data_25380
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25380
_Entry.PDB_ID 2MX0
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 25380
_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 HIS N N 2 120.430 120.430 120.916 -0.486 25380
2 1 1 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.507 0.228 25380
3 1 1 . 1 1 2 2 HIS C C 2 173.884 173.884 175.275 -1.391 25380
4 1 1 . 1 1 2 2 HIS CA C 2 55.052 55.052 58.091 -3.039 25380
5 1 1 . 1 1 2 2 HIS CB C 2 28.666 28.666 30.156 -1.490 25380
6 1 1 . 1 1 2 2 HIS H H 2 8.678 8.678 8.699 -0.021 25380
7 1 1 . 1 1 3 3 MET N N 3 122.377 122.377 118.645 3.732 25380
8 1 1 . 1 1 3 3 MET HA H 3 4.207 4.207 4.651 -0.444 25380
9 1 1 . 1 1 3 3 MET C C 3 174.584 174.584 174.838 -0.254 25380
10 1 1 . 1 1 3 3 MET CA C 3 56.550 56.550 55.420 1.130 25380
11 1 1 . 1 1 3 3 MET CB C 3 33.426 33.426 32.341 1.085 25380
12 1 1 . 1 1 3 3 MET H H 3 8.240 8.240 7.936 0.304 25380
13 1 1 . 1 1 4 4 LYS N N 4 123.568 123.568 117.993 5.575 25380
14 1 1 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.065 0.774 25380
15 1 1 . 1 1 4 4 LYS C C 4 175.906 175.906 174.431 1.475 25380
16 1 1 . 1 1 4 4 LYS CA C 4 54.800 54.800 57.410 -2.610 25380
17 1 1 . 1 1 4 4 LYS CB C 4 34.900 34.900 30.198 4.702 25380
18 1 1 . 1 1 4 4 LYS H H 4 8.351 8.351 8.455 -0.104 25380
19 1 1 . 1 1 5 5 LEU N N 5 123.568 123.568 112.185 11.383 25380
20 1 1 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.709 -0.870 25380
21 1 1 . 1 1 5 5 LEU C C 5 175.900 175.900 175.737 0.163 25380
22 1 1 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.153 0.197 25380
23 1 1 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.905 -0.005 25380
24 1 1 . 1 1 5 5 LEU H H 5 8.281 8.281 7.600 0.681 25380
25 1 1 . 1 1 6 6 VAL N N 6 121.564 121.564 121.003 0.561 25380
26 1 1 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.346 0.080 25380
27 1 1 . 1 1 6 6 VAL C C 6 178.200 178.200 174.884 3.316 25380
28 1 1 . 1 1 6 6 VAL CA C 6 63.200 63.200 61.405 1.795 25380
29 1 1 . 1 1 6 6 VAL CB C 6 33.200 33.200 33.695 -0.495 25380
30 1 1 . 1 1 6 6 VAL H H 6 9.276 9.276 9.045 0.231 25380
31 1 1 . 1 1 7 7 LEU N N 7 121.564 121.564 125.942 -4.378 25380
32 1 1 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.460 -1.034 25380
33 1 1 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.003 10.197 25380
34 1 1 . 1 1 7 7 LEU CB C 7 33.200 33.200 45.285 -12.085 25380
35 1 1 . 1 1 7 7 LEU H H 7 9.276 9.276 8.569 0.707 25380
36 1 1 . 1 1 8 8 ALA C C 8 177.040 177.040 178.060 -1.020 25380
37 1 1 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.298 -0.597 25380
38 1 1 . 1 1 8 8 ALA CB C 8 20.864 20.864 20.217 0.647 25380
39 1 1 . 1 1 9 9 LYS N N 9 119.845 119.845 123.115 -3.270 25380
40 1 1 . 1 1 9 9 LYS HA H 9 4.128 4.128 4.204 -0.076 25380
41 1 1 . 1 1 9 9 LYS C C 9 176.075 176.075 176.956 -0.881 25380
42 1 1 . 1 1 9 9 LYS CA C 9 56.761 56.761 57.566 -0.805 25380
43 1 1 . 1 1 9 9 LYS CB C 9 32.919 32.919 31.932 0.987 25380
44 1 1 . 1 1 9 9 LYS H H 9 8.545 8.545 8.804 -0.259 25380
45 1 1 . 1 1 10 10 ASN N N 10 119.279 119.279 120.009 -0.730 25380
46 1 1 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.541 0.104 25380
47 1 1 . 1 1 10 10 ASN C C 10 175.443 175.443 176.938 -1.495 25380
48 1 1 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.768 -2.111 25380
49 1 1 . 1 1 10 10 ASN CB C 10 38.777 38.777 38.691 0.086 25380
50 1 1 . 1 1 10 10 ASN H H 10 8.592 8.592 9.046 -0.454 25380
51 1 1 . 1 1 11 11 THR N N 11 111.876 111.876 108.929 2.947 25380
52 1 1 . 1 1 11 11 THR HA H 11 4.311 4.311 4.440 -0.129 25380
53 1 1 . 1 1 11 11 THR C C 11 174.666 174.666 176.081 -1.415 25380
54 1 1 . 1 1 11 11 THR CA C 11 62.044 62.044 63.227 -1.183 25380
55 1 1 . 1 1 11 11 THR CB C 11 69.895 69.895 69.713 0.182 25380
56 1 1 . 1 1 11 11 THR H H 11 8.058 8.058 8.272 -0.214 25380
57 1 1 . 1 1 12 12 ARG N N 12 121.152 121.152 120.300 0.852 25380
58 1 1 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.431 -0.169 25380
59 1 1 . 1 1 12 12 ARG C C 12 176.714 176.714 175.695 1.019 25380
60 1 1 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.359 0.463 25380
61 1 1 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.248 -0.546 25380
62 1 1 . 1 1 12 12 ARG H H 12 8.291 8.291 7.934 0.357 25380
63 1 1 . 1 1 13 13 LYS N N 13 120.459 120.459 120.011 0.448 25380
64 1 1 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.082 -0.186 25380
65 1 1 . 1 1 13 13 LYS C C 13 176.682 176.682 176.475 0.207 25380
66 1 1 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.056 -0.078 25380
67 1 1 . 1 1 13 13 LYS CB C 13 32.498 32.498 31.025 1.473 25380
68 1 1 . 1 1 13 13 LYS H H 13 8.286 8.286 8.349 -0.063 25380
69 1 1 . 1 1 14 14 SER N N 14 114.568 114.568 115.323 -0.755 25380
70 1 1 . 1 1 14 14 SER HA H 14 4.371 4.371 4.353 0.018 25380
71 1 1 . 1 1 14 14 SER C C 14 173.990 173.990 175.078 -1.088 25380
72 1 1 . 1 1 14 14 SER CA C 14 58.617 58.617 58.704 -0.087 25380
73 1 1 . 1 1 14 14 SER CB C 14 63.933 63.933 63.777 0.156 25380
74 1 1 . 1 1 14 14 SER H H 14 7.957 7.957 8.460 -0.503 25380
75 1 1 . 1 1 15 15 ASP N N 15 121.565 121.565 119.342 2.223 25380
76 1 1 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.721 -0.120 25380
77 1 1 . 1 1 15 15 ASP C C 15 175.684 175.684 176.015 -0.331 25380
78 1 1 . 1 1 15 15 ASP CA C 15 54.149 54.149 54.164 -0.015 25380
79 1 1 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.257 0.972 25380
80 1 1 . 1 1 15 15 ASP H H 15 8.166 8.166 8.482 -0.316 25380
81 1 1 . 1 1 16 16 ALA N N 16 124.173 124.173 123.686 0.487 25380
82 1 1 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.024 0.347 25380
83 1 1 . 1 1 16 16 ALA C C 16 177.184 177.184 177.804 -0.620 25380
84 1 1 . 1 1 16 16 ALA CA C 16 52.337 52.337 53.689 -1.352 25380
85 1 1 . 1 1 16 16 ALA CB C 16 19.359 19.359 19.064 0.295 25380
86 1 1 . 1 1 16 16 ALA H H 16 8.163 8.163 8.151 0.012 25380
87 1 1 . 1 1 17 17 LYS N N 17 121.152 121.152 118.643 2.509 25380
88 1 1 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.060 0.366 25380
89 1 1 . 1 1 17 17 LYS C C 17 175.488 175.488 176.566 -1.078 25380
90 1 1 . 1 1 17 17 LYS CA C 17 56.205 56.205 57.686 -1.481 25380
91 1 1 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.459 1.837 25380
92 1 1 . 1 1 17 17 LYS H H 17 8.363 8.363 7.928 0.435 25380
93 1 1 . 1 1 18 18 SER N N 18 116.448 116.448 115.444 1.004 25380
94 1 1 . 1 1 18 18 SER HA H 18 5.355 5.355 3.936 1.419 25380
95 1 1 . 1 1 18 18 SER C C 18 173.887 173.887 174.895 -1.008 25380
96 1 1 . 1 1 18 18 SER CA C 18 57.248 57.248 59.770 -2.522 25380
97 1 1 . 1 1 18 18 SER CB C 18 64.962 64.962 62.266 2.696 25380
98 1 1 . 1 1 18 18 SER H H 18 8.206 8.206 8.945 -0.739 25380
99 1 1 . 1 1 19 19 VAL N N 19 117.867 117.867 120.658 -2.791 25380
100 1 1 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.633 -0.013 25380
101 1 1 . 1 1 19 19 VAL C C 19 174.169 174.169 176.623 -2.454 25380
102 1 1 . 1 1 19 19 VAL CA C 19 59.546 59.546 65.699 -6.153 25380
103 1 1 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.894 4.008 25380
104 1 1 . 1 1 19 19 VAL H H 19 9.086 9.086 7.287 1.799 25380
105 1 1 . 1 1 20 20 GLU N N 20 120.843 120.843 118.785 2.058 25380
106 1 1 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.059 0.809 25380
107 1 1 . 1 1 20 20 GLU C C 20 178.747 178.747 178.297 0.450 25380
108 1 1 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.459 -4.907 25380
109 1 1 . 1 1 20 20 GLU CB C 20 31.099 31.099 28.042 3.057 25380
110 1 1 . 1 1 20 20 GLU H H 20 8.841 8.841 8.550 0.291 25380
111 1 1 . 1 1 21 21 LEU N N 21 122.653 122.653 121.001 1.652 25380
112 1 1 . 1 1 21 21 LEU HA H 21 3.443 3.443 4.003 -0.560 25380
113 1 1 . 1 1 21 21 LEU C C 21 178.799 178.799 179.250 -0.451 25380
114 1 1 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.499 1.208 25380
115 1 1 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.625 -3.054 25380
116 1 1 . 1 1 21 21 LEU H H 21 8.744 8.744 7.298 1.446 25380
117 1 1 . 1 1 22 22 GLU N N 22 115.392 115.392 119.679 -4.287 25380
118 1 1 . 1 1 22 22 GLU HA H 22 3.989 3.989 4.043 -0.054 25380
119 1 1 . 1 1 22 22 GLU C C 22 179.328 179.328 179.102 0.226 25380
120 1 1 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.450 0.630 25380
121 1 1 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.428 -0.594 25380
122 1 1 . 1 1 22 22 GLU H H 22 8.744 8.744 7.559 1.185 25380
123 1 1 . 1 1 23 23 ASP N N 23 118.597 118.597 120.951 -2.354 25380
124 1 1 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.381 0.230 25380
125 1 1 . 1 1 23 23 ASP C C 23 179.139 179.139 178.630 0.509 25380
126 1 1 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.201 0.318 25380
127 1 1 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.397 0.045 25380
128 1 1 . 1 1 23 23 ASP H H 23 7.098 7.098 8.459 -1.361 25380
129 1 1 . 1 1 24 24 LEU N N 24 119.869 119.869 120.818 -0.949 25380
130 1 1 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.575 0.359 25380
131 1 1 . 1 1 24 24 LEU C C 24 179.045 179.045 178.430 0.615 25380
132 1 1 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.560 -1.011 25380
133 1 1 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.401 0.149 25380
134 1 1 . 1 1 24 24 LEU H H 24 7.576 7.576 8.453 -0.877 25380
135 1 1 . 1 1 25 25 TYR N N 25 118.100 118.100 118.576 -0.476 25380
136 1 1 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.804 0.563 25380
137 1 1 . 1 1 25 25 TYR C C 25 177.945 177.945 177.758 0.187 25380
138 1 1 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.220 1.386 25380
139 1 1 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.155 -0.207 25380
140 1 1 . 1 1 25 25 TYR H H 25 8.320 8.320 7.287 1.033 25380
141 1 1 . 1 1 26 26 HIS N N 26 119.440 119.440 117.921 1.519 25380
142 1 1 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.532 -0.161 25380
143 1 1 . 1 1 26 26 HIS C C 26 176.559 176.559 177.864 -1.305 25380
144 1 1 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.723 -0.204 25380
145 1 1 . 1 1 26 26 HIS CB C 26 28.128 28.128 29.984 -1.856 25380
146 1 1 . 1 1 26 26 HIS H H 26 8.383 8.383 8.213 0.170 25380
147 1 1 . 1 1 27 27 GLU N N 27 119.915 119.915 121.618 -1.703 25380
148 1 1 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.017 0.241 25380
149 1 1 . 1 1 27 27 GLU C C 27 179.163 179.163 178.287 0.876 25380
150 1 1 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.008 1.067 25380
151 1 1 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.522 0.013 25380
152 1 1 . 1 1 27 27 GLU H H 27 8.288 8.288 8.784 -0.496 25380
153 1 1 . 1 1 28 28 PHE N N 28 120.500 120.500 119.625 0.875 25380
154 1 1 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.208 0.764 25380
155 1 1 . 1 1 28 28 PHE C C 28 177.386 177.386 176.685 0.701 25380
156 1 1 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.806 -0.405 25380
157 1 1 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.035 0.533 25380
158 1 1 . 1 1 28 28 PHE H H 28 8.568 8.568 7.796 0.772 25380
159 1 1 . 1 1 29 29 SER N N 29 114.306 114.306 114.373 -0.067 25380
160 1 1 . 1 1 29 29 SER HA H 29 4.288 4.288 4.393 -0.105 25380
161 1 1 . 1 1 29 29 SER C C 29 175.656 175.656 176.379 -0.723 25380
162 1 1 . 1 1 29 29 SER CA C 29 61.058 61.058 60.309 0.749 25380
163 1 1 . 1 1 29 29 SER CB C 29 63.555 63.555 63.517 0.037 25380
164 1 1 . 1 1 29 29 SER H H 29 8.479 8.479 7.871 0.608 25380
165 1 1 . 1 1 30 30 GLU N N 30 118.322 118.322 120.547 -2.225 25380
166 1 1 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.207 -0.115 25380
167 1 1 . 1 1 30 30 GLU C C 30 177.312 177.312 176.622 0.690 25380
168 1 1 . 1 1 30 30 GLU CA C 30 57.580 57.580 58.217 -0.637 25380
169 1 1 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.569 -0.992 25380
170 1 1 . 1 1 30 30 GLU H H 30 8.428 8.428 7.936 0.492 25380
171 1 1 . 1 1 31 31 ASP N N 31 115.630 115.630 116.619 -0.989 25380
172 1 1 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.837 -0.027 25380
173 1 1 . 1 1 31 31 ASP C C 31 175.723 175.723 173.783 1.940 25380
174 1 1 . 1 1 31 31 ASP CA C 31 53.974 53.974 53.049 0.925 25380
175 1 1 . 1 1 31 31 ASP CB C 31 40.818 40.818 44.063 -3.245 25380
176 1 1 . 1 1 31 31 ASP H H 31 7.303 7.303 7.973 -0.670 25380
177 1 1 . 1 1 32 32 LYS N N 32 114.357 114.357 121.216 -6.859 25380
178 1 1 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.277 -0.450 25380
179 1 1 . 1 1 32 32 LYS C C 32 175.716 175.716 176.195 -0.479 25380
180 1 1 . 1 1 32 32 LYS CA C 32 56.162 56.162 56.246 -0.084 25380
181 1 1 . 1 1 32 32 LYS CB C 32 28.381 28.381 32.973 -4.592 25380
182 1 1 . 1 1 32 32 LYS H H 32 7.148 7.148 8.416 -1.268 25380
183 1 1 . 1 1 33 33 ARG N N 33 120.929 120.929 125.460 -4.531 25380
184 1 1 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.671 -0.470 25380
185 1 1 . 1 1 33 33 ARG C C 33 173.982 173.982 173.512 0.470 25380
186 1 1 . 1 1 33 33 ARG CA C 33 56.194 56.194 54.811 1.383 25380
187 1 1 . 1 1 33 33 ARG CB C 33 30.642 30.642 33.932 -3.290 25380
188 1 1 . 1 1 33 33 ARG H H 33 7.388 7.388 8.698 -1.310 25380
189 1 1 . 1 1 34 34 SER N N 34 115.867 115.867 114.383 1.484 25380
190 1 1 . 1 1 34 34 SER HA H 34 5.355 5.355 4.921 0.434 25380
191 1 1 . 1 1 34 34 SER C C 34 172.754 172.754 172.622 0.132 25380
192 1 1 . 1 1 34 34 SER CA C 34 58.236 58.236 57.116 1.120 25380
193 1 1 . 1 1 34 34 SER CB C 34 65.212 65.212 65.023 0.188 25380
194 1 1 . 1 1 34 34 SER H H 34 8.173 8.173 8.375 -0.202 25380
195 1 1 . 1 1 35 35 ILE N N 35 119.621 119.621 115.381 4.240 25380
196 1 1 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.877 -0.014 25380
197 1 1 . 1 1 35 35 ILE C C 35 174.069 174.069 173.312 0.757 25380
198 1 1 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.349 0.607 25380
199 1 1 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.413 -0.758 25380
200 1 1 . 1 1 35 35 ILE H H 35 6.779 6.779 8.820 -2.041 25380
201 1 1 . 1 1 36 36 PHE N N 36 124.305 124.305 117.986 6.319 25380
202 1 1 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.617 -1.164 25380
203 1 1 . 1 1 36 36 PHE C C 36 173.204 173.204 174.552 -1.348 25380
204 1 1 . 1 1 36 36 PHE CA C 36 56.416 56.416 55.747 0.669 25380
205 1 1 . 1 1 36 36 PHE CB C 36 44.817 44.817 41.570 3.247 25380
206 1 1 . 1 1 36 36 PHE H H 36 8.411 8.411 8.670 -0.259 25380
207 1 1 . 1 1 37 37 TYR N N 37 118.743 118.743 124.196 -5.453 25380
208 1 1 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.081 0.489 25380
209 1 1 . 1 1 37 37 TYR C C 37 175.455 175.455 173.699 1.756 25380
210 1 1 . 1 1 37 37 TYR CA C 37 56.518 56.518 54.433 2.085 25380
211 1 1 . 1 1 37 37 TYR CB C 37 40.991 40.991 39.954 1.037 25380
212 1 1 . 1 1 37 37 TYR H H 37 8.353 8.353 9.155 -0.802 25380
213 1 1 . 1 1 38 38 PHE N N 38 119.236 119.236 129.037 -9.801 25380
214 1 1 . 1 1 38 38 PHE HA H 38 5.160 5.160 5.348 -0.188 25380
215 1 1 . 1 1 38 38 PHE C C 38 174.650 174.650 174.323 0.327 25380
216 1 1 . 1 1 38 38 PHE CA C 38 56.842 56.842 56.395 0.447 25380
217 1 1 . 1 1 38 38 PHE CB C 38 42.619 42.619 38.752 3.867 25380
218 1 1 . 1 1 38 38 PHE H H 38 9.756 9.756 9.605 0.151 25380
219 1 1 . 1 1 39 39 ALA N N 39 122.516 122.516 125.330 -2.814 25380
220 1 1 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.840 -0.300 25380
221 1 1 . 1 1 39 39 ALA C C 39 177.042 177.042 174.284 2.758 25380
222 1 1 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.319 1.524 25380
223 1 1 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.463 -2.885 25380
224 1 1 . 1 1 39 39 ALA H H 39 7.738 7.738 8.884 -1.146 25380
225 1 1 . 1 1 40 40 PRO C C 40 175.411 175.411 177.562 -2.151 25380
226 1 1 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.679 1.609 25380
227 1 1 . 1 1 40 40 PRO CB C 40 31.104 31.104 33.843 -2.739 25380
228 1 1 . 1 1 41 41 THR N N 41 105.878 105.878 117.209 -11.331 25380
229 1 1 . 1 1 41 41 THR HA H 41 4.190 4.190 4.013 0.177 25380
230 1 1 . 1 1 41 41 THR C C 41 176.400 176.400 175.328 1.072 25380
231 1 1 . 1 1 41 41 THR CA C 41 61.937 61.937 65.650 -3.713 25380
232 1 1 . 1 1 41 41 THR CB C 41 68.331 68.331 68.681 -0.350 25380
233 1 1 . 1 1 41 41 THR H H 41 6.715 6.715 8.380 -1.665 25380
234 1 1 . 1 1 42 42 ASN N N 42 118.863 118.863 118.653 0.210 25380
235 1 1 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.455 0.080 25380
236 1 1 . 1 1 42 42 ASN C C 42 173.764 173.764 175.883 -2.119 25380
237 1 1 . 1 1 42 42 ASN CA C 42 54.176 54.176 54.670 -0.494 25380
238 1 1 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.956 3.759 25380
239 1 1 . 1 1 42 42 ASN H H 42 7.153 7.153 8.197 -1.044 25380
240 1 1 . 1 1 43 43 ALA N N 43 126.174 126.174 120.155 6.019 25380
241 1 1 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.391 0.034 25380
242 1 1 . 1 1 43 43 ALA C C 43 179.308 179.308 176.839 2.469 25380
243 1 1 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.995 -1.013 25380
244 1 1 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.227 -0.932 25380
245 1 1 . 1 1 43 43 ALA H H 43 9.465 9.465 7.951 1.514 25380
246 1 1 . 1 1 44 44 HIS N N 44 126.251 126.251 114.438 11.813 25380
247 1 1 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.301 -0.474 25380
248 1 1 . 1 1 44 44 HIS C C 44 177.407 177.407 175.161 2.246 25380
249 1 1 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.943 4.082 25380
250 1 1 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.217 1.413 25380
251 1 1 . 1 1 44 44 HIS H H 44 9.407 9.407 8.216 1.191 25380
252 1 1 . 1 1 45 45 LYS N N 45 114.990 114.990 119.760 -4.770 25380
253 1 1 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.291 -0.408 25380
254 1 1 . 1 1 45 45 LYS C C 45 178.284 178.284 177.834 0.450 25380
255 1 1 . 1 1 45 45 LYS CA C 45 59.249 59.249 58.768 0.481 25380
256 1 1 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.612 -0.778 25380
257 1 1 . 1 1 45 45 LYS H H 45 8.960 8.960 8.217 0.743 25380
258 1 1 . 1 1 46 46 ASP N N 46 120.411 120.411 120.153 0.258 25380
259 1 1 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.454 -0.028 25380
260 1 1 . 1 1 46 46 ASP C C 46 177.773 177.773 178.069 -0.296 25380
261 1 1 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.259 -0.243 25380
262 1 1 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.138 -0.241 25380
263 1 1 . 1 1 46 46 ASP H H 46 6.777 6.777 8.517 -1.740 25380
264 1 1 . 1 1 47 47 MET N N 47 118.178 118.178 118.997 -0.819 25380
265 1 1 . 1 1 47 47 MET HA H 47 3.879 3.879 3.862 0.017 25380
266 1 1 . 1 1 47 47 MET C C 47 179.499 179.499 177.649 1.850 25380
267 1 1 . 1 1 47 47 MET CA C 47 56.052 56.052 59.018 -2.966 25380
268 1 1 . 1 1 47 47 MET CB C 47 29.601 29.601 32.483 -2.882 25380
269 1 1 . 1 1 47 47 MET H H 47 7.367 7.367 8.024 -0.657 25380
270 1 1 . 1 1 48 48 LEU N N 48 117.665 117.665 118.885 -1.220 25380
271 1 1 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.855 -0.008 25380
272 1 1 . 1 1 48 48 LEU C C 48 179.843 179.843 178.808 1.035 25380
273 1 1 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.322 0.258 25380
274 1 1 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.434 -0.481 25380
275 1 1 . 1 1 48 48 LEU H H 48 7.672 7.672 7.535 0.137 25380
276 1 1 . 1 1 49 49 LYS N N 49 119.326 119.326 118.816 0.510 25380
277 1 1 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.606 0.521 25380
278 1 1 . 1 1 49 49 LYS C C 49 179.684 179.684 178.503 1.181 25380
279 1 1 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.176 -0.377 25380
280 1 1 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.874 -0.421 25380
281 1 1 . 1 1 49 49 LYS H H 49 7.420 7.420 7.954 -0.534 25380
282 1 1 . 1 1 50 50 ALA N N 50 122.022 122.022 122.787 -0.765 25380
283 1 1 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.876 0.167 25380
284 1 1 . 1 1 50 50 ALA C C 50 178.818 178.818 179.053 -0.235 25380
285 1 1 . 1 1 50 50 ALA CA C 50 55.169 55.169 55.139 0.030 25380
286 1 1 . 1 1 50 50 ALA CB C 50 17.300 17.300 18.252 -0.952 25380
287 1 1 . 1 1 50 50 ALA H H 50 7.551 7.551 7.810 -0.259 25380
288 1 1 . 1 1 51 51 VAL N N 51 118.165 118.165 118.256 -0.091 25380
289 1 1 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.759 -0.317 25380
290 1 1 . 1 1 51 51 VAL C C 51 178.646 178.646 178.206 0.440 25380
291 1 1 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.536 0.670 25380
292 1 1 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.875 0.578 25380
293 1 1 . 1 1 51 51 VAL H H 51 7.226 7.226 7.556 -0.330 25380
294 1 1 . 1 1 52 52 ASP N N 52 122.298 122.298 120.806 1.492 25380
295 1 1 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.356 0.015 25380
296 1 1 . 1 1 52 52 ASP C C 52 177.898 177.898 179.105 -1.207 25380
297 1 1 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.190 0.381 25380
298 1 1 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.152 0.234 25380
299 1 1 . 1 1 52 52 ASP H H 52 8.232 8.232 7.526 0.706 25380
300 1 1 . 1 1 53 53 PHE N N 53 121.541 121.541 119.958 1.583 25380
301 1 1 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.439 -0.118 25380
302 1 1 . 1 1 53 53 PHE C C 53 177.224 177.224 178.171 -0.947 25380
303 1 1 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.965 2.115 25380
304 1 1 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.983 1.717 25380
305 1 1 . 1 1 53 53 PHE H H 53 8.240 8.240 7.725 0.515 25380
306 1 1 . 1 1 54 54 PHE N N 54 115.925 115.925 117.436 -1.511 25380
307 1 1 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.298 -0.643 25380
308 1 1 . 1 1 54 54 PHE C C 54 178.269 178.269 177.293 0.976 25380
309 1 1 . 1 1 54 54 PHE CA C 54 64.200 64.200 60.756 3.444 25380
310 1 1 . 1 1 54 54 PHE CB C 54 38.578 38.578 38.309 0.269 25380
311 1 1 . 1 1 54 54 PHE H H 54 7.755 7.755 8.067 -0.312 25380
312 1 1 . 1 1 55 55 LYS N N 55 120.251 120.251 117.828 2.423 25380
313 1 1 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.028 0.398 25380
314 1 1 . 1 1 55 55 LYS C C 55 181.484 181.484 178.472 3.012 25380
315 1 1 . 1 1 55 55 LYS CA C 55 59.629 59.629 59.163 0.466 25380
316 1 1 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.404 -0.665 25380
317 1 1 . 1 1 55 55 LYS H H 55 8.213 8.213 7.658 0.555 25380
318 1 1 . 1 1 56 56 GLU N N 56 120.146 120.146 117.429 2.717 25380
319 1 1 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.183 -0.190 25380
320 1 1 . 1 1 56 56 GLU C C 56 178.085 178.085 177.570 0.515 25380
321 1 1 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.474 0.314 25380
322 1 1 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.233 -1.637 25380
323 1 1 . 1 1 56 56 GLU H H 56 7.850 7.850 7.824 0.026 25380
324 1 1 . 1 1 57 57 LYS N N 57 115.940 115.940 119.378 -3.438 25380
325 1 1 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.431 -0.328 25380
326 1 1 . 1 1 57 57 LYS C C 57 176.225 176.225 176.183 0.042 25380
327 1 1 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.286 -0.714 25380
328 1 1 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.785 -1.749 25380
329 1 1 . 1 1 57 57 LYS H H 57 7.019 7.019 7.772 -0.753 25380
330 1 1 . 1 1 58 58 GLY N N 58 106.593 106.593 109.914 -3.321 25380
331 1 1 . 1 1 58 58 GLY C C 58 174.350 174.350 175.335 -0.985 25380
332 1 1 . 1 1 58 58 GLY CA C 58 45.500 45.500 44.854 0.646 25380
333 1 1 . 1 1 58 58 GLY H H 58 7.883 7.883 8.356 -0.473 25380
334 1 1 . 1 1 59 59 HIS N N 59 117.962 117.962 118.027 -0.065 25380
335 1 1 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.315 0.552 25380
336 1 1 . 1 1 59 59 HIS C C 59 173.271 173.271 176.131 -2.860 25380
337 1 1 . 1 1 59 59 HIS CA C 59 54.778 54.778 58.002 -3.224 25380
338 1 1 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.498 2.187 25380
339 1 1 . 1 1 59 59 HIS H H 59 8.218 8.218 8.245 -0.027 25380
340 1 1 . 1 1 60 60 THR N N 60 119.624 119.624 108.680 10.944 25380
341 1 1 . 1 1 60 60 THR HA H 60 4.430 4.430 4.773 -0.343 25380
342 1 1 . 1 1 60 60 THR C C 60 171.430 171.430 174.876 -3.446 25380
343 1 1 . 1 1 60 60 THR CA C 60 63.480 63.480 61.383 2.097 25380
344 1 1 . 1 1 60 60 THR CB C 60 69.761 69.761 70.700 -0.939 25380
345 1 1 . 1 1 60 60 THR H H 60 8.780 8.780 7.470 1.310 25380
346 1 1 . 1 1 61 61 ALA N N 61 126.706 126.706 121.437 5.269 25380
347 1 1 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.338 0.908 25380
348 1 1 . 1 1 61 61 ALA C C 61 174.753 174.753 176.263 -1.510 25380
349 1 1 . 1 1 61 61 ALA CA C 61 49.772 49.772 52.037 -2.265 25380
350 1 1 . 1 1 61 61 ALA CB C 61 22.889 22.889 21.315 1.574 25380
351 1 1 . 1 1 61 61 ALA H H 61 7.795 7.795 8.798 -1.003 25380
352 1 1 . 1 1 62 62 TYR N N 62 117.859 117.859 116.546 1.313 25380
353 1 1 . 1 1 62 62 TYR C C 62 173.431 173.431 173.618 -0.187 25380
354 1 1 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.265 -0.618 25380
355 1 1 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.770 -2.221 25380
356 1 1 . 1 1 62 62 TYR H H 62 8.711 8.711 8.017 0.694 25380
357 1 1 . 1 1 63 63 LEU N N 63 125.044 125.044 122.800 2.244 25380
358 1 1 . 1 1 63 63 LEU HA H 63 5.411 5.411 5.026 0.385 25380
359 1 1 . 1 1 63 63 LEU C C 63 175.319 175.319 174.734 0.585 25380
360 1 1 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.442 -0.212 25380
361 1 1 . 1 1 63 63 LEU CB C 63 45.701 45.701 45.341 0.360 25380
362 1 1 . 1 1 63 63 LEU H H 63 8.746 8.746 8.404 0.342 25380
363 1 1 . 1 1 64 64 ASP N N 64 125.463 125.463 123.911 1.552 25380
364 1 1 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.912 0.287 25380
365 1 1 . 1 1 64 64 ASP C C 64 174.512 174.512 174.163 0.349 25380
366 1 1 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.951 -0.251 25380
367 1 1 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.354 -0.400 25380
368 1 1 . 1 1 64 64 ASP H H 64 9.293 9.293 8.904 0.389 25380
369 1 1 . 1 1 65 65 GLU N N 65 120.711 120.711 119.702 1.009 25380
370 1 1 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.420 0.647 25380
371 1 1 . 1 1 65 65 GLU C C 65 175.652 175.652 176.533 -0.881 25380
372 1 1 . 1 1 65 65 GLU CA C 65 55.643 55.643 57.506 -1.863 25380
373 1 1 . 1 1 65 65 GLU CB C 65 30.455 30.455 30.705 -0.250 25380
374 1 1 . 1 1 65 65 GLU H H 65 8.715 8.715 8.501 0.214 25380
375 1 1 . 1 1 66 66 VAL N N 66 122.936 122.936 121.544 1.392 25380
376 1 1 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.069 0.361 25380
377 1 1 . 1 1 66 66 VAL C C 66 175.065 175.065 175.232 -0.167 25380
378 1 1 . 1 1 66 66 VAL CA C 66 60.991 60.991 61.941 -0.950 25380
379 1 1 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.538 1.742 25380
380 1 1 . 1 1 66 66 VAL H H 66 9.156 9.156 8.639 0.517 25380
381 1 1 . 1 1 67 67 ARG N N 67 126.104 126.104 128.211 -2.107 25380
382 1 1 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.374 0.167 25380
383 1 1 . 1 1 67 67 ARG C C 67 176.708 176.708 175.553 1.155 25380
384 1 1 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.321 0.759 25380
385 1 1 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.049 1.859 25380
386 1 1 . 1 1 67 67 ARG H H 67 8.734 8.734 8.629 0.105 25380
387 1 1 . 1 1 68 68 VAL N N 68 120.707 120.707 115.616 5.091 25380
388 1 1 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.393 -0.241 25380
389 1 1 . 1 1 68 68 VAL C C 68 175.931 175.931 176.455 -0.524 25380
390 1 1 . 1 1 68 68 VAL CA C 68 62.776 62.776 60.762 2.014 25380
391 1 1 . 1 1 68 68 VAL CB C 68 32.489 32.489 30.968 1.521 25380
392 1 1 . 1 1 68 68 VAL H H 68 8.384 8.384 7.528 0.856 25380
393 1 1 . 1 1 69 69 SER N N 69 116.156 116.156 118.221 -2.065 25380
394 1 1 . 1 1 69 69 SER HA H 69 4.693 4.693 4.304 0.389 25380
395 1 1 . 1 1 69 69 SER C C 69 174.544 174.544 176.603 -2.059 25380
396 1 1 . 1 1 69 69 SER CA C 69 57.754 57.754 61.459 -3.705 25380
397 1 1 . 1 1 69 69 SER CB C 69 64.831 64.831 62.709 2.122 25380
398 1 1 . 1 1 69 69 SER H H 69 8.067 8.067 7.685 0.382 25380
399 1 1 . 1 1 70 70 THR N N 70 110.753 110.753 112.081 -1.328 25380
400 1 1 . 1 1 70 70 THR HA H 70 4.152 4.152 4.078 0.074 25380
401 1 1 . 1 1 70 70 THR C C 70 174.865 174.865 175.492 -0.627 25380
402 1 1 . 1 1 70 70 THR CA C 70 63.831 63.831 64.684 -0.853 25380
403 1 1 . 1 1 70 70 THR CB C 70 68.956 68.956 68.471 0.485 25380
404 1 1 . 1 1 70 70 THR H H 70 8.095 8.095 7.985 0.110 25380
405 1 1 . 1 1 71 71 ASP N N 71 121.817 121.817 120.769 1.048 25380
406 1 1 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.595 -0.005 25380
407 1 1 . 1 1 71 71 ASP C C 71 176.746 176.746 176.924 -0.178 25380
408 1 1 . 1 1 71 71 ASP CA C 71 54.264 54.264 55.965 -1.701 25380
409 1 1 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.903 0.522 25380
410 1 1 . 1 1 71 71 ASP H H 71 8.076 8.076 8.514 -0.438 25380
411 1 1 . 1 1 72 72 GLU N N 72 123.635 123.635 116.409 7.226 25380
412 1 1 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.583 -0.590 25380
413 1 1 . 1 1 72 72 GLU C C 72 176.971 176.971 175.858 1.113 25380
414 1 1 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.603 1.615 25380
415 1 1 . 1 1 72 72 GLU CB C 72 29.702 29.702 31.826 -2.124 25380
416 1 1 . 1 1 72 72 GLU H H 72 8.514 8.514 8.168 0.346 25380
417 1 1 . 1 1 73 73 LYS N N 73 117.857 117.857 116.464 1.393 25380
418 1 1 . 1 1 73 73 LYS HA H 73 4.643 4.643 3.978 0.665 25380
419 1 1 . 1 1 73 73 LYS C C 73 176.508 176.508 175.606 0.902 25380
420 1 1 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.432 -0.352 25380
421 1 1 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.209 0.994 25380
422 1 1 . 1 1 73 73 LYS H H 73 8.423 8.423 8.162 0.261 25380
423 1 1 . 1 1 74 74 ASP N N 74 120.580 120.580 114.380 6.200 25380
424 1 1 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.891 -0.133 25380
425 1 1 . 1 1 74 74 ASP C C 74 174.059 174.059 175.246 -1.187 25380
426 1 1 . 1 1 74 74 ASP CA C 74 53.279 53.279 53.386 -0.107 25380
427 1 1 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.405 -0.827 25380
428 1 1 . 1 1 74 74 ASP H H 74 7.918 7.918 8.548 -0.630 25380
429 1 1 . 1 1 75 75 PHE N N 75 118.513 118.513 120.886 -2.373 25380
430 1 1 . 1 1 75 75 PHE HA H 75 5.363 5.363 4.913 0.450 25380
431 1 1 . 1 1 75 75 PHE C C 75 173.038 173.038 173.085 -0.047 25380
432 1 1 . 1 1 75 75 PHE CA C 75 55.522 55.522 56.565 -1.042 25380
433 1 1 . 1 1 75 75 PHE CB C 75 41.714 41.714 40.599 1.115 25380
434 1 1 . 1 1 75 75 PHE H H 75 7.397 7.397 7.928 -0.531 25380
435 1 1 . 1 1 76 76 LEU N N 76 116.773 116.773 128.875 -12.102 25380
436 1 1 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.782 -0.139 25380
437 1 1 . 1 1 76 76 LEU C C 76 177.553 177.553 174.718 2.835 25380
438 1 1 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.046 -0.427 25380
439 1 1 . 1 1 76 76 LEU CB C 76 45.701 45.701 44.617 1.084 25380
440 1 1 . 1 1 76 76 LEU H H 76 8.774 8.774 8.926 -0.152 25380
441 1 1 . 1 1 77 77 TYR N N 77 118.377 118.377 126.542 -8.165 25380
442 1 1 . 1 1 77 77 TYR HA H 77 5.415 5.415 5.055 0.360 25380
443 1 1 . 1 1 77 77 TYR C C 77 175.479 175.479 173.220 2.259 25380
444 1 1 . 1 1 77 77 TYR CA C 77 58.391 58.391 55.569 2.822 25380
445 1 1 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.724 0.376 25380
446 1 1 . 1 1 77 77 TYR H H 77 8.589 8.589 9.541 -0.952 25380
447 1 1 . 1 1 78 78 GLU N N 78 123.875 123.875 129.406 -5.531 25380
