11 174.711 174.711 174.798 -0.087 18237
330 1 2 . 1 1 11 11 GLN CA C 11 53.398 53.398 55.022 -1.624 18237
331 1 2 . 1 1 11 11 GLN CB C 11 30.306 30.306 30.232 0.074 18237
332 1 2 . 1 1 11 11 GLN H H 11 8.416 8.416 8.117 0.299 18237
333 1 2 . 1 1 12 12 ALA N N 12 121.020 121.020 122.488 -1.468 18237
334 1 2 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.663 0.280 18237
335 1 2 . 1 1 12 12 ALA C C 12 177.990 177.990 175.347 2.643 18237
336 1 2 . 1 1 12 12 ALA CA C 12 50.511 50.511 51.164 -0.653 18237
337 1 2 . 1 1 12 12 ALA CB C 12 20.147 20.147 21.023 -0.876 18237
338 1 2 . 1 1 12 12 ALA H H 12 7.933 7.933 8.148 -0.215 18237
339 1 2 . 1 1 13 13 TYR N N 13 121.755 121.755 119.358 2.397 18237
340 1 2 . 1 1 13 13 TYR C C 13 175.519 175.519 175.188 0.331 18237
341 1 2 . 1 1 13 13 TYR CA C 13 59.090 59.090 57.256 1.834 18237
342 1 2 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.936 1.244 18237
343 1 2 . 1 1 13 13 TYR H H 13 9.575 9.575 8.575 1.000 18237
344 1 2 . 1 1 14 14 VAL N N 14 112.251 112.251 120.958 -8.707 18237
345 1 2 . 1 1 14 14 VAL C C 14 174.074 174.074 174.985 -0.911 18237
346 1 2 . 1 1 14 14 VAL CA C 14 59.090 59.090 59.360 -0.270 18237
347 1 2 . 1 1 14 14 VAL CB C 14 32.750 32.750 35.854 -3.104 18237
348 1 2 . 1 1 14 14 VAL H H 14 9.659 9.659 9.119 0.540 18237
349 1 2 . 1 1 15 15 ARG N N 15 124.657 124.657 124.237 0.420 18237
350 1 2 . 1 1 15 15 ARG C C 15 174.948 174.948 175.252 -0.304 18237
351 1 2 . 1 1 15 15 ARG CA C 15 53.520 53.520 56.009 -2.489 18237
352 1 2 . 1 1 15 15 ARG CB C 15 32.533 32.533 30.367 2.166 18237
353 1 2 . 1 1 15 15 ARG H H 15 8.503 8.503 8.541 -0.038 18237
354 1 2 . 1 1 16 16 LYS N N 16 128.240 128.240 127.654 0.586 18237
355 1 2 . 1 1 16 16 LYS C C 16 175.974 175.974 175.453 0.521 18237
356 1 2 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.509 0.267 18237
357 1 2 . 1 1 16 16 LYS CB C 16 36.553 36.553 35.203 1.350 18237
358 1 2 . 1 1 16 16 LYS H H 16 9.052 9.052 8.718 0.334 18237
359 1 2 . 1 1 17 17 ASP N N 17 130.562 130.562 125.029 5.533 18237
360 1 2 . 1 1 17 17 ASP C C 17 175.822 175.822 176.296 -0.474 18237
361 1 2 . 1 1 17 17 ASP CA C 17 56.447 56.447 54.523 1.924 18237
362 1 2 . 1 1 17 17 ASP CB C 17 40.192 40.192 39.230 0.962 18237
363 1 2 . 1 1 17 17 ASP H H 17 10.886 10.886 9.014 1.872 18237
364 1 2 . 1 1 18 18 GLY N N 18 104.754 104.754 105.854 -1.100 18237
365 1 2 . 1 1 18 18 GLY C C 18 173.104 173.104 173.197 -0.093 18237
366 1 2 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.503 -0.259 18237
367 1 2 . 1 1 18 18 GLY H H 18 9.353 9.353 8.479 0.874 18237
368 1 2 . 1 1 19 19 GLU N N 19 117.501 117.501 117.482 0.019 18237
369 1 2 . 1 1 19 19 GLU HA H 19 4.648 4.648 4.375 0.273 18237
370 1 2 . 1 1 19 19 GLU C C 19 176.166 176.166 174.738 1.428 18237
371 1 2 . 1 1 19 19 GLU CA C 19 53.865 53.865 54.199 -0.334 18237
372 1 2 . 1 1 19 19 GLU CB C 19 33.130 33.130 33.580 -0.450 18237
373 1 2 . 1 1 19 19 GLU H H 19 7.813 7.813 7.945 -0.132 18237
374 1 2 . 1 1 20 20 TRP N N 20 122.768 122.768 121.752 1.016 18237
375 1 2 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.649 -0.982 18237
376 1 2 . 1 1 20 20 TRP C C 20 176.302 176.302 175.993 0.309 18237
377 1 2 . 1 1 20 20 TRP CA C 20 55.878 55.878 55.158 0.720 18237
378 1 2 . 1 1 20 20 TRP CB C 20 29.545 29.545 29.165 0.380 18237
379 1 2 . 1 1 20 20 TRP H H 20 9.094 9.094 7.351 1.743 18237
380 1 2 . 1 1 21 21 VAL N N 21 123.071 123.071 124.287 -1.216 18237
381 1 2 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.502 0.483 18237
382 1 2 . 1 1 21 21 VAL C C 21 175.640 175.640 175.839 -0.199 18237
383 1 2 . 1 1 21 21 VAL CA C 21 59.537 59.537 60.589 -1.052 18237
384 1 2 . 1 1 21 21 VAL CB C 21 34.651 34.651 35.420 -0.769 18237
385 1 2 . 1 1 21 21 VAL H H 21 9.868 9.868 8.496 1.372 18237
386 1 2 . 1 1 22 22 LEU N N 22 127.193 127.193 128.678 -1.485 18237
387 1 2 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.140 0.282 18237
388 1 2 . 1 1 22 22 LEU C C 22 179.268 179.268 178.662 0.606 18237
389 1 2 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.791 -0.157 18237
390 1 2 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.523 -0.244 18237
391 1 2 . 1 1 22 22 LEU H H 22 8.812 8.812 8.994 -0.182 18237
392 1 2 . 1 1 23 23 LEU N N 23 126.386 126.386 128.575 -2.189 18237
393 1 2 . 1 1 23 23 LEU C C 23 178.844 178.844 178.438 0.406 18237
394 1 2 . 1 1 23 23 LEU CA C 23 57.403 57.403 58.196 -0.793 18237
395 1 2 . 1 1 23 23 LEU CB C 23 41.061 41.061 42.129 -1.068 18237
396 1 2 . 1 1 23 23 LEU H H 23 8.562 8.562 8.038 0.524 18237
397 1 2 . 1 1 24 24 SER N N 24 113.100 113.100 113.333 -0.233 18237
398 1 2 . 1 1 24 24 SER HA H 24 4.621 4.621 4.112 0.509 18237
399 1 2 . 1 1 24 24 SER C C 24 176.676 176.676 176.326 0.350 18237
400 1 2 . 1 1 24 24 SER CA C 24 60.960 60.960 61.676 -0.716 18237
401 1 2 . 1 1 24 24 SER CB C 24 61.650 61.650 62.111 -0.461 18237
402 1 2 . 1 1 24 24 SER H H 24 9.098 9.098 8.607 0.491 18237
403 1 2 . 1 1 25 25 THR N N 25 116.715 116.715 118.586 -1.871 18237
404 1 2 . 1 1 25 25 THR HA H 25 3.915 3.915 4.164 -0.249 18237
405 1 2 . 1 1 25 25 THR CA C 25 64.599 64.599 65.993 -1.394 18237
406 1 2 . 1 1 25 25 THR CB C 25 68.657 68.657 68.609 0.048 18237
407 1 2 . 1 1 25 25 THR H H 25 7.238 7.238 8.216 -0.978 18237
408 1 2 . 1 1 26 26 PHE N N 26 118.488 118.488 120.043 -1.555 18237
409 1 2 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.438 -0.328 18237
410 1 2 . 1 1 26 26 PHE C C 26 176.181 176.181 176.734 -0.553 18237
411 1 2 . 1 1 26 26 PHE CA C 26 58.627 58.627 60.054 -1.427 18237
412 1 2 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.736 0.057 18237
413 1 2 . 1 1 26 26 PHE H H 26 7.945 7.945 8.287 -0.342 18237
414 1 2 . 1 1 27 27 LEU N N 27 118.525 118.525 119.646 -1.121 18237
415 1 2 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.331 0.192 18237
416 1 2 . 1 1 27 27 LEU C C 27 177.752 177.752 177.991 -0.239 18237
417 1 2 . 1 1 27 27 LEU CA C 27 54.679 54.679 56.067 -1.388 18237
418 1 2 . 1 1 27 27 LEU CB C 27 41.333 41.333 42.530 -1.197 18237
419 1 2 . 1 1 27 27 LEU H H 27 7.290 7.290 7.773 -0.483 18237
420 1 2 . 1 1 28 28 GLY N N 28 108.823 108.823 105.995 2.828 18237
421 1 2 . 1 1 28 28 GLY C C 28 174.630 174.630 174.228 0.402 18237
422 1 2 . 1 1 28 28 GLY CA C 28 45.374 45.374 45.211 0.163 18237
423 1 2 . 1 1 28 28 GLY H H 28 8.242 8.242 8.276 -0.034 18237
424 1 2 . 1 1 29 29 SER N N 29 116.210 116.210 116.488 -0.278 18237
425 1 2 . 1 1 29 29 SER HA H 29 4.626 4.626 4.563 0.063 18237
426 1 2 . 1 1 29 29 SER C C 29 175.312 175.312 175.882 -0.570 18237
427 1 2 . 1 1 29 29 SER CA C 29 57.992 57.992 58.101 -0.109 18237
428 1 2 . 1 1 29 29 SER CB C 29 63.605 63.605 64.842 -1.237 18237
429 1 2 . 1 1 29 29 SER H H 29 8.310 8.310 7.546 0.764 18237
430 1 2 . 1 1 30 30 SER N N 30 118.892 118.892 113.209 5.683 18237
431 1 2 . 1 1 30 30 SER HA H 30 4.597 4.597 4.278 0.319 18237
432 1 2 . 1 1 30 30 SER C C 30 175.479 175.479 174.834 0.645 18237
433 1 2 . 1 1 30 30 SER CA C 30 58.582 58.582 59.689 -1.107 18237
434 1 2 . 1 1 30 30 SER CB C 30 63.605 63.605 61.589 2.016 18237
435 1 2 . 1 1 30 30 SER H H 30 8.593 8.593 8.608 -0.015 18237
436 1 2 . 1 1 31 31 GLY N N 31 111.354 111.354 110.313 1.041 18237
437 1 2 . 1 1 31 31 GLY C C 31 174.428 174.428 175.518 -1.090 18237
438 1 2 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.610 -0.154 18237
439 1 2 . 1 1 31 31 GLY H H 31 8.584 8.584 8.088 0.496 18237
440 1 2 . 1 1 32 32 ASN N N 32 119.486 119.486 119.464 0.022 18237
441 1 2 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.636 0.181 18237
442 1 2 . 1 1 32 32 ASN C C 32 175.928 175.928 176.335 -0.407 18237
443 1 2 . 1 1 32 32 ASN CA C 32 53.215 53.215 52.360 0.855 18237
444 1 2 . 1 1 32 32 ASN CB C 32 38.780 38.780 37.701 1.079 18237
445 1 2 . 1 1 32 32 ASN H H 32 8.393 8.393 8.612 -0.219 18237
446 1 2 . 1 1 33 33 GLU N N 33 122.031 122.031 120.732 1.299 18237
447 1 2 . 1 1 33 33 GLU HA H 33 4.271 4.271 3.982 0.289 18237
448 1 2 . 1 1 33 33 GLU CA C 33 57.426 57.426 58.903 -1.477 18237
449 1 2 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.401 -0.073 18237
450 1 2 . 1 1 33 33 GLU H H 33 8.711 8.711 8.556 0.155 18237
451 1 2 . 1 1 34 34 GLN N N 34 120.866 120.866 118.585 2.281 18237
452 1 2 . 1 1 34 34 GLN HA H 34 4.271 4.271 4.021 0.250 18237
453 1 2 . 1 1 34 34 GLN CA C 34 56.226 56.226 59.033 -2.807 18237
454 1 2 . 1 1 34 34 GLN CB C 34 28.839 28.839 28.682 0.157 18237
455 1 2 . 1 1 34 34 GLN H H 34 8.438 8.438 7.540 0.898 18237
456 1 2 . 1 1 35 35 GLU N N 35 122.323 122.323 119.832 2.491 18237
457 1 2 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.181 0.138 18237
458 1 2 . 1 1 35 35 GLU C C 35 177.176 177.176 179.033 -1.857 18237
459 1 2 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.556 -1.560 18237
460 1 2 . 1 1 35 35 GLU CB C 35 29.545 29.545 29.069 0.476 18237
461 1 2 . 1 1 35 35 GLU H H 35 8.424 8.424 7.745 0.679 18237
462 1 2 . 1 1 36 36 LEU N N 36 122.904 122.904 117.862 5.042 18237
463 1 2 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.109 0.210 18237
464 1 2 . 1 1 36 36 LEU CA C 36 55.898 55.898 56.785 -0.887 18237
465 1 2 . 1 1 36 36 LEU CB C 36 41.496 41.496 41.746 -0.250 18237
466 1 2 . 1 1 36 36 LEU H H 36 8.342 8.342 7.462 0.880 18237
467 1 2 . 1 1 38 38 GLU N N 38 121.931 121.931 120.993 0.938 18237
468 1 2 . 1 1 38 38 GLU HA H 38 4.396 4.396 4.089 0.307 18237
469 1 2 . 1 1 38 38 GLU C C 38 177.318 177.318 178.112 -0.794 18237
470 1 2 . 1 1 38 38 GLU CA C 38 56.366 56.366 59.385 -3.019 18237
471 1 2 . 1 1 38 38 GLU CB C 38 29.328 29.328 29.744 -0.416 18237
472 1 2 . 1 1 38 38 GLU H H 38 8.342 8.342 7.916 0.426 18237
473 1 2 . 1 1 39 39 LEU N N 39 123.317 123.317 119.309 4.008 18237
474 1 2 . 1 1 39 39 LEU HA H 39 4.348 4.348 2.174 2.174 18237
475 1 2 . 1 1 39 39 LEU CA C 39 56.833 56.833 58.243 -1.410 18237
476 1 2 . 1 1 39 39 LEU CB C 39 41.387 41.387 41.479 -0.092 18237
477 1 2 . 1 1 39 39 LEU H H 39 8.342 8.342 7.176 1.166 18237
478 1 2 . 1 1 40 40 ASP N N 40 119.726 119.726 115.729 3.997 18237
479 1 2 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.255 0.316 18237
480 1 2 . 1 1 40 40 ASP CA C 40 55.589 55.589 56.897 -1.308 18237
481 1 2 . 1 1 40 40 ASP H H 40 8.530 8.530 8.414 0.116 18237
482 1 2 . 1 1 41 41 LYS N N 41 121.200 121.200 118.849 2.351 18237
483 1 2 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.344 -0.180 18237
484 1 2 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.051 0.169 18237
485 1 2 . 1 1 41 41 LYS H H 41 8.145 8.145 7.806 0.339 18237
486 1 2 . 1 1 42 42 TRP N N 42 120.615 120.615 120.725 -0.110 18237
487 1 2 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.402 0.195 18237
488 1 2 . 1 1 42 42 TRP C C 42 177.641 177.641 178.275 -0.634 18237
489 1 2 . 1 1 42 42 TRP CA C 42 58.561 58.561 58.840 -0.279 18237
490 1 2 . 1 1 42 42 TRP CB C 42 28.839 28.839 28.190 0.649 18237
491 1 2 . 1 1 42 42 TRP H H 42 8.025 8.025 8.412 -0.387 18237
492 1 2 . 1 1 43 43 ALA N N 43 122.056 122.056 120.937 1.119 18237
493 1 2 . 1 1 43 43 ALA HA H 43 4.140 4.140 4.172 -0.032 18237
494 1 2 . 1 1 43 43 ALA C C 43 172.776 172.776 179.992 -7.216 18237
495 1 2 . 1 1 43 43 ALA CA C 43 54.864 54.864 55.221 -0.357 18237
496 1 2 . 1 1 43 43 ALA CB C 43 17.974 17.974 17.960 0.014 18237
497 1 2 . 1 1 43 43 ALA H H 43 8.199 8.199 7.978 0.221 18237
498 1 2 . 1 1 44 44 SER N N 44 113.378 113.378 115.080 -1.702 18237
499 1 2 . 1 1 44 44 SER HA H 44 4.376 4.376 4.238 0.138 18237
500 1 2 . 1 1 44 44 SER C C 44 176.767 176.767 176.909 -0.142 18237
501 1 2 . 1 1 44 44 SER CA C 44 60.980 60.980 62.362 -1.382 18237
502 1 2 . 1 1 44 44 SER CB C 44 62.410 62.410 62.927 -0.517 18237
503 1 2 . 1 1 44 44 SER H H 44 8.210 8.210 8.488 -0.278 18237
504 1 2 . 1 1 45 45 LEU N N 45 123.425 123.425 122.329 1.096 18237
505 1 2 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.177 0.017 18237
506 1 2 . 1 1 45 45 LEU CA C 45 57.606 57.606 57.829 -0.223 18237
507 1 2 . 1 1 45 45 LEU CB C 45 41.170 41.170 41.666 -0.496 18237
508 1 2 . 1 1 45 45 LEU H H 45 7.906 7.906 7.621 0.285 18237
509 1 2 . 1 1 46 46 TRP N N 46 118.572 118.572 117.550 1.022 18237
510 1 2 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.371 0.284 18237
511 1 2 . 1 1 46 46 TRP C C 46 177.838 177.838 179.150 -1.312 18237
512 1 2 . 1 1 46 46 TRP CA C 46 58.907 58.907 60.325 -1.417 18237
513 1 2 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.253 -0.035 18237
514 1 2 . 1 1 46 46 TRP H H 46 8.043 8.043 7.885 0.158 18237
515 1 2 . 1 1 47 47 ASN N N 47 116.564 116.564 117.887 -1.323 18237
516 1 2 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.787 -0.161 18237
517 1 2 . 1 1 47 47 ASN C C 47 176.904 176.904 177.383 -0.479 18237
518 1 2 . 1 1 47 47 ASN CA C 47 55.045 55.045 55.619 -0.574 18237
519 1 2 . 1 1 47 47 ASN CB C 47 38.563 38.563 38.741 -0.178 18237
520 1 2 . 1 1 47 47 ASN H H 47 8.174 8.174 8.736 -0.562 18237
521 1 2 . 1 1 48 48 TRP N N 48 121.421 121.421 121.524 -0.103 18237
522 1 2 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.674 -0.307 18237
523 1 2 . 1 1 48 48 TRP CA C 48 59.517 59.517 58.175 1.342 18237
524 1 2 . 1 1 48 48 TRP CB C 48 28.893 28.893 28.861 0.032 18237
525 1 2 . 1 1 48 48 TRP H H 48 8.145 8.145 8.281 -0.136 18237
526 1 2 . 1 1 49 49 PHE N N 49 118.299 118.299 122.371 -4.072 18237
527 1 2 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.829 0.423 18237
528 1 2 . 1 1 49 49 PHE C C 49 175.565 175.565 174.605 0.960 18237
529 1 2 . 1 1 49 49 PHE CA C 49 58.887 58.887 57.382 1.505 18237
530 1 2 . 1 1 49 49 PHE CB C 49 38.671 38.671 38.536 0.135 18237
531 1 2 . 1 1 49 49 PHE H H 49 8.036 8.036 7.799 0.237 18237
532 1 2 . 1 1 50 50 ASN N N 50 118.836 118.836 119.477 -0.641 18237
533 1 2 . 1 1 50 50 ASN HA H 50 4.626 4.626 4.100 0.526 18237
534 1 2 . 1 1 50 50 ASN C C 50 176.439 176.439 176.791 -0.352 18237
535 1 2 . 1 1 50 50 ASN CA C 50 53.215 53.215 55.087 -1.872 18237
536 1 2 . 1 1 50 50 ASN CB C 50 38.128 38.128 38.323 -0.195 18237
537 1 2 . 1 1 50 50 ASN H H 50 7.795 7.795 7.660 0.135 18237
538 1 2 . 1 1 51 51 ILE N N 51 120.218 120.218 116.462 3.756 18237
539 1 2 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.810 -0.019 18237
540 1 2 . 1 1 51 51 ILE C C 51 177.202 177.202 176.954 0.248 18237
541 1 2 . 1 1 51 51 ILE CA C 51 63.102 63.102 64.936 -1.835 18237
542 1 2 . 1 1 51 51 ILE CB C 51 37.367 37.367 37.193 0.174 18237
543 1 2 . 1 1 51 51 ILE H H 51 8.147 8.147 7.011 1.136 18237
544 1 2 . 1 1 52 52 THR N N 52 115.352 115.352 112.787 2.565 18237
545 1 2 . 1 1 52 52 THR HA H 52 4.031 4.031 3.998 0.033 18237
546 1 2 . 1 1 52 52 THR C C 52 176.095 176.095 176.513 -0.418 18237
547 1 2 . 1 1 52 52 THR CA C 52 65.148 65.148 65.201 -0.053 18237
548 1 2 . 1 1 52 52 THR CB C 52 68.277 68.277 67.591 0.686 18237
549 1 2 . 1 1 52 52 THR H H 52 8.009 8.009 7.199 0.810 18237
550 1 2 . 1 1 53 53 ASN N N 53 119.874 119.874 121.261 -1.387 18237
551 1 2 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.251 0.385 18237
552 1 2 . 1 1 53 53 ASN C C 53 176.530 176.530 176.977 -0.447 18237
553 1 2 . 1 1 53 53 ASN CA C 53 54.457 54.457 55.672 -1.215 18237
554 1 2 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.672 0.130 18237
555 1 2 . 1 1 53 53 ASN H H 53 7.972 7.972 7.051 0.921 18237
556 1 2 . 1 1 54 54 TRP N N 54 120.192 120.192 120.174 0.018 18237
557 1 2 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.499 0.156 18237
558 1 2 . 1 1 54 54 TRP CA C 54 58.643 58.643 59.044 -0.401 18237
559 1 2 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.220 -0.055 18237
560 1 2 . 1 1 54 54 TRP H H 54 7.897 7.897 7.397 0.500 18237
561 1 2 . 1 1 55 55 LEU N N 55 118.354 118.354 122.200 -3.846 18237
562 1 2 . 1 1 55 55 LEU HA H 55 4.088 4.088 3.977 0.111 18237
563 1 2 . 1 1 55 55 LEU C C 55 177.975 177.975 178.993 -1.018 18237
564 1 2 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.344 -1.874 18237
565 1 2 . 1 1 55 55 LEU CB C 55 40.898 40.898 42.118 -1.220 18237
566 1 2 . 1 1 55 55 LEU H H 55 7.931 7.931 8.227 -0.296 18237
567 1 2 . 1 1 56 56 TRP N N 56 118.335 118.335 117.438 0.897 18237
568 1 2 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.339 0.028 18237
569 1 2 . 1 1 56 56 TRP C C 56 176.863 176.863 178.378 -1.515 18237
570 1 2 . 1 1 56 56 TRP CA C 56 59.070 59.070 61.072 -2.002 18237
571 1 2 . 1 1 56 56 TRP CB C 56 28.839 28.839 28.861 -0.022 18237
572 1 2 . 1 1 56 56 TRP H H 56 7.665 7.665 7.863 -0.198 18237
573 1 2 . 1 1 57 57 TYR N N 57 116.808 116.808 118.501 -1.693 18237
574 1 2 . 1 1 57 57 TYR HA H 57 4.172 4.172 4.407 -0.235 18237
575 1 2 . 1 1 57 57 TYR C C 57 176.085 176.085 176.702 -0.617 18237
576 1 2 . 1 1 57 57 TYR CA C 57 59.865 59.865 61.071 -1.206 18237
577 1 2 . 1 1 57 57 TYR CB C 57 38.563 38.563 38.868 -0.305 18237
578 1 2 . 1 1 57 57 TYR H H 57 7.578 7.578 7.424 0.154 18237
579 1 2 . 1 1 58 58 ILE N N 58 115.526 115.526 118.197 -2.671 18237
580 1 2 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.161 0.104 18237
581 1 2 . 1 1 58 58 ILE C C 58 174.782 174.782 175.380 -0.598 18237
582 1 2 . 1 1 58 58 ILE CA C 58 60.940 60.940 60.911 0.029 18237
583 1 2 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.667 -0.485 18237
584 1 2 . 1 1 58 58 ILE H H 58 7.586 7.586 8.156 -0.570 18237
585 1 3 . 1 1 2 2 TYR N N 2 120.470 120.470 120.505 -0.035 18237
586 1 3 . 1 1 2 2 TYR C C 2 176.535 176.535 176.158 0.377 18237
587 1 3 . 1 1 2 2 TYR CA C 2 55.995 55.995 57.928 -1.933 18237
588 1 3 . 1 1 2 2 TYR CB C 2 37.313 37.313 39.391 -2.078 18237
589 1 3 . 1 1 2 2 TYR H H 2 7.951 7.951 8.304 -0.353 18237
590 1 3 . 1 1 3 3 ILE N N 3 118.307 118.307 119.550 -1.243 18237
591 1 3 . 1 1 3 3 ILE CA C 3 58.968 58.968 60.896 -1.928 18237
592 1 3 . 1 1 3 3 ILE CB C 3 38.074 38.074 36.566 1.508 18237
593 1 3 . 1 1 3 3 ILE H H 3 8.381 8.381 8.462 -0.081 18237
594 1 3 . 1 1 5 5 GLU N N 5 118.785 118.785 119.306 -0.521 18237
595 1 3 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.165 0.090 18237
596 1 3 . 1 1 5 5 GLU C C 5 176.267 176.267 175.928 0.339 18237
597 1 3 . 1 1 5 5 GLU CA C 5 55.959 55.959 57.157 -1.198 18237
598 1 3 . 1 1 5 5 GLU CB C 5 30.034 30.034 30.097 -0.063 18237
599 1 3 . 1 1 5 5 GLU H H 5 7.710 7.710 8.535 -0.825 18237
600 1 3 . 1 1 6 6 ALA N N 6 131.546 131.546 120.232 11.314 18237
601 1 3 . 1 1 6 6 ALA HA H 6 3.575 3.575 3.476 0.099 18237
602 1 3 . 1 1 6 6 ALA CA C 6 50.959 50.959 50.400 0.559 18237
603 1 3 . 1 1 6 6 ALA CB C 6 14.389 14.389 19.551 -5.162 18237
604 1 3 . 1 1 6 6 ALA H H 6 8.338 8.338 7.782 0.556 18237
605 1 3 . 1 1 8 8 ARG N N 8 126.915 126.915 124.779 2.136 18237
606 1 3 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.490 -0.420 18237
607 1 3 . 1 1 8 8 ARG C C 8 175.110 175.110 175.135 -0.025 18237
608 1 3 . 1 1 8 8 ARG CA C 8 54.699 54.699 55.900 -1.200 18237
609 1 3 . 1 1 8 8 ARG CB C 8 28.078 28.078 30.259 -2.182 18237
610 1 3 . 1 1 8 8 ARG H H 8 8.725 8.725 8.452 0.273 18237
611 1 3 . 1 1 9 9 ASP N N 9 123.653 123.653 126.705 -3.052 18237
612 1 3 . 1 1 9 9 ASP C C 9 178.015 178.015 176.608 1.407 18237
613 1 3 . 1 1 9 9 ASP CA C 9 52.747 52.747 54.462 -1.715 18237
614 1 3 . 1 1 9 9 ASP CB C 9 40.844 40.844 41.223 -0.379 18237
615 1 3 . 1 1 9 9 ASP H H 9 8.432 8.432 8.814 -0.382 18237
616 1 3 . 1 1 10 10 GLY N N 10 111.908 111.908 108.250 3.658 18237
617 1 3 . 1 1 10 10 GLY C C 10 174.822 174.822 174.512 0.310 18237
618 1 3 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.125 0.119 18237
619 1 3 . 1 1 10 10 GLY H H 10 9.727 9.727 8.645 1.082 18237
620 1 3 . 1 1 11 11 GLN N N 11 118.395 118.395 118.517 -0.122 18237
621 1 3 . 1 1 11 11 GLN C C 11 174.711 174.711 174.371 0.340 18237
622 1 3 . 1 1 11 11 GLN CA C 11 53.398 53.398 54.840 -1.442 18237
623 1 3 . 1 1 11 11 GLN CB C 11 30.306 30.306 29.602 0.705 18237
624 1 3 . 1 1 11 11 GLN H H 11 8.416 8.416 7.794 0.622 18237
625 1 3 . 1 1 12 12 ALA N N 12 121.020 121.020 123.008 -1.988 18237
626 1 3 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.656 0.287 18237
627 1 3 . 1 1 12 12 ALA C C 12 177.990 177.990 175.326 2.664 18237
628 1 3 . 1 1 12 12 ALA CA C 12 50.511 50.511 51.303 -0.792 18237
629 1 3 . 1 1 12 12 ALA CB C 12 20.147 20.147 21.208 -1.061 18237
630 1 3 . 1 1 12 12 ALA H H 12 7.933 7.933 8.151 -0.218 18237
631 1 3 . 1 1 13 13 TYR N N 13 121.755 121.755 119.722 2.033 18237
632 1 3 . 1 1 13 13 TYR C C 13 175.519 175.519 175.078 0.441 18237
633 1 3 . 1 1 13 13 TYR CA C 13 59.090 59.090 57.286 1.804 18237
634 1 3 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.843 1.337 18237
635 1 3 . 1 1 13 13 TYR H H 13 9.575 9.575 8.538 1.037 18237
636 1 3 . 1 1 14 14 VAL N N 14 112.251 112.251 121.206 -8.955 18237
637 1 3 . 1 1 14 14 VAL C C 14 174.074 174.074 175.259 -1.185 18237
638 1 3 . 1 1 14 14 VAL CA C 14 59.090 59.090 59.419 -0.329 18237
639 1 3 . 1 1 14 14 VAL CB C 14 32.750 32.750 35.354 -2.604 18237
640 1 3 . 1 1 14 14 VAL H H 14 9.659 9.659 9.019 0.640 18237
641 1 3 . 1 1 15 15 ARG N N 15 124.657 124.657 123.668 0.989 18237
642 1 3 . 1 1 15 15 ARG C C 15 174.948 174.948 175.158 -0.210 18237
643 1 3 . 1 1 15 15 ARG CA C 15 53.520 53.520 55.856 -2.336 18237
644 1 3 . 1 1 15 15 ARG CB C 15 32.533 32.533 29.948 2.585 18237
645 1 3 . 1 1 15 15 ARG H H 15 8.503 8.503 8.565 -0.062 18237
646 1 3 . 1 1 16 16 LYS N N 16 128.240 128.240 126.705 1.535 18237
647 1 3 . 1 1 16 16 LYS C C 16 175.974 175.974 175.383 0.591 18237
648 1 3 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.681 0.095 18237
649 1 3 . 1 1 16 16 LYS CB C 16 36.553 36.553 35.071 1.482 18237
650 1 3 . 1 1 16 16 LYS H H 16 9.052 9.052 8.641 0.411 18237
651 1 3 . 1 1 17 17 ASP N N 17 130.562 130.562 127.075 3.487 18237
652 1 3 . 1 1 17 17 ASP C C 17 175.822 175.822 176.349 -0.527 18237
653 1 3 . 1 1 17 17 ASP CA C 17 56.447 56.447 54.781 1.666 18237
654 1 3 . 1 1 17 17 ASP CB C 17 40.192 40.192 39.506 0.686 18237
655 1 3 . 1 1 17 17 ASP H H 17 10.886 10.886 9.140 1.746 18237
656 1 3 . 1 1 18 18 GLY N N 18 104.754 104.754 104.575 0.179 18237
657 1 3 . 1 1 18 18 GLY C C 18 173.104 173.104 173.235 -0.131 18237
658 1 3 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.187 0.057 18237
659 1 3 . 1 1 18 18 GLY H H 18 9.353 9.353 8.376 0.977 18237
660 1 3 . 1 1 19 19 GLU N N 19 117.501 117.501 117.745 -0.244 18237
661 1 3 . 1 1 19 19 GLU HA H 19 4.648 4.648 3.815 0.833 18237
662 1 3 . 1 1 19 19 GLU C C 19 176.166 176.166 174.634 1.532 18237
663 1 3 . 1 1 19 19 GLU CA C 19 53.865 53.865 53.371 0.494 18237
664 1 3 . 1 1 19 19 GLU CB C 19 33.130 33.130 32.806 0.324 18237
665 1 3 . 1 1 19 19 GLU H H 19 7.813 7.813 8.206 -0.393 18237
666 1 3 . 1 1 20 20 TRP N N 20 122.768 122.768 122.938 -0.170 18237
667 1 3 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.584 -0.917 18237
668 1 3 . 1 1 20 20 TRP C C 20 176.302 176.302 175.813 0.489 18237
669 1 3 . 1 1 20 20 TRP CA C 20 55.878 55.878 55.346 0.531 18237
670 1 3 . 1 1 20 20 TRP CB C 20 29.545 29.545 29.353 0.192 18237
671 1 3 . 1 1 20 20 TRP H H 20 9.094 9.094 7.303 1.791 18237
672 1 3 . 1 1 21 21 VAL N N 21 123.071 123.071 123.986 -0.915 18237
673 1 3 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.504 0.481 18237
674 1 3 . 1 1 21 21 VAL C C 21 175.640 175.640 175.871 -0.231 18237
675 1 3 . 1 1 21 21 VAL CA C 21 59.537 59.537 60.592 -1.055 18237
676 1 3 . 1 1 21 21 VAL CB C 21 34.651 34.651 35.421 -0.770 18237
677 1 3 . 1 1 21 21 VAL H H 21 9.868 9.868 8.296 1.572 18237
678 1 3 . 1 1 22 22 LEU N N 22 127.193 127.193 128.715 -1.522 18237
679 1 3 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.253 0.169 18237
680 1 3 . 1 1 22 22 LEU C C 22 179.268 179.268 178.983 0.285 18237
681 1 3 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.408 0.226 18237
682 1 3 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.182 0.097 18237
683 1 3 . 1 1 22 22 LEU H H 22 8.812 8.812 9.071 -0.259 18237
684 1 3 . 1 1 23 23 LEU N N 23 126.386 126.386 124.686 1.700 18237
685 1 3 . 1 1 23 23 LEU C C 23 178.844 178.844 178.633 0.211 18237
686 1 3 . 1 1 23 23 LEU CA C 23 57.403 57.403 57.845 -0.442 18237
687 1 3 . 1 1 23 23 LEU CB C 23 41.061 41.061 41.366 -0.305 18237
688 1 3 . 1 1 23 23 LEU H H 23 8.562 8.562 8.131 0.431 18237
689 1 3 . 1 1 24 24 SER N N 24 113.100 113.100 116.337 -3.237 18237
690 1 3 . 1 1 24 24 SER HA H 24 4.621 4.621 4.115 0.506 18237
691 1 3 . 1 1 24 24 SER C C 24 176.676 176.676 176.396 0.280 18237
692 1 3 . 1 1 24 24 SER CA C 24 60.960 60.960 61.898 -0.938 18237
693 1 3 . 1 1 24 24 SER CB C 24 61.650 61.650 62.432 -0.782 18237
694 1 3 . 1 1 24 24 SER H H 24 9.098 9.098 8.596 0.502 18237
695 1 3 . 1 1 25 25 THR N N 25 116.715 116.715 115.182 1.533 18237
696 1 3 . 1 1 25 25 THR HA H 25 3.915 3.915 4.135 -0.220 18237
697 1 3 . 1 1 25 25 THR CA C 25 64.599 64.599 64.919 -0.320 18237
698 1 3 . 1 1 25 25 THR CB C 25 68.657 68.657 68.590 0.067 18237
699 1 3 . 1 1 25 25 THR H H 25 7.238 7.238 8.136 -0.898 18237
700 1 3 . 1 1 26 26 PHE N N 26 118.488 118.488 120.136 -1.648 18237
701 1 3 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.441 -0.331 18237
702 1 3 . 1 1 26 26 PHE C C 26 176.181 176.181 176.637 -0.456 18237
703 1 3 . 1 1 26 26 PHE CA C 26 58.627 58.627 60.333 -1.706 18237
704 1 3 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.799 -0.006 18237
705 1 3 . 1 1 26 26 PHE H H 26 7.945 7.945 8.562 -0.617 18237
706 1 3 . 1 1 27 27 LEU N N 27 118.525 118.525 119.759 -1.234 18237
707 1 3 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.276 0.247 18237
708 1 3 . 1 1 27 27 LEU C C 27 177.752 177.752 178.035 -0.283 18237
709 1 3 . 1 1 27 27 LEU CA C 27 54.679 54.679 56.110 -1.431 18237
710 1 3 . 1 1 27 27 LEU CB C 27 41.333 41.333 42.456 -1.123 18237
711 1 3 . 1 1 27 27 LEU H H 27 7.290 7.290 7.681 -0.391 18237
712 1 3 . 1 1 28 28 GLY N N 28 108.823 108.823 105.178 3.645 18237
713 1 3 . 1 1 28 28 GLY C C 28 174.630 174.630 174.510 0.120 18237
714 1 3 . 1 1 28 28 GLY CA C 28 45.374 45.374 45.225 0.149 18237
715 1 3 . 1 1 28 28 GLY H H 28 8.242 8.242 7.858 0.384 18237
716 1 3 . 1 1 29 29 SER N N 29 116.210 116.210 115.393 0.817 18237
717 1 3 . 1 1 29 29 SER HA H 29 4.626 4.626 4.657 -0.031 18237
718 1 3 . 1 1 29 29 SER C C 29 175.312 175.312 175.573 -0.261 18237
719 1 3 . 1 1 29 29 SER CA C 29 57.992 57.992 58.575 -0.583 18237
720 1 3 . 1 1 29 29 SER CB C 29 63.605 63.605 63.954 -0.349 18237
721 1 3 . 1 1 29 29 SER H H 29 8.310 8.310 7.747 0.563 18237
722 1 3 . 1 1 30 30 SER N N 30 118.892 118.892 114.861 4.031 18237
723 1 3 . 1 1 30 30 SER HA H 30 4.597 4.597 4.239 0.357 18237
724 1 3 . 1 1 30 30 SER C C 30 175.479 175.479 174.986 0.493 18237
725 1 3 . 1 1 30 30 SER CA C 30 58.582 58.582 59.980 -1.398 18237
726 1 3 . 1 1 30 30 SER CB C 30 63.605 63.605 62.095 1.510 18237
727 1 3 . 1 1 30 30 SER H H 30 8.593 8.593 8.851 -0.258 18237
728 1 3 . 1 1 31 31 GLY N N 31 111.354 111.354 108.631 2.723 18237
729 1 3 . 1 1 31 31 GLY C C 31 174.428 174.428 175.044 -0.616 18237
730 1 3 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.598 -0.142 18237
731 1 3 . 1 1 31 31 GLY H H 31 8.584 8.584 7.840 0.744 18237
732 1 3 . 1 1 32 32 ASN N N 32 119.486 119.486 118.037 1.449 18237
733 1 3 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.644 0.173 18237
734 1 3 . 1 1 32 32 ASN C C 32 175.928 175.928 176.244 -0.316 18237
735 1 3 . 1 1 32 32 ASN CA C 32 53.215 53.215 52.432 0.783 18237