448 1 1 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.539 0.434 25380
449 1 1 . 1 1 78 78 GLU C C 78 174.120 174.120 173.398 0.722 25380
450 1 1 . 1 1 78 78 GLU CA C 78 54.378 54.378 54.237 0.141 25380
451 1 1 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.049 -0.409 25380
452 1 1 . 1 1 78 78 GLU H H 78 9.576 9.576 8.877 0.699 25380
453 1 1 . 1 1 79 79 LEU N N 79 128.661 128.661 126.730 1.931 25380
454 1 1 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.328 0.961 25380
455 1 1 . 1 1 79 79 LEU C C 79 174.219 174.219 175.365 -1.146 25380
456 1 1 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.594 -0.445 25380
457 1 1 . 1 1 79 79 LEU CB C 79 46.630 46.630 43.913 2.717 25380
458 1 1 . 1 1 79 79 LEU H H 79 9.139 9.139 8.793 0.346 25380
459 1 1 . 1 1 80 80 HIS N N 80 124.886 124.886 122.208 2.678 25380
460 1 1 . 1 1 80 80 HIS HA H 80 5.430 5.430 5.000 0.430 25380
461 1 1 . 1 1 80 80 HIS C C 80 173.346 173.346 175.335 -1.989 25380
462 1 1 . 1 1 80 80 HIS CA C 80 53.149 53.149 55.126 -1.976 25380
463 1 1 . 1 1 80 80 HIS CB C 80 30.768 30.768 32.032 -1.264 25380
464 1 1 . 1 1 80 80 HIS H H 80 8.897 8.897 9.076 -0.179 25380
465 1 1 . 1 1 81 81 ILE N N 81 125.173 125.173 121.319 3.854 25380
466 1 1 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.626 0.664 25380
467 1 1 . 1 1 81 81 ILE C C 81 174.600 174.600 175.484 -0.884 25380
468 1 1 . 1 1 81 81 ILE CA C 81 60.500 60.500 62.025 -1.524 25380
469 1 1 . 1 1 81 81 ILE CB C 81 39.700 39.700 35.750 3.950 25380
470 1 1 . 1 1 81 81 ILE H H 81 8.909 8.909 8.555 0.354 25380
471 1 2 . 1 1 2 2 HIS N N 2 120.430 120.430 118.084 2.346 25380
472 1 2 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.298 0.437 25380
473 1 2 . 1 1 2 2 HIS C C 2 173.884 173.884 174.940 -1.056 25380
474 1 2 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.981 -1.929 25380
475 1 2 . 1 1 2 2 HIS CB C 2 28.666 28.666 28.512 0.154 25380
476 1 2 . 1 1 2 2 HIS H H 2 8.678 8.678 8.545 0.133 25380
477 1 2 . 1 1 3 3 MET N N 3 122.377 122.377 118.226 4.151 25380
478 1 2 . 1 1 3 3 MET HA H 3 4.207 4.207 4.292 -0.085 25380
479 1 2 . 1 1 3 3 MET C C 3 174.584 174.584 176.773 -2.189 25380
480 1 2 . 1 1 3 3 MET CA C 3 56.550 56.550 56.621 -0.071 25380
481 1 2 . 1 1 3 3 MET CB C 3 33.426 33.426 32.967 0.459 25380
482 1 2 . 1 1 3 3 MET H H 3 8.240 8.240 7.990 0.250 25380
483 1 2 . 1 1 4 4 LYS N N 4 123.568 123.568 115.198 8.370 25380
484 1 2 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.098 0.741 25380
485 1 2 . 1 1 4 4 LYS C C 4 175.906 175.906 174.577 1.329 25380
486 1 2 . 1 1 4 4 LYS CA C 4 54.800 54.800 56.652 -1.852 25380
487 1 2 . 1 1 4 4 LYS CB C 4 34.900 34.900 30.735 4.165 25380
488 1 2 . 1 1 4 4 LYS H H 4 8.351 8.351 8.590 -0.239 25380
489 1 2 . 1 1 5 5 LEU N N 5 123.568 123.568 112.259 11.309 25380
490 1 2 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.807 -0.968 25380
491 1 2 . 1 1 5 5 LEU C C 5 175.900 175.900 175.637 0.263 25380
492 1 2 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.702 -0.352 25380
493 1 2 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.691 0.209 25380
494 1 2 . 1 1 5 5 LEU H H 5 8.281 8.281 7.458 0.823 25380
495 1 2 . 1 1 6 6 VAL N N 6 121.564 121.564 122.289 -0.725 25380
496 1 2 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.505 -0.079 25380
497 1 2 . 1 1 6 6 VAL C C 6 178.200 178.200 175.035 3.165 25380
498 1 2 . 1 1 6 6 VAL CA C 6 63.200 63.200 61.506 1.694 25380
499 1 2 . 1 1 6 6 VAL CB C 6 33.200 33.200 33.328 -0.128 25380
500 1 2 . 1 1 6 6 VAL H H 6 9.276 9.276 9.148 0.128 25380
501 1 2 . 1 1 7 7 LEU N N 7 121.564 121.564 127.474 -5.910 25380
502 1 2 . 1 1 7 7 LEU HA H 7 4.426 4.426 4.539 -0.113 25380
503 1 2 . 1 1 7 7 LEU CA C 7 63.200 63.200 54.375 8.825 25380
504 1 2 . 1 1 7 7 LEU CB C 7 33.200 33.200 42.476 -9.276 25380
505 1 2 . 1 1 7 7 LEU H H 7 9.276 9.276 8.634 0.642 25380
506 1 2 . 1 1 8 8 ALA C C 8 177.040 177.040 177.667 -0.627 25380
507 1 2 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.612 -0.911 25380
508 1 2 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.651 1.213 25380
509 1 2 . 1 1 9 9 LYS N N 9 119.845 119.845 125.078 -5.233 25380
510 1 2 . 1 1 9 9 LYS HA H 9 4.128 4.128 3.913 0.215 25380
511 1 2 . 1 1 9 9 LYS C C 9 176.075 176.075 178.388 -2.313 25380
512 1 2 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.716 -2.955 25380
513 1 2 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.580 0.339 25380
514 1 2 . 1 1 9 9 LYS H H 9 8.545 8.545 8.817 -0.272 25380
515 1 2 . 1 1 10 10 ASN N N 10 119.279 119.279 117.372 1.907 25380
516 1 2 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.492 0.153 25380
517 1 2 . 1 1 10 10 ASN C C 10 175.443 175.443 177.334 -1.891 25380
518 1 2 . 1 1 10 10 ASN CA C 10 53.657 53.657 56.028 -2.371 25380
519 1 2 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.815 0.962 25380
520 1 2 . 1 1 10 10 ASN H H 10 8.592 8.592 8.455 0.137 25380
521 1 2 . 1 1 11 11 THR N N 11 111.876 111.876 110.819 1.057 25380
522 1 2 . 1 1 11 11 THR HA H 11 4.311 4.311 4.260 0.051 25380
523 1 2 . 1 1 11 11 THR C C 11 174.666 174.666 175.692 -1.026 25380
524 1 2 . 1 1 11 11 THR CA C 11 62.044 62.044 63.962 -1.918 25380
525 1 2 . 1 1 11 11 THR CB C 11 69.895 69.895 69.105 0.790 25380
526 1 2 . 1 1 11 11 THR H H 11 8.058 8.058 8.353 -0.295 25380
527 1 2 . 1 1 12 12 ARG N N 12 121.152 121.152 119.576 1.576 25380
528 1 2 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.436 -0.174 25380
529 1 2 . 1 1 12 12 ARG C C 12 176.714 176.714 176.017 0.697 25380
530 1 2 . 1 1 12 12 ARG CA C 12 56.822 56.822 55.702 1.120 25380
531 1 2 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.283 -0.581 25380
532 1 2 . 1 1 12 12 ARG H H 12 8.291 8.291 7.555 0.736 25380
533 1 2 . 1 1 13 13 LYS N N 13 120.459 120.459 118.593 1.866 25380
534 1 2 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.031 -0.135 25380
535 1 2 . 1 1 13 13 LYS C C 13 176.682 176.682 176.438 0.244 25380
536 1 2 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.464 -0.486 25380
537 1 2 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.470 2.028 25380
538 1 2 . 1 1 13 13 LYS H H 13 8.286 8.286 8.421 -0.135 25380
539 1 2 . 1 1 14 14 SER N N 14 114.568 114.568 114.725 -0.157 25380
540 1 2 . 1 1 14 14 SER HA H 14 4.371 4.371 4.404 -0.033 25380
541 1 2 . 1 1 14 14 SER C C 14 173.990 173.990 174.963 -0.973 25380
542 1 2 . 1 1 14 14 SER CA C 14 58.617 58.617 58.690 -0.073 25380
543 1 2 . 1 1 14 14 SER CB C 14 63.933 63.933 63.912 0.021 25380
544 1 2 . 1 1 14 14 SER H H 14 7.957 7.957 8.267 -0.310 25380
545 1 2 . 1 1 15 15 ASP N N 15 121.565 121.565 120.227 1.338 25380
546 1 2 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.750 -0.149 25380
547 1 2 . 1 1 15 15 ASP C C 15 175.684 175.684 176.461 -0.777 25380
548 1 2 . 1 1 15 15 ASP CA C 15 54.149 54.149 54.069 0.079 25380
549 1 2 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.531 0.698 25380
550 1 2 . 1 1 15 15 ASP H H 15 8.166 8.166 8.495 -0.329 25380
551 1 2 . 1 1 16 16 ALA N N 16 124.173 124.173 122.573 1.600 25380
552 1 2 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.114 0.257 25380
553 1 2 . 1 1 16 16 ALA C C 16 177.184 177.184 177.709 -0.525 25380
554 1 2 . 1 1 16 16 ALA CA C 16 52.337 52.337 53.161 -0.824 25380
555 1 2 . 1 1 16 16 ALA CB C 16 19.359 19.359 19.005 0.354 25380
556 1 2 . 1 1 16 16 ALA H H 16 8.163 8.163 8.156 0.007 25380
557 1 2 . 1 1 17 17 LYS N N 17 121.152 121.152 118.935 2.217 25380
558 1 2 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.149 0.277 25380
559 1 2 . 1 1 17 17 LYS C C 17 175.488 175.488 176.504 -1.016 25380
560 1 2 . 1 1 17 17 LYS CA C 17 56.205 56.205 57.073 -0.868 25380
561 1 2 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.768 1.528 25380
562 1 2 . 1 1 17 17 LYS H H 17 8.363 8.363 7.815 0.548 25380
563 1 2 . 1 1 18 18 SER N N 18 116.448 116.448 115.664 0.784 25380
564 1 2 . 1 1 18 18 SER HA H 18 5.355 5.355 4.129 1.226 25380
565 1 2 . 1 1 18 18 SER C C 18 173.887 173.887 175.262 -1.375 25380
566 1 2 . 1 1 18 18 SER CA C 18 57.248 57.248 59.363 -2.115 25380
567 1 2 . 1 1 18 18 SER CB C 18 64.962 64.962 62.518 2.444 25380
568 1 2 . 1 1 18 18 SER H H 18 8.206 8.206 8.960 -0.754 25380
569 1 2 . 1 1 19 19 VAL N N 19 117.867 117.867 120.507 -2.640 25380
570 1 2 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.658 -0.038 25380
571 1 2 . 1 1 19 19 VAL C C 19 174.169 174.169 176.547 -2.378 25380
572 1 2 . 1 1 19 19 VAL CA C 19 59.546 59.546 65.684 -6.138 25380
573 1 2 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.838 4.064 25380
574 1 2 . 1 1 19 19 VAL H H 19 9.086 9.086 7.809 1.277 25380
575 1 2 . 1 1 20 20 GLU N N 20 120.843 120.843 119.800 1.043 25380
576 1 2 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.162 0.706 25380
577 1 2 . 1 1 20 20 GLU C C 20 178.747 178.747 178.611 0.136 25380
578 1 2 . 1 1 20 20 GLU CA C 20 54.552 54.552 60.113 -5.561 25380
579 1 2 . 1 1 20 20 GLU CB C 20 31.099 31.099 29.346 1.753 25380
580 1 2 . 1 1 20 20 GLU H H 20 8.841 8.841 8.770 0.071 25380
581 1 2 . 1 1 21 21 LEU N N 21 122.653 122.653 119.333 3.320 25380
582 1 2 . 1 1 21 21 LEU HA H 21 3.443 3.443 4.018 -0.575 25380
583 1 2 . 1 1 21 21 LEU C C 21 178.799 178.799 179.047 -0.248 25380
584 1 2 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.569 1.138 25380
585 1 2 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.675 -3.103 25380
586 1 2 . 1 1 21 21 LEU H H 21 8.744 8.744 7.410 1.334 25380
587 1 2 . 1 1 22 22 GLU N N 22 115.392 115.392 119.852 -4.460 25380
588 1 2 . 1 1 22 22 GLU HA H 22 3.989 3.989 4.066 -0.077 25380
589 1 2 . 1 1 22 22 GLU C C 22 179.328 179.328 179.242 0.086 25380
590 1 2 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.852 0.228 25380
591 1 2 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.544 -0.710 25380
592 1 2 . 1 1 22 22 GLU H H 22 8.744 8.744 7.688 1.056 25380
593 1 2 . 1 1 23 23 ASP N N 23 118.597 118.597 121.147 -2.550 25380
594 1 2 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.545 0.066 25380
595 1 2 . 1 1 23 23 ASP C C 23 179.139 179.139 178.944 0.195 25380
596 1 2 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.380 0.139 25380
597 1 2 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.619 -0.177 25380
598 1 2 . 1 1 23 23 ASP H H 23 7.098 7.098 8.611 -1.513 25380
599 1 2 . 1 1 24 24 LEU N N 24 119.869 119.869 121.181 -1.312 25380
600 1 2 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.769 0.165 25380
601 1 2 . 1 1 24 24 LEU C C 24 179.045 179.045 179.038 0.007 25380
602 1 2 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.378 -0.829 25380
603 1 2 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.688 -0.139 25380
604 1 2 . 1 1 24 24 LEU H H 24 7.576 7.576 8.575 -0.999 25380
605 1 2 . 1 1 25 25 TYR N N 25 118.100 118.100 117.202 0.898 25380
606 1 2 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.121 1.246 25380
607 1 2 . 1 1 25 25 TYR C C 25 177.945 177.945 178.450 -0.505 25380
608 1 2 . 1 1 25 25 TYR CA C 25 62.606 62.606 62.311 0.295 25380
609 1 2 . 1 1 25 25 TYR CB C 25 37.948 37.948 37.902 0.046 25380
610 1 2 . 1 1 25 25 TYR H H 25 8.320 8.320 7.527 0.793 25380
611 1 2 . 1 1 26 26 HIS N N 26 119.440 119.440 117.918 1.522 25380
612 1 2 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.726 -0.355 25380
613 1 2 . 1 1 26 26 HIS C C 26 176.559 176.559 178.095 -1.536 25380
614 1 2 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.000 0.519 25380
615 1 2 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.028 -1.900 25380
616 1 2 . 1 1 26 26 HIS H H 26 8.383 8.383 8.712 -0.329 25380
617 1 2 . 1 1 27 27 GLU N N 27 119.915 119.915 121.938 -2.023 25380
618 1 2 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.060 0.198 25380
619 1 2 . 1 1 27 27 GLU C C 27 179.163 179.163 178.537 0.626 25380
620 1 2 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.532 0.542 25380
621 1 2 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.686 -0.152 25380
622 1 2 . 1 1 27 27 GLU H H 27 8.288 8.288 9.028 -0.740 25380
623 1 2 . 1 1 28 28 PHE N N 28 120.500 120.500 120.710 -0.210 25380
624 1 2 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.375 0.597 25380
625 1 2 . 1 1 28 28 PHE C C 28 177.386 177.386 177.298 0.088 25380
626 1 2 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.831 -0.430 25380
627 1 2 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.314 0.254 25380
628 1 2 . 1 1 28 28 PHE H H 28 8.568 8.568 7.965 0.603 25380
629 1 2 . 1 1 29 29 SER N N 29 114.306 114.306 114.354 -0.048 25380
630 1 2 . 1 1 29 29 SER HA H 29 4.288 4.288 4.393 -0.105 25380
631 1 2 . 1 1 29 29 SER C C 29 175.656 175.656 176.494 -0.838 25380
632 1 2 . 1 1 29 29 SER CA C 29 61.058 61.058 60.597 0.461 25380
633 1 2 . 1 1 29 29 SER CB C 29 63.555 63.555 63.700 -0.145 25380
634 1 2 . 1 1 29 29 SER H H 29 8.479 8.479 8.033 0.446 25380
635 1 2 . 1 1 30 30 GLU N N 30 118.322 118.322 120.579 -2.257 25380
636 1 2 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.336 -0.244 25380
637 1 2 . 1 1 30 30 GLU C C 30 177.312 177.312 176.542 0.770 25380
638 1 2 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.902 -0.322 25380
639 1 2 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.801 -1.224 25380
640 1 2 . 1 1 30 30 GLU H H 30 8.428 8.428 8.081 0.347 25380
641 1 2 . 1 1 31 31 ASP N N 31 115.630 115.630 117.566 -1.936 25380
642 1 2 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.906 -0.096 25380
643 1 2 . 1 1 31 31 ASP C C 31 175.723 175.723 173.806 1.917 25380
644 1 2 . 1 1 31 31 ASP CA C 31 53.974 53.974 53.057 0.917 25380
645 1 2 . 1 1 31 31 ASP CB C 31 40.818 40.818 43.868 -3.050 25380
646 1 2 . 1 1 31 31 ASP H H 31 7.303 7.303 8.043 -0.740 25380
647 1 2 . 1 1 32 32 LYS N N 32 114.357 114.357 121.366 -7.009 25380
648 1 2 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.508 -0.681 25380
649 1 2 . 1 1 32 32 LYS C C 32 175.716 175.716 175.691 0.025 25380
650 1 2 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.556 0.606 25380
651 1 2 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.705 -5.324 25380
652 1 2 . 1 1 32 32 LYS H H 32 7.148 7.148 8.365 -1.217 25380
653 1 2 . 1 1 33 33 ARG N N 33 120.929 120.929 124.961 -4.032 25380
654 1 2 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.685 -0.484 25380
655 1 2 . 1 1 33 33 ARG C C 33 173.982 173.982 173.671 0.311 25380
656 1 2 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.109 1.085 25380
657 1 2 . 1 1 33 33 ARG CB C 33 30.642 30.642 34.242 -3.600 25380
658 1 2 . 1 1 33 33 ARG H H 33 7.388 7.388 8.750 -1.362 25380
659 1 2 . 1 1 34 34 SER N N 34 115.867 115.867 114.184 1.683 25380
660 1 2 . 1 1 34 34 SER HA H 34 5.355 5.355 4.493 0.862 25380
661 1 2 . 1 1 34 34 SER C C 34 172.754 172.754 172.479 0.275 25380
662 1 2 . 1 1 34 34 SER CA C 34 58.236 58.236 57.037 1.199 25380
663 1 2 . 1 1 34 34 SER CB C 34 65.212 65.212 66.180 -0.968 25380
664 1 2 . 1 1 34 34 SER H H 34 8.173 8.173 8.343 -0.170 25380
665 1 2 . 1 1 35 35 ILE N N 35 119.621 119.621 120.704 -1.083 25380
666 1 2 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.707 0.156 25380
667 1 2 . 1 1 35 35 ILE C C 35 174.069 174.069 173.550 0.519 25380
668 1 2 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.230 0.726 25380
669 1 2 . 1 1 35 35 ILE CB C 35 40.655 40.655 42.299 -1.644 25380
670 1 2 . 1 1 35 35 ILE H H 35 6.779 6.779 8.619 -1.840 25380
671 1 2 . 1 1 36 36 PHE N N 36 124.305 124.305 126.963 -2.658 25380
672 1 2 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.371 -0.918 25380
673 1 2 . 1 1 36 36 PHE C C 36 173.204 173.204 174.746 -1.542 25380
674 1 2 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.770 -0.354 25380
675 1 2 . 1 1 36 36 PHE CB C 36 44.817 44.817 40.759 4.058 25380
676 1 2 . 1 1 36 36 PHE H H 36 8.411 8.411 9.390 -0.979 25380
677 1 2 . 1 1 37 37 TYR N N 37 118.743 118.743 126.102 -7.359 25380
678 1 2 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.326 0.244 25380
679 1 2 . 1 1 37 37 TYR C C 37 175.455 175.455 173.754 1.701 25380
680 1 2 . 1 1 37 37 TYR CA C 37 56.518 56.518 56.176 0.342 25380
681 1 2 . 1 1 37 37 TYR CB C 37 40.991 40.991 40.943 0.048 25380
682 1 2 . 1 1 37 37 TYR H H 37 8.353 8.353 9.363 -1.010 25380
683 1 2 . 1 1 38 38 PHE N N 38 119.236 119.236 128.872 -9.636 25380
684 1 2 . 1 1 38 38 PHE HA H 38 5.160 5.160 5.355 -0.195 25380
685 1 2 . 1 1 38 38 PHE C C 38 174.650 174.650 173.913 0.737 25380
686 1 2 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.707 1.135 25380
687 1 2 . 1 1 38 38 PHE CB C 38 42.619 42.619 38.395 4.224 25380
688 1 2 . 1 1 38 38 PHE H H 38 9.756 9.756 8.850 0.906 25380
689 1 2 . 1 1 39 39 ALA N N 39 122.516 122.516 124.545 -2.029 25380
690 1 2 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.738 -0.198 25380
691 1 2 . 1 1 39 39 ALA C C 39 177.042 177.042 174.169 2.873 25380
692 1 2 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.101 1.742 25380
693 1 2 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.345 -2.767 25380
694 1 2 . 1 1 39 39 ALA H H 39 7.738 7.738 8.792 -1.054 25380
695 1 2 . 1 1 40 40 PRO C C 40 175.411 175.411 177.415 -2.004 25380
696 1 2 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.998 1.290 25380
697 1 2 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.276 -1.172 25380
698 1 2 . 1 1 41 41 THR N N 41 105.878 105.878 119.025 -13.147 25380
699 1 2 . 1 1 41 41 THR HA H 41 4.190 4.190 4.028 0.162 25380
700 1 2 . 1 1 41 41 THR C C 41 176.400 176.400 175.259 1.141 25380
701 1 2 . 1 1 41 41 THR CA C 41 61.937 61.937 65.401 -3.464 25380
702 1 2 . 1 1 41 41 THR CB C 41 68.331 68.331 68.543 -0.212 25380
703 1 2 . 1 1 41 41 THR H H 41 6.715 6.715 8.432 -1.717 25380
704 1 2 . 1 1 42 42 ASN N N 42 118.863 118.863 118.528 0.335 25380
705 1 2 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.436 0.099 25380
706 1 2 . 1 1 42 42 ASN C C 42 173.764 173.764 175.788 -2.024 25380
707 1 2 . 1 1 42 42 ASN CA C 42 54.176 54.176 54.660 -0.484 25380
708 1 2 . 1 1 42 42 ASN CB C 42 41.715 41.715 38.049 3.666 25380
709 1 2 . 1 1 42 42 ASN H H 42 7.153 7.153 8.109 -0.956 25380
710 1 2 . 1 1 43 43 ALA N N 43 126.174 126.174 118.744 7.430 25380
711 1 2 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.402 0.023 25380
712 1 2 . 1 1 43 43 ALA C C 43 179.308 179.308 176.837 2.471 25380
713 1 2 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.376 -0.394 25380
714 1 2 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.645 -1.351 25380
715 1 2 . 1 1 43 43 ALA H H 43 9.465 9.465 7.593 1.872 25380
716 1 2 . 1 1 44 44 HIS N N 44 126.251 126.251 116.128 10.123 25380
717 1 2 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.341 -0.514 25380
718 1 2 . 1 1 44 44 HIS C C 44 177.407 177.407 175.239 2.168 25380
719 1 2 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.833 4.192 25380
720 1 2 . 1 1 44 44 HIS CB C 44 28.630 28.630 26.814 1.816 25380
721 1 2 . 1 1 44 44 HIS H H 44 9.407 9.407 7.752 1.655 25380
722 1 2 . 1 1 45 45 LYS N N 45 114.990 114.990 119.866 -4.876 25380
723 1 2 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.208 -0.325 25380
724 1 2 . 1 1 45 45 LYS C C 45 178.284 178.284 177.394 0.890 25380
725 1 2 . 1 1 45 45 LYS CA C 45 59.249 59.249 58.998 0.251 25380
726 1 2 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.834 -1.000 25380
727 1 2 . 1 1 45 45 LYS H H 45 8.960 8.960 8.164 0.796 25380
728 1 2 . 1 1 46 46 ASP N N 46 120.411 120.411 119.513 0.898 25380
729 1 2 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.537 -0.111 25380
730 1 2 . 1 1 46 46 ASP C C 46 177.773 177.773 178.381 -0.608 25380
731 1 2 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.260 -0.244 25380
732 1 2 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.168 -0.271 25380
733 1 2 . 1 1 46 46 ASP H H 46 6.777 6.777 8.677 -1.900 25380
734 1 2 . 1 1 47 47 MET N N 47 118.178 118.178 119.305 -1.127 25380
735 1 2 . 1 1 47 47 MET HA H 47 3.879 3.879 4.539 -0.660 25380
736 1 2 . 1 1 47 47 MET C C 47 179.499 179.499 177.721 1.778 25380
737 1 2 . 1 1 47 47 MET CA C 47 56.052 56.052 59.170 -3.118 25380
738 1 2 . 1 1 47 47 MET CB C 47 29.601 29.601 32.742 -3.141 25380
739 1 2 . 1 1 47 47 MET H H 47 7.367 7.367 8.115 -0.748 25380
740 1 2 . 1 1 48 48 LEU N N 48 117.665 117.665 120.636 -2.971 25380
741 1 2 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.936 -0.089 25380
742 1 2 . 1 1 48 48 LEU C C 48 179.843 179.843 178.217 1.626 25380
743 1 2 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.143 -0.563 25380
744 1 2 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.652 -0.699 25380
745 1 2 . 1 1 48 48 LEU H H 48 7.672 7.672 7.708 -0.036 25380
746 1 2 . 1 1 49 49 LYS N N 49 119.326 119.326 118.669 0.657 25380
747 1 2 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.660 0.467 25380
748 1 2 . 1 1 49 49 LYS C C 49 179.684 179.684 178.554 1.130 25380
749 1 2 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.362 -0.563 25380
750 1 2 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.965 -0.512 25380
751 1 2 . 1 1 49 49 LYS H H 49 7.420 7.420 7.778 -0.358 25380
752 1 2 . 1 1 50 50 ALA N N 50 122.022 122.022 122.958 -0.936 25380
753 1 2 . 1 1 50 50 ALA HA H 50 4.043 4.043 4.127 -0.084 25380
754 1 2 . 1 1 50 50 ALA C C 50 178.818 178.818 179.373 -0.555 25380
755 1 2 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.980 0.189 25380
756 1 2 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.998 -0.698 25380
757 1 2 . 1 1 50 50 ALA H H 50 7.551 7.551 7.792 -0.241 25380
758 1 2 . 1 1 51 51 VAL N N 51 118.165 118.165 117.773 0.392 25380
759 1 2 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.551 -0.109 25380
760 1 2 . 1 1 51 51 VAL C C 51 178.646 178.646 178.018 0.628 25380
761 1 2 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.329 0.878 25380
762 1 2 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.836 0.617 25380
763 1 2 . 1 1 51 51 VAL H H 51 7.226 7.226 7.528 -0.302 25380
764 1 2 . 1 1 52 52 ASP N N 52 122.298 122.298 120.762 1.536 25380
765 1 2 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.368 0.003 25380
766 1 2 . 1 1 52 52 ASP C C 52 177.898 177.898 179.130 -1.232 25380
767 1 2 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.215 0.355 25380
768 1 2 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.194 0.192 25380
769 1 2 . 1 1 52 52 ASP H H 52 8.232 8.232 7.531 0.701 25380
770 1 2 . 1 1 53 53 PHE N N 53 121.541 121.541 119.747 1.794 25380
771 1 2 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.471 -0.150 25380
772 1 2 . 1 1 53 53 PHE C C 53 177.224 177.224 177.997 -0.773 25380
773 1 2 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.855 2.225 25380
774 1 2 . 1 1 53 53 PHE CB C 53 39.700 39.700 38.068 1.632 25380
775 1 2 . 1 1 53 53 PHE H H 53 8.240 8.240 7.903 0.337 25380
776 1 2 . 1 1 54 54 PHE N N 54 115.925 115.925 120.256 -4.331 25380
777 1 2 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.015 -0.360 25380
778 1 2 . 1 1 54 54 PHE C C 54 178.269 178.269 176.451 1.818 25380
779 1 2 . 1 1 54 54 PHE CA C 54 64.200 64.200 61.566 2.634 25380
780 1 2 . 1 1 54 54 PHE CB C 54 38.578 38.578 39.313 -0.735 25380
781 1 2 . 1 1 54 54 PHE H H 54 7.755 7.755 7.908 -0.153 25380
782 1 2 . 1 1 55 55 LYS N N 55 120.251 120.251 118.153 2.098 25380
783 1 2 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.007 0.419 25380
784 1 2 . 1 1 55 55 LYS C C 55 181.484 181.484 178.761 2.723 25380
785 1 2 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.537 1.092 25380
786 1 2 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.424 -0.685 25380
787 1 2 . 1 1 55 55 LYS H H 55 8.213 8.213 7.541 0.672 25380
788 1 2 . 1 1 56 56 GLU N N 56 120.146 120.146 117.881 2.265 25380
789 1 2 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.135 -0.142 25380
790 1 2 . 1 1 56 56 GLU C C 56 178.085 178.085 177.047 1.038 25380
791 1 2 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.659 0.129 25380
792 1 2 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.235 -1.639 25380
793 1 2 . 1 1 56 56 GLU H H 56 7.850 7.850 7.814 0.036 25380
794 1 2 . 1 1 57 57 LYS N N 57 115.940 115.940 118.944 -3.004 25380
795 1 2 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.372 -0.269 25380
796 1 2 . 1 1 57 57 LYS C C 57 176.225 176.225 176.489 -0.264 25380
797 1 2 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.035 -0.463 25380
798 1 2 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.657 -1.621 25380
799 1 2 . 1 1 57 57 LYS H H 57 7.019 7.019 7.654 -0.635 25380
800 1 2 . 1 1 58 58 GLY N N 58 106.593 106.593 110.959 -4.366 25380
801 1 2 . 1 1 58 58 GLY C C 58 174.350 174.350 174.644 -0.294 25380
802 1 2 . 1 1 58 58 GLY CA C 58 45.500 45.500 44.564 0.936 25380
803 1 2 . 1 1 58 58 GLY H H 58 7.883 7.883 8.392 -0.509 25380
804 1 2 . 1 1 59 59 HIS N N 59 117.962 117.962 117.598 0.364 25380
805 1 2 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.519 0.348 25380
806 1 2 . 1 1 59 59 HIS C C 59 173.271 173.271 175.832 -2.561 25380
807 1 2 . 1 1 59 59 HIS CA C 59 54.778 54.778 57.357 -2.579 25380
808 1 2 . 1 1 59 59 HIS CB C 59 31.685 31.685 30.140 1.545 25380
809 1 2 . 1 1 59 59 HIS H H 59 8.218 8.218 7.406 0.812 25380
810 1 2 . 1 1 60 60 THR N N 60 119.624 119.624 114.924 4.700 25380
811 1 2 . 1 1 60 60 THR HA H 60 4.430 4.430 4.238 0.192 25380
812 1 2 . 1 1 60 60 THR C C 60 171.430 171.430 174.189 -2.759 25380
813 1 2 . 1 1 60 60 THR CA C 60 63.480 63.480 63.617 -0.137 25380
814 1 2 . 1 1 60 60 THR CB C 60 69.761 69.761 69.710 0.051 25380
815 1 2 . 1 1 60 60 THR H H 60 8.780 8.780 7.677 1.103 25380
816 1 2 . 1 1 61 61 ALA N N 61 126.706 126.706 128.327 -1.621 25380
817 1 2 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.360 0.886 25380
818 1 2 . 1 1 61 61 ALA C C 61 174.753 174.753 177.024 -2.271 25380
819 1 2 . 1 1 61 61 ALA CA C 61 49.772 49.772 53.739 -3.967 25380
820 1 2 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.235 2.654 25380
821 1 2 . 1 1 61 61 ALA H H 61 7.795 7.795 9.011 -1.216 25380
822 1 2 . 1 1 62 62 TYR N N 62 117.859 117.859 115.461 2.398 25380
823 1 2 . 1 1 62 62 TYR C C 62 173.431 173.431 173.006 0.425 25380
824 1 2 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.484 -0.838 25380
825 1 2 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.466 -1.917 25380
826 1 2 . 1 1 62 62 TYR H H 62 8.711 8.711 7.956 0.755 25380
827 1 2 . 1 1 63 63 LEU N N 63 125.044 125.044 124.873 0.171 25380
828 1 2 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.293 1.118 25380
829 1 2 . 1 1 63 63 LEU C C 63 175.319 175.319 173.794 1.525 25380
830 1 2 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.266 -0.035 25380
831 1 2 . 1 1 63 63 LEU CB C 63 45.701 45.701 43.647 2.054 25380
832 1 2 . 1 1 63 63 LEU H H 63 8.746 8.746 7.053 1.693 25380
833 1 2 . 1 1 64 64 ASP N N 64 125.463 125.463 124.978 0.485 25380
834 1 2 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.791 0.408 25380
835 1 2 . 1 1 64 64 ASP C C 64 174.512 174.512 174.620 -0.108 25380
836 1 2 . 1 1 64 64 ASP CA C 64 52.700 52.700 51.818 0.882 25380
837 1 2 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.729 -0.775 25380
838 1 2 . 1 1 64 64 ASP H H 64 9.293 9.293 8.603 0.690 25380
839 1 2 . 1 1 65 65 GLU N N 65 120.711 120.711 120.782 -0.071 25380
840 1 2 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.228 0.839 25380
841 1 2 . 1 1 65 65 GLU C C 65 175.652 175.652 176.506 -0.854 25380
842 1 2 . 1 1 65 65 GLU CA C 65 55.643 55.643 57.270 -1.627 25380
843 1 2 . 1 1 65 65 GLU CB C 65 30.455 30.455 30.628 -0.173 25380
844 1 2 . 1 1 65 65 GLU H H 65 8.715 8.715 8.535 0.180 25380
845 1 2 . 1 1 66 66 VAL N N 66 122.936 122.936 116.606 6.330 25380
846 1 2 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.358 0.072 25380
847 1 2 . 1 1 66 66 VAL C C 66 175.065 175.065 176.206 -1.141 25380
848 1 2 . 1 1 66 66 VAL CA C 66 60.991 60.991 60.924 0.067 25380
849 1 2 . 1 1 66 66 VAL CB C 66 34.280 34.280 33.691 0.589 25380
850 1 2 . 1 1 66 66 VAL H H 66 9.156 9.156 8.197 0.959 25380
851 1 2 . 1 1 67 67 ARG N N 67 126.104 126.104 120.264 5.840 25380
852 1 2 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.340 0.201 25380
853 1 2 . 1 1 67 67 ARG C C 67 176.708 176.708 176.745 -0.037 25380
854 1 2 . 1 1 67 67 ARG CA C 67 56.080 56.080 56.239 -0.158 25380
855 1 2 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.251 1.657 25380
856 1 2 . 1 1 67 67 ARG H H 67 8.734 8.734 8.680 0.054 25380
857 1 2 . 1 1 68 68 VAL N N 68 120.707 120.707 115.272 5.435 25380
858 1 2 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.377 -0.225 25380
859 1 2 . 1 1 68 68 VAL C C 68 175.931 175.931 176.461 -0.530 25380
860 1 2 . 1 1 68 68 VAL CA C 68 62.776 62.776 62.978 -0.202 25380
861 1 2 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.204 1.285 25380
862 1 2 . 1 1 68 68 VAL H H 68 8.384 8.384 7.923 0.461 25380
863 1 2 . 1 1 69 69 SER N N 69 116.156 116.156 117.677 -1.521 25380
864 1 2 . 1 1 69 69 SER HA H 69 4.693 4.693 4.262 0.431 25380
865 1 2 . 1 1 69 69 SER C C 69 174.544 174.544 176.520 -1.976 25380
866 1 2 . 1 1 69 69 SER CA C 69 57.754 57.754 61.703 -3.949 25380
867 1 2 . 1 1 69 69 SER CB C 69 64.831 64.831 62.733 2.098 25380
868 1 2 . 1 1 69 69 SER H H 69 8.067 8.067 7.789 0.278 25380
869 1 2 . 1 1 70 70 THR N N 70 110.753 110.753 117.785 -7.032 25380
870 1 2 . 1 1 70 70 THR HA H 70 4.152 4.152 4.105 0.047 25380
871 1 2 . 1 1 70 70 THR C C 70 174.865 174.865 175.610 -0.745 25380
872 1 2 . 1 1 70 70 THR CA C 70 63.831 63.831 65.618 -1.786 25380
873 1 2 . 1 1 70 70 THR CB C 70 68.956 68.956 68.647 0.309 25380
874 1 2 . 1 1 70 70 THR H H 70 8.095 8.095 8.216 -0.121 25380
875 1 2 . 1 1 71 71 ASP N N 71 121.817 121.817 120.812 1.005 25380
876 1 2 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.582 0.008 25380
877 1 2 . 1 1 71 71 ASP C C 71 176.746 176.746 176.919 -0.173 25380
878 1 2 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.419 -2.155 25380
879 1 2 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.770 0.655 25380
880 1 2 . 1 1 71 71 ASP H H 71 8.076 8.076 8.353 -0.277 25380
881 1 2 . 1 1 72 72 GLU N N 72 123.635 123.635 115.237 8.398 25380
882 1 2 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.466 -0.473 25380
883 1 2 . 1 1 72 72 GLU C C 72 176.971 176.971 175.483 1.488 25380
884 1 2 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.173 2.046 25380
885 1 2 . 1 1 72 72 GLU CB C 72 29.702 29.702 32.061 -2.359 25380
886 1 2 . 1 1 72 72 GLU H H 72 8.514 8.514 7.944 0.570 25380
887 1 2 . 1 1 73 73 LYS N N 73 117.857 117.857 117.928 -0.071 25380
888 1 2 . 1 1 73 73 LYS HA H 73 4.643 4.643 3.997 0.646 25380
889 1 2 . 1 1 73 73 LYS C C 73 176.508 176.508 175.567 0.941 25380
890 1 2 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.159 -0.079 25380
891 1 2 . 1 1 73 73 LYS CB C 73 32.203 32.203 30.600 1.603 25380
892 1 2 . 1 1 73 73 LYS H H 73 8.423 8.423 8.239 0.184 25380
893 1 2 . 1 1 74 74 ASP N N 74 120.580 120.580 118.106 2.474 25380
894 1 2 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.377 0.381 25380
895 1 2 . 1 1 74 74 ASP C C 74 174.059 174.059 174.938 -0.879 25380
896 1 2 . 1 1 74 74 ASP CA C 74 53.279 53.279 55.418 -2.139 25380
897 1 2 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.135 -0.556 25380
898 1 2 . 1 1 74 74 ASP H H 74 7.918 7.918 8.364 -0.446 25380
899 1 2 . 1 1 75 75 PHE N N 75 118.513 118.513 117.422 1.091 25380
900 1 2 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.532 -0.169 25380
901 1 2 . 1 1 75 75 PHE C C 75 173.038 173.038 175.717 -2.679 25380
902 1 2 . 1 1 75 75 PHE CA C 75 55.522 55.522 55.638 -0.116 25380
903 1 2 . 1 1 75 75 PHE CB C 75 41.714 41.714 40.133 1.581 25380
904 1 2 . 1 1 75 75 PHE H H 75 7.397 7.397 7.565 -0.168 25380
905 1 2 . 1 1 76 76 LEU N N 76 116.773 116.773 122.336 -5.563 25380
906 1 2 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.533 0.110 25380
907 1 2 . 1 1 76 76 LEU C C 76 177.553 177.553 175.480 2.073 25380
908 1 2 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.395 -0.776 25380
909 1 2 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.699 2.002 25380
910 1 2 . 1 1 76 76 LEU H H 76 8.774 8.774 9.085 -0.311 25380
911 1 2 . 1 1 77 77 TYR N N 77 118.377 118.377 125.633 -7.256 25380
912 1 2 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.826 0.589 25380
913 1 2 . 1 1 77 77 TYR C C 77 175.479 175.479 173.237 2.242 25380
914 1 2 . 1 1 77 77 TYR CA C 77 58.391 58.391 54.678 3.713 25380
915 1 2 . 1 1 77 77 TYR CB C 77 41.100 41.100 39.494 1.606 25380
916 1 2 . 1 1 77 77 TYR H H 77 8.589 8.589 9.123 -0.534 25380
917 1 2 . 1 1 78 78 GLU N N 78 123.875 123.875 128.444 -4.569 25380
918 1 2 . 1 1 78 78 GLU HA H 78 4.973 4.973 5.007 -0.034 25380
919 1 2 . 1 1 78 78 GLU C C 78 174.120 174.120 174.104 0.016 25380
920 1 2 . 1 1 78 78 GLU CA C 78 54.378 54.378 54.043 0.335 25380
921 1 2 . 1 1 78 78 GLU CB C 78 32.640 32.640 34.006 -1.366 25380
922 1 2 . 1 1 78 78 GLU H H 78 9.576 9.576 8.858 0.718 25380
923 1 2 . 1 1 79 79 LEU N N 79 128.661 128.661 125.964 2.697 25380
924 1 2 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.522 0.767 25380
925 1 2 . 1 1 79 79 LEU C C 79 174.219 174.219 175.161 -0.942 25380
926 1 2 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.872 -0.723 25380
927 1 2 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.110 2.520 25380
928 1 2 . 1 1 79 79 LEU H H 79 9.139 9.139 8.841 0.298 25380
929 1 2 . 1 1 80 80 HIS N N 80 124.886 124.886 122.691 2.195 25380
930 1 2 . 1 1 80 80 HIS HA H 80 5.430 5.430 5.000 0.430 25380
931 1 2 . 1 1 80 80 HIS C C 80 173.346 173.346 176.284 -2.938 25380
932 1 2 . 1 1 80 80 HIS CA C 80 53.149 53.149 55.459 -2.310 25380
933 1 2 . 1 1 80 80 HIS CB C 80 30.768 30.768 32.072 -1.304 25380
934 1 2 . 1 1 80 80 HIS H H 80 8.897 8.897 9.061 -0.164 25380
935 1 2 . 1 1 81 81 ILE N N 81 125.173 125.173 122.477 2.696 25380
936 1 2 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.657 0.633 25380
937 1 2 . 1 1 81 81 ILE C C 81 174.600 174.600 176.114 -1.514 25380
938 1 2 . 1 1 81 81 ILE CA C 81 60.500 60.500 64.677 -4.177 25380
939 1 2 . 1 1 81 81 ILE CB C 81 39.700 39.700 37.268 2.432 25380
940 1 2 . 1 1 81 81 ILE H H 81 8.909 8.909 8.395 0.514 25380
941 1 3 . 1 1 2 2 HIS N N 2 120.430 120.430 121.980 -1.550 25380
942 1 3 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.821 -0.086 25380
943 1 3 . 1 1 2 2 HIS C C 2 173.884 173.884 174.532 -0.648 25380
944 1 3 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.574 -1.522 25380
945 1 3 . 1 1 2 2 HIS CB C 2 28.666 28.666 30.609 -1.943 25380
946 1 3 . 1 1 2 2 HIS H H 2 8.678 8.678 8.215 0.463 25380
947 1 3 . 1 1 3 3 MET N N 3 122.377 122.377 124.504 -2.127 25380
948 1 3 . 1 1 3 3 MET HA H 3 4.207 4.207 4.533 -0.326 25380
949 1 3 . 1 1 3 3 MET C C 3 174.584 174.584 175.216 -0.632 25380
950 1 3 . 1 1 3 3 MET CA C 3 56.550 56.550 54.703 1.847 25380
951 1 3 . 1 1 3 3 MET CB C 3 33.426 33.426 33.031 0.395 25380
952 1 3 . 1 1 3 3 MET H H 3 8.240 8.240 8.615 -0.375 25380
953 1 3 . 1 1 4 4 LYS N N 4 123.568 123.568 116.000 7.568 25380
954 1 3 . 1 1 4 4 LYS HA H 4 4.839 4.839 3.763 1.077 25380
955 1 3 . 1 1 4 4 LYS C C 4 175.906 175.906 174.305 1.601 25380
956 1 3 . 1 1 4 4 LYS CA C 4 54.800 54.800 57.445 -2.645 25380
957 1 3 . 1 1 4 4 LYS CB C 4 34.900 34.900 30.171 4.729 25380
958 1 3 . 1 1 4 4 LYS H H 4 8.351 8.351 7.200 1.151 25380
959 1 3 . 1 1 5 5 LEU N N 5 123.568 123.568 116.964 6.604 25380
960 1 3 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.623 -0.784 25380
961 1 3 . 1 1 5 5 LEU C C 5 175.900 175.900 176.257 -0.357 25380
962 1 3 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.105 0.245 25380
963 1 3 . 1 1 5 5 LEU CB C 5 45.900 45.900 46.439 -0.539 25380
964 1 3 . 1 1 5 5 LEU H H 5 8.281 8.281 7.256 1.025 25380
965 1 3 . 1 1 6 6 VAL N N 6 121.564 121.564 121.448 0.116 25380
966 1 3 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.459 -0.033 25380
967 1 3 . 1 1 6 6 VAL C C 6 178.200 178.200 174.440 3.760 25380
968 1 3 . 1 1 6 6 VAL CA C 6 63.200 63.200 61.192 2.008 25380
969 1 3 . 1 1 6 6 VAL CB C 6 33.200 33.200 35.605 -2.405 25380
970 1 3 . 1 1 6 6 VAL H H 6 9.276 9.276 8.948 0.328 25380
971 1 3 . 1 1 7 7 LEU N N 7 121.564 121.564 123.819 -2.255 25380
972 1 3 . 1 1 7 7 LEU HA H 7 4.426 4.426 4.979 -0.553 25380
973 1 3 . 1 1 7 7 LEU CA C 7 63.200 63.200 52.953 10.247 25380
974 1 3 . 1 1 7 7 LEU CB C 7 33.200 33.200 44.343 -11.143 25380
975 1 3 . 1 1 7 7 LEU H H 7 9.276 9.276 8.284 0.992 25380
976 1 3 . 1 1 8 8 ALA C C 8 177.040 177.040 177.992 -0.952 25380
977 1 3 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.133 -0.432 25380
978 1 3 . 1 1 8 8 ALA CB C 8 20.864 20.864 20.046 0.818 25380
979 1 3 . 1 1 9 9 LYS N N 9 119.845 119.845 120.799 -0.954 25380
980 1 3 . 1 1 9 9 LYS HA H 9 4.128 4.128 4.192 -0.064 25380
981 1 3 . 1 1 9 9 LYS C C 9 176.075 176.075 177.769 -1.694 25380
982 1 3 . 1 1 9 9 LYS CA C 9 56.761 56.761 57.915 -1.154 25380
983 1 3 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.046 0.873 25380
984 1 3 . 1 1 9 9 LYS H H 9 8.545 8.545 8.154 0.391 25380
985 1 3 . 1 1 10 10 ASN N N 10 119.279 119.279 119.316 -0.037 25380
986 1 3 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.509 0.136 25380
987 1 3 . 1 1 10 10 ASN C C 10 175.443 175.443 175.955 -0.512 25380
988 1 3 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.952 -2.295 25380
989 1 3 . 1 1 10 10 ASN CB C 10 38.777 38.777 38.240 0.536 25380
990 1 3 . 1 1 10 10 ASN H H 10 8.592 8.592 9.039 -0.447 25380
991 1 3 . 1 1 11 11 THR N N 11 111.876 111.876 107.467 4.409 25380
992 1 3 . 1 1 11 11 THR HA H 11 4.311 4.311 4.485 -0.174 25380
993 1 3 . 1 1 11 11 THR C C 11 174.666 174.666 175.748 -1.082 25380
994 1 3 . 1 1 11 11 THR CA C 11 62.044 62.044 62.179 -0.135 25380
995 1 3 . 1 1 11 11 THR CB C 11 69.895 69.895 69.714 0.181 25380
996 1 3 . 1 1 11 11 THR H H 11 8.058 8.058 8.094 -0.036 25380
997 1 3 . 1 1 12 12 ARG N N 12 121.152 121.152 120.740 0.412 25380
998 1 3 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.449 -0.187 25380
999 1 3 . 1 1 12 12 ARG C C 12 176.714 176.714 176.046 0.668 25380
1000 1 3 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.247 0.575 25380
1001 1 3 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.282 -0.580 25380
1002 1 3 . 1 1 12 12 ARG H H 12 8.291 8.291 8.142 0.149 25380
1003 1 3 . 1 1 13 13 LYS N N 13 120.459 120.459 119.003 1.456 25380
1004 1 3 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.060 -0.164 25380
1005 1 3 . 1 1 13 13 LYS C C 13 176.682 176.682 176.733 -0.051 25380
1006 1 3 . 1 1 13 13 LYS CA C 13 56.978 56.978 56.933 0.045 25380
1007 1 3 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.847 1.651 25380
1008 1 3 . 1 1 13 13 LYS H H 13 8.286 8.286 8.206 0.080 25380
1009 1 3 . 1 1 14 14 SER N N 14 114.568 114.568 114.511 0.057 25380
1010 1 3 . 1 1 14 14 SER HA H 14 4.371 4.371 4.349 0.022 25380
1011 1 3 . 1 1 14 14 SER C C 14 173.990 173.990 174.968 -0.978 25380
1012 1 3 . 1 1 14 14 SER CA C 14 58.617 58.617 59.516 -0.898 25380
1013 1 3 . 1 1 14 14 SER CB C 14 63.933 63.933 63.914 0.019 25380
1014 1 3 . 1 1 14 14 SER H H 14 7.957 7.957 8.444 -0.487 25380
1015 1 3 . 1 1 15 15 ASP N N 15 121.565 121.565 118.390 3.175 25380
1016 1 3 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.697 -0.096 25380
1017 1 3 . 1 1 15 15 ASP C C 15 175.684 175.684 175.164 0.520 25380
1018 1 3 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.728 0.421 25380
1019 1 3 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.106 1.123 25380
1020 1 3 . 1 1 15 15 ASP H H 15 8.166 8.166 8.149 0.017 25380
1021 1 3 . 1 1 16 16 ALA N N 16 124.173 124.173 124.311 -0.138 25380
1022 1 3 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.372 -0.001 25380
1023 1 3 . 1 1 16 16 ALA C C 16 177.184 177.184 175.735 1.449 25380
1024 1 3 . 1 1 16 16 ALA CA C 16 52.337 52.337 51.610 0.727 25380
1025 1 3 . 1 1 16 16 ALA CB C 16 19.359 19.359 17.553 1.806 25380
1026 1 3 . 1 1 16 16 ALA H H 16 8.163 8.163 8.252 -0.089 25380
1027 1 3 . 1 1 17 17 LYS N N 17 121.152 121.152 121.388 -0.236 25380
1028 1 3 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.569 -0.143 25380
1029 1 3 . 1 1 17 17 LYS C C 17 175.488 175.488 176.152 -0.664 25380
1030 1 3 . 1 1 17 17 LYS CA C 17 56.205 56.205 56.028 0.178 25380
1031 1 3 . 1 1 17 17 LYS CB C 17 34.296 34.296 34.676 -0.380 25380
1032 1 3 . 1 1 17 17 LYS H H 17 8.363 8.363 7.796 0.567 25380
1033 1 3 . 1 1 18 18 SER N N 18 116.448 116.448 116.531 -0.083 25380
1034 1 3 . 1 1 18 18 SER HA H 18 5.355 5.355 4.057 1.298 25380
1035 1 3 . 1 1 18 18 SER C C 18 173.887 173.887 175.142 -1.255 25380
1036 1 3 . 1 1 18 18 SER CA C 18 57.248 57.248 59.081 -1.833 25380
1037 1 3 . 1 1 18 18 SER CB C 18 64.962 64.962 62.664 2.298 25380
1038 1 3 . 1 1 18 18 SER H H 18 8.206 8.206 9.015 -0.809 25380
1039 1 3 . 1 1 19 19 VAL N N 19 117.867 117.867 118.275 -0.408 25380
1040 1 3 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.747 -0.127 25380
1041 1 3 . 1 1 19 19 VAL C C 19 174.169 174.169 177.636 -3.467 25380
1042 1 3 . 1 1 19 19 VAL CA C 19 59.546 59.546 66.294 -6.748 25380
1043 1 3 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.557 4.345 25380
1044 1 3 . 1 1 19 19 VAL H H 19 9.086 9.086 8.322 0.764 25380
1045 1 3 . 1 1 20 20 GLU N N 20 120.843 120.843 120.586 0.257 25380
1046 1 3 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.291 0.577 25380
1047 1 3 . 1 1 20 20 GLU C C 20 178.747 178.747 178.685 0.062 25380
1048 1 3 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.694 -5.142 25380
1049 1 3 . 1 1 20 20 GLU CB C 20 31.099 31.099 29.112 1.987 25380
1050 1 3 . 1 1 20 20 GLU H H 20 8.841 8.841 8.828 0.013 25380
1051 1 3 . 1 1 21 21 LEU N N 21 122.653 122.653 117.770 4.883 25380
1052 1 3 . 1 1 21 21 LEU HA H 21 3.443 3.443 3.982 -0.539 25380
1053 1 3 . 1 1 21 21 LEU C C 21 178.799 178.799 179.053 -0.254 25380
1054 1 3 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.890 0.817 25380
1055 1 3 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.506 -2.935 25380
1056 1 3 . 1 1 21 21 LEU H H 21 8.744 8.744 8.141 0.603 25380
1057 1 3 . 1 1 22 22 GLU N N 22 115.392 115.392 119.251 -3.859 25380
1058 1 3 . 1 1 22 22 GLU HA H 22 3.989 3.989 3.988 0.001 25380
1059 1 3 . 1 1 22 22 GLU C C 22 179.328 179.328 179.109 0.219 25380
1060 1 3 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.505 0.575 25380
1061 1 3 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.421 -0.587 25380
1062 1 3 . 1 1 22 22 GLU H H 22 8.744 8.744 7.571 1.173 25380
1063 1 3 . 1 1 23 23 ASP N N 23 118.597 118.597 120.330 -1.733 25380
1064 1 3 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.455 0.156 25380
1065 1 3 . 1 1 23 23 ASP C C 23 179.139 179.139 178.798 0.341 25380
1066 1 3 . 1 1 23 23 ASP CA C 23 57.519 57.519 56.780 0.739 25380
1067 1 3 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.457 -0.015 25380
1068 1 3 . 1 1 23 23 ASP H H 23 7.098 7.098 8.606 -1.508 25380
1069 1 3 . 1 1 24 24 LEU N N 24 119.869 119.869 121.258 -1.389 25380
1070 1 3 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.778 0.156 25380
1071 1 3 . 1 1 24 24 LEU C C 24 179.045 179.045 178.832 0.213 25380
1072 1 3 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.288 -0.739 25380
1073 1 3 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.760 -0.210 25380
1074 1 3 . 1 1 24 24 LEU H H 24 7.576 7.576 8.645 -1.069 25380
1075 1 3 . 1 1 25 25 TYR N N 25 118.100 118.100 117.966 0.134 25380
1076 1 3 . 1 1 25 25 TYR HA H 25 4.367 4.367 2.950 1.417 25380
1077 1 3 . 1 1 25 25 TYR C C 25 177.945 177.945 177.551 0.394 25380
1078 1 3 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.436 1.170 25380
1079 1 3 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.267 -0.319 25380
1080 1 3 . 1 1 25 25 TYR H H 25 8.320 8.320 7.397 0.923 25380
1081 1 3 . 1 1 26 26 HIS N N 26 119.440 119.440 119.421 0.019 25380
1082 1 3 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.352 0.019 25380
1083 1 3 . 1 1 26 26 HIS C C 26 176.559 176.559 177.692 -1.133 25380
1084 1 3 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.915 -0.396 25380
1085 1 3 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.183 -2.055 25380
1086 1 3 . 1 1 26 26 HIS H H 26 8.383 8.383 7.880 0.503 25380
1087 1 3 . 1 1 27 27 GLU N N 27 119.915 119.915 119.214 0.701 25380
1088 1 3 . 1 1 27 27 GLU HA H 27 4.258 4.258 3.977 0.281 25380
1089 1 3 . 1 1 27 27 GLU C C 27 179.163 179.163 178.921 0.242 25380
1090 1 3 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.105 0.970 25380
1091 1 3 . 1 1 27 27 GLU CB C 27 29.535 29.535 28.848 0.687 25380
1092 1 3 . 1 1 27 27 GLU H H 27 8.288 8.288 8.912 -0.624 25380
1093 1 3 . 1 1 28 28 PHE N N 28 120.500 120.500 119.869 0.631 25380
1094 1 3 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.325 0.647 25380
1095 1 3 . 1 1 28 28 PHE C C 28 177.386 177.386 176.715 0.671 25380
1096 1 3 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.897 -0.496 25380
1097 1 3 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.439 0.129 25380
1098 1 3 . 1 1 28 28 PHE H H 28 8.568 8.568 8.209 0.359 25380
1099 1 3 . 1 1 29 29 SER N N 29 114.306 114.306 114.103 0.203 25380
1100 1 3 . 1 1 29 29 SER HA H 29 4.288 4.288 3.926 0.362 25380
1101 1 3 . 1 1 29 29 SER C C 29 175.656 175.656 175.855 -0.199 25380
1102 1 3 . 1 1 29 29 SER CA C 29 61.058 61.058 60.082 0.976 25380
1103 1 3 . 1 1 29 29 SER CB C 29 63.555 63.555 63.266 0.289 25380
1104 1 3 . 1 1 29 29 SER H H 29 8.479 8.479 7.899 0.580 25380
1105 1 3 . 1 1 30 30 GLU N N 30 118.322 118.322 120.953 -2.631 25380
1106 1 3 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.099 -0.007 25380
1107 1 3 . 1 1 30 30 GLU C C 30 177.312 177.312 176.482 0.830 25380
1108 1 3 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.576 0.004 25380
1109 1 3 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.556 -0.979 25380
1110 1 3 . 1 1 30 30 GLU H H 30 8.428 8.428 7.734 0.694 25380
1111 1 3 . 1 1 31 31 ASP N N 31 115.630 115.630 116.836 -1.206 25380
1112 1 3 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.811 -0.001 25380
1113 1 3 . 1 1 31 31 ASP C C 31 175.723 175.723 173.599 2.124 25380
1114 1 3 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.954 1.020 25380
1115 1 3 . 1 1 31 31 ASP CB C 31 40.818 40.818 44.254 -3.436 25380
1116 1 3 . 1 1 31 31 ASP H H 31 7.303 7.303 8.003 -0.700 25380
1117 1 3 . 1 1 32 32 LYS N N 32 114.357 114.357 121.042 -6.685 25380
1118 1 3 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.500 -0.673 25380
1119 1 3 . 1 1 32 32 LYS C C 32 175.716 175.716 176.005 -0.289 25380
1120 1 3 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.725 0.437 25380
1121 1 3 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.496 -5.115 25380
1122 1 3 . 1 1 32 32 LYS H H 32 7.148 7.148 8.359 -1.211 25380
1123 1 3 . 1 1 33 33 ARG N N 33 120.929 120.929 125.275 -4.346 25380
1124 1 3 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.692 -0.491 25380
1125 1 3 . 1 1 33 33 ARG C C 33 173.982 173.982 173.415 0.567 25380
1126 1 3 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.246 0.948 25380
1127 1 3 . 1 1 33 33 ARG CB C 33 30.642 30.642 33.951 -3.309 25380
1128 1 3 . 1 1 33 33 ARG H H 33 7.388 7.388 8.957 -1.569 25380
1129 1 3 . 1 1 34 34 SER N N 34 115.867 115.867 116.908 -1.041 25380
1130 1 3 . 1 1 34 34 SER HA H 34 5.355 5.355 4.970 0.385 25380
1131 1 3 . 1 1 34 34 SER C C 34 172.754 172.754 173.137 -0.383 25380
1132 1 3 . 1 1 34 34 SER CA C 34 58.236 58.236 56.925 1.311 25380
1133 1 3 . 1 1 34 34 SER CB C 34 65.212 65.212 66.167 -0.955 25380
1134 1 3 . 1 1 34 34 SER H H 34 8.173 8.173 8.479 -0.306 25380
1135 1 3 . 1 1 35 35 ILE N N 35 119.621 119.621 120.117 -0.496 25380
1136 1 3 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.664 0.199 25380
1137 1 3 . 1 1 35 35 ILE C C 35 174.069 174.069 174.188 -0.119 25380
1138 1 3 . 1 1 35 35 ILE CA C 35 59.956 59.956 58.856 1.100 25380
1139 1 3 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.414 -0.759 25380
1140 1 3 . 1 1 35 35 ILE H H 35 6.779 6.779 8.633 -1.854 25380
1141 1 3 . 1 1 36 36 PHE N N 36 124.305 124.305 125.127 -0.822 25380
1142 1 3 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.390 -0.937 25380
1143 1 3 . 1 1 36 36 PHE C C 36 173.204 173.204 174.993 -1.789 25380
1144 1 3 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.468 -0.052 25380
1145 1 3 . 1 1 36 36 PHE CB C 36 44.817 44.817 41.727 3.090 25380
1146 1 3 . 1 1 36 36 PHE H H 36 8.411 8.411 9.339 -0.928 25380
1147 1 3 . 1 1 37 37 TYR N N 37 118.743 118.743 126.796 -8.053 25380
1148 1 3 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.117 0.453 25380
1149 1 3 . 1 1 37 37 TYR C C 37 175.455 175.455 173.630 1.825 25380
1150 1 3 . 1 1 37 37 TYR CA C 37 56.518 56.518 56.383 0.135 25380
1151 1 3 . 1 1 37 37 TYR CB C 37 40.991 40.991 41.159 -0.168 25380
1152 1 3 . 1 1 37 37 TYR H H 37 8.353 8.353 9.593 -1.240 25380
1153 1 3 . 1 1 38 38 PHE N N 38 119.236 119.236 130.853 -11.617 25380
1154 1 3 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.819 0.341 25380
1155 1 3 . 1 1 38 38 PHE C C 38 174.650 174.650 172.839 1.811 25380
1156 1 3 . 1 1 38 38 PHE CA C 38 56.842 56.842 54.605 2.237 25380
1157 1 3 . 1 1 38 38 PHE CB C 38 42.619 42.619 39.373 3.246 25380
1158 1 3 . 1 1 38 38 PHE H H 38 9.756 9.756 8.885 0.871 25380
1159 1 3 . 1 1 39 39 ALA N N 39 122.516 122.516 129.897 -7.381 25380
1160 1 3 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.706 -0.166 25380
1161 1 3 . 1 1 39 39 ALA C C 39 177.042 177.042 173.991 3.051 25380
1162 1 3 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.267 1.577 25380
1163 1 3 . 1 1 39 39 ALA CB C 39 18.578 18.578 22.047 -3.469 25380
1164 1 3 . 1 1 39 39 ALA H H 39 7.738 7.738 8.612 -0.874 25380
1165 1 3 . 1 1 40 40 PRO C C 40 175.411 175.411 177.652 -2.241 25380
1166 1 3 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.985 1.303 25380
1167 1 3 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.375 -1.271 25380
1168 1 3 . 1 1 41 41 THR N N 41 105.878 105.878 117.356 -11.478 25380
1169 1 3 . 1 1 41 41 THR HA H 41 4.190 4.190 3.782 0.408 25380
1170 1 3 . 1 1 41 41 THR C C 41 176.400 176.400 174.807 1.593 25380
1171 1 3 . 1 1 41 41 THR CA C 41 61.937 61.937 65.805 -3.868 25380
1172 1 3 . 1 1 41 41 THR CB C 41 68.331 68.331 68.803 -0.472 25380
1173 1 3 . 1 1 41 41 THR H H 41 6.715 6.715 8.529 -1.814 25380
1174 1 3 . 1 1 42 42 ASN N N 42 118.863 118.863 117.572 1.291 25380
1175 1 3 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.478 0.057 25380
1176 1 3 . 1 1 42 42 ASN C C 42 173.764 173.764 175.369 -1.605 25380
1177 1 3 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.217 -1.041 25380
1178 1 3 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.704 4.011 25380
1179 1 3 . 1 1 42 42 ASN H H 42 7.153 7.153 8.196 -1.043 25380
1180 1 3 . 1 1 43 43 ALA N N 43 126.174 126.174 118.148 8.026 25380
1181 1 3 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.426 -0.001 25380
1182 1 3 . 1 1 43 43 ALA C C 43 179.308 179.308 176.540 2.768 25380
1183 1 3 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.184 -0.203 25380
1184 1 3 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.757 -1.463 25380
1185 1 3 . 1 1 43 43 ALA H H 43 9.465 9.465 7.431 2.034 25380
1186 1 3 . 1 1 44 44 HIS N N 44 126.251 126.251 116.022 10.229 25380
1187 1 3 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.281 -0.454 25380
1188 1 3 . 1 1 44 44 HIS C C 44 177.407 177.407 175.024 2.383 25380
1189 1 3 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.924 4.101 25380
1190 1 3 . 1 1 44 44 HIS CB C 44 28.630 28.630 26.934 1.696 25380
1191 1 3 . 1 1 44 44 HIS H H 44 9.407 9.407 7.869 1.538 25380
1192 1 3 . 1 1 45 45 LYS N N 45 114.990 114.990 119.673 -4.683 25380
1193 1 3 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.295 -0.412 25380
1194 1 3 . 1 1 45 45 LYS C C 45 178.284 178.284 177.426 0.858 25380
1195 1 3 . 1 1 45 45 LYS CA C 45 59.249 59.249 58.715 0.534 25380
1196 1 3 . 1 1 45 45 LYS CB C 45 31.834 31.834 33.021 -1.187 25380
1197 1 3 . 1 1 45 45 LYS H H 45 8.960 8.960 8.140 0.820 25380
1198 1 3 . 1 1 46 46 ASP N N 46 120.411 120.411 119.415 0.996 25380
1199 1 3 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.456 -0.030 25380
1200 1 3 . 1 1 46 46 ASP C C 46 177.773 177.773 178.229 -0.456 25380
1201 1 3 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.289 -0.273 25380
1202 1 3 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.222 -0.325 25380
1203 1 3 . 1 1 46 46 ASP H H 46 6.777 6.777 8.640 -1.863 25380
1204 1 3 . 1 1 47 47 MET N N 47 118.178 118.178 118.710 -0.532 25380
1205 1 3 . 1 1 47 47 MET HA H 47 3.879 3.879 4.395 -0.516 25380
1206 1 3 . 1 1 47 47 MET C C 47 179.499 179.499 177.673 1.826 25380
1207 1 3 . 1 1 47 47 MET CA C 47 56.052 56.052 59.011 -2.959 25380
1208 1 3 . 1 1 47 47 MET CB C 47 29.601 29.601 32.748 -3.147 25380
1209 1 3 . 1 1 47 47 MET H H 47 7.367 7.367 8.000 -0.633 25380
1210 1 3 . 1 1 48 48 LEU N N 48 117.665 117.665 119.585 -1.920 25380
1211 1 3 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.928 -0.081 25380
1212 1 3 . 1 1 48 48 LEU C C 48 179.843 179.843 178.287 1.556 25380
1213 1 3 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.797 -0.217 25380
1214 1 3 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.578 -0.625 25380
1215 1 3 . 1 1 48 48 LEU H H 48 7.672 7.672 7.594 0.078 25380
1216 1 3 . 1 1 49 49 LYS N N 49 119.326 119.326 118.379 0.947 25380
1217 1 3 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.580 0.547 25380
1218 1 3 . 1 1 49 49 LYS C C 49 179.684 179.684 178.120 1.564 25380
1219 1 3 . 1 1 49 49 LYS CA C 49 58.799 58.799 58.909 -0.110 25380
1220 1 3 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.846 -0.393 25380
1221 1 3 . 1 1 49 49 LYS H H 49 7.420 7.420 7.578 -0.158 25380
1222 1 3 . 1 1 50 50 ALA N N 50 122.022 122.022 122.235 -0.213 25380
1223 1 3 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.382 0.661 25380
1224 1 3 . 1 1 50 50 ALA C C 50 178.818 178.818 178.570 0.248 25380
1225 1 3 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.453 0.716 25380
1226 1 3 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.355 -0.055 25380
1227 1 3 . 1 1 50 50 ALA H H 50 7.551 7.551 7.367 0.184 25380
1228 1 3 . 1 1 51 51 VAL N N 51 118.165 118.165 117.756 0.409 25380
1229 1 3 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.531 -0.089 25380
1230 1 3 . 1 1 51 51 VAL C C 51 178.646 178.646 177.985 0.661 25380
1231 1 3 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.166 1.040 25380
1232 1 3 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.753 0.700 25380
1233 1 3 . 1 1 51 51 VAL H H 51 7.226 7.226 7.303 -0.077 25380
1234 1 3 . 1 1 52 52 ASP N N 52 122.298 122.298 120.282 2.016 25380
1235 1 3 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.295 0.076 25380
1236 1 3 . 1 1 52 52 ASP C C 52 177.898 177.898 178.985 -1.087 25380
1237 1 3 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.020 0.551 25380
1238 1 3 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.068 0.318 25380
1239 1 3 . 1 1 52 52 ASP H H 52 8.232 8.232 7.253 0.979 25380
1240 1 3 . 1 1 53 53 PHE N N 53 121.541 121.541 119.831 1.710 25380
1241 1 3 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.373 -0.052 25380
1242 1 3 . 1 1 53 53 PHE C C 53 177.224 177.224 178.186 -0.962 25380
1243 1 3 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.971 2.109 25380
1244 1 3 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.822 1.878 25380
1245 1 3 . 1 1 53 53 PHE H H 53 8.240 8.240 7.452 0.788 25380
1246 1 3 . 1 1 54 54 PHE N N 54 115.925 115.925 116.599 -0.674 25380
1247 1 3 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.257 -0.602 25380
1248 1 3 . 1 1 54 54 PHE C C 54 178.269 178.269 177.425 0.844 25380
1249 1 3 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.746 4.454 25380
1250 1 3 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.955 0.623 25380
1251 1 3 . 1 1 54 54 PHE H H 54 7.755 7.755 7.476 0.279 25380
1252 1 3 . 1 1 55 55 LYS N N 55 120.251 120.251 117.997 2.254 25380
1253 1 3 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.064 0.362 25380
1254 1 3 . 1 1 55 55 LYS C C 55 181.484 181.484 178.250 3.234 25380
1255 1 3 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.871 0.758 25380
1256 1 3 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.479 -0.740 25380
1257 1 3 . 1 1 55 55 LYS H H 55 8.213 8.213 7.496 0.717 25380
1258 1 3 . 1 1 56 56 GLU N N 56 120.146 120.146 117.677 2.469 25380
1259 1 3 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.163 -0.170 25380
1260 1 3 . 1 1 56 56 GLU C C 56 178.085 178.085 177.568 0.517 25380
1261 1 3 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.400 0.388 25380
1262 1 3 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.222 -1.626 25380
1263 1 3 . 1 1 56 56 GLU H H 56 7.850 7.850 7.860 -0.010 25380
1264 1 3 . 1 1 57 57 LYS N N 57 115.940 115.940 119.217 -3.277 25380
1265 1 3 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.481 -0.379 25380
1266 1 3 . 1 1 57 57 LYS C C 57 176.225 176.225 177.199 -0.974 25380
1267 1 3 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.106 -0.534 25380
1268 1 3 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.525 -1.489 25380
1269 1 3 . 1 1 57 57 LYS H H 57 7.019 7.019 7.992 -0.973 25380
1270 1 3 . 1 1 58 58 GLY N N 58 106.593 106.593 110.982 -4.389 25380
1271 1 3 . 1 1 58 58 GLY C C 58 174.350 174.350 174.851 -0.501 25380
1272 1 3 . 1 1 58 58 GLY CA C 58 45.500 45.500 46.339 -0.839 25380
1273 1 3 . 1 1 58 58 GLY H H 58 7.883 7.883 8.564 -0.681 25380
1274 1 3 . 1 1 59 59 HIS N N 59 117.962 117.962 117.699 0.263 25380
1275 1 3 . 1 1 59 59 HIS HA H 59 4.867 4.867 3.781 1.086 25380
1276 1 3 . 1 1 59 59 HIS C C 59 173.271 173.271 175.434 -2.163 25380
1277 1 3 . 1 1 59 59 HIS CA C 59 54.778 54.778 57.884 -3.106 25380
1278 1 3 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.411 2.274 25380
1279 1 3 . 1 1 59 59 HIS H H 59 8.218 8.218 7.931 0.287 25380
1280 1 3 . 1 1 60 60 THR N N 60 119.624 119.624 110.875 8.749 25380
1281 1 3 . 1 1 60 60 THR HA H 60 4.430 4.430 3.626 0.804 25380
1282 1 3 . 1 1 60 60 THR C C 60 171.430 171.430 173.631 -2.201 25380
1283 1 3 . 1 1 60 60 THR CA C 60 63.480 63.480 63.001 0.479 25380
1284 1 3 . 1 1 60 60 THR CB C 60 69.761 69.761 69.242 0.519 25380
1285 1 3 . 1 1 60 60 THR H H 60 8.780 8.780 7.844 0.936 25380
1286 1 3 . 1 1 61 61 ALA N N 61 126.706 126.706 129.808 -3.102 25380
1287 1 3 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.120 1.126 25380
1288 1 3 . 1 1 61 61 ALA C C 61 174.753 174.753 176.648 -1.895 25380
1289 1 3 . 1 1 61 61 ALA CA C 61 49.772 49.772 52.971 -3.199 25380
1290 1 3 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.570 2.319 25380
1291 1 3 . 1 1 61 61 ALA H H 61 7.795 7.795 8.463 -0.668 25380
1292 1 3 . 1 1 62 62 TYR N N 62 117.859 117.859 115.635 2.224 25380
1293 1 3 . 1 1 62 62 TYR C C 62 173.431 173.431 173.525 -0.094 25380
1294 1 3 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.221 -0.574 25380
1295 1 3 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.619 -2.070 25380
1296 1 3 . 1 1 62 62 TYR H H 62 8.711 8.711 7.853 0.858 25380
1297 1 3 . 1 1 63 63 LEU N N 63 125.044 125.044 123.298 1.746 25380
1298 1 3 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.717 0.694 25380
1299 1 3 . 1 1 63 63 LEU C C 63 175.319 175.319 174.931 0.388 25380
1300 1 3 . 1 1 63 63 LEU CA C 63 53.230 53.230 54.233 -1.003 25380
1301 1 3 . 1 1 63 63 LEU CB C 63 45.701 45.701 44.831 0.870 25380
1302 1 3 . 1 1 63 63 LEU H H 63 8.746 8.746 8.512 0.234 25380
1303 1 3 . 1 1 64 64 ASP N N 64 125.463 125.463 126.125 -0.662 25380
1304 1 3 . 1 1 64 64 ASP HA H 64 5.199 5.199 5.021 0.178 25380
1305 1 3 . 1 1 64 64 ASP C C 64 174.512 174.512 173.908 0.604 25380
1306 1 3 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.790 -0.090 25380
1307 1 3 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.587 -0.634 25380
1308 1 3 . 1 1 64 64 ASP H H 64 9.293 9.293 9.216 0.077 25380
1309 1 3 . 1 1 65 65 GLU N N 65 120.711 120.711 120.783 -0.072 25380
1310 1 3 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.497 0.570 25380
1311 1 3 . 1 1 65 65 GLU C C 65 175.652 175.652 175.904 -0.252 25380
1312 1 3 . 1 1 65 65 GLU CA C 65 55.643 55.643 55.527 0.116 25380
1313 1 3 . 1 1 65 65 GLU CB C 65 30.455 30.455 31.488 -1.033 25380
1314 1 3 . 1 1 65 65 GLU H H 65 8.715 8.715 8.556 0.159 25380
1315 1 3 . 1 1 66 66 VAL N N 66 122.936 122.936 123.910 -0.974 25380
1316 1 3 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.288 0.142 25380
1317 1 3 . 1 1 66 66 VAL C C 66 175.065 175.065 176.411 -1.346 25380
1318 1 3 . 1 1 66 66 VAL CA C 66 60.991 60.991 61.931 -0.940 25380
1319 1 3 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.737 1.543 25380
1320 1 3 . 1 1 66 66 VAL H H 66 9.156 9.156 8.661 0.495 25380
1321 1 3 . 1 1 67 67 ARG N N 67 126.104 126.104 125.554 0.550 25380
1322 1 3 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.439 0.102 25380
1323 1 3 . 1 1 67 67 ARG C C 67 176.708 176.708 176.677 0.031 25380
1324 1 3 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.053 1.027 25380
1325 1 3 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.049 1.859 25380
1326 1 3 . 1 1 67 67 ARG H H 67 8.734 8.734 8.736 -0.002 25380
1327 1 3 . 1 1 68 68 VAL N N 68 120.707 120.707 116.965 3.742 25380
1328 1 3 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.441 -0.289 25380
1329 1 3 . 1 1 68 68 VAL C C 68 175.931 175.931 176.054 -0.123 25380
1330 1 3 . 1 1 68 68 VAL CA C 68 62.776 62.776 62.150 0.626 25380
1331 1 3 . 1 1 68 68 VAL CB C 68 32.489 32.489 30.719 1.770 25380
1332 1 3 . 1 1 68 68 VAL H H 68 8.384 8.384 7.909 0.475 25380
1333 1 3 . 1 1 69 69 SER N N 69 116.156 116.156 117.157 -1.001 25380
1334 1 3 . 1 1 69 69 SER HA H 69 4.693 4.693 4.423 0.270 25380
1335 1 3 . 1 1 69 69 SER C C 69 174.544 174.544 175.786 -1.242 25380
1336 1 3 . 1 1 69 69 SER CA C 69 57.754 57.754 61.034 -3.280 25380