736 1 3 . 1 1 32 32 ASN CB C 32 38.780 38.780 37.606 1.174 18237
737 1 3 . 1 1 32 32 ASN H H 32 8.393 8.393 8.777 -0.384 18237
738 1 3 . 1 1 33 33 GLU N N 33 122.031 122.031 120.296 1.735 18237
739 1 3 . 1 1 33 33 GLU HA H 33 4.271 4.271 3.965 0.306 18237
740 1 3 . 1 1 33 33 GLU CA C 33 57.426 57.426 58.920 -1.494 18237
741 1 3 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.364 -0.036 18237
742 1 3 . 1 1 33 33 GLU H H 33 8.711 8.711 8.589 0.122 18237
743 1 3 . 1 1 34 34 GLN N N 34 120.866 120.866 117.770 3.096 18237
744 1 3 . 1 1 34 34 GLN HA H 34 4.271 4.271 4.027 0.244 18237
745 1 3 . 1 1 34 34 GLN CA C 34 56.226 56.226 58.757 -2.531 18237
746 1 3 . 1 1 34 34 GLN CB C 34 28.839 28.839 28.718 0.121 18237
747 1 3 . 1 1 34 34 GLN H H 34 8.438 8.438 7.614 0.824 18237
748 1 3 . 1 1 35 35 GLU N N 35 122.323 122.323 119.692 2.631 18237
749 1 3 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.159 0.160 18237
750 1 3 . 1 1 35 35 GLU C C 35 177.176 177.176 178.852 -1.676 18237
751 1 3 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.750 -1.754 18237
752 1 3 . 1 1 35 35 GLU CB C 35 29.545 29.545 29.582 -0.037 18237
753 1 3 . 1 1 35 35 GLU H H 35 8.424 8.424 7.700 0.724 18237
754 1 3 . 1 1 36 36 LEU N N 36 122.904 122.904 117.346 5.558 18237
755 1 3 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.094 0.225 18237
756 1 3 . 1 1 36 36 LEU CA C 36 55.898 55.898 56.707 -0.809 18237
757 1 3 . 1 1 36 36 LEU CB C 36 41.496 41.496 41.813 -0.318 18237
758 1 3 . 1 1 36 36 LEU H H 36 8.342 8.342 7.407 0.935 18237
759 1 3 . 1 1 38 38 GLU N N 38 121.931 121.931 121.515 0.416 18237
760 1 3 . 1 1 38 38 GLU HA H 38 4.396 4.396 4.120 0.276 18237
761 1 3 . 1 1 38 38 GLU C C 38 177.318 177.318 178.281 -0.963 18237
762 1 3 . 1 1 38 38 GLU CA C 38 56.366 56.366 59.614 -3.248 18237
763 1 3 . 1 1 38 38 GLU CB C 38 29.328 29.328 30.150 -0.822 18237
764 1 3 . 1 1 38 38 GLU H H 38 8.342 8.342 7.722 0.620 18237
765 1 3 . 1 1 39 39 LEU N N 39 123.317 123.317 119.529 3.788 18237
766 1 3 . 1 1 39 39 LEU HA H 39 4.348 4.348 2.235 2.113 18237
767 1 3 . 1 1 39 39 LEU CA C 39 56.833 56.833 57.818 -0.985 18237
768 1 3 . 1 1 39 39 LEU CB C 39 41.387 41.387 41.435 -0.049 18237
769 1 3 . 1 1 39 39 LEU H H 39 8.342 8.342 7.043 1.299 18237
770 1 3 . 1 1 40 40 ASP N N 40 119.726 119.726 116.027 3.699 18237
771 1 3 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.283 0.288 18237
772 1 3 . 1 1 40 40 ASP CA C 40 55.589 55.589 57.246 -1.657 18237
773 1 3 . 1 1 40 40 ASP H H 40 8.530 8.530 8.439 0.091 18237
774 1 3 . 1 1 41 41 LYS N N 41 121.200 121.200 119.028 2.172 18237
775 1 3 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.329 -0.165 18237
776 1 3 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.322 -0.102 18237
777 1 3 . 1 1 41 41 LYS H H 41 8.145 8.145 7.790 0.355 18237
778 1 3 . 1 1 42 42 TRP N N 42 120.615 120.615 120.977 -0.362 18237
779 1 3 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.500 0.097 18237
780 1 3 . 1 1 42 42 TRP C C 42 177.641 177.641 178.409 -0.768 18237
781 1 3 . 1 1 42 42 TRP CA C 42 58.561 58.561 59.013 -0.452 18237
782 1 3 . 1 1 42 42 TRP CB C 42 28.839 28.839 27.864 0.975 18237
783 1 3 . 1 1 42 42 TRP H H 42 8.025 8.025 8.377 -0.352 18237
784 1 3 . 1 1 43 43 ALA N N 43 122.056 122.056 120.587 1.469 18237
785 1 3 . 1 1 43 43 ALA HA H 43 4.140 4.140 4.103 0.037 18237
786 1 3 . 1 1 43 43 ALA C C 43 172.776 172.776 179.577 -6.801 18237
787 1 3 . 1 1 43 43 ALA CA C 43 54.864 54.864 55.267 -0.403 18237
788 1 3 . 1 1 43 43 ALA CB C 43 17.974 17.974 17.886 0.088 18237
789 1 3 . 1 1 43 43 ALA H H 43 8.199 8.199 8.007 0.192 18237
790 1 3 . 1 1 44 44 SER N N 44 113.378 113.378 115.176 -1.798 18237
791 1 3 . 1 1 44 44 SER HA H 44 4.376 4.376 4.304 0.072 18237
792 1 3 . 1 1 44 44 SER C C 44 176.767 176.767 176.808 -0.041 18237
793 1 3 . 1 1 44 44 SER CA C 44 60.980 60.980 61.789 -0.810 18237
794 1 3 . 1 1 44 44 SER CB C 44 62.410 62.410 62.696 -0.286 18237
795 1 3 . 1 1 44 44 SER H H 44 8.210 8.210 8.371 -0.161 18237
796 1 3 . 1 1 45 45 LEU N N 45 123.425 123.425 122.924 0.501 18237
797 1 3 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.268 -0.074 18237
798 1 3 . 1 1 45 45 LEU CA C 45 57.606 57.606 57.871 -0.265 18237
799 1 3 . 1 1 45 45 LEU CB C 45 41.170 41.170 41.818 -0.648 18237
800 1 3 . 1 1 45 45 LEU H H 45 7.906 7.906 7.554 0.352 18237
801 1 3 . 1 1 46 46 TRP N N 46 118.572 118.572 118.515 0.057 18237
802 1 3 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.335 0.320 18237
803 1 3 . 1 1 46 46 TRP C C 46 177.838 177.838 179.142 -1.304 18237
804 1 3 . 1 1 46 46 TRP CA C 46 58.907 58.907 61.164 -2.257 18237
805 1 3 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.067 0.152 18237
806 1 3 . 1 1 46 46 TRP H H 46 8.043 8.043 8.039 0.004 18237
807 1 3 . 1 1 47 47 ASN N N 47 116.564 116.564 117.869 -1.305 18237
808 1 3 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.752 -0.126 18237
809 1 3 . 1 1 47 47 ASN C C 47 176.904 176.904 177.385 -0.481 18237
810 1 3 . 1 1 47 47 ASN CA C 47 55.045 55.045 55.753 -0.708 18237
811 1 3 . 1 1 47 47 ASN CB C 47 38.563 38.563 39.100 -0.537 18237
812 1 3 . 1 1 47 47 ASN H H 47 8.174 8.174 8.780 -0.606 18237
813 1 3 . 1 1 48 48 TRP N N 48 121.421 121.421 121.363 0.058 18237
814 1 3 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.670 -0.303 18237
815 1 3 . 1 1 48 48 TRP CA C 48 59.517 59.517 58.098 1.419 18237
816 1 3 . 1 1 48 48 TRP CB C 48 28.893 28.893 29.531 -0.638 18237
817 1 3 . 1 1 48 48 TRP H H 48 8.145 8.145 8.172 -0.027 18237
818 1 3 . 1 1 49 49 PHE N N 49 118.299 118.299 121.056 -2.757 18237
819 1 3 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.728 0.524 18237
820 1 3 . 1 1 49 49 PHE C C 49 175.565 175.565 175.400 0.165 18237
821 1 3 . 1 1 49 49 PHE CA C 49 58.887 58.887 58.043 0.844 18237
822 1 3 . 1 1 49 49 PHE CB C 49 38.671 38.671 38.593 0.078 18237
823 1 3 . 1 1 49 49 PHE H H 49 8.036 8.036 7.716 0.320 18237
824 1 3 . 1 1 50 50 ASN N N 50 118.836 118.836 119.323 -0.487 18237
825 1 3 . 1 1 50 50 ASN HA H 50 4.626 4.626 4.177 0.449 18237
826 1 3 . 1 1 50 50 ASN C C 50 176.439 176.439 176.353 0.086 18237
827 1 3 . 1 1 50 50 ASN CA C 50 53.215 53.215 54.755 -1.540 18237
828 1 3 . 1 1 50 50 ASN CB C 50 38.128 38.128 37.886 0.242 18237
829 1 3 . 1 1 50 50 ASN H H 50 7.795 7.795 7.640 0.155 18237
830 1 3 . 1 1 51 51 ILE N N 51 120.218 120.218 115.546 4.672 18237
831 1 3 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.909 -0.118 18237
832 1 3 . 1 1 51 51 ILE C C 51 177.202 177.202 177.159 0.043 18237
833 1 3 . 1 1 51 51 ILE CA C 51 63.102 63.102 65.039 -1.937 18237
834 1 3 . 1 1 51 51 ILE CB C 51 37.367 37.367 37.069 0.298 18237
835 1 3 . 1 1 51 51 ILE H H 51 8.147 8.147 6.998 1.149 18237
836 1 3 . 1 1 52 52 THR N N 52 115.352 115.352 112.797 2.555 18237
837 1 3 . 1 1 52 52 THR HA H 52 4.031 4.031 4.008 0.023 18237
838 1 3 . 1 1 52 52 THR C C 52 176.095 176.095 176.596 -0.501 18237
839 1 3 . 1 1 52 52 THR CA C 52 65.148 65.148 65.324 -0.176 18237
840 1 3 . 1 1 52 52 THR CB C 52 68.277 68.277 68.162 0.115 18237
841 1 3 . 1 1 52 52 THR H H 52 8.009 8.009 7.423 0.586 18237
842 1 3 . 1 1 53 53 ASN N N 53 119.874 119.874 121.304 -1.430 18237
843 1 3 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.243 0.393 18237
844 1 3 . 1 1 53 53 ASN C C 53 176.530 176.530 177.024 -0.494 18237
845 1 3 . 1 1 53 53 ASN CA C 53 54.457 54.457 56.103 -1.646 18237
846 1 3 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.974 -0.172 18237
847 1 3 . 1 1 53 53 ASN H H 53 7.972 7.972 7.122 0.850 18237
848 1 3 . 1 1 54 54 TRP N N 54 120.192 120.192 119.395 0.797 18237
849 1 3 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.583 0.072 18237
850 1 3 . 1 1 54 54 TRP CA C 54 58.643 58.643 58.180 0.463 18237
851 1 3 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.341 -0.176 18237
852 1 3 . 1 1 54 54 TRP H H 54 7.897 7.897 7.340 0.557 18237
853 1 3 . 1 1 55 55 LEU N N 55 118.354 118.354 121.838 -3.484 18237
854 1 3 . 1 1 55 55 LEU HA H 55 4.088 4.088 3.882 0.206 18237
855 1 3 . 1 1 55 55 LEU C C 55 177.975 177.975 178.570 -0.595 18237
856 1 3 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.525 -2.055 18237
857 1 3 . 1 1 55 55 LEU CB C 55 40.898 40.898 41.941 -1.043 18237
858 1 3 . 1 1 55 55 LEU H H 55 7.931 7.931 7.852 0.079 18237
859 1 3 . 1 1 56 56 TRP N N 56 118.335 118.335 116.794 1.541 18237
860 1 3 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.351 0.016 18237
861 1 3 . 1 1 56 56 TRP C C 56 176.863 176.863 178.269 -1.406 18237
862 1 3 . 1 1 56 56 TRP CA C 56 59.070 59.070 61.044 -1.974 18237
863 1 3 . 1 1 56 56 TRP CB C 56 28.839 28.839 28.978 -0.139 18237
864 1 3 . 1 1 56 56 TRP H H 56 7.665 7.665 7.951 -0.286 18237
865 1 3 . 1 1 57 57 TYR N N 57 116.808 116.808 119.912 -3.104 18237
866 1 3 . 1 1 57 57 TYR HA H 57 4.172 4.172 4.392 -0.220 18237
867 1 3 . 1 1 57 57 TYR C C 57 176.085 176.085 177.194 -1.109 18237
868 1 3 . 1 1 57 57 TYR CA C 57 59.865 59.865 61.189 -1.324 18237
869 1 3 . 1 1 57 57 TYR CB C 57 38.563 38.563 39.292 -0.729 18237
870 1 3 . 1 1 57 57 TYR H H 57 7.578 7.578 7.924 -0.346 18237
871 1 3 . 1 1 58 58 ILE N N 58 115.526 115.526 112.642 2.884 18237
872 1 3 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.392 -0.127 18237
873 1 3 . 1 1 58 58 ILE C C 58 174.782 174.782 175.809 -1.027 18237
874 1 3 . 1 1 58 58 ILE CA C 58 60.940 60.940 61.680 -0.740 18237
875 1 3 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.590 -0.408 18237
876 1 3 . 1 1 58 58 ILE H H 58 7.586 7.586 7.954 -0.368 18237
877 1 4 . 1 1 2 2 TYR N N 2 120.470 120.470 120.794 -0.324 18237
878 1 4 . 1 1 2 2 TYR C C 2 176.535 176.535 175.258 1.277 18237
879 1 4 . 1 1 2 2 TYR CA C 2 55.995 55.995 57.685 -1.690 18237
880 1 4 . 1 1 2 2 TYR CB C 2 37.313 37.313 39.718 -2.405 18237
881 1 4 . 1 1 2 2 TYR H H 2 7.951 7.951 7.869 0.082 18237
882 1 4 . 1 1 3 3 ILE N N 3 118.307 118.307 121.830 -3.523 18237
883 1 4 . 1 1 3 3 ILE CA C 3 58.968 58.968 59.255 -0.287 18237
884 1 4 . 1 1 3 3 ILE CB C 3 38.074 38.074 37.897 0.177 18237
885 1 4 . 1 1 3 3 ILE H H 3 8.381 8.381 8.295 0.086 18237
886 1 4 . 1 1 5 5 GLU N N 5 118.785 118.785 123.259 -4.474 18237
887 1 4 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.110 0.145 18237
888 1 4 . 1 1 5 5 GLU C C 5 176.267 176.267 176.267 0.000 18237
889 1 4 . 1 1 5 5 GLU CA C 5 55.959 55.959 56.514 -0.555 18237
890 1 4 . 1 1 5 5 GLU CB C 5 30.034 30.034 30.519 -0.485 18237
891 1 4 . 1 1 5 5 GLU H H 5 7.710 7.710 8.554 -0.844 18237
892 1 4 . 1 1 6 6 ALA N N 6 131.546 131.546 119.002 12.544 18237
893 1 4 . 1 1 6 6 ALA HA H 6 3.575 3.575 4.257 -0.682 18237
894 1 4 . 1 1 6 6 ALA CA C 6 50.959 50.959 52.188 -1.229 18237
895 1 4 . 1 1 6 6 ALA CB C 6 14.389 14.389 17.170 -2.781 18237
896 1 4 . 1 1 6 6 ALA H H 6 8.338 8.338 8.170 0.168 18237
897 1 4 . 1 1 8 8 ARG N N 8 126.915 126.915 121.557 5.358 18237
898 1 4 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.364 -0.294 18237
899 1 4 . 1 1 8 8 ARG C C 8 175.110 175.110 175.114 -0.004 18237
900 1 4 . 1 1 8 8 ARG CA C 8 54.699 54.699 55.890 -1.191 18237
901 1 4 . 1 1 8 8 ARG CB C 8 28.078 28.078 29.689 -1.611 18237
902 1 4 . 1 1 8 8 ARG H H 8 8.725 8.725 8.427 0.298 18237
903 1 4 . 1 1 9 9 ASP N N 9 123.653 123.653 122.751 0.902 18237
904 1 4 . 1 1 9 9 ASP C C 9 178.015 178.015 176.896 1.119 18237
905 1 4 . 1 1 9 9 ASP CA C 9 52.747 52.747 54.278 -1.531 18237
906 1 4 . 1 1 9 9 ASP CB C 9 40.844 40.844 41.237 -0.393 18237
907 1 4 . 1 1 9 9 ASP H H 9 8.432 8.432 8.181 0.251 18237
908 1 4 . 1 1 10 10 GLY N N 10 111.908 111.908 108.076 3.832 18237
909 1 4 . 1 1 10 10 GLY C C 10 174.822 174.822 174.661 0.161 18237
910 1 4 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.435 -0.191 18237
911 1 4 . 1 1 10 10 GLY H H 10 9.727 9.727 8.607 1.120 18237
912 1 4 . 1 1 11 11 GLN N N 11 118.395 118.395 118.667 -0.272 18237
913 1 4 . 1 1 11 11 GLN C C 11 174.711 174.711 174.669 0.042 18237
914 1 4 . 1 1 11 11 GLN CA C 11 53.398 53.398 54.976 -1.578 18237
915 1 4 . 1 1 11 11 GLN CB C 11 30.306 30.306 29.707 0.599 18237
916 1 4 . 1 1 11 11 GLN H H 11 8.416 8.416 7.845 0.571 18237
917 1 4 . 1 1 12 12 ALA N N 12 121.020 121.020 123.259 -2.239 18237
918 1 4 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.667 0.276 18237
919 1 4 . 1 1 12 12 ALA C C 12 177.990 177.990 175.378 2.612 18237
920 1 4 . 1 1 12 12 ALA CA C 12 50.511 50.511 51.336 -0.825 18237
921 1 4 . 1 1 12 12 ALA CB C 12 20.147 20.147 20.965 -0.818 18237
922 1 4 . 1 1 12 12 ALA H H 12 7.933 7.933 8.150 -0.217 18237
923 1 4 . 1 1 13 13 TYR N N 13 121.755 121.755 119.917 1.838 18237
924 1 4 . 1 1 13 13 TYR C C 13 175.519 175.519 174.218 1.301 18237
925 1 4 . 1 1 13 13 TYR CA C 13 59.090 59.090 57.458 1.632 18237
926 1 4 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.944 1.236 18237
927 1 4 . 1 1 13 13 TYR H H 13 9.575 9.575 8.578 0.997 18237
928 1 4 . 1 1 14 14 VAL N N 14 112.251 112.251 120.141 -7.890 18237
929 1 4 . 1 1 14 14 VAL C C 14 174.074 174.074 175.036 -0.962 18237
930 1 4 . 1 1 14 14 VAL CA C 14 59.090 59.090 59.236 -0.146 18237
931 1 4 . 1 1 14 14 VAL CB C 14 32.750 32.750 35.477 -2.728 18237
932 1 4 . 1 1 14 14 VAL H H 14 9.659 9.659 8.436 1.223 18237
933 1 4 . 1 1 15 15 ARG N N 15 124.657 124.657 122.542 2.115 18237
934 1 4 . 1 1 15 15 ARG C C 15 174.948 174.948 175.276 -0.328 18237
935 1 4 . 1 1 15 15 ARG CA C 15 53.520 53.520 55.976 -2.456 18237
936 1 4 . 1 1 15 15 ARG CB C 15 32.533 32.533 30.190 2.343 18237
937 1 4 . 1 1 15 15 ARG H H 15 8.503 8.503 8.557 -0.054 18237
938 1 4 . 1 1 16 16 LYS N N 16 128.240 128.240 125.519 2.721 18237
939 1 4 . 1 1 16 16 LYS C C 16 175.974 175.974 175.219 0.755 18237
940 1 4 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.676 0.100 18237
941 1 4 . 1 1 16 16 LYS CB C 16 36.553 36.553 35.160 1.393 18237
942 1 4 . 1 1 16 16 LYS H H 16 9.052 9.052 8.327 0.725 18237
943 1 4 . 1 1 17 17 ASP N N 17 130.562 130.562 125.327 5.235 18237
944 1 4 . 1 1 17 17 ASP C C 17 175.822 175.822 175.824 -0.002 18237
945 1 4 . 1 1 17 17 ASP CA C 17 56.447 56.447 55.204 1.243 18237
946 1 4 . 1 1 17 17 ASP CB C 17 40.192 40.192 39.033 1.159 18237
947 1 4 . 1 1 17 17 ASP H H 17 10.886 10.886 9.130 1.756 18237
948 1 4 . 1 1 18 18 GLY N N 18 104.754 104.754 105.047 -0.293 18237
949 1 4 . 1 1 18 18 GLY C C 18 173.104 173.104 173.821 -0.717 18237
950 1 4 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.467 -0.223 18237
951 1 4 . 1 1 18 18 GLY H H 18 9.353 9.353 8.210 1.143 18237
952 1 4 . 1 1 19 19 GLU N N 19 117.501 117.501 117.782 -0.281 18237
953 1 4 . 1 1 19 19 GLU HA H 19 4.648 4.648 4.385 0.263 18237
954 1 4 . 1 1 19 19 GLU C C 19 176.166 176.166 174.739 1.427 18237
955 1 4 . 1 1 19 19 GLU CA C 19 53.865 53.865 54.115 -0.250 18237
956 1 4 . 1 1 19 19 GLU CB C 19 33.130 33.130 34.196 -1.066 18237
957 1 4 . 1 1 19 19 GLU H H 19 7.813 7.813 8.053 -0.240 18237
958 1 4 . 1 1 20 20 TRP N N 20 122.768 122.768 122.244 0.524 18237
959 1 4 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.342 -0.675 18237
960 1 4 . 1 1 20 20 TRP C C 20 176.302 176.302 176.530 -0.228 18237
961 1 4 . 1 1 20 20 TRP CA C 20 55.878 55.878 56.442 -0.564 18237
962 1 4 . 1 1 20 20 TRP CB C 20 29.545 29.545 30.249 -0.704 18237
963 1 4 . 1 1 20 20 TRP H H 20 9.094 9.094 8.305 0.789 18237
964 1 4 . 1 1 21 21 VAL N N 21 123.071 123.071 125.658 -2.587 18237
965 1 4 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.511 0.474 18237
966 1 4 . 1 1 21 21 VAL C C 21 175.640 175.640 175.401 0.239 18237
967 1 4 . 1 1 21 21 VAL CA C 21 59.537 59.537 61.171 -1.634 18237
968 1 4 . 1 1 21 21 VAL CB C 21 34.651 34.651 34.868 -0.217 18237
969 1 4 . 1 1 21 21 VAL H H 21 9.868 9.868 8.356 1.512 18237
970 1 4 . 1 1 22 22 LEU N N 22 127.193 127.193 129.048 -1.855 18237
971 1 4 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.181 0.241 18237
972 1 4 . 1 1 22 22 LEU C C 22 179.268 179.268 178.689 0.579 18237
973 1 4 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.412 0.222 18237
974 1 4 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.032 0.247 18237
975 1 4 . 1 1 22 22 LEU H H 22 8.812 8.812 8.944 -0.131 18237
976 1 4 . 1 1 23 23 LEU N N 23 126.386 126.386 122.962 3.424 18237
977 1 4 . 1 1 23 23 LEU C C 23 178.844 178.844 178.946 -0.102 18237
978 1 4 . 1 1 23 23 LEU CA C 23 57.403 57.403 58.348 -0.945 18237
979 1 4 . 1 1 23 23 LEU CB C 23 41.061 41.061 41.287 -0.226 18237
980 1 4 . 1 1 23 23 LEU H H 23 8.562 8.562 8.356 0.206 18237
981 1 4 . 1 1 24 24 SER N N 24 113.100 113.100 116.005 -2.905 18237
982 1 4 . 1 1 24 24 SER HA H 24 4.621 4.621 4.039 0.582 18237
983 1 4 . 1 1 24 24 SER C C 24 176.676 176.676 176.353 0.323 18237
984 1 4 . 1 1 24 24 SER CA C 24 60.960 60.960 61.742 -0.782 18237
985 1 4 . 1 1 24 24 SER CB C 24 61.650 61.650 62.640 -0.990 18237
986 1 4 . 1 1 24 24 SER H H 24 9.098 9.098 8.438 0.660 18237
987 1 4 . 1 1 25 25 THR N N 25 116.715 116.715 113.078 3.637 18237
988 1 4 . 1 1 25 25 THR HA H 25 3.915 3.915 4.124 -0.209 18237
989 1 4 . 1 1 25 25 THR CA C 25 64.599 64.599 64.768 -0.169 18237
990 1 4 . 1 1 25 25 THR CB C 25 68.657 68.657 68.973 -0.316 18237
991 1 4 . 1 1 25 25 THR H H 25 7.238 7.238 7.954 -0.716 18237
992 1 4 . 1 1 26 26 PHE N N 26 118.488 118.488 119.991 -1.503 18237
993 1 4 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.427 -0.317 18237
994 1 4 . 1 1 26 26 PHE C C 26 176.181 176.181 176.231 -0.050 18237
995 1 4 . 1 1 26 26 PHE CA C 26 58.627 58.627 60.367 -1.740 18237
996 1 4 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.614 0.179 18237
997 1 4 . 1 1 26 26 PHE H H 26 7.945 7.945 8.173 -0.228 18237
998 1 4 . 1 1 27 27 LEU N N 27 118.525 118.525 119.370 -0.845 18237
999 1 4 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.236 0.287 18237
1000 1 4 . 1 1 27 27 LEU C C 27 177.752 177.752 177.747 0.005 18237
1001 1 4 . 1 1 27 27 LEU CA C 27 54.679 54.679 56.853 -2.174 18237
1002 1 4 . 1 1 27 27 LEU CB C 27 41.333 41.333 42.662 -1.329 18237
1003 1 4 . 1 1 27 27 LEU H H 27 7.290 7.290 7.717 -0.427 18237
1004 1 4 . 1 1 28 28 GLY N N 28 108.823 108.823 101.937 6.886 18237
1005 1 4 . 1 1 28 28 GLY C C 28 174.630 174.630 173.621 1.009 18237
1006 1 4 . 1 1 28 28 GLY CA C 28 45.374 45.374 45.748 -0.374 18237
1007 1 4 . 1 1 28 28 GLY H H 28 8.242 8.242 7.685 0.557 18237
1008 1 4 . 1 1 29 29 SER N N 29 116.210 116.210 116.197 0.013 18237
1009 1 4 . 1 1 29 29 SER HA H 29 4.626 4.626 4.292 0.334 18237
1010 1 4 . 1 1 29 29 SER C C 29 175.312 175.312 174.064 1.248 18237
1011 1 4 . 1 1 29 29 SER CA C 29 57.992 57.992 58.398 -0.406 18237
1012 1 4 . 1 1 29 29 SER CB C 29 63.605 63.605 62.990 0.615 18237
1013 1 4 . 1 1 29 29 SER H H 29 8.310 8.310 8.357 -0.047 18237
1014 1 4 . 1 1 30 30 SER N N 30 118.892 118.892 112.813 6.079 18237
1015 1 4 . 1 1 30 30 SER HA H 30 4.597 4.597 4.175 0.422 18237
1016 1 4 . 1 1 30 30 SER C C 30 175.479 175.479 175.401 0.078 18237
1017 1 4 . 1 1 30 30 SER CA C 30 58.582 58.582 59.634 -1.052 18237
1018 1 4 . 1 1 30 30 SER CB C 30 63.605 63.605 62.074 1.531 18237
1019 1 4 . 1 1 30 30 SER H H 30 8.593 8.593 8.569 0.024 18237
1020 1 4 . 1 1 31 31 GLY N N 31 111.354 111.354 107.774 3.580 18237
1021 1 4 . 1 1 31 31 GLY C C 31 174.428 174.428 174.960 -0.532 18237
1022 1 4 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.466 -0.010 18237
1023 1 4 . 1 1 31 31 GLY H H 31 8.584 8.584 7.798 0.786 18237
1024 1 4 . 1 1 32 32 ASN N N 32 119.486 119.486 115.426 4.060 18237
1025 1 4 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.761 0.056 18237
1026 1 4 . 1 1 32 32 ASN C C 32 175.928 175.928 175.428 0.500 18237
1027 1 4 . 1 1 32 32 ASN CA C 32 53.215 53.215 53.465 -0.250 18237
1028 1 4 . 1 1 32 32 ASN CB C 32 38.780 38.780 39.182 -0.402 18237
1029 1 4 . 1 1 32 32 ASN H H 32 8.393 8.393 8.022 0.371 18237
1030 1 4 . 1 1 33 33 GLU N N 33 122.031 122.031 120.635 1.396 18237
1031 1 4 . 1 1 33 33 GLU HA H 33 4.271 4.271 4.053 0.218 18237
1032 1 4 . 1 1 33 33 GLU CA C 33 57.426 57.426 58.958 -1.532 18237
1033 1 4 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.102 0.225 18237
1034 1 4 . 1 1 33 33 GLU H H 33 8.711 8.711 8.784 -0.073 18237
1035 1 4 . 1 1 34 34 GLN N N 34 120.866 120.866 118.326 2.540 18237
1036 1 4 . 1 1 34 34 GLN HA H 34 4.271 4.271 3.953 0.318 18237
1037 1 4 . 1 1 34 34 GLN CA C 34 56.226 56.226 59.067 -2.841 18237
1038 1 4 . 1 1 34 34 GLN CB C 34 28.839 28.839 28.573 0.266 18237
1039 1 4 . 1 1 34 34 GLN H H 34 8.438 8.438 8.237 0.201 18237
1040 1 4 . 1 1 35 35 GLU N N 35 122.323 122.323 120.098 2.225 18237
1041 1 4 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.092 0.227 18237
1042 1 4 . 1 1 35 35 GLU C C 35 177.176 177.176 178.962 -1.786 18237
1043 1 4 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.823 -1.827 18237
1044 1 4 . 1 1 35 35 GLU CB C 35 29.545 29.545 29.377 0.168 18237
1045 1 4 . 1 1 35 35 GLU H H 35 8.424 8.424 7.800 0.624 18237
1046 1 4 . 1 1 36 36 LEU N N 36 122.904 122.904 117.204 5.700 18237
1047 1 4 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.089 0.230 18237
1048 1 4 . 1 1 36 36 LEU CA C 36 55.898 55.898 56.570 -0.672 18237
1049 1 4 . 1 1 36 36 LEU CB C 36 41.496 41.496 42.001 -0.505 18237
1050 1 4 . 1 1 36 36 LEU H H 36 8.342 8.342 7.311 1.031 18237
1051 1 4 . 1 1 38 38 GLU N N 38 121.931 121.931 120.751 1.180 18237
1052 1 4 . 1 1 38 38 GLU HA H 38 4.396 4.396 4.126 0.270 18237
1053 1 4 . 1 1 38 38 GLU C C 38 177.318 177.318 178.137 -0.819 18237
1054 1 4 . 1 1 38 38 GLU CA C 38 56.366 56.366 59.245 -2.880 18237
1055 1 4 . 1 1 38 38 GLU CB C 38 29.328 29.328 29.572 -0.244 18237
1056 1 4 . 1 1 38 38 GLU H H 38 8.342 8.342 8.018 0.324 18237
1057 1 4 . 1 1 39 39 LEU N N 39 123.317 123.317 119.484 3.833 18237
1058 1 4 . 1 1 39 39 LEU HA H 39 4.348 4.348 2.465 1.883 18237
1059 1 4 . 1 1 39 39 LEU CA C 39 56.833 56.833 58.292 -1.459 18237
1060 1 4 . 1 1 39 39 LEU CB C 39 41.387 41.387 41.486 -0.099 18237
1061 1 4 . 1 1 39 39 LEU H H 39 8.342 8.342 6.963 1.379 18237
1062 1 4 . 1 1 40 40 ASP N N 40 119.726 119.726 116.313 3.413 18237
1063 1 4 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.239 0.332 18237
1064 1 4 . 1 1 40 40 ASP CA C 40 55.589 55.589 57.353 -1.764 18237
1065 1 4 . 1 1 40 40 ASP H H 40 8.530 8.530 8.461 0.069 18237
1066 1 4 . 1 1 41 41 LYS N N 41 121.200 121.200 119.273 1.927 18237
1067 1 4 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.328 -0.164 18237
1068 1 4 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.468 -0.248 18237
1069 1 4 . 1 1 41 41 LYS H H 41 8.145 8.145 7.630 0.515 18237
1070 1 4 . 1 1 42 42 TRP N N 42 120.615 120.615 120.550 0.065 18237
1071 1 4 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.369 0.228 18237
1072 1 4 . 1 1 42 42 TRP C C 42 177.641 177.641 178.459 -0.818 18237
1073 1 4 . 1 1 42 42 TRP CA C 42 58.561 58.561 58.599 -0.038 18237
1074 1 4 . 1 1 42 42 TRP CB C 42 28.839 28.839 27.953 0.886 18237
1075 1 4 . 1 1 42 42 TRP H H 42 8.025 8.025 8.462 -0.437 18237
1076 1 4 . 1 1 43 43 ALA N N 43 122.056 122.056 120.240 1.816 18237
1077 1 4 . 1 1 43 43 ALA HA H 43 4.140 4.140 4.122 0.018 18237
1078 1 4 . 1 1 43 43 ALA C C 43 172.776 172.776 179.622 -6.846 18237
1079 1 4 . 1 1 43 43 ALA CA C 43 54.864 54.864 55.020 -0.156 18237
1080 1 4 . 1 1 43 43 ALA CB C 43 17.974 17.974 17.863 0.111 18237
1081 1 4 . 1 1 43 43 ALA H H 43 8.199 8.199 7.992 0.207 18237
1082 1 4 . 1 1 44 44 SER N N 44 113.378 113.378 114.432 -1.054 18237
1083 1 4 . 1 1 44 44 SER HA H 44 4.376 4.376 4.292 0.084 18237
1084 1 4 . 1 1 44 44 SER C C 44 176.767 176.767 176.827 -0.060 18237
1085 1 4 . 1 1 44 44 SER CA C 44 60.980 60.980 62.136 -1.156 18237
1086 1 4 . 1 1 44 44 SER CB C 44 62.410 62.410 63.082 -0.672 18237
1087 1 4 . 1 1 44 44 SER H H 44 8.210 8.210 8.158 0.052 18237
1088 1 4 . 1 1 45 45 LEU N N 45 123.425 123.425 121.729 1.696 18237
1089 1 4 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.312 -0.118 18237
1090 1 4 . 1 1 45 45 LEU CA C 45 57.606 57.606 57.519 0.087 18237
1091 1 4 . 1 1 45 45 LEU CB C 45 41.170 41.170 41.610 -0.440 18237
1092 1 4 . 1 1 45 45 LEU H H 45 7.906 7.906 7.599 0.307 18237
1093 1 4 . 1 1 46 46 TRP N N 46 118.572 118.572 120.469 -1.897 18237
1094 1 4 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.314 0.341 18237
1095 1 4 . 1 1 46 46 TRP C C 46 177.838 177.838 178.347 -0.509 18237
1096 1 4 . 1 1 46 46 TRP CA C 46 58.907 58.907 60.253 -1.346 18237
1097 1 4 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.470 -0.251 18237
1098 1 4 . 1 1 46 46 TRP H H 46 8.043 8.043 8.246 -0.203 18237
1099 1 4 . 1 1 47 47 ASN N N 47 116.564 116.564 117.736 -1.172 18237
1100 1 4 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.573 0.053 18237
1101 1 4 . 1 1 47 47 ASN C C 47 176.904 176.904 177.516 -0.612 18237
1102 1 4 . 1 1 47 47 ASN CA C 47 55.045 55.045 55.567 -0.522 18237
1103 1 4 . 1 1 47 47 ASN CB C 47 38.563 38.563 38.493 0.070 18237
1104 1 4 . 1 1 47 47 ASN H H 47 8.174 8.174 8.746 -0.572 18237
1105 1 4 . 1 1 48 48 TRP N N 48 121.421 121.421 121.288 0.133 18237
1106 1 4 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.604 -0.237 18237
1107 1 4 . 1 1 48 48 TRP CA C 48 59.517 59.517 58.182 1.335 18237
1108 1 4 . 1 1 48 48 TRP CB C 48 28.893 28.893 28.916 -0.023 18237
1109 1 4 . 1 1 48 48 TRP H H 48 8.145 8.145 8.168 -0.023 18237
1110 1 4 . 1 1 49 49 PHE N N 49 118.299 118.299 121.462 -3.163 18237
1111 1 4 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.719 0.533 18237
1112 1 4 . 1 1 49 49 PHE C C 49 175.565 175.565 175.097 0.468 18237
1113 1 4 . 1 1 49 49 PHE CA C 49 58.887 58.887 57.700 1.187 18237
1114 1 4 . 1 1 49 49 PHE CB C 49 38.671 38.671 38.386 0.285 18237
1115 1 4 . 1 1 49 49 PHE H H 49 8.036 8.036 7.530 0.506 18237
1116 1 4 . 1 1 50 50 ASN N N 50 118.836 118.836 119.290 -0.454 18237
1117 1 4 . 1 1 50 50 ASN HA H 50 4.626 4.626 3.886 0.740 18237
1118 1 4 . 1 1 50 50 ASN C C 50 176.439 176.439 176.481 -0.042 18237
1119 1 4 . 1 1 50 50 ASN CA C 50 53.215 53.215 54.840 -1.625 18237
1120 1 4 . 1 1 50 50 ASN CB C 50 38.128 38.128 38.245 -0.117 18237
1121 1 4 . 1 1 50 50 ASN H H 50 7.795 7.795 7.415 0.380 18237
1122 1 4 . 1 1 51 51 ILE N N 51 120.218 120.218 116.791 3.427 18237
1123 1 4 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.719 0.072 18237
1124 1 4 . 1 1 51 51 ILE C C 51 177.202 177.202 177.269 -0.067 18237
1125 1 4 . 1 1 51 51 ILE CA C 51 63.102 63.102 64.868 -1.766 18237
1126 1 4 . 1 1 51 51 ILE CB C 51 37.367 37.367 37.086 0.281 18237
1127 1 4 . 1 1 51 51 ILE H H 51 8.147 8.147 6.887 1.260 18237
1128 1 4 . 1 1 52 52 THR N N 52 115.352 115.352 113.818 1.534 18237
1129 1 4 . 1 1 52 52 THR HA H 52 4.031 4.031 3.780 0.251 18237
1130 1 4 . 1 1 52 52 THR C C 52 176.095 176.095 176.113 -0.018 18237
1131 1 4 . 1 1 52 52 THR CA C 52 65.148 65.148 64.885 0.263 18237
1132 1 4 . 1 1 52 52 THR CB C 52 68.277 68.277 67.854 0.423 18237
1133 1 4 . 1 1 52 52 THR H H 52 8.009 8.009 7.206 0.803 18237
1134 1 4 . 1 1 53 53 ASN N N 53 119.874 119.874 120.267 -0.393 18237
1135 1 4 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.351 0.285 18237
1136 1 4 . 1 1 53 53 ASN C C 53 176.530 176.530 177.612 -1.082 18237
1137 1 4 . 1 1 53 53 ASN CA C 53 54.457 54.457 56.313 -1.856 18237
1138 1 4 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.725 0.077 18237
1139 1 4 . 1 1 53 53 ASN H H 53 7.972 7.972 6.908 1.064 18237
1140 1 4 . 1 1 54 54 TRP N N 54 120.192 120.192 119.665 0.527 18237