1337 1 3 . 1 1 69 69 SER CB C 69 64.831 64.831 63.133 1.698 25380
1338 1 3 . 1 1 69 69 SER H H 69 8.067 8.067 8.050 0.017 25380
1339 1 3 . 1 1 70 70 THR N N 70 110.753 110.753 113.219 -2.466 25380
1340 1 3 . 1 1 70 70 THR HA H 70 4.152 4.152 4.143 0.009 25380
1341 1 3 . 1 1 70 70 THR C C 70 174.865 174.865 175.696 -0.831 25380
1342 1 3 . 1 1 70 70 THR CA C 70 63.831 63.831 64.874 -1.043 25380
1343 1 3 . 1 1 70 70 THR CB C 70 68.956 68.956 68.918 0.038 25380
1344 1 3 . 1 1 70 70 THR H H 70 8.095 8.095 8.064 0.031 25380
1345 1 3 . 1 1 71 71 ASP N N 71 121.817 121.817 121.048 0.769 25380
1346 1 3 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.605 -0.015 25380
1347 1 3 . 1 1 71 71 ASP C C 71 176.746 176.746 176.797 -0.051 25380
1348 1 3 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.294 -2.030 25380
1349 1 3 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.703 0.722 25380
1350 1 3 . 1 1 71 71 ASP H H 71 8.076 8.076 8.154 -0.078 25380
1351 1 3 . 1 1 72 72 GLU N N 72 123.635 123.635 115.739 7.896 25380
1352 1 3 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.588 -0.595 25380
1353 1 3 . 1 1 72 72 GLU C C 72 176.971 176.971 175.368 1.603 25380
1354 1 3 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.474 1.745 25380
1355 1 3 . 1 1 72 72 GLU CB C 72 29.702 29.702 32.171 -2.469 25380
1356 1 3 . 1 1 72 72 GLU H H 72 8.514 8.514 8.262 0.252 25380
1357 1 3 . 1 1 73 73 LYS N N 73 117.857 117.857 118.238 -0.381 25380
1358 1 3 . 1 1 73 73 LYS HA H 73 4.643 4.643 3.992 0.651 25380
1359 1 3 . 1 1 73 73 LYS C C 73 176.508 176.508 174.398 2.110 25380
1360 1 3 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.368 -0.288 25380
1361 1 3 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.624 0.579 25380
1362 1 3 . 1 1 73 73 LYS H H 73 8.423 8.423 7.756 0.667 25380
1363 1 3 . 1 1 74 74 ASP N N 74 120.580 120.580 113.148 7.432 25380
1364 1 3 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.776 -0.018 25380
1365 1 3 . 1 1 74 74 ASP C C 74 174.059 174.059 174.873 -0.814 25380
1366 1 3 . 1 1 74 74 ASP CA C 74 53.279 53.279 52.788 0.492 25380
1367 1 3 . 1 1 74 74 ASP CB C 74 40.578 40.578 40.869 -0.291 25380
1368 1 3 . 1 1 74 74 ASP H H 74 7.918 7.918 8.364 -0.446 25380
1369 1 3 . 1 1 75 75 PHE N N 75 118.513 118.513 120.010 -1.497 25380
1370 1 3 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.745 -0.382 25380
1371 1 3 . 1 1 75 75 PHE C C 75 173.038 173.038 175.358 -2.320 25380
1372 1 3 . 1 1 75 75 PHE CA C 75 55.522 55.522 57.204 -1.682 25380
1373 1 3 . 1 1 75 75 PHE CB C 75 41.714 41.714 41.082 0.632 25380
1374 1 3 . 1 1 75 75 PHE H H 75 7.397 7.397 7.944 -0.547 25380
1375 1 3 . 1 1 76 76 LEU N N 76 116.773 116.773 123.883 -7.110 25380
1376 1 3 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.818 -0.175 25380
1377 1 3 . 1 1 76 76 LEU C C 76 177.553 177.553 175.888 1.665 25380
1378 1 3 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.349 -0.730 25380
1379 1 3 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.566 2.135 25380
1380 1 3 . 1 1 76 76 LEU H H 76 8.774 8.774 9.217 -0.443 25380
1381 1 3 . 1 1 77 77 TYR N N 77 118.377 118.377 124.862 -6.485 25380
1382 1 3 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.735 0.680 25380
1383 1 3 . 1 1 77 77 TYR C C 77 175.479 175.479 173.325 2.154 25380
1384 1 3 . 1 1 77 77 TYR CA C 77 58.391 58.391 56.153 2.238 25380
1385 1 3 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.377 0.723 25380
1386 1 3 . 1 1 77 77 TYR H H 77 8.589 8.589 9.109 -0.520 25380
1387 1 3 . 1 1 78 78 GLU N N 78 123.875 123.875 128.752 -4.877 25380
1388 1 3 . 1 1 78 78 GLU HA H 78 4.973 4.973 5.036 -0.063 25380
1389 1 3 . 1 1 78 78 GLU C C 78 174.120 174.120 174.020 0.100 25380
1390 1 3 . 1 1 78 78 GLU CA C 78 54.378 54.378 53.435 0.943 25380
1391 1 3 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.679 -1.039 25380
1392 1 3 . 1 1 78 78 GLU H H 78 9.576 9.576 8.293 1.283 25380
1393 1 3 . 1 1 79 79 LEU N N 79 128.661 128.661 120.343 8.318 25380
1394 1 3 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.779 0.510 25380
1395 1 3 . 1 1 79 79 LEU C C 79 174.219 174.219 174.726 -0.507 25380
1396 1 3 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.171 -0.022 25380
1397 1 3 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.671 1.959 25380
1398 1 3 . 1 1 79 79 LEU H H 79 9.139 9.139 8.651 0.488 25380
1399 1 3 . 1 1 80 80 HIS N N 80 124.886 124.886 121.477 3.409 25380
1400 1 3 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.933 0.497 25380
1401 1 3 . 1 1 80 80 HIS C C 80 173.346 173.346 175.214 -1.868 25380
1402 1 3 . 1 1 80 80 HIS CA C 80 53.149 53.149 55.345 -2.196 25380
1403 1 3 . 1 1 80 80 HIS CB C 80 30.768 30.768 31.608 -0.840 25380
1404 1 3 . 1 1 80 80 HIS H H 80 8.897 8.897 9.198 -0.301 25380
1405 1 3 . 1 1 81 81 ILE N N 81 125.173 125.173 124.637 0.536 25380
1406 1 3 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.911 0.379 25380
1407 1 3 . 1 1 81 81 ILE C C 81 174.600 174.600 175.117 -0.517 25380
1408 1 3 . 1 1 81 81 ILE CA C 81 60.500 60.500 62.608 -2.108 25380
1409 1 3 . 1 1 81 81 ILE CB C 81 39.700 39.700 37.720 1.980 25380
1410 1 3 . 1 1 81 81 ILE H H 81 8.909 8.909 8.333 0.576 25380
1411 1 4 . 1 1 2 2 HIS N N 2 120.430 120.430 119.754 0.676 25380
1412 1 4 . 1 1 2 2 HIS HA H 2 4.735 4.735 5.019 -0.284 25380
1413 1 4 . 1 1 2 2 HIS C C 2 173.884 173.884 174.780 -0.896 25380
1414 1 4 . 1 1 2 2 HIS CA C 2 55.052 55.052 55.856 -0.804 25380
1415 1 4 . 1 1 2 2 HIS CB C 2 28.666 28.666 31.333 -2.667 25380
1416 1 4 . 1 1 2 2 HIS H H 2 8.678 8.678 8.485 0.193 25380
1417 1 4 . 1 1 3 3 MET N N 3 122.377 122.377 121.605 0.772 25380
1418 1 4 . 1 1 3 3 MET HA H 3 4.207 4.207 4.637 -0.430 25380
1419 1 4 . 1 1 3 3 MET C C 3 174.584 174.584 176.571 -1.987 25380
1420 1 4 . 1 1 3 3 MET CA C 3 56.550 56.550 57.170 -0.620 25380
1421 1 4 . 1 1 3 3 MET CB C 3 33.426 33.426 33.775 -0.349 25380
1422 1 4 . 1 1 3 3 MET H H 3 8.240 8.240 8.818 -0.578 25380
1423 1 4 . 1 1 4 4 LYS N N 4 123.568 123.568 119.999 3.569 25380
1424 1 4 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.629 0.210 25380
1425 1 4 . 1 1 4 4 LYS C C 4 175.906 175.906 174.845 1.061 25380
1426 1 4 . 1 1 4 4 LYS CA C 4 54.800 54.800 55.927 -1.127 25380
1427 1 4 . 1 1 4 4 LYS CB C 4 34.900 34.900 32.953 1.947 25380
1428 1 4 . 1 1 4 4 LYS H H 4 8.351 8.351 8.149 0.202 25380
1429 1 4 . 1 1 5 5 LEU N N 5 123.568 123.568 120.086 3.482 25380
1430 1 4 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.734 -0.895 25380
1431 1 4 . 1 1 5 5 LEU C C 5 175.900 175.900 176.050 -0.150 25380
1432 1 4 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.654 -0.304 25380
1433 1 4 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.813 0.087 25380
1434 1 4 . 1 1 5 5 LEU H H 5 8.281 8.281 7.955 0.326 25380
1435 1 4 . 1 1 6 6 VAL N N 6 121.564 121.564 120.663 0.901 25380
1436 1 4 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.468 -0.042 25380
1437 1 4 . 1 1 6 6 VAL C C 6 178.200 178.200 174.384 3.816 25380
1438 1 4 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.284 2.916 25380
1439 1 4 . 1 1 6 6 VAL CB C 6 33.200 33.200 35.730 -2.530 25380
1440 1 4 . 1 1 6 6 VAL H H 6 9.276 9.276 9.166 0.110 25380
1441 1 4 . 1 1 7 7 LEU N N 7 121.564 121.564 124.623 -3.059 25380
1442 1 4 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.056 -0.630 25380
1443 1 4 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.169 10.031 25380
1444 1 4 . 1 1 7 7 LEU CB C 7 33.200 33.200 44.974 -11.774 25380
1445 1 4 . 1 1 7 7 LEU H H 7 9.276 9.276 8.738 0.538 25380
1446 1 4 . 1 1 8 8 ALA C C 8 177.040 177.040 178.482 -1.442 25380
1447 1 4 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.298 -0.597 25380
1448 1 4 . 1 1 8 8 ALA CB C 8 20.864 20.864 20.178 0.686 25380
1449 1 4 . 1 1 9 9 LYS N N 9 119.845 119.845 121.942 -2.097 25380
1450 1 4 . 1 1 9 9 LYS HA H 9 4.128 4.128 4.032 0.096 25380
1451 1 4 . 1 1 9 9 LYS C C 9 176.075 176.075 178.578 -2.503 25380
1452 1 4 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.202 -2.441 25380
1453 1 4 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.208 0.711 25380
1454 1 4 . 1 1 9 9 LYS H H 9 8.545 8.545 8.387 0.158 25380
1455 1 4 . 1 1 10 10 ASN N N 10 119.279 119.279 119.563 -0.284 25380
1456 1 4 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.563 0.082 25380
1457 1 4 . 1 1 10 10 ASN C C 10 175.443 175.443 177.599 -2.156 25380
1458 1 4 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.905 -2.248 25380
1459 1 4 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.861 0.916 25380
1460 1 4 . 1 1 10 10 ASN H H 10 8.592 8.592 8.707 -0.115 25380
1461 1 4 . 1 1 11 11 THR N N 11 111.876 111.876 113.385 -1.509 25380
1462 1 4 . 1 1 11 11 THR HA H 11 4.311 4.311 4.350 -0.039 25380
1463 1 4 . 1 1 11 11 THR C C 11 174.666 174.666 175.208 -0.542 25380
1464 1 4 . 1 1 11 11 THR CA C 11 62.044 62.044 64.743 -2.700 25380
1465 1 4 . 1 1 11 11 THR CB C 11 69.895 69.895 69.318 0.577 25380
1466 1 4 . 1 1 11 11 THR H H 11 8.058 8.058 8.216 -0.158 25380
1467 1 4 . 1 1 12 12 ARG N N 12 121.152 121.152 120.970 0.182 25380
1468 1 4 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.428 -0.166 25380
1469 1 4 . 1 1 12 12 ARG C C 12 176.714 176.714 176.174 0.540 25380
1470 1 4 . 1 1 12 12 ARG CA C 12 56.822 56.822 55.977 0.845 25380
1471 1 4 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.362 -0.660 25380
1472 1 4 . 1 1 12 12 ARG H H 12 8.291 8.291 8.010 0.281 25380
1473 1 4 . 1 1 13 13 LYS N N 13 120.459 120.459 121.195 -0.736 25380
1474 1 4 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.087 -0.191 25380
1475 1 4 . 1 1 13 13 LYS C C 13 176.682 176.682 177.445 -0.763 25380
1476 1 4 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.118 -0.140 25380
1477 1 4 . 1 1 13 13 LYS CB C 13 32.498 32.498 32.214 0.284 25380
1478 1 4 . 1 1 13 13 LYS H H 13 8.286 8.286 7.841 0.445 25380
1479 1 4 . 1 1 14 14 SER N N 14 114.568 114.568 118.180 -3.612 25380
1480 1 4 . 1 1 14 14 SER HA H 14 4.371 4.371 4.213 0.158 25380
1481 1 4 . 1 1 14 14 SER C C 14 173.990 173.990 175.087 -1.097 25380
1482 1 4 . 1 1 14 14 SER CA C 14 58.617 58.617 60.594 -1.977 25380
1483 1 4 . 1 1 14 14 SER CB C 14 63.933 63.933 63.282 0.651 25380
1484 1 4 . 1 1 14 14 SER H H 14 7.957 7.957 8.555 -0.598 25380
1485 1 4 . 1 1 15 15 ASP N N 15 121.565 121.565 118.195 3.370 25380
1486 1 4 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.709 -0.108 25380
1487 1 4 . 1 1 15 15 ASP C C 15 175.684 175.684 176.242 -0.558 25380
1488 1 4 . 1 1 15 15 ASP CA C 15 54.149 54.149 54.241 -0.092 25380
1489 1 4 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.087 1.142 25380
1490 1 4 . 1 1 15 15 ASP H H 15 8.166 8.166 8.273 -0.107 25380
1491 1 4 . 1 1 16 16 ALA N N 16 124.173 124.173 123.203 0.970 25380
1492 1 4 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.405 -0.034 25380
1493 1 4 . 1 1 16 16 ALA C C 16 177.184 177.184 176.650 0.534 25380
1494 1 4 . 1 1 16 16 ALA CA C 16 52.337 52.337 51.323 1.014 25380
1495 1 4 . 1 1 16 16 ALA CB C 16 19.359 19.359 18.708 0.651 25380
1496 1 4 . 1 1 16 16 ALA H H 16 8.163 8.163 8.300 -0.137 25380
1497 1 4 . 1 1 17 17 LYS N N 17 121.152 121.152 120.570 0.582 25380
1498 1 4 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.268 0.158 25380
1499 1 4 . 1 1 17 17 LYS C C 17 175.488 175.488 176.512 -1.024 25380
1500 1 4 . 1 1 17 17 LYS CA C 17 56.205 56.205 56.990 -0.785 25380
1501 1 4 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.915 1.381 25380
1502 1 4 . 1 1 17 17 LYS H H 17 8.363 8.363 7.699 0.664 25380
1503 1 4 . 1 1 18 18 SER N N 18 116.448 116.448 115.606 0.842 25380
1504 1 4 . 1 1 18 18 SER HA H 18 5.355 5.355 4.137 1.218 25380
1505 1 4 . 1 1 18 18 SER C C 18 173.887 173.887 175.188 -1.301 25380
1506 1 4 . 1 1 18 18 SER CA C 18 57.248 57.248 59.230 -1.982 25380
1507 1 4 . 1 1 18 18 SER CB C 18 64.962 64.962 62.771 2.191 25380
1508 1 4 . 1 1 18 18 SER H H 18 8.206 8.206 8.890 -0.684 25380
1509 1 4 . 1 1 19 19 VAL N N 19 117.867 117.867 119.599 -1.732 25380
1510 1 4 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.731 -0.111 25380
1511 1 4 . 1 1 19 19 VAL C C 19 174.169 174.169 176.811 -2.642 25380
1512 1 4 . 1 1 19 19 VAL CA C 19 59.546 59.546 66.398 -6.852 25380
1513 1 4 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.977 3.925 25380
1514 1 4 . 1 1 19 19 VAL H H 19 9.086 9.086 7.548 1.538 25380
1515 1 4 . 1 1 20 20 GLU N N 20 120.843 120.843 120.132 0.711 25380
1516 1 4 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.070 0.798 25380
1517 1 4 . 1 1 20 20 GLU C C 20 178.747 178.747 178.449 0.298 25380
1518 1 4 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.557 -5.005 25380
1519 1 4 . 1 1 20 20 GLU CB C 20 31.099 31.099 28.770 2.329 25380
1520 1 4 . 1 1 20 20 GLU H H 20 8.841 8.841 8.697 0.144 25380
1521 1 4 . 1 1 21 21 LEU N N 21 122.653 122.653 118.372 4.281 25380
1522 1 4 . 1 1 21 21 LEU HA H 21 3.443 3.443 3.962 -0.519 25380
1523 1 4 . 1 1 21 21 LEU C C 21 178.799 178.799 179.292 -0.493 25380
1524 1 4 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.991 0.716 25380
1525 1 4 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.610 -3.039 25380
1526 1 4 . 1 1 21 21 LEU H H 21 8.744 8.744 7.765 0.979 25380
1527 1 4 . 1 1 22 22 GLU N N 22 115.392 115.392 119.391 -3.999 25380
1528 1 4 . 1 1 22 22 GLU HA H 22 3.989 3.989 4.096 -0.107 25380
1529 1 4 . 1 1 22 22 GLU C C 22 179.328 179.328 179.559 -0.231 25380
1530 1 4 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.694 0.386 25380
1531 1 4 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.463 -0.629 25380
1532 1 4 . 1 1 22 22 GLU H H 22 8.744 8.744 7.621 1.123 25380
1533 1 4 . 1 1 23 23 ASP N N 23 118.597 118.597 121.279 -2.682 25380
1534 1 4 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.569 0.042 25380
1535 1 4 . 1 1 23 23 ASP C C 23 179.139 179.139 178.768 0.371 25380
1536 1 4 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.231 0.288 25380
1537 1 4 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.497 -0.055 25380
1538 1 4 . 1 1 23 23 ASP H H 23 7.098 7.098 8.647 -1.549 25380
1539 1 4 . 1 1 24 24 LEU N N 24 119.869 119.869 120.691 -0.822 25380
1540 1 4 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.407 0.527 25380
1541 1 4 . 1 1 24 24 LEU C C 24 179.045 179.045 178.638 0.407 25380
1542 1 4 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.193 -0.644 25380
1543 1 4 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.444 0.106 25380
1544 1 4 . 1 1 24 24 LEU H H 24 7.576 7.576 8.377 -0.801 25380
1545 1 4 . 1 1 25 25 TYR N N 25 118.100 118.100 118.761 -0.661 25380
1546 1 4 . 1 1 25 25 TYR HA H 25 4.367 4.367 2.623 1.744 25380
1547 1 4 . 1 1 25 25 TYR C C 25 177.945 177.945 177.679 0.266 25380
1548 1 4 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.536 1.070 25380
1549 1 4 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.195 -0.247 25380
1550 1 4 . 1 1 25 25 TYR H H 25 8.320 8.320 7.280 1.040 25380
1551 1 4 . 1 1 26 26 HIS N N 26 119.440 119.440 117.735 1.705 25380
1552 1 4 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.444 -0.073 25380
1553 1 4 . 1 1 26 26 HIS C C 26 176.559 176.559 178.154 -1.595 25380
1554 1 4 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.720 -0.201 25380
1555 1 4 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.052 -1.924 25380
1556 1 4 . 1 1 26 26 HIS H H 26 8.383 8.383 8.507 -0.124 25380
1557 1 4 . 1 1 27 27 GLU N N 27 119.915 119.915 121.607 -1.692 25380
1558 1 4 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.070 0.188 25380
1559 1 4 . 1 1 27 27 GLU C C 27 179.163 179.163 178.525 0.638 25380
1560 1 4 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.454 0.621 25380
1561 1 4 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.699 -0.164 25380
1562 1 4 . 1 1 27 27 GLU H H 27 8.288 8.288 8.886 -0.598 25380
1563 1 4 . 1 1 28 28 PHE N N 28 120.500 120.500 119.624 0.876 25380
1564 1 4 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.236 0.736 25380
1565 1 4 . 1 1 28 28 PHE C C 28 177.386 177.386 176.334 1.052 25380
1566 1 4 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.821 -0.420 25380
1567 1 4 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.357 0.211 25380
1568 1 4 . 1 1 28 28 PHE H H 28 8.568 8.568 8.050 0.518 25380
1569 1 4 . 1 1 29 29 SER N N 29 114.306 114.306 114.066 0.240 25380
1570 1 4 . 1 1 29 29 SER HA H 29 4.288 4.288 4.327 -0.039 25380
1571 1 4 . 1 1 29 29 SER C C 29 175.656 175.656 176.504 -0.848 25380
1572 1 4 . 1 1 29 29 SER CA C 29 61.058 61.058 60.232 0.826 25380
1573 1 4 . 1 1 29 29 SER CB C 29 63.555 63.555 63.644 -0.089 25380
1574 1 4 . 1 1 29 29 SER H H 29 8.479 8.479 7.905 0.574 25380
1575 1 4 . 1 1 30 30 GLU N N 30 118.322 118.322 120.982 -2.660 25380
1576 1 4 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.247 -0.155 25380
1577 1 4 . 1 1 30 30 GLU C C 30 177.312 177.312 176.791 0.521 25380
1578 1 4 . 1 1 30 30 GLU CA C 30 57.580 57.580 58.062 -0.482 25380
1579 1 4 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.619 -1.042 25380
1580 1 4 . 1 1 30 30 GLU H H 30 8.428 8.428 8.147 0.281 25380
1581 1 4 . 1 1 31 31 ASP N N 31 115.630 115.630 115.343 0.287 25380
1582 1 4 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.785 0.025 25380
1583 1 4 . 1 1 31 31 ASP C C 31 175.723 175.723 173.853 1.870 25380
1584 1 4 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.733 1.240 25380
1585 1 4 . 1 1 31 31 ASP CB C 31 40.818 40.818 43.281 -2.463 25380
1586 1 4 . 1 1 31 31 ASP H H 31 7.303 7.303 8.131 -0.828 25380
1587 1 4 . 1 1 32 32 LYS N N 32 114.357 114.357 119.365 -5.008 25380
1588 1 4 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.337 -0.510 25380
1589 1 4 . 1 1 32 32 LYS C C 32 175.716 175.716 175.950 -0.234 25380
1590 1 4 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.657 0.505 25380
1591 1 4 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.145 -4.764 25380
1592 1 4 . 1 1 32 32 LYS H H 32 7.148 7.148 8.220 -1.072 25380
1593 1 4 . 1 1 33 33 ARG N N 33 120.929 120.929 123.200 -2.271 25380
1594 1 4 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.727 -0.526 25380
1595 1 4 . 1 1 33 33 ARG C C 33 173.982 173.982 174.062 -0.080 25380
1596 1 4 . 1 1 33 33 ARG CA C 33 56.194 56.194 54.864 1.330 25380
1597 1 4 . 1 1 33 33 ARG CB C 33 30.642 30.642 32.846 -2.204 25380
1598 1 4 . 1 1 33 33 ARG H H 33 7.388 7.388 8.782 -1.394 25380
1599 1 4 . 1 1 34 34 SER N N 34 115.867 115.867 114.129 1.738 25380
1600 1 4 . 1 1 34 34 SER HA H 34 5.355 5.355 4.684 0.671 25380
1601 1 4 . 1 1 34 34 SER C C 34 172.754 172.754 172.339 0.415 25380
1602 1 4 . 1 1 34 34 SER CA C 34 58.236 58.236 56.906 1.330 25380
1603 1 4 . 1 1 34 34 SER CB C 34 65.212 65.212 66.302 -1.090 25380
1604 1 4 . 1 1 34 34 SER H H 34 8.173 8.173 8.200 -0.027 25380
1605 1 4 . 1 1 35 35 ILE N N 35 119.621 119.621 113.324 6.297 25380
1606 1 4 . 1 1 35 35 ILE HA H 35 4.863 4.863 5.042 -0.179 25380
1607 1 4 . 1 1 35 35 ILE C C 35 174.069 174.069 173.568 0.501 25380
1608 1 4 . 1 1 35 35 ILE CA C 35 59.956 59.956 58.995 0.961 25380
1609 1 4 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.725 -1.070 25380
1610 1 4 . 1 1 35 35 ILE H H 35 6.779 6.779 8.490 -1.711 25380
1611 1 4 . 1 1 36 36 PHE N N 36 124.305 124.305 120.750 3.555 25380
1612 1 4 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.708 -1.255 25380
1613 1 4 . 1 1 36 36 PHE C C 36 173.204 173.204 174.987 -1.783 25380
1614 1 4 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.391 0.026 25380
1615 1 4 . 1 1 36 36 PHE CB C 36 44.817 44.817 42.150 2.667 25380
1616 1 4 . 1 1 36 36 PHE H H 36 8.411 8.411 9.265 -0.854 25380
1617 1 4 . 1 1 37 37 TYR N N 37 118.743 118.743 126.818 -8.075 25380
1618 1 4 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.186 0.384 25380
1619 1 4 . 1 1 37 37 TYR C C 37 175.455 175.455 173.863 1.592 25380
1620 1 4 . 1 1 37 37 TYR CA C 37 56.518 56.518 54.845 1.673 25380
1621 1 4 . 1 1 37 37 TYR CB C 37 40.991 40.991 40.550 0.441 25380
1622 1 4 . 1 1 37 37 TYR H H 37 8.353 8.353 9.475 -1.122 25380
1623 1 4 . 1 1 38 38 PHE N N 38 119.236 119.236 130.689 -11.453 25380
1624 1 4 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.200 0.960 25380
1625 1 4 . 1 1 38 38 PHE C C 38 174.650 174.650 172.740 1.910 25380
1626 1 4 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.267 1.575 25380
1627 1 4 . 1 1 38 38 PHE CB C 38 42.619 42.619 38.578 4.041 25380
1628 1 4 . 1 1 38 38 PHE H H 38 9.756 9.756 9.169 0.587 25380
1629 1 4 . 1 1 39 39 ALA N N 39 122.516 122.516 129.755 -7.239 25380
1630 1 4 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.559 -0.019 25380
1631 1 4 . 1 1 39 39 ALA C C 39 177.042 177.042 174.110 2.932 25380
1632 1 4 . 1 1 39 39 ALA CA C 39 50.843 50.843 48.552 2.291 25380
1633 1 4 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.354 -2.776 25380
1634 1 4 . 1 1 39 39 ALA H H 39 7.738 7.738 8.088 -0.350 25380
1635 1 4 . 1 1 40 40 PRO C C 40 175.411 175.411 177.196 -1.785 25380
1636 1 4 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.468 1.820 25380
1637 1 4 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.716 -1.612 25380
1638 1 4 . 1 1 41 41 THR N N 41 105.878 105.878 116.575 -10.697 25380
1639 1 4 . 1 1 41 41 THR HA H 41 4.190 4.190 3.829 0.361 25380
1640 1 4 . 1 1 41 41 THR C C 41 176.400 176.400 175.531 0.869 25380
1641 1 4 . 1 1 41 41 THR CA C 41 61.937 61.937 65.286 -3.349 25380
1642 1 4 . 1 1 41 41 THR CB C 41 68.331 68.331 68.388 -0.057 25380
1643 1 4 . 1 1 41 41 THR H H 41 6.715 6.715 8.213 -1.498 25380
1644 1 4 . 1 1 42 42 ASN N N 42 118.863 118.863 118.674 0.189 25380
1645 1 4 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.406 0.129 25380
1646 1 4 . 1 1 42 42 ASN C C 42 173.764 173.764 175.780 -2.016 25380
1647 1 4 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.716 -1.540 25380
1648 1 4 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.615 4.099 25380
1649 1 4 . 1 1 42 42 ASN H H 42 7.153 7.153 8.397 -1.244 25380
1650 1 4 . 1 1 43 43 ALA N N 43 126.174 126.174 118.501 7.673 25380
1651 1 4 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.394 0.031 25380
1652 1 4 . 1 1 43 43 ALA C C 43 179.308 179.308 176.732 2.576 25380
1653 1 4 . 1 1 43 43 ALA CA C 43 51.982 51.982 51.816 0.166 25380
1654 1 4 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.701 -1.407 25380
1655 1 4 . 1 1 43 43 ALA H H 43 9.465 9.465 7.815 1.650 25380
1656 1 4 . 1 1 44 44 HIS N N 44 126.251 126.251 116.110 10.141 25380
1657 1 4 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.218 -0.392 25380
1658 1 4 . 1 1 44 44 HIS C C 44 177.407 177.407 174.935 2.472 25380
1659 1 4 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.847 4.178 25380
1660 1 4 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.136 1.494 25380
1661 1 4 . 1 1 44 44 HIS H H 44 9.407 9.407 7.621 1.786 25380
1662 1 4 . 1 1 45 45 LYS N N 45 114.990 114.990 120.062 -5.072 25380
1663 1 4 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.057 -0.174 25380
1664 1 4 . 1 1 45 45 LYS C C 45 178.284 178.284 177.215 1.069 25380
1665 1 4 . 1 1 45 45 LYS CA C 45 59.249 59.249 58.322 0.927 25380
1666 1 4 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.702 -0.868 25380
1667 1 4 . 1 1 45 45 LYS H H 45 8.960 8.960 7.896 1.064 25380
1668 1 4 . 1 1 46 46 ASP N N 46 120.411 120.411 119.371 1.040 25380
1669 1 4 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.409 0.017 25380
1670 1 4 . 1 1 46 46 ASP C C 46 177.773 177.773 178.366 -0.593 25380
1671 1 4 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.665 -0.649 25380
1672 1 4 . 1 1 46 46 ASP CB C 46 39.897 39.897 39.831 0.066 25380
1673 1 4 . 1 1 46 46 ASP H H 46 6.777 6.777 8.306 -1.529 25380
1674 1 4 . 1 1 47 47 MET N N 47 118.178 118.178 119.534 -1.356 25380
1675 1 4 . 1 1 47 47 MET HA H 47 3.879 3.879 4.025 -0.146 25380
1676 1 4 . 1 1 47 47 MET C C 47 179.499 179.499 177.740 1.759 25380
1677 1 4 . 1 1 47 47 MET CA C 47 56.052 56.052 59.215 -3.163 25380
1678 1 4 . 1 1 47 47 MET CB C 47 29.601 29.601 32.522 -2.921 25380
1679 1 4 . 1 1 47 47 MET H H 47 7.367 7.367 7.920 -0.553 25380
1680 1 4 . 1 1 48 48 LEU N N 48 117.665 117.665 118.638 -0.973 25380
1681 1 4 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.824 0.023 25380
1682 1 4 . 1 1 48 48 LEU C C 48 179.843 179.843 178.719 1.124 25380
1683 1 4 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.362 0.218 25380
1684 1 4 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.435 -0.482 25380
1685 1 4 . 1 1 48 48 LEU H H 48 7.672 7.672 7.491 0.181 25380
1686 1 4 . 1 1 49 49 LYS N N 49 119.326 119.326 118.306 1.020 25380
1687 1 4 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.495 0.632 25380
1688 1 4 . 1 1 49 49 LYS C C 49 179.684 179.684 178.310 1.374 25380
1689 1 4 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.017 -0.218 25380
1690 1 4 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.621 -0.168 25380
1691 1 4 . 1 1 49 49 LYS H H 49 7.420 7.420 7.526 -0.106 25380
1692 1 4 . 1 1 50 50 ALA N N 50 122.022 122.022 122.830 -0.808 25380
1693 1 4 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.462 0.581 25380
1694 1 4 . 1 1 50 50 ALA C C 50 178.818 178.818 179.016 -0.198 25380
1695 1 4 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.753 0.416 25380
1696 1 4 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.650 -0.350 25380
1697 1 4 . 1 1 50 50 ALA H H 50 7.551 7.551 8.030 -0.479 25380
1698 1 4 . 1 1 51 51 VAL N N 51 118.165 118.165 118.289 -0.124 25380
1699 1 4 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.531 -0.089 25380
1700 1 4 . 1 1 51 51 VAL C C 51 178.646 178.646 178.246 0.400 25380
1701 1 4 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.537 0.669 25380
1702 1 4 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.816 0.637 25380
1703 1 4 . 1 1 51 51 VAL H H 51 7.226 7.226 7.508 -0.282 25380
1704 1 4 . 1 1 52 52 ASP N N 52 122.298 122.298 120.126 2.172 25380
1705 1 4 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.477 -0.106 25380
1706 1 4 . 1 1 52 52 ASP C C 52 177.898 177.898 179.181 -1.283 25380
1707 1 4 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.121 0.450 25380
1708 1 4 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.461 -0.075 25380
1709 1 4 . 1 1 52 52 ASP H H 52 8.232 8.232 7.359 0.873 25380
1710 1 4 . 1 1 53 53 PHE N N 53 121.541 121.541 120.472 1.069 25380
1711 1 4 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.293 0.028 25380
1712 1 4 . 1 1 53 53 PHE C C 53 177.224 177.224 178.193 -0.969 25380
1713 1 4 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.412 2.668 25380
1714 1 4 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.821 1.879 25380
1715 1 4 . 1 1 53 53 PHE H H 53 8.240 8.240 8.369 -0.129 25380
1716 1 4 . 1 1 54 54 PHE N N 54 115.925 115.925 117.442 -1.517 25380
1717 1 4 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.241 -0.586 25380
1718 1 4 . 1 1 54 54 PHE C C 54 178.269 178.269 177.610 0.659 25380
1719 1 4 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.759 4.441 25380
1720 1 4 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.984 0.594 25380
1721 1 4 . 1 1 54 54 PHE H H 54 7.755 7.755 8.382 -0.627 25380
1722 1 4 . 1 1 55 55 LYS N N 55 120.251 120.251 118.283 1.968 25380
1723 1 4 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.090 0.336 25380
1724 1 4 . 1 1 55 55 LYS C C 55 181.484 181.484 178.456 3.028 25380
1725 1 4 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.981 0.648 25380
1726 1 4 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.498 -0.759 25380
1727 1 4 . 1 1 55 55 LYS H H 55 8.213 8.213 7.458 0.755 25380
1728 1 4 . 1 1 56 56 GLU N N 56 120.146 120.146 117.493 2.653 25380
1729 1 4 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.145 -0.152 25380
1730 1 4 . 1 1 56 56 GLU C C 56 178.085 178.085 177.568 0.517 25380
1731 1 4 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.311 0.477 25380
1732 1 4 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.055 -1.459 25380
1733 1 4 . 1 1 56 56 GLU H H 56 7.850 7.850 8.168 -0.318 25380
1734 1 4 . 1 1 57 57 LYS N N 57 115.940 115.940 119.284 -3.344 25380
1735 1 4 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.473 -0.370 25380
1736 1 4 . 1 1 57 57 LYS C C 57 176.225 176.225 177.115 -0.890 25380
1737 1 4 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.166 -0.595 25380
1738 1 4 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.505 -1.469 25380
1739 1 4 . 1 1 57 57 LYS H H 57 7.019 7.019 7.709 -0.690 25380
1740 1 4 . 1 1 58 58 GLY N N 58 106.593 106.593 110.877 -4.284 25380
1741 1 4 . 1 1 58 58 GLY C C 58 174.350 174.350 174.865 -0.515 25380
1742 1 4 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.780 -0.280 25380
1743 1 4 . 1 1 58 58 GLY H H 58 7.883 7.883 8.575 -0.692 25380
1744 1 4 . 1 1 59 59 HIS N N 59 117.962 117.962 117.828 0.134 25380
1745 1 4 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.074 0.793 25380
1746 1 4 . 1 1 59 59 HIS C C 59 173.271 173.271 175.618 -2.347 25380
1747 1 4 . 1 1 59 59 HIS CA C 59 54.778 54.778 57.757 -2.979 25380
1748 1 4 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.682 2.003 25380
1749 1 4 . 1 1 59 59 HIS H H 59 8.218 8.218 7.884 0.334 25380
1750 1 4 . 1 1 60 60 THR N N 60 119.624 119.624 111.885 7.739 25380
1751 1 4 . 1 1 60 60 THR HA H 60 4.430 4.430 4.248 0.182 25380
1752 1 4 . 1 1 60 60 THR C C 60 171.430 171.430 173.905 -2.475 25380
1753 1 4 . 1 1 60 60 THR CA C 60 63.480 63.480 62.439 1.041 25380
1754 1 4 . 1 1 60 60 THR CB C 60 69.761 69.761 69.797 -0.036 25380
1755 1 4 . 1 1 60 60 THR H H 60 8.780 8.780 7.790 0.990 25380
1756 1 4 . 1 1 61 61 ALA N N 61 126.706 126.706 128.950 -2.244 25380
1757 1 4 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.400 0.846 25380
1758 1 4 . 1 1 61 61 ALA C C 61 174.753 174.753 176.757 -2.004 25380
1759 1 4 . 1 1 61 61 ALA CA C 61 49.772 49.772 53.104 -3.332 25380
1760 1 4 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.599 2.290 25380
1761 1 4 . 1 1 61 61 ALA H H 61 7.795 7.795 8.636 -0.841 25380
1762 1 4 . 1 1 62 62 TYR N N 62 117.859 117.859 119.245 -1.386 25380
1763 1 4 . 1 1 62 62 TYR C C 62 173.431 173.431 172.917 0.514 25380
1764 1 4 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.214 -0.567 25380
1765 1 4 . 1 1 62 62 TYR CB C 62 40.549 40.549 41.316 -0.767 25380
1766 1 4 . 1 1 62 62 TYR H H 62 8.711 8.711 7.890 0.821 25380
1767 1 4 . 1 1 63 63 LEU N N 63 125.044 125.044 129.482 -4.438 25380
1768 1 4 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.959 0.452 25380
1769 1 4 . 1 1 63 63 LEU C C 63 175.319 175.319 174.568 0.751 25380
1770 1 4 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.349 -0.119 25380
1771 1 4 . 1 1 63 63 LEU CB C 63 45.701 45.701 44.611 1.091 25380
1772 1 4 . 1 1 63 63 LEU H H 63 8.746 8.746 8.185 0.561 25380
1773 1 4 . 1 1 64 64 ASP N N 64 125.463 125.463 124.082 1.381 25380
1774 1 4 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.857 0.342 25380