1141 1 4 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.543 0.112 18237
1142 1 4 . 1 1 54 54 TRP CA C 54 58.643 58.643 58.460 0.183 18237
1143 1 4 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.138 0.027 18237
1144 1 4 . 1 1 54 54 TRP H H 54 7.897 7.897 7.190 0.707 18237
1145 1 4 . 1 1 55 55 LEU N N 55 118.354 118.354 122.056 -3.702 18237
1146 1 4 . 1 1 55 55 LEU HA H 55 4.088 4.088 3.670 0.418 18237
1147 1 4 . 1 1 55 55 LEU C C 55 177.975 177.975 178.257 -0.282 18237
1148 1 4 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.431 -1.961 18237
1149 1 4 . 1 1 55 55 LEU CB C 55 40.898 40.898 41.440 -0.542 18237
1150 1 4 . 1 1 55 55 LEU H H 55 7.931 7.931 7.556 0.375 18237
1151 1 4 . 1 1 56 56 TRP N N 56 118.335 118.335 117.194 1.141 18237
1152 1 4 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.317 0.050 18237
1153 1 4 . 1 1 56 56 TRP C C 56 176.863 176.863 178.331 -1.468 18237
1154 1 4 . 1 1 56 56 TRP CA C 56 59.070 59.070 59.618 -0.548 18237
1155 1 4 . 1 1 56 56 TRP CB C 56 28.839 28.839 29.022 -0.183 18237
1156 1 4 . 1 1 56 56 TRP H H 56 7.665 7.665 7.252 0.413 18237
1157 1 4 . 1 1 57 57 TYR N N 57 116.808 116.808 119.040 -2.232 18237
1158 1 4 . 1 1 57 57 TYR HA H 57 4.172 4.172 4.431 -0.260 18237
1159 1 4 . 1 1 57 57 TYR C C 57 176.085 176.085 176.598 -0.513 18237
1160 1 4 . 1 1 57 57 TYR CA C 57 59.865 59.865 60.768 -0.903 18237
1161 1 4 . 1 1 57 57 TYR CB C 57 38.563 38.563 38.827 -0.264 18237
1162 1 4 . 1 1 57 57 TYR H H 57 7.578 7.578 7.364 0.214 18237
1163 1 4 . 1 1 58 58 ILE N N 58 115.526 115.526 117.561 -2.035 18237
1164 1 4 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.135 0.130 18237
1165 1 4 . 1 1 58 58 ILE C C 58 174.782 174.782 175.603 -0.821 18237
1166 1 4 . 1 1 58 58 ILE CA C 58 60.940 60.940 61.478 -0.538 18237
1167 1 4 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.718 -0.536 18237
1168 1 4 . 1 1 58 58 ILE H H 58 7.586 7.586 8.301 -0.715 18237
1169 1 5 . 1 1 2 2 TYR N N 2 120.470 120.470 121.177 -0.707 18237
1170 1 5 . 1 1 2 2 TYR C C 2 176.535 176.535 175.277 1.258 18237
1171 1 5 . 1 1 2 2 TYR CA C 2 55.995 55.995 58.052 -2.057 18237
1172 1 5 . 1 1 2 2 TYR CB C 2 37.313 37.313 39.235 -1.922 18237
1173 1 5 . 1 1 2 2 TYR H H 2 7.951 7.951 8.155 -0.204 18237
1174 1 5 . 1 1 3 3 ILE N N 3 118.307 118.307 119.808 -1.501 18237
1175 1 5 . 1 1 3 3 ILE CA C 3 58.968 58.968 60.787 -1.819 18237
1176 1 5 . 1 1 3 3 ILE CB C 3 38.074 38.074 37.069 1.005 18237
1177 1 5 . 1 1 3 3 ILE H H 3 8.381 8.381 7.910 0.471 18237
1178 1 5 . 1 1 5 5 GLU N N 5 118.785 118.785 123.778 -4.993 18237
1179 1 5 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.173 0.082 18237
1180 1 5 . 1 1 5 5 GLU C C 5 176.267 176.267 174.981 1.286 18237
1181 1 5 . 1 1 5 5 GLU CA C 5 55.959 55.959 56.674 -0.715 18237
1182 1 5 . 1 1 5 5 GLU CB C 5 30.034 30.034 30.309 -0.275 18237
1183 1 5 . 1 1 5 5 GLU H H 5 7.710 7.710 8.536 -0.826 18237
1184 1 5 . 1 1 6 6 ALA N N 6 131.546 131.546 120.130 11.416 18237
1185 1 5 . 1 1 6 6 ALA HA H 6 3.575 3.575 3.689 -0.114 18237
1186 1 5 . 1 1 6 6 ALA CA C 6 50.959 50.959 49.759 1.200 18237
1187 1 5 . 1 1 6 6 ALA CB C 6 14.389 14.389 19.845 -5.456 18237
1188 1 5 . 1 1 6 6 ALA H H 6 8.338 8.338 8.173 0.165 18237
1189 1 5 . 1 1 8 8 ARG N N 8 126.915 126.915 121.547 5.368 18237
1190 1 5 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.531 -0.461 18237
1191 1 5 . 1 1 8 8 ARG C C 8 175.110 175.110 175.368 -0.258 18237
1192 1 5 . 1 1 8 8 ARG CA C 8 54.699 54.699 56.081 -1.382 18237
1193 1 5 . 1 1 8 8 ARG CB C 8 28.078 28.078 31.254 -3.176 18237
1194 1 5 . 1 1 8 8 ARG H H 8 8.725 8.725 8.392 0.333 18237
1195 1 5 . 1 1 9 9 ASP N N 9 123.653 123.653 124.453 -0.800 18237
1196 1 5 . 1 1 9 9 ASP C C 9 178.015 178.015 177.215 0.800 18237
1197 1 5 . 1 1 9 9 ASP CA C 9 52.747 52.747 54.260 -1.513 18237
1198 1 5 . 1 1 9 9 ASP CB C 9 40.844 40.844 41.288 -0.444 18237
1199 1 5 . 1 1 9 9 ASP H H 9 8.432 8.432 8.623 -0.191 18237
1200 1 5 . 1 1 10 10 GLY N N 10 111.908 111.908 108.054 3.854 18237
1201 1 5 . 1 1 10 10 GLY C C 10 174.822 174.822 174.798 0.024 18237
1202 1 5 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.014 0.230 18237
1203 1 5 . 1 1 10 10 GLY H H 10 9.727 9.727 8.596 1.131 18237
1204 1 5 . 1 1 11 11 GLN N N 11 118.395 118.395 120.461 -2.066 18237
1205 1 5 . 1 1 11 11 GLN C C 11 174.711 174.711 174.416 0.295 18237
1206 1 5 . 1 1 11 11 GLN CA C 11 53.398 53.398 54.754 -1.356 18237
1207 1 5 . 1 1 11 11 GLN CB C 11 30.306 30.306 30.404 -0.098 18237
1208 1 5 . 1 1 11 11 GLN H H 11 8.416 8.416 8.040 0.376 18237
1209 1 5 . 1 1 12 12 ALA N N 12 121.020 121.020 122.316 -1.296 18237
1210 1 5 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.170 0.773 18237
1211 1 5 . 1 1 12 12 ALA C C 12 177.990 177.990 175.173 2.817 18237
1212 1 5 . 1 1 12 12 ALA CA C 12 50.511 50.511 50.750 -0.239 18237
1213 1 5 . 1 1 12 12 ALA CB C 12 20.147 20.147 20.759 -0.612 18237
1214 1 5 . 1 1 12 12 ALA H H 12 7.933 7.933 8.098 -0.165 18237
1215 1 5 . 1 1 13 13 TYR N N 13 121.755 121.755 119.230 2.525 18237
1216 1 5 . 1 1 13 13 TYR C C 13 175.519 175.519 174.613 0.906 18237
1217 1 5 . 1 1 13 13 TYR CA C 13 59.090 59.090 56.075 3.015 18237
1218 1 5 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.288 1.892 18237
1219 1 5 . 1 1 13 13 TYR H H 13 9.575 9.575 8.152 1.423 18237
1220 1 5 . 1 1 14 14 VAL N N 14 112.251 112.251 120.716 -8.465 18237
1221 1 5 . 1 1 14 14 VAL C C 14 174.074 174.074 174.866 -0.792 18237
1222 1 5 . 1 1 14 14 VAL CA C 14 59.090 59.090 58.900 0.190 18237
1223 1 5 . 1 1 14 14 VAL CB C 14 32.750 32.750 34.934 -2.184 18237
1224 1 5 . 1 1 14 14 VAL H H 14 9.659 9.659 9.074 0.585 18237
1225 1 5 . 1 1 15 15 ARG N N 15 124.657 124.657 122.567 2.090 18237
1226 1 5 . 1 1 15 15 ARG C C 15 174.948 174.948 175.536 -0.588 18237
1227 1 5 . 1 1 15 15 ARG CA C 15 53.520 53.520 55.992 -2.472 18237
1228 1 5 . 1 1 15 15 ARG CB C 15 32.533 32.533 30.148 2.385 18237
1229 1 5 . 1 1 15 15 ARG H H 15 8.503 8.503 8.517 -0.014 18237
1230 1 5 . 1 1 16 16 LYS N N 16 128.240 128.240 125.681 2.559 18237
1231 1 5 . 1 1 16 16 LYS C C 16 175.974 175.974 175.341 0.633 18237
1232 1 5 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.786 -0.010 18237
1233 1 5 . 1 1 16 16 LYS CB C 16 36.553 36.553 35.598 0.955 18237
1234 1 5 . 1 1 16 16 LYS H H 16 9.052 9.052 8.689 0.363 18237
1235 1 5 . 1 1 17 17 ASP N N 17 130.562 130.562 126.578 3.984 18237
1236 1 5 . 1 1 17 17 ASP C C 17 175.822 175.822 176.458 -0.636 18237
1237 1 5 . 1 1 17 17 ASP CA C 17 56.447 56.447 54.754 1.694 18237
1238 1 5 . 1 1 17 17 ASP CB C 17 40.192 40.192 40.145 0.047 18237
1239 1 5 . 1 1 17 17 ASP H H 17 10.886 10.886 9.020 1.866 18237
1240 1 5 . 1 1 18 18 GLY N N 18 104.754 104.754 105.268 -0.514 18237
1241 1 5 . 1 1 18 18 GLY C C 18 173.104 173.104 173.221 -0.117 18237
1242 1 5 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.412 -0.168 18237
1243 1 5 . 1 1 18 18 GLY H H 18 9.353 9.353 8.329 1.024 18237
1244 1 5 . 1 1 19 19 GLU N N 19 117.501 117.501 117.710 -0.209 18237
1245 1 5 . 1 1 19 19 GLU HA H 19 4.648 4.648 4.070 0.578 18237
1246 1 5 . 1 1 19 19 GLU C C 19 176.166 176.166 174.609 1.557 18237
1247 1 5 . 1 1 19 19 GLU CA C 19 53.865 53.865 53.550 0.315 18237
1248 1 5 . 1 1 19 19 GLU CB C 19 33.130 33.130 32.481 0.649 18237
1249 1 5 . 1 1 19 19 GLU H H 19 7.813 7.813 7.991 -0.178 18237
1250 1 5 . 1 1 20 20 TRP N N 20 122.768 122.768 122.723 0.045 18237
1251 1 5 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.564 -0.897 18237
1252 1 5 . 1 1 20 20 TRP C C 20 176.302 176.302 175.766 0.536 18237
1253 1 5 . 1 1 20 20 TRP CA C 20 55.878 55.878 55.265 0.613 18237
1254 1 5 . 1 1 20 20 TRP CB C 20 29.545 29.545 29.012 0.533 18237
1255 1 5 . 1 1 20 20 TRP H H 20 9.094 9.094 7.114 1.980 18237
1256 1 5 . 1 1 21 21 VAL N N 21 123.071 123.071 124.413 -1.342 18237
1257 1 5 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.442 0.543 18237
1258 1 5 . 1 1 21 21 VAL C C 21 175.640 175.640 175.711 -0.071 18237
1259 1 5 . 1 1 21 21 VAL CA C 21 59.537 59.537 60.615 -1.078 18237
1260 1 5 . 1 1 21 21 VAL CB C 21 34.651 34.651 34.930 -0.279 18237
1261 1 5 . 1 1 21 21 VAL H H 21 9.868 9.868 8.445 1.423 18237
1262 1 5 . 1 1 22 22 LEU N N 22 127.193 127.193 129.187 -1.994 18237
1263 1 5 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.514 -0.092 18237
1264 1 5 . 1 1 22 22 LEU C C 22 179.268 179.268 179.008 0.260 18237
1265 1 5 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.563 0.071 18237
1266 1 5 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.400 -0.121 18237
1267 1 5 . 1 1 22 22 LEU H H 22 8.812 8.812 9.079 -0.267 18237
1268 1 5 . 1 1 23 23 LEU N N 23 126.386 126.386 126.487 -0.101 18237
1269 1 5 . 1 1 23 23 LEU C C 23 178.844 178.844 178.240 0.604 18237
1270 1 5 . 1 1 23 23 LEU CA C 23 57.403 57.403 58.091 -0.688 18237
1271 1 5 . 1 1 23 23 LEU CB C 23 41.061 41.061 41.733 -0.672 18237
1272 1 5 . 1 1 23 23 LEU H H 23 8.562 8.562 8.094 0.468 18237
1273 1 5 . 1 1 24 24 SER N N 24 113.100 113.100 114.957 -1.857 18237
1274 1 5 . 1 1 24 24 SER HA H 24 4.621 4.621 4.101 0.520 18237
1275 1 5 . 1 1 24 24 SER C C 24 176.676 176.676 176.295 0.381 18237
1276 1 5 . 1 1 24 24 SER CA C 24 60.960 60.960 61.498 -0.538 18237
1277 1 5 . 1 1 24 24 SER CB C 24 61.650 61.650 62.505 -0.855 18237
1278 1 5 . 1 1 24 24 SER H H 24 9.098 9.098 8.512 0.586 18237
1279 1 5 . 1 1 25 25 THR N N 25 116.715 116.715 115.340 1.375 18237
1280 1 5 . 1 1 25 25 THR HA H 25 3.915 3.915 4.127 -0.212 18237
1281 1 5 . 1 1 25 25 THR CA C 25 64.599 64.599 64.546 0.053 18237
1282 1 5 . 1 1 25 25 THR CB C 25 68.657 68.657 68.610 0.047 18237
1283 1 5 . 1 1 25 25 THR H H 25 7.238 7.238 8.049 -0.811 18237
1284 1 5 . 1 1 26 26 PHE N N 26 118.488 118.488 118.866 -0.378 18237
1285 1 5 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.516 -0.406 18237
1286 1 5 . 1 1 26 26 PHE C C 26 176.181 176.181 176.417 -0.236 18237
1287 1 5 . 1 1 26 26 PHE CA C 26 58.627 58.627 60.218 -1.591 18237
1288 1 5 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.638 0.155 18237
1289 1 5 . 1 1 26 26 PHE H H 26 7.945 7.945 8.167 -0.222 18237
1290 1 5 . 1 1 27 27 LEU N N 27 118.525 118.525 119.573 -1.048 18237
1291 1 5 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.234 0.289 18237
1292 1 5 . 1 1 27 27 LEU C C 27 177.752 177.752 178.347 -0.595 18237
1293 1 5 . 1 1 27 27 LEU CA C 27 54.679 54.679 56.185 -1.506 18237
1294 1 5 . 1 1 27 27 LEU CB C 27 41.333 41.333 42.562 -1.230 18237
1295 1 5 . 1 1 27 27 LEU H H 27 7.290 7.290 7.644 -0.354 18237
1296 1 5 . 1 1 28 28 GLY N N 28 108.823 108.823 105.503 3.320 18237
1297 1 5 . 1 1 28 28 GLY C C 28 174.630 174.630 174.222 0.408 18237
1298 1 5 . 1 1 28 28 GLY CA C 28 45.374 45.374 45.106 0.268 18237
1299 1 5 . 1 1 28 28 GLY H H 28 8.242 8.242 7.988 0.254 18237
1300 1 5 . 1 1 29 29 SER N N 29 116.210 116.210 115.527 0.683 18237
1301 1 5 . 1 1 29 29 SER HA H 29 4.626 4.626 4.620 0.006 18237
1302 1 5 . 1 1 29 29 SER C C 29 175.312 175.312 176.026 -0.714 18237
1303 1 5 . 1 1 29 29 SER CA C 29 57.992 57.992 57.903 0.089 18237
1304 1 5 . 1 1 29 29 SER CB C 29 63.605 63.605 63.875 -0.270 18237
1305 1 5 . 1 1 29 29 SER H H 29 8.310 8.310 7.865 0.445 18237
1306 1 5 . 1 1 30 30 SER N N 30 118.892 118.892 112.563 6.329 18237
1307 1 5 . 1 1 30 30 SER HA H 30 4.597 4.597 4.371 0.226 18237
1308 1 5 . 1 1 30 30 SER C C 30 175.479 175.479 174.609 0.870 18237
1309 1 5 . 1 1 30 30 SER CA C 30 58.582 58.582 59.676 -1.094 18237
1310 1 5 . 1 1 30 30 SER CB C 30 63.605 63.605 61.471 2.134 18237
1311 1 5 . 1 1 30 30 SER H H 30 8.593 8.593 8.663 -0.070 18237
1312 1 5 . 1 1 31 31 GLY N N 31 111.354 111.354 110.493 0.861 18237
1313 1 5 . 1 1 31 31 GLY C C 31 174.428 174.428 175.260 -0.832 18237
1314 1 5 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.614 -0.158 18237
1315 1 5 . 1 1 31 31 GLY H H 31 8.584 8.584 7.896 0.688 18237
1316 1 5 . 1 1 32 32 ASN N N 32 119.486 119.486 118.532 0.954 18237
1317 1 5 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.643 0.174 18237
1318 1 5 . 1 1 32 32 ASN C C 32 175.928 175.928 176.391 -0.463 18237
1319 1 5 . 1 1 32 32 ASN CA C 32 53.215 53.215 52.517 0.698 18237
1320 1 5 . 1 1 32 32 ASN CB C 32 38.780 38.780 37.831 0.949 18237
1321 1 5 . 1 1 32 32 ASN H H 32 8.393 8.393 8.705 -0.312 18237
1322 1 5 . 1 1 33 33 GLU N N 33 122.031 122.031 120.160 1.871 18237
1323 1 5 . 1 1 33 33 GLU HA H 33 4.271 4.271 3.960 0.311 18237
1324 1 5 . 1 1 33 33 GLU CA C 33 57.426 57.426 58.849 -1.423 18237
1325 1 5 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.435 -0.107 18237
1326 1 5 . 1 1 33 33 GLU H H 33 8.711 8.711 8.516 0.195 18237
1327 1 5 . 1 1 34 34 GLN N N 34 120.866 120.866 117.775 3.091 18237
1328 1 5 . 1 1 34 34 GLN HA H 34 4.271 4.271 4.011 0.260 18237
1329 1 5 . 1 1 34 34 GLN CA C 34 56.226 56.226 58.794 -2.568 18237
1330 1 5 . 1 1 34 34 GLN CB C 34 28.839 28.839 28.872 -0.033 18237
1331 1 5 . 1 1 34 34 GLN H H 34 8.438 8.438 7.540 0.898 18237
1332 1 5 . 1 1 35 35 GLU N N 35 122.323 122.323 120.042 2.281 18237
1333 1 5 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.151 0.168 18237
1334 1 5 . 1 1 35 35 GLU C C 35 177.176 177.176 178.949 -1.773 18237
1335 1 5 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.764 -1.768 18237
1336 1 5 . 1 1 35 35 GLU CB C 35 29.545 29.545 29.466 0.079 18237
1337 1 5 . 1 1 35 35 GLU H H 35 8.424 8.424 7.740 0.684 18237
1338 1 5 . 1 1 36 36 LEU N N 36 122.904 122.904 117.361 5.543 18237
1339 1 5 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.113 0.206 18237
1340 1 5 . 1 1 36 36 LEU CA C 36 55.898 55.898 56.446 -0.548 18237
1341 1 5 . 1 1 36 36 LEU CB C 36 41.496 41.496 41.769 -0.273 18237
1342 1 5 . 1 1 36 36 LEU H H 36 8.342 8.342 7.426 0.916 18237
1343 1 5 . 1 1 38 38 GLU N N 38 121.931 121.931 120.945 0.986 18237
1344 1 5 . 1 1 38 38 GLU HA H 38 4.396 4.396 4.138 0.258 18237
1345 1 5 . 1 1 38 38 GLU C C 38 177.318 177.318 178.205 -0.887 18237
1346 1 5 . 1 1 38 38 GLU CA C 38 56.366 56.366 59.314 -2.948 18237
1347 1 5 . 1 1 38 38 GLU CB C 38 29.328 29.328 29.728 -0.400 18237
1348 1 5 . 1 1 38 38 GLU H H 38 8.342 8.342 7.718 0.624 18237
1349 1 5 . 1 1 39 39 LEU N N 39 123.317 123.317 119.430 3.887 18237
1350 1 5 . 1 1 39 39 LEU HA H 39 4.348 4.348 2.226 2.122 18237
1351 1 5 . 1 1 39 39 LEU CA C 39 56.833 56.833 58.157 -1.324 18237
1352 1 5 . 1 1 39 39 LEU CB C 39 41.387 41.387 41.395 -0.008 18237
1353 1 5 . 1 1 39 39 LEU H H 39 8.342 8.342 7.108 1.234 18237
1354 1 5 . 1 1 40 40 ASP N N 40 119.726 119.726 116.245 3.481 18237
1355 1 5 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.243 0.328 18237
1356 1 5 . 1 1 40 40 ASP CA C 40 55.589 55.589 57.486 -1.897 18237
1357 1 5 . 1 1 40 40 ASP H H 40 8.530 8.530 8.448 0.082 18237
1358 1 5 . 1 1 41 41 LYS N N 41 121.200 121.200 118.893 2.307 18237
1359 1 5 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.355 -0.191 18237
1360 1 5 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.286 -0.066 18237
1361 1 5 . 1 1 41 41 LYS H H 41 8.145 8.145 7.776 0.369 18237
1362 1 5 . 1 1 42 42 TRP N N 42 120.615 120.615 120.698 -0.083 18237
1363 1 5 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.390 0.207 18237
1364 1 5 . 1 1 42 42 TRP C C 42 177.641 177.641 178.291 -0.650 18237
1365 1 5 . 1 1 42 42 TRP CA C 42 58.561 58.561 58.755 -0.194 18237
1366 1 5 . 1 1 42 42 TRP CB C 42 28.839 28.839 28.102 0.737 18237
1367 1 5 . 1 1 42 42 TRP H H 42 8.025 8.025 8.332 -0.307 18237
1368 1 5 . 1 1 43 43 ALA N N 43 122.056 122.056 120.979 1.077 18237
1369 1 5 . 1 1 43 43 ALA HA H 43 4.140 4.140 4.159 -0.019 18237
1370 1 5 . 1 1 43 43 ALA C C 43 172.776 172.776 179.919 -7.143 18237
1371 1 5 . 1 1 43 43 ALA CA C 43 54.864 54.864 55.322 -0.459 18237
1372 1 5 . 1 1 43 43 ALA CB C 43 17.974 17.974 17.853 0.121 18237
1373 1 5 . 1 1 43 43 ALA H H 43 8.199 8.199 7.970 0.229 18237
1374 1 5 . 1 1 44 44 SER N N 44 113.378 113.378 115.474 -2.096 18237
1375 1 5 . 1 1 44 44 SER HA H 44 4.376 4.376 4.228 0.148 18237
1376 1 5 . 1 1 44 44 SER C C 44 176.767 176.767 176.841 -0.074 18237
1377 1 5 . 1 1 44 44 SER CA C 44 60.980 60.980 62.195 -1.215 18237
1378 1 5 . 1 1 44 44 SER CB C 44 62.410 62.410 62.930 -0.520 18237
1379 1 5 . 1 1 44 44 SER H H 44 8.210 8.210 8.332 -0.122 18237
1380 1 5 . 1 1 45 45 LEU N N 45 123.425 123.425 121.775 1.650 18237
1381 1 5 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.355 -0.161 18237
1382 1 5 . 1 1 45 45 LEU CA C 45 57.606 57.606 57.443 0.163 18237
1383 1 5 . 1 1 45 45 LEU CB C 45 41.170 41.170 41.698 -0.528 18237
1384 1 5 . 1 1 45 45 LEU H H 45 7.906 7.906 7.514 0.392 18237
1385 1 5 . 1 1 46 46 TRP N N 46 118.572 118.572 120.914 -2.342 18237
1386 1 5 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.240 0.415 18237
1387 1 5 . 1 1 46 46 TRP C C 46 177.838 177.838 177.205 0.633 18237
1388 1 5 . 1 1 46 46 TRP CA C 46 58.907 58.907 61.228 -2.321 18237
1389 1 5 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.374 -0.155 18237
1390 1 5 . 1 1 46 46 TRP H H 46 8.043 8.043 8.307 -0.264 18237
1391 1 5 . 1 1 47 47 ASN N N 47 116.564 116.564 116.745 -0.181 18237
1392 1 5 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.230 0.396 18237
1393 1 5 . 1 1 47 47 ASN C C 47 176.904 176.904 176.965 -0.061 18237
1394 1 5 . 1 1 47 47 ASN CA C 47 55.045 55.045 54.875 0.170 18237
1395 1 5 . 1 1 47 47 ASN CB C 47 38.563 38.563 38.518 0.045 18237
1396 1 5 . 1 1 47 47 ASN H H 47 8.174 8.174 8.569 -0.395 18237
1397 1 5 . 1 1 48 48 TRP N N 48 121.421 121.421 120.651 0.770 18237
1398 1 5 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.585 -0.218 18237
1399 1 5 . 1 1 48 48 TRP CA C 48 59.517 59.517 58.533 0.984 18237
1400 1 5 . 1 1 48 48 TRP CB C 48 28.893 28.893 29.908 -1.015 18237
1401 1 5 . 1 1 48 48 TRP H H 48 8.145 8.145 7.650 0.495 18237
1402 1 5 . 1 1 49 49 PHE N N 49 118.299 118.299 119.498 -1.199 18237
1403 1 5 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.213 1.039 18237
1404 1 5 . 1 1 49 49 PHE C C 49 175.565 175.565 175.995 -0.430 18237
1405 1 5 . 1 1 49 49 PHE CA C 49 58.887 58.887 59.668 -0.781 18237
1406 1 5 . 1 1 49 49 PHE CB C 49 38.671 38.671 38.059 0.612 18237
1407 1 5 . 1 1 49 49 PHE H H 49 8.036 8.036 8.476 -0.440 18237
1408 1 5 . 1 1 50 50 ASN N N 50 118.836 118.836 119.426 -0.590 18237
1409 1 5 . 1 1 50 50 ASN HA H 50 4.626 4.626 3.918 0.708 18237
1410 1 5 . 1 1 50 50 ASN C C 50 176.439 176.439 176.615 -0.176 18237
1411 1 5 . 1 1 50 50 ASN CA C 50 53.215 53.215 55.103 -1.888 18237
1412 1 5 . 1 1 50 50 ASN CB C 50 38.128 38.128 37.208 0.920 18237
1413 1 5 . 1 1 50 50 ASN H H 50 7.795 7.795 7.565 0.230 18237
1414 1 5 . 1 1 51 51 ILE N N 51 120.218 120.218 116.777 3.441 18237
1415 1 5 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.876 -0.085 18237
1416 1 5 . 1 1 51 51 ILE C C 51 177.202 177.202 177.405 -0.203 18237
1417 1 5 . 1 1 51 51 ILE CA C 51 63.102 63.102 64.720 -1.618 18237
1418 1 5 . 1 1 51 51 ILE CB C 51 37.367 37.367 36.952 0.416 18237
1419 1 5 . 1 1 51 51 ILE H H 51 8.147 8.147 7.318 0.829 18237
1420 1 5 . 1 1 52 52 THR N N 52 115.352 115.352 114.603 0.749 18237
1421 1 5 . 1 1 52 52 THR HA H 52 4.031 4.031 3.980 0.051 18237
1422 1 5 . 1 1 52 52 THR C C 52 176.095 176.095 176.000 0.095 18237
1423 1 5 . 1 1 52 52 THR CA C 52 65.148 65.148 65.545 -0.397 18237
1424 1 5 . 1 1 52 52 THR CB C 52 68.277 68.277 68.198 0.079 18237
1425 1 5 . 1 1 52 52 THR H H 52 8.009 8.009 7.299 0.710 18237
1426 1 5 . 1 1 53 53 ASN N N 53 119.874 119.874 120.918 -1.044 18237
1427 1 5 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.128 0.508 18237
1428 1 5 . 1 1 53 53 ASN C C 53 176.530 176.530 177.284 -0.754 18237
1429 1 5 . 1 1 53 53 ASN CA C 53 54.457 54.457 55.253 -0.796 18237
1430 1 5 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.340 0.462 18237
1431 1 5 . 1 1 53 53 ASN H H 53 7.972 7.972 6.965 1.007 18237
1432 1 5 . 1 1 54 54 TRP N N 54 120.192 120.192 119.851 0.341 18237
1433 1 5 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.806 -0.151 18237
1434 1 5 . 1 1 54 54 TRP CA C 54 58.643 58.643 58.337 0.306 18237
1435 1 5 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.167 -0.002 18237
1436 1 5 . 1 1 54 54 TRP H H 54 7.897 7.897 7.174 0.723 18237
1437 1 5 . 1 1 55 55 LEU N N 55 118.354 118.354 123.014 -4.660 18237
1438 1 5 . 1 1 55 55 LEU HA H 55 4.088 4.088 3.945 0.143 18237
1439 1 5 . 1 1 55 55 LEU C C 55 177.975 177.975 178.164 -0.189 18237
1440 1 5 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.424 -1.954 18237
1441 1 5 . 1 1 55 55 LEU CB C 55 40.898 40.898 41.961 -1.063 18237
1442 1 5 . 1 1 55 55 LEU H H 55 7.931 7.931 7.721 0.210 18237
1443 1 5 . 1 1 56 56 TRP N N 56 118.335 118.335 117.541 0.794 18237
1444 1 5 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.468 -0.101 18237
1445 1 5 . 1 1 56 56 TRP C C 56 176.863 176.863 177.397 -0.534 18237
1446 1 5 . 1 1 56 56 TRP CA C 56 59.070 59.070 57.616 1.454 18237
1447 1 5 . 1 1 56 56 TRP CB C 56 28.839 28.839 27.641 1.198 18237
1448 1 5 . 1 1 56 56 TRP H H 56 7.665 7.665 8.021 -0.356 18237
1449 1 5 . 1 1 57 57 TYR N N 57 116.808 116.808 121.063 -4.255 18237
1450 1 5 . 1 1 57 57 TYR HA H 57 4.172 4.172 3.812 0.360 18237
1451 1 5 . 1 1 57 57 TYR C C 57 176.085 176.085 176.536 -0.451 18237
1452 1 5 . 1 1 57 57 TYR CA C 57 59.865 59.865 61.195 -1.330 18237
1453 1 5 . 1 1 57 57 TYR CB C 57 38.563 38.563 39.267 -0.703 18237
1454 1 5 . 1 1 57 57 TYR H H 57 7.578 7.578 8.120 -0.542 18237
1455 1 5 . 1 1 58 58 ILE N N 58 115.526 115.526 116.102 -0.576 18237
1456 1 5 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.115 0.150 18237
1457 1 5 . 1 1 58 58 ILE C C 58 174.782 174.782 175.721 -0.939 18237
1458 1 5 . 1 1 58 58 ILE CA C 58 60.940 60.940 62.065 -1.125 18237
1459 1 5 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.818 -0.636 18237
1460 1 5 . 1 1 58 58 ILE H H 58 7.586 7.586 7.688 -0.102 18237
1461 1 6 . 1 1 2 2 TYR N N 2 120.470 120.470 120.516 -0.046 18237
1462 1 6 . 1 1 2 2 TYR C C 2 176.535 176.535 175.442 1.093 18237
1463 1 6 . 1 1 2 2 TYR CA C 2 55.995 55.995 55.833 0.162 18237
1464 1 6 . 1 1 2 2 TYR CB C 2 37.313 37.313 39.116 -1.803 18237
1465 1 6 . 1 1 2 2 TYR H H 2 7.951 7.951 7.509 0.442 18237
1466 1 6 . 1 1 3 3 ILE N N 3 118.307 118.307 120.604 -2.297 18237
1467 1 6 . 1 1 3 3 ILE CA C 3 58.968 58.968 61.407 -2.439 18237
1468 1 6 . 1 1 3 3 ILE CB C 3 38.074 38.074 37.759 0.315 18237
1469 1 6 . 1 1 3 3 ILE H H 3 8.381 8.381 8.371 0.010 18237
1470 1 6 . 1 1 5 5 GLU N N 5 118.785 118.785 117.701 1.084 18237
1471 1 6 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.419 -0.164 18237
1472 1 6 . 1 1 5 5 GLU C C 5 176.267 176.267 174.381 1.886 18237
1473 1 6 . 1 1 5 5 GLU CA C 5 55.959 55.959 56.211 -0.252 18237
1474 1 6 . 1 1 5 5 GLU CB C 5 30.034 30.034 29.981 0.053 18237
1475 1 6 . 1 1 5 5 GLU H H 5 7.710 7.710 7.818 -0.108 18237
1476 1 6 . 1 1 6 6 ALA N N 6 131.546 131.546 122.995 8.551 18237
1477 1 6 . 1 1 6 6 ALA HA H 6 3.575 3.575 4.457 -0.882 18237
1478 1 6 . 1 1 6 6 ALA CA C 6 50.959 50.959 51.506 -0.547 18237
1479 1 6 . 1 1 6 6 ALA CB C 6 14.389 14.389 18.776 -4.387 18237
1480 1 6 . 1 1 6 6 ALA H H 6 8.338 8.338 8.083 0.255 18237
1481 1 6 . 1 1 8 8 ARG N N 8 126.915 126.915 121.466 5.449 18237
1482 1 6 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.490 -0.420 18237
1483 1 6 . 1 1 8 8 ARG C C 8 175.110 175.110 175.165 -0.055 18237
1484 1 6 . 1 1 8 8 ARG CA C 8 54.699 54.699 55.895 -1.196 18237
1485 1 6 . 1 1 8 8 ARG CB C 8 28.078 28.078 31.202 -3.124 18237
1486 1 6 . 1 1 8 8 ARG H H 8 8.725 8.725 8.405 0.320 18237
1487 1 6 . 1 1 9 9 ASP N N 9 123.653 123.653 123.247 0.406 18237
1488 1 6 . 1 1 9 9 ASP C C 9 178.015 178.015 177.075 0.940 18237
1489 1 6 . 1 1 9 9 ASP CA C 9 52.747 52.747 53.706 -0.959 18237
1490 1 6 . 1 1 9 9 ASP CB C 9 40.844 40.844 41.294 -0.450 18237
1491 1 6 . 1 1 9 9 ASP H H 9 8.432 8.432 8.546 -0.114 18237
1492 1 6 . 1 1 10 10 GLY N N 10 111.908 111.908 107.220 4.688 18237
1493 1 6 . 1 1 10 10 GLY C C 10 174.822 174.822 174.737 0.085 18237
1494 1 6 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.342 -0.097 18237
1495 1 6 . 1 1 10 10 GLY H H 10 9.727 9.727 8.302 1.425 18237
1496 1 6 . 1 1 11 11 GLN N N 11 118.395 118.395 118.822 -0.427 18237
1497 1 6 . 1 1 11 11 GLN C C 11 174.711 174.711 174.509 0.202 18237
1498 1 6 . 1 1 11 11 GLN CA C 11 53.398 53.398 54.869 -1.471 18237
1499 1 6 . 1 1 11 11 GLN CB C 11 30.306 30.306 29.657 0.649 18237
1500 1 6 . 1 1 11 11 GLN H H 11 8.416 8.416 7.810 0.606 18237
1501 1 6 . 1 1 12 12 ALA N N 12 121.020 121.020 122.807 -1.787 18237
1502 1 6 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.630 0.313 18237
1503 1 6 . 1 1 12 12 ALA C C 12 177.990 177.990 175.160 2.830 18237
1504 1 6 . 1 1 12 12 ALA CA C 12 50.511 50.511 51.283 -0.772 18237
1505 1 6 . 1 1 12 12 ALA CB C 12 20.147 20.147 21.088 -0.941 18237
1506 1 6 . 1 1 12 12 ALA H H 12 7.933 7.933 8.148 -0.215 18237
1507 1 6 . 1 1 13 13 TYR N N 13 121.755 121.755 119.325 2.430 18237
1508 1 6 . 1 1 13 13 TYR C C 13 175.519 175.519 174.815 0.704 18237
1509 1 6 . 1 1 13 13 TYR CA C 13 59.090 59.090 57.098 1.992 18237
1510 1 6 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.480 1.700 18237
1511 1 6 . 1 1 13 13 TYR H H 13 9.575 9.575 8.505 1.070 18237
1512 1 6 . 1 1 14 14 VAL N N 14 112.251 112.251 120.738 -8.487 18237
1513 1 6 . 1 1 14 14 VAL C C 14 174.074 174.074 174.605 -0.531 18237
1514 1 6 . 1 1 14 14 VAL CA C 14 59.090 59.090 59.572 -0.482 18237
1515 1 6 . 1 1 14 14 VAL CB C 14 32.750 32.750 35.080 -2.330 18237
1516 1 6 . 1 1 14 14 VAL H H 14 9.659 9.659 8.615 1.044 18237
1517 1 6 . 1 1 15 15 ARG N N 15 124.657 124.657 123.319 1.338 18237
1518 1 6 . 1 1 15 15 ARG C C 15 174.948 174.948 175.213 -0.265 18237
1519 1 6 . 1 1 15 15 ARG CA C 15 53.520 53.520 56.072 -2.552 18237
1520 1 6 . 1 1 15 15 ARG CB C 15 32.533 32.533 30.304 2.229 18237
1521 1 6 . 1 1 15 15 ARG H H 15 8.503 8.503 8.538 -0.035 18237
1522 1 6 . 1 1 16 16 LYS N N 16 128.240 128.240 127.708 0.532 18237
1523 1 6 . 1 1 16 16 LYS C C 16 175.974 175.974 175.279 0.695 18237
1524 1 6 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.937 -0.161 18237
1525 1 6 . 1 1 16 16 LYS CB C 16 36.553 36.553 35.228 1.325 18237
1526 1 6 . 1 1 16 16 LYS H H 16 9.052 9.052 8.633 0.419 18237
1527 1 6 . 1 1 17 17 ASP N N 17 130.562 130.562 126.501 4.061 18237
1528 1 6 . 1 1 17 17 ASP C C 17 175.822 175.822 176.416 -0.594 18237
1529 1 6 . 1 1 17 17 ASP CA C 17 56.447 56.447 54.757 1.690 18237
1530 1 6 . 1 1 17 17 ASP CB C 17 40.192 40.192 40.045 0.147 18237
1531 1 6 . 1 1 17 17 ASP H H 17 10.886 10.886 8.982 1.904 18237
1532 1 6 . 1 1 18 18 GLY N N 18 104.754 104.754 104.987 -0.233 18237
1533 1 6 . 1 1 18 18 GLY C C 18 173.104 173.104 173.191 -0.087 18237
1534 1 6 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.426 -0.182 18237
1535 1 6 . 1 1 18 18 GLY H H 18 9.353 9.353 8.297 1.056 18237
1536 1 6 . 1 1 19 19 GLU N N 19 117.501 117.501 118.480 -0.979 18237
1537 1 6 . 1 1 19 19 GLU HA H 19 4.648 4.648 4.141 0.507 18237
1538 1 6 . 1 1 19 19 GLU C C 19 176.166 176.166 174.424 1.742 18237
1539 1 6 . 1 1 19 19 GLU CA C 19 53.865 53.865 53.403 0.462 18237
1540 1 6 . 1 1 19 19 GLU CB C 19 33.130 33.130 31.705 1.425 18237
1541 1 6 . 1 1 19 19 GLU H H 19 7.813 7.813 8.077 -0.264 18237
1542 1 6 . 1 1 20 20 TRP N N 20 122.768 122.768 122.996 -0.228 18237
1543 1 6 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.604 -0.937 18237
1544 1 6 . 1 1 20 20 TRP C C 20 176.302 176.302 176.189 0.113 18237
1545 1 6 . 1 1 20 20 TRP CA C 20 55.878 55.878 55.170 0.708 18237
1546 1 6 . 1 1 20 20 TRP CB C 20 29.545 29.545 29.184 0.361 18237
1547 1 6 . 1 1 20 20 TRP H H 20 9.094 9.094 7.096 1.998 18237
1548 1 6 . 1 1 21 21 VAL N N 21 123.071 123.071 125.100 -2.029 18237
1549 1 6 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.477 0.508 18237
1550 1 6 . 1 1 21 21 VAL C C 21 175.640 175.640 175.622 0.018 18237
1551 1 6 . 1 1 21 21 VAL CA C 21 59.537 59.537 60.835 -1.298 18237
1552 1 6 . 1 1 21 21 VAL CB C 21 34.651 34.651 34.663 -0.012 18237
1553 1 6 . 1 1 21 21 VAL H H 21 9.868 9.868 8.239 1.629 18237
1554 1 6 . 1 1 22 22 LEU N N 22 127.193 127.193 129.242 -2.049 18237
1555 1 6 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.295 0.127 18237
1556 1 6 . 1 1 22 22 LEU C C 22 179.268 179.268 178.893 0.375 18237
1557 1 6 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.549 0.085 18237
1558 1 6 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.371 -0.092 18237
1559 1 6 . 1 1 22 22 LEU H H 22 8.812 8.812 9.089 -0.277 18237
1560 1 6 . 1 1 23 23 LEU N N 23 126.386 126.386 124.738 1.648 18237
1561 1 6 . 1 1 23 23 LEU C C 23 178.844 178.844 178.545 0.299 18237
1562 1 6 . 1 1 23 23 LEU CA C 23 57.403 57.403 58.566 -1.163 18237
1563 1 6 . 1 1 23 23 LEU CB C 23 41.061 41.061 41.389 -0.328 18237
1564 1 6 . 1 1 23 23 LEU H H 23 8.562 8.562 8.282 0.280 18237
1565 1 6 . 1 1 24 24 SER N N 24 113.100 113.100 115.407 -2.307 18237
1566 1 6 . 1 1 24 24 SER HA H 24 4.621 4.621 4.047 0.574 18237
1567 1 6 . 1 1 24 24 SER C C 24 176.676 176.676 176.367 0.309 18237
1568 1 6 . 1 1 24 24 SER CA C 24 60.960 60.960 62.612 -1.652 18237
1569 1 6 . 1 1 24 24 SER CB C 24 61.650 61.650 62.430 -0.780 18237
1570 1 6 . 1 1 24 24 SER H H 24 9.098 9.098 8.501 0.597 18237
1571 1 6 . 1 1 25 25 THR N N 25 116.715 116.715 114.891 1.824 18237
1572 1 6 . 1 1 25 25 THR HA H 25 3.915 3.915 4.105 -0.190 18237
1573 1 6 . 1 1 25 25 THR CA C 25 64.599 64.599 65.120 -0.520 18237
1574 1 6 . 1 1 25 25 THR CB C 25 68.657 68.657 68.695 -0.038 18237
1575 1 6 . 1 1 25 25 THR H H 25 7.238 7.238 8.094 -0.856 18237
1576 1 6 . 1 1 26 26 PHE N N 26 118.488 118.488 119.654 -1.166 18237
1577 1 6 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.551 -0.441 18237
1578 1 6 . 1 1 26 26 PHE C C 26 176.181 176.181 176.850 -0.669 18237
1579 1 6 . 1 1 26 26 PHE CA C 26 58.627 58.627 59.617 -0.990 18237
1580 1 6 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.993 -0.200 18237
1581 1 6 . 1 1 26 26 PHE H H 26 7.945 7.945 8.277 -0.332 18237
1582 1 6 . 1 1 27 27 LEU N N 27 118.525 118.525 120.769 -2.244 18237
1583 1 6 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.332 0.191 18237
1584 1 6 . 1 1 27 27 LEU C C 27 177.752 177.752 177.217 0.535 18237
1585 1 6 . 1 1 27 27 LEU CA C 27 54.679 54.679 55.993 -1.314 18237
1586 1 6 . 1 1 27 27 LEU CB C 27 41.333 41.333 43.040 -1.707 18237
1587 1 6 . 1 1 27 27 LEU H H 27 7.290 7.290 7.940 -0.650 18237
1588 1 6 . 1 1 28 28 GLY N N 28 108.823 108.823 107.925 0.898 18237
1589 1 6 . 1 1 28 28 GLY C C 28 174.630 174.630 173.253 1.377 18237
1590 1 6 . 1 1 28 28 GLY CA C 28 45.374 45.374 45.018 0.356 18237
1591 1 6 . 1 1 28 28 GLY H H 28 8.242 8.242 7.864 0.378 18237
1592 1 6 . 1 1 29 29 SER N N 29 116.210 116.210 118.747 -2.537 18237
1593 1 6 . 1 1 29 29 SER HA H 29 4.626 4.626 4.711 -0.085 18237
1594 1 6 . 1 1 29 29 SER C C 29 175.312 175.312 174.211 1.101 18237
1595 1 6 . 1 1 29 29 SER CA C 29 57.992 57.992 57.628 0.364 18237
1596 1 6 . 1 1 29 29 SER CB C 29 63.605 63.605 65.734 -2.129 18237
1597 1 6 . 1 1 29 29 SER H H 29 8.310 8.310 8.195 0.115 18237
1598 1 6 . 1 1 30 30 SER N N 30 118.892 118.892 116.540 2.352 18237
1599 1 6 . 1 1 30 30 SER HA H 30 4.597 4.597 4.177 0.420 18237
1600 1 6 . 1 1 30 30 SER C C 30 175.479 175.479 175.219 0.260 18237
1601 1 6 . 1 1 30 30 SER CA C 30 58.582 58.582 60.803 -2.221 18237
1602 1 6 . 1 1 30 30 SER CB C 30 63.605 63.605 62.036 1.569 18237
1603 1 6 . 1 1 30 30 SER H H 30 8.593 8.593 8.874 -0.281 18237
1604 1 6 . 1 1 31 31 GLY N N 31 111.354 111.354 108.987 2.367 18237
1605 1 6 . 1 1 31 31 GLY C C 31 174.428 174.428 174.160 0.268 18237
1606 1 6 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.599 -0.142 18237
1607 1 6 . 1 1 31 31 GLY H H 31 8.584 8.584 7.950 0.634 18237
1608 1 6 . 1 1 32 32 ASN N N 32 119.486 119.486 115.467 4.019 18237
1609 1 6 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.704 0.113 18237
1610 1 6 . 1 1 32 32 ASN C C 32 175.928 175.928 175.099 0.829 18237
1611 1 6 . 1 1 32 32 ASN CA C 32 53.215 53.215 53.139 0.076 18237
1612 1 6 . 1 1 32 32 ASN CB C 32 38.780 38.780 39.487 -0.707 18237
1613 1 6 . 1 1 32 32 ASN H H 32 8.393 8.393 7.807 0.586 18237
1614 1 6 . 1 1 33 33 GLU N N 33 122.031 122.031 119.936 2.095 18237
1615 1 6 . 1 1 33 33 GLU HA H 33 4.271 4.271 4.026 0.245 18237
1616 1 6 . 1 1 33 33 GLU CA C 33 57.426 57.426 58.707 -1.281 18237
1617 1 6 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.350 -0.022 18237
1618 1 6 . 1 1 33 33 GLU H H 33 8.711 8.711 8.676 0.035 18237
1619 1 6 . 1 1 34 34 GLN N N 34 120.866 120.866 118.185 2.681 18237
1620 1 6 . 1 1 34 34 GLN HA H 34 4.271 4.271 4.075 0.196 18237
1621 1 6 . 1 1 34 34 GLN CA C 34 56.226 56.226 58.990 -2.764 18237
1622 1 6 . 1 1 34 34 GLN CB C 34 28.839 28.839 28.435 0.404 18237
1623 1 6 . 1 1 34 34 GLN H H 34 8.438 8.438 8.330 0.108 18237
1624 1 6 . 1 1 35 35 GLU N N 35 122.323 122.323 119.547 2.776 18237
1625 1 6 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.193 0.126 18237
1626 1 6 . 1 1 35 35 GLU C C 35 177.176 177.176 178.674 -1.498 18237
1627 1 6 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.554 -1.558 18237
1628 1 6 . 1 1 35 35 GLU CB C 35 29.545 29.545 28.887 0.658 18237
1629 1 6 . 1 1 35 35 GLU H H 35 8.424 8.424 7.987 0.437 18237
1630 1 6 . 1 1 36 36 LEU N N 36 122.904 122.904 118.438 4.466 18237
1631 1 6 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.202 0.117 18237
1632 1 6 . 1 1 36 36 LEU CA C 36 55.898 55.898 56.839 -0.941 18237
1633 1 6 . 1 1 36 36 LEU CB C 36 41.496 41.496 42.172 -0.676 18237
1634 1 6 . 1 1 36 36 LEU H H 36 8.342 8.342 7.380 0.962 18237
1635 1 6 . 1 1 38 38 GLU N N 38 121.931 121.931 120.648 1.283 18237
1636 1 6 . 1 1 38 38 GLU HA H 38 4.396 4.396 4.001 0.395 18237
1637 1 6 . 1 1 38 38 GLU C C 38 177.318 177.318 178.606 -1.288 18237
1638 1 6 . 1 1 38 38 GLU CA C 38 56.366 56.366 59.772 -3.405 18237
1639 1 6 . 1 1 38 38 GLU CB C 38 29.328 29.328 29.565 -0.237 18237
1640 1 6 . 1 1 38 38 GLU H H 38 8.342 8.342 7.834 0.508 18237
1641 1 6 . 1 1 39 39 LEU N N 39 123.317 123.317 120.411 2.906 18237
1642 1 6 . 1 1 39 39 LEU HA H 39 4.348 4.348 4.166 0.182 18237
1643 1 6 . 1 1 39 39 LEU CA C 39 56.833 56.833 58.788 -1.956 18237
1644 1 6 . 1 1 39 39 LEU CB C 39 41.387 41.387 41.968 -0.581 18237
1645 1 6 . 1 1 39 39 LEU H H 39 8.342 8.342 8.057 0.285 18237
1646 1 6 . 1 1 40 40 ASP N N 40 119.726 119.726 117.221 2.505 18237
1647 1 6 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.303 0.268 18237
1648 1 6 . 1 1 40 40 ASP CA C 40 55.589 55.589 57.968 -2.380 18237
1649 1 6 . 1 1 40 40 ASP H H 40 8.530 8.530 8.564 -0.034 18237
1650 1 6 . 1 1 41 41 LYS N N 41 121.200 121.200 120.902 0.298 18237
1651 1 6 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.074 0.090 18237
1652 1 6 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.725 -0.505 18237
1653 1 6 . 1 1 41 41 LYS H H 41 8.145 8.145 7.800 0.345 18237
1654 1 6 . 1 1 42 42 TRP N N 42 120.615 120.615 119.946 0.669 18237
1655 1 6 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.342 0.255 18237
1656 1 6 . 1 1 42 42 TRP C C 42 177.641 177.641 178.489 -0.848 18237
1657 1 6 . 1 1 42 42 TRP CA C 42 58.561 58.561 59.845 -1.284 18237
1658 1 6 . 1 1 42 42 TRP CB C 42 28.839 28.839 29.114 -0.275 18237
1659 1 6 . 1 1 42 42 TRP H H 42 8.025 8.025 7.977 0.048 18237
1660 1 6 . 1 1 43 43 ALA N N 43 122.056 122.056 120.783 1.273 18237
1661 1 6 . 1 1 43 43 ALA HA H 43 4.140 4.140 4.062 0.078 18237
1662 1 6 . 1 1 43 43 ALA C C 43 172.776 172.776 179.344 -6.568 18237
1663 1 6 . 1 1 43 43 ALA CA C 43 54.864 54.864 55.344 -0.480 18237
1664 1 6 . 1 1 43 43 ALA CB C 43 17.974 17.974 17.970 0.004 18237
1665 1 6 . 1 1 43 43 ALA H H 43 8.199 8.199 8.713 -0.514 18237
1666 1 6 . 1 1 44 44 SER N N 44 113.378 113.378 115.287 -1.909 18237
1667 1 6 . 1 1 44 44 SER HA H 44 4.376 4.376 4.244 0.132 18237
1668 1 6 . 1 1 44 44 SER C C 44 176.767 176.767 176.759 0.008 18237
1669 1 6 . 1 1 44 44 SER CA C 44 60.980 60.980 62.323 -1.343 18237
1670 1 6 . 1 1 44 44 SER CB C 44 62.410 62.410 62.670 -0.261 18237
1671 1 6 . 1 1 44 44 SER H H 44 8.210 8.210 7.624 0.586 18237
1672 1 6 . 1 1 45 45 LEU N N 45 123.425 123.425 122.875 0.550 18237
1673 1 6 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.401 -0.207 18237
1674 1 6 . 1 1 45 45 LEU CA C 45 57.606 57.606 58.195 -0.589 18237
1675 1 6 . 1 1 45 45 LEU CB C 45 41.170 41.170 41.340 -0.170 18237
1676 1 6 . 1 1 45 45 LEU H H 45 7.906 7.906 7.592 0.314 18237
1677 1 6 . 1 1 46 46 TRP N N 46 118.572 118.572 119.085 -0.513 18237
1678 1 6 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.318 0.337 18237
1679 1 6 . 1 1 46 46 TRP C C 46 177.838 177.838 178.866 -1.028 18237
1680 1 6 . 1 1 46 46 TRP CA C 46 58.907 58.907 59.940 -1.033 18237
1681 1 6 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.636 -0.416 18237
1682 1 6 . 1 1 46 46 TRP H H 46 8.043 8.043 8.755 -0.712 18237
1683 1 6 . 1 1 47 47 ASN N N 47 116.564 116.564 117.221 -0.657 18237
1684 1 6 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.704 -0.078 18237
1685 1 6 . 1 1 47 47 ASN C C 47 176.904 176.904 177.702 -0.798 18237
1686 1 6 . 1 1 47 47 ASN CA C 47 55.045 55.045 55.811 -0.766 18237
1687 1 6 . 1 1 47 47 ASN CB C 47 38.563 38.563 38.362 0.201 18237
1688 1 6 . 1 1 47 47 ASN H H 47 8.174 8.174 8.864 -0.690 18237
1689 1 6 . 1 1 48 48 TRP N N 48 121.421 121.421 121.382 0.039 18237
1690 1 6 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.697 -0.330 18237
1691 1 6 . 1 1 48 48 TRP CA C 48 59.517 59.517 58.188 1.329 18237
1692 1 6 . 1 1 48 48 TRP CB C 48 28.893 28.893 28.915 -0.022 18237
1693 1 6 . 1 1 48 48 TRP H H 48 8.145 8.145 8.316 -0.171 18237
1694 1 6 . 1 1 49 49 PHE N N 49 118.299 118.299 122.122 -3.823 18237
1695 1 6 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.638 0.614 18237
1696 1 6 . 1 1 49 49 PHE C C 49 175.565 175.565 174.565 1.000 18237
1697 1 6 . 1 1 49 49 PHE CA C 49 58.887 58.887 58.082 0.805 18237
1698 1 6 . 1 1 49 49 PHE CB C 49 38.671 38.671 38.441 0.230 18237
1699 1 6 . 1 1 49 49 PHE H H 49 8.036 8.036 7.773 0.263 18237
1700 1 6 . 1 1 50 50 ASN N N 50 118.836 118.836 118.757 0.079 18237
1701 1 6 . 1 1 50 50 ASN HA H 50 4.626 4.626 4.063 0.563 18237
1702 1 6 . 1 1 50 50 ASN C C 50 176.439 176.439 176.977 -0.538 18237
1703 1 6 . 1 1 50 50 ASN CA C 50 53.215 53.215 54.876 -1.661 18237
1704 1 6 . 1 1 50 50 ASN CB C 50 38.128 38.128 37.377 0.750 18237
1705 1 6 . 1 1 50 50 ASN H H 50 7.795 7.795 7.589 0.206 18237
1706 1 6 . 1 1 51 51 ILE N N 51 120.218 120.218 115.516 4.702 18237
1707 1 6 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.914 -0.123 18237
1708 1 6 . 1 1 51 51 ILE C C 51 177.202 177.202 177.154 0.048 18237
1709 1 6 . 1 1 51 51 ILE CA C 51 63.102 63.102 64.796 -1.694 18237
1710 1 6 . 1 1 51 51 ILE CB C 51 37.367 37.367 37.010 0.357 18237
1711 1 6 . 1 1 51 51 ILE H H 51 8.147 8.147 7.027 1.120 18237
1712 1 6 . 1 1 52 52 THR N N 52 115.352 115.352 112.965 2.387 18237
1713 1 6 . 1 1 52 52 THR HA H 52 4.031 4.031 4.065 -0.034 18237
1714 1 6 . 1 1 52 52 THR C C 52 176.095 176.095 176.677 -0.582 18237
1715 1 6 . 1 1 52 52 THR CA C 52 65.148 65.148 65.458 -0.310 18237
1716 1 6 . 1 1 52 52 THR CB C 52 68.277 68.277 68.032 0.245 18237
1717 1 6 . 1 1 52 52 THR H H 52 8.009 8.009 7.431 0.578 18237
1718 1 6 . 1 1 53 53 ASN N N 53 119.874 119.874 122.012 -2.138 18237
1719 1 6 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.235 0.401 18237
1720 1 6 . 1 1 53 53 ASN C C 53 176.530 176.530 177.166 -0.636 18237
1721 1 6 . 1 1 53 53 ASN CA C 53 54.457 54.457 55.779 -1.323 18237
1722 1 6 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.584 0.217 18237
1723 1 6 . 1 1 53 53 ASN H H 53 7.972 7.972 7.111 0.861 18237
1724 1 6 . 1 1 54 54 TRP N N 54 120.192 120.192 120.212 -0.020 18237
1725 1 6 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.493 0.162 18237
1726 1 6 . 1 1 54 54 TRP CA C 54 58.643 58.643 59.009 -0.366 18237
1727 1 6 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.227 -0.062 18237
1728 1 6 . 1 1 54 54 TRP H H 54 7.897 7.897 7.405 0.492 18237
1729 1 6 . 1 1 55 55 LEU N N 55 118.354 118.354 121.144 -2.790 18237
1730 1 6 . 1 1 55 55 LEU HA H 55 4.088 4.088 3.884 0.204 18237
1731 1 6 . 1 1 55 55 LEU C C 55 177.975 177.975 178.759 -0.784 18237
1732 1 6 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.538 -2.068 18237
1733 1 6 . 1 1 55 55 LEU CB C 55 40.898 40.898 42.025 -1.127 18237
1734 1 6 . 1 1 55 55 LEU H H 55 7.931 7.931 8.208 -0.277 18237
1735 1 6 . 1 1 56 56 TRP N N 56 118.335 118.335 117.002 1.333 18237
1736 1 6 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.331 0.036 18237
1737 1 6 . 1 1 56 56 TRP C C 56 176.863 176.863 178.265 -1.402 18237
1738 1 6 . 1 1 56 56 TRP CA C 56 59.070 59.070 61.068 -1.998 18237
1739 1 6 . 1 1 56 56 TRP CB C 56 28.839 28.839 28.905 -0.066 18237
1740 1 6 . 1 1 56 56 TRP H H 56 7.665 7.665 7.913 -0.248 18237
1741 1 6 . 1 1 57 57 TYR N N 57 116.808 116.808 119.632 -2.824 18237
1742 1 6 . 1 1 57 57 TYR HA H 57 4.172 4.172 4.360 -0.188 18237
1743 1 6 . 1 1 57 57 TYR C C 57 176.085 176.085 177.173 -1.088 18237
1744 1 6 . 1 1 57 57 TYR CA C 57 59.865 59.865 61.012 -1.147 18237
1745 1 6 . 1 1 57 57 TYR CB C 57 38.563 38.563 39.186 -0.623 18237
1746 1 6 . 1 1 57 57 TYR H H 57 7.578 7.578 7.582 -0.004 18237
1747 1 6 . 1 1 58 58 ILE N N 58 115.526 115.526 112.924 2.602 18237
1748 1 6 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.360 -0.095 18237
1749 1 6 . 1 1 58 58 ILE C C 58 174.782 174.782 176.031 -1.249 18237
1750 1 6 . 1 1 58 58 ILE CA C 58 60.940 60.940 61.365 -0.425 18237
1751 1 6 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.546 -0.364 18237
1752 1 6 . 1 1 58 58 ILE H H 58 7.586 7.586 8.279 -0.693 18237
1753 1 7 . 1 1 2 2 TYR N N 2 120.470 120.470 119.313 1.157 18237
1754 1 7 . 1 1 2 2 TYR C C 2 176.535 176.535 175.494 1.041 18237
1755 1 7 . 1 1 2 2 TYR CA C 2 55.995 55.995 58.086 -2.091 18237
1756 1 7 . 1 1 2 2 TYR CB C 2 37.313 37.313 38.251 -0.938 18237
1757 1 7 . 1 1 2 2 TYR H H 2 7.951 7.951 7.832 0.119 18237
1758 1 7 . 1 1 3 3 ILE N N 3 118.307 118.307 119.915 -1.608 18237
1759 1 7 . 1 1 3 3 ILE CA C 3 58.968 58.968 61.699 -2.731 18237
1760 1 7 . 1 1 3 3 ILE CB C 3 38.074 38.074 37.703 0.371 18237
1761 1 7 . 1 1 3 3 ILE H H 3 8.381 8.381 8.182 0.199 18237
1762 1 7 . 1 1 5 5 GLU N N 5 118.785 118.785 123.832 -5.047 18237
1763 1 7 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.410 -0.155 18237
1764 1 7 . 1 1 5 5 GLU C C 5 176.267 176.267 174.068 2.199 18237
1765 1 7 . 1 1 5 5 GLU CA C 5 55.959 55.959 57.117 -1.159 18237
1766 1 7 . 1 1 5 5 GLU CB C 5 30.034 30.034 31.563 -1.529 18237
1767 1 7 . 1 1 5 5 GLU H H 5 7.710 7.710 8.553 -0.843 18237
1768 1 7 . 1 1 6 6 ALA N N 6 131.546 131.546 125.545 6.001 18237
1769 1 7 . 1 1 6 6 ALA HA H 6 3.575 3.575 3.322 0.253 18237
1770 1 7 . 1 1 6 6 ALA CA C 6 50.959 50.959 49.643 1.316 18237
1771 1 7 . 1 1 6 6 ALA CB C 6 14.389 14.389 20.462 -6.073 18237
1772 1 7 . 1 1 6 6 ALA H H 6 8.338 8.338 8.032 0.306 18237
1773 1 7 . 1 1 8 8 ARG N N 8 126.915 126.915 120.025 6.890 18237
1774 1 7 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.542 -0.472 18237
1775 1 7 . 1 1 8 8 ARG C C 8 175.110 175.110 175.392 -0.282 18237
1776 1 7 . 1 1 8 8 ARG CA C 8 54.699 54.699 56.090 -1.391 18237
1777 1 7 . 1 1 8 8 ARG CB C 8 28.078 28.078 31.431 -3.353 18237
1778 1 7 . 1 1 8 8 ARG H H 8 8.725 8.725 8.354 0.371 18237
1779 1 7 . 1 1 9 9 ASP N N 9 123.653 123.653 124.911 -1.258 18237
1780 1 7 . 1 1 9 9 ASP C C 9 178.015 178.015 177.250 0.765 18237
1781 1 7 . 1 1 9 9 ASP CA C 9 52.747 52.747 54.211 -1.464 18237
1782 1 7 . 1 1 9 9 ASP CB C 9 40.844 40.844 41.236 -0.392 18237
1783 1 7 . 1 1 9 9 ASP H H 9 8.432 8.432 8.689 -0.257 18237
1784 1 7 . 1 1 10 10 GLY N N 10 111.908 111.908 107.937 3.971 18237
1785 1 7 . 1 1 10 10 GLY C C 10 174.822 174.822 174.808 0.014 18237
1786 1 7 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.016 0.228 18237
1787 1 7 . 1 1 10 10 GLY H H 10 9.727 9.727 8.625 1.102 18237
1788 1 7 . 1 1 11 11 GLN N N 11 118.395 118.395 120.477 -2.082 18237
1789 1 7 . 1 1 11 11 GLN C C 11 174.711 174.711 174.433 0.278 18237
1790 1 7 . 1 1 11 11 GLN CA C 11 53.398 53.398 54.757 -1.359 18237
1791 1 7 . 1 1 11 11 GLN CB C 11 30.306 30.306 30.356 -0.050 18237
1792 1 7 . 1 1 11 11 GLN H H 11 8.416 8.416 8.044 0.372 18237
1793 1 7 . 1 1 12 12 ALA N N 12 121.020 121.020 122.169 -1.149 18237
1794 1 7 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.177 0.766 18237
1795 1 7 . 1 1 12 12 ALA C C 12 177.990 177.990 175.152 2.838 18237
1796 1 7 . 1 1 12 12 ALA CA C 12 50.511 50.511 50.763 -0.252 18237
1797 1 7 . 1 1 12 12 ALA CB C 12 20.147 20.147 20.828 -0.681 18237
1798 1 7 . 1 1 12 12 ALA H H 12 7.933 7.933 8.093 -0.160 18237
1799 1 7 . 1 1 13 13 TYR N N 13 121.755 121.755 119.132 2.623 18237
1800 1 7 . 1 1 13 13 TYR C C 13 175.519 175.519 174.591 0.928 18237
1801 1 7 . 1 1 13 13 TYR CA C 13 59.090 59.090 56.212 2.878 18237
1802 1 7 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.181 1.999 18237
1803 1 7 . 1 1 13 13 TYR H H 13 9.575 9.575 8.148 1.427 18237
1804 1 7 . 1 1 14 14 VAL N N 14 112.251 112.251 120.922 -8.671 18237
1805 1 7 . 1 1 14 14 VAL C C 14 174.074 174.074 174.921 -0.847 18237
1806 1 7 . 1 1 14 14 VAL CA C 14 59.090 59.090 58.887 0.203 18237
1807 1 7 . 1 1 14 14 VAL CB C 14 32.750 32.750 34.743 -1.993 18237
1808 1 7 . 1 1 14 14 VAL H H 14 9.659 9.659 8.681 0.978 18237
1809 1 7 . 1 1 15 15 ARG N N 15 124.657 124.657 122.681 1.976 18237
1810 1 7 . 1 1 15 15 ARG C C 15 174.948 174.948 175.515 -0.567 18237
1811 1 7 . 1 1 15 15 ARG CA C 15 53.520 53.520 55.970 -2.450 18237
1812 1 7 . 1 1 15 15 ARG CB C 15 32.533 32.533 30.072 2.461 18237
1813 1 7 . 1 1 15 15 ARG H H 15 8.503 8.503 8.503 -0.000 18237
1814 1 7 . 1 1 16 16 LYS N N 16 128.240 128.240 125.676 2.564 18237
1815 1 7 . 1 1 16 16 LYS C C 16 175.974 175.974 175.419 0.555 18237
1816 1 7 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.864 -0.088 18237
1817 1 7 . 1 1 16 16 LYS CB C 16 36.553 36.553 35.581 0.972 18237
1818 1 7 . 1 1 16 16 LYS H H 16 9.052 9.052 8.401 0.651 18237
1819 1 7 . 1 1 17 17 ASP N N 17 130.562 130.562 126.536 4.026 18237
1820 1 7 . 1 1 17 17 ASP C C 17 175.822 175.822 176.485 -0.663 18237
1821 1 7 . 1 1 17 17 ASP CA C 17 56.447 56.447 54.776 1.671 18237
1822 1 7 . 1 1 17 17 ASP CB C 17 40.192 40.192 40.077 0.115 18237
1823 1 7 . 1 1 17 17 ASP H H 17 10.886 10.886 9.035 1.851 18237
1824 1 7 . 1 1 18 18 GLY N N 18 104.754 104.754 104.661 0.093 18237
1825 1 7 . 1 1 18 18 GLY C C 18 173.104 173.104 173.575 -0.471 18237
1826 1 7 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.542 -0.298 18237
1827 1 7 . 1 1 18 18 GLY H H 18 9.353 9.353 8.286 1.067 18237
1828 1 7 . 1 1 19 19 GLU N N 19 117.501 117.501 117.928 -0.427 18237
1829 1 7 . 1 1 19 19 GLU HA H 19 4.648 4.648 4.309 0.339 18237
1830 1 7 . 1 1 19 19 GLU C C 19 176.166 176.166 174.738 1.428 18237
1831 1 7 . 1 1 19 19 GLU CA C 19 53.865 53.865 54.117 -0.252 18237
1832 1 7 . 1 1 19 19 GLU CB C 19 33.130 33.130 32.984 0.145 18237
1833 1 7 . 1 1 19 19 GLU H H 19 7.813 7.813 8.091 -0.278 18237
1834 1 7 . 1 1 20 20 TRP N N 20 122.768 122.768 123.009 -0.241 18237
1835 1 7 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.425 -0.758 18237
1836 1 7 . 1 1 20 20 TRP C C 20 176.302 176.302 176.110 0.192 18237
1837 1 7 . 1 1 20 20 TRP CA C 20 55.878 55.878 54.915 0.963 18237
1838 1 7 . 1 1 20 20 TRP CB C 20 29.545 29.545 28.977 0.568 18237
1839 1 7 . 1 1 20 20 TRP H H 20 9.094 9.094 7.346 1.748 18237
1840 1 7 . 1 1 21 21 VAL N N 21 123.071 123.071 125.033 -1.962 18237
1841 1 7 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.450 0.535 18237
1842 1 7 . 1 1 21 21 VAL C C 21 175.640 175.640 175.810 -0.170 18237
1843 1 7 . 1 1 21 21 VAL CA C 21 59.537 59.537 60.602 -1.065 18237
1844 1 7 . 1 1 21 21 VAL CB C 21 34.651 34.651 33.990 0.661 18237
1845 1 7 . 1 1 21 21 VAL H H 21 9.868 9.868 8.262 1.606 18237
1846 1 7 . 1 1 22 22 LEU N N 22 127.193 127.193 129.784 -2.591 18237
1847 1 7 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.542 -0.120 18237
1848 1 7 . 1 1 22 22 LEU C C 22 179.268 179.268 179.034 0.234 18237
1849 1 7 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.464 0.170 18237
1850 1 7 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.395 -0.117 18237
1851 1 7 . 1 1 22 22 LEU H H 22 8.812 8.812 9.091 -0.279 18237
1852 1 7 . 1 1 23 23 LEU N N 23 126.386 126.386 124.931 1.455 18237
1853 1 7 . 1 1 23 23 LEU C C 23 178.844 178.844 178.623 0.221 18237
1854 1 7 . 1 1 23 23 LEU CA C 23 57.403 57.403 58.006 -0.603 18237
1855 1 7 . 1 1 23 23 LEU CB C 23 41.061 41.061 41.200 -0.139 18237
1856 1 7 . 1 1 23 23 LEU H H 23 8.562 8.562 8.283 0.279 18237
1857 1 7 . 1 1 24 24 SER N N 24 113.100 113.100 115.121 -2.021 18237
1858 1 7 . 1 1 24 24 SER HA H 24 4.621 4.621 4.076 0.545 18237
1859 1 7 . 1 1 24 24 SER C C 24 176.676 176.676 176.506 0.170 18237
1860 1 7 . 1 1 24 24 SER CA C 24 60.960 60.960 61.449 -0.489 18237
1861 1 7 . 1 1 24 24 SER CB C 24 61.650 61.650 62.778 -1.127 18237
1862 1 7 . 1 1 24 24 SER H H 24 9.098 9.098 8.567 0.531 18237
1863 1 7 . 1 1 25 25 THR N N 25 116.715 116.715 117.260 -0.545 18237
1864 1 7 . 1 1 25 25 THR HA H 25 3.915 3.915 4.045 -0.130 18237
1865 1 7 . 1 1 25 25 THR CA C 25 64.599 64.599 65.657 -1.058 18237
1866 1 7 . 1 1 25 25 THR CB C 25 68.657 68.657 69.001 -0.344 18237
1867 1 7 . 1 1 25 25 THR H H 25 7.238 7.238 8.080 -0.842 18237
1868 1 7 . 1 1 26 26 PHE N N 26 118.488 118.488 118.116 0.372 18237
1869 1 7 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.412 -0.302 18237
1870 1 7 . 1 1 26 26 PHE C C 26 176.181 176.181 176.496 -0.315 18237
1871 1 7 . 1 1 26 26 PHE CA C 26 58.627 58.627 60.211 -1.584 18237
1872 1 7 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.525 0.268 18237
1873 1 7 . 1 1 26 26 PHE H H 26 7.945 7.945 8.226 -0.281 18237
1874 1 7 . 1 1 27 27 LEU N N 27 118.525 118.525 118.756 -0.231 18237
1875 1 7 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.238 0.285 18237
1876 1 7 . 1 1 27 27 LEU C C 27 177.752 177.752 177.411 0.341 18237
1877 1 7 . 1 1 27 27 LEU CA C 27 54.679 54.679 55.105 -0.426 18237
1878 1 7 . 1 1 27 27 LEU CB C 27 41.333 41.333 41.812 -0.479 18237
1879 1 7 . 1 1 27 27 LEU H H 27 7.290 7.290 7.589 -0.299 18237
1880 1 7 . 1 1 28 28 GLY N N 28 108.823 108.823 106.928 1.895 18237
1881 1 7 . 1 1 28 28 GLY C C 28 174.630 174.630 174.481 0.149 18237
1882 1 7 . 1 1 28 28 GLY CA C 28 45.374 45.374 46.321 -0.947 18237
1883 1 7 . 1 1 28 28 GLY H H 28 8.242 8.242 7.562 0.680 18237
1884 1 7 . 1 1 29 29 SER N N 29 116.210 116.210 115.501 0.709 18237
1885 1 7 . 1 1 29 29 SER HA H 29 4.626 4.626 4.634 -0.008 18237
1886 1 7 . 1 1 29 29 SER C C 29 175.312 175.312 172.847 2.465 18237
1887 1 7 . 1 1 29 29 SER CA C 29 57.992 57.992 57.894 0.098 18237
1888 1 7 . 1 1 29 29 SER CB C 29 63.605 63.605 64.331 -0.726 18237
1889 1 7 . 1 1 29 29 SER H H 29 8.310 8.310 8.134 0.176 18237
1890 1 7 . 1 1 30 30 SER N N 30 118.892 118.892 117.579 1.313 18237
1891 1 7 . 1 1 30 30 SER HA H 30 4.597 4.597 4.562 0.035 18237
1892 1 7 . 1 1 30 30 SER C C 30 175.479 175.479 175.643 -0.164 18237
1893 1 7 . 1 1 30 30 SER CA C 30 58.582 58.582 58.486 0.096 18237
1894 1 7 . 1 1 30 30 SER CB C 30 63.605 63.605 64.215 -0.610 18237
1895 1 7 . 1 1 30 30 SER H H 30 8.593 8.593 8.160 0.433 18237
1896 1 7 . 1 1 31 31 GLY N N 31 111.354 111.354 112.273 -0.919 18237
1897 1 7 . 1 1 31 31 GLY C C 31 174.428 174.428 175.520 -1.092 18237
1898 1 7 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.674 -0.218 18237
1899 1 7 . 1 1 31 31 GLY H H 31 8.584 8.584 8.566 0.018 18237
1900 1 7 . 1 1 32 32 ASN N N 32 119.486 119.486 119.063 0.423 18237
1901 1 7 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.627 0.190 18237
1902 1 7 . 1 1 32 32 ASN C C 32 175.928 175.928 176.759 -0.831 18237
1903 1 7 . 1 1 32 32 ASN CA C 32 53.215 53.215 54.086 -0.871 18237
1904 1 7 . 1 1 32 32 ASN CB C 32 38.780 38.780 38.128 0.652 18237
1905 1 7 . 1 1 32 32 ASN H H 32 8.393 8.393 8.452 -0.059 18237
1906 1 7 . 1 1 33 33 GLU N N 33 122.031 122.031 120.427 1.604 18237
1907 1 7 . 1 1 33 33 GLU HA H 33 4.271 4.271 4.020 0.251 18237
1908 1 7 . 1 1 33 33 GLU CA C 33 57.426 57.426 59.652 -2.226 18237
1909 1 7 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.413 -0.085 18237
1910 1 7 . 1 1 33 33 GLU H H 33 8.711 8.711 8.791 -0.080 18237
1911 1 7 . 1 1 34 34 GLN N N 34 120.866 120.866 116.759 4.107 18237
1912 1 7 . 1 1 34 34 GLN HA H 34 4.271 4.271 4.079 0.192 18237
1913 1 7 . 1 1 34 34 GLN CA C 34 56.226 56.226 58.659 -2.433 18237
1914 1 7 . 1 1 34 34 GLN CB C 34 28.839 28.839 28.107 0.732 18237
1915 1 7 . 1 1 34 34 GLN H H 34 8.438 8.438 7.959 0.479 18237
1916 1 7 . 1 1 35 35 GLU N N 35 122.323 122.323 121.574 0.749 18237
1917 1 7 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.210 0.109 18237
1918 1 7 . 1 1 35 35 GLU C C 35 177.176 177.176 178.701 -1.525 18237
1919 1 7 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.651 -1.655 18237
1920 1 7 . 1 1 35 35 GLU CB C 35 29.545 29.545 29.193 0.352 18237
1921 1 7 . 1 1 35 35 GLU H H 35 8.424 8.424 7.360 1.064 18237
1922 1 7 . 1 1 36 36 LEU N N 36 122.904 122.904 118.870 4.034 18237
1923 1 7 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.063 0.256 18237
1924 1 7 . 1 1 36 36 LEU CA C 36 55.898 55.898 57.468 -1.570 18237
1925 1 7 . 1 1 36 36 LEU CB C 36 41.496 41.496 41.507 -0.011 18237
1926 1 7 . 1 1 36 36 LEU H H 36 8.342 8.342 7.617 0.725 18237
1927 1 7 . 1 1 38 38 GLU N N 38 121.931 121.931 120.580 1.351 18237
1928 1 7 . 1 1 38 38 GLU HA H 38 4.396 4.396 4.161 0.235 18237
1929 1 7 . 1 1 38 38 GLU C C 38 177.318 177.318 178.654 -1.336 18237
1930 1 7 . 1 1 38 38 GLU CA C 38 56.366 56.366 59.077 -2.711 18237
1931 1 7 . 1 1 38 38 GLU CB C 38 29.328 29.328 29.699 -0.371 18237
1932 1 7 . 1 1 38 38 GLU H H 38 8.342 8.342 7.715 0.627 18237
1933 1 7 . 1 1 39 39 LEU N N 39 123.317 123.317 118.100 5.217 18237
1934 1 7 . 1 1 39 39 LEU HA H 39 4.348 4.348 3.732 0.616 18237
1935 1 7 . 1 1 39 39 LEU CA C 39 56.833 56.833 57.386 -0.553 18237
1936 1 7 . 1 1 39 39 LEU CB C 39 41.387 41.387 41.973 -0.586 18237
1937 1 7 . 1 1 39 39 LEU H H 39 8.342 8.342 8.382 -0.040 18237
1938 1 7 . 1 1 40 40 ASP N N 40 119.726 119.726 116.697 3.029 18237
1939 1 7 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.501 0.070 18237
1940 1 7 . 1 1 40 40 ASP CA C 40 55.589 55.589 56.142 -0.553 18237
1941 1 7 . 1 1 40 40 ASP H H 40 8.530 8.530 7.472 1.058 18237
1942 1 7 . 1 1 41 41 LYS N N 41 121.200 121.200 120.512 0.688 18237
1943 1 7 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.232 -0.068 18237