1775 1 4 . 1 1 64 64 ASP C C 64 174.512 174.512 174.251 0.261 25380
1776 1 4 . 1 1 64 64 ASP CA C 64 52.700 52.700 51.812 0.888 25380
1777 1 4 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.056 -0.102 25380
1778 1 4 . 1 1 64 64 ASP H H 64 9.293 9.293 8.811 0.482 25380
1779 1 4 . 1 1 65 65 GLU N N 65 120.711 120.711 119.304 1.407 25380
1780 1 4 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.458 0.609 25380
1781 1 4 . 1 1 65 65 GLU C C 65 175.652 175.652 176.411 -0.759 25380
1782 1 4 . 1 1 65 65 GLU CA C 65 55.643 55.643 56.471 -0.828 25380
1783 1 4 . 1 1 65 65 GLU CB C 65 30.455 30.455 31.142 -0.687 25380
1784 1 4 . 1 1 65 65 GLU H H 65 8.715 8.715 8.502 0.213 25380
1785 1 4 . 1 1 66 66 VAL N N 66 122.936 122.936 117.364 5.572 25380
1786 1 4 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.409 0.021 25380
1787 1 4 . 1 1 66 66 VAL C C 66 175.065 175.065 176.419 -1.354 25380
1788 1 4 . 1 1 66 66 VAL CA C 66 60.991 60.991 60.763 0.229 25380
1789 1 4 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.685 1.595 25380
1790 1 4 . 1 1 66 66 VAL H H 66 9.156 9.156 8.581 0.575 25380
1791 1 4 . 1 1 67 67 ARG N N 67 126.104 126.104 121.067 5.037 25380
1792 1 4 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.106 0.435 25380
1793 1 4 . 1 1 67 67 ARG C C 67 176.708 176.708 178.049 -1.341 25380
1794 1 4 . 1 1 67 67 ARG CA C 67 56.080 56.080 59.247 -3.167 25380
1795 1 4 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.817 1.091 25380
1796 1 4 . 1 1 67 67 ARG H H 67 8.734 8.734 8.762 -0.028 25380
1797 1 4 . 1 1 68 68 VAL N N 68 120.707 120.707 114.700 6.007 25380
1798 1 4 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.012 0.140 25380
1799 1 4 . 1 1 68 68 VAL C C 68 175.931 175.931 176.552 -0.621 25380
1800 1 4 . 1 1 68 68 VAL CA C 68 62.776 62.776 64.290 -1.514 25380
1801 1 4 . 1 1 68 68 VAL CB C 68 32.489 32.489 30.734 1.755 25380
1802 1 4 . 1 1 68 68 VAL H H 68 8.384 8.384 8.156 0.228 25380
1803 1 4 . 1 1 69 69 SER N N 69 116.156 116.156 118.065 -1.909 25380
1804 1 4 . 1 1 69 69 SER HA H 69 4.693 4.693 4.213 0.480 25380
1805 1 4 . 1 1 69 69 SER C C 69 174.544 174.544 176.602 -2.058 25380
1806 1 4 . 1 1 69 69 SER CA C 69 57.754 57.754 62.323 -4.569 25380
1807 1 4 . 1 1 69 69 SER CB C 69 64.831 64.831 63.227 1.605 25380
1808 1 4 . 1 1 69 69 SER H H 69 8.067 8.067 7.715 0.352 25380
1809 1 4 . 1 1 70 70 THR N N 70 110.753 110.753 114.113 -3.360 25380
1810 1 4 . 1 1 70 70 THR HA H 70 4.152 4.152 4.089 0.063 25380
1811 1 4 . 1 1 70 70 THR C C 70 174.865 174.865 175.900 -1.035 25380
1812 1 4 . 1 1 70 70 THR CA C 70 63.831 63.831 65.438 -1.607 25380
1813 1 4 . 1 1 70 70 THR CB C 70 68.956 68.956 68.805 0.151 25380
1814 1 4 . 1 1 70 70 THR H H 70 8.095 8.095 7.742 0.353 25380
1815 1 4 . 1 1 71 71 ASP N N 71 121.817 121.817 121.964 -0.147 25380
1816 1 4 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.612 -0.022 25380
1817 1 4 . 1 1 71 71 ASP C C 71 176.746 176.746 177.594 -0.848 25380
1818 1 4 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.443 -2.179 25380
1819 1 4 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.908 0.517 25380
1820 1 4 . 1 1 71 71 ASP H H 71 8.076 8.076 8.199 -0.123 25380
1821 1 4 . 1 1 72 72 GLU N N 72 123.635 123.635 116.126 7.509 25380
1822 1 4 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.522 -0.529 25380
1823 1 4 . 1 1 72 72 GLU C C 72 176.971 176.971 175.521 1.450 25380
1824 1 4 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.328 1.891 25380
1825 1 4 . 1 1 72 72 GLU CB C 72 29.702 29.702 31.703 -2.001 25380
1826 1 4 . 1 1 72 72 GLU H H 72 8.514 8.514 8.027 0.487 25380
1827 1 4 . 1 1 73 73 LYS N N 73 117.857 117.857 118.552 -0.695 25380
1828 1 4 . 1 1 73 73 LYS HA H 73 4.643 4.643 3.930 0.713 25380
1829 1 4 . 1 1 73 73 LYS C C 73 176.508 176.508 175.598 0.910 25380
1830 1 4 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.300 -0.220 25380
1831 1 4 . 1 1 73 73 LYS CB C 73 32.203 32.203 30.761 1.442 25380
1832 1 4 . 1 1 73 73 LYS H H 73 8.423 8.423 8.294 0.129 25380
1833 1 4 . 1 1 74 74 ASP N N 74 120.580 120.580 117.145 3.435 25380
1834 1 4 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.171 0.587 25380
1835 1 4 . 1 1 74 74 ASP C C 74 174.059 174.059 175.806 -1.747 25380
1836 1 4 . 1 1 74 74 ASP CA C 74 53.279 53.279 56.181 -2.902 25380
1837 1 4 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.560 -0.982 25380
1838 1 4 . 1 1 74 74 ASP H H 74 7.918 7.918 8.413 -0.495 25380
1839 1 4 . 1 1 75 75 PHE N N 75 118.513 118.513 117.880 0.633 25380
1840 1 4 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.516 -0.153 25380
1841 1 4 . 1 1 75 75 PHE C C 75 173.038 173.038 174.958 -1.920 25380
1842 1 4 . 1 1 75 75 PHE CA C 75 55.522 55.522 57.186 -1.664 25380
1843 1 4 . 1 1 75 75 PHE CB C 75 41.714 41.714 41.825 -0.111 25380
1844 1 4 . 1 1 75 75 PHE H H 75 7.397 7.397 7.731 -0.334 25380
1845 1 4 . 1 1 76 76 LEU N N 76 116.773 116.773 123.498 -6.725 25380
1846 1 4 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.903 -0.260 25380
1847 1 4 . 1 1 76 76 LEU C C 76 177.553 177.553 175.645 1.908 25380
1848 1 4 . 1 1 76 76 LEU CA C 76 53.619 53.619 53.980 -0.361 25380
1849 1 4 . 1 1 76 76 LEU CB C 76 45.701 45.701 44.284 1.417 25380
1850 1 4 . 1 1 76 76 LEU H H 76 8.774 8.774 9.245 -0.471 25380
1851 1 4 . 1 1 77 77 TYR N N 77 118.377 118.377 125.700 -7.323 25380
1852 1 4 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.535 0.880 25380
1853 1 4 . 1 1 77 77 TYR C C 77 175.479 175.479 173.300 2.179 25380
1854 1 4 . 1 1 77 77 TYR CA C 77 58.391 58.391 55.168 3.223 25380
1855 1 4 . 1 1 77 77 TYR CB C 77 41.100 41.100 39.033 2.067 25380
1856 1 4 . 1 1 77 77 TYR H H 77 8.589 8.589 9.146 -0.557 25380
1857 1 4 . 1 1 78 78 GLU N N 78 123.875 123.875 129.707 -5.832 25380
1858 1 4 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.979 -0.006 25380
1859 1 4 . 1 1 78 78 GLU C C 78 174.120 174.120 173.790 0.330 25380
1860 1 4 . 1 1 78 78 GLU CA C 78 54.378 54.378 53.928 0.450 25380
1861 1 4 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.549 -0.909 25380
1862 1 4 . 1 1 78 78 GLU H H 78 9.576 9.576 8.824 0.752 25380
1863 1 4 . 1 1 79 79 LEU N N 79 128.661 128.661 126.799 1.862 25380
1864 1 4 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.341 0.948 25380
1865 1 4 . 1 1 79 79 LEU C C 79 174.219 174.219 175.207 -0.988 25380
1866 1 4 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.913 -0.765 25380
1867 1 4 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.036 2.594 25380
1868 1 4 . 1 1 79 79 LEU H H 79 9.139 9.139 8.973 0.166 25380
1869 1 4 . 1 1 80 80 HIS N N 80 124.886 124.886 122.464 2.422 25380
1870 1 4 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.801 0.629 25380
1871 1 4 . 1 1 80 80 HIS C C 80 173.346 173.346 176.218 -2.872 25380
1872 1 4 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.930 -1.781 25380
1873 1 4 . 1 1 80 80 HIS CB C 80 30.768 30.768 31.148 -0.380 25380
1874 1 4 . 1 1 80 80 HIS H H 80 8.897 8.897 8.680 0.217 25380
1875 1 4 . 1 1 81 81 ILE N N 81 125.173 125.173 121.861 3.312 25380
1876 1 4 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.597 0.693 25380
1877 1 4 . 1 1 81 81 ILE C C 81 174.600 174.600 175.679 -1.079 25380
1878 1 4 . 1 1 81 81 ILE CA C 81 60.500 60.500 65.143 -4.643 25380
1879 1 4 . 1 1 81 81 ILE CB C 81 39.700 39.700 37.196 2.504 25380
1880 1 4 . 1 1 81 81 ILE H H 81 8.909 8.909 8.499 0.410 25380
1881 1 5 . 1 1 2 2 HIS N N 2 120.430 120.430 123.398 -2.968 25380
1882 1 5 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.684 0.051 25380
1883 1 5 . 1 1 2 2 HIS C C 2 173.884 173.884 174.708 -0.824 25380
1884 1 5 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.551 -1.500 25380
1885 1 5 . 1 1 2 2 HIS CB C 2 28.666 28.666 28.423 0.243 25380
1886 1 5 . 1 1 2 2 HIS H H 2 8.678 8.678 8.649 0.029 25380
1887 1 5 . 1 1 3 3 MET N N 3 122.377 122.377 118.361 4.016 25380
1888 1 5 . 1 1 3 3 MET HA H 3 4.207 4.207 4.796 -0.589 25380
1889 1 5 . 1 1 3 3 MET C C 3 174.584 174.584 175.638 -1.054 25380
1890 1 5 . 1 1 3 3 MET CA C 3 56.550 56.550 55.256 1.294 25380
1891 1 5 . 1 1 3 3 MET CB C 3 33.426 33.426 33.215 0.211 25380
1892 1 5 . 1 1 3 3 MET H H 3 8.240 8.240 7.863 0.377 25380
1893 1 5 . 1 1 4 4 LYS N N 4 123.568 123.568 117.407 6.161 25380
1894 1 5 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.019 0.820 25380
1895 1 5 . 1 1 4 4 LYS C C 4 175.906 175.906 174.866 1.040 25380
1896 1 5 . 1 1 4 4 LYS CA C 4 54.800 54.800 56.979 -2.179 25380
1897 1 5 . 1 1 4 4 LYS CB C 4 34.900 34.900 30.285 4.615 25380
1898 1 5 . 1 1 4 4 LYS H H 4 8.351 8.351 8.432 -0.081 25380
1899 1 5 . 1 1 5 5 LEU N N 5 123.568 123.568 113.110 10.458 25380
1900 1 5 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.908 -1.069 25380
1901 1 5 . 1 1 5 5 LEU C C 5 175.900 175.900 175.985 -0.085 25380
1902 1 5 . 1 1 5 5 LEU CA C 5 53.350 53.350 52.851 0.499 25380
1903 1 5 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.091 0.809 25380
1904 1 5 . 1 1 5 5 LEU H H 5 8.281 8.281 7.565 0.716 25380
1905 1 5 . 1 1 6 6 VAL N N 6 121.564 121.564 120.795 0.769 25380
1906 1 5 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.270 0.156 25380
1907 1 5 . 1 1 6 6 VAL C C 6 178.200 178.200 175.139 3.061 25380
1908 1 5 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.686 2.514 25380
1909 1 5 . 1 1 6 6 VAL CB C 6 33.200 33.200 33.525 -0.325 25380
1910 1 5 . 1 1 6 6 VAL H H 6 9.276 9.276 8.937 0.339 25380
1911 1 5 . 1 1 7 7 LEU N N 7 121.564 121.564 125.606 -4.042 25380
1912 1 5 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.272 -0.846 25380
1913 1 5 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.102 10.098 25380
1914 1 5 . 1 1 7 7 LEU CB C 7 33.200 33.200 45.080 -11.880 25380
1915 1 5 . 1 1 7 7 LEU H H 7 9.276 9.276 8.528 0.748 25380
1916 1 5 . 1 1 8 8 ALA C C 8 177.040 177.040 177.553 -0.513 25380
1917 1 5 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.575 -0.874 25380
1918 1 5 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.868 0.996 25380
1919 1 5 . 1 1 9 9 LYS N N 9 119.845 119.845 124.333 -4.488 25380
1920 1 5 . 1 1 9 9 LYS HA H 9 4.128 4.128 4.126 0.002 25380
1921 1 5 . 1 1 9 9 LYS C C 9 176.075 176.075 178.235 -2.160 25380
1922 1 5 . 1 1 9 9 LYS CA C 9 56.761 56.761 58.722 -1.961 25380
1923 1 5 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.506 0.413 25380
1924 1 5 . 1 1 9 9 LYS H H 9 8.545 8.545 8.551 -0.006 25380
1925 1 5 . 1 1 10 10 ASN N N 10 119.279 119.279 120.094 -0.815 25380
1926 1 5 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.515 0.130 25380
1927 1 5 . 1 1 10 10 ASN C C 10 175.443 175.443 177.331 -1.888 25380
1928 1 5 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.998 -2.341 25380
1929 1 5 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.711 1.066 25380
1930 1 5 . 1 1 10 10 ASN H H 10 8.592 8.592 8.315 0.277 25380
1931 1 5 . 1 1 11 11 THR N N 11 111.876 111.876 111.567 0.309 25380
1932 1 5 . 1 1 11 11 THR HA H 11 4.311 4.311 4.210 0.101 25380
1933 1 5 . 1 1 11 11 THR C C 11 174.666 174.666 175.614 -0.948 25380
1934 1 5 . 1 1 11 11 THR CA C 11 62.044 62.044 64.428 -2.384 25380
1935 1 5 . 1 1 11 11 THR CB C 11 69.895 69.895 68.797 1.098 25380
1936 1 5 . 1 1 11 11 THR H H 11 8.058 8.058 8.312 -0.254 25380
1937 1 5 . 1 1 12 12 ARG N N 12 121.152 121.152 120.500 0.652 25380
1938 1 5 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.445 -0.183 25380
1939 1 5 . 1 1 12 12 ARG C C 12 176.714 176.714 176.267 0.447 25380
1940 1 5 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.208 0.614 25380
1941 1 5 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.231 -0.529 25380
1942 1 5 . 1 1 12 12 ARG H H 12 8.291 8.291 7.818 0.473 25380
1943 1 5 . 1 1 13 13 LYS N N 13 120.459 120.459 120.686 -0.227 25380
1944 1 5 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.022 -0.126 25380
1945 1 5 . 1 1 13 13 LYS C C 13 176.682 176.682 177.353 -0.671 25380
1946 1 5 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.042 -0.064 25380
1947 1 5 . 1 1 13 13 LYS CB C 13 32.498 32.498 32.288 0.210 25380
1948 1 5 . 1 1 13 13 LYS H H 13 8.286 8.286 8.246 0.040 25380
1949 1 5 . 1 1 14 14 SER N N 14 114.568 114.568 121.916 -7.348 25380
1950 1 5 . 1 1 14 14 SER HA H 14 4.371 4.371 4.392 -0.021 25380
1951 1 5 . 1 1 14 14 SER C C 14 173.990 173.990 174.650 -0.660 25380
1952 1 5 . 1 1 14 14 SER CA C 14 58.617 58.617 58.878 -0.261 25380
1953 1 5 . 1 1 14 14 SER CB C 14 63.933 63.933 63.815 0.118 25380
1954 1 5 . 1 1 14 14 SER H H 14 7.957 7.957 8.478 -0.521 25380
1955 1 5 . 1 1 15 15 ASP N N 15 121.565 121.565 118.639 2.926 25380
1956 1 5 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.733 -0.132 25380
1957 1 5 . 1 1 15 15 ASP C C 15 175.684 175.684 176.404 -0.720 25380
1958 1 5 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.937 0.212 25380
1959 1 5 . 1 1 15 15 ASP CB C 15 41.229 41.229 39.905 1.324 25380
1960 1 5 . 1 1 15 15 ASP H H 15 8.166 8.166 8.461 -0.295 25380
1961 1 5 . 1 1 16 16 ALA N N 16 124.173 124.173 123.181 0.992 25380
1962 1 5 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.047 0.324 25380
1963 1 5 . 1 1 16 16 ALA C C 16 177.184 177.184 177.351 -0.167 25380
1964 1 5 . 1 1 16 16 ALA CA C 16 52.337 52.337 54.078 -1.741 25380
1965 1 5 . 1 1 16 16 ALA CB C 16 19.359 19.359 18.660 0.699 25380
1966 1 5 . 1 1 16 16 ALA H H 16 8.163 8.163 8.242 -0.079 25380
1967 1 5 . 1 1 17 17 LYS N N 17 121.152 121.152 118.507 2.645 25380
1968 1 5 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.386 0.040 25380
1969 1 5 . 1 1 17 17 LYS C C 17 175.488 175.488 176.102 -0.614 25380
1970 1 5 . 1 1 17 17 LYS CA C 17 56.205 56.205 56.274 -0.069 25380
1971 1 5 . 1 1 17 17 LYS CB C 17 34.296 34.296 31.057 3.239 25380
1972 1 5 . 1 1 17 17 LYS H H 17 8.363 8.363 8.491 -0.128 25380
1973 1 5 . 1 1 18 18 SER N N 18 116.448 116.448 115.006 1.442 25380
1974 1 5 . 1 1 18 18 SER HA H 18 5.355 5.355 4.702 0.653 25380
1975 1 5 . 1 1 18 18 SER C C 18 173.887 173.887 175.752 -1.865 25380
1976 1 5 . 1 1 18 18 SER CA C 18 57.248 57.248 58.167 -0.919 25380
1977 1 5 . 1 1 18 18 SER CB C 18 64.962 64.962 64.446 0.516 25380
1978 1 5 . 1 1 18 18 SER H H 18 8.206 8.206 8.136 0.070 25380
1979 1 5 . 1 1 19 19 VAL N N 19 117.867 117.867 123.038 -5.171 25380
1980 1 5 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.672 -0.052 25380
1981 1 5 . 1 1 19 19 VAL C C 19 174.169 174.169 177.480 -3.311 25380
1982 1 5 . 1 1 19 19 VAL CA C 19 59.546 59.546 65.634 -6.088 25380
1983 1 5 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.175 4.726 25380
1984 1 5 . 1 1 19 19 VAL H H 19 9.086 9.086 7.909 1.177 25380
1985 1 5 . 1 1 20 20 GLU N N 20 120.843 120.843 119.769 1.074 25380
1986 1 5 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.054 0.814 25380
1987 1 5 . 1 1 20 20 GLU C C 20 178.747 178.747 178.930 -0.183 25380
1988 1 5 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.539 -4.987 25380
1989 1 5 . 1 1 20 20 GLU CB C 20 31.099 31.099 28.715 2.384 25380
1990 1 5 . 1 1 20 20 GLU H H 20 8.841 8.841 8.571 0.270 25380
1991 1 5 . 1 1 21 21 LEU N N 21 122.653 122.653 120.929 1.724 25380
1992 1 5 . 1 1 21 21 LEU HA H 21 3.443 3.443 3.982 -0.539 25380
1993 1 5 . 1 1 21 21 LEU C C 21 178.799 178.799 179.170 -0.371 25380
1994 1 5 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.822 0.885 25380
1995 1 5 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.642 -3.071 25380
1996 1 5 . 1 1 21 21 LEU H H 21 8.744 8.744 7.594 1.150 25380
1997 1 5 . 1 1 22 22 GLU N N 22 115.392 115.392 119.674 -4.282 25380
1998 1 5 . 1 1 22 22 GLU HA H 22 3.989 3.989 4.119 -0.130 25380
1999 1 5 . 1 1 22 22 GLU C C 22 179.328 179.328 179.301 0.027 25380
2000 1 5 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.749 0.331 25380
2001 1 5 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.499 -0.665 25380
2002 1 5 . 1 1 22 22 GLU H H 22 8.744 8.744 7.623 1.121 25380
2003 1 5 . 1 1 23 23 ASP N N 23 118.597 118.597 121.307 -2.710 25380
2004 1 5 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.509 0.102 25380
2005 1 5 . 1 1 23 23 ASP C C 23 179.139 179.139 178.881 0.258 25380
2006 1 5 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.475 0.044 25380
2007 1 5 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.468 -0.026 25380
2008 1 5 . 1 1 23 23 ASP H H 23 7.098 7.098 8.549 -1.451 25380
2009 1 5 . 1 1 24 24 LEU N N 24 119.869 119.869 121.226 -1.357 25380
2010 1 5 . 1 1 24 24 LEU HA H 24 3.934 3.934 4.091 -0.157 25380
2011 1 5 . 1 1 24 24 LEU C C 24 179.045 179.045 178.858 0.187 25380
2012 1 5 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.414 -0.866 25380
2013 1 5 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.605 -0.055 25380
2014 1 5 . 1 1 24 24 LEU H H 24 7.576 7.576 8.415 -0.839 25380
2015 1 5 . 1 1 25 25 TYR N N 25 118.100 118.100 119.353 -1.253 25380
2016 1 5 . 1 1 25 25 TYR HA H 25 4.367 4.367 2.715 1.652 25380
2017 1 5 . 1 1 25 25 TYR C C 25 177.945 177.945 177.536 0.409 25380
2018 1 5 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.965 0.641 25380
2019 1 5 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.260 -0.312 25380
2020 1 5 . 1 1 25 25 TYR H H 25 8.320 8.320 7.597 0.723 25380
2021 1 5 . 1 1 26 26 HIS N N 26 119.440 119.440 117.832 1.608 25380
2022 1 5 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.520 -0.149 25380
2023 1 5 . 1 1 26 26 HIS C C 26 176.559 176.559 178.129 -1.570 25380
2024 1 5 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.616 -0.097 25380
2025 1 5 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.058 -1.930 25380
2026 1 5 . 1 1 26 26 HIS H H 26 8.383 8.383 8.864 -0.481 25380
2027 1 5 . 1 1 27 27 GLU N N 27 119.915 119.915 121.593 -1.678 25380
2028 1 5 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.056 0.202 25380
2029 1 5 . 1 1 27 27 GLU C C 27 179.163 179.163 178.548 0.615 25380
2030 1 5 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.333 0.742 25380
2031 1 5 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.627 -0.092 25380
2032 1 5 . 1 1 27 27 GLU H H 27 8.288 8.288 9.039 -0.751 25380
2033 1 5 . 1 1 28 28 PHE N N 28 120.500 120.500 120.957 -0.457 25380
2034 1 5 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.373 0.599 25380
2035 1 5 . 1 1 28 28 PHE C C 28 177.386 177.386 177.221 0.165 25380
2036 1 5 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.682 -0.281 25380
2037 1 5 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.192 0.376 25380
2038 1 5 . 1 1 28 28 PHE H H 28 8.568 8.568 8.009 0.559 25380
2039 1 5 . 1 1 29 29 SER N N 29 114.306 114.306 114.435 -0.129 25380
2040 1 5 . 1 1 29 29 SER HA H 29 4.288 4.288 4.249 0.039 25380
2041 1 5 . 1 1 29 29 SER C C 29 175.656 175.656 176.469 -0.813 25380
2042 1 5 . 1 1 29 29 SER CA C 29 61.058 61.058 60.507 0.551 25380
2043 1 5 . 1 1 29 29 SER CB C 29 63.555 63.555 63.393 0.162 25380
2044 1 5 . 1 1 29 29 SER H H 29 8.479 8.479 7.898 0.581 25380
2045 1 5 . 1 1 30 30 GLU N N 30 118.322 118.322 120.439 -2.117 25380
2046 1 5 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.226 -0.134 25380
2047 1 5 . 1 1 30 30 GLU C C 30 177.312 177.312 176.655 0.657 25380
2048 1 5 . 1 1 30 30 GLU CA C 30 57.580 57.580 58.024 -0.444 25380
2049 1 5 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.622 -1.045 25380
2050 1 5 . 1 1 30 30 GLU H H 30 8.428 8.428 7.978 0.450 25380
2051 1 5 . 1 1 31 31 ASP N N 31 115.630 115.630 116.955 -1.325 25380
2052 1 5 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.872 -0.062 25380
2053 1 5 . 1 1 31 31 ASP C C 31 175.723 175.723 173.708 2.015 25380
2054 1 5 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.845 1.129 25380
2055 1 5 . 1 1 31 31 ASP CB C 31 40.818 40.818 44.004 -3.186 25380
2056 1 5 . 1 1 31 31 ASP H H 31 7.303 7.303 7.985 -0.682 25380
2057 1 5 . 1 1 32 32 LYS N N 32 114.357 114.357 120.159 -5.802 25380
2058 1 5 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.487 -0.660 25380
2059 1 5 . 1 1 32 32 LYS C C 32 175.716 175.716 175.741 -0.025 25380
2060 1 5 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.379 0.783 25380
2061 1 5 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.631 -5.250 25380
2062 1 5 . 1 1 32 32 LYS H H 32 7.148 7.148 8.270 -1.122 25380
2063 1 5 . 1 1 33 33 ARG N N 33 120.929 120.929 123.820 -2.891 25380
2064 1 5 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.620 -0.419 25380
2065 1 5 . 1 1 33 33 ARG C C 33 173.982 173.982 173.594 0.388 25380
2066 1 5 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.120 1.074 25380
2067 1 5 . 1 1 33 33 ARG CB C 33 30.642 30.642 32.686 -2.044 25380
2068 1 5 . 1 1 33 33 ARG H H 33 7.388 7.388 8.754 -1.366 25380
2069 1 5 . 1 1 34 34 SER N N 34 115.867 115.867 114.795 1.072 25380
2070 1 5 . 1 1 34 34 SER HA H 34 5.355 5.355 4.949 0.406 25380
2071 1 5 . 1 1 34 34 SER C C 34 172.754 172.754 172.798 -0.044 25380
2072 1 5 . 1 1 34 34 SER CA C 34 58.236 58.236 56.411 1.825 25380
2073 1 5 . 1 1 34 34 SER CB C 34 65.212 65.212 66.414 -1.202 25380
2074 1 5 . 1 1 34 34 SER H H 34 8.173 8.173 8.027 0.146 25380
2075 1 5 . 1 1 35 35 ILE N N 35 119.621 119.621 113.187 6.434 25380
2076 1 5 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.986 -0.123 25380
2077 1 5 . 1 1 35 35 ILE C C 35 174.069 174.069 173.539 0.530 25380
2078 1 5 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.592 0.364 25380
2079 1 5 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.604 -0.949 25380
2080 1 5 . 1 1 35 35 ILE H H 35 6.779 6.779 8.559 -1.780 25380
2081 1 5 . 1 1 36 36 PHE N N 36 124.305 124.305 118.848 5.457 25380
2082 1 5 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.800 -1.347 25380
2083 1 5 . 1 1 36 36 PHE C C 36 173.204 173.204 174.873 -1.669 25380
2084 1 5 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.150 0.266 25380
2085 1 5 . 1 1 36 36 PHE CB C 36 44.817 44.817 43.193 1.624 25380
2086 1 5 . 1 1 36 36 PHE H H 36 8.411 8.411 9.092 -0.681 25380
2087 1 5 . 1 1 37 37 TYR N N 37 118.743 118.743 122.471 -3.728 25380
2088 1 5 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.483 0.087 25380
2089 1 5 . 1 1 37 37 TYR C C 37 175.455 175.455 173.880 1.575 25380
2090 1 5 . 1 1 37 37 TYR CA C 37 56.518 56.518 54.732 1.786 25380
2091 1 5 . 1 1 37 37 TYR CB C 37 40.991 40.991 41.523 -0.532 25380
2092 1 5 . 1 1 37 37 TYR H H 37 8.353 8.353 9.276 -0.923 25380
2093 1 5 . 1 1 38 38 PHE N N 38 119.236 119.236 127.871 -8.635 25380
2094 1 5 . 1 1 38 38 PHE HA H 38 5.160 5.160 5.204 -0.044 25380
2095 1 5 . 1 1 38 38 PHE C C 38 174.650 174.650 173.968 0.682 25380
2096 1 5 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.638 1.204 25380
2097 1 5 . 1 1 38 38 PHE CB C 38 42.619 42.619 38.275 4.344 25380
2098 1 5 . 1 1 38 38 PHE H H 38 9.756 9.756 10.028 -0.272 25380
2099 1 5 . 1 1 39 39 ALA N N 39 122.516 122.516 125.285 -2.769 25380
2100 1 5 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.837 -0.297 25380
2101 1 5 . 1 1 39 39 ALA C C 39 177.042 177.042 174.137 2.905 25380
2102 1 5 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.236 1.607 25380
2103 1 5 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.153 -2.575 25380
2104 1 5 . 1 1 39 39 ALA H H 39 7.738 7.738 8.768 -1.030 25380
2105 1 5 . 1 1 40 40 PRO C C 40 175.411 175.411 176.618 -1.207 25380
2106 1 5 . 1 1 40 40 PRO CA C 40 64.288 64.288 63.296 0.992 25380
2107 1 5 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.235 -1.131 25380
2108 1 5 . 1 1 41 41 THR N N 41 105.878 105.878 118.710 -12.832 25380
2109 1 5 . 1 1 41 41 THR HA H 41 4.190 4.190 3.919 0.271 25380
2110 1 5 . 1 1 41 41 THR C C 41 176.400 176.400 175.535 0.865 25380
2111 1 5 . 1 1 41 41 THR CA C 41 61.937 61.937 65.223 -3.286 25380
2112 1 5 . 1 1 41 41 THR CB C 41 68.331 68.331 68.698 -0.367 25380
2113 1 5 . 1 1 41 41 THR H H 41 6.715 6.715 8.617 -1.902 25380
2114 1 5 . 1 1 42 42 ASN N N 42 118.863 118.863 118.160 0.703 25380
2115 1 5 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.330 0.205 25380
2116 1 5 . 1 1 42 42 ASN C C 42 173.764 173.764 176.096 -2.332 25380
2117 1 5 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.807 -1.631 25380
2118 1 5 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.348 4.367 25380
2119 1 5 . 1 1 42 42 ASN H H 42 7.153 7.153 8.461 -1.308 25380
2120 1 5 . 1 1 43 43 ALA N N 43 126.174 126.174 119.942 6.232 25380
2121 1 5 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.278 0.147 25380
2122 1 5 . 1 1 43 43 ALA C C 43 179.308 179.308 176.942 2.366 25380
2123 1 5 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.201 -0.219 25380
2124 1 5 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.291 -0.997 25380
2125 1 5 . 1 1 43 43 ALA H H 43 9.465 9.465 7.771 1.694 25380
2126 1 5 . 1 1 44 44 HIS N N 44 126.251 126.251 116.109 10.142 25380
2127 1 5 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.256 -0.429 25380
2128 1 5 . 1 1 44 44 HIS C C 44 177.407 177.407 174.804 2.603 25380
2129 1 5 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.824 4.201 25380
2130 1 5 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.213 1.417 25380
2131 1 5 . 1 1 44 44 HIS H H 44 9.407 9.407 7.964 1.443 25380
2132 1 5 . 1 1 45 45 LYS N N 45 114.990 114.990 119.197 -4.207 25380
2133 1 5 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.382 -0.499 25380
2134 1 5 . 1 1 45 45 LYS C C 45 178.284 178.284 177.175 1.109 25380
2135 1 5 . 1 1 45 45 LYS CA C 45 59.249 59.249 57.972 1.277 25380
2136 1 5 . 1 1 45 45 LYS CB C 45 31.834 31.834 33.597 -1.763 25380
2137 1 5 . 1 1 45 45 LYS H H 45 8.960 8.960 7.986 0.974 25380
2138 1 5 . 1 1 46 46 ASP N N 46 120.411 120.411 119.371 1.040 25380
2139 1 5 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.412 0.014 25380
2140 1 5 . 1 1 46 46 ASP C C 46 177.773 177.773 177.937 -0.164 25380
2141 1 5 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.318 -0.302 25380
2142 1 5 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.212 -0.315 25380
2143 1 5 . 1 1 46 46 ASP H H 46 6.777 6.777 8.598 -1.821 25380
2144 1 5 . 1 1 47 47 MET N N 47 118.178 118.178 119.443 -1.265 25380
2145 1 5 . 1 1 47 47 MET HA H 47 3.879 3.879 3.865 0.014 25380
2146 1 5 . 1 1 47 47 MET C C 47 179.499 179.499 177.385 2.114 25380
2147 1 5 . 1 1 47 47 MET CA C 47 56.052 56.052 59.109 -3.058 25380
2148 1 5 . 1 1 47 47 MET CB C 47 29.601 29.601 32.333 -2.732 25380
2149 1 5 . 1 1 47 47 MET H H 47 7.367 7.367 8.008 -0.641 25380
2150 1 5 . 1 1 48 48 LEU N N 48 117.665 117.665 118.763 -1.098 25380
2151 1 5 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.928 -0.081 25380
2152 1 5 . 1 1 48 48 LEU C C 48 179.843 179.843 178.276 1.567 25380
2153 1 5 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.110 -0.530 25380
2154 1 5 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.358 -0.405 25380
2155 1 5 . 1 1 48 48 LEU H H 48 7.672 7.672 7.944 -0.273 25380
2156 1 5 . 1 1 49 49 LYS N N 49 119.326 119.326 118.094 1.232 25380
2157 1 5 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.584 0.543 25380
2158 1 5 . 1 1 49 49 LYS C C 49 179.684 179.684 178.520 1.164 25380
2159 1 5 . 1 1 49 49 LYS CA C 49 58.799 58.799 57.955 0.844 25380
2160 1 5 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.471 -0.018 25380
2161 1 5 . 1 1 49 49 LYS H H 49 7.420 7.420 7.710 -0.290 25380
2162 1 5 . 1 1 50 50 ALA N N 50 122.022 122.022 122.957 -0.935 25380
2163 1 5 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.843 0.200 25380
2164 1 5 . 1 1 50 50 ALA C C 50 178.818 178.818 178.983 -0.165 25380
2165 1 5 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.622 0.547 25380
2166 1 5 . 1 1 50 50 ALA CB C 50 17.300 17.300 18.125 -0.825 25380
2167 1 5 . 1 1 50 50 ALA H H 50 7.551 7.551 8.171 -0.620 25380
2168 1 5 . 1 1 51 51 VAL N N 51 118.165 118.165 117.997 0.168 25380
2169 1 5 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.458 -0.016 25380
2170 1 5 . 1 1 51 51 VAL C C 51 178.646 178.646 178.024 0.622 25380
2171 1 5 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.297 0.909 25380
2172 1 5 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.734 0.719 25380
2173 1 5 . 1 1 51 51 VAL H H 51 7.226 7.226 7.507 -0.281 25380
2174 1 5 . 1 1 52 52 ASP N N 52 122.298 122.298 120.405 1.893 25380
2175 1 5 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.312 0.059 25380
2176 1 5 . 1 1 52 52 ASP C C 52 177.898 177.898 179.037 -1.139 25380
2177 1 5 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.109 0.462 25380
2178 1 5 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.108 0.278 25380
2179 1 5 . 1 1 52 52 ASP H H 52 8.232 8.232 7.300 0.932 25380
2180 1 5 . 1 1 53 53 PHE N N 53 121.541 121.541 119.681 1.860 25380
2181 1 5 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.294 0.027 25380
2182 1 5 . 1 1 53 53 PHE C C 53 177.224 177.224 178.162 -0.938 25380
2183 1 5 . 1 1 53 53 PHE CA C 53 61.080 61.080 59.118 1.962 25380
2184 1 5 . 1 1 53 53 PHE CB C 53 39.700 39.700 38.008 1.692 25380
2185 1 5 . 1 1 53 53 PHE H H 53 8.240 8.240 7.458 0.782 25380
2186 1 5 . 1 1 54 54 PHE N N 54 115.925 115.925 117.468 -1.543 25380
2187 1 5 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.283 -0.628 25380
2188 1 5 . 1 1 54 54 PHE C C 54 178.269 178.269 177.155 1.114 25380
2189 1 5 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.319 4.881 25380
2190 1 5 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.938 0.640 25380
2191 1 5 . 1 1 54 54 PHE H H 54 7.755 7.755 7.856 -0.101 25380
2192 1 5 . 1 1 55 55 LYS N N 55 120.251 120.251 117.650 2.601 25380
2193 1 5 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.082 0.344 25380
2194 1 5 . 1 1 55 55 LYS C C 55 181.484 181.484 178.534 2.950 25380
2195 1 5 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.752 0.877 25380
2196 1 5 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.450 -0.712 25380
2197 1 5 . 1 1 55 55 LYS H H 55 8.213 8.213 7.514 0.699 25380
2198 1 5 . 1 1 56 56 GLU N N 56 120.146 120.146 117.908 2.238 25380
2199 1 5 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.185 -0.192 25380
2200 1 5 . 1 1 56 56 GLU C C 56 178.085 178.085 177.489 0.596 25380
2201 1 5 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.554 0.234 25380
2202 1 5 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.332 -1.736 25380
2203 1 5 . 1 1 56 56 GLU H H 56 7.850 7.850 8.099 -0.249 25380
2204 1 5 . 1 1 57 57 LYS N N 57 115.940 115.940 119.081 -3.141 25380
2205 1 5 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.542 -0.439 25380
2206 1 5 . 1 1 57 57 LYS C C 57 176.225 176.225 176.888 -0.663 25380
2207 1 5 . 1 1 57 57 LYS CA C 57 54.572 54.572 54.998 -0.426 25380
2208 1 5 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.855 -1.819 25380
2209 1 5 . 1 1 57 57 LYS H H 57 7.019 7.019 8.075 -1.056 25380
2210 1 5 . 1 1 58 58 GLY N N 58 106.593 106.593 112.109 -5.516 25380
2211 1 5 . 1 1 58 58 GLY C C 58 174.350 174.350 174.911 -0.561 25380
2212 1 5 . 1 1 58 58 GLY CA C 58 45.500 45.500 46.113 -0.613 25380
2213 1 5 . 1 1 58 58 GLY H H 58 7.883 7.883 8.630 -0.747 25380
2214 1 5 . 1 1 59 59 HIS N N 59 117.962 117.962 116.982 0.980 25380