1944 1 7 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.813 -0.593 18237
1945 1 7 . 1 1 41 41 LYS H H 41 8.145 8.145 7.826 0.319 18237
1946 1 7 . 1 1 42 42 TRP N N 42 120.615 120.615 119.805 0.810 18237
1947 1 7 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.484 0.113 18237
1948 1 7 . 1 1 42 42 TRP C C 42 177.641 177.641 177.789 -0.148 18237
1949 1 7 . 1 1 42 42 TRP CA C 42 58.561 58.561 59.076 -0.515 18237
1950 1 7 . 1 1 42 42 TRP CB C 42 28.839 28.839 28.406 0.433 18237
1951 1 7 . 1 1 42 42 TRP H H 42 8.025 8.025 7.832 0.193 18237
1952 1 7 . 1 1 43 43 ALA N N 43 122.056 122.056 123.018 -0.962 18237
1953 1 7 . 1 1 43 43 ALA HA H 43 4.140 4.140 3.711 0.429 18237
1954 1 7 . 1 1 43 43 ALA C C 43 172.776 172.776 179.440 -6.664 18237
1955 1 7 . 1 1 43 43 ALA CA C 43 54.864 54.864 54.319 0.545 18237
1956 1 7 . 1 1 43 43 ALA CB C 43 17.974 17.974 17.299 0.675 18237
1957 1 7 . 1 1 43 43 ALA H H 43 8.199 8.199 7.512 0.687 18237
1958 1 7 . 1 1 44 44 SER N N 44 113.378 113.378 115.596 -2.218 18237
1959 1 7 . 1 1 44 44 SER HA H 44 4.376 4.376 4.195 0.181 18237
1960 1 7 . 1 1 44 44 SER C C 44 176.767 176.767 176.576 0.191 18237
1961 1 7 . 1 1 44 44 SER CA C 44 60.980 60.980 62.892 -1.912 18237
1962 1 7 . 1 1 44 44 SER CB C 44 62.410 62.410 63.118 -0.708 18237
1963 1 7 . 1 1 44 44 SER H H 44 8.210 8.210 7.819 0.391 18237
1964 1 7 . 1 1 45 45 LEU N N 45 123.425 123.425 121.684 1.741 18237
1965 1 7 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.389 -0.195 18237
1966 1 7 . 1 1 45 45 LEU CA C 45 57.606 57.606 58.383 -0.777 18237
1967 1 7 . 1 1 45 45 LEU CB C 45 41.170 41.170 42.035 -0.865 18237
1968 1 7 . 1 1 45 45 LEU H H 45 7.906 7.906 8.159 -0.253 18237
1969 1 7 . 1 1 46 46 TRP N N 46 118.572 118.572 121.351 -2.779 18237
1970 1 7 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.385 0.270 18237
1971 1 7 . 1 1 46 46 TRP C C 46 177.838 177.838 178.061 -0.223 18237
1972 1 7 . 1 1 46 46 TRP CA C 46 58.907 58.907 60.825 -1.918 18237
1973 1 7 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.457 -0.238 18237
1974 1 7 . 1 1 46 46 TRP H H 46 8.043 8.043 7.969 0.074 18237
1975 1 7 . 1 1 47 47 ASN N N 47 116.564 116.564 116.326 0.238 18237
1976 1 7 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.452 0.174 18237
1977 1 7 . 1 1 47 47 ASN C C 47 176.904 176.904 177.054 -0.150 18237
1978 1 7 . 1 1 47 47 ASN CA C 47 55.045 55.045 55.299 -0.254 18237
1979 1 7 . 1 1 47 47 ASN CB C 47 38.563 38.563 38.664 -0.102 18237
1980 1 7 . 1 1 47 47 ASN H H 47 8.174 8.174 8.898 -0.724 18237
1981 1 7 . 1 1 48 48 TRP N N 48 121.421 121.421 121.795 -0.374 18237
1982 1 7 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.573 -0.206 18237
1983 1 7 . 1 1 48 48 TRP CA C 48 59.517 59.517 58.693 0.824 18237
1984 1 7 . 1 1 48 48 TRP CB C 48 28.893 28.893 29.362 -0.469 18237
1985 1 7 . 1 1 48 48 TRP H H 48 8.145 8.145 7.948 0.197 18237
1986 1 7 . 1 1 49 49 PHE N N 49 118.299 118.299 119.595 -1.296 18237
1987 1 7 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.478 0.774 18237
1988 1 7 . 1 1 49 49 PHE C C 49 175.565 175.565 176.157 -0.592 18237
1989 1 7 . 1 1 49 49 PHE CA C 49 58.887 58.887 59.902 -1.015 18237
1990 1 7 . 1 1 49 49 PHE CB C 49 38.671 38.671 37.675 0.996 18237
1991 1 7 . 1 1 49 49 PHE H H 49 8.036 8.036 8.002 0.034 18237
1992 1 7 . 1 1 50 50 ASN N N 50 118.836 118.836 119.541 -0.705 18237
1993 1 7 . 1 1 50 50 ASN HA H 50 4.626 4.626 3.969 0.657 18237
1994 1 7 . 1 1 50 50 ASN C C 50 176.439 176.439 176.571 -0.132 18237
1995 1 7 . 1 1 50 50 ASN CA C 50 53.215 53.215 55.260 -2.045 18237
1996 1 7 . 1 1 50 50 ASN CB C 50 38.128 38.128 38.344 -0.217 18237
1997 1 7 . 1 1 50 50 ASN H H 50 7.795 7.795 7.385 0.410 18237
1998 1 7 . 1 1 51 51 ILE N N 51 120.218 120.218 116.766 3.452 18237
1999 1 7 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.866 -0.075 18237
2000 1 7 . 1 1 51 51 ILE C C 51 177.202 177.202 177.198 0.004 18237
2001 1 7 . 1 1 51 51 ILE CA C 51 63.102 63.102 64.945 -1.843 18237
2002 1 7 . 1 1 51 51 ILE CB C 51 37.367 37.367 37.254 0.113 18237
2003 1 7 . 1 1 51 51 ILE H H 51 8.147 8.147 7.311 0.836 18237
2004 1 7 . 1 1 52 52 THR N N 52 115.352 115.352 113.886 1.466 18237
2005 1 7 . 1 1 52 52 THR HA H 52 4.031 4.031 4.101 -0.070 18237
2006 1 7 . 1 1 52 52 THR C C 52 176.095 176.095 175.855 0.240 18237
2007 1 7 . 1 1 52 52 THR CA C 52 65.148 65.148 64.916 0.232 18237
2008 1 7 . 1 1 52 52 THR CB C 52 68.277 68.277 68.470 -0.193 18237
2009 1 7 . 1 1 52 52 THR H H 52 8.009 8.009 7.421 0.588 18237
2010 1 7 . 1 1 53 53 ASN N N 53 119.874 119.874 121.503 -1.629 18237
2011 1 7 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.196 0.440 18237
2012 1 7 . 1 1 53 53 ASN C C 53 176.530 176.530 176.602 -0.072 18237
2013 1 7 . 1 1 53 53 ASN CA C 53 54.457 54.457 55.434 -0.978 18237
2014 1 7 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.501 0.301 18237
2015 1 7 . 1 1 53 53 ASN H H 53 7.972 7.972 7.218 0.754 18237
2016 1 7 . 1 1 54 54 TRP N N 54 120.192 120.192 118.882 1.310 18237
2017 1 7 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.624 0.031 18237
2018 1 7 . 1 1 54 54 TRP CA C 54 58.643 58.643 58.138 0.505 18237
2019 1 7 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.233 -0.068 18237
2020 1 7 . 1 1 54 54 TRP H H 54 7.897 7.897 7.013 0.884 18237
2021 1 7 . 1 1 55 55 LEU N N 55 118.354 118.354 123.581 -5.227 18237
2022 1 7 . 1 1 55 55 LEU HA H 55 4.088 4.088 3.964 0.124 18237
2023 1 7 . 1 1 55 55 LEU C C 55 177.975 177.975 178.424 -0.449 18237
2024 1 7 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.569 -2.099 18237
2025 1 7 . 1 1 55 55 LEU CB C 55 40.898 40.898 41.926 -1.028 18237
2026 1 7 . 1 1 55 55 LEU H H 55 7.931 7.931 7.668 0.263 18237
2027 1 7 . 1 1 56 56 TRP N N 56 118.335 118.335 116.304 2.031 18237
2028 1 7 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.270 0.097 18237
2029 1 7 . 1 1 56 56 TRP C C 56 176.863 176.863 178.249 -1.386 18237
2030 1 7 . 1 1 56 56 TRP CA C 56 59.070 59.070 61.034 -1.964 18237
2031 1 7 . 1 1 56 56 TRP CB C 56 28.839 28.839 28.770 0.069 18237
2032 1 7 . 1 1 56 56 TRP H H 56 7.665 7.665 7.852 -0.187 18237
2033 1 7 . 1 1 57 57 TYR N N 57 116.808 116.808 118.797 -1.989 18237
2034 1 7 . 1 1 57 57 TYR HA H 57 4.172 4.172 4.270 -0.098 18237
2035 1 7 . 1 1 57 57 TYR C C 57 176.085 176.085 177.501 -1.416 18237
2036 1 7 . 1 1 57 57 TYR CA C 57 59.865 59.865 61.687 -1.822 18237
2037 1 7 . 1 1 57 57 TYR CB C 57 38.563 38.563 39.387 -0.824 18237
2038 1 7 . 1 1 57 57 TYR H H 57 7.578 7.578 8.058 -0.480 18237
2039 1 7 . 1 1 58 58 ILE N N 58 115.526 115.526 115.924 -0.398 18237
2040 1 7 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.185 0.080 18237
2041 1 7 . 1 1 58 58 ILE C C 58 174.782 174.782 175.395 -0.613 18237
2042 1 7 . 1 1 58 58 ILE CA C 58 60.940 60.940 60.852 0.088 18237
2043 1 7 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.673 -0.491 18237
2044 1 7 . 1 1 58 58 ILE H H 58 7.586 7.586 7.710 -0.124 18237
2045 1 8 . 1 1 2 2 TYR N N 2 120.470 120.470 119.908 0.562 18237
2046 1 8 . 1 1 2 2 TYR C C 2 176.535 176.535 175.755 0.780 18237
2047 1 8 . 1 1 2 2 TYR CA C 2 55.995 55.995 57.560 -1.565 18237
2048 1 8 . 1 1 2 2 TYR CB C 2 37.313 37.313 39.182 -1.869 18237
2049 1 8 . 1 1 2 2 TYR H H 2 7.951 7.951 8.125 -0.174 18237
2050 1 8 . 1 1 3 3 ILE N N 3 118.307 118.307 119.266 -0.959 18237
2051 1 8 . 1 1 3 3 ILE CA C 3 58.968 58.968 61.718 -2.750 18237
2052 1 8 . 1 1 3 3 ILE CB C 3 38.074 38.074 36.585 1.489 18237
2053 1 8 . 1 1 3 3 ILE H H 3 8.381 8.381 7.979 0.402 18237
2054 1 8 . 1 1 5 5 GLU N N 5 118.785 118.785 123.261 -4.476 18237
2055 1 8 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.344 -0.089 18237
2056 1 8 . 1 1 5 5 GLU C C 5 176.267 176.267 174.007 2.260 18237
2057 1 8 . 1 1 5 5 GLU CA C 5 55.959 55.959 57.153 -1.194 18237
2058 1 8 . 1 1 5 5 GLU CB C 5 30.034 30.034 31.095 -1.061 18237
2059 1 8 . 1 1 5 5 GLU H H 5 7.710 7.710 8.422 -0.712 18237
2060 1 8 . 1 1 6 6 ALA N N 6 131.546 131.546 127.071 4.475 18237
2061 1 8 . 1 1 6 6 ALA HA H 6 3.575 3.575 3.884 -0.309 18237
2062 1 8 . 1 1 6 6 ALA CA C 6 50.959 50.959 49.142 1.817 18237
2063 1 8 . 1 1 6 6 ALA CB C 6 14.389 14.389 19.003 -4.614 18237
2064 1 8 . 1 1 6 6 ALA H H 6 8.338 8.338 7.998 0.340 18237
2065 1 8 . 1 1 8 8 ARG N N 8 126.915 126.915 121.438 5.477 18237
2066 1 8 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.537 -0.467 18237
2067 1 8 . 1 1 8 8 ARG C C 8 175.110 175.110 175.359 -0.249 18237
2068 1 8 . 1 1 8 8 ARG CA C 8 54.699 54.699 56.018 -1.319 18237
2069 1 8 . 1 1 8 8 ARG CB C 8 28.078 28.078 31.178 -3.100 18237
2070 1 8 . 1 1 8 8 ARG H H 8 8.725 8.725 8.457 0.268 18237
2071 1 8 . 1 1 9 9 ASP N N 9 123.653 123.653 124.880 -1.227 18237
2072 1 8 . 1 1 9 9 ASP C C 9 178.015 178.015 177.236 0.779 18237
2073 1 8 . 1 1 9 9 ASP CA C 9 52.747 52.747 54.360 -1.613 18237
2074 1 8 . 1 1 9 9 ASP CB C 9 40.844 40.844 41.653 -0.808 18237
2075 1 8 . 1 1 9 9 ASP H H 9 8.432 8.432 8.659 -0.227 18237
2076 1 8 . 1 1 10 10 GLY N N 10 111.908 111.908 108.666 3.242 18237
2077 1 8 . 1 1 10 10 GLY C C 10 174.822 174.822 174.735 0.087 18237
2078 1 8 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.036 0.208 18237
2079 1 8 . 1 1 10 10 GLY H H 10 9.727 9.727 8.626 1.101 18237
2080 1 8 . 1 1 11 11 GLN N N 11 118.395 118.395 118.982 -0.587 18237
2081 1 8 . 1 1 11 11 GLN C C 11 174.711 174.711 173.993 0.718 18237
2082 1 8 . 1 1 11 11 GLN CA C 11 53.398 53.398 54.758 -1.360 18237
2083 1 8 . 1 1 11 11 GLN CB C 11 30.306 30.306 29.774 0.532 18237
2084 1 8 . 1 1 11 11 GLN H H 11 8.416 8.416 7.720 0.696 18237
2085 1 8 . 1 1 12 12 ALA N N 12 121.020 121.020 122.708 -1.688 18237
2086 1 8 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.214 0.729 18237
2087 1 8 . 1 1 12 12 ALA C C 12 177.990 177.990 175.148 2.842 18237
2088 1 8 . 1 1 12 12 ALA CA C 12 50.511 50.511 50.963 -0.452 18237
2089 1 8 . 1 1 12 12 ALA CB C 12 20.147 20.147 20.899 -0.753 18237
2090 1 8 . 1 1 12 12 ALA H H 12 7.933 7.933 8.140 -0.207 18237
2091 1 8 . 1 1 13 13 TYR N N 13 121.755 121.755 119.343 2.412 18237
2092 1 8 . 1 1 13 13 TYR C C 13 175.519 175.519 174.641 0.878 18237
2093 1 8 . 1 1 13 13 TYR CA C 13 59.090 59.090 56.357 2.733 18237
2094 1 8 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.058 2.122 18237
2095 1 8 . 1 1 13 13 TYR H H 13 9.575 9.575 8.194 1.381 18237
2096 1 8 . 1 1 14 14 VAL N N 14 112.251 112.251 120.225 -7.974 18237
2097 1 8 . 1 1 14 14 VAL C C 14 174.074 174.074 174.821 -0.747 18237
2098 1 8 . 1 1 14 14 VAL CA C 14 59.090 59.090 59.236 -0.146 18237
2099 1 8 . 1 1 14 14 VAL CB C 14 32.750 32.750 35.176 -2.426 18237
2100 1 8 . 1 1 14 14 VAL H H 14 9.659 9.659 8.769 0.890 18237
2101 1 8 . 1 1 15 15 ARG N N 15 124.657 124.657 122.380 2.277 18237
2102 1 8 . 1 1 15 15 ARG C C 15 174.948 174.948 175.321 -0.373 18237
2103 1 8 . 1 1 15 15 ARG CA C 15 53.520 53.520 55.492 -1.972 18237
2104 1 8 . 1 1 15 15 ARG CB C 15 32.533 32.533 29.869 2.663 18237
2105 1 8 . 1 1 15 15 ARG H H 15 8.503 8.503 8.519 -0.016 18237
2106 1 8 . 1 1 16 16 LYS N N 16 128.240 128.240 125.598 2.642 18237
2107 1 8 . 1 1 16 16 LYS C C 16 175.974 175.974 175.415 0.559 18237
2108 1 8 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.772 0.005 18237
2109 1 8 . 1 1 16 16 LYS CB C 16 36.553 36.553 35.632 0.921 18237
2110 1 8 . 1 1 16 16 LYS H H 16 9.052 9.052 8.590 0.462 18237
2111 1 8 . 1 1 17 17 ASP N N 17 130.562 130.562 126.791 3.771 18237
2112 1 8 . 1 1 17 17 ASP C C 17 175.822 175.822 176.378 -0.556 18237
2113 1 8 . 1 1 17 17 ASP CA C 17 56.447 56.447 54.751 1.696 18237
2114 1 8 . 1 1 17 17 ASP CB C 17 40.192 40.192 40.124 0.068 18237
2115 1 8 . 1 1 17 17 ASP H H 17 10.886 10.886 9.014 1.872 18237
2116 1 8 . 1 1 18 18 GLY N N 18 104.754 104.754 104.931 -0.177 18237
2117 1 8 . 1 1 18 18 GLY C C 18 173.104 173.104 173.484 -0.380 18237
2118 1 8 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.427 -0.183 18237
2119 1 8 . 1 1 18 18 GLY H H 18 9.353 9.353 8.241 1.112 18237
2120 1 8 . 1 1 19 19 GLU N N 19 117.501 117.501 117.520 -0.019 18237
2121 1 8 . 1 1 19 19 GLU HA H 19 4.648 4.648 4.174 0.474 18237
2122 1 8 . 1 1 19 19 GLU C C 19 176.166 176.166 174.402 1.764 18237
2123 1 8 . 1 1 19 19 GLU CA C 19 53.865 53.865 54.062 -0.197 18237
2124 1 8 . 1 1 19 19 GLU CB C 19 33.130 33.130 33.937 -0.806 18237
2125 1 8 . 1 1 19 19 GLU H H 19 7.813 7.813 7.886 -0.073 18237
2126 1 8 . 1 1 20 20 TRP N N 20 122.768 122.768 122.416 0.352 18237
2127 1 8 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.468 -0.801 18237
2128 1 8 . 1 1 20 20 TRP C C 20 176.302 176.302 176.681 -0.379 18237
2129 1 8 . 1 1 20 20 TRP CA C 20 55.878 55.878 56.437 -0.559 18237
2130 1 8 . 1 1 20 20 TRP CB C 20 29.545 29.545 30.270 -0.725 18237
2131 1 8 . 1 1 20 20 TRP H H 20 9.094 9.094 8.205 0.889 18237
2132 1 8 . 1 1 21 21 VAL N N 21 123.071 123.071 124.514 -1.443 18237
2133 1 8 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.540 0.445 18237
2134 1 8 . 1 1 21 21 VAL C C 21 175.640 175.640 175.765 -0.125 18237
2135 1 8 . 1 1 21 21 VAL CA C 21 59.537 59.537 60.844 -1.307 18237
2136 1 8 . 1 1 21 21 VAL CB C 21 34.651 34.651 34.707 -0.056 18237
2137 1 8 . 1 1 21 21 VAL H H 21 9.868 9.868 8.580 1.288 18237
2138 1 8 . 1 1 22 22 LEU N N 22 127.193 127.193 129.382 -2.189 18237
2139 1 8 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.492 -0.070 18237
2140 1 8 . 1 1 22 22 LEU C C 22 179.268 179.268 178.797 0.471 18237
2141 1 8 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.901 -0.267 18237
2142 1 8 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.535 -0.256 18237
2143 1 8 . 1 1 22 22 LEU H H 22 8.812 8.812 9.028 -0.216 18237
2144 1 8 . 1 1 23 23 LEU N N 23 126.386 126.386 128.613 -2.227 18237
2145 1 8 . 1 1 23 23 LEU C C 23 178.844 178.844 178.585 0.259 18237
2146 1 8 . 1 1 23 23 LEU CA C 23 57.403 57.403 58.389 -0.986 18237
2147 1 8 . 1 1 23 23 LEU CB C 23 41.061 41.061 42.126 -1.065 18237
2148 1 8 . 1 1 23 23 LEU H H 23 8.562 8.562 8.287 0.275 18237
2149 1 8 . 1 1 24 24 SER N N 24 113.100 113.100 114.094 -0.994 18237
2150 1 8 . 1 1 24 24 SER HA H 24 4.621 4.621 4.114 0.507 18237
2151 1 8 . 1 1 24 24 SER C C 24 176.676 176.676 176.313 0.363 18237
2152 1 8 . 1 1 24 24 SER CA C 24 60.960 60.960 62.221 -1.262 18237
2153 1 8 . 1 1 24 24 SER CB C 24 61.650 61.650 62.240 -0.590 18237
2154 1 8 . 1 1 24 24 SER H H 24 9.098 9.098 8.659 0.439 18237
2155 1 8 . 1 1 25 25 THR N N 25 116.715 116.715 118.610 -1.895 18237
2156 1 8 . 1 1 25 25 THR HA H 25 3.915 3.915 4.082 -0.167 18237
2157 1 8 . 1 1 25 25 THR CA C 25 64.599 64.599 66.117 -1.518 18237
2158 1 8 . 1 1 25 25 THR CB C 25 68.657 68.657 68.721 -0.064 18237
2159 1 8 . 1 1 25 25 THR H H 25 7.238 7.238 8.155 -0.917 18237
2160 1 8 . 1 1 26 26 PHE N N 26 118.488 118.488 119.919 -1.431 18237
2161 1 8 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.383 -0.273 18237
2162 1 8 . 1 1 26 26 PHE C C 26 176.181 176.181 176.622 -0.441 18237
2163 1 8 . 1 1 26 26 PHE CA C 26 58.627 58.627 60.630 -2.003 18237
2164 1 8 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.364 0.429 18237
2165 1 8 . 1 1 26 26 PHE H H 26 7.945 7.945 8.432 -0.487 18237
2166 1 8 . 1 1 27 27 LEU N N 27 118.525 118.525 119.734 -1.209 18237
2167 1 8 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.299 0.224 18237
2168 1 8 . 1 1 27 27 LEU C C 27 177.752 177.752 177.941 -0.189 18237
2169 1 8 . 1 1 27 27 LEU CA C 27 54.679 54.679 56.117 -1.438 18237
2170 1 8 . 1 1 27 27 LEU CB C 27 41.333 41.333 42.563 -1.230 18237
2171 1 8 . 1 1 27 27 LEU H H 27 7.290 7.290 7.667 -0.377 18237
2172 1 8 . 1 1 28 28 GLY N N 28 108.823 108.823 105.521 3.302 18237
2173 1 8 . 1 1 28 28 GLY C C 28 174.630 174.630 174.411 0.219 18237
2174 1 8 . 1 1 28 28 GLY CA C 28 45.374 45.374 44.863 0.511 18237
2175 1 8 . 1 1 28 28 GLY H H 28 8.242 8.242 7.861 0.381 18237
2176 1 8 . 1 1 29 29 SER N N 29 116.210 116.210 115.617 0.593 18237
2177 1 8 . 1 1 29 29 SER HA H 29 4.626 4.626 4.503 0.123 18237
2178 1 8 . 1 1 29 29 SER C C 29 175.312 175.312 174.639 0.673 18237
2179 1 8 . 1 1 29 29 SER CA C 29 57.992 57.992 58.418 -0.426 18237
2180 1 8 . 1 1 29 29 SER CB C 29 63.605 63.605 64.508 -0.903 18237
2181 1 8 . 1 1 29 29 SER H H 29 8.310 8.310 7.602 0.708 18237
2182 1 8 . 1 1 30 30 SER N N 30 118.892 118.892 113.099 5.793 18237
2183 1 8 . 1 1 30 30 SER HA H 30 4.597 4.597 4.245 0.352 18237
2184 1 8 . 1 1 30 30 SER C C 30 175.479 175.479 173.685 1.794 18237
2185 1 8 . 1 1 30 30 SER CA C 30 58.582 58.582 59.661 -1.079 18237
2186 1 8 . 1 1 30 30 SER CB C 30 63.605 63.605 62.934 0.671 18237
2187 1 8 . 1 1 30 30 SER H H 30 8.593 8.593 8.880 -0.287 18237
2188 1 8 . 1 1 31 31 GLY N N 31 111.354 111.354 106.221 5.133 18237
2189 1 8 . 1 1 31 31 GLY C C 31 174.428 174.428 173.638 0.790 18237
2190 1 8 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.201 0.255 18237
2191 1 8 . 1 1 31 31 GLY H H 31 8.584 8.584 8.042 0.542 18237
2192 1 8 . 1 1 32 32 ASN N N 32 119.486 119.486 117.081 2.405 18237
2193 1 8 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.751 0.066 18237
2194 1 8 . 1 1 32 32 ASN C C 32 175.928 175.928 175.595 0.333 18237
2195 1 8 . 1 1 32 32 ASN CA C 32 53.215 53.215 53.412 -0.197 18237
2196 1 8 . 1 1 32 32 ASN CB C 32 38.780 38.780 39.749 -0.969 18237
2197 1 8 . 1 1 32 32 ASN H H 32 8.393 8.393 8.217 0.176 18237
2198 1 8 . 1 1 33 33 GLU N N 33 122.031 122.031 120.556 1.475 18237
2199 1 8 . 1 1 33 33 GLU HA H 33 4.271 4.271 4.018 0.253 18237
2200 1 8 . 1 1 33 33 GLU CA C 33 57.426 57.426 59.306 -1.880 18237
2201 1 8 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.113 0.215 18237
2202 1 8 . 1 1 33 33 GLU H H 33 8.711 8.711 8.678 0.033 18237
2203 1 8 . 1 1 34 34 GLN N N 34 120.866 120.866 118.324 2.542 18237
2204 1 8 . 1 1 34 34 GLN HA H 34 4.271 4.271 3.976 0.295 18237
2205 1 8 . 1 1 34 34 GLN CA C 34 56.226 56.226 59.276 -3.050 18237
2206 1 8 . 1 1 34 34 GLN CB C 34 28.839 28.839 28.406 0.433 18237
2207 1 8 . 1 1 34 34 GLN H H 34 8.438 8.438 8.321 0.117 18237
2208 1 8 . 1 1 35 35 GLU N N 35 122.323 122.323 118.903 3.420 18237
2209 1 8 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.168 0.151 18237
2210 1 8 . 1 1 35 35 GLU C C 35 177.176 177.176 179.100 -1.924 18237
2211 1 8 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.803 -1.807 18237
2212 1 8 . 1 1 35 35 GLU CB C 35 29.545 29.545 29.452 0.093 18237
2213 1 8 . 1 1 35 35 GLU H H 35 8.424 8.424 7.855 0.569 18237
2214 1 8 . 1 1 36 36 LEU N N 36 122.904 122.904 119.410 3.494 18237
2215 1 8 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.177 0.142 18237
2216 1 8 . 1 1 36 36 LEU CA C 36 55.898 55.898 57.391 -1.493 18237
2217 1 8 . 1 1 36 36 LEU CB C 36 41.496 41.496 42.244 -0.748 18237
2218 1 8 . 1 1 36 36 LEU H H 36 8.342 8.342 7.360 0.982 18237
2219 1 8 . 1 1 38 38 GLU N N 38 121.931 121.931 120.832 1.099 18237
2220 1 8 . 1 1 38 38 GLU HA H 38 4.396 4.396 3.948 0.448 18237
2221 1 8 . 1 1 38 38 GLU C C 38 177.318 177.318 178.417 -1.099 18237
2222 1 8 . 1 1 38 38 GLU CA C 38 56.366 56.366 59.477 -3.111 18237
2223 1 8 . 1 1 38 38 GLU CB C 38 29.328 29.328 29.349 -0.021 18237
2224 1 8 . 1 1 38 38 GLU H H 38 8.342 8.342 7.865 0.477 18237
2225 1 8 . 1 1 39 39 LEU N N 39 123.317 123.317 120.425 2.892 18237
2226 1 8 . 1 1 39 39 LEU HA H 39 4.348 4.348 4.191 0.157 18237
2227 1 8 . 1 1 39 39 LEU CA C 39 56.833 56.833 59.032 -2.199 18237
2228 1 8 . 1 1 39 39 LEU CB C 39 41.387 41.387 42.060 -0.673 18237
2229 1 8 . 1 1 39 39 LEU H H 39 8.342 8.342 8.084 0.258 18237
2230 1 8 . 1 1 40 40 ASP N N 40 119.726 119.726 117.009 2.717 18237
2231 1 8 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.366 0.205 18237
2232 1 8 . 1 1 40 40 ASP CA C 40 55.589 55.589 57.911 -2.322 18237
2233 1 8 . 1 1 40 40 ASP H H 40 8.530 8.530 8.680 -0.150 18237
2234 1 8 . 1 1 41 41 LYS N N 41 121.200 121.200 120.855 0.345 18237
2235 1 8 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.135 0.029 18237
2236 1 8 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.623 -0.403 18237
2237 1 8 . 1 1 41 41 LYS H H 41 8.145 8.145 7.830 0.315 18237
2238 1 8 . 1 1 42 42 TRP N N 42 120.615 120.615 120.061 0.554 18237
2239 1 8 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.292 0.305 18237
2240 1 8 . 1 1 42 42 TRP C C 42 177.641 177.641 178.580 -0.939 18237
2241 1 8 . 1 1 42 42 TRP CA C 42 58.561 58.561 60.049 -1.488 18237
2242 1 8 . 1 1 42 42 TRP CB C 42 28.839 28.839 29.153 -0.314 18237
2243 1 8 . 1 1 42 42 TRP H H 42 8.025 8.025 8.167 -0.142 18237
2244 1 8 . 1 1 43 43 ALA N N 43 122.056 122.056 120.473 1.583 18237
2245 1 8 . 1 1 43 43 ALA HA H 43 4.140 4.140 4.234 -0.094 18237
2246 1 8 . 1 1 43 43 ALA C C 43 172.776 172.776 179.872 -7.096 18237
2247 1 8 . 1 1 43 43 ALA CA C 43 54.864 54.864 55.519 -0.655 18237
2248 1 8 . 1 1 43 43 ALA CB C 43 17.974 17.974 18.071 -0.097 18237
2249 1 8 . 1 1 43 43 ALA H H 43 8.199 8.199 8.576 -0.377 18237
2250 1 8 . 1 1 44 44 SER N N 44 113.378 113.378 115.634 -2.256 18237
2251 1 8 . 1 1 44 44 SER HA H 44 4.376 4.376 4.243 0.133 18237
2252 1 8 . 1 1 44 44 SER C C 44 176.767 176.767 177.036 -0.269 18237
2253 1 8 . 1 1 44 44 SER CA C 44 60.980 60.980 62.137 -1.157 18237
2254 1 8 . 1 1 44 44 SER CB C 44 62.410 62.410 62.763 -0.353 18237
2255 1 8 . 1 1 44 44 SER H H 44 8.210 8.210 7.765 0.445 18237
2256 1 8 . 1 1 45 45 LEU N N 45 123.425 123.425 121.881 1.544 18237
2257 1 8 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.282 -0.088 18237
2258 1 8 . 1 1 45 45 LEU CA C 45 57.606 57.606 58.043 -0.437 18237
2259 1 8 . 1 1 45 45 LEU CB C 45 41.170 41.170 41.953 -0.783 18237
2260 1 8 . 1 1 45 45 LEU H H 45 7.906 7.906 7.462 0.444 18237
2261 1 8 . 1 1 46 46 TRP N N 46 118.572 118.572 120.628 -2.056 18237
2262 1 8 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.415 0.240 18237
2263 1 8 . 1 1 46 46 TRP C C 46 177.838 177.838 178.473 -0.635 18237
2264 1 8 . 1 1 46 46 TRP CA C 46 58.907 58.907 60.961 -2.054 18237
2265 1 8 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.404 -0.185 18237
2266 1 8 . 1 1 46 46 TRP H H 46 8.043 8.043 8.507 -0.464 18237
2267 1 8 . 1 1 47 47 ASN N N 47 116.564 116.564 118.259 -1.695 18237
2268 1 8 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.018 0.608 18237
2269 1 8 . 1 1 47 47 ASN C C 47 176.904 176.904 177.239 -0.335 18237
2270 1 8 . 1 1 47 47 ASN CA C 47 55.045 55.045 55.635 -0.590 18237
2271 1 8 . 1 1 47 47 ASN CB C 47 38.563 38.563 38.725 -0.162 18237
2272 1 8 . 1 1 47 47 ASN H H 47 8.174 8.174 8.715 -0.541 18237
2273 1 8 . 1 1 48 48 TRP N N 48 121.421 121.421 120.260 1.161 18237
2274 1 8 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.634 -0.267 18237
2275 1 8 . 1 1 48 48 TRP CA C 48 59.517 59.517 57.998 1.519 18237
2276 1 8 . 1 1 48 48 TRP CB C 48 28.893 28.893 29.245 -0.352 18237
2277 1 8 . 1 1 48 48 TRP H H 48 8.145 8.145 8.142 0.003 18237
2278 1 8 . 1 1 49 49 PHE N N 49 118.299 118.299 121.675 -3.376 18237
2279 1 8 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.849 0.403 18237
2280 1 8 . 1 1 49 49 PHE C C 49 175.565 175.565 175.126 0.439 18237
2281 1 8 . 1 1 49 49 PHE CA C 49 58.887 58.887 57.164 1.723 18237
2282 1 8 . 1 1 49 49 PHE CB C 49 38.671 38.671 38.936 -0.265 18237
2283 1 8 . 1 1 49 49 PHE H H 49 8.036 8.036 7.677 0.359 18237
2284 1 8 . 1 1 50 50 ASN N N 50 118.836 118.836 119.066 -0.230 18237
2285 1 8 . 1 1 50 50 ASN HA H 50 4.626 4.626 4.149 0.477 18237
2286 1 8 . 1 1 50 50 ASN C C 50 176.439 176.439 176.345 0.094 18237
2287 1 8 . 1 1 50 50 ASN CA C 50 53.215 53.215 54.825 -1.610 18237
2288 1 8 . 1 1 50 50 ASN CB C 50 38.128 38.128 37.426 0.702 18237
2289 1 8 . 1 1 50 50 ASN H H 50 7.795 7.795 7.575 0.220 18237
2290 1 8 . 1 1 51 51 ILE N N 51 120.218 120.218 115.432 4.786 18237
2291 1 8 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.809 -0.018 18237
2292 1 8 . 1 1 51 51 ILE C C 51 177.202 177.202 176.973 0.229 18237
2293 1 8 . 1 1 51 51 ILE CA C 51 63.102 63.102 64.664 -1.562 18237
2294 1 8 . 1 1 51 51 ILE CB C 51 37.367 37.367 36.995 0.372 18237
2295 1 8 . 1 1 51 51 ILE H H 51 8.147 8.147 6.937 1.210 18237
2296 1 8 . 1 1 52 52 THR N N 52 115.352 115.352 112.634 2.718 18237
2297 1 8 . 1 1 52 52 THR HA H 52 4.031 4.031 4.032 -0.001 18237
2298 1 8 . 1 1 52 52 THR C C 52 176.095 176.095 176.645 -0.550 18237
2299 1 8 . 1 1 52 52 THR CA C 52 65.148 65.148 65.155 -0.007 18237
2300 1 8 . 1 1 52 52 THR CB C 52 68.277 68.277 67.944 0.333 18237
2301 1 8 . 1 1 52 52 THR H H 52 8.009 8.009 7.061 0.948 18237
2302 1 8 . 1 1 53 53 ASN N N 53 119.874 119.874 121.490 -1.616 18237
2303 1 8 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.181 0.455 18237
2304 1 8 . 1 1 53 53 ASN C C 53 176.530 176.530 177.375 -0.845 18237
2305 1 8 . 1 1 53 53 ASN CA C 53 54.457 54.457 55.533 -1.076 18237
2306 1 8 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.800 0.002 18237
2307 1 8 . 1 1 53 53 ASN H H 53 7.972 7.972 7.001 0.971 18237
2308 1 8 . 1 1 54 54 TRP N N 54 120.192 120.192 119.763 0.429 18237
2309 1 8 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.446 0.209 18237
2310 1 8 . 1 1 54 54 TRP CA C 54 58.643 58.643 59.040 -0.397 18237
2311 1 8 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.255 -0.090 18237
2312 1 8 . 1 1 54 54 TRP H H 54 7.897 7.897 7.325 0.572 18237
2313 1 8 . 1 1 55 55 LEU N N 55 118.354 118.354 121.875 -3.521 18237
2314 1 8 . 1 1 55 55 LEU HA H 55 4.088 4.088 3.922 0.166 18237
2315 1 8 . 1 1 55 55 LEU C C 55 177.975 177.975 178.922 -0.947 18237
2316 1 8 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.548 -2.078 18237
2317 1 8 . 1 1 55 55 LEU CB C 55 40.898 40.898 42.062 -1.164 18237
2318 1 8 . 1 1 55 55 LEU H H 55 7.931 7.931 7.947 -0.016 18237
2319 1 8 . 1 1 56 56 TRP N N 56 118.335 118.335 117.717 0.618 18237
2320 1 8 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.335 0.032 18237
2321 1 8 . 1 1 56 56 TRP C C 56 176.863 176.863 178.417 -1.554 18237
2322 1 8 . 1 1 56 56 TRP CA C 56 59.070 59.070 61.058 -1.988 18237
2323 1 8 . 1 1 56 56 TRP CB C 56 28.839 28.839 28.814 0.025 18237
2324 1 8 . 1 1 56 56 TRP H H 56 7.665 7.665 7.852 -0.187 18237
2325 1 8 . 1 1 57 57 TYR N N 57 116.808 116.808 118.637 -1.829 18237
2326 1 8 . 1 1 57 57 TYR HA H 57 4.172 4.172 4.398 -0.226 18237
2327 1 8 . 1 1 57 57 TYR C C 57 176.085 176.085 176.866 -0.781 18237
2328 1 8 . 1 1 57 57 TYR CA C 57 59.865 59.865 61.018 -1.153 18237
2329 1 8 . 1 1 57 57 TYR CB C 57 38.563 38.563 38.961 -0.398 18237
2330 1 8 . 1 1 57 57 TYR H H 57 7.578 7.578 7.407 0.171 18237
2331 1 8 . 1 1 58 58 ILE N N 58 115.526 115.526 116.462 -0.936 18237
2332 1 8 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.162 0.103 18237
2333 1 8 . 1 1 58 58 ILE C C 58 174.782 174.782 176.013 -1.231 18237
2334 1 8 . 1 1 58 58 ILE CA C 58 60.940 60.940 61.424 -0.484 18237
2335 1 8 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.158 0.024 18237
2336 1 8 . 1 1 58 58 ILE H H 58 7.586 7.586 8.424 -0.838 18237
2337 1 9 . 1 1 2 2 TYR N N 2 120.470 120.470 118.669 1.801 18237
2338 1 9 . 1 1 2 2 TYR C C 2 176.535 176.535 174.579 1.956 18237
2339 1 9 . 1 1 2 2 TYR CA C 2 55.995 55.995 57.009 -1.014 18237
2340 1 9 . 1 1 2 2 TYR CB C 2 37.313 37.313 39.698 -2.385 18237
2341 1 9 . 1 1 2 2 TYR H H 2 7.951 7.951 7.645 0.306 18237
2342 1 9 . 1 1 3 3 ILE N N 3 118.307 118.307 122.822 -4.515 18237
2343 1 9 . 1 1 3 3 ILE CA C 3 58.968 58.968 59.241 -0.273 18237
2344 1 9 . 1 1 3 3 ILE CB C 3 38.074 38.074 39.356 -1.282 18237
2345 1 9 . 1 1 3 3 ILE H H 3 8.381 8.381 8.265 0.116 18237
2346 1 9 . 1 1 5 5 GLU N N 5 118.785 118.785 122.970 -4.185 18237
2347 1 9 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.582 -0.327 18237
2348 1 9 . 1 1 5 5 GLU C C 5 176.267 176.267 174.604 1.663 18237
2349 1 9 . 1 1 5 5 GLU CA C 5 55.959 55.959 56.496 -0.537 18237
2350 1 9 . 1 1 5 5 GLU CB C 5 30.034 30.034 30.835 -0.801 18237
2351 1 9 . 1 1 5 5 GLU H H 5 7.710 7.710 8.472 -0.762 18237
2352 1 9 . 1 1 6 6 ALA N N 6 131.546 131.546 128.016 3.530 18237
2353 1 9 . 1 1 6 6 ALA HA H 6 3.575 3.575 4.609 -1.034 18237
2354 1 9 . 1 1 6 6 ALA CA C 6 50.959 50.959 52.545 -1.586 18237
2355 1 9 . 1 1 6 6 ALA CB C 6 14.389 14.389 18.538 -4.149 18237
2356 1 9 . 1 1 6 6 ALA H H 6 8.338 8.338 8.186 0.152 18237
2357 1 9 . 1 1 8 8 ARG N N 8 126.915 126.915 122.890 4.025 18237
2358 1 9 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.418 -0.348 18237
2359 1 9 . 1 1 8 8 ARG C C 8 175.110 175.110 174.678 0.432 18237
2360 1 9 . 1 1 8 8 ARG CA C 8 54.699 54.699 54.559 0.140 18237
2361 1 9 . 1 1 8 8 ARG CB C 8 28.078 28.078 32.229 -4.151 18237
2362 1 9 . 1 1 8 8 ARG H H 8 8.725 8.725 7.841 0.884 18237
2363 1 9 . 1 1 9 9 ASP N N 9 123.653 123.653 119.405 4.248 18237
2364 1 9 . 1 1 9 9 ASP C C 9 178.015 178.015 176.778 1.237 18237
2365 1 9 . 1 1 9 9 ASP CA C 9 52.747 52.747 54.135 -1.388 18237
2366 1 9 . 1 1 9 9 ASP CB C 9 40.844 40.844 41.270 -0.426 18237
2367 1 9 . 1 1 9 9 ASP H H 9 8.432 8.432 8.578 -0.145 18237
2368 1 9 . 1 1 10 10 GLY N N 10 111.908 111.908 107.832 4.076 18237
2369 1 9 . 1 1 10 10 GLY C C 10 174.822 174.822 174.599 0.223 18237
2370 1 9 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.445 -0.201 18237
2371 1 9 . 1 1 10 10 GLY H H 10 9.727 9.727 8.331 1.396 18237
2372 1 9 . 1 1 11 11 GLN N N 11 118.395 118.395 120.346 -1.951 18237
2373 1 9 . 1 1 11 11 GLN C C 11 174.711 174.711 175.045 -0.334 18237
2374 1 9 . 1 1 11 11 GLN CA C 11 53.398 53.398 54.741 -1.343 18237
2375 1 9 . 1 1 11 11 GLN CB C 11 30.306 30.306 30.014 0.292 18237
2376 1 9 . 1 1 11 11 GLN H H 11 8.416 8.416 8.010 0.406 18237
2377 1 9 . 1 1 12 12 ALA N N 12 121.020 121.020 122.888 -1.868 18237
2378 1 9 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.754 0.189 18237
2379 1 9 . 1 1 12 12 ALA C C 12 177.990 177.990 175.485 2.505 18237
2380 1 9 . 1 1 12 12 ALA CA C 12 50.511 50.511 51.219 -0.708 18237
2381 1 9 . 1 1 12 12 ALA CB C 12 20.147 20.147 20.202 -0.055 18237
2382 1 9 . 1 1 12 12 ALA H H 12 7.933 7.933 8.104 -0.171 18237
2383 1 9 . 1 1 13 13 TYR N N 13 121.755 121.755 120.778 0.977 18237
2384 1 9 . 1 1 13 13 TYR C C 13 175.519 175.519 174.945 0.574 18237
2385 1 9 . 1 1 13 13 TYR CA C 13 59.090 59.090 56.733 2.357 18237
2386 1 9 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.440 1.740 18237
2387 1 9 . 1 1 13 13 TYR H H 13 9.575 9.575 8.621 0.954 18237
2388 1 9 . 1 1 14 14 VAL N N 14 112.251 112.251 121.232 -8.981 18237
2389 1 9 . 1 1 14 14 VAL C C 14 174.074 174.074 174.763 -0.689 18237
2390 1 9 . 1 1 14 14 VAL CA C 14 59.090 59.090 58.953 0.137 18237
2391 1 9 . 1 1 14 14 VAL CB C 14 32.750 32.750 35.033 -2.283 18237
2392 1 9 . 1 1 14 14 VAL H H 14 9.659 9.659 9.037 0.622 18237
2393 1 9 . 1 1 15 15 ARG N N 15 124.657 124.657 122.254 2.403 18237
2394 1 9 . 1 1 15 15 ARG C C 15 174.948 174.948 175.500 -0.552 18237
2395 1 9 . 1 1 15 15 ARG CA C 15 53.520 53.520 55.920 -2.400 18237
2396 1 9 . 1 1 15 15 ARG CB C 15 32.533 32.533 30.140 2.393 18237
2397 1 9 . 1 1 15 15 ARG H H 15 8.503 8.503 8.525 -0.022 18237
2398 1 9 . 1 1 16 16 LYS N N 16 128.240 128.240 125.684 2.556 18237
2399 1 9 . 1 1 16 16 LYS C C 16 175.974 175.974 175.473 0.501 18237
2400 1 9 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.669 0.107 18237
2401 1 9 . 1 1 16 16 LYS CB C 16 36.553 36.553 35.467 1.086 18237
2402 1 9 . 1 1 16 16 LYS H H 16 9.052 9.052 8.682 0.370 18237
2403 1 9 . 1 1 17 17 ASP N N 17 130.562 130.562 127.253 3.309 18237
2404 1 9 . 1 1 17 17 ASP C C 17 175.822 175.822 176.490 -0.668 18237
2405 1 9 . 1 1 17 17 ASP CA C 17 56.447 56.447 54.770 1.677 18237
2406 1 9 . 1 1 17 17 ASP CB C 17 40.192 40.192 39.938 0.254 18237
2407 1 9 . 1 1 17 17 ASP H H 17 10.886 10.886 9.028 1.858 18237
2408 1 9 . 1 1 18 18 GLY N N 18 104.754 104.754 105.400 -0.646 18237
2409 1 9 . 1 1 18 18 GLY C C 18 173.104 173.104 173.624 -0.520 18237
2410 1 9 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.254 -0.010 18237
2411 1 9 . 1 1 18 18 GLY H H 18 9.353 9.353 8.399 0.954 18237
2412 1 9 . 1 1 19 19 GLU N N 19 117.501 117.501 118.122 -0.621 18237
2413 1 9 . 1 1 19 19 GLU HA H 19 4.648 4.648 4.030 0.618 18237
2414 1 9 . 1 1 19 19 GLU C C 19 176.166 176.166 174.716 1.450 18237
2415 1 9 . 1 1 19 19 GLU CA C 19 53.865 53.865 54.423 -0.558 18237
2416 1 9 . 1 1 19 19 GLU CB C 19 33.130 33.130 33.108 0.022 18237
2417 1 9 . 1 1 19 19 GLU H H 19 7.813 7.813 8.248 -0.435 18237
2418 1 9 . 1 1 20 20 TRP N N 20 122.768 122.768 122.254 0.514 18237
2419 1 9 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.568 -0.901 18237
2420 1 9 . 1 1 20 20 TRP C C 20 176.302 176.302 176.531 -0.229 18237
2421 1 9 . 1 1 20 20 TRP CA C 20 55.878 55.878 55.324 0.554 18237
2422 1 9 . 1 1 20 20 TRP CB C 20 29.545 29.545 29.213 0.332 18237
2423 1 9 . 1 1 20 20 TRP H H 20 9.094 9.094 7.487 1.607 18237
2424 1 9 . 1 1 21 21 VAL N N 21 123.071 123.071 124.523 -1.452 18237
2425 1 9 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.511 0.474 18237
2426 1 9 . 1 1 21 21 VAL C C 21 175.640 175.640 175.906 -0.266 18237
2427 1 9 . 1 1 21 21 VAL CA C 21 59.537 59.537 60.552 -1.015 18237
2428 1 9 . 1 1 21 21 VAL CB C 21 34.651 34.651 34.206 0.445 18237
2429 1 9 . 1 1 21 21 VAL H H 21 9.868 9.868 8.516 1.352 18237
2430 1 9 . 1 1 22 22 LEU N N 22 127.193 127.193 129.460 -2.267 18237
2431 1 9 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.163 0.259 18237
2432 1 9 . 1 1 22 22 LEU C C 22 179.268 179.268 178.667 0.601 18237
2433 1 9 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.645 -0.011 18237
2434 1 9 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.096 0.183 18237
2435 1 9 . 1 1 22 22 LEU H H 22 8.812 8.812 9.057 -0.245 18237
2436 1 9 . 1 1 23 23 LEU N N 23 126.386 126.386 128.455 -2.069 18237
2437 1 9 . 1 1 23 23 LEU C C 23 178.844 178.844 178.515 0.329 18237
2438 1 9 . 1 1 23 23 LEU CA C 23 57.403 57.403 58.126 -0.723 18237
2439 1 9 . 1 1 23 23 LEU CB C 23 41.061 41.061 42.111 -1.050 18237
2440 1 9 . 1 1 23 23 LEU H H 23 8.562 8.562 8.158 0.404 18237
2441 1 9 . 1 1 24 24 SER N N 24 113.100 113.100 113.142 -0.042 18237
2442 1 9 . 1 1 24 24 SER HA H 24 4.621 4.621 4.156 0.465 18237
2443 1 9 . 1 1 24 24 SER C C 24 176.676 176.676 176.050 0.626 18237
2444 1 9 . 1 1 24 24 SER CA C 24 60.960 60.960 61.202 -0.242 18237
2445 1 9 . 1 1 24 24 SER CB C 24 61.650 61.650 62.581 -0.931 18237
2446 1 9 . 1 1 24 24 SER H H 24 9.098 9.098 8.654 0.444 18237
2447 1 9 . 1 1 25 25 THR N N 25 116.715 116.715 117.465 -0.750 18237
2448 1 9 . 1 1 25 25 THR HA H 25 3.915 3.915 4.068 -0.153 18237
2449 1 9 . 1 1 25 25 THR CA C 25 64.599 64.599 66.065 -1.466 18237
2450 1 9 . 1 1 25 25 THR CB C 25 68.657 68.657 68.732 -0.075 18237
2451 1 9 . 1 1 25 25 THR H H 25 7.238 7.238 8.066 -0.828 18237
2452 1 9 . 1 1 26 26 PHE N N 26 118.488 118.488 118.051 0.437 18237
2453 1 9 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.490 -0.380 18237
2454 1 9 . 1 1 26 26 PHE C C 26 176.181 176.181 176.589 -0.408 18237
2455 1 9 . 1 1 26 26 PHE CA C 26 58.627 58.627 59.416 -0.789 18237
2456 1 9 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.477 0.316 18237
2457 1 9 . 1 1 26 26 PHE H H 26 7.945 7.945 8.028 -0.083 18237
2458 1 9 . 1 1 27 27 LEU N N 27 118.525 118.525 120.613 -2.088 18237
2459 1 9 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.261 0.262 18237
2460 1 9 . 1 1 27 27 LEU C C 27 177.752 177.752 177.607 0.145 18237
2461 1 9 . 1 1 27 27 LEU CA C 27 54.679 54.679 55.623 -0.944 18237
2462 1 9 . 1 1 27 27 LEU CB C 27 41.333 41.333 43.233 -1.900 18237
2463 1 9 . 1 1 27 27 LEU H H 27 7.290 7.290 7.484 -0.194 18237
2464 1 9 . 1 1 28 28 GLY N N 28 108.823 108.823 108.293 0.530 18237
2465 1 9 . 1 1 28 28 GLY C C 28 174.630 174.630 173.553 1.077 18237
2466 1 9 . 1 1 28 28 GLY CA C 28 45.374 45.374 44.959 0.415 18237
2467 1 9 . 1 1 28 28 GLY H H 28 8.242 8.242 7.907 0.335 18237
2468 1 9 . 1 1 29 29 SER N N 29 116.210 116.210 116.944 -0.734 18237
2469 1 9 . 1 1 29 29 SER HA H 29 4.626 4.626 4.662 -0.036 18237
2470 1 9 . 1 1 29 29 SER C C 29 175.312 175.312 174.533 0.779 18237
2471 1 9 . 1 1 29 29 SER CA C 29 57.992 57.992 57.995 -0.003 18237
2472 1 9 . 1 1 29 29 SER CB C 29 63.605 63.605 65.278 -1.673 18237
2473 1 9 . 1 1 29 29 SER H H 29 8.310 8.310 7.994 0.316 18237
2474 1 9 . 1 1 30 30 SER N N 30 118.892 118.892 113.388 5.504 18237
2475 1 9 . 1 1 30 30 SER HA H 30 4.597 4.597 4.297 0.300 18237
2476 1 9 . 1 1 30 30 SER C C 30 175.479 175.479 174.644 0.835 18237
2477 1 9 . 1 1 30 30 SER CA C 30 58.582 58.582 60.056 -1.474 18237
2478 1 9 . 1 1 30 30 SER CB C 30 63.605 63.605 61.838 1.767 18237
2479 1 9 . 1 1 30 30 SER H H 30 8.593 8.593 8.868 -0.275 18237
2480 1 9 . 1 1 31 31 GLY N N 31 111.354 111.354 110.099 1.255 18237
2481 1 9 . 1 1 31 31 GLY C C 31 174.428 174.428 174.993 -0.565 18237
2482 1 9 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.604 -0.148 18237
2483 1 9 . 1 1 31 31 GLY H H 31 8.584 8.584 7.938 0.646 18237
2484 1 9 . 1 1 32 32 ASN N N 32 119.486 119.486 120.883 -1.397 18237
2485 1 9 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.670 0.147 18237
2486 1 9 . 1 1 32 32 ASN C C 32 175.928 175.928 175.748 0.180 18237
2487 1 9 . 1 1 32 32 ASN CA C 32 53.215 53.215 52.926 0.289 18237
2488 1 9 . 1 1 32 32 ASN CB C 32 38.780 38.780 37.232 1.548 18237
2489 1 9 . 1 1 32 32 ASN H H 32 8.393 8.393 8.578 -0.185 18237
2490 1 9 . 1 1 33 33 GLU N N 33 122.031 122.031 120.786 1.245 18237
2491 1 9 . 1 1 33 33 GLU HA H 33 4.271 4.271 3.950 0.321 18237
2492 1 9 . 1 1 33 33 GLU CA C 33 57.426 57.426 58.861 -1.435 18237
2493 1 9 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.643 -0.315 18237
2494 1 9 . 1 1 33 33 GLU H H 33 8.711 8.711 8.021 0.690 18237
2495 1 9 . 1 1 34 34 GLN N N 34 120.866 120.866 116.876 3.990 18237
2496 1 9 . 1 1 34 34 GLN HA H 34 4.271 4.271 4.058 0.213 18237
2497 1 9 . 1 1 34 34 GLN CA C 34 56.226 56.226 58.354 -2.128 18237
2498 1 9 . 1 1 34 34 GLN CB C 34 28.839 28.839 28.189 0.651 18237
2499 1 9 . 1 1 34 34 GLN H H 34 8.438 8.438 7.647 0.791 18237
2500 1 9 . 1 1 35 35 GLU N N 35 122.323 122.323 121.091 1.232 18237
2501 1 9 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.180 0.139 18237
2502 1 9 . 1 1 35 35 GLU C C 35 177.176 177.176 178.362 -1.186 18237
2503 1 9 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.340 -1.344 18237
2504 1 9 . 1 1 35 35 GLU CB C 35 29.545 29.545 29.510 0.035 18237
2505 1 9 . 1 1 35 35 GLU H H 35 8.424 8.424 7.724 0.700 18237
2506 1 9 . 1 1 36 36 LEU N N 36 122.904 122.904 117.197 5.707 18237
2507 1 9 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.132 0.187 18237
2508 1 9 . 1 1 36 36 LEU CA C 36 55.898 55.898 56.540 -0.642 18237
2509 1 9 . 1 1 36 36 LEU CB C 36 41.496 41.496 42.075 -0.579 18237
2510 1 9 . 1 1 36 36 LEU H H 36 8.342 8.342 7.396 0.946 18237
2511 1 9 . 1 1 38 38 GLU N N 38 121.931 121.931 121.057 0.874 18237
2512 1 9 . 1 1 38 38 GLU HA H 38 4.396 4.396 4.114 0.282 18237
2513 1 9 . 1 1 38 38 GLU C C 38 177.318 177.318 178.120 -0.802 18237
2514 1 9 . 1 1 38 38 GLU CA C 38 56.366 56.366 59.280 -2.914 18237
2515 1 9 . 1 1 38 38 GLU CB C 38 29.328 29.328 29.665 -0.337 18237
2516 1 9 . 1 1 38 38 GLU H H 38 8.342 8.342 7.423 0.919 18237
2517 1 9 . 1 1 39 39 LEU N N 39 123.317 123.317 119.837 3.480 18237
2518 1 9 . 1 1 39 39 LEU HA H 39 4.348 4.348 2.275 2.073 18237
2519 1 9 . 1 1 39 39 LEU CA C 39 56.833 56.833 57.873 -1.040 18237
2520 1 9 . 1 1 39 39 LEU CB C 39 41.387 41.387 41.325 0.062 18237
2521 1 9 . 1 1 39 39 LEU H H 39 8.342 8.342 7.186 1.156 18237
2522 1 9 . 1 1 40 40 ASP N N 40 119.726 119.726 116.153 3.573 18237
2523 1 9 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.251 0.320 18237
2524 1 9 . 1 1 40 40 ASP CA C 40 55.589 55.589 57.203 -1.614 18237
2525 1 9 . 1 1 40 40 ASP H H 40 8.530 8.530 8.496 0.034 18237
2526 1 9 . 1 1 41 41 LYS N N 41 121.200 121.200 118.279 2.921 18237
2527 1 9 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.339 -0.175 18237
2528 1 9 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.157 0.063 18237
2529 1 9 . 1 1 41 41 LYS H H 41 8.145 8.145 7.818 0.327 18237
2530 1 9 . 1 1 42 42 TRP N N 42 120.615 120.615 121.403 -0.788 18237
2531 1 9 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.394 0.203 18237
2532 1 9 . 1 1 42 42 TRP C C 42 177.641 177.641 178.242 -0.601 18237
2533 1 9 . 1 1 42 42 TRP CA C 42 58.561 58.561 59.293 -0.732 18237
2534 1 9 . 1 1 42 42 TRP CB C 42 28.839 28.839 27.881 0.958 18237
2535 1 9 . 1 1 42 42 TRP H H 42 8.025 8.025 7.958 0.067 18237
2536 1 9 . 1 1 43 43 ALA N N 43 122.056 122.056 120.412 1.644 18237
2537 1 9 . 1 1 43 43 ALA HA H 43 4.140 4.140 4.081 0.059 18237
2538 1 9 . 1 1 43 43 ALA C C 43 172.776 172.776 179.948 -7.172 18237
2539 1 9 . 1 1 43 43 ALA CA C 43 54.864 54.864 55.174 -0.310 18237
2540 1 9 . 1 1 43 43 ALA CB C 43 17.974 17.974 17.826 0.148 18237
2541 1 9 . 1 1 43 43 ALA H H 43 8.199 8.199 7.993 0.206 18237
2542 1 9 . 1 1 44 44 SER N N 44 113.378 113.378 114.563 -1.185 18237
2543 1 9 . 1 1 44 44 SER HA H 44 4.376 4.376 4.289 0.087 18237
2544 1 9 . 1 1 44 44 SER C C 44 176.767 176.767 176.886 -0.119 18237
2545 1 9 . 1 1 44 44 SER CA C 44 60.980 60.980 62.077 -1.097 18237
2546 1 9 . 1 1 44 44 SER CB C 44 62.410 62.410 63.111 -0.701 18237
2547 1 9 . 1 1 44 44 SER H H 44 8.210 8.210 8.119 0.091 18237
2548 1 9 . 1 1 45 45 LEU N N 45 123.425 123.425 122.283 1.142 18237
2549 1 9 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.326 -0.132 18237
2550 1 9 . 1 1 45 45 LEU CA C 45 57.606 57.606 57.973 -0.367 18237
2551 1 9 . 1 1 45 45 LEU CB C 45 41.170 41.170 41.904 -0.734 18237
2552 1 9 . 1 1 45 45 LEU H H 45 7.906 7.906 7.609 0.297 18237
2553 1 9 . 1 1 46 46 TRP N N 46 118.572 118.572 119.864 -1.292 18237
2554 1 9 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.318 0.337 18237
2555 1 9 . 1 1 46 46 TRP C C 46 177.838 177.838 178.710 -0.872 18237
2556 1 9 . 1 1 46 46 TRP CA C 46 58.907 58.907 60.523 -1.616 18237
2557 1 9 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.409 -0.190 18237
2558 1 9 . 1 1 46 46 TRP H H 46 8.043 8.043 8.230 -0.187 18237
2559 1 9 . 1 1 47 47 ASN N N 47 116.564 116.564 117.741 -1.177 18237
2560 1 9 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.754 -0.128 18237
2561 1 9 . 1 1 47 47 ASN C C 47 176.904 176.904 177.719 -0.815 18237
2562 1 9 . 1 1 47 47 ASN CA C 47 55.045 55.045 55.909 -0.864 18237
2563 1 9 . 1 1 47 47 ASN CB C 47 38.563 38.563 38.620 -0.057 18237
2564 1 9 . 1 1 47 47 ASN H H 47 8.174 8.174 8.861 -0.687 18237
2565 1 9 . 1 1 48 48 TRP N N 48 121.421 121.421 121.439 -0.018 18237
2566 1 9 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.615 -0.248 18237
2567 1 9 . 1 1 48 48 TRP CA C 48 59.517 59.517 58.356 1.161 18237
2568 1 9 . 1 1 48 48 TRP CB C 48 28.893 28.893 28.796 0.097 18237
2569 1 9 . 1 1 48 48 TRP H H 48 8.145 8.145 8.186 -0.041 18237
2570 1 9 . 1 1 49 49 PHE N N 49 118.299 118.299 120.333 -2.034 18237
2571 1 9 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.748 0.504 18237
2572 1 9 . 1 1 49 49 PHE C C 49 175.565 175.565 175.283 0.282 18237
2573 1 9 . 1 1 49 49 PHE CA C 49 58.887 58.887 58.320 0.567 18237
2574 1 9 . 1 1 49 49 PHE CB C 49 38.671 38.671 37.924 0.747 18237
2575 1 9 . 1 1 49 49 PHE H H 49 8.036 8.036 7.605 0.431 18237
2576 1 9 . 1 1 50 50 ASN N N 50 118.836 118.836 119.468 -0.632 18237
2577 1 9 . 1 1 50 50 ASN HA H 50 4.626 4.626 3.992 0.634 18237
2578 1 9 . 1 1 50 50 ASN C C 50 176.439 176.439 176.554 -0.115 18237
2579 1 9 . 1 1 50 50 ASN CA C 50 53.215 53.215 54.999 -1.784 18237
2580 1 9 . 1 1 50 50 ASN CB C 50 38.128 38.128 38.376 -0.248 18237
2581 1 9 . 1 1 50 50 ASN H H 50 7.795 7.795 7.502 0.293 18237
2582 1 9 . 1 1 51 51 ILE N N 51 120.218 120.218 116.885 3.333 18237
2583 1 9 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.827 -0.036 18237
2584 1 9 . 1 1 51 51 ILE C C 51 177.202 177.202 177.251 -0.049 18237
2585 1 9 . 1 1 51 51 ILE CA C 51 63.102 63.102 65.121 -2.019 18237
2586 1 9 . 1 1 51 51 ILE CB C 51 37.367 37.367 37.215 0.152 18237
2587 1 9 . 1 1 51 51 ILE H H 51 8.147 8.147 6.945 1.202 18237
2588 1 9 . 1 1 52 52 THR N N 52 115.352 115.352 114.951 0.401 18237
2589 1 9 . 1 1 52 52 THR HA H 52 4.031 4.031 4.095 -0.064 18237
2590 1 9 . 1 1 52 52 THR C C 52 176.095 176.095 176.276 -0.181 18237
2591 1 9 . 1 1 52 52 THR CA C 52 65.148 65.148 66.271 -1.123 18237
2592 1 9 . 1 1 52 52 THR CB C 52 68.277 68.277 68.045 0.232 18237
2593 1 9 . 1 1 52 52 THR H H 52 8.009 8.009 7.454 0.555 18237
2594 1 9 . 1 1 53 53 ASN N N 53 119.874 119.874 121.024 -1.150 18237
2595 1 9 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.208 0.428 18237
2596 1 9 . 1 1 53 53 ASN C C 53 176.530 176.530 177.082 -0.552 18237
2597 1 9 . 1 1 53 53 ASN CA C 53 54.457 54.457 55.665 -1.208 18237
2598 1 9 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.618 0.184 18237
2599 1 9 . 1 1 53 53 ASN H H 53 7.972 7.972 7.098 0.874 18237
2600 1 9 . 1 1 54 54 TRP N N 54 120.192 120.192 120.375 -0.183 18237
2601 1 9 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.559 0.096 18237
2602 1 9 . 1 1 54 54 TRP CA C 54 58.643 58.643 59.198 -0.555 18237
2603 1 9 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.238 -0.073 18237
2604 1 9 . 1 1 54 54 TRP H H 54 7.897 7.897 7.249 0.648 18237
2605 1 9 . 1 1 55 55 LEU N N 55 118.354 118.354 121.076 -2.722 18237
2606 1 9 . 1 1 55 55 LEU HA H 55 4.088 4.088 4.082 0.006 18237
2607 1 9 . 1 1 55 55 LEU C C 55 177.975 177.975 179.700 -1.725 18237
2608 1 9 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.551 -2.081 18237
2609 1 9 . 1 1 55 55 LEU CB C 55 40.898 40.898 41.351 -0.453 18237
2610 1 9 . 1 1 55 55 LEU H H 55 7.931 7.931 7.916 0.015 18237
2611 1 9 . 1 1 56 56 TRP N N 56 118.335 118.335 117.393 0.942 18237
2612 1 9 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.313 0.054 18237
2613 1 9 . 1 1 56 56 TRP C C 56 176.863 176.863 178.495 -1.632 18237
2614 1 9 . 1 1 56 56 TRP CA C 56 59.070 59.070 61.108 -2.038 18237
2615 1 9 . 1 1 56 56 TRP CB C 56 28.839 28.839 28.857 -0.018 18237
2616 1 9 . 1 1 56 56 TRP H H 56 7.665 7.665 7.874 -0.209 18237
2617 1 9 . 1 1 57 57 TYR N N 57 116.808 116.808 119.544 -2.736 18237
2618 1 9 . 1 1 57 57 TYR HA H 57 4.172 4.172 4.364 -0.192 18237
2619 1 9 . 1 1 57 57 TYR C C 57 176.085 176.085 177.287 -1.202 18237
2620 1 9 . 1 1 57 57 TYR CA C 57 59.865 59.865 61.206 -1.341 18237
2621 1 9 . 1 1 57 57 TYR CB C 57 38.563 38.563 39.256 -0.693 18237
2622 1 9 . 1 1 57 57 TYR H H 57 7.578 7.578 7.593 -0.015 18237
2623 1 9 . 1 1 58 58 ILE N N 58 115.526 115.526 113.167 2.359 18237
2624 1 9 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.326 -0.061 18237
2625 1 9 . 1 1 58 58 ILE C C 58 174.782 174.782 175.864 -1.082 18237
2626 1 9 . 1 1 58 58 ILE CA C 58 60.940 60.940 61.707 -0.767 18237
2627 1 9 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.159 0.023 18237
2628 1 9 . 1 1 58 58 ILE H H 58 7.586 7.586 8.471 -0.885 18237
2629 1 10 . 1 1 2 2 TYR N N 2 120.470 120.470 120.595 -0.125 18237
2630 1 10 . 1 1 2 2 TYR C C 2 176.535 176.535 176.347 0.188 18237
2631 1 10 . 1 1 2 2 TYR CA C 2 55.995 55.995 56.821 -0.826 18237
2632 1 10 . 1 1 2 2 TYR CB C 2 37.313 37.313 39.583 -2.270 18237
2633 1 10 . 1 1 2 2 TYR H H 2 7.951 7.951 8.061 -0.110 18237
2634 1 10 . 1 1 3 3 ILE N N 3 118.307 118.307 122.082 -3.775 18237
2635 1 10 . 1 1 3 3 ILE CA C 3 58.968 58.968 59.232 -0.264 18237
2636 1 10 . 1 1 3 3 ILE CB C 3 38.074 38.074 36.569 1.505 18237
2637 1 10 . 1 1 3 3 ILE H H 3 8.381 8.381 8.313 0.068 18237
2638 1 10 . 1 1 5 5 GLU N N 5 118.785 118.785 117.032 1.753 18237
2639 1 10 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.277 -0.022 18237
2640 1 10 . 1 1 5 5 GLU C C 5 176.267 176.267 174.755 1.512 18237
2641 1 10 . 1 1 5 5 GLU CA C 5 55.959 55.959 56.560 -0.601 18237
2642 1 10 . 1 1 5 5 GLU CB C 5 30.034 30.034 29.713 0.321 18237
2643 1 10 . 1 1 5 5 GLU H H 5 7.710 7.710 8.050 -0.340 18237
2644 1 10 . 1 1 6 6 ALA N N 6 131.546 131.546 122.451 9.095 18237
2645 1 10 . 1 1 6 6 ALA HA H 6 3.575 3.575 2.505 1.070 18237
2646 1 10 . 1 1 6 6 ALA CA C 6 50.959 50.959 52.365 -1.406 18237
2647 1 10 . 1 1 6 6 ALA CB C 6 14.389 14.389 17.250 -2.861 18237
2648 1 10 . 1 1 6 6 ALA H H 6 8.338 8.338 7.992 0.346 18237
2649 1 10 . 1 1 8 8 ARG N N 8 126.915 126.915 119.531 7.384 18237
2650 1 10 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.640 -0.570 18237
2651 1 10 . 1 1 8 8 ARG C C 8 175.110 175.110 175.125 -0.015 18237
2652 1 10 . 1 1 8 8 ARG CA C 8 54.699 54.699 55.467 -0.768 18237
2653 1 10 . 1 1 8 8 ARG CB C 8 28.078 28.078 29.778 -1.700 18237
2654 1 10 . 1 1 8 8 ARG H H 8 8.725 8.725 8.184 0.541 18237
2655 1 10 . 1 1 9 9 ASP N N 9 123.653 123.653 124.336 -0.683 18237
2656 1 10 . 1 1 9 9 ASP C C 9 178.015 178.015 177.239 0.776 18237
2657 1 10 . 1 1 9 9 ASP CA C 9 52.747 52.747 53.958 -1.210 18237
2658 1 10 . 1 1 9 9 ASP CB C 9 40.844 40.844 40.572 0.272 18237
2659 1 10 . 1 1 9 9 ASP H H 9 8.432 8.432 8.491 -0.059 18237
2660 1 10 . 1 1 10 10 GLY N N 10 111.908 111.908 107.737 4.171 18237
2661 1 10 . 1 1 10 10 GLY C C 10 174.822 174.822 174.787 0.035 18237
2662 1 10 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.011 0.233 18237
2663 1 10 . 1 1 10 10 GLY H H 10 9.727 9.727 8.521 1.206 18237
2664 1 10 . 1 1 11 11 GLN N N 11 118.395 118.395 120.633 -2.238 18237
2665 1 10 . 1 1 11 11 GLN C C 11 174.711 174.711 174.548 0.163 18237
2666 1 10 . 1 1 11 11 GLN CA C 11 53.398 53.398 54.732 -1.334 18237
2667 1 10 . 1 1 11 11 GLN CB C 11 30.306 30.306 30.394 -0.088 18237
2668 1 10 . 1 1 11 11 GLN H H 11 8.416 8.416 8.090 0.326 18237
2669 1 10 . 1 1 12 12 ALA N N 12 121.020 121.020 122.506 -1.486 18237
2670 1 10 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.191 0.752 18237
2671 1 10 . 1 1 12 12 ALA C C 12 177.990 177.990 175.194 2.796 18237
2672 1 10 . 1 1 12 12 ALA CA C 12 50.511 50.511 50.769 -0.258 18237
2673 1 10 . 1 1 12 12 ALA CB C 12 20.147 20.147 20.528 -0.381 18237
2674 1 10 . 1 1 12 12 ALA H H 12 7.933 7.933 8.166 -0.233 18237
2675 1 10 . 1 1 13 13 TYR N N 13 121.755 121.755 119.209 2.546 18237
2676 1 10 . 1 1 13 13 TYR C C 13 175.519 175.519 174.765 0.754 18237
2677 1 10 . 1 1 13 13 TYR CA C 13 59.090 59.090 56.357 2.733 18237
2678 1 10 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.130 2.050 18237
2679 1 10 . 1 1 13 13 TYR H H 13 9.575 9.575 8.179 1.396 18237
2680 1 10 . 1 1 14 14 VAL N N 14 112.251 112.251 121.243 -8.992 18237
2681 1 10 . 1 1 14 14 VAL C C 14 174.074 174.074 175.222 -1.148 18237
2682 1 10 . 1 1 14 14 VAL CA C 14 59.090 59.090 59.067 0.023 18237
2683 1 10 . 1 1 14 14 VAL CB C 14 32.750 32.750 35.331 -2.581 18237
2684 1 10 . 1 1 14 14 VAL H H 14 9.659 9.659 8.499 1.160 18237
2685 1 10 . 1 1 15 15 ARG N N 15 124.657 124.657 122.549 2.108 18237
2686 1 10 . 1 1 15 15 ARG C C 15 174.948 174.948 175.577 -0.629 18237
2687 1 10 . 1 1 15 15 ARG CA C 15 53.520 53.520 55.479 -1.959 18237
2688 1 10 . 1 1 15 15 ARG CB C 15 32.533 32.533 29.592 2.941 18237
2689 1 10 . 1 1 15 15 ARG H H 15 8.503 8.503 8.557 -0.054 18237
2690 1 10 . 1 1 16 16 LYS N N 16 128.240 128.240 125.451 2.789 18237
2691 1 10 . 1 1 16 16 LYS C C 16 175.974 175.974 175.403 0.571 18237
2692 1 10 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.869 -0.093 18237
2693 1 10 . 1 1 16 16 LYS CB C 16 36.553 36.553 35.520 1.033 18237
2694 1 10 . 1 1 16 16 LYS H H 16 9.052 9.052 8.408 0.644 18237
2695 1 10 . 1 1 17 17 ASP N N 17 130.562 130.562 126.207 4.355 18237
2696 1 10 . 1 1 17 17 ASP C C 17 175.822 175.822 176.417 -0.595 18237
2697 1 10 . 1 1 17 17 ASP CA C 17 56.447 56.447 54.758 1.689 18237
2698 1 10 . 1 1 17 17 ASP CB C 17 40.192 40.192 40.154 0.038 18237
2699 1 10 . 1 1 17 17 ASP H H 17 10.886 10.886 9.013 1.873 18237
2700 1 10 . 1 1 18 18 GLY N N 18 104.754 104.754 104.968 -0.214 18237
2701 1 10 . 1 1 18 18 GLY C C 18 173.104 173.104 173.371 -0.267 18237
2702 1 10 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.417 -0.173 18237
2703 1 10 . 1 1 18 18 GLY H H 18 9.353 9.353 8.265 1.088 18237
2704 1 10 . 1 1 19 19 GLU N N 19 117.501 117.501 118.370 -0.869 18237
2705 1 10 . 1 1 19 19 GLU HA H 19 4.648 4.648 4.193 0.455 18237
2706 1 10 . 1 1 19 19 GLU C C 19 176.166 176.166 174.492 1.674 18237
2707 1 10 . 1 1 19 19 GLU CA C 19 53.865 53.865 53.648 0.217 18237
2708 1 10 . 1 1 19 19 GLU CB C 19 33.130 33.130 32.099 1.031 18237
2709 1 10 . 1 1 19 19 GLU H H 19 7.813 7.813 8.187 -0.374 18237
2710 1 10 . 1 1 20 20 TRP N N 20 122.768 122.768 122.536 0.232 18237
2711 1 10 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.441 -0.774 18237
2712 1 10 . 1 1 20 20 TRP C C 20 176.302 176.302 176.395 -0.093 18237
2713 1 10 . 1 1 20 20 TRP CA C 20 55.878 55.878 55.235 0.643 18237
2714 1 10 . 1 1 20 20 TRP CB C 20 29.545 29.545 29.189 0.356 18237
2715 1 10 . 1 1 20 20 TRP H H 20 9.094 9.094 7.267 1.827 18237
2716 1 10 . 1 1 21 21 VAL N N 21 123.071 123.071 124.911 -1.840 18237
2717 1 10 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.423 0.562 18237
2718 1 10 . 1 1 21 21 VAL C C 21 175.640 175.640 175.794 -0.154 18237
2719 1 10 . 1 1 21 21 VAL CA C 21 59.537 59.537 60.868 -1.331 18237
2720 1 10 . 1 1 21 21 VAL CB C 21 34.651 34.651 34.518 0.133 18237
2721 1 10 . 1 1 21 21 VAL H H 21 9.868 9.868 8.171 1.697 18237
2722 1 10 . 1 1 22 22 LEU N N 22 127.193 127.193 129.089 -1.896 18237
2723 1 10 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.477 -0.055 18237
2724 1 10 . 1 1 22 22 LEU C C 22 179.268 179.268 178.654 0.614 18237
2725 1 10 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.897 -0.263 18237
2726 1 10 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.853 -0.575 18237
2727 1 10 . 1 1 22 22 LEU H H 22 8.812 8.812 8.987 -0.175 18237
2728 1 10 . 1 1 23 23 LEU N N 23 126.386 126.386 128.532 -2.146 18237
2729 1 10 . 1 1 23 23 LEU C C 23 178.844 178.844 178.698 0.146 18237
2730 1 10 . 1 1 23 23 LEU CA C 23 57.403 57.403 58.344 -0.941 18237
2731 1 10 . 1 1 23 23 LEU CB C 23 41.061 41.061 42.107 -1.046 18237
2732 1 10 . 1 1 23 23 LEU H H 23 8.562 8.562 8.425 0.137 18237
2733 1 10 . 1 1 24 24 SER N N 24 113.100 113.100 112.649 0.451 18237
2734 1 10 . 1 1 24 24 SER HA H 24 4.621 4.621 4.137 0.484 18237
2735 1 10 . 1 1 24 24 SER C C 24 176.676 176.676 176.145 0.531 18237
2736 1 10 . 1 1 24 24 SER CA C 24 60.960 60.960 61.488 -0.528 18237
2737 1 10 . 1 1 24 24 SER CB C 24 61.650 61.650 62.583 -0.933 18237
2738 1 10 . 1 1 24 24 SER H H 24 9.098 9.098 8.721 0.377 18237
2739 1 10 . 1 1 25 25 THR N N 25 116.715 116.715 116.666 0.049 18237
2740 1 10 . 1 1 25 25 THR HA H 25 3.915 3.915 4.068 -0.153 18237
2741 1 10 . 1 1 25 25 THR CA C 25 64.599 64.599 65.773 -1.174 18237
2742 1 10 . 1 1 25 25 THR CB C 25 68.657 68.657 68.967 -0.310 18237
2743 1 10 . 1 1 25 25 THR H H 25 7.238 7.238 7.935 -0.697 18237
2744 1 10 . 1 1 26 26 PHE N N 26 118.488 118.488 120.122 -1.634 18237
2745 1 10 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.452 -0.342 18237