2215 1 5 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.398 0.469 25380
2216 1 5 . 1 1 59 59 HIS C C 59 173.271 173.271 175.915 -2.644 25380
2217 1 5 . 1 1 59 59 HIS CA C 59 54.778 54.778 57.070 -2.292 25380
2218 1 5 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.847 1.838 25380
2219 1 5 . 1 1 59 59 HIS H H 59 8.218 8.218 7.849 0.369 25380
2220 1 5 . 1 1 60 60 THR N N 60 119.624 119.624 112.016 7.608 25380
2221 1 5 . 1 1 60 60 THR HA H 60 4.430 4.430 3.830 0.600 25380
2222 1 5 . 1 1 60 60 THR C C 60 171.430 171.430 174.108 -2.678 25380
2223 1 5 . 1 1 60 60 THR CA C 60 63.480 63.480 62.402 1.078 25380
2224 1 5 . 1 1 60 60 THR CB C 60 69.761 69.761 69.502 0.259 25380
2225 1 5 . 1 1 60 60 THR H H 60 8.780 8.780 7.668 1.112 25380
2226 1 5 . 1 1 61 61 ALA N N 61 126.706 126.706 128.947 -2.241 25380
2227 1 5 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.282 0.964 25380
2228 1 5 . 1 1 61 61 ALA C C 61 174.753 174.753 176.967 -2.214 25380
2229 1 5 . 1 1 61 61 ALA CA C 61 49.772 49.772 53.864 -4.091 25380
2230 1 5 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.196 2.693 25380
2231 1 5 . 1 1 61 61 ALA H H 61 7.795 7.795 8.732 -0.937 25380
2232 1 5 . 1 1 62 62 TYR N N 62 117.859 117.859 115.359 2.500 25380
2233 1 5 . 1 1 62 62 TYR C C 62 173.431 173.431 173.216 0.215 25380
2234 1 5 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.492 -0.846 25380
2235 1 5 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.232 -1.683 25380
2236 1 5 . 1 1 62 62 TYR H H 62 8.711 8.711 7.813 0.898 25380
2237 1 5 . 1 1 63 63 LEU N N 63 125.044 125.044 119.507 5.537 25380
2238 1 5 . 1 1 63 63 LEU HA H 63 5.411 5.411 5.178 0.233 25380
2239 1 5 . 1 1 63 63 LEU C C 63 175.319 175.319 174.588 0.731 25380
2240 1 5 . 1 1 63 63 LEU CA C 63 53.230 53.230 52.972 0.258 25380
2241 1 5 . 1 1 63 63 LEU CB C 63 45.701 45.701 46.347 -0.646 25380
2242 1 5 . 1 1 63 63 LEU H H 63 8.746 8.746 7.579 1.167 25380
2243 1 5 . 1 1 64 64 ASP N N 64 125.463 125.463 120.333 5.130 25380
2244 1 5 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.918 0.281 25380
2245 1 5 . 1 1 64 64 ASP C C 64 174.512 174.512 174.379 0.133 25380
2246 1 5 . 1 1 64 64 ASP CA C 64 52.700 52.700 53.073 -0.373 25380
2247 1 5 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.797 -0.843 25380
2248 1 5 . 1 1 64 64 ASP H H 64 9.293 9.293 8.932 0.361 25380
2249 1 5 . 1 1 65 65 GLU N N 65 120.711 120.711 119.636 1.075 25380
2250 1 5 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.291 0.776 25380
2251 1 5 . 1 1 65 65 GLU C C 65 175.652 175.652 176.206 -0.554 25380
2252 1 5 . 1 1 65 65 GLU CA C 65 55.643 55.643 56.877 -1.234 25380
2253 1 5 . 1 1 65 65 GLU CB C 65 30.455 30.455 30.286 0.169 25380
2254 1 5 . 1 1 65 65 GLU H H 65 8.715 8.715 8.529 0.186 25380
2255 1 5 . 1 1 66 66 VAL N N 66 122.936 122.936 121.598 1.338 25380
2256 1 5 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.124 0.306 25380
2257 1 5 . 1 1 66 66 VAL C C 66 175.065 175.065 175.893 -0.828 25380
2258 1 5 . 1 1 66 66 VAL CA C 66 60.991 60.991 62.721 -1.730 25380
2259 1 5 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.914 1.366 25380
2260 1 5 . 1 1 66 66 VAL H H 66 9.156 9.156 8.456 0.700 25380
2261 1 5 . 1 1 67 67 ARG N N 67 126.104 126.104 128.282 -2.178 25380
2262 1 5 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.395 0.146 25380
2263 1 5 . 1 1 67 67 ARG C C 67 176.708 176.708 175.827 0.881 25380
2264 1 5 . 1 1 67 67 ARG CA C 67 56.080 56.080 56.578 -0.498 25380
2265 1 5 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.549 1.359 25380
2266 1 5 . 1 1 67 67 ARG H H 67 8.734 8.734 8.805 -0.071 25380
2267 1 5 . 1 1 68 68 VAL N N 68 120.707 120.707 117.142 3.565 25380
2268 1 5 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.516 -0.364 25380
2269 1 5 . 1 1 68 68 VAL C C 68 175.931 175.931 176.291 -0.360 25380
2270 1 5 . 1 1 68 68 VAL CA C 68 62.776 62.776 61.112 1.664 25380
2271 1 5 . 1 1 68 68 VAL CB C 68 32.489 32.489 30.987 1.502 25380
2272 1 5 . 1 1 68 68 VAL H H 68 8.384 8.384 7.938 0.446 25380
2273 1 5 . 1 1 69 69 SER N N 69 116.156 116.156 117.974 -1.818 25380
2274 1 5 . 1 1 69 69 SER HA H 69 4.693 4.693 4.171 0.522 25380
2275 1 5 . 1 1 69 69 SER C C 69 174.544 174.544 176.456 -1.912 25380
2276 1 5 . 1 1 69 69 SER CA C 69 57.754 57.754 62.222 -4.468 25380
2277 1 5 . 1 1 69 69 SER CB C 69 64.831 64.831 62.818 2.013 25380
2278 1 5 . 1 1 69 69 SER H H 69 8.067 8.067 8.105 -0.038 25380
2279 1 5 . 1 1 70 70 THR N N 70 110.753 110.753 112.373 -1.620 25380
2280 1 5 . 1 1 70 70 THR HA H 70 4.152 4.152 4.061 0.091 25380
2281 1 5 . 1 1 70 70 THR C C 70 174.865 174.865 175.511 -0.646 25380
2282 1 5 . 1 1 70 70 THR CA C 70 63.831 63.831 64.522 -0.691 25380
2283 1 5 . 1 1 70 70 THR CB C 70 68.956 68.956 68.464 0.492 25380
2284 1 5 . 1 1 70 70 THR H H 70 8.095 8.095 8.255 -0.160 25380
2285 1 5 . 1 1 71 71 ASP N N 71 121.817 121.817 121.136 0.681 25380
2286 1 5 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.591 -0.001 25380
2287 1 5 . 1 1 71 71 ASP C C 71 176.746 176.746 177.059 -0.313 25380
2288 1 5 . 1 1 71 71 ASP CA C 71 54.264 54.264 55.848 -1.584 25380
2289 1 5 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.934 0.491 25380
2290 1 5 . 1 1 71 71 ASP H H 71 8.076 8.076 8.446 -0.370 25380
2291 1 5 . 1 1 72 72 GLU N N 72 123.635 123.635 116.455 7.180 25380
2292 1 5 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.508 -0.515 25380
2293 1 5 . 1 1 72 72 GLU C C 72 176.971 176.971 175.466 1.505 25380
2294 1 5 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.224 1.994 25380
2295 1 5 . 1 1 72 72 GLU CB C 72 29.702 29.702 31.578 -1.876 25380
2296 1 5 . 1 1 72 72 GLU H H 72 8.514 8.514 7.973 0.541 25380
2297 1 5 . 1 1 73 73 LYS N N 73 117.857 117.857 118.316 -0.459 25380
2298 1 5 . 1 1 73 73 LYS HA H 73 4.643 4.643 3.909 0.734 25380
2299 1 5 . 1 1 73 73 LYS C C 73 176.508 176.508 175.520 0.988 25380
2300 1 5 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.343 -0.263 25380
2301 1 5 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.109 1.094 25380
2302 1 5 . 1 1 73 73 LYS H H 73 8.423 8.423 8.224 0.199 25380
2303 1 5 . 1 1 74 74 ASP N N 74 120.580 120.580 115.792 4.788 25380
2304 1 5 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.611 0.147 25380
2305 1 5 . 1 1 74 74 ASP C C 74 174.059 174.059 175.125 -1.066 25380
2306 1 5 . 1 1 74 74 ASP CA C 74 53.279 53.279 55.499 -2.220 25380
2307 1 5 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.792 -1.214 25380
2308 1 5 . 1 1 74 74 ASP H H 74 7.918 7.918 8.183 -0.265 25380
2309 1 5 . 1 1 75 75 PHE N N 75 118.513 118.513 117.467 1.046 25380
2310 1 5 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.708 -0.345 25380
2311 1 5 . 1 1 75 75 PHE C C 75 173.038 173.038 175.042 -2.004 25380
2312 1 5 . 1 1 75 75 PHE CA C 75 55.522 55.522 55.589 -0.067 25380
2313 1 5 . 1 1 75 75 PHE CB C 75 41.714 41.714 41.144 0.570 25380
2314 1 5 . 1 1 75 75 PHE H H 75 7.397 7.397 7.656 -0.259 25380
2315 1 5 . 1 1 76 76 LEU N N 76 116.773 116.773 122.854 -6.081 25380
2316 1 5 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.700 -0.057 25380
2317 1 5 . 1 1 76 76 LEU C C 76 177.553 177.553 175.214 2.339 25380
2318 1 5 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.108 -0.488 25380
2319 1 5 . 1 1 76 76 LEU CB C 76 45.701 45.701 44.485 1.216 25380
2320 1 5 . 1 1 76 76 LEU H H 76 8.774 8.774 9.096 -0.322 25380
2321 1 5 . 1 1 77 77 TYR N N 77 118.377 118.377 124.081 -5.704 25380
2322 1 5 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.704 0.711 25380
2323 1 5 . 1 1 77 77 TYR C C 77 175.479 175.479 173.383 2.096 25380
2324 1 5 . 1 1 77 77 TYR CA C 77 58.391 58.391 55.399 2.992 25380
2325 1 5 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.214 0.886 25380
2326 1 5 . 1 1 77 77 TYR H H 77 8.589 8.589 9.301 -0.712 25380
2327 1 5 . 1 1 78 78 GLU N N 78 123.875 123.875 129.038 -5.163 25380
2328 1 5 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.770 0.203 25380
2329 1 5 . 1 1 78 78 GLU C C 78 174.120 174.120 174.127 -0.007 25380
2330 1 5 . 1 1 78 78 GLU CA C 78 54.378 54.378 54.119 0.259 25380
2331 1 5 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.120 -0.480 25380
2332 1 5 . 1 1 78 78 GLU H H 78 9.576 9.576 8.807 0.769 25380
2333 1 5 . 1 1 79 79 LEU N N 79 128.661 128.661 126.495 2.166 25380
2334 1 5 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.449 0.840 25380
2335 1 5 . 1 1 79 79 LEU C C 79 174.219 174.219 175.488 -1.269 25380
2336 1 5 . 1 1 79 79 LEU CA C 79 53.149 53.149 54.028 -0.879 25380
2337 1 5 . 1 1 79 79 LEU CB C 79 46.630 46.630 43.681 2.949 25380
2338 1 5 . 1 1 79 79 LEU H H 79 9.139 9.139 8.756 0.383 25380
2339 1 5 . 1 1 80 80 HIS N N 80 124.886 124.886 122.291 2.595 25380
2340 1 5 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.924 0.506 25380
2341 1 5 . 1 1 80 80 HIS C C 80 173.346 173.346 175.650 -2.304 25380
2342 1 5 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.093 -0.944 25380
2343 1 5 . 1 1 80 80 HIS CB C 80 30.768 30.768 31.745 -0.978 25380
2344 1 5 . 1 1 80 80 HIS H H 80 8.897 8.897 9.035 -0.138 25380
2345 1 5 . 1 1 81 81 ILE N N 81 125.173 125.173 120.730 4.443 25380
2346 1 5 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.766 0.524 25380
2347 1 5 . 1 1 81 81 ILE C C 81 174.600 174.600 175.708 -1.108 25380
2348 1 5 . 1 1 81 81 ILE CA C 81 60.500 60.500 62.198 -1.698 25380
2349 1 5 . 1 1 81 81 ILE CB C 81 39.700 39.700 35.965 3.735 25380
2350 1 5 . 1 1 81 81 ILE H H 81 8.909 8.909 8.426 0.483 25380
2351 1 6 . 1 1 2 2 HIS N N 2 120.430 120.430 125.023 -4.593 25380
2352 1 6 . 1 1 2 2 HIS HA H 2 4.735 4.735 5.007 -0.272 25380
2353 1 6 . 1 1 2 2 HIS C C 2 173.884 173.884 174.695 -0.811 25380
2354 1 6 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.245 -1.193 25380
2355 1 6 . 1 1 2 2 HIS CB C 2 28.666 28.666 30.668 -2.002 25380
2356 1 6 . 1 1 2 2 HIS H H 2 8.678 8.678 8.836 -0.158 25380
2357 1 6 . 1 1 3 3 MET N N 3 122.377 122.377 122.860 -0.483 25380
2358 1 6 . 1 1 3 3 MET HA H 3 4.207 4.207 4.709 -0.502 25380
2359 1 6 . 1 1 3 3 MET C C 3 174.584 174.584 176.677 -2.093 25380
2360 1 6 . 1 1 3 3 MET CA C 3 56.550 56.550 55.704 0.846 25380
2361 1 6 . 1 1 3 3 MET CB C 3 33.426 33.426 33.786 -0.360 25380
2362 1 6 . 1 1 3 3 MET H H 3 8.240 8.240 8.791 -0.551 25380
2363 1 6 . 1 1 4 4 LYS N N 4 123.568 123.568 120.466 3.102 25380
2364 1 6 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.594 0.245 25380
2365 1 6 . 1 1 4 4 LYS C C 4 175.906 175.906 174.861 1.045 25380
2366 1 6 . 1 1 4 4 LYS CA C 4 54.800 54.800 56.148 -1.348 25380
2367 1 6 . 1 1 4 4 LYS CB C 4 34.900 34.900 33.015 1.885 25380
2368 1 6 . 1 1 4 4 LYS H H 4 8.351 8.351 8.470 -0.119 25380
2369 1 6 . 1 1 5 5 LEU N N 5 123.568 123.568 118.940 4.628 25380
2370 1 6 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.647 -0.808 25380
2371 1 6 . 1 1 5 5 LEU C C 5 175.900 175.900 176.495 -0.595 25380
2372 1 6 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.614 -0.264 25380
2373 1 6 . 1 1 5 5 LEU CB C 5 45.900 45.900 46.090 -0.190 25380
2374 1 6 . 1 1 5 5 LEU H H 5 8.281 8.281 7.635 0.646 25380
2375 1 6 . 1 1 6 6 VAL N N 6 121.564 121.564 121.831 -0.267 25380
2376 1 6 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.470 -0.044 25380
2377 1 6 . 1 1 6 6 VAL C C 6 178.200 178.200 174.781 3.419 25380
2378 1 6 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.738 2.462 25380
2379 1 6 . 1 1 6 6 VAL CB C 6 33.200 33.200 34.300 -1.101 25380
2380 1 6 . 1 1 6 6 VAL H H 6 9.276 9.276 9.399 -0.123 25380
2381 1 6 . 1 1 7 7 LEU N N 7 121.564 121.564 127.938 -6.374 25380
2382 1 6 . 1 1 7 7 LEU HA H 7 4.426 4.426 4.932 -0.506 25380
2383 1 6 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.781 9.419 25380
2384 1 6 . 1 1 7 7 LEU CB C 7 33.200 33.200 43.226 -10.026 25380
2385 1 6 . 1 1 7 7 LEU H H 7 9.276 9.276 8.606 0.670 25380
2386 1 6 . 1 1 8 8 ALA C C 8 177.040 177.040 178.433 -1.393 25380
2387 1 6 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.361 -0.660 25380
2388 1 6 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.712 1.152 25380
2389 1 6 . 1 1 9 9 LYS N N 9 119.845 119.845 123.796 -3.951 25380
2390 1 6 . 1 1 9 9 LYS HA H 9 4.128 4.128 3.946 0.182 25380
2391 1 6 . 1 1 9 9 LYS C C 9 176.075 176.075 179.074 -2.999 25380
2392 1 6 . 1 1 9 9 LYS CA C 9 56.761 56.761 60.054 -3.293 25380
2393 1 6 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.386 0.533 25380
2394 1 6 . 1 1 9 9 LYS H H 9 8.545 8.545 9.042 -0.497 25380
2395 1 6 . 1 1 10 10 ASN N N 10 119.279 119.279 117.952 1.327 25380
2396 1 6 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.522 0.123 25380
2397 1 6 . 1 1 10 10 ASN C C 10 175.443 175.443 177.817 -2.374 25380
2398 1 6 . 1 1 10 10 ASN CA C 10 53.657 53.657 56.048 -2.391 25380
2399 1 6 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.986 0.791 25380
2400 1 6 . 1 1 10 10 ASN H H 10 8.592 8.592 9.145 -0.553 25380
2401 1 6 . 1 1 11 11 THR N N 11 111.876 111.876 113.387 -1.511 25380
2402 1 6 . 1 1 11 11 THR HA H 11 4.311 4.311 4.171 0.140 25380
2403 1 6 . 1 1 11 11 THR C C 11 174.666 174.666 176.398 -1.732 25380
2404 1 6 . 1 1 11 11 THR CA C 11 62.044 62.044 64.693 -2.649 25380
2405 1 6 . 1 1 11 11 THR CB C 11 69.895 69.895 68.939 0.956 25380
2406 1 6 . 1 1 11 11 THR H H 11 8.058 8.058 8.263 -0.205 25380
2407 1 6 . 1 1 12 12 ARG N N 12 121.152 121.152 119.142 2.010 25380
2408 1 6 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.423 -0.161 25380
2409 1 6 . 1 1 12 12 ARG C C 12 176.714 176.714 177.736 -1.022 25380
2410 1 6 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.445 0.377 25380
2411 1 6 . 1 1 12 12 ARG CB C 12 30.702 30.702 30.669 0.033 25380
2412 1 6 . 1 1 12 12 ARG H H 12 8.291 8.291 7.674 0.617 25380
2413 1 6 . 1 1 13 13 LYS N N 13 120.459 120.459 115.694 4.765 25380
2414 1 6 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.016 -0.120 25380
2415 1 6 . 1 1 13 13 LYS C C 13 176.682 176.682 176.781 -0.099 25380
2416 1 6 . 1 1 13 13 LYS CA C 13 56.978 56.978 58.979 -2.001 25380
2417 1 6 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.624 1.874 25380
2418 1 6 . 1 1 13 13 LYS H H 13 8.286 8.286 8.867 -0.581 25380
2419 1 6 . 1 1 14 14 SER N N 14 114.568 114.568 113.346 1.222 25380
2420 1 6 . 1 1 14 14 SER HA H 14 4.371 4.371 4.469 -0.098 25380
2421 1 6 . 1 1 14 14 SER C C 14 173.990 173.990 175.082 -1.092 25380
2422 1 6 . 1 1 14 14 SER CA C 14 58.617 58.617 59.425 -0.808 25380
2423 1 6 . 1 1 14 14 SER CB C 14 63.933 63.933 63.871 0.062 25380
2424 1 6 . 1 1 14 14 SER H H 14 7.957 7.957 8.202 -0.245 25380
2425 1 6 . 1 1 15 15 ASP N N 15 121.565 121.565 118.221 3.344 25380
2426 1 6 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.736 -0.135 25380
2427 1 6 . 1 1 15 15 ASP C C 15 175.684 175.684 175.918 -0.234 25380
2428 1 6 . 1 1 15 15 ASP CA C 15 54.149 54.149 54.153 -0.004 25380
2429 1 6 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.563 0.666 25380
2430 1 6 . 1 1 15 15 ASP H H 15 8.166 8.166 8.562 -0.396 25380
2431 1 6 . 1 1 16 16 ALA N N 16 124.173 124.173 121.770 2.403 25380
2432 1 6 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.449 -0.078 25380
2433 1 6 . 1 1 16 16 ALA C C 16 177.184 177.184 178.799 -1.615 25380
2434 1 6 . 1 1 16 16 ALA CA C 16 52.337 52.337 52.757 -0.420 25380
2435 1 6 . 1 1 16 16 ALA CB C 16 19.359 19.359 18.944 0.415 25380
2436 1 6 . 1 1 16 16 ALA H H 16 8.163 8.163 8.231 -0.068 25380
2437 1 6 . 1 1 17 17 LYS N N 17 121.152 121.152 118.807 2.345 25380
2438 1 6 . 1 1 17 17 LYS HA H 17 4.426 4.426 3.993 0.433 25380
2439 1 6 . 1 1 17 17 LYS C C 17 175.488 175.488 176.365 -0.877 25380
2440 1 6 . 1 1 17 17 LYS CA C 17 56.205 56.205 59.052 -2.847 25380
2441 1 6 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.694 1.602 25380
2442 1 6 . 1 1 17 17 LYS H H 17 8.363 8.363 8.558 -0.195 25380
2443 1 6 . 1 1 18 18 SER N N 18 116.448 116.448 109.154 7.294 25380
2444 1 6 . 1 1 18 18 SER HA H 18 5.355 5.355 4.666 0.689 25380
2445 1 6 . 1 1 18 18 SER C C 18 173.887 173.887 175.032 -1.145 25380
2446 1 6 . 1 1 18 18 SER CA C 18 57.248 57.248 56.953 0.295 25380
2447 1 6 . 1 1 18 18 SER CB C 18 64.962 64.962 63.705 1.257 25380
2448 1 6 . 1 1 18 18 SER H H 18 8.206 8.206 7.778 0.428 25380
2449 1 6 . 1 1 19 19 VAL N N 19 117.867 117.867 123.396 -5.529 25380
2450 1 6 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.775 -0.155 25380
2451 1 6 . 1 1 19 19 VAL C C 19 174.169 174.169 177.261 -3.092 25380
2452 1 6 . 1 1 19 19 VAL CA C 19 59.546 59.546 65.976 -6.430 25380
2453 1 6 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.499 4.403 25380
2454 1 6 . 1 1 19 19 VAL H H 19 9.086 9.086 7.350 1.736 25380
2455 1 6 . 1 1 20 20 GLU N N 20 120.843 120.843 120.100 0.743 25380
2456 1 6 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.149 0.719 25380
2457 1 6 . 1 1 20 20 GLU C C 20 178.747 178.747 178.879 -0.132 25380
2458 1 6 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.525 -4.973 25380
2459 1 6 . 1 1 20 20 GLU CB C 20 31.099 31.099 28.907 2.192 25380
2460 1 6 . 1 1 20 20 GLU H H 20 8.841 8.841 8.724 0.117 25380
2461 1 6 . 1 1 21 21 LEU N N 21 122.653 122.653 119.396 3.257 25380
2462 1 6 . 1 1 21 21 LEU HA H 21 3.443 3.443 3.995 -0.552 25380
2463 1 6 . 1 1 21 21 LEU C C 21 178.799 178.799 179.333 -0.534 25380
2464 1 6 . 1 1 21 21 LEU CA C 21 58.707 58.707 58.018 0.689 25380
2465 1 6 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.642 -3.071 25380
2466 1 6 . 1 1 21 21 LEU H H 21 8.744 8.744 7.632 1.112 25380
2467 1 6 . 1 1 22 22 GLU N N 22 115.392 115.392 118.746 -3.354 25380
2468 1 6 . 1 1 22 22 GLU HA H 22 3.989 3.989 3.740 0.249 25380
2469 1 6 . 1 1 22 22 GLU C C 22 179.328 179.328 178.593 0.735 25380
2470 1 6 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.465 0.615 25380
2471 1 6 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.349 -0.514 25380
2472 1 6 . 1 1 22 22 GLU H H 22 8.744 8.744 7.575 1.169 25380
2473 1 6 . 1 1 23 23 ASP N N 23 118.597 118.597 120.802 -2.205 25380
2474 1 6 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.509 0.102 25380
2475 1 6 . 1 1 23 23 ASP C C 23 179.139 179.139 178.594 0.545 25380
2476 1 6 . 1 1 23 23 ASP CA C 23 57.519 57.519 56.696 0.823 25380
2477 1 6 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.811 -0.369 25380
2478 1 6 . 1 1 23 23 ASP H H 23 7.098 7.098 8.447 -1.349 25380
2479 1 6 . 1 1 24 24 LEU N N 24 119.869 119.869 120.354 -0.485 25380
2480 1 6 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.692 0.242 25380
2481 1 6 . 1 1 24 24 LEU C C 24 179.045 179.045 178.950 0.095 25380
2482 1 6 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.443 -0.894 25380
2483 1 6 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.957 -0.407 25380
2484 1 6 . 1 1 24 24 LEU H H 24 7.576 7.576 8.359 -0.783 25380
2485 1 6 . 1 1 25 25 TYR N N 25 118.100 118.100 118.356 -0.256 25380
2486 1 6 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.817 0.550 25380
2487 1 6 . 1 1 25 25 TYR C C 25 177.945 177.945 177.687 0.258 25380
2488 1 6 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.134 1.472 25380
2489 1 6 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.435 -0.487 25380
2490 1 6 . 1 1 25 25 TYR H H 25 8.320 8.320 7.450 0.870 25380
2491 1 6 . 1 1 26 26 HIS N N 26 119.440 119.440 118.746 0.694 25380
2492 1 6 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.207 0.164 25380
2493 1 6 . 1 1 26 26 HIS C C 26 176.559 176.559 177.788 -1.229 25380
2494 1 6 . 1 1 26 26 HIS CA C 26 59.519 59.519 58.259 1.260 25380
2495 1 6 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.202 -2.074 25380
2496 1 6 . 1 1 26 26 HIS H H 26 8.383 8.383 8.355 0.028 25380
2497 1 6 . 1 1 27 27 GLU N N 27 119.915 119.915 121.051 -1.136 25380
2498 1 6 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.038 0.220 25380
2499 1 6 . 1 1 27 27 GLU C C 27 179.163 179.163 178.628 0.535 25380
2500 1 6 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.454 0.621 25380
2501 1 6 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.904 -0.369 25380
2502 1 6 . 1 1 27 27 GLU H H 27 8.288 8.288 8.822 -0.534 25380
2503 1 6 . 1 1 28 28 PHE N N 28 120.500 120.500 119.290 1.210 25380
2504 1 6 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.630 0.342 25380
2505 1 6 . 1 1 28 28 PHE C C 28 177.386 177.386 176.934 0.452 25380
2506 1 6 . 1 1 28 28 PHE CA C 28 60.401 60.401 59.613 0.788 25380
2507 1 6 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.046 0.522 25380
2508 1 6 . 1 1 28 28 PHE H H 28 8.568 8.568 8.022 0.546 25380
2509 1 6 . 1 1 29 29 SER N N 29 114.306 114.306 114.900 -0.594 25380
2510 1 6 . 1 1 29 29 SER HA H 29 4.288 4.288 3.524 0.764 25380
2511 1 6 . 1 1 29 29 SER C C 29 175.656 175.656 176.301 -0.645 25380
2512 1 6 . 1 1 29 29 SER CA C 29 61.058 61.058 59.877 1.181 25380
2513 1 6 . 1 1 29 29 SER CB C 29 63.555 63.555 62.942 0.613 25380
2514 1 6 . 1 1 29 29 SER H H 29 8.479 8.479 7.065 1.414 25380
2515 1 6 . 1 1 30 30 GLU N N 30 118.322 118.322 119.788 -1.466 25380
2516 1 6 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.213 -0.121 25380
2517 1 6 . 1 1 30 30 GLU C C 30 177.312 177.312 176.323 0.989 25380
2518 1 6 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.591 -0.011 25380
2519 1 6 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.865 -1.288 25380
2520 1 6 . 1 1 30 30 GLU H H 30 8.428 8.428 8.003 0.425 25380
2521 1 6 . 1 1 31 31 ASP N N 31 115.630 115.630 117.413 -1.783 25380
2522 1 6 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.807 0.003 25380
2523 1 6 . 1 1 31 31 ASP C C 31 175.723 175.723 173.873 1.850 25380
2524 1 6 . 1 1 31 31 ASP CA C 31 53.974 53.974 53.407 0.567 25380
2525 1 6 . 1 1 31 31 ASP CB C 31 40.818 40.818 43.779 -2.961 25380
2526 1 6 . 1 1 31 31 ASP H H 31 7.303 7.303 7.964 -0.661 25380
2527 1 6 . 1 1 32 32 LYS N N 32 114.357 114.357 122.424 -8.067 25380
2528 1 6 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.644 -0.817 25380
2529 1 6 . 1 1 32 32 LYS C C 32 175.716 175.716 176.331 -0.615 25380
2530 1 6 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.887 0.275 25380
2531 1 6 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.593 -5.213 25380
2532 1 6 . 1 1 32 32 LYS H H 32 7.148 7.148 8.485 -1.337 25380
2533 1 6 . 1 1 33 33 ARG N N 33 120.929 120.929 123.069 -2.140 25380
2534 1 6 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.612 -0.411 25380
2535 1 6 . 1 1 33 33 ARG C C 33 173.982 173.982 173.420 0.562 25380
2536 1 6 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.363 0.831 25380
2537 1 6 . 1 1 33 33 ARG CB C 33 30.642 30.642 35.198 -4.556 25380
2538 1 6 . 1 1 33 33 ARG H H 33 7.388 7.388 8.570 -1.182 25380
2539 1 6 . 1 1 34 34 SER N N 34 115.867 115.867 114.744 1.123 25380
2540 1 6 . 1 1 34 34 SER HA H 34 5.355 5.355 5.077 0.278 25380
2541 1 6 . 1 1 34 34 SER C C 34 172.754 172.754 172.753 0.001 25380
2542 1 6 . 1 1 34 34 SER CA C 34 58.236 58.236 56.604 1.632 25380
2543 1 6 . 1 1 34 34 SER CB C 34 65.212 65.212 66.412 -1.200 25380
2544 1 6 . 1 1 34 34 SER H H 34 8.173 8.173 8.346 -0.173 25380
2545 1 6 . 1 1 35 35 ILE N N 35 119.621 119.621 113.686 5.935 25380
2546 1 6 . 1 1 35 35 ILE HA H 35 4.863 4.863 5.080 -0.217 25380
2547 1 6 . 1 1 35 35 ILE C C 35 174.069 174.069 173.956 0.113 25380
2548 1 6 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.088 0.868 25380
2549 1 6 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.537 -0.882 25380
2550 1 6 . 1 1 35 35 ILE H H 35 6.779 6.779 8.348 -1.569 25380
2551 1 6 . 1 1 36 36 PHE N N 36 124.305 124.305 121.100 3.205 25380
2552 1 6 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.977 -1.524 25380
2553 1 6 . 1 1 36 36 PHE C C 36 173.204 173.204 175.344 -2.140 25380
2554 1 6 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.449 -0.033 25380
2555 1 6 . 1 1 36 36 PHE CB C 36 44.817 44.817 42.455 2.362 25380
2556 1 6 . 1 1 36 36 PHE H H 36 8.411 8.411 9.280 -0.869 25380
2557 1 6 . 1 1 37 37 TYR N N 37 118.743 118.743 123.600 -4.857 25380
2558 1 6 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.575 -0.005 25380
2559 1 6 . 1 1 37 37 TYR C C 37 175.455 175.455 173.972 1.483 25380
2560 1 6 . 1 1 37 37 TYR CA C 37 56.518 56.518 55.280 1.238 25380
2561 1 6 . 1 1 37 37 TYR CB C 37 40.991 40.991 41.394 -0.403 25380
2562 1 6 . 1 1 37 37 TYR H H 37 8.353 8.353 9.388 -1.035 25380
2563 1 6 . 1 1 38 38 PHE N N 38 119.236 119.236 130.119 -10.883 25380
2564 1 6 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.351 0.809 25380
2565 1 6 . 1 1 38 38 PHE C C 38 174.650 174.650 172.762 1.888 25380
2566 1 6 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.729 1.113 25380
2567 1 6 . 1 1 38 38 PHE CB C 38 42.619 42.619 39.123 3.497 25380
2568 1 6 . 1 1 38 38 PHE H H 38 9.756 9.756 9.123 0.633 25380
2569 1 6 . 1 1 39 39 ALA N N 39 122.516 122.516 129.407 -6.891 25380
2570 1 6 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.600 -0.060 25380
2571 1 6 . 1 1 39 39 ALA C C 39 177.042 177.042 174.167 2.875 25380
2572 1 6 . 1 1 39 39 ALA CA C 39 50.843 50.843 48.634 2.209 25380
2573 1 6 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.504 -2.926 25380
2574 1 6 . 1 1 39 39 ALA H H 39 7.738 7.738 8.360 -0.622 25380
2575 1 6 . 1 1 40 40 PRO C C 40 175.411 175.411 177.026 -1.615 25380
2576 1 6 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.635 1.653 25380
2577 1 6 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.810 -1.706 25380
2578 1 6 . 1 1 41 41 THR N N 41 105.878 105.878 116.204 -10.326 25380
2579 1 6 . 1 1 41 41 THR HA H 41 4.190 4.190 3.659 0.531 25380
2580 1 6 . 1 1 41 41 THR C C 41 176.400 176.400 175.397 1.003 25380
2581 1 6 . 1 1 41 41 THR CA C 41 61.937 61.937 65.058 -3.121 25380
2582 1 6 . 1 1 41 41 THR CB C 41 68.331 68.331 68.578 -0.247 25380
2583 1 6 . 1 1 41 41 THR H H 41 6.715 6.715 8.175 -1.460 25380
2584 1 6 . 1 1 42 42 ASN N N 42 118.863 118.863 118.146 0.717 25380
2585 1 6 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.373 0.162 25380
2586 1 6 . 1 1 42 42 ASN C C 42 173.764 173.764 175.795 -2.031 25380
2587 1 6 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.761 -1.585 25380
2588 1 6 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.400 4.315 25380
2589 1 6 . 1 1 42 42 ASN H H 42 7.153 7.153 8.401 -1.248 25380
2590 1 6 . 1 1 43 43 ALA N N 43 126.174 126.174 119.158 7.016 25380
2591 1 6 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.392 0.033 25380
2592 1 6 . 1 1 43 43 ALA C C 43 179.308 179.308 176.883 2.425 25380
2593 1 6 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.217 -0.235 25380
2594 1 6 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.593 -1.299 25380
2595 1 6 . 1 1 43 43 ALA H H 43 9.465 9.465 7.551 1.914 25380
2596 1 6 . 1 1 44 44 HIS N N 44 126.251 126.251 115.295 10.956 25380
2597 1 6 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.253 -0.426 25380
2598 1 6 . 1 1 44 44 HIS C C 44 177.407 177.407 174.977 2.430 25380
2599 1 6 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.773 4.252 25380
2600 1 6 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.486 1.144 25380
2601 1 6 . 1 1 44 44 HIS H H 44 9.407 9.407 7.886 1.521 25380
2602 1 6 . 1 1 45 45 LYS N N 45 114.990 114.990 119.600 -4.610 25380
2603 1 6 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.387 -0.504 25380
2604 1 6 . 1 1 45 45 LYS C C 45 178.284 178.284 177.671 0.613 25380
2605 1 6 . 1 1 45 45 LYS CA C 45 59.249 59.249 58.374 0.875 25380
2606 1 6 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.938 -1.104 25380
2607 1 6 . 1 1 45 45 LYS H H 45 8.960 8.960 8.154 0.806 25380
2608 1 6 . 1 1 46 46 ASP N N 46 120.411 120.411 119.507 0.904 25380
2609 1 6 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.490 -0.064 25380
2610 1 6 . 1 1 46 46 ASP C C 46 177.773 177.773 178.289 -0.516 25380
2611 1 6 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.208 -0.192 25380
2612 1 6 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.145 -0.248 25380
2613 1 6 . 1 1 46 46 ASP H H 46 6.777 6.777 8.634 -1.857 25380
2614 1 6 . 1 1 47 47 MET N N 47 118.178 118.178 118.902 -0.724 25380
2615 1 6 . 1 1 47 47 MET HA H 47 3.879 3.879 4.278 -0.399 25380
2616 1 6 . 1 1 47 47 MET C C 47 179.499 179.499 177.701 1.798 25380
2617 1 6 . 1 1 47 47 MET CA C 47 56.052 56.052 59.255 -3.203 25380
2618 1 6 . 1 1 47 47 MET CB C 47 29.601 29.601 32.717 -3.116 25380
2619 1 6 . 1 1 47 47 MET H H 47 7.367 7.367 7.975 -0.608 25380
2620 1 6 . 1 1 48 48 LEU N N 48 117.665 117.665 119.423 -1.758 25380
2621 1 6 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.913 -0.066 25380
2622 1 6 . 1 1 48 48 LEU C C 48 179.843 179.843 178.374 1.469 25380
2623 1 6 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.829 -0.249 25380
2624 1 6 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.537 -0.584 25380
2625 1 6 . 1 1 48 48 LEU H H 48 7.672 7.672 7.647 0.025 25380
2626 1 6 . 1 1 49 49 LYS N N 49 119.326 119.326 118.385 0.941 25380
2627 1 6 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.471 0.656 25380
2628 1 6 . 1 1 49 49 LYS C C 49 179.684 179.684 178.243 1.441 25380
2629 1 6 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.098 -0.299 25380
2630 1 6 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.817 -0.364 25380
2631 1 6 . 1 1 49 49 LYS H H 49 7.420 7.420 7.498 -0.078 25380
2632 1 6 . 1 1 50 50 ALA N N 50 122.022 122.022 122.538 -0.516 25380
2633 1 6 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.441 0.602 25380
2634 1 6 . 1 1 50 50 ALA C C 50 178.818 178.818 178.897 -0.079 25380
2635 1 6 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.697 0.472 25380
2636 1 6 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.692 -0.392 25380
2637 1 6 . 1 1 50 50 ALA H H 50 7.551 7.551 7.744 -0.193 25380
2638 1 6 . 1 1 51 51 VAL N N 51 118.165 118.165 117.825 0.340 25380
2639 1 6 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.532 -0.090 25380
2640 1 6 . 1 1 51 51 VAL C C 51 178.646 178.646 178.209 0.437 25380
2641 1 6 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.377 0.829 25380
2642 1 6 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.785 0.668 25380
2643 1 6 . 1 1 51 51 VAL H H 51 7.226 7.226 7.375 -0.149 25380
2644 1 6 . 1 1 52 52 ASP N N 52 122.298 122.298 120.442 1.856 25380
2645 1 6 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.323 0.048 25380
2646 1 6 . 1 1 52 52 ASP C C 52 177.898 177.898 178.983 -1.085 25380
2647 1 6 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.023 0.548 25380
2648 1 6 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.188 0.198 25380
2649 1 6 . 1 1 52 52 ASP H H 52 8.232 8.232 7.300 0.932 25380
2650 1 6 . 1 1 53 53 PHE N N 53 121.541 121.541 120.147 1.394 25380
2651 1 6 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.379 -0.058 25380
2652 1 6 . 1 1 53 53 PHE C C 53 177.224 177.224 178.148 -0.924 25380
2653 1 6 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.978 2.102 25380
2654 1 6 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.986 1.714 25380
2655 1 6 . 1 1 53 53 PHE H H 53 8.240 8.240 7.731 0.509 25380
2656 1 6 . 1 1 54 54 PHE N N 54 115.925 115.925 116.757 -0.832 25380
2657 1 6 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.144 -0.489 25380
2658 1 6 . 1 1 54 54 PHE C C 54 178.269 178.269 177.759 0.510 25380
2659 1 6 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.583 4.617 25380
2660 1 6 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.927 0.651 25380
2661 1 6 . 1 1 54 54 PHE H H 54 7.755 7.755 8.069 -0.314 25380
2662 1 6 . 1 1 55 55 LYS N N 55 120.251 120.251 118.135 2.116 25380
2663 1 6 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.057 0.369 25380
2664 1 6 . 1 1 55 55 LYS C C 55 181.484 181.484 178.216 3.268 25380
2665 1 6 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.777 0.852 25380
2666 1 6 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.357 -0.618 25380
2667 1 6 . 1 1 55 55 LYS H H 55 8.213 8.213 7.441 0.772 25380
2668 1 6 . 1 1 56 56 GLU N N 56 120.146 120.146 117.767 2.379 25380
2669 1 6 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.093 -0.100 25380
2670 1 6 . 1 1 56 56 GLU C C 56 178.085 178.085 177.502 0.583 25380
2671 1 6 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.425 0.362 25380
2672 1 6 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.043 -1.446 25380
2673 1 6 . 1 1 56 56 GLU H H 56 7.850 7.850 7.769 0.081 25380
2674 1 6 . 1 1 57 57 LYS N N 57 115.940 115.940 119.215 -3.275 25380
2675 1 6 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.261 -0.158 25380
2676 1 6 . 1 1 57 57 LYS C C 57 176.225 176.225 177.204 -0.979 25380
2677 1 6 . 1 1 57 57 LYS CA C 57 54.572 54.572 54.967 -0.395 25380
2678 1 6 . 1 1 57 57 LYS CB C 57 32.036 32.036 32.884 -0.848 25380
2679 1 6 . 1 1 57 57 LYS H H 57 7.019 7.019 7.636 -0.617 25380
2680 1 6 . 1 1 58 58 GLY N N 58 106.593 106.593 109.014 -2.421 25380
2681 1 6 . 1 1 58 58 GLY C C 58 174.350 174.350 174.645 -0.295 25380
2682 1 6 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.503 -0.003 25380
2683 1 6 . 1 1 58 58 GLY H H 58 7.883 7.883 8.592 -0.709 25380
2684 1 6 . 1 1 59 59 HIS N N 59 117.962 117.962 117.137 0.825 25380
2685 1 6 . 1 1 59 59 HIS HA H 59 4.867 4.867 3.963 0.904 25380
2686 1 6 . 1 1 59 59 HIS C C 59 173.271 173.271 174.899 -1.628 25380
2687 1 6 . 1 1 59 59 HIS CA C 59 54.778 54.778 56.983 -2.205 25380
2688 1 6 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.938 1.747 25380
2689 1 6 . 1 1 59 59 HIS H H 59 8.218 8.218 7.967 0.251 25380
2690 1 6 . 1 1 60 60 THR N N 60 119.624 119.624 110.643 8.981 25380
2691 1 6 . 1 1 60 60 THR HA H 60 4.430 4.430 4.147 0.283 25380
2692 1 6 . 1 1 60 60 THR C C 60 171.430 171.430 174.103 -2.673 25380
2693 1 6 . 1 1 60 60 THR CA C 60 63.480 63.480 60.001 3.479 25380
2694 1 6 . 1 1 60 60 THR CB C 60 69.761 69.761 70.476 -0.715 25380
2695 1 6 . 1 1 60 60 THR H H 60 8.780 8.780 7.541 1.239 25380
2696 1 6 . 1 1 61 61 ALA N N 61 126.706 126.706 129.891 -3.185 25380
2697 1 6 . 1 1 61 61 ALA HA H 61 5.246 5.246 3.921 1.325 25380
2698 1 6 . 1 1 61 61 ALA C C 61 174.753 174.753 176.859 -2.106 25380
2699 1 6 . 1 1 61 61 ALA CA C 61 49.772 49.772 53.812 -4.040 25380
2700 1 6 . 1 1 61 61 ALA CB C 61 22.889 22.889 19.500 3.389 25380
2701 1 6 . 1 1 61 61 ALA H H 61 7.795 7.795 8.505 -0.710 25380
2702 1 6 . 1 1 62 62 TYR N N 62 117.859 117.859 114.956 2.903 25380
2703 1 6 . 1 1 62 62 TYR C C 62 173.431 173.431 173.801 -0.370 25380
2704 1 6 . 1 1 62 62 TYR CA C 62 56.647 56.647 56.506 0.141 25380
2705 1 6 . 1 1 62 62 TYR CB C 62 40.549 40.549 41.957 -1.408 25380
2706 1 6 . 1 1 62 62 TYR H H 62 8.711 8.711 7.907 0.804 25380
2707 1 6 . 1 1 63 63 LEU N N 63 125.044 125.044 123.510 1.534 25380
2708 1 6 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.739 0.672 25380
2709 1 6 . 1 1 63 63 LEU C C 63 175.319 175.319 175.065 0.254 25380
2710 1 6 . 1 1 63 63 LEU CA C 63 53.230 53.230 54.096 -0.866 25380
2711 1 6 . 1 1 63 63 LEU CB C 63 45.701 45.701 44.801 0.900 25380
2712 1 6 . 1 1 63 63 LEU H H 63 8.746 8.746 8.375 0.371 25380
2713 1 6 . 1 1 64 64 ASP N N 64 125.463 125.463 125.685 -0.222 25380
2714 1 6 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.909 0.290 25380
2715 1 6 . 1 1 64 64 ASP C C 64 174.512 174.512 174.368 0.144 25380
2716 1 6 . 1 1 64 64 ASP CA C 64 52.700 52.700 53.147 -0.446 25380
2717 1 6 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.038 -0.084 25380
2718 1 6 . 1 1 64 64 ASP H H 64 9.293 9.293 8.912 0.381 25380
2719 1 6 . 1 1 65 65 GLU N N 65 120.711 120.711 120.972 -0.261 25380
2720 1 6 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.357 0.710 25380
2721 1 6 . 1 1 65 65 GLU C C 65 175.652 175.652 176.696 -1.044 25380
2722 1 6 . 1 1 65 65 GLU CA C 65 55.643 55.643 57.585 -1.942 25380
2723 1 6 . 1 1 65 65 GLU CB C 65 30.455 30.455 30.671 -0.216 25380
2724 1 6 . 1 1 65 65 GLU H H 65 8.715 8.715 8.534 0.181 25380
2725 1 6 . 1 1 66 66 VAL N N 66 122.936 122.936 121.710 1.226 25380
2726 1 6 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.107 0.323 25380
2727 1 6 . 1 1 66 66 VAL C C 66 175.065 175.065 175.788 -0.723 25380
2728 1 6 . 1 1 66 66 VAL CA C 66 60.991 60.991 63.178 -2.187 25380
2729 1 6 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.659 1.621 25380
2730 1 6 . 1 1 66 66 VAL H H 66 9.156 9.156 8.522 0.634 25380
2731 1 6 . 1 1 67 67 ARG N N 67 126.104 126.104 128.449 -2.345 25380
2732 1 6 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.431 0.110 25380
2733 1 6 . 1 1 67 67 ARG C C 67 176.708 176.708 175.865 0.843 25380
2734 1 6 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.568 0.512 25380
2735 1 6 . 1 1 67 67 ARG CB C 67 30.908 30.908 28.690 2.218 25380
2736 1 6 . 1 1 67 67 ARG H H 67 8.734 8.734 8.794 -0.060 25380
2737 1 6 . 1 1 68 68 VAL N N 68 120.707 120.707 116.733 3.974 25380
2738 1 6 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.484 -0.332 25380
2739 1 6 . 1 1 68 68 VAL C C 68 175.931 175.931 176.526 -0.595 25380
2740 1 6 . 1 1 68 68 VAL CA C 68 62.776 62.776 61.392 1.384 25380
2741 1 6 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.141 1.348 25380
2742 1 6 . 1 1 68 68 VAL H H 68 8.384 8.384 7.820 0.564 25380
2743 1 6 . 1 1 69 69 SER N N 69 116.156 116.156 117.701 -1.545 25380
2744 1 6 . 1 1 69 69 SER HA H 69 4.693 4.693 4.254 0.439 25380
2745 1 6 . 1 1 69 69 SER C C 69 174.544 174.544 175.758 -1.214 25380
2746 1 6 . 1 1 69 69 SER CA C 69 57.754 57.754 61.296 -3.542 25380
2747 1 6 . 1 1 69 69 SER CB C 69 64.831 64.831 62.939 1.892 25380
2748 1 6 . 1 1 69 69 SER H H 69 8.067 8.067 7.720 0.347 25380
2749 1 6 . 1 1 70 70 THR N N 70 110.753 110.753 111.520 -0.767 25380
2750 1 6 . 1 1 70 70 THR HA H 70 4.152 4.152 4.236 -0.084 25380
2751 1 6 . 1 1 70 70 THR C C 70 174.865 174.865 175.368 -0.503 25380
2752 1 6 . 1 1 70 70 THR CA C 70 63.831 63.831 64.374 -0.543 25380
2753 1 6 . 1 1 70 70 THR CB C 70 68.956 68.956 69.006 -0.050 25380
2754 1 6 . 1 1 70 70 THR H H 70 8.095 8.095 8.134 -0.039 25380
2755 1 6 . 1 1 71 71 ASP N N 71 121.817 121.817 121.473 0.344 25380
2756 1 6 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.609 -0.019 25380
2757 1 6 . 1 1 71 71 ASP C C 71 176.746 176.746 177.180 -0.434 25380
2758 1 6 . 1 1 71 71 ASP CA C 71 54.264 54.264 55.870 -1.606 25380
2759 1 6 . 1 1 71 71 ASP CB C 71 41.425 41.425 41.034 0.391 25380
2760 1 6 . 1 1 71 71 ASP H H 71 8.076 8.076 8.401 -0.325 25380
2761 1 6 . 1 1 72 72 GLU N N 72 123.635 123.635 115.872 7.763 25380
2762 1 6 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.491 -0.498 25380
2763 1 6 . 1 1 72 72 GLU C C 72 176.971 176.971 175.329 1.642 25380
2764 1 6 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.167 2.052 25380
2765 1 6 . 1 1 72 72 GLU CB C 72 29.702 29.702 31.722 -2.020 25380
2766 1 6 . 1 1 72 72 GLU H H 72 8.514 8.514 8.353 0.161 25380
2767 1 6 . 1 1 73 73 LYS N N 73 117.857 117.857 119.498 -1.641 25380
2768 1 6 . 1 1 73 73 LYS HA H 73 4.643 4.643 3.970 0.673 25380
2769 1 6 . 1 1 73 73 LYS C C 73 176.508 176.508 175.095 1.413 25380
2770 1 6 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.392 -0.312 25380
2771 1 6 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.257 0.946 25380
2772 1 6 . 1 1 73 73 LYS H H 73 8.423 8.423 7.661 0.762 25380
2773 1 6 . 1 1 74 74 ASP N N 74 120.580 120.580 115.499 5.081 25380
2774 1 6 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.339 0.419 25380
2775 1 6 . 1 1 74 74 ASP C C 74 174.059 174.059 175.781 -1.722 25380
2776 1 6 . 1 1 74 74 ASP CA C 74 53.279 53.279 56.326 -3.047 25380
2777 1 6 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.238 -0.660 25380
2778 1 6 . 1 1 74 74 ASP H H 74 7.918 7.918 8.485 -0.567 25380
2779 1 6 . 1 1 75 75 PHE N N 75 118.513 118.513 118.334 0.179 25380
2780 1 6 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.646 -0.283 25380
2781 1 6 . 1 1 75 75 PHE C C 75 173.038 173.038 175.488 -2.450 25380
2782 1 6 . 1 1 75 75 PHE CA C 75 55.522 55.522 57.208 -1.686 25380
2783 1 6 . 1 1 75 75 PHE CB C 75 41.714 41.714 40.466 1.248 25380
2784 1 6 . 1 1 75 75 PHE H H 75 7.397 7.397 7.891 -0.494 25380
2785 1 6 . 1 1 76 76 LEU N N 76 116.773 116.773 124.233 -7.460 25380
2786 1 6 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.610 0.033 25380
2787 1 6 . 1 1 76 76 LEU C C 76 177.553 177.553 175.620 1.933 25380
2788 1 6 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.565 -0.946 25380
2789 1 6 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.473 2.228 25380
2790 1 6 . 1 1 76 76 LEU H H 76 8.774 8.774 9.179 -0.405 25380
2791 1 6 . 1 1 77 77 TYR N N 77 118.377 118.377 125.639 -7.262 25380
2792 1 6 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.906 0.509 25380
2793 1 6 . 1 1 77 77 TYR C C 77 175.479 175.479 173.399 2.080 25380
2794 1 6 . 1 1 77 77 TYR CA C 77 58.391 58.391 55.611 2.780 25380
2795 1 6 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.285 0.815 25380
2796 1 6 . 1 1 77 77 TYR H H 77 8.589 8.589 9.178 -0.589 25380
2797 1 6 . 1 1 78 78 GLU N N 78 123.875 123.875 129.396 -5.521 25380
2798 1 6 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.774 0.199 25380
2799 1 6 . 1 1 78 78 GLU C C 78 174.120 174.120 173.943 0.177 25380
2800 1 6 . 1 1 78 78 GLU CA C 78 54.378 54.378 54.124 0.254 25380
2801 1 6 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.061 -0.421 25380
2802 1 6 . 1 1 78 78 GLU H H 78 9.576 9.576 8.656 0.920 25380
2803 1 6 . 1 1 79 79 LEU N N 79 128.661 128.661 127.060 1.601 25380
2804 1 6 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.380 0.909 25380
2805 1 6 . 1 1 79 79 LEU C C 79 174.219 174.219 175.422 -1.203 25380
2806 1 6 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.981 -0.832 25380
2807 1 6 . 1 1 79 79 LEU CB C 79 46.630 46.630 43.740 2.890 25380
2808 1 6 . 1 1 79 79 LEU H H 79 9.139 9.139 8.869 0.270 25380
2809 1 6 . 1 1 80 80 HIS N N 80 124.886 124.886 122.171 2.715 25380
2810 1 6 . 1 1 80 80 HIS HA H 80 5.430 5.430 5.017 0.413 25380
2811 1 6 . 1 1 80 80 HIS C C 80 173.346 173.346 175.190 -1.844 25380
2812 1 6 . 1 1 80 80 HIS CA C 80 53.149 53.149 53.917 -0.768 25380
2813 1 6 . 1 1 80 80 HIS CB C 80 30.768 30.768 31.665 -0.897 25380
2814 1 6 . 1 1 80 80 HIS H H 80 8.897 8.897 9.033 -0.136 25380
2815 1 6 . 1 1 81 81 ILE N N 81 125.173 125.173 120.463 4.710 25380
2816 1 6 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.683 0.607 25380
2817 1 6 . 1 1 81 81 ILE C C 81 174.600 174.600 174.024 0.576 25380
2818 1 6 . 1 1 81 81 ILE CA C 81 60.500 60.500 61.848 -1.348 25380
2819 1 6 . 1 1 81 81 ILE CB C 81 39.700 39.700 36.358 3.342 25380
2820 1 6 . 1 1 81 81 ILE H H 81 8.909 8.909 8.918 -0.009 25380
2821 1 7 . 1 1 2 2 HIS N N 2 120.430 120.430 120.841 -0.411 25380
2822 1 7 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.839 -0.104 25380
2823 1 7 . 1 1 2 2 HIS C C 2 173.884 173.884 174.745 -0.861 25380
2824 1 7 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.208 -1.155 25380
2825 1 7 . 1 1 2 2 HIS CB C 2 28.666 28.666 31.061 -2.394 25380
2826 1 7 . 1 1 2 2 HIS H H 2 8.678 8.678 8.465 0.213 25380
2827 1 7 . 1 1 3 3 MET N N 3 122.377 122.377 123.205 -0.828 25380
2828 1 7 . 1 1 3 3 MET HA H 3 4.207 4.207 4.696 -0.489 25380
2829 1 7 . 1 1 3 3 MET C C 3 174.584 174.584 176.400 -1.816 25380
2830 1 7 . 1 1 3 3 MET CA C 3 56.550 56.550 54.531 2.019 25380
2831 1 7 . 1 1 3 3 MET CB C 3 33.426 33.426 32.921 0.505 25380
2832 1 7 . 1 1 3 3 MET H H 3 8.240 8.240 8.746 -0.506 25380
2833 1 7 . 1 1 4 4 LYS N N 4 123.568 123.568 121.285 2.283 25380
2834 1 7 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.583 0.256 25380
2835 1 7 . 1 1 4 4 LYS C C 4 175.906 175.906 175.224 0.682 25380
2836 1 7 . 1 1 4 4 LYS CA C 4 54.800 54.800 56.509 -1.709 25380
2837 1 7 . 1 1 4 4 LYS CB C 4 34.900 34.900 33.156 1.744 25380
2838 1 7 . 1 1 4 4 LYS H H 4 8.351 8.351 8.385 -0.034 25380
2839 1 7 . 1 1 5 5 LEU N N 5 123.568 123.568 119.163 4.405 25380
2840 1 7 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.694 -0.855 25380
2841 1 7 . 1 1 5 5 LEU C C 5 175.900 175.900 176.810 -0.910 25380
2842 1 7 . 1 1 5 5 LEU CA C 5 53.350 53.350 52.984 0.366 25380
2843 1 7 . 1 1 5 5 LEU CB C 5 45.900 45.900 44.888 1.012 25380
2844 1 7 . 1 1 5 5 LEU H H 5 8.281 8.281 7.591 0.690 25380
2845 1 7 . 1 1 6 6 VAL N N 6 121.564 121.564 123.166 -1.602 25380
2846 1 7 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.308 0.118 25380
2847 1 7 . 1 1 6 6 VAL C C 6 178.200 178.200 174.506 3.694 25380
2848 1 7 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.654 2.546 25380
2849 1 7 . 1 1 6 6 VAL CB C 6 33.200 33.200 34.052 -0.852 25380
2850 1 7 . 1 1 6 6 VAL H H 6 9.276 9.276 9.088 0.188 25380
2851 1 7 . 1 1 7 7 LEU N N 7 121.564 121.564 127.413 -5.849 25380
2852 1 7 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.121 -0.695 25380
2853 1 7 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.004 10.196 25380
2854 1 7 . 1 1 7 7 LEU CB C 7 33.200 33.200 44.215 -11.015 25380
2855 1 7 . 1 1 7 7 LEU H H 7 9.276 9.276 8.344 0.932 25380
2856 1 7 . 1 1 8 8 ALA C C 8 177.040 177.040 177.550 -0.510 25380
2857 1 7 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.526 -0.825 25380
2858 1 7 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.670 1.194 25380
2859 1 7 . 1 1 9 9 LYS N N 9 119.845 119.845 125.725 -5.880 25380
2860 1 7 . 1 1 9 9 LYS HA H 9 4.128 4.128 3.924 0.204 25380
2861 1 7 . 1 1 9 9 LYS C C 9 176.075 176.075 178.284 -2.209 25380
2862 1 7 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.685 -2.924 25380
2863 1 7 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.602 0.317 25380
2864 1 7 . 1 1 9 9 LYS H H 9 8.545 8.545 8.586 -0.041 25380
2865 1 7 . 1 1 10 10 ASN N N 10 119.279 119.279 117.790 1.489 25380
2866 1 7 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.550 0.095 25380
2867 1 7 . 1 1 10 10 ASN C C 10 175.443 175.443 177.692 -2.249 25380
2868 1 7 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.918 -2.261 25380
2869 1 7 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.788 0.988 25380
2870 1 7 . 1 1 10 10 ASN H H 10 8.592 8.592 8.777 -0.185 25380
2871 1 7 . 1 1 11 11 THR N N 11 111.876 111.876 114.647 -2.771 25380
2872 1 7 . 1 1 11 11 THR HA H 11 4.311 4.311 4.159 0.152 25380
2873 1 7 . 1 1 11 11 THR C C 11 174.666 174.666 175.441 -0.775 25380
2874 1 7 . 1 1 11 11 THR CA C 11 62.044 62.044 65.396 -3.352 25380
2875 1 7 . 1 1 11 11 THR CB C 11 69.895 69.895 68.907 0.988 25380
2876 1 7 . 1 1 11 11 THR H H 11 8.058 8.058 8.332 -0.274 25380
2877 1 7 . 1 1 12 12 ARG N N 12 121.152 121.152 118.549 2.603 25380
2878 1 7 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.328 -0.066 25380
2879 1 7 . 1 1 12 12 ARG C C 12 176.714 176.714 176.404 0.310 25380
2880 1 7 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.542 0.280 25380
2881 1 7 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.183 -0.481 25380
2882 1 7 . 1 1 12 12 ARG H H 12 8.291 8.291 7.684 0.607 25380
2883 1 7 . 1 1 13 13 LYS N N 13 120.459 120.459 118.215 2.244 25380
2884 1 7 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.073 -0.177 25380
2885 1 7 . 1 1 13 13 LYS C C 13 176.682 176.682 176.567 0.115 25380
2886 1 7 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.307 -0.329 25380
2887 1 7 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.282 2.216 25380
2888 1 7 . 1 1 13 13 LYS H H 13 8.286 8.286 8.488 -0.202 25380
2889 1 7 . 1 1 14 14 SER N N 14 114.568 114.568 114.228 0.340 25380
2890 1 7 . 1 1 14 14 SER HA H 14 4.371 4.371 4.288 0.083 25380
2891 1 7 . 1 1 14 14 SER C C 14 173.990 173.990 174.914 -0.924 25380
2892 1 7 . 1 1 14 14 SER CA C 14 58.617 58.617 59.644 -1.027 25380
2893 1 7 . 1 1 14 14 SER CB C 14 63.933 63.933 63.710 0.223 25380
2894 1 7 . 1 1 14 14 SER H H 14 7.957 7.957 8.428 -0.471 25380
2895 1 7 . 1 1 15 15 ASP N N 15 121.565 121.565 118.488 3.077 25380
2896 1 7 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.671 -0.070 25380
2897 1 7 . 1 1 15 15 ASP C C 15 175.684 175.684 176.264 -0.580 25380
2898 1 7 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.811 0.338 25380
2899 1 7 . 1 1 15 15 ASP CB C 15 41.229 41.229 39.969 1.260 25380
2900 1 7 . 1 1 15 15 ASP H H 15 8.166 8.166 8.056 0.110 25380
2901 1 7 . 1 1 16 16 ALA N N 16 124.173 124.173 123.382 0.791 25380
2902 1 7 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.012 0.359 25380
2903 1 7 . 1 1 16 16 ALA C C 16 177.184 177.184 177.392 -0.208 25380
2904 1 7 . 1 1 16 16 ALA CA C 16 52.337 52.337 54.237 -1.900 25380
2905 1 7 . 1 1 16 16 ALA CB C 16 19.359 19.359 18.714 0.645 25380
2906 1 7 . 1 1 16 16 ALA H H 16 8.163 8.163 8.202 -0.039 25380
2907 1 7 . 1 1 17 17 LYS N N 17 121.152 121.152 119.717 1.435 25380
2908 1 7 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.266 0.160 25380
2909 1 7 . 1 1 17 17 LYS C C 17 175.488 175.488 175.735 -0.247 25380
2910 1 7 . 1 1 17 17 LYS CA C 17 56.205 56.205 56.502 -0.297 25380
2911 1 7 . 1 1 17 17 LYS CB C 17 34.296 34.296 30.802 3.494 25380
2912 1 7 . 1 1 17 17 LYS H H 17 8.363 8.363 8.512 -0.149 25380
2913 1 7 . 1 1 18 18 SER N N 18 116.448 116.448 117.181 -0.733 25380
2914 1 7 . 1 1 18 18 SER HA H 18 5.355 5.355 4.530 0.825 25380
2915 1 7 . 1 1 18 18 SER C C 18 173.887 173.887 175.865 -1.978 25380
2916 1 7 . 1 1 18 18 SER CA C 18 57.248 57.248 58.199 -0.951 25380
2917 1 7 . 1 1 18 18 SER CB C 18 64.962 64.962 64.896 0.066 25380
2918 1 7 . 1 1 18 18 SER H H 18 8.206 8.206 8.539 -0.333 25380
2919 1 7 . 1 1 19 19 VAL N N 19 117.867 117.867 122.914 -5.047 25380
2920 1 7 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.688 -0.068 25380
2921 1 7 . 1 1 19 19 VAL C C 19 174.169 174.169 177.136 -2.967 25380
2922 1 7 . 1 1 19 19 VAL CA C 19 59.546 59.546 67.066 -7.520 25380
2923 1 7 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.860 4.042 25380
2924 1 7 . 1 1 19 19 VAL H H 19 9.086 9.086 7.959 1.127 25380
2925 1 7 . 1 1 20 20 GLU N N 20 120.843 120.843 119.864 0.979 25380
2926 1 7 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.231 0.637 25380
2927 1 7 . 1 1 20 20 GLU C C 20 178.747 178.747 178.516 0.231 25380
2928 1 7 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.313 -4.761 25380
2929 1 7 . 1 1 20 20 GLU CB C 20 31.099 31.099 29.218 1.881 25380
2930 1 7 . 1 1 20 20 GLU H H 20 8.841 8.841 8.570 0.271 25380
2931 1 7 . 1 1 21 21 LEU N N 21 122.653 122.653 118.987 3.666 25380
2932 1 7 . 1 1 21 21 LEU HA H 21 3.443 3.443 3.942 -0.499 25380
2933 1 7 . 1 1 21 21 LEU C C 21 178.799 178.799 179.123 -0.324 25380
2934 1 7 . 1 1 21 21 LEU CA C 21 58.707 58.707 58.010 0.697 25380
2935 1 7 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.620 -3.049 25380
2936 1 7 . 1 1 21 21 LEU H H 21 8.744 8.744 7.636 1.108 25380
2937 1 7 . 1 1 22 22 GLU N N 22 115.392 115.392 119.093 -3.701 25380
2938 1 7 . 1 1 22 22 GLU HA H 22 3.989 3.989 3.702 0.287 25380
2939 1 7 . 1 1 22 22 GLU C C 22 179.328 179.328 178.634 0.694 25380
2940 1 7 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.304 0.776 25380
2941 1 7 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.201 -0.367 25380
2942 1 7 . 1 1 22 22 GLU H H 22 8.744 8.744 7.525 1.219 25380
2943 1 7 . 1 1 23 23 ASP N N 23 118.597 118.597 120.754 -2.157 25380
2944 1 7 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.422 0.189 25380
2945 1 7 . 1 1 23 23 ASP C C 23 179.139 179.139 178.827 0.312 25380
2946 1 7 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.128 0.391 25380
2947 1 7 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.454 -0.012 25380
2948 1 7 . 1 1 23 23 ASP H H 23 7.098 7.098 8.308 -1.210 25380
2949 1 7 . 1 1 24 24 LEU N N 24 119.869 119.869 121.191 -1.322 25380
2950 1 7 . 1 1 24 24 LEU HA H 24 3.934 3.934 4.099 -0.165 25380
2951 1 7 . 1 1 24 24 LEU C C 24 179.045 179.045 178.927 0.118 25380
2952 1 7 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.218 -0.669 25380
2953 1 7 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.994 -0.444 25380
2954 1 7 . 1 1 24 24 LEU H H 24 7.576 7.576 8.533 -0.957 25380
2955 1 7 . 1 1 25 25 TYR N N 25 118.100 118.100 118.478 -0.378 25380
2956 1 7 . 1 1 25 25 TYR HA H 25 4.367 4.367 2.888 1.479 25380
2957 1 7 . 1 1 25 25 TYR C C 25 177.945 177.945 177.775 0.170 25380
2958 1 7 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.541 1.065 25380
2959 1 7 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.308 -0.360 25380
2960 1 7 . 1 1 25 25 TYR H H 25 8.320 8.320 7.239 1.081 25380
2961 1 7 . 1 1 26 26 HIS N N 26 119.440 119.440 118.418 1.022 25380
2962 1 7 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.305 0.066 25380
2963 1 7 . 1 1 26 26 HIS C C 26 176.559 176.559 178.116 -1.557 25380
2964 1 7 . 1 1 26 26 HIS CA C 26 59.519 59.519 58.667 0.852 25380
2965 1 7 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.180 -2.052 25380
2966 1 7 . 1 1 26 26 HIS H H 26 8.383 8.383 8.449 -0.066 25380
2967 1 7 . 1 1 27 27 GLU N N 27 119.915 119.915 120.450 -0.535 25380
2968 1 7 . 1 1 27 27 GLU HA H 27 4.258 4.258 3.972 0.286 25380
2969 1 7 . 1 1 27 27 GLU C C 27 179.163 179.163 178.533 0.630 25380
2970 1 7 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.163 0.912 25380
2971 1 7 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.393 0.142 25380
2972 1 7 . 1 1 27 27 GLU H H 27 8.288 8.288 8.752 -0.464 25380
2973 1 7 . 1 1 28 28 PHE N N 28 120.500 120.500 120.290 0.210 25380
2974 1 7 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.326 0.646 25380
2975 1 7 . 1 1 28 28 PHE C C 28 177.386 177.386 176.684 0.702 25380
2976 1 7 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.957 -0.556 25380
2977 1 7 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.287 0.281 25380
2978 1 7 . 1 1 28 28 PHE H H 28 8.568 8.568 7.959 0.609 25380
2979 1 7 . 1 1 29 29 SER N N 29 114.306 114.306 114.366 -0.060 25380
2980 1 7 . 1 1 29 29 SER HA H 29 4.288 4.288 4.378 -0.090 25380
2981 1 7 . 1 1 29 29 SER C C 29 175.656 175.656 176.327 -0.671 25380
2982 1 7 . 1 1 29 29 SER CA C 29 61.058 61.058 60.478 0.580 25380
2983 1 7 . 1 1 29 29 SER CB C 29 63.555 63.555 63.463 0.092 25380
2984 1 7 . 1 1 29 29 SER H H 29 8.479 8.479 7.964 0.515 25380
2985 1 7 . 1 1 30 30 GLU N N 30 118.322 118.322 120.247 -1.925 25380
2986 1 7 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.241 -0.149 25380
2987 1 7 . 1 1 30 30 GLU C C 30 177.312 177.312 176.581 0.731 25380
2988 1 7 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.978 -0.398 25380
2989 1 7 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.704 -1.127 25380
2990 1 7 . 1 1 30 30 GLU H H 30 8.428 8.428 8.031 0.397 25380
2991 1 7 . 1 1 31 31 ASP N N 31 115.630 115.630 116.759 -1.129 25380
2992 1 7 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.832 -0.022 25380
2993 1 7 . 1 1 31 31 ASP C C 31 175.723 175.723 173.659 2.064 25380
2994 1 7 . 1 1 31 31 ASP CA C 31 53.974 53.974 53.023 0.951 25380
2995 1 7 . 1 1 31 31 ASP CB C 31 40.818 40.818 44.138 -3.320 25380
2996 1 7 . 1 1 31 31 ASP H H 31 7.303 7.303 8.049 -0.746 25380
2997 1 7 . 1 1 32 32 LYS N N 32 114.357 114.357 120.915 -6.558 25380
2998 1 7 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.371 -0.544 25380
2999 1 7 . 1 1 32 32 LYS C C 32 175.716 175.716 175.846 -0.130 25380
3000 1 7 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.624 0.538 25380
3001 1 7 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.184 -4.803 25380
3002 1 7 . 1 1 32 32 LYS H H 32 7.148 7.148 8.318 -1.170 25380
3003 1 7 . 1 1 33 33 ARG N N 33 120.929 120.929 122.576 -1.647 25380
3004 1 7 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.647 -0.446 25380
3005 1 7 . 1 1 33 33 ARG C C 33 173.982 173.982 173.808 0.174 25380
3006 1 7 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.301 0.893 25380
3007 1 7 . 1 1 33 33 ARG CB C 33 30.642 30.642 32.949 -2.307 25380
3008 1 7 . 1 1 33 33 ARG H H 33 7.388 7.388 8.498 -1.110 25380
3009 1 7 . 1 1 34 34 SER N N 34 115.867 115.867 115.914 -0.047 25380
3010 1 7 . 1 1 34 34 SER HA H 34 5.355 5.355 5.359 -0.004 25380
3011 1 7 . 1 1 34 34 SER C C 34 172.754 172.754 173.599 -0.845 25380
3012 1 7 . 1 1 34 34 SER CA C 34 58.236 58.236 57.014 1.222 25380
3013 1 7 . 1 1 34 34 SER CB C 34 65.212 65.212 66.700 -1.488 25380
3014 1 7 . 1 1 34 34 SER H H 34 8.173 8.173 8.532 -0.359 25380
3015 1 7 . 1 1 35 35 ILE N N 35 119.621 119.621 114.583 5.038 25380
3016 1 7 . 1 1 35 35 ILE HA H 35 4.863 4.863 5.232 -0.369 25380
3017 1 7 . 1 1 35 35 ILE C C 35 174.069 174.069 173.760 0.309 25380
3018 1 7 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.482 0.474 25380
3019 1 7 . 1 1 35 35 ILE CB C 35 40.655 40.655 42.073 -1.418 25380
3020 1 7 . 1 1 35 35 ILE H H 35 6.779 6.779 8.932 -2.153 25380
3021 1 7 . 1 1 36 36 PHE N N 36 124.305 124.305 119.475 4.830 25380
3022 1 7 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.877 -1.424 25380
3023 1 7 . 1 1 36 36 PHE C C 36 173.204 173.204 175.024 -1.820 25380
3024 1 7 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.263 0.153 25380
3025 1 7 . 1 1 36 36 PHE CB C 36 44.817 44.817 42.781 2.036 25380
3026 1 7 . 1 1 36 36 PHE H H 36 8.411 8.411 9.166 -0.755 25380
3027 1 7 . 1 1 37 37 TYR N N 37 118.743 118.743 125.419 -6.676 25380
3028 1 7 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.145 0.425 25380
3029 1 7 . 1 1 37 37 TYR C C 37 175.455 175.455 173.958 1.497 25380
3030 1 7 . 1 1 37 37 TYR CA C 37 56.518 56.518 56.850 -0.332 25380
3031 1 7 . 1 1 37 37 TYR CB C 37 40.991 40.991 41.029 -0.038 25380
3032 1 7 . 1 1 37 37 TYR H H 37 8.353 8.353 9.584 -1.231 25380
3033 1 7 . 1 1 38 38 PHE N N 38 119.236 119.236 130.277 -11.041 25380
3034 1 7 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.792 0.368 25380
3035 1 7 . 1 1 38 38 PHE C C 38 174.650 174.650 173.036 1.614 25380
3036 1 7 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.000 1.842 25380
3037 1 7 . 1 1 38 38 PHE CB C 38 42.619 42.619 39.506 3.113 25380
3038 1 7 . 1 1 38 38 PHE H H 38 9.756 9.756 9.082 0.674 25380
3039 1 7 . 1 1 39 39 ALA N N 39 122.516 122.516 129.718 -7.202 25380
3040 1 7 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.898 -0.358 25380
3041 1 7 . 1 1 39 39 ALA C C 39 177.042 177.042 173.993 3.049 25380
3042 1 7 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.339 1.504 25380
3043 1 7 . 1 1 39 39 ALA CB C 39 18.578 18.578 22.252 -3.674 25380
3044 1 7 . 1 1 39 39 ALA H H 39 7.738 7.738 8.754 -1.016 25380
3045 1 7 . 1 1 40 40 PRO C C 40 175.411 175.411 177.356 -1.945 25380
3046 1 7 . 1 1 40 40 PRO CA C 40 64.288 64.288 63.096 1.192 25380
3047 1 7 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.531 -1.427 25380
3048 1 7 . 1 1 41 41 THR N N 41 105.878 105.878 117.131 -11.253 25380
3049 1 7 . 1 1 41 41 THR HA H 41 4.190 4.190 3.857 0.333 25380
3050 1 7 . 1 1 41 41 THR C C 41 176.400 176.400 175.088 1.312 25380
3051 1 7 . 1 1 41 41 THR CA C 41 61.937 61.937 65.480 -3.543 25380
3052 1 7 . 1 1 41 41 THR CB C 41 68.331 68.331 68.754 -0.423 25380
3053 1 7 . 1 1 41 41 THR H H 41 6.715 6.715 8.416 -1.701 25380
3054 1 7 . 1 1 42 42 ASN N N 42 118.863 118.863 117.494 1.369 25380
3055 1 7 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.448 0.087 25380
3056 1 7 . 1 1 42 42 ASN C C 42 173.764 173.764 176.051 -2.287 25380
3057 1 7 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.489 -1.313 25380
3058 1 7 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.933 3.782 25380
3059 1 7 . 1 1 42 42 ASN H H 42 7.153 7.153 8.336 -1.183 25380
3060 1 7 . 1 1 43 43 ALA N N 43 126.174 126.174 120.004 6.170 25380
3061 1 7 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.369 0.056 25380
3062 1 7 . 1 1 43 43 ALA C C 43 179.308 179.308 176.934 2.374 25380
3063 1 7 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.224 -0.242 25380
3064 1 7 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.528 -1.234 25380
3065 1 7 . 1 1 43 43 ALA H H 43 9.465 9.465 7.899 1.566 25380
3066 1 7 . 1 1 44 44 HIS N N 44 126.251 126.251 115.708 10.543 25380
3067 1 7 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.345 -0.518 25380
3068 1 7 . 1 1 44 44 HIS C C 44 177.407 177.407 175.335 2.072 25380
3069 1 7 . 1 1 44 44 HIS CA C 44 61.025 61.025 57.024 4.001 25380
3070 1 7 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.483 1.147 25380
3071 1 7 . 1 1 44 44 HIS H H 44 9.407 9.407 7.892 1.515 25380
3072 1 7 . 1 1 45 45 LYS N N 45 114.990 114.990 118.855 -3.865 25380
3073 1 7 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.193 -0.310 25380
3074 1 7 . 1 1 45 45 LYS C C 45 178.284 178.284 177.453 0.831 25380
3075 1 7 . 1 1 45 45 LYS CA C 45 59.249 59.249 59.434 -0.185 25380
3076 1 7 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.508 -0.674 25380
3077 1 7 . 1 1 45 45 LYS H H 45 8.960 8.960 8.144 0.816 25380
3078 1 7 . 1 1 46 46 ASP N N 46 120.411 120.411 119.382 1.029 25380
3079 1 7 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.414 0.012 25380
3080 1 7 . 1 1 46 46 ASP C C 46 177.773 177.773 178.048 -0.275 25380
3081 1 7 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.367 -0.351 25380
3082 1 7 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.215 -0.318 25380
3083 1 7 . 1 1 46 46 ASP H H 46 6.777 6.777 8.538 -1.761 25380
3084 1 7 . 1 1 47 47 MET N N 47 118.178 118.178 119.731 -1.553 25380
3085 1 7 . 1 1 47 47 MET HA H 47 3.879 3.879 4.009 -0.130 25380
3086 1 7 . 1 1 47 47 MET C C 47 179.499 179.499 177.797 1.702 25380
3087 1 7 . 1 1 47 47 MET CA C 47 56.052 56.052 59.022 -2.970 25380
3088 1 7 . 1 1 47 47 MET CB C 47 29.601 29.601 32.596 -2.995 25380
3089 1 7 . 1 1 47 47 MET H H 47 7.367 7.367 7.957 -0.590 25380
3090 1 7 . 1 1 48 48 LEU N N 48 117.665 117.665 118.838 -1.173 25380
3091 1 7 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.796 0.051 25380
3092 1 7 . 1 1 48 48 LEU C C 48 179.843 179.843 178.674 1.169 25380
3093 1 7 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.409 0.171 25380
3094 1 7 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.407 -0.454 25380
3095 1 7 . 1 1 48 48 LEU H H 48 7.672 7.672 7.828 -0.156 25380
3096 1 7 . 1 1 49 49 LYS N N 49 119.326 119.326 118.599 0.727 25380