2746 1 10 . 1 1 26 26 PHE C C 26 176.181 176.181 176.519 -0.338 18237
2747 1 10 . 1 1 26 26 PHE CA C 26 58.627 58.627 60.131 -1.504 18237
2748 1 10 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.939 -0.146 18237
2749 1 10 . 1 1 26 26 PHE H H 26 7.945 7.945 8.302 -0.357 18237
2750 1 10 . 1 1 27 27 LEU N N 27 118.525 118.525 119.153 -0.628 18237
2751 1 10 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.331 0.192 18237
2752 1 10 . 1 1 27 27 LEU C C 27 177.752 177.752 177.713 0.039 18237
2753 1 10 . 1 1 27 27 LEU CA C 27 54.679 54.679 55.367 -0.688 18237
2754 1 10 . 1 1 27 27 LEU CB C 27 41.333 41.333 42.367 -1.034 18237
2755 1 10 . 1 1 27 27 LEU H H 27 7.290 7.290 7.929 -0.639 18237
2756 1 10 . 1 1 28 28 GLY N N 28 108.823 108.823 107.297 1.526 18237
2757 1 10 . 1 1 28 28 GLY C C 28 174.630 174.630 174.482 0.148 18237
2758 1 10 . 1 1 28 28 GLY CA C 28 45.374 45.374 44.570 0.804 18237
2759 1 10 . 1 1 28 28 GLY H H 28 8.242 8.242 7.628 0.614 18237
2760 1 10 . 1 1 29 29 SER N N 29 116.210 116.210 116.287 -0.077 18237
2761 1 10 . 1 1 29 29 SER HA H 29 4.626 4.626 4.290 0.336 18237
2762 1 10 . 1 1 29 29 SER C C 29 175.312 175.312 174.005 1.307 18237
2763 1 10 . 1 1 29 29 SER CA C 29 57.992 57.992 58.712 -0.720 18237
2764 1 10 . 1 1 29 29 SER CB C 29 63.605 63.605 63.925 -0.320 18237
2765 1 10 . 1 1 29 29 SER H H 29 8.310 8.310 8.033 0.277 18237
2766 1 10 . 1 1 30 30 SER N N 30 118.892 118.892 116.659 2.233 18237
2767 1 10 . 1 1 30 30 SER HA H 30 4.597 4.597 4.165 0.432 18237
2768 1 10 . 1 1 30 30 SER C C 30 175.479 175.479 174.068 1.411 18237
2769 1 10 . 1 1 30 30 SER CA C 30 58.582 58.582 59.462 -0.880 18237
2770 1 10 . 1 1 30 30 SER CB C 30 63.605 63.605 62.722 0.883 18237
2771 1 10 . 1 1 30 30 SER H H 30 8.593 8.593 8.858 -0.265 18237
2772 1 10 . 1 1 31 31 GLY N N 31 111.354 111.354 106.095 5.259 18237
2773 1 10 . 1 1 31 31 GLY C C 31 174.428 174.428 173.968 0.460 18237
2774 1 10 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.038 0.419 18237
2775 1 10 . 1 1 31 31 GLY H H 31 8.584 8.584 8.286 0.298 18237
2776 1 10 . 1 1 32 32 ASN N N 32 119.486 119.486 117.227 2.259 18237
2777 1 10 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.749 0.068 18237
2778 1 10 . 1 1 32 32 ASN C C 32 175.928 175.928 175.705 0.223 18237
2779 1 10 . 1 1 32 32 ASN CA C 32 53.215 53.215 53.069 0.146 18237
2780 1 10 . 1 1 32 32 ASN CB C 32 38.780 38.780 39.727 -0.947 18237
2781 1 10 . 1 1 32 32 ASN H H 32 8.393 8.393 8.253 0.140 18237
2782 1 10 . 1 1 33 33 GLU N N 33 122.031 122.031 121.408 0.623 18237
2783 1 10 . 1 1 33 33 GLU HA H 33 4.271 4.271 4.127 0.144 18237
2784 1 10 . 1 1 33 33 GLU CA C 33 57.426 57.426 58.703 -1.277 18237
2785 1 10 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.466 -0.138 18237
2786 1 10 . 1 1 33 33 GLU H H 33 8.711 8.711 8.746 -0.035 18237
2787 1 10 . 1 1 34 34 GLN N N 34 120.866 120.866 118.567 2.299 18237
2788 1 10 . 1 1 34 34 GLN HA H 34 4.271 4.271 4.103 0.168 18237
2789 1 10 . 1 1 34 34 GLN CA C 34 56.226 56.226 59.055 -2.829 18237
2790 1 10 . 1 1 34 34 GLN CB C 34 28.839 28.839 28.072 0.767 18237
2791 1 10 . 1 1 34 34 GLN H H 34 8.438 8.438 8.643 -0.205 18237
2792 1 10 . 1 1 35 35 GLU N N 35 122.323 122.323 119.049 3.274 18237
2793 1 10 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.435 -0.116 18237
2794 1 10 . 1 1 35 35 GLU C C 35 177.176 177.176 179.255 -2.079 18237
2795 1 10 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.727 -1.731 18237
2796 1 10 . 1 1 35 35 GLU CB C 35 29.545 29.545 29.290 0.255 18237
2797 1 10 . 1 1 35 35 GLU H H 35 8.424 8.424 7.928 0.496 18237
2798 1 10 . 1 1 36 36 LEU N N 36 122.904 122.904 119.587 3.317 18237
2799 1 10 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.169 0.150 18237
2800 1 10 . 1 1 36 36 LEU CA C 36 55.898 55.898 57.498 -1.600 18237
2801 1 10 . 1 1 36 36 LEU CB C 36 41.496 41.496 42.279 -0.783 18237
2802 1 10 . 1 1 36 36 LEU H H 36 8.342 8.342 7.369 0.973 18237
2803 1 10 . 1 1 38 38 GLU N N 38 121.931 121.931 121.176 0.755 18237
2804 1 10 . 1 1 38 38 GLU HA H 38 4.396 4.396 3.836 0.560 18237
2805 1 10 . 1 1 38 38 GLU C C 38 177.318 177.318 178.256 -0.938 18237
2806 1 10 . 1 1 38 38 GLU CA C 38 56.366 56.366 59.953 -3.587 18237
2807 1 10 . 1 1 38 38 GLU CB C 38 29.328 29.328 29.907 -0.579 18237
2808 1 10 . 1 1 38 38 GLU H H 38 8.342 8.342 8.061 0.281 18237
2809 1 10 . 1 1 39 39 LEU N N 39 123.317 123.317 120.262 3.055 18237
2810 1 10 . 1 1 39 39 LEU HA H 39 4.348 4.348 4.181 0.167 18237
2811 1 10 . 1 1 39 39 LEU CA C 39 56.833 56.833 58.726 -1.893 18237
2812 1 10 . 1 1 39 39 LEU CB C 39 41.387 41.387 42.047 -0.660 18237
2813 1 10 . 1 1 39 39 LEU H H 39 8.342 8.342 7.936 0.406 18237
2814 1 10 . 1 1 40 40 ASP N N 40 119.726 119.726 117.202 2.524 18237
2815 1 10 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.351 0.220 18237
2816 1 10 . 1 1 40 40 ASP CA C 40 55.589 55.589 57.723 -2.134 18237
2817 1 10 . 1 1 40 40 ASP H H 40 8.530 8.530 8.635 -0.105 18237
2818 1 10 . 1 1 41 41 LYS N N 41 121.200 121.200 120.870 0.330 18237
2819 1 10 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.059 0.105 18237
2820 1 10 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.736 -0.515 18237
2821 1 10 . 1 1 41 41 LYS H H 41 8.145 8.145 7.730 0.415 18237
2822 1 10 . 1 1 42 42 TRP N N 42 120.615 120.615 119.958 0.657 18237
2823 1 10 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.307 0.290 18237
2824 1 10 . 1 1 42 42 TRP C C 42 177.641 177.641 178.564 -0.923 18237
2825 1 10 . 1 1 42 42 TRP CA C 42 58.561 58.561 59.752 -1.191 18237
2826 1 10 . 1 1 42 42 TRP CB C 42 28.839 28.839 29.147 -0.308 18237
2827 1 10 . 1 1 42 42 TRP H H 42 8.025 8.025 8.046 -0.021 18237
2828 1 10 . 1 1 43 43 ALA N N 43 122.056 122.056 120.188 1.868 18237
2829 1 10 . 1 1 43 43 ALA HA H 43 4.140 4.140 4.100 0.040 18237
2830 1 10 . 1 1 43 43 ALA C C 43 172.776 172.776 179.776 -7.000 18237
2831 1 10 . 1 1 43 43 ALA CA C 43 54.864 54.864 55.319 -0.455 18237
2832 1 10 . 1 1 43 43 ALA CB C 43 17.974 17.974 17.920 0.054 18237
2833 1 10 . 1 1 43 43 ALA H H 43 8.199 8.199 8.618 -0.419 18237
2834 1 10 . 1 1 44 44 SER N N 44 113.378 113.378 114.882 -1.504 18237
2835 1 10 . 1 1 44 44 SER HA H 44 4.376 4.376 4.298 0.078 18237
2836 1 10 . 1 1 44 44 SER C C 44 176.767 176.767 176.945 -0.178 18237
2837 1 10 . 1 1 44 44 SER CA C 44 60.980 60.980 61.952 -0.972 18237
2838 1 10 . 1 1 44 44 SER CB C 44 62.410 62.410 62.766 -0.356 18237
2839 1 10 . 1 1 44 44 SER H H 44 8.210 8.210 7.807 0.403 18237
2840 1 10 . 1 1 45 45 LEU N N 45 123.425 123.425 121.681 1.744 18237
2841 1 10 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.323 -0.129 18237
2842 1 10 . 1 1 45 45 LEU CA C 45 57.606 57.606 57.790 -0.184 18237
2843 1 10 . 1 1 45 45 LEU CB C 45 41.170 41.170 41.998 -0.828 18237
2844 1 10 . 1 1 45 45 LEU H H 45 7.906 7.906 7.577 0.329 18237
2845 1 10 . 1 1 46 46 TRP N N 46 118.572 118.572 120.194 -1.622 18237
2846 1 10 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.338 0.317 18237
2847 1 10 . 1 1 46 46 TRP C C 46 177.838 177.838 179.219 -1.381 18237
2848 1 10 . 1 1 46 46 TRP CA C 46 58.907 58.907 61.274 -2.367 18237
2849 1 10 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.453 -0.234 18237
2850 1 10 . 1 1 46 46 TRP H H 46 8.043 8.043 8.454 -0.411 18237
2851 1 10 . 1 1 47 47 ASN N N 47 116.564 116.564 118.721 -2.157 18237
2852 1 10 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.633 -0.007 18237
2853 1 10 . 1 1 47 47 ASN C C 47 176.904 176.904 177.493 -0.589 18237
2854 1 10 . 1 1 47 47 ASN CA C 47 55.045 55.045 55.726 -0.681 18237
2855 1 10 . 1 1 47 47 ASN CB C 47 38.563 38.563 38.846 -0.283 18237
2856 1 10 . 1 1 47 47 ASN H H 47 8.174 8.174 8.932 -0.758 18237
2857 1 10 . 1 1 48 48 TRP N N 48 121.421 121.421 119.872 1.549 18237
2858 1 10 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.669 -0.302 18237
2859 1 10 . 1 1 48 48 TRP CA C 48 59.517 59.517 57.620 1.897 18237
2860 1 10 . 1 1 48 48 TRP CB C 48 28.893 28.893 29.565 -0.672 18237
2861 1 10 . 1 1 48 48 TRP H H 48 8.145 8.145 8.049 0.096 18237
2862 1 10 . 1 1 49 49 PHE N N 49 118.299 118.299 121.175 -2.876 18237
2863 1 10 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.754 0.498 18237
2864 1 10 . 1 1 49 49 PHE C C 49 175.565 175.565 174.997 0.568 18237
2865 1 10 . 1 1 49 49 PHE CA C 49 58.887 58.887 57.459 1.427 18237
2866 1 10 . 1 1 49 49 PHE CB C 49 38.671 38.671 38.749 -0.078 18237
2867 1 10 . 1 1 49 49 PHE H H 49 8.036 8.036 7.281 0.755 18237
2868 1 10 . 1 1 50 50 ASN N N 50 118.836 118.836 119.250 -0.414 18237
2869 1 10 . 1 1 50 50 ASN HA H 50 4.626 4.626 3.856 0.770 18237
2870 1 10 . 1 1 50 50 ASN C C 50 176.439 176.439 176.217 0.222 18237
2871 1 10 . 1 1 50 50 ASN CA C 50 53.215 53.215 54.541 -1.326 18237
2872 1 10 . 1 1 50 50 ASN CB C 50 38.128 38.128 37.681 0.447 18237
2873 1 10 . 1 1 50 50 ASN H H 50 7.795 7.795 7.475 0.320 18237
2874 1 10 . 1 1 51 51 ILE N N 51 120.218 120.218 115.317 4.901 18237
2875 1 10 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.801 -0.010 18237
2876 1 10 . 1 1 51 51 ILE C C 51 177.202 177.202 176.858 0.344 18237
2877 1 10 . 1 1 51 51 ILE CA C 51 63.102 63.102 64.809 -1.707 18237
2878 1 10 . 1 1 51 51 ILE CB C 51 37.367 37.367 36.994 0.373 18237
2879 1 10 . 1 1 51 51 ILE H H 51 8.147 8.147 6.873 1.274 18237
2880 1 10 . 1 1 52 52 THR N N 52 115.352 115.352 112.024 3.328 18237
2881 1 10 . 1 1 52 52 THR HA H 52 4.031 4.031 3.977 0.054 18237
2882 1 10 . 1 1 52 52 THR C C 52 176.095 176.095 176.254 -0.159 18237
2883 1 10 . 1 1 52 52 THR CA C 52 65.148 65.148 65.267 -0.119 18237
2884 1 10 . 1 1 52 52 THR CB C 52 68.277 68.277 67.714 0.563 18237
2885 1 10 . 1 1 52 52 THR H H 52 8.009 8.009 7.110 0.899 18237
2886 1 10 . 1 1 53 53 ASN N N 53 119.874 119.874 120.768 -0.894 18237
2887 1 10 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.153 0.483 18237
2888 1 10 . 1 1 53 53 ASN C C 53 176.530 176.530 176.919 -0.389 18237
2889 1 10 . 1 1 53 53 ASN CA C 53 54.457 54.457 55.522 -1.065 18237
2890 1 10 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.492 0.310 18237
2891 1 10 . 1 1 53 53 ASN H H 53 7.972 7.972 6.792 1.180 18237
2892 1 10 . 1 1 54 54 TRP N N 54 120.192 120.192 119.596 0.596 18237
2893 1 10 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.430 0.225 18237
2894 1 10 . 1 1 54 54 TRP CA C 54 58.643 58.643 59.191 -0.548 18237
2895 1 10 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.128 0.037 18237
2896 1 10 . 1 1 54 54 TRP H H 54 7.897 7.897 7.277 0.620 18237
2897 1 10 . 1 1 55 55 LEU N N 55 118.354 118.354 121.372 -3.018 18237
2898 1 10 . 1 1 55 55 LEU HA H 55 4.088 4.088 3.954 0.134 18237
2899 1 10 . 1 1 55 55 LEU C C 55 177.975 177.975 178.684 -0.709 18237
2900 1 10 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.321 -1.851 18237
2901 1 10 . 1 1 55 55 LEU CB C 55 40.898 40.898 41.520 -0.622 18237
2902 1 10 . 1 1 55 55 LEU H H 55 7.931 7.931 7.960 -0.029 18237
2903 1 10 . 1 1 56 56 TRP N N 56 118.335 118.335 117.632 0.703 18237
2904 1 10 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.314 0.053 18237
2905 1 10 . 1 1 56 56 TRP C C 56 176.863 176.863 178.371 -1.508 18237
2906 1 10 . 1 1 56 56 TRP CA C 56 59.070 59.070 61.040 -1.970 18237
2907 1 10 . 1 1 56 56 TRP CB C 56 28.839 28.839 28.648 0.192 18237
2908 1 10 . 1 1 56 56 TRP H H 56 7.665 7.665 7.890 -0.225 18237
2909 1 10 . 1 1 57 57 TYR N N 57 116.808 116.808 119.401 -2.593 18237
2910 1 10 . 1 1 57 57 TYR HA H 57 4.172 4.172 4.359 -0.187 18237
2911 1 10 . 1 1 57 57 TYR C C 57 176.085 176.085 177.139 -1.054 18237
2912 1 10 . 1 1 57 57 TYR CA C 57 59.865 59.865 60.932 -1.067 18237
2913 1 10 . 1 1 57 57 TYR CB C 57 38.563 38.563 39.006 -0.443 18237
2914 1 10 . 1 1 57 57 TYR H H 57 7.578 7.578 7.449 0.129 18237
2915 1 10 . 1 1 58 58 ILE N N 58 115.526 115.526 112.997 2.529 18237
2916 1 10 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.326 -0.061 18237
2917 1 10 . 1 1 58 58 ILE C C 58 174.782 174.782 176.203 -1.421 18237
2918 1 10 . 1 1 58 58 ILE CA C 58 60.940 60.940 61.388 -0.448 18237
2919 1 10 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.431 -0.249 18237
2920 1 10 . 1 1 58 58 ILE H H 58 7.586 7.586 8.465 -0.879 18237
2921 1 11 . 1 1 2 2 TYR N N 2 120.470 120.470 118.551 1.919 18237
2922 1 11 . 1 1 2 2 TYR C C 2 176.535 176.535 174.734 1.801 18237
2923 1 11 . 1 1 2 2 TYR CA C 2 55.995 55.995 57.562 -1.567 18237
2924 1 11 . 1 1 2 2 TYR CB C 2 37.313 37.313 40.090 -2.777 18237
2925 1 11 . 1 1 2 2 TYR H H 2 7.951 7.951 8.069 -0.118 18237
2926 1 11 . 1 1 3 3 ILE N N 3 118.307 118.307 121.070 -2.763 18237
2927 1 11 . 1 1 3 3 ILE CA C 3 58.968 58.968 58.862 0.106 18237
2928 1 11 . 1 1 3 3 ILE CB C 3 38.074 38.074 37.788 0.286 18237
2929 1 11 . 1 1 3 3 ILE H H 3 8.381 8.381 7.877 0.504 18237
2930 1 11 . 1 1 5 5 GLU N N 5 118.785 118.785 116.209 2.576 18237
2931 1 11 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.037 0.218 18237
2932 1 11 . 1 1 5 5 GLU C C 5 176.267 176.267 174.860 1.407 18237
2933 1 11 . 1 1 5 5 GLU CA C 5 55.959 55.959 56.818 -0.859 18237
2934 1 11 . 1 1 5 5 GLU CB C 5 30.034 30.034 30.181 -0.147 18237
2935 1 11 . 1 1 5 5 GLU H H 5 7.710 7.710 8.553 -0.843 18237
2936 1 11 . 1 1 6 6 ALA N N 6 131.546 131.546 125.586 5.960 18237
2937 1 11 . 1 1 6 6 ALA HA H 6 3.575 3.575 3.586 -0.011 18237
2938 1 11 . 1 1 6 6 ALA CA C 6 50.959 50.959 50.781 0.178 18237
2939 1 11 . 1 1 6 6 ALA CB C 6 14.389 14.389 18.825 -4.436 18237
2940 1 11 . 1 1 6 6 ALA H H 6 8.338 8.338 8.396 -0.058 18237
2941 1 11 . 1 1 8 8 ARG N N 8 126.915 126.915 121.901 5.014 18237
2942 1 11 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.508 -0.438 18237
2943 1 11 . 1 1 8 8 ARG C C 8 175.110 175.110 175.272 -0.162 18237
2944 1 11 . 1 1 8 8 ARG CA C 8 54.699 54.699 56.053 -1.354 18237
2945 1 11 . 1 1 8 8 ARG CB C 8 28.078 28.078 31.582 -3.504 18237
2946 1 11 . 1 1 8 8 ARG H H 8 8.725 8.725 8.416 0.309 18237
2947 1 11 . 1 1 9 9 ASP N N 9 123.653 123.653 125.185 -1.532 18237
2948 1 11 . 1 1 9 9 ASP C C 9 178.015 178.015 177.016 0.999 18237
2949 1 11 . 1 1 9 9 ASP CA C 9 52.747 52.747 54.239 -1.492 18237
2950 1 11 . 1 1 9 9 ASP CB C 9 40.844 40.844 41.536 -0.692 18237
2951 1 11 . 1 1 9 9 ASP H H 9 8.432 8.432 8.695 -0.263 18237
2952 1 11 . 1 1 10 10 GLY N N 10 111.908 111.908 107.668 4.240 18237
2953 1 11 . 1 1 10 10 GLY C C 10 174.822 174.822 174.970 -0.148 18237
2954 1 11 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.183 0.061 18237
2955 1 11 . 1 1 10 10 GLY H H 10 9.727 9.727 8.591 1.136 18237
2956 1 11 . 1 1 11 11 GLN N N 11 118.395 118.395 120.666 -2.271 18237
2957 1 11 . 1 1 11 11 GLN C C 11 174.711 174.711 174.651 0.060 18237
2958 1 11 . 1 1 11 11 GLN CA C 11 53.398 53.398 54.349 -0.951 18237
2959 1 11 . 1 1 11 11 GLN CB C 11 30.306 30.306 30.040 0.266 18237
2960 1 11 . 1 1 11 11 GLN H H 11 8.416 8.416 7.907 0.509 18237
2961 1 11 . 1 1 12 12 ALA N N 12 121.020 121.020 121.727 -0.707 18237
2962 1 11 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.181 0.762 18237
2963 1 11 . 1 1 12 12 ALA C C 12 177.990 177.990 175.137 2.853 18237
2964 1 11 . 1 1 12 12 ALA CA C 12 50.511 50.511 50.798 -0.287 18237
2965 1 11 . 1 1 12 12 ALA CB C 12 20.147 20.147 20.679 -0.532 18237
2966 1 11 . 1 1 12 12 ALA H H 12 7.933 7.933 8.000 -0.067 18237
2967 1 11 . 1 1 13 13 TYR N N 13 121.755 121.755 119.186 2.569 18237
2968 1 11 . 1 1 13 13 TYR C C 13 175.519 175.519 174.628 0.891 18237
2969 1 11 . 1 1 13 13 TYR CA C 13 59.090 59.090 56.347 2.743 18237
2970 1 11 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.167 2.013 18237
2971 1 11 . 1 1 13 13 TYR H H 13 9.575 9.575 8.204 1.371 18237
2972 1 11 . 1 1 14 14 VAL N N 14 112.251 112.251 120.230 -7.979 18237
2973 1 11 . 1 1 14 14 VAL C C 14 174.074 174.074 174.646 -0.572 18237
2974 1 11 . 1 1 14 14 VAL CA C 14 59.090 59.090 59.340 -0.249 18237
2975 1 11 . 1 1 14 14 VAL CB C 14 32.750 32.750 35.013 -2.263 18237
2976 1 11 . 1 1 14 14 VAL H H 14 9.659 9.659 8.852 0.807 18237
2977 1 11 . 1 1 15 15 ARG N N 15 124.657 124.657 123.083 1.574 18237
2978 1 11 . 1 1 15 15 ARG C C 15 174.948 174.948 174.947 0.001 18237
2979 1 11 . 1 1 15 15 ARG CA C 15 53.520 53.520 55.926 -2.406 18237
2980 1 11 . 1 1 15 15 ARG CB C 15 32.533 32.533 30.247 2.286 18237
2981 1 11 . 1 1 15 15 ARG H H 15 8.503 8.503 8.588 -0.085 18237
2982 1 11 . 1 1 16 16 LYS N N 16 128.240 128.240 127.673 0.567 18237
2983 1 11 . 1 1 16 16 LYS C C 16 175.974 175.974 175.440 0.534 18237
2984 1 11 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.650 0.126 18237
2985 1 11 . 1 1 16 16 LYS CB C 16 36.553 36.553 34.943 1.610 18237
2986 1 11 . 1 1 16 16 LYS H H 16 9.052 9.052 8.734 0.318 18237
2987 1 11 . 1 1 17 17 ASP N N 17 130.562 130.562 127.543 3.019 18237
2988 1 11 . 1 1 17 17 ASP C C 17 175.822 175.822 176.439 -0.617 18237
2989 1 11 . 1 1 17 17 ASP CA C 17 56.447 56.447 54.774 1.673 18237
2990 1 11 . 1 1 17 17 ASP CB C 17 40.192 40.192 39.969 0.223 18237
2991 1 11 . 1 1 17 17 ASP H H 17 10.886 10.886 9.026 1.860 18237
2992 1 11 . 1 1 18 18 GLY N N 18 104.754 104.754 105.128 -0.374 18237
2993 1 11 . 1 1 18 18 GLY C C 18 173.104 173.104 173.229 -0.125 18237
2994 1 11 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.383 -0.139 18237
2995 1 11 . 1 1 18 18 GLY H H 18 9.353 9.353 8.252 1.101 18237
2996 1 11 . 1 1 19 19 GLU N N 19 117.501 117.501 117.824 -0.323 18237
2997 1 11 . 1 1 19 19 GLU HA H 19 4.648 4.648 4.294 0.354 18237
2998 1 11 . 1 1 19 19 GLU C C 19 176.166 176.166 174.259 1.907 18237
2999 1 11 . 1 1 19 19 GLU CA C 19 53.865 53.865 54.407 -0.542 18237
3000 1 11 . 1 1 19 19 GLU CB C 19 33.130 33.130 33.262 -0.132 18237
3001 1 11 . 1 1 19 19 GLU H H 19 7.813 7.813 7.747 0.066 18237
3002 1 11 . 1 1 20 20 TRP N N 20 122.768 122.768 123.633 -0.865 18237
3003 1 11 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.534 -0.867 18237
3004 1 11 . 1 1 20 20 TRP C C 20 176.302 176.302 176.506 -0.204 18237
3005 1 11 . 1 1 20 20 TRP CA C 20 55.878 55.878 56.186 -0.308 18237
3006 1 11 . 1 1 20 20 TRP CB C 20 29.545 29.545 30.139 -0.594 18237
3007 1 11 . 1 1 20 20 TRP H H 20 9.094 9.094 8.412 0.682 18237
3008 1 11 . 1 1 21 21 VAL N N 21 123.071 123.071 124.982 -1.911 18237
3009 1 11 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.503 0.482 18237
3010 1 11 . 1 1 21 21 VAL C C 21 175.640 175.640 175.594 0.046 18237
3011 1 11 . 1 1 21 21 VAL CA C 21 59.537 59.537 60.954 -1.417 18237
3012 1 11 . 1 1 21 21 VAL CB C 21 34.651 34.651 35.045 -0.394 18237
3013 1 11 . 1 1 21 21 VAL H H 21 9.868 9.868 8.424 1.444 18237
3014 1 11 . 1 1 22 22 LEU N N 22 127.193 127.193 128.916 -1.723 18237
3015 1 11 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.502 -0.080 18237
3016 1 11 . 1 1 22 22 LEU C C 22 179.268 179.268 179.057 0.211 18237
3017 1 11 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.634 0.000 18237
3018 1 11 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.157 0.122 18237
3019 1 11 . 1 1 22 22 LEU H H 22 8.812 8.812 9.088 -0.276 18237
3020 1 11 . 1 1 23 23 LEU N N 23 126.386 126.386 125.784 0.602 18237
3021 1 11 . 1 1 23 23 LEU C C 23 178.844 178.844 178.817 0.027 18237
3022 1 11 . 1 1 23 23 LEU CA C 23 57.403 57.403 58.490 -1.087 18237
3023 1 11 . 1 1 23 23 LEU CB C 23 41.061 41.061 41.309 -0.248 18237
3024 1 11 . 1 1 23 23 LEU H H 23 8.562 8.562 8.324 0.238 18237
3025 1 11 . 1 1 24 24 SER N N 24 113.100 113.100 115.026 -1.926 18237
3026 1 11 . 1 1 24 24 SER HA H 24 4.621 4.621 4.109 0.512 18237
3027 1 11 . 1 1 24 24 SER C C 24 176.676 176.676 176.034 0.642 18237
3028 1 11 . 1 1 24 24 SER CA C 24 60.960 60.960 61.444 -0.484 18237
3029 1 11 . 1 1 24 24 SER CB C 24 61.650 61.650 62.444 -0.794 18237
3030 1 11 . 1 1 24 24 SER H H 24 9.098 9.098 8.604 0.494 18237
3031 1 11 . 1 1 25 25 THR N N 25 116.715 116.715 115.537 1.178 18237
3032 1 11 . 1 1 25 25 THR HA H 25 3.915 3.915 4.136 -0.221 18237
3033 1 11 . 1 1 25 25 THR CA C 25 64.599 64.599 64.880 -0.281 18237
3034 1 11 . 1 1 25 25 THR CB C 25 68.657 68.657 68.359 0.298 18237
3035 1 11 . 1 1 25 25 THR H H 25 7.238 7.238 8.122 -0.884 18237
3036 1 11 . 1 1 26 26 PHE N N 26 118.488 118.488 119.944 -1.456 18237
3037 1 11 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.496 -0.386 18237
3038 1 11 . 1 1 26 26 PHE C C 26 176.181 176.181 176.915 -0.734 18237
3039 1 11 . 1 1 26 26 PHE CA C 26 58.627 58.627 60.191 -1.564 18237
3040 1 11 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.630 0.163 18237
3041 1 11 . 1 1 26 26 PHE H H 26 7.945 7.945 8.557 -0.612 18237
3042 1 11 . 1 1 27 27 LEU N N 27 118.525 118.525 119.868 -1.343 18237
3043 1 11 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.316 0.207 18237
3044 1 11 . 1 1 27 27 LEU C C 27 177.752 177.752 177.805 -0.053 18237
3045 1 11 . 1 1 27 27 LEU CA C 27 54.679 54.679 55.713 -1.034 18237
3046 1 11 . 1 1 27 27 LEU CB C 27 41.333 41.333 42.464 -1.131 18237
3047 1 11 . 1 1 27 27 LEU H H 27 7.290 7.290 7.688 -0.398 18237
3048 1 11 . 1 1 28 28 GLY N N 28 108.823 108.823 106.669 2.154 18237
3049 1 11 . 1 1 28 28 GLY C C 28 174.630 174.630 174.061 0.569 18237
3050 1 11 . 1 1 28 28 GLY CA C 28 45.374 45.374 44.854 0.520 18237
3051 1 11 . 1 1 28 28 GLY H H 28 8.242 8.242 7.711 0.531 18237
3052 1 11 . 1 1 29 29 SER N N 29 116.210 116.210 115.353 0.857 18237
3053 1 11 . 1 1 29 29 SER HA H 29 4.626 4.626 4.600 0.026 18237
3054 1 11 . 1 1 29 29 SER C C 29 175.312 175.312 174.679 0.633 18237
3055 1 11 . 1 1 29 29 SER CA C 29 57.992 57.992 58.126 -0.133 18237
3056 1 11 . 1 1 29 29 SER CB C 29 63.605 63.605 64.090 -0.485 18237
3057 1 11 . 1 1 29 29 SER H H 29 8.310 8.310 7.576 0.734 18237
3058 1 11 . 1 1 30 30 SER N N 30 118.892 118.892 114.879 4.013 18237
3059 1 11 . 1 1 30 30 SER HA H 30 4.597 4.597 4.277 0.320 18237
3060 1 11 . 1 1 30 30 SER C C 30 175.479 175.479 173.961 1.518 18237
3061 1 11 . 1 1 30 30 SER CA C 30 58.582 58.582 59.700 -1.118 18237
3062 1 11 . 1 1 30 30 SER CB C 30 63.605 63.605 61.365 2.240 18237
3063 1 11 . 1 1 30 30 SER H H 30 8.593 8.593 8.777 -0.184 18237
3064 1 11 . 1 1 31 31 GLY N N 31 111.354 111.354 107.665 3.689 18237
3065 1 11 . 1 1 31 31 GLY C C 31 174.428 174.428 173.463 0.965 18237
3066 1 11 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.721 -0.265 18237
3067 1 11 . 1 1 31 31 GLY H H 31 8.584 8.584 8.171 0.413 18237
3068 1 11 . 1 1 32 32 ASN N N 32 119.486 119.486 117.607 1.879 18237
3069 1 11 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.767 0.050 18237
3070 1 11 . 1 1 32 32 ASN C C 32 175.928 175.928 176.009 -0.081 18237
3071 1 11 . 1 1 32 32 ASN CA C 32 53.215 53.215 53.262 -0.047 18237
3072 1 11 . 1 1 32 32 ASN CB C 32 38.780 38.780 39.229 -0.449 18237
3073 1 11 . 1 1 32 32 ASN H H 32 8.393 8.393 8.192 0.201 18237
3074 1 11 . 1 1 33 33 GLU N N 33 122.031 122.031 120.646 1.385 18237
3075 1 11 . 1 1 33 33 GLU HA H 33 4.271 4.271 3.988 0.283 18237
3076 1 11 . 1 1 33 33 GLU CA C 33 57.426 57.426 59.134 -1.708 18237
3077 1 11 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.215 0.113 18237
3078 1 11 . 1 1 33 33 GLU H H 33 8.711 8.711 8.613 0.098 18237
3079 1 11 . 1 1 34 34 GLN N N 34 120.866 120.866 117.819 3.047 18237
3080 1 11 . 1 1 34 34 GLN HA H 34 4.271 4.271 4.042 0.229 18237
3081 1 11 . 1 1 34 34 GLN CA C 34 56.226 56.226 59.073 -2.847 18237
3082 1 11 . 1 1 34 34 GLN CB C 34 28.839 28.839 27.932 0.907 18237
3083 1 11 . 1 1 34 34 GLN H H 34 8.438 8.438 8.304 0.134 18237
3084 1 11 . 1 1 35 35 GLU N N 35 122.323 122.323 119.482 2.841 18237
3085 1 11 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.119 0.200 18237
3086 1 11 . 1 1 35 35 GLU C C 35 177.176 177.176 179.121 -1.945 18237
3087 1 11 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.818 -1.822 18237
3088 1 11 . 1 1 35 35 GLU CB C 35 29.545 29.545 29.343 0.202 18237
3089 1 11 . 1 1 35 35 GLU H H 35 8.424 8.424 7.796 0.628 18237
3090 1 11 . 1 1 36 36 LEU N N 36 122.904 122.904 117.520 5.384 18237
3091 1 11 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.090 0.229 18237
3092 1 11 . 1 1 36 36 LEU CA C 36 55.898 55.898 56.809 -0.911 18237
3093 1 11 . 1 1 36 36 LEU CB C 36 41.496 41.496 41.878 -0.382 18237
3094 1 11 . 1 1 36 36 LEU H H 36 8.342 8.342 7.333 1.009 18237
3095 1 11 . 1 1 38 38 GLU N N 38 121.931 121.931 120.992 0.939 18237
3096 1 11 . 1 1 38 38 GLU HA H 38 4.396 4.396 4.079 0.317 18237
3097 1 11 . 1 1 38 38 GLU C C 38 177.318 177.318 178.210 -0.892 18237
3098 1 11 . 1 1 38 38 GLU CA C 38 56.366 56.366 59.642 -3.276 18237
3099 1 11 . 1 1 38 38 GLU CB C 38 29.328 29.328 30.003 -0.675 18237
3100 1 11 . 1 1 38 38 GLU H H 38 8.342 8.342 8.158 0.184 18237
3101 1 11 . 1 1 39 39 LEU N N 39 123.317 123.317 119.552 3.765 18237
3102 1 11 . 1 1 39 39 LEU HA H 39 4.348 4.348 2.445 1.903 18237
3103 1 11 . 1 1 39 39 LEU CA C 39 56.833 56.833 58.080 -1.247 18237
3104 1 11 . 1 1 39 39 LEU CB C 39 41.387 41.387 41.455 -0.067 18237
3105 1 11 . 1 1 39 39 LEU H H 39 8.342 8.342 6.929 1.413 18237
3106 1 11 . 1 1 40 40 ASP N N 40 119.726 119.726 116.132 3.594 18237
3107 1 11 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.234 0.337 18237
3108 1 11 . 1 1 40 40 ASP CA C 40 55.589 55.589 57.371 -1.782 18237
3109 1 11 . 1 1 40 40 ASP H H 40 8.530 8.530 8.453 0.077 18237
3110 1 11 . 1 1 41 41 LYS N N 41 121.200 121.200 119.425 1.775 18237
3111 1 11 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.315 -0.151 18237
3112 1 11 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.356 -0.136 18237
3113 1 11 . 1 1 41 41 LYS H H 41 8.145 8.145 7.717 0.428 18237
3114 1 11 . 1 1 42 42 TRP N N 42 120.615 120.615 120.599 0.016 18237
3115 1 11 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.484 0.113 18237
3116 1 11 . 1 1 42 42 TRP C C 42 177.641 177.641 178.443 -0.802 18237
3117 1 11 . 1 1 42 42 TRP CA C 42 58.561 58.561 58.600 -0.039 18237
3118 1 11 . 1 1 42 42 TRP CB C 42 28.839 28.839 28.173 0.666 18237
3119 1 11 . 1 1 42 42 TRP H H 42 8.025 8.025 8.431 -0.406 18237
3120 1 11 . 1 1 43 43 ALA N N 43 122.056 122.056 120.973 1.083 18237
3121 1 11 . 1 1 43 43 ALA HA H 43 4.140 4.140 4.087 0.053 18237
3122 1 11 . 1 1 43 43 ALA C C 43 172.776 172.776 179.831 -7.055 18237
3123 1 11 . 1 1 43 43 ALA CA C 43 54.864 54.864 55.345 -0.481 18237
3124 1 11 . 1 1 43 43 ALA CB C 43 17.974 17.974 17.816 0.158 18237
3125 1 11 . 1 1 43 43 ALA H H 43 8.199 8.199 8.001 0.198 18237
3126 1 11 . 1 1 44 44 SER N N 44 113.378 113.378 115.657 -2.279 18237
3127 1 11 . 1 1 44 44 SER HA H 44 4.376 4.376 4.231 0.145 18237
3128 1 11 . 1 1 44 44 SER C C 44 176.767 176.767 176.818 -0.051 18237
3129 1 11 . 1 1 44 44 SER CA C 44 60.980 60.980 62.132 -1.152 18237
3130 1 11 . 1 1 44 44 SER CB C 44 62.410 62.410 62.865 -0.455 18237
3131 1 11 . 1 1 44 44 SER H H 44 8.210 8.210 8.181 0.029 18237
3132 1 11 . 1 1 45 45 LEU N N 45 123.425 123.425 122.895 0.530 18237
3133 1 11 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.256 -0.062 18237
3134 1 11 . 1 1 45 45 LEU CA C 45 57.606 57.606 57.965 -0.359 18237
3135 1 11 . 1 1 45 45 LEU CB C 45 41.170 41.170 41.729 -0.559 18237
3136 1 11 . 1 1 45 45 LEU H H 45 7.906 7.906 7.609 0.297 18237
3137 1 11 . 1 1 46 46 TRP N N 46 118.572 118.572 118.306 0.266 18237
3138 1 11 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.450 0.205 18237
3139 1 11 . 1 1 46 46 TRP C C 46 177.838 177.838 178.685 -0.847 18237
3140 1 11 . 1 1 46 46 TRP CA C 46 58.907 58.907 61.005 -2.098 18237
3141 1 11 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.452 -0.233 18237
3142 1 11 . 1 1 46 46 TRP H H 46 8.043 8.043 8.400 -0.357 18237
3143 1 11 . 1 1 47 47 ASN N N 47 116.564 116.564 117.991 -1.427 18237
3144 1 11 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.746 -0.120 18237
3145 1 11 . 1 1 47 47 ASN C C 47 176.904 176.904 177.775 -0.871 18237
3146 1 11 . 1 1 47 47 ASN CA C 47 55.045 55.045 56.042 -0.997 18237
3147 1 11 . 1 1 47 47 ASN CB C 47 38.563 38.563 38.884 -0.321 18237
3148 1 11 . 1 1 47 47 ASN H H 47 8.174 8.174 8.706 -0.532 18237
3149 1 11 . 1 1 48 48 TRP N N 48 121.421 121.421 120.464 0.957 18237
3150 1 11 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.726 -0.359 18237
3151 1 11 . 1 1 48 48 TRP CA C 48 59.517 59.517 58.078 1.439 18237
3152 1 11 . 1 1 48 48 TRP CB C 48 28.893 28.893 29.248 -0.355 18237
3153 1 11 . 1 1 48 48 TRP H H 48 8.145 8.145 8.241 -0.096 18237
3154 1 11 . 1 1 49 49 PHE N N 49 118.299 118.299 122.636 -4.337 18237
3155 1 11 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.773 0.479 18237
3156 1 11 . 1 1 49 49 PHE C C 49 175.565 175.565 174.541 1.024 18237
3157 1 11 . 1 1 49 49 PHE CA C 49 58.887 58.887 57.315 1.572 18237
3158 1 11 . 1 1 49 49 PHE CB C 49 38.671 38.671 38.752 -0.081 18237
3159 1 11 . 1 1 49 49 PHE H H 49 8.036 8.036 7.866 0.170 18237
3160 1 11 . 1 1 50 50 ASN N N 50 118.836 118.836 119.307 -0.471 18237
3161 1 11 . 1 1 50 50 ASN HA H 50 4.626 4.626 4.114 0.512 18237
3162 1 11 . 1 1 50 50 ASN C C 50 176.439 176.439 176.838 -0.399 18237
3163 1 11 . 1 1 50 50 ASN CA C 50 53.215 53.215 55.003 -1.788 18237
3164 1 11 . 1 1 50 50 ASN CB C 50 38.128 38.128 37.357 0.771 18237
3165 1 11 . 1 1 50 50 ASN H H 50 7.795 7.795 7.734 0.061 18237
3166 1 11 . 1 1 51 51 ILE N N 51 120.218 120.218 115.603 4.615 18237
3167 1 11 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.821 -0.030 18237
3168 1 11 . 1 1 51 51 ILE C C 51 177.202 177.202 177.010 0.192 18237
3169 1 11 . 1 1 51 51 ILE CA C 51 63.102 63.102 64.632 -1.530 18237
3170 1 11 . 1 1 51 51 ILE CB C 51 37.367 37.367 36.955 0.412 18237
3171 1 11 . 1 1 51 51 ILE H H 51 8.147 8.147 7.003 1.144 18237
3172 1 11 . 1 1 52 52 THR N N 52 115.352 115.352 112.499 2.853 18237
3173 1 11 . 1 1 52 52 THR HA H 52 4.031 4.031 3.667 0.364 18237
3174 1 11 . 1 1 52 52 THR C C 52 176.095 176.095 176.403 -0.308 18237
3175 1 11 . 1 1 52 52 THR CA C 52 65.148 65.148 64.998 0.150 18237
3176 1 11 . 1 1 52 52 THR CB C 52 68.277 68.277 67.893 0.384 18237
3177 1 11 . 1 1 52 52 THR H H 52 8.009 8.009 7.122 0.887 18237
3178 1 11 . 1 1 53 53 ASN N N 53 119.874 119.874 121.495 -1.621 18237
3179 1 11 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.377 0.259 18237
3180 1 11 . 1 1 53 53 ASN C C 53 176.530 176.530 177.043 -0.513 18237
3181 1 11 . 1 1 53 53 ASN CA C 53 54.457 54.457 55.711 -1.254 18237
3182 1 11 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.762 0.040 18237
3183 1 11 . 1 1 53 53 ASN H H 53 7.972 7.972 7.081 0.891 18237
3184 1 11 . 1 1 54 54 TRP N N 54 120.192 120.192 119.786 0.406 18237
3185 1 11 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.522 0.133 18237
3186 1 11 . 1 1 54 54 TRP CA C 54 58.643 58.643 58.615 0.028 18237
3187 1 11 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.268 -0.103 18237
3188 1 11 . 1 1 54 54 TRP H H 54 7.897 7.897 7.382 0.515 18237
3189 1 11 . 1 1 55 55 LEU N N 55 118.354 118.354 122.001 -3.647 18237
3190 1 11 . 1 1 55 55 LEU HA H 55 4.088 4.088 3.679 0.409 18237
3191 1 11 . 1 1 55 55 LEU C C 55 177.975 177.975 178.253 -0.278 18237
3192 1 11 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.455 -1.985 18237
3193 1 11 . 1 1 55 55 LEU CB C 55 40.898 40.898 41.455 -0.556 18237
3194 1 11 . 1 1 55 55 LEU H H 55 7.931 7.931 7.776 0.155 18237
3195 1 11 . 1 1 56 56 TRP N N 56 118.335 118.335 116.449 1.886 18237
3196 1 11 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.307 0.060 18237
3197 1 11 . 1 1 56 56 TRP C C 56 176.863 176.863 178.372 -1.509 18237
3198 1 11 . 1 1 56 56 TRP CA C 56 59.070 59.070 59.571 -0.501 18237
3199 1 11 . 1 1 56 56 TRP CB C 56 28.839 28.839 29.128 -0.288 18237
3200 1 11 . 1 1 56 56 TRP H H 56 7.665 7.665 7.249 0.416 18237
3201 1 11 . 1 1 57 57 TYR N N 57 116.808 116.808 118.360 -1.552 18237
3202 1 11 . 1 1 57 57 TYR HA H 57 4.172 4.172 4.397 -0.225 18237
3203 1 11 . 1 1 57 57 TYR C C 57 176.085 176.085 176.801 -0.716 18237
3204 1 11 . 1 1 57 57 TYR CA C 57 59.865 59.865 60.455 -0.590 18237
3205 1 11 . 1 1 57 57 TYR CB C 57 38.563 38.563 39.035 -0.472 18237
3206 1 11 . 1 1 57 57 TYR H H 57 7.578 7.578 7.419 0.159 18237
3207 1 11 . 1 1 58 58 ILE N N 58 115.526 115.526 117.449 -1.923 18237
3208 1 11 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.158 0.107 18237
3209 1 11 . 1 1 58 58 ILE C C 58 174.782 174.782 175.457 -0.675 18237
3210 1 11 . 1 1 58 58 ILE CA C 58 60.940 60.940 61.624 -0.684 18237
3211 1 11 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.760 -0.578 18237
3212 1 11 . 1 1 58 58 ILE H H 58 7.586 7.586 8.267 -0.681 18237
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 54 2.494 -0.498 2.466 18237
2 1 1 "Average Difference" HA 44 0.346 -0.130 0.325 18237
3 1 1 "Average Difference" C 42 1.463 0.119 1.476 18237
4 1 1 "Average Difference" CA 54 1.413 0.829 1.156 18237
5 1 1 "Average Difference" CB 48 1.283 0.370 1.241 18237
6 1 1 "Average Difference" HN 54 0.653 -0.273 0.599 18237
7 1 2 "Average Difference" N 54 2.740 -0.476 2.724 18237
8 1 2 "Average Difference" HA 44 0.454 -0.153 0.433 18237
9 1 2 "Average Difference" C 42 1.417 0.244 1.412 18237
10 1 2 "Average Difference" CA 54 1.285 0.699 1.089 18237
11 1 2 "Average Difference" CB 48 1.196 0.240 1.184 18237
12 1 2 "Average Difference" HN 54 0.657 -0.279 0.601 18237
13 1 3 "Average Difference" N 54 3.000 -0.727 2.938 18237
14 1 3 "Average Difference" HA 44 0.457 -0.166 0.430 18237
15 1 3 "Average Difference" C 42 1.322 0.267 1.311 18237
16 1 3 "Average Difference" CA 54 1.321 0.751 1.097 18237
17 1 3 "Average Difference" CB 48 1.201 0.191 1.198 18237
18 1 3 "Average Difference" HN 54 0.689 -0.283 0.634 18237
19 1 4 "Average Difference" N 54 3.451 -0.930 3.355 18237
20 1 4 "Average Difference" HA 44 0.424 -0.169 0.393 18237
21 1 4 "Average Difference" C 42 1.344 0.132 1.354 18237
22 1 4 "Average Difference" CA 54 1.254 0.771 0.998 18237
23 1 4 "Average Difference" CB 48 0.978 0.168 0.973 18237
24 1 4 "Average Difference" HN 54 0.678 -0.349 0.587 18237
25 1 5 "Average Difference" N 54 3.139 -0.617 3.106 18237
26 1 5 "Average Difference" HA 44 0.500 -0.210 0.459 18237
27 1 5 "Average Difference" C 42 1.368 0.148 1.377 18237
28 1 5 "Average Difference" CA 54 1.317 0.620 1.173 18237
29 1 5 "Average Difference" CB 48 1.264 0.159 1.267 18237
30 1 5 "Average Difference" HN 54 0.698 -0.320 0.626 18237
31 1 6 "Average Difference" N 54 2.811 -0.607 2.770 18237
32 1 6 "Average Difference" HA 44 0.349 -0.089 0.341 18237
33 1 6 "Average Difference" C 42 1.382 0.090 1.396 18237
34 1 6 "Average Difference" CA 54 1.355 0.808 1.098 18237
35 1 6 "Average Difference" CB 48 1.179 0.231 1.169 18237
36 1 6 "Average Difference" HN 54 0.695 -0.286 0.639 18237
37 1 7 "Average Difference" N 54 2.781 -0.388 2.779 18237
38 1 7 "Average Difference" HA 44 0.351 -0.158 0.318 18237
39 1 7 "Average Difference" C 42 1.394 0.139 1.404 18237
40 1 7 "Average Difference" CA 54 1.371 0.748 1.160 18237
41 1 7 "Average Difference" CB 48 1.270 0.269 1.254 18237
42 1 7 "Average Difference" HN 54 0.692 -0.339 0.609 18237
43 1 8 "Average Difference" N 54 2.753 -0.515 2.730 18237
44 1 8 "Average Difference" HA 44 0.328 -0.135 0.302 18237
45 1 8 "Average Difference" C 42 1.456 0.126 1.468 18237
46 1 8 "Average Difference" CA 54 1.484 0.858 1.222 18237
47 1 8 "Average Difference" CB 48 1.197 0.329 1.163 18237
48 1 8 "Average Difference" HN 54 0.649 -0.276 0.593 18237
49 1 9 "Average Difference" N 54 2.729 -0.380 2.728 18237
50 1 9 "Average Difference" HA 44 0.469 -0.129 0.456 18237
51 1 9 "Average Difference" C 42 1.438 0.165 1.446 18237
52 1 9 "Average Difference" CA 54 1.216 0.711 0.996 18237
53 1 9 "Average Difference" CB 48 1.264 0.248 1.252 18237
54 1 9 "Average Difference" HN 54 0.686 -0.333 0.605 18237
55 1 10 "Average Difference" N 54 2.994 -0.714 2.935 18237
56 1 10 "Average Difference" HA 44 0.380 -0.165 0.347 18237
57 1 10 "Average Difference" C 42 1.425 0.169 1.432 18237
58 1 10 "Average Difference" CA 54 1.337 0.708 1.145 18237
59 1 10 "Average Difference" CB 48 1.029 0.164 1.027 18237
60 1 10 "Average Difference" HN 54 0.712 -0.300 0.651 18237
61 1 11 "Average Difference" N 54 2.741 -0.643 2.689 18237
62 1 11 "Average Difference" HA 44 0.432 -0.166 0.403 18237
63 1 11 "Average Difference" C 42 1.433 0.078 1.448 18237
64 1 11 "Average Difference" CA 54 1.276 0.670 1.096 18237
65 1 11 "Average Difference" CB 48 1.211 0.220 1.203 18237
66 1 11 "Average Difference" HN 54 0.661 -0.292 0.598 18237
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 18237
_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 2 2 TYR N N 2 120.470 120.470 120.006 0.464 18237
2 1 . 1 1 2 2 TYR C C 2 176.535 176.535 175.524 1.011 18237
3 1 . 1 1 2 2 TYR CA C 2 55.995 55.995 57.461 -1.466 18237
4 1 . 1 1 2 2 TYR CB C 2 37.313 37.313 39.506 -2.193 18237
5 1 . 1 1 2 2 TYR H H 2 7.951 7.951 7.980 -0.029 18237
6 1 . 1 1 3 3 ILE N N 3 118.307 118.307 120.511 -2.204 18237
7 1 . 1 1 3 3 ILE CA C 3 58.968 58.968 60.288 -1.320 18237
8 1 . 1 1 3 3 ILE CB C 3 38.074 38.074 37.556 0.518 18237
9 1 . 1 1 3 3 ILE H H 3 8.381 8.381 8.210 0.171 18237
10 1 . 1 1 5 5 GLU N N 5 118.785 118.785 120.586 -1.801 18237
11 1 . 1 1 5 5 GLU HA H 5 4.255 4.255 4.277 -0.022 18237
12 1 . 1 1 5 5 GLU C C 5 176.267 176.267 174.693 1.574 18237
13 1 . 1 1 5 5 GLU CA C 5 55.959 55.959 56.738 -0.779 18237
14 1 . 1 1 5 5 GLU CB C 5 30.034 30.034 30.483 -0.449 18237
15 1 . 1 1 5 5 GLU H H 5 7.710 7.710 8.406 -0.696 18237
16 1 . 1 1 6 6 ALA N N 6 131.546 131.546 124.062 7.484 18237
17 1 . 1 1 6 6 ALA HA H 6 3.575 3.575 3.765 -0.190 18237
18 1 . 1 1 6 6 ALA CA C 6 50.959 50.959 50.699 0.260 18237
19 1 . 1 1 6 6 ALA CB C 6 14.389 14.389 18.863 -4.474 18237
20 1 . 1 1 6 6 ALA H H 6 8.338 8.338 8.075 0.263 18237
21 1 . 1 1 8 8 ARG N N 8 126.915 126.915 121.610 5.305 18237
22 1 . 1 1 8 8 ARG HA H 8 4.070 4.070 4.504 -0.434 18237
23 1 . 1 1 8 8 ARG C C 8 175.110 175.110 175.194 -0.084 18237
24 1 . 1 1 8 8 ARG CA C 8 54.699 54.699 55.823 -1.124 18237
25 1 . 1 1 8 8 ARG CB C 8 28.078 28.078 30.982 -2.904 18237
26 1 . 1 1 8 8 ARG H H 8 8.725 8.725 8.342 0.383 18237
27 1 . 1 1 9 9 ASP N N 9 123.653 123.653 124.070 -0.417 18237
28 1 . 1 1 9 9 ASP C C 9 178.015 178.015 177.046 0.969 18237
29 1 . 1 1 9 9 ASP CA C 9 52.747 52.747 54.220 -1.473 18237
30 1 . 1 1 9 9 ASP CB C 9 40.844 40.844 41.275 -0.431 18237
31 1 . 1 1 9 9 ASP H H 9 8.432 8.432 8.602 -0.169 18237
32 1 . 1 1 10 10 GLY N N 10 111.908 111.908 107.985 3.923 18237
33 1 . 1 1 10 10 GLY C C 10 174.822 174.822 174.733 0.089 18237
34 1 . 1 1 10 10 GLY CA C 10 45.244 45.244 45.168 0.076 18237
35 1 . 1 1 10 10 GLY H H 10 9.727 9.727 8.553 1.174 18237
36 1 . 1 1 11 11 GLN N N 11 118.395 118.395 119.717 -1.322 18237
37 1 . 1 1 11 11 GLN C C 11 174.711 174.711 174.496 0.215 18237
38 1 . 1 1 11 11 GLN CA C 11 53.398 53.398 54.781 -1.383 18237
39 1 . 1 1 11 11 GLN CB C 11 30.306 30.306 29.991 0.315 18237
40 1 . 1 1 11 11 GLN H H 11 8.416 8.416 7.919 0.497 18237
41 1 . 1 1 12 12 ALA N N 12 121.020 121.020 122.636 -1.616 18237
42 1 . 1 1 12 12 ALA HA H 12 4.943 4.943 4.410 0.533 18237
43 1 . 1 1 12 12 ALA C C 12 177.990 177.990 175.249 2.741 18237
44 1 . 1 1 12 12 ALA CA C 12 50.511 50.511 51.027 -0.516 18237
45 1 . 1 1 12 12 ALA CB C 12 20.147 20.147 20.809 -0.662 18237
46 1 . 1 1 12 12 ALA H H 12 7.933 7.933 8.120 -0.187 18237
47 1 . 1 1 13 13 TYR N N 13 121.755 121.755 119.549 2.206 18237
48 1 . 1 1 13 13 TYR C C 13 175.519 175.519 174.757 0.762 18237
49 1 . 1 1 13 13 TYR CA C 13 59.090 59.090 56.670 2.420 18237
50 1 . 1 1 13 13 TYR CB C 13 43.180 43.180 41.424 1.756 18237
51 1 . 1 1 13 13 TYR H H 13 9.575 9.575 8.355 1.220 18237
52 1 . 1 1 14 14 VAL N N 14 112.251 112.251 120.738 -8.487 18237
53 1 . 1 1 14 14 VAL C C 14 174.074 174.074 174.899 -0.825 18237
54 1 . 1 1 14 14 VAL CA C 14 59.090 59.090 59.213 -0.123 18237
55 1 . 1 1 14 14 VAL CB C 14 32.750 32.750 35.178 -2.429 18237
56 1 . 1 1 14 14 VAL H H 14 9.659 9.659 8.829 0.830 18237
57 1 . 1 1 15 15 ARG N N 15 124.657 124.657 122.953 1.704 18237
58 1 . 1 1 15 15 ARG C C 15 174.948 174.948 175.321 -0.373 18237
59 1 . 1 1 15 15 ARG CA C 15 53.520 53.520 55.864 -2.344 18237
60 1 . 1 1 15 15 ARG CB C 15 32.533 32.533 30.096 2.437 18237
61 1 . 1 1 15 15 ARG H H 15 8.503 8.503 8.539 -0.036 18237
62 1 . 1 1 16 16 LYS N N 16 128.240 128.240 126.265 1.975 18237
63 1 . 1 1 16 16 LYS C C 16 175.974 175.974 175.392 0.582 18237
64 1 . 1 1 16 16 LYS CA C 16 55.776 55.776 55.724 0.052 18237
65 1 . 1 1 16 16 LYS CB C 16 36.553 36.553 35.345 1.208 18237
66 1 . 1 1 16 16 LYS H H 16 9.052 9.052 8.582 0.470 18237
67 1 . 1 1 17 17 ASP N N 17 130.562 130.562 126.517 4.045 18237
68 1 . 1 1 17 17 ASP C C 17 175.822 175.822 176.350 -0.528 18237
69 1 . 1 1 17 17 ASP CA C 17 56.447 56.447 54.785 1.662 18237
70 1 . 1 1 17 17 ASP CB C 17 40.192 40.192 39.793 0.399 18237
71 1 . 1 1 17 17 ASP H H 17 10.886 10.886 9.045 1.841 18237
72 1 . 1 1 18 18 GLY N N 18 104.754 104.754 105.205 -0.451 18237
73 1 . 1 1 18 18 GLY C C 18 173.104 173.104 173.403 -0.299 18237
74 1 . 1 1 18 18 GLY CA C 18 45.244 45.244 45.396 -0.152 18237
75 1 . 1 1 18 18 GLY H H 18 9.353 9.353 8.294 1.059 18237
76 1 . 1 1 19 19 GLU N N 19 117.501 117.501 117.908 -0.407 18237
77 1 . 1 1 19 19 GLU HA H 19 4.648 4.648 4.184 0.464 18237
78 1 . 1 1 19 19 GLU C C 19 176.166 176.166 174.581 1.585 18237
79 1 . 1 1 19 19 GLU CA C 19 53.865 53.865 53.988 -0.123 18237
80 1 . 1 1 19 19 GLU CB C 19 33.130 33.130 33.094 0.036 18237
81 1 . 1 1 19 19 GLU H H 19 7.813 7.813 8.035 -0.222 18237
82 1 . 1 1 20 20 TRP N N 20 122.768 122.768 122.584 0.184 18237
83 1 . 1 1 20 20 TRP HA H 20 4.667 4.667 5.520 -0.853 18237
84 1 . 1 1 20 20 TRP C C 20 176.302 176.302 176.295 0.007 18237
85 1 . 1 1 20 20 TRP CA C 20 55.878 55.878 55.590 0.288 18237
86 1 . 1 1 20 20 TRP CB C 20 29.545 29.545 29.522 0.023 18237
87 1 . 1 1 20 20 TRP H H 20 9.094 9.094 7.641 1.453 18237
88 1 . 1 1 21 21 VAL N N 21 123.071 123.071 124.694 -1.623 18237
89 1 . 1 1 21 21 VAL HA H 21 4.985 4.985 4.490 0.495 18237
90 1 . 1 1 21 21 VAL C C 21 175.640 175.640 175.746 -0.106 18237
91 1 . 1 1 21 21 VAL CA C 21 59.537 59.537 60.762 -1.225 18237
92 1 . 1 1 21 21 VAL CB C 21 34.651 34.651 34.829 -0.178 18237
93 1 . 1 1 21 21 VAL H H 21 9.868 9.868 8.402 1.466 18237
94 1 . 1 1 22 22 LEU N N 22 127.193 127.193 129.108 -1.915 18237
95 1 . 1 1 22 22 LEU HA H 22 4.422 4.422 4.367 0.055 18237
96 1 . 1 1 22 22 LEU C C 22 179.268 179.268 178.839 0.429 18237
97 1 . 1 1 22 22 LEU CA C 22 55.634 55.634 55.651 -0.017 18237
98 1 . 1 1 22 22 LEU CB C 22 41.279 41.279 41.376 -0.097 18237
99 1 . 1 1 22 22 LEU H H 22 8.812 8.812 9.037 -0.225 18237
100 1 . 1 1 23 23 LEU N N 23 126.386 126.386 126.554 -0.168 18237
101 1 . 1 1 23 23 LEU C C 23 178.844 178.844 178.597 0.247 18237
102 1 . 1 1 23 23 LEU CA C 23 57.403 57.403 58.239 -0.836 18237
103 1 . 1 1 23 23 LEU CB C 23 41.061 41.061 41.718 -0.657 18237
104 1 . 1 1 23 23 LEU H H 23 8.562 8.562 8.234 0.328 18237
105 1 . 1 1 24 24 SER N N 24 113.100 113.100 114.581 -1.481 18237
106 1 . 1 1 24 24 SER HA H 24 4.621 4.621 4.100 0.521 18237
107 1 . 1 1 24 24 SER C C 24 176.676 176.676 176.283 0.393 18237
108 1 . 1 1 24 24 SER CA C 24 60.960 60.960 61.724 -0.764 18237
109 1 . 1 1 24 24 SER CB C 24 61.650 61.650 62.497 -0.846 18237
110 1 . 1 1 24 24 SER H H 24 9.098 9.098 8.592 0.506 18237
111 1 . 1 1 25 25 THR N N 25 116.715 116.715 116.411 0.304 18237
112 1 . 1 1 25 25 THR HA H 25 3.915 3.915 4.104 -0.189 18237
113 1 . 1 1 25 25 THR CA C 25 64.599 64.599 65.428 -0.829 18237
114 1 . 1 1 25 25 THR CB C 25 68.657 68.657 68.749 -0.092 18237
115 1 . 1 1 25 25 THR H H 25 7.238 7.238 8.095 -0.857 18237
116 1 . 1 1 26 26 PHE N N 26 118.488 118.488 119.523 -1.035 18237
117 1 . 1 1 26 26 PHE HA H 26 4.110 4.110 4.458 -0.348 18237
118 1 . 1 1 26 26 PHE C C 26 176.181 176.181 176.605 -0.424 18237
119 1 . 1 1 26 26 PHE CA C 26 58.627 58.627 60.124 -1.497 18237
120 1 . 1 1 26 26 PHE CB C 26 39.793 39.793 39.664 0.129 18237
121 1 . 1 1 26 26 PHE H H 26 7.945 7.945 8.309 -0.364 18237
122 1 . 1 1 27 27 LEU N N 27 118.525 118.525 119.787 -1.262 18237
123 1 . 1 1 27 27 LEU HA H 27 4.523 4.523 4.288 0.235 18237
124 1 . 1 1 27 27 LEU C C 27 177.752 177.752 177.770 -0.018 18237
125 1 . 1 1 27 27 LEU CA C 27 54.679 54.679 55.926 -1.247 18237
126 1 . 1 1 27 27 LEU CB C 27 41.333 41.333 42.603 -1.270 18237
127 1 . 1 1 27 27 LEU H H 27 7.290 7.290 7.707 -0.417 18237
128 1 . 1 1 28 28 GLY N N 28 108.823 108.823 106.110 2.713 18237
129 1 . 1 1 28 28 GLY C C 28 174.630 174.630 174.087 0.543 18237
130 1 . 1 1 28 28 GLY CA C 28 45.374 45.374 45.153 0.221 18237
131 1 . 1 1 28 28 GLY H H 28 8.242 8.242 7.829 0.413 18237
132 1 . 1 1 29 29 SER N N 29 116.210 116.210 116.200 0.010 18237
133 1 . 1 1 29 29 SER HA H 29 4.626 4.626 4.554 0.072 18237
134 1 . 1 1 29 29 SER C C 29 175.312 175.312 174.690 0.622 18237
135 1 . 1 1 29 29 SER CA C 29 57.992 57.992 58.220 -0.227 18237
136 1 . 1 1 29 29 SER CB C 29 63.605 63.605 64.363 -0.758 18237
137 1 . 1 1 29 29 SER H H 29 8.310 8.310 7.869 0.441 18237
138 1 . 1 1 30 30 SER N N 30 118.892 118.892 114.630 4.262 18237
139 1 . 1 1 30 30 SER HA H 30 4.597 4.597 4.287 0.310 18237
140 1 . 1 1 30 30 SER C C 30 175.479 175.479 174.679 0.800 18237
141 1 . 1 1 30 30 SER CA C 30 58.582 58.582 59.609 -1.027 18237
142 1 . 1 1 30 30 SER CB C 30 63.605 63.605 62.205 1.400 18237
143 1 . 1 1 30 30 SER H H 30 8.593 8.593 8.713 -0.120 18237
144 1 . 1 1 31 31 GLY N N 31 111.354 111.354 108.774 2.580 18237
145 1 . 1 1 31 31 GLY C C 31 174.428 174.428 174.542 -0.114 18237
146 1 . 1 1 31 31 GLY CA C 31 45.456 45.456 45.491 -0.035 18237
147 1 . 1 1 31 31 GLY H H 31 8.584 8.584 8.069 0.515 18237
148 1 . 1 1 32 32 ASN N N 32 119.486 119.486 117.822 1.664 18237
149 1 . 1 1 32 32 ASN HA H 32 4.817 4.817 4.699 0.118 18237
150 1 . 1 1 32 32 ASN C C 32 175.928 175.928 175.924 0.004 18237
151 1 . 1 1 32 32 ASN CA C 32 53.215 53.215 53.106 0.109 18237
152 1 . 1 1 32 32 ASN CB C 32 38.780 38.780 38.662 0.118 18237
153 1 . 1 1 32 32 ASN H H 32 8.393 8.393 8.332 0.061 18237
154 1 . 1 1 33 33 GLU N N 33 122.031 122.031 120.610 1.421 18237
155 1 . 1 1 33 33 GLU HA H 33 4.271 4.271 4.004 0.267 18237
156 1 . 1 1 33 33 GLU CA C 33 57.426 57.426 59.006 -1.580 18237
157 1 . 1 1 33 33 GLU CB C 33 29.328 29.328 29.350 -0.022 18237
158 1 . 1 1 33 33 GLU H H 33 8.711 8.711 8.603 0.108 18237
159 1 . 1 1 34 34 GLN N N 34 120.866 120.866 117.954 2.912 18237
160 1 . 1 1 34 34 GLN HA H 34 4.271 4.271 4.033 0.238 18237
161 1 . 1 1 34 34 GLN CA C 34 56.226 56.226 58.938 -2.712 18237
162 1 . 1 1 34 34 GLN CB C 34 28.839 28.839 28.387 0.452 18237
163 1 . 1 1 34 34 GLN H H 34 8.438 8.438 8.052 0.386 18237
164 1 . 1 1 35 35 GLU N N 35 122.323 122.323 119.842 2.481 18237
165 1 . 1 1 35 35 GLU HA H 35 4.319 4.319 4.207 0.112 18237
166 1 . 1 1 35 35 GLU C C 35 177.176 177.176 178.921 -1.745 18237
167 1 . 1 1 35 35 GLU CA C 35 56.996 56.996 58.689 -1.693 18237
168 1 . 1 1 35 35 GLU CB C 35 29.545 29.545 29.320 0.225 18237
169 1 . 1 1 35 35 GLU H H 35 8.424 8.424 7.782 0.642 18237
170 1 . 1 1 36 36 LEU N N 36 122.904 122.904 118.225 4.679 18237
171 1 . 1 1 36 36 LEU HA H 36 4.319 4.319 4.130 0.189 18237
172 1 . 1 1 36 36 LEU CA C 36 55.898 55.898 56.955 -1.057 18237
173 1 . 1 1 36 36 LEU CB C 36 41.496 41.496 41.974 -0.478 18237
174 1 . 1 1 36 36 LEU H H 36 8.342 8.342 7.401 0.941 18237
175 1 . 1 1 38 38 GLU N N 38 121.931 121.931 120.981 0.950 18237
176 1 . 1 1 38 38 GLU HA H 38 4.396 4.396 4.048 0.348 18237
177 1 . 1 1 38 38 GLU C C 38 177.318 177.318 178.316 -0.998 18237
178 1 . 1 1 38 38 GLU CA C 38 56.366 56.366 59.526 -3.160 18237
179 1 . 1 1 38 38 GLU CB C 38 29.328 29.328 29.729 -0.401 18237
180 1 . 1 1 38 38 GLU H H 38 8.342 8.342 7.879 0.463 18237
181 1 . 1 1 39 39 LEU N N 39 123.317 123.317 119.677 3.640 18237
182 1 . 1 1 39 39 LEU HA H 39 4.348 4.348 3.116 1.232 18237
183 1 . 1 1 39 39 LEU CA C 39 56.833 56.833 58.284 -1.451 18237
184 1 . 1 1 39 39 LEU CB C 39 41.387 41.387 41.696 -0.309 18237
185 1 . 1 1 39 39 LEU H H 39 8.342 8.342 7.547 0.795 18237
186 1 . 1 1 40 40 ASP N N 40 119.726 119.726 116.531 3.195 18237
187 1 . 1 1 40 40 ASP HA H 40 4.571 4.571 4.307 0.264 18237
188 1 . 1 1 40 40 ASP CA C 40 55.589 55.589 57.377 -1.788 18237
189 1 . 1 1 40 40 ASP H H 40 8.530 8.530 8.425 0.105 18237
190 1 . 1 1 41 41 LYS N N 41 121.200 121.200 119.790 1.410 18237
191 1 . 1 1 41 41 LYS HA H 41 4.164 4.164 4.232 -0.068 18237
192 1 . 1 1 41 41 LYS CA C 41 58.220 58.220 58.478 -0.258 18237
193 1 . 1 1 41 41 LYS H H 41 8.145 8.145 7.764 0.381 18237
194 1 . 1 1 42 42 TRP N N 42 120.615 120.615 120.410 0.205 18237
195 1 . 1 1 42 42 TRP HA H 42 4.597 4.597 4.395 0.202 18237
196 1 . 1 1 42 42 TRP C C 42 177.641 177.641 178.363 -0.722 18237
197 1 . 1 1 42 42 TRP CA C 42 58.561 58.561 59.200 -0.639 18237
198 1 . 1 1 42 42 TRP CB C 42 28.839 28.839 28.472 0.367 18237
199 1 . 1 1 42 42 TRP H H 42 8.025 8.025 8.188 -0.163 18237
200 1 . 1 1 43 43 ALA N N 43 122.056 122.056 120.872 1.184 18237
201 1 . 1 1 43 43 ALA HA H 43 4.140 4.140 4.083 0.057 18237
202 1 . 1 1 43 43 ALA C C 43 172.776 172.776 179.735 -6.959 18237
203 1 . 1 1 43 43 ALA CA C 43 54.864 54.864 55.207 -0.344 18237
204 1 . 1 1 43 43 ALA CB C 43 17.974 17.974 17.856 0.118 18237
205 1 . 1 1 43 43 ALA H H 43 8.199 8.199 8.188 0.011 18237
206 1 . 1 1 44 44 SER N N 44 113.378 113.378 115.134 -1.756 18237
207 1 . 1 1 44 44 SER HA H 44 4.376 4.376 4.261 0.115 18237
208 1 . 1 1 44 44 SER C C 44 176.767 176.767 176.834 -0.067 18237
209 1 . 1 1 44 44 SER CA C 44 60.980 60.980 62.132 -1.152 18237
210 1 . 1 1 44 44 SER CB C 44 62.410 62.410 62.869 -0.459 18237
211 1 . 1 1 44 44 SER H H 44 8.210 8.210 8.030 0.180 18237
212 1 . 1 1 45 45 LEU N N 45 123.425 123.425 122.170 1.255 18237
213 1 . 1 1 45 45 LEU HA H 45 4.194 4.194 4.311 -0.117 18237
214 1 . 1 1 45 45 LEU CA C 45 57.606 57.606 57.941 -0.335 18237
215 1 . 1 1 45 45 LEU CB C 45 41.170 41.170 41.786 -0.616 18237
216 1 . 1 1 45 45 LEU H H 45 7.906 7.906 7.621 0.285 18237
217 1 . 1 1 46 46 TRP N N 46 118.572 118.572 119.708 -1.136 18237
218 1 . 1 1 46 46 TRP HA H 46 4.655 4.655 4.341 0.314 18237
219 1 . 1 1 46 46 TRP C C 46 177.838 177.838 178.435 -0.597 18237
220 1 . 1 1 46 46 TRP CA C 46 58.907 58.907 60.739 -1.832 18237
221 1 . 1 1 46 46 TRP CB C 46 29.219 29.219 29.394 -0.175 18237
222 1 . 1 1 46 46 TRP H H 46 8.043 8.043 8.284 -0.241 18237
223 1 . 1 1 47 47 ASN N N 47 116.564 116.564 117.590 -1.026 18237
224 1 . 1 1 47 47 ASN HA H 47 4.626 4.626 4.577 0.049 18237
225 1 . 1 1 47 47 ASN C C 47 176.904 176.904 177.407 -0.503 18237
226 1 . 1 1 47 47 ASN CA C 47 55.045 55.045 55.617 -0.572 18237
227 1 . 1 1 47 47 ASN CB C 47 38.563 38.563 38.736 -0.173 18237
228 1 . 1 1 47 47 ASN H H 47 8.174 8.174 8.750 -0.576 18237
229 1 . 1 1 48 48 TRP N N 48 121.421 121.421 121.012 0.409 18237
230 1 . 1 1 48 48 TRP HA H 48 4.367 4.367 4.642 -0.275 18237
231 1 . 1 1 48 48 TRP CA C 48 59.517 59.517 58.211 1.306 18237
232 1 . 1 1 48 48 TRP CB C 48 28.893 28.893 29.303 -0.410 18237
233 1 . 1 1 48 48 TRP H H 48 8.145 8.145 8.077 0.068 18237
234 1 . 1 1 49 49 PHE N N 49 118.299 118.299 121.101 -2.802 18237
235 1 . 1 1 49 49 PHE HA H 49 4.252 4.252 3.644 0.608 18237
236 1 . 1 1 49 49 PHE C C 49 175.565 175.565 175.211 0.354 18237
237 1 . 1 1 49 49 PHE CA C 49 58.887 58.887 58.160 0.727 18237
238 1 . 1 1 49 49 PHE CB C 49 38.671 38.671 38.372 0.299 18237
239 1 . 1 1 49 49 PHE H H 49 8.036 8.036 7.814 0.222 18237
240 1 . 1 1 50 50 ASN N N 50 118.836 118.836 119.265 -0.429 18237
241 1 . 1 1 50 50 ASN HA H 50 4.626 4.626 4.014 0.612 18237
242 1 . 1 1 50 50 ASN C C 50 176.439 176.439 176.587 -0.148 18237
243 1 . 1 1 50 50 ASN CA C 50 53.215 53.215 54.946 -1.731 18237
244 1 . 1 1 50 50 ASN CB C 50 38.128 38.128 37.797 0.331 18237
245 1 . 1 1 50 50 ASN H H 50 7.795 7.795 7.555 0.240 18237
246 1 . 1 1 51 51 ILE N N 51 120.218 120.218 116.148 4.070 18237
247 1 . 1 1 51 51 ILE HA H 51 3.791 3.791 3.837 -0.046 18237
248 1 . 1 1 51 51 ILE C C 51 177.202 177.202 177.126 0.076 18237
249 1 . 1 1 51 51 ILE CA C 51 63.102 63.102 64.873 -1.771 18237
250 1 . 1 1 51 51 ILE CB C 51 37.367 37.367 37.070 0.297 18237
251 1 . 1 1 51 51 ILE H H 51 8.147 8.147 7.038 1.109 18237
252 1 . 1 1 52 52 THR N N 52 115.352 115.352 113.407 1.945 18237
253 1 . 1 1 52 52 THR HA H 52 4.031 4.031 3.982 0.049 18237
254 1 . 1 1 52 52 THR C C 52 176.095 176.095 176.305 -0.210 18237
255 1 . 1 1 52 52 THR CA C 52 65.148 65.148 65.385 -0.237 18237
256 1 . 1 1 52 52 THR CB C 52 68.277 68.277 67.974 0.303 18237
257 1 . 1 1 52 52 THR H H 52 8.009 8.009 7.264 0.745 18237
258 1 . 1 1 53 53 ASN N N 53 119.874 119.874 121.176 -1.302 18237
259 1 . 1 1 53 53 ASN HA H 53 4.636 4.636 4.228 0.408 18237
260 1 . 1 1 53 53 ASN C C 53 176.530 176.530 177.092 -0.562 18237
261 1 . 1 1 53 53 ASN CA C 53 54.457 54.457 55.679 -1.222 18237
262 1 . 1 1 53 53 ASN CB C 53 37.802 37.802 37.627 0.175 18237
263 1 . 1 1 53 53 ASN H H 53 7.972 7.972 7.024 0.948 18237
264 1 . 1 1 54 54 TRP N N 54 120.192 120.192 119.772 0.420 18237
265 1 . 1 1 54 54 TRP HA H 54 4.655 4.655 4.547 0.108 18237
266 1 . 1 1 54 54 TRP CA C 54 58.643 58.643 58.797 -0.154 18237
267 1 . 1 1 54 54 TRP CB C 54 29.165 29.165 29.206 -0.041 18237
268 1 . 1 1 54 54 TRP H H 54 7.897 7.897 7.254 0.643 18237
269 1 . 1 1 55 55 LEU N N 55 118.354 118.354 121.843 -3.489 18237
270 1 . 1 1 55 55 LEU HA H 55 4.088 4.088 3.894 0.194 18237
271 1 . 1 1 55 55 LEU C C 55 177.975 177.975 178.733 -0.758 18237
272 1 . 1 1 55 55 LEU CA C 55 56.470 56.470 58.433 -1.963 18237
273 1 . 1 1 55 55 LEU CB C 55 40.898 40.898 41.784 -0.886 18237
274 1 . 1 1 55 55 LEU H H 55 7.931 7.931 7.865 0.066 18237
275 1 . 1 1 56 56 TRP N N 56 118.335 118.335 117.166 1.169 18237
276 1 . 1 1 56 56 TRP HA H 56 4.367 4.367 4.335 0.032 18237
277 1 . 1 1 56 56 TRP C C 56 176.863 176.863 178.267 -1.404 18237
278 1 . 1 1 56 56 TRP CA C 56 59.070 59.070 60.481 -1.411 18237
279 1 . 1 1 56 56 TRP CB C 56 28.839 28.839 28.767 0.072 18237
280 1 . 1 1 56 56 TRP H H 56 7.665 7.665 7.782 -0.117 18237
281 1 . 1 1 57 57 TYR N N 57 116.808 116.808 119.299 -2.491 18237
282 1 . 1 1 57 57 TYR HA H 57 4.172 4.172 4.323 -0.151 18237
283 1 . 1 1 57 57 TYR C C 57 176.085 176.085 176.995 -0.910 18237
284 1 . 1 1 57 57 TYR CA C 57 59.865 59.865 61.044 -1.179 18237
285 1 . 1 1 57 57 TYR CB C 57 38.563 38.563 39.099 -0.536 18237
286 1 . 1 1 57 57 TYR H H 57 7.578 7.578 7.620 -0.042 18237
287 1 . 1 1 58 58 ILE N N 58 115.526 115.526 115.179 0.347 18237
288 1 . 1 1 58 58 ILE HA H 58 4.265 4.265 4.240 0.025 18237
289 1 . 1 1 58 58 ILE C C 58 174.782 174.782 175.838 -1.056 18237
290 1 . 1 1 58 58 ILE CA C 58 60.940 60.940 61.437 -0.497 18237
291 1 . 1 1 58 58 ILE CB C 58 38.182 38.182 38.512 -0.330 18237
292 1 . 1 1 58 58 ILE H H 58 7.586 7.586 8.209 -0.623 18237
stop_
save_