3097 1 7 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.579 0.548 25380
3098 1 7 . 1 1 49 49 LYS C C 49 179.684 179.684 178.276 1.408 25380
3099 1 7 . 1 1 49 49 LYS CA C 49 58.799 58.799 58.905 -0.106 25380
3100 1 7 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.866 -0.412 25380
3101 1 7 . 1 1 49 49 LYS H H 49 7.420 7.420 7.722 -0.302 25380
3102 1 7 . 1 1 50 50 ALA N N 50 122.022 122.022 122.402 -0.380 25380
3103 1 7 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.602 0.441 25380
3104 1 7 . 1 1 50 50 ALA C C 50 178.818 178.818 178.639 0.179 25380
3105 1 7 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.625 0.544 25380
3106 1 7 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.387 -0.087 25380
3107 1 7 . 1 1 50 50 ALA H H 50 7.551 7.551 7.579 -0.028 25380
3108 1 7 . 1 1 51 51 VAL N N 51 118.165 118.165 117.968 0.197 25380
3109 1 7 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.553 -0.111 25380
3110 1 7 . 1 1 51 51 VAL C C 51 178.646 178.646 178.022 0.624 25380
3111 1 7 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.308 0.898 25380
3112 1 7 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.760 0.693 25380
3113 1 7 . 1 1 51 51 VAL H H 51 7.226 7.226 7.262 -0.036 25380
3114 1 7 . 1 1 52 52 ASP N N 52 122.298 122.298 120.424 1.874 25380
3115 1 7 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.302 0.069 25380
3116 1 7 . 1 1 52 52 ASP C C 52 177.898 177.898 179.009 -1.111 25380
3117 1 7 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.039 0.532 25380
3118 1 7 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.133 0.253 25380
3119 1 7 . 1 1 52 52 ASP H H 52 8.232 8.232 7.249 0.983 25380
3120 1 7 . 1 1 53 53 PHE N N 53 121.541 121.541 119.974 1.567 25380
3121 1 7 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.188 0.133 25380
3122 1 7 . 1 1 53 53 PHE C C 53 177.224 177.224 178.165 -0.941 25380
3123 1 7 . 1 1 53 53 PHE CA C 53 61.080 61.080 59.069 2.011 25380
3124 1 7 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.807 1.893 25380
3125 1 7 . 1 1 53 53 PHE H H 53 8.240 8.240 7.762 0.478 25380
3126 1 7 . 1 1 54 54 PHE N N 54 115.925 115.925 117.124 -1.199 25380
3127 1 7 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.229 -0.574 25380
3128 1 7 . 1 1 54 54 PHE C C 54 178.269 178.269 177.235 1.034 25380
3129 1 7 . 1 1 54 54 PHE CA C 54 64.200 64.200 60.068 4.132 25380
3130 1 7 . 1 1 54 54 PHE CB C 54 38.578 38.578 38.036 0.542 25380
3131 1 7 . 1 1 54 54 PHE H H 54 7.755 7.755 7.723 0.032 25380
3132 1 7 . 1 1 55 55 LYS N N 55 120.251 120.251 117.342 2.909 25380
3133 1 7 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.063 0.363 25380
3134 1 7 . 1 1 55 55 LYS C C 55 181.484 181.484 178.498 2.986 25380
3135 1 7 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.809 0.820 25380
3136 1 7 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.399 -0.660 25380
3137 1 7 . 1 1 55 55 LYS H H 55 8.213 8.213 7.544 0.669 25380
3138 1 7 . 1 1 56 56 GLU N N 56 120.146 120.146 117.540 2.606 25380
3139 1 7 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.186 -0.193 25380
3140 1 7 . 1 1 56 56 GLU C C 56 178.085 178.085 177.454 0.631 25380
3141 1 7 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.450 0.338 25380
3142 1 7 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.261 -1.665 25380
3143 1 7 . 1 1 56 56 GLU H H 56 7.850 7.850 7.857 -0.007 25380
3144 1 7 . 1 1 57 57 LYS N N 57 115.940 115.940 119.143 -3.203 25380
3145 1 7 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.538 -0.435 25380
3146 1 7 . 1 1 57 57 LYS C C 57 176.225 176.225 176.865 -0.640 25380
3147 1 7 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.074 -0.502 25380
3148 1 7 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.829 -1.793 25380
3149 1 7 . 1 1 57 57 LYS H H 57 7.019 7.019 7.800 -0.781 25380
3150 1 7 . 1 1 58 58 GLY N N 58 106.593 106.593 110.779 -4.186 25380
3151 1 7 . 1 1 58 58 GLY C C 58 174.350 174.350 174.920 -0.570 25380
3152 1 7 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.576 -0.076 25380
3153 1 7 . 1 1 58 58 GLY H H 58 7.883 7.883 8.543 -0.659 25380
3154 1 7 . 1 1 59 59 HIS N N 59 117.962 117.962 117.974 -0.012 25380
3155 1 7 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.382 0.485 25380
3156 1 7 . 1 1 59 59 HIS C C 59 173.271 173.271 175.625 -2.354 25380
3157 1 7 . 1 1 59 59 HIS CA C 59 54.778 54.778 57.980 -3.202 25380
3158 1 7 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.699 1.986 25380
3159 1 7 . 1 1 59 59 HIS H H 59 8.218 8.218 7.965 0.253 25380
3160 1 7 . 1 1 60 60 THR N N 60 119.624 119.624 111.463 8.161 25380
3161 1 7 . 1 1 60 60 THR HA H 60 4.430 4.430 3.974 0.456 25380
3162 1 7 . 1 1 60 60 THR C C 60 171.430 171.430 173.914 -2.484 25380
3163 1 7 . 1 1 60 60 THR CA C 60 63.480 63.480 62.759 0.721 25380
3164 1 7 . 1 1 60 60 THR CB C 60 69.761 69.761 69.357 0.404 25380
3165 1 7 . 1 1 60 60 THR H H 60 8.780 8.780 7.958 0.822 25380
3166 1 7 . 1 1 61 61 ALA N N 61 126.706 126.706 127.977 -1.271 25380
3167 1 7 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.369 0.877 25380
3168 1 7 . 1 1 61 61 ALA C C 61 174.753 174.753 176.652 -1.899 25380
3169 1 7 . 1 1 61 61 ALA CA C 61 49.772 49.772 52.912 -3.140 25380
3170 1 7 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.680 2.208 25380
3171 1 7 . 1 1 61 61 ALA H H 61 7.795 7.795 8.534 -0.739 25380
3172 1 7 . 1 1 62 62 TYR N N 62 117.859 117.859 118.485 -0.626 25380
3173 1 7 . 1 1 62 62 TYR C C 62 173.431 173.431 172.843 0.588 25380
3174 1 7 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.434 -0.787 25380
3175 1 7 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.199 -1.650 25380
3176 1 7 . 1 1 62 62 TYR H H 62 8.711 8.711 7.708 1.003 25380
3177 1 7 . 1 1 63 63 LEU N N 63 125.044 125.044 127.613 -2.569 25380
3178 1 7 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.443 0.968 25380
3179 1 7 . 1 1 63 63 LEU C C 63 175.319 175.319 174.023 1.296 25380
3180 1 7 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.433 -0.203 25380
3181 1 7 . 1 1 63 63 LEU CB C 63 45.701 45.701 44.455 1.246 25380
3182 1 7 . 1 1 63 63 LEU H H 63 8.746 8.746 7.780 0.966 25380
3183 1 7 . 1 1 64 64 ASP N N 64 125.463 125.463 124.495 0.968 25380
3184 1 7 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.865 0.334 25380
3185 1 7 . 1 1 64 64 ASP C C 64 174.512 174.512 174.688 -0.176 25380
3186 1 7 . 1 1 64 64 ASP CA C 64 52.700 52.700 51.723 0.977 25380
3187 1 7 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.781 -0.827 25380
3188 1 7 . 1 1 64 64 ASP H H 64 9.293 9.293 8.758 0.535 25380
3189 1 7 . 1 1 65 65 GLU N N 65 120.711 120.711 119.748 0.963 25380
3190 1 7 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.394 0.673 25380
3191 1 7 . 1 1 65 65 GLU C C 65 175.652 175.652 176.076 -0.424 25380
3192 1 7 . 1 1 65 65 GLU CA C 65 55.643 55.643 57.066 -1.423 25380
3193 1 7 . 1 1 65 65 GLU CB C 65 30.455 30.455 31.302 -0.848 25380
3194 1 7 . 1 1 65 65 GLU H H 65 8.715 8.715 8.564 0.151 25380
3195 1 7 . 1 1 66 66 VAL N N 66 122.936 122.936 121.253 1.683 25380
3196 1 7 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.254 0.176 25380
3197 1 7 . 1 1 66 66 VAL C C 66 175.065 175.065 174.927 0.138 25380
3198 1 7 . 1 1 66 66 VAL CA C 66 60.991 60.991 62.257 -1.266 25380
3199 1 7 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.982 1.298 25380
3200 1 7 . 1 1 66 66 VAL H H 66 9.156 9.156 8.694 0.462 25380
3201 1 7 . 1 1 67 67 ARG N N 67 126.104 126.104 127.027 -0.923 25380
3202 1 7 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.503 0.038 25380
3203 1 7 . 1 1 67 67 ARG C C 67 176.708 176.708 175.874 0.834 25380
3204 1 7 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.854 0.226 25380
3205 1 7 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.452 1.456 25380
3206 1 7 . 1 1 67 67 ARG H H 67 8.734 8.734 8.735 -0.001 25380
3207 1 7 . 1 1 68 68 VAL N N 68 120.707 120.707 117.516 3.191 25380
3208 1 7 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.419 -0.267 25380
3209 1 7 . 1 1 68 68 VAL C C 68 175.931 175.931 176.038 -0.107 25380
3210 1 7 . 1 1 68 68 VAL CA C 68 62.776 62.776 60.537 2.239 25380
3211 1 7 . 1 1 68 68 VAL CB C 68 32.489 32.489 30.992 1.496 25380
3212 1 7 . 1 1 68 68 VAL H H 68 8.384 8.384 7.874 0.510 25380
3213 1 7 . 1 1 69 69 SER N N 69 116.156 116.156 117.494 -1.338 25380
3214 1 7 . 1 1 69 69 SER HA H 69 4.693 4.693 4.382 0.311 25380
3215 1 7 . 1 1 69 69 SER C C 69 174.544 174.544 175.828 -1.284 25380
3216 1 7 . 1 1 69 69 SER CA C 69 57.754 57.754 60.681 -2.927 25380
3217 1 7 . 1 1 69 69 SER CB C 69 64.831 64.831 62.731 2.100 25380
3218 1 7 . 1 1 69 69 SER H H 69 8.067 8.067 7.906 0.161 25380
3219 1 7 . 1 1 70 70 THR N N 70 110.753 110.753 116.725 -5.972 25380
3220 1 7 . 1 1 70 70 THR HA H 70 4.152 4.152 4.206 -0.054 25380
3221 1 7 . 1 1 70 70 THR C C 70 174.865 174.865 174.933 -0.068 25380
3222 1 7 . 1 1 70 70 THR CA C 70 63.831 63.831 64.539 -0.708 25380
3223 1 7 . 1 1 70 70 THR CB C 70 68.956 68.956 68.933 0.023 25380
3224 1 7 . 1 1 70 70 THR H H 70 8.095 8.095 8.074 0.021 25380
3225 1 7 . 1 1 71 71 ASP N N 71 121.817 121.817 120.324 1.493 25380
3226 1 7 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.597 -0.007 25380
3227 1 7 . 1 1 71 71 ASP C C 71 176.746 176.746 176.828 -0.082 25380
3228 1 7 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.055 -1.791 25380
3229 1 7 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.956 0.469 25380
3230 1 7 . 1 1 71 71 ASP H H 71 8.076 8.076 8.309 -0.233 25380
3231 1 7 . 1 1 72 72 GLU N N 72 123.635 123.635 116.289 7.346 25380
3232 1 7 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.575 -0.582 25380
3233 1 7 . 1 1 72 72 GLU C C 72 176.971 176.971 175.265 1.706 25380
3234 1 7 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.152 2.067 25380
3235 1 7 . 1 1 72 72 GLU CB C 72 29.702 29.702 32.219 -2.517 25380
3236 1 7 . 1 1 72 72 GLU H H 72 8.514 8.514 8.160 0.354 25380
3237 1 7 . 1 1 73 73 LYS N N 73 117.857 117.857 119.858 -2.001 25380
3238 1 7 . 1 1 73 73 LYS HA H 73 4.643 4.643 4.051 0.592 25380
3239 1 7 . 1 1 73 73 LYS C C 73 176.508 176.508 174.883 1.625 25380
3240 1 7 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.358 -0.278 25380
3241 1 7 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.770 0.433 25380
3242 1 7 . 1 1 73 73 LYS H H 73 8.423 8.423 7.868 0.555 25380
3243 1 7 . 1 1 74 74 ASP N N 74 120.580 120.580 113.936 6.644 25380
3244 1 7 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.746 0.012 25380
3245 1 7 . 1 1 74 74 ASP C C 74 174.059 174.059 174.887 -0.828 25380
3246 1 7 . 1 1 74 74 ASP CA C 74 53.279 53.279 52.948 0.331 25380
3247 1 7 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.219 -0.641 25380
3248 1 7 . 1 1 74 74 ASP H H 74 7.918 7.918 8.492 -0.574 25380
3249 1 7 . 1 1 75 75 PHE N N 75 118.513 118.513 120.337 -1.824 25380
3250 1 7 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.923 -0.560 25380
3251 1 7 . 1 1 75 75 PHE C C 75 173.038 173.038 175.360 -2.322 25380
3252 1 7 . 1 1 75 75 PHE CA C 75 55.522 55.522 57.187 -1.665 25380
3253 1 7 . 1 1 75 75 PHE CB C 75 41.714 41.714 41.011 0.703 25380
3254 1 7 . 1 1 75 75 PHE H H 75 7.397 7.397 8.003 -0.606 25380
3255 1 7 . 1 1 76 76 LEU N N 76 116.773 116.773 124.453 -7.680 25380
3256 1 7 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.716 -0.073 25380
3257 1 7 . 1 1 76 76 LEU C C 76 177.553 177.553 175.543 2.010 25380
3258 1 7 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.363 -0.744 25380
3259 1 7 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.537 2.164 25380
3260 1 7 . 1 1 76 76 LEU H H 76 8.774 8.774 9.305 -0.531 25380
3261 1 7 . 1 1 77 77 TYR N N 77 118.377 118.377 126.516 -8.139 25380
3262 1 7 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.941 0.474 25380
3263 1 7 . 1 1 77 77 TYR C C 77 175.479 175.479 173.205 2.274 25380
3264 1 7 . 1 1 77 77 TYR CA C 77 58.391 58.391 55.415 2.976 25380
3265 1 7 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.105 0.995 25380
3266 1 7 . 1 1 77 77 TYR H H 77 8.589 8.589 9.339 -0.750 25380
3267 1 7 . 1 1 78 78 GLU N N 78 123.875 123.875 129.333 -5.458 25380
3268 1 7 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.864 0.109 25380
3269 1 7 . 1 1 78 78 GLU C C 78 174.120 174.120 173.610 0.510 25380
3270 1 7 . 1 1 78 78 GLU CA C 78 54.378 54.378 53.973 0.405 25380
3271 1 7 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.745 -1.105 25380
3272 1 7 . 1 1 78 78 GLU H H 78 9.576 9.576 8.896 0.680 25380
3273 1 7 . 1 1 79 79 LEU N N 79 128.661 128.661 126.570 2.091 25380
3274 1 7 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.411 0.878 25380
3275 1 7 . 1 1 79 79 LEU C C 79 174.219 174.219 175.123 -0.904 25380
3276 1 7 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.804 -0.655 25380
3277 1 7 . 1 1 79 79 LEU CB C 79 46.630 46.630 43.858 2.772 25380
3278 1 7 . 1 1 79 79 LEU H H 79 9.139 9.139 8.724 0.415 25380
3279 1 7 . 1 1 80 80 HIS N N 80 124.886 124.886 122.858 2.028 25380
3280 1 7 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.868 0.562 25380
3281 1 7 . 1 1 80 80 HIS C C 80 173.346 173.346 176.019 -2.673 25380
3282 1 7 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.861 -1.712 25380
3283 1 7 . 1 1 80 80 HIS CB C 80 30.768 30.768 30.683 0.085 25380
3284 1 7 . 1 1 80 80 HIS H H 80 8.897 8.897 9.302 -0.405 25380
3285 1 7 . 1 1 81 81 ILE N N 81 125.173 125.173 124.017 1.156 25380
3286 1 7 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.802 0.488 25380
3287 1 7 . 1 1 81 81 ILE C C 81 174.600 174.600 174.260 0.340 25380
3288 1 7 . 1 1 81 81 ILE CA C 81 60.500 60.500 62.105 -1.605 25380
3289 1 7 . 1 1 81 81 ILE CB C 81 39.700 39.700 36.980 2.720 25380
3290 1 7 . 1 1 81 81 ILE H H 81 8.909 8.909 8.156 0.753 25380
3291 1 8 . 1 1 2 2 HIS N N 2 120.430 120.430 120.599 -0.169 25380
3292 1 8 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.909 -0.174 25380
3293 1 8 . 1 1 2 2 HIS C C 2 173.884 173.884 174.903 -1.019 25380
3294 1 8 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.262 -1.210 25380
3295 1 8 . 1 1 2 2 HIS CB C 2 28.666 28.666 31.064 -2.398 25380
3296 1 8 . 1 1 2 2 HIS H H 2 8.678 8.678 8.360 0.318 25380
3297 1 8 . 1 1 3 3 MET N N 3 122.377 122.377 122.346 0.031 25380
3298 1 8 . 1 1 3 3 MET HA H 3 4.207 4.207 4.771 -0.564 25380
3299 1 8 . 1 1 3 3 MET C C 3 174.584 174.584 175.637 -1.053 25380
3300 1 8 . 1 1 3 3 MET CA C 3 56.550 56.550 54.413 2.137 25380
3301 1 8 . 1 1 3 3 MET CB C 3 33.426 33.426 32.776 0.650 25380
3302 1 8 . 1 1 3 3 MET H H 3 8.240 8.240 8.768 -0.528 25380
3303 1 8 . 1 1 4 4 LYS N N 4 123.568 123.568 121.834 1.734 25380
3304 1 8 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.628 0.211 25380
3305 1 8 . 1 1 4 4 LYS C C 4 175.906 175.906 174.815 1.091 25380
3306 1 8 . 1 1 4 4 LYS CA C 4 54.800 54.800 55.820 -1.020 25380
3307 1 8 . 1 1 4 4 LYS CB C 4 34.900 34.900 33.088 1.812 25380
3308 1 8 . 1 1 4 4 LYS H H 4 8.351 8.351 8.366 -0.015 25380
3309 1 8 . 1 1 5 5 LEU N N 5 123.568 123.568 118.907 4.661 25380
3310 1 8 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.617 -0.778 25380
3311 1 8 . 1 1 5 5 LEU C C 5 175.900 175.900 176.581 -0.681 25380
3312 1 8 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.595 -0.245 25380
3313 1 8 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.809 0.090 25380
3314 1 8 . 1 1 5 5 LEU H H 5 8.281 8.281 7.653 0.628 25380
3315 1 8 . 1 1 6 6 VAL N N 6 121.564 121.564 122.302 -0.738 25380
3316 1 8 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.429 -0.003 25380
3317 1 8 . 1 1 6 6 VAL C C 6 178.200 178.200 174.816 3.384 25380
3318 1 8 . 1 1 6 6 VAL CA C 6 63.200 63.200 61.012 2.188 25380
3319 1 8 . 1 1 6 6 VAL CB C 6 33.200 33.200 34.272 -1.072 25380
3320 1 8 . 1 1 6 6 VAL H H 6 9.276 9.276 9.231 0.045 25380
3321 1 8 . 1 1 7 7 LEU N N 7 121.564 121.564 128.316 -6.752 25380
3322 1 8 . 1 1 7 7 LEU HA H 7 4.426 4.426 4.814 -0.388 25380
3323 1 8 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.416 9.784 25380
3324 1 8 . 1 1 7 7 LEU CB C 7 33.200 33.200 42.852 -9.652 25380
3325 1 8 . 1 1 7 7 LEU H H 7 9.276 9.276 8.559 0.717 25380
3326 1 8 . 1 1 8 8 ALA C C 8 177.040 177.040 178.383 -1.343 25380
3327 1 8 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.214 -0.513 25380
3328 1 8 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.898 0.966 25380
3329 1 8 . 1 1 9 9 LYS N N 9 119.845 119.845 122.707 -2.862 25380
3330 1 8 . 1 1 9 9 LYS HA H 9 4.128 4.128 3.881 0.247 25380
3331 1 8 . 1 1 9 9 LYS C C 9 176.075 176.075 178.670 -2.595 25380
3332 1 8 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.036 -2.275 25380
3333 1 8 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.215 0.704 25380
3334 1 8 . 1 1 9 9 LYS H H 9 8.545 8.545 8.463 0.082 25380
3335 1 8 . 1 1 10 10 ASN N N 10 119.279 119.279 118.464 0.815 25380
3336 1 8 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.487 0.158 25380
3337 1 8 . 1 1 10 10 ASN C C 10 175.443 175.443 176.946 -1.503 25380
3338 1 8 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.594 -1.937 25380
3339 1 8 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.716 1.061 25380
3340 1 8 . 1 1 10 10 ASN H H 10 8.592 8.592 8.817 -0.225 25380
3341 1 8 . 1 1 11 11 THR N N 11 111.876 111.876 113.420 -1.544 25380
3342 1 8 . 1 1 11 11 THR HA H 11 4.311 4.311 4.124 0.187 25380
3343 1 8 . 1 1 11 11 THR C C 11 174.666 174.666 175.349 -0.683 25380
3344 1 8 . 1 1 11 11 THR CA C 11 62.044 62.044 64.513 -2.469 25380
3345 1 8 . 1 1 11 11 THR CB C 11 69.895 69.895 68.882 1.013 25380
3346 1 8 . 1 1 11 11 THR H H 11 8.058 8.058 8.089 -0.031 25380
3347 1 8 . 1 1 12 12 ARG N N 12 121.152 121.152 120.211 0.941 25380
3348 1 8 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.333 -0.071 25380
3349 1 8 . 1 1 12 12 ARG C C 12 176.714 176.714 176.022 0.692 25380
3350 1 8 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.114 0.708 25380
3351 1 8 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.348 -0.646 25380
3352 1 8 . 1 1 12 12 ARG H H 12 8.291 8.291 7.817 0.474 25380
3353 1 8 . 1 1 13 13 LYS N N 13 120.459 120.459 120.014 0.445 25380
3354 1 8 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.026 -0.130 25380
3355 1 8 . 1 1 13 13 LYS C C 13 176.682 176.682 176.584 0.098 25380
3356 1 8 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.221 -0.243 25380
3357 1 8 . 1 1 13 13 LYS CB C 13 32.498 32.498 31.007 1.491 25380
3358 1 8 . 1 1 13 13 LYS H H 13 8.286 8.286 8.410 -0.124 25380
3359 1 8 . 1 1 14 14 SER N N 14 114.568 114.568 113.662 0.906 25380
3360 1 8 . 1 1 14 14 SER HA H 14 4.371 4.371 4.258 0.113 25380
3361 1 8 . 1 1 14 14 SER C C 14 173.990 173.990 174.649 -0.659 25380
3362 1 8 . 1 1 14 14 SER CA C 14 58.617 58.617 60.130 -1.513 25380
3363 1 8 . 1 1 14 14 SER CB C 14 63.933 63.933 63.877 0.056 25380
3364 1 8 . 1 1 14 14 SER H H 14 7.957 7.957 8.405 -0.448 25380
3365 1 8 . 1 1 15 15 ASP N N 15 121.565 121.565 116.874 4.691 25380
3366 1 8 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.658 -0.057 25380
3367 1 8 . 1 1 15 15 ASP C C 15 175.684 175.684 175.547 0.137 25380
3368 1 8 . 1 1 15 15 ASP CA C 15 54.149 54.149 54.230 -0.081 25380
3369 1 8 . 1 1 15 15 ASP CB C 15 41.229 41.229 39.511 1.718 25380
3370 1 8 . 1 1 15 15 ASP H H 15 8.166 8.166 7.766 0.400 25380
3371 1 8 . 1 1 16 16 ALA N N 16 124.173 124.173 123.166 1.007 25380
3372 1 8 . 1 1 16 16 ALA HA H 16 4.371 4.371 3.991 0.380 25380
3373 1 8 . 1 1 16 16 ALA C C 16 177.184 177.184 177.818 -0.634 25380
3374 1 8 . 1 1 16 16 ALA CA C 16 52.337 52.337 53.665 -1.328 25380
3375 1 8 . 1 1 16 16 ALA CB C 16 19.359 19.359 19.003 0.356 25380
3376 1 8 . 1 1 16 16 ALA H H 16 8.163 8.163 8.131 0.032 25380
3377 1 8 . 1 1 17 17 LYS N N 17 121.152 121.152 119.205 1.947 25380
3378 1 8 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.093 0.333 25380
3379 1 8 . 1 1 17 17 LYS C C 17 175.488 175.488 176.990 -1.502 25380
3380 1 8 . 1 1 17 17 LYS CA C 17 56.205 56.205 57.946 -1.741 25380
3381 1 8 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.633 1.663 25380
3382 1 8 . 1 1 17 17 LYS H H 17 8.363 8.363 7.785 0.578 25380
3383 1 8 . 1 1 18 18 SER N N 18 116.448 116.448 115.036 1.412 25380
3384 1 8 . 1 1 18 18 SER HA H 18 5.355 5.355 4.052 1.303 25380
3385 1 8 . 1 1 18 18 SER C C 18 173.887 173.887 175.334 -1.447 25380
3386 1 8 . 1 1 18 18 SER CA C 18 57.248 57.248 59.975 -2.727 25380
3387 1 8 . 1 1 18 18 SER CB C 18 64.962 64.962 62.602 2.360 25380
3388 1 8 . 1 1 18 18 SER H H 18 8.206 8.206 9.076 -0.870 25380
3389 1 8 . 1 1 19 19 VAL N N 19 117.867 117.867 119.523 -1.656 25380
3390 1 8 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.692 -0.072 25380
3391 1 8 . 1 1 19 19 VAL C C 19 174.169 174.169 177.427 -3.258 25380
3392 1 8 . 1 1 19 19 VAL CA C 19 59.546 59.546 66.170 -6.624 25380
3393 1 8 . 1 1 19 19 VAL CB C 19 35.902 35.902 32.005 3.897 25380
3394 1 8 . 1 1 19 19 VAL H H 19 9.086 9.086 7.365 1.721 25380
3395 1 8 . 1 1 20 20 GLU N N 20 120.843 120.843 120.468 0.375 25380
3396 1 8 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.214 0.654 25380
3397 1 8 . 1 1 20 20 GLU C C 20 178.747 178.747 178.678 0.069 25380
3398 1 8 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.608 -5.056 25380
3399 1 8 . 1 1 20 20 GLU CB C 20 31.099 31.099 28.655 2.444 25380
3400 1 8 . 1 1 20 20 GLU H H 20 8.841 8.841 8.807 0.034 25380
3401 1 8 . 1 1 21 21 LEU N N 21 122.653 122.653 119.387 3.266 25380
3402 1 8 . 1 1 21 21 LEU HA H 21 3.443 3.443 4.091 -0.648 25380
3403 1 8 . 1 1 21 21 LEU C C 21 178.799 178.799 179.455 -0.656 25380
3404 1 8 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.709 0.998 25380
3405 1 8 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.471 -2.900 25380
3406 1 8 . 1 1 21 21 LEU H H 21 8.744 8.744 8.108 0.636 25380
3407 1 8 . 1 1 22 22 GLU N N 22 115.392 115.392 119.499 -4.107 25380
3408 1 8 . 1 1 22 22 GLU HA H 22 3.989 3.989 3.982 0.007 25380
3409 1 8 . 1 1 22 22 GLU C C 22 179.328 179.328 179.103 0.225 25380
3410 1 8 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.657 0.423 25380
3411 1 8 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.332 -0.498 25380
3412 1 8 . 1 1 22 22 GLU H H 22 8.744 8.744 7.894 0.850 25380
3413 1 8 . 1 1 23 23 ASP N N 23 118.597 118.597 120.655 -2.058 25380
3414 1 8 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.563 0.048 25380
3415 1 8 . 1 1 23 23 ASP C C 23 179.139 179.139 178.989 0.150 25380
3416 1 8 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.405 0.114 25380
3417 1 8 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.575 -0.133 25380
3418 1 8 . 1 1 23 23 ASP H H 23 7.098 7.098 8.367 -1.269 25380
3419 1 8 . 1 1 24 24 LEU N N 24 119.869 119.869 120.345 -0.476 25380
3420 1 8 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.783 0.151 25380
3421 1 8 . 1 1 24 24 LEU C C 24 179.045 179.045 178.885 0.160 25380
3422 1 8 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.056 -0.507 25380
3423 1 8 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.469 0.081 25380
3424 1 8 . 1 1 24 24 LEU H H 24 7.576 7.576 8.337 -0.761 25380
3425 1 8 . 1 1 25 25 TYR N N 25 118.100 118.100 119.079 -0.979 25380
3426 1 8 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.111 1.256 25380
3427 1 8 . 1 1 25 25 TYR C C 25 177.945 177.945 177.699 0.246 25380
3428 1 8 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.596 1.010 25380
3429 1 8 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.323 -0.375 25380
3430 1 8 . 1 1 25 25 TYR H H 25 8.320 8.320 7.423 0.897 25380
3431 1 8 . 1 1 26 26 HIS N N 26 119.440 119.440 119.609 -0.169 25380
3432 1 8 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.364 0.007 25380
3433 1 8 . 1 1 26 26 HIS C C 26 176.559 176.559 177.848 -1.289 25380
3434 1 8 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.627 -0.108 25380
3435 1 8 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.231 -2.103 25380
3436 1 8 . 1 1 26 26 HIS H H 26 8.383 8.383 8.538 -0.155 25380
3437 1 8 . 1 1 27 27 GLU N N 27 119.915 119.915 120.209 -0.294 25380
3438 1 8 . 1 1 27 27 GLU HA H 27 4.258 4.258 3.978 0.280 25380
3439 1 8 . 1 1 27 27 GLU C C 27 179.163 179.163 178.747 0.416 25380
3440 1 8 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.087 0.988 25380
3441 1 8 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.648 -0.114 25380
3442 1 8 . 1 1 27 27 GLU H H 27 8.288 8.288 8.941 -0.653 25380
3443 1 8 . 1 1 28 28 PHE N N 28 120.500 120.500 121.001 -0.501 25380
3444 1 8 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.406 0.566 25380
3445 1 8 . 1 1 28 28 PHE C C 28 177.386 177.386 177.264 0.122 25380
3446 1 8 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.840 -0.439 25380
3447 1 8 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.237 0.331 25380
3448 1 8 . 1 1 28 28 PHE H H 28 8.568 8.568 7.888 0.680 25380
3449 1 8 . 1 1 29 29 SER N N 29 114.306 114.306 114.235 0.071 25380
3450 1 8 . 1 1 29 29 SER HA H 29 4.288 4.288 4.189 0.099 25380
3451 1 8 . 1 1 29 29 SER C C 29 175.656 175.656 176.300 -0.644 25380
3452 1 8 . 1 1 29 29 SER CA C 29 61.058 61.058 60.280 0.778 25380
3453 1 8 . 1 1 29 29 SER CB C 29 63.555 63.555 63.215 0.340 25380
3454 1 8 . 1 1 29 29 SER H H 29 8.479 8.479 8.015 0.464 25380
3455 1 8 . 1 1 30 30 GLU N N 30 118.322 118.322 121.703 -3.381 25380
3456 1 8 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.095 -0.003 25380
3457 1 8 . 1 1 30 30 GLU C C 30 177.312 177.312 176.573 0.739 25380
3458 1 8 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.653 -0.073 25380
3459 1 8 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.371 -0.794 25380
3460 1 8 . 1 1 30 30 GLU H H 30 8.428 8.428 7.974 0.454 25380
3461 1 8 . 1 1 31 31 ASP N N 31 115.630 115.630 115.176 0.454 25380
3462 1 8 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.806 0.004 25380
3463 1 8 . 1 1 31 31 ASP C C 31 175.723 175.723 173.563 2.160 25380
3464 1 8 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.992 0.982 25380
3465 1 8 . 1 1 31 31 ASP CB C 31 40.818 40.818 43.262 -2.444 25380
3466 1 8 . 1 1 31 31 ASP H H 31 7.303 7.303 7.992 -0.689 25380
3467 1 8 . 1 1 32 32 LYS N N 32 114.357 114.357 117.675 -3.318 25380
3468 1 8 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.445 -0.618 25380
3469 1 8 . 1 1 32 32 LYS C C 32 175.716 175.716 175.444 0.272 25380
3470 1 8 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.198 0.964 25380
3471 1 8 . 1 1 32 32 LYS CB C 32 28.381 28.381 34.233 -5.852 25380
3472 1 8 . 1 1 32 32 LYS H H 32 7.148 7.148 8.342 -1.194 25380
3473 1 8 . 1 1 33 33 ARG N N 33 120.929 120.929 124.465 -3.536 25380
3474 1 8 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.580 -0.379 25380
3475 1 8 . 1 1 33 33 ARG C C 33 173.982 173.982 173.611 0.371 25380
3476 1 8 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.702 0.492 25380
3477 1 8 . 1 1 33 33 ARG CB C 33 30.642 30.642 33.477 -2.835 25380
3478 1 8 . 1 1 33 33 ARG H H 33 7.388 7.388 8.847 -1.459 25380
3479 1 8 . 1 1 34 34 SER N N 34 115.867 115.867 114.237 1.630 25380
3480 1 8 . 1 1 34 34 SER HA H 34 5.355 5.355 4.949 0.406 25380
3481 1 8 . 1 1 34 34 SER C C 34 172.754 172.754 172.662 0.092 25380
3482 1 8 . 1 1 34 34 SER CA C 34 58.236 58.236 57.213 1.023 25380
3483 1 8 . 1 1 34 34 SER CB C 34 65.212 65.212 66.314 -1.102 25380
3484 1 8 . 1 1 34 34 SER H H 34 8.173 8.173 8.264 -0.091 25380
3485 1 8 . 1 1 35 35 ILE N N 35 119.621 119.621 113.748 5.873 25380
3486 1 8 . 1 1 35 35 ILE HA H 35 4.863 4.863 5.152 -0.289 25380
3487 1 8 . 1 1 35 35 ILE C C 35 174.069 174.069 173.585 0.484 25380
3488 1 8 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.292 0.664 25380
3489 1 8 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.758 -1.103 25380
3490 1 8 . 1 1 35 35 ILE H H 35 6.779 6.779 8.535 -1.756 25380
3491 1 8 . 1 1 36 36 PHE N N 36 124.305 124.305 119.873 4.432 25380
3492 1 8 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.803 -1.350 25380
3493 1 8 . 1 1 36 36 PHE C C 36 173.204 173.204 175.059 -1.855 25380
3494 1 8 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.288 0.128 25380
3495 1 8 . 1 1 36 36 PHE CB C 36 44.817 44.817 42.537 2.280 25380
3496 1 8 . 1 1 36 36 PHE H H 36 8.411 8.411 8.788 -0.377 25380
3497 1 8 . 1 1 37 37 TYR N N 37 118.743 118.743 125.053 -6.310 25380
3498 1 8 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.297 0.273 25380
3499 1 8 . 1 1 37 37 TYR C C 37 175.455 175.455 173.917 1.538 25380
3500 1 8 . 1 1 37 37 TYR CA C 37 56.518 56.518 56.303 0.215 25380
3501 1 8 . 1 1 37 37 TYR CB C 37 40.991 40.991 41.348 -0.357 25380
3502 1 8 . 1 1 37 37 TYR H H 37 8.353 8.353 9.527 -1.174 25380
3503 1 8 . 1 1 38 38 PHE N N 38 119.236 119.236 130.258 -11.022 25380
3504 1 8 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.582 0.578 25380
3505 1 8 . 1 1 38 38 PHE C C 38 174.650 174.650 172.897 1.753 25380
3506 1 8 . 1 1 38 38 PHE CA C 38 56.842 56.842 53.549 3.293 25380
3507 1 8 . 1 1 38 38 PHE CB C 38 42.619 42.619 38.686 3.933 25380
3508 1 8 . 1 1 38 38 PHE H H 38 9.756 9.756 8.935 0.821 25380
3509 1 8 . 1 1 39 39 ALA N N 39 122.516 122.516 130.110 -7.594 25380
3510 1 8 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.801 -0.261 25380
3511 1 8 . 1 1 39 39 ALA C C 39 177.042 177.042 174.317 2.725 25380
3512 1 8 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.433 1.410 25380
3513 1 8 . 1 1 39 39 ALA CB C 39 18.578 18.578 22.267 -3.689 25380
3514 1 8 . 1 1 39 39 ALA H H 39 7.738 7.738 9.014 -1.276 25380
3515 1 8 . 1 1 40 40 PRO C C 40 175.411 175.411 177.079 -1.668 25380
3516 1 8 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.862 1.426 25380
3517 1 8 . 1 1 40 40 PRO CB C 40 31.104 31.104 33.161 -2.057 25380
3518 1 8 . 1 1 41 41 THR N N 41 105.878 105.878 116.591 -10.713 25380
3519 1 8 . 1 1 41 41 THR HA H 41 4.190 4.190 3.879 0.311 25380
3520 1 8 . 1 1 41 41 THR C C 41 176.400 176.400 175.596 0.804 25380
3521 1 8 . 1 1 41 41 THR CA C 41 61.937 61.937 64.859 -2.922 25380
3522 1 8 . 1 1 41 41 THR CB C 41 68.331 68.331 68.864 -0.533 25380
3523 1 8 . 1 1 41 41 THR H H 41 6.715 6.715 8.303 -1.588 25380
3524 1 8 . 1 1 42 42 ASN N N 42 118.863 118.863 118.656 0.207 25380
3525 1 8 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.490 0.045 25380
3526 1 8 . 1 1 42 42 ASN C C 42 173.764 173.764 175.687 -1.923 25380
3527 1 8 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.662 -1.486 25380
3528 1 8 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.964 3.751 25380
3529 1 8 . 1 1 42 42 ASN H H 42 7.153 7.153 8.507 -1.354 25380
3530 1 8 . 1 1 43 43 ALA N N 43 126.174 126.174 119.595 6.579 25380
3531 1 8 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.436 -0.011 25380
3532 1 8 . 1 1 43 43 ALA C C 43 179.308 179.308 176.580 2.728 25380
3533 1 8 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.225 -0.243 25380
3534 1 8 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.502 -1.208 25380
3535 1 8 . 1 1 43 43 ALA H H 43 9.465 9.465 7.851 1.614 25380
3536 1 8 . 1 1 44 44 HIS N N 44 126.251 126.251 116.006 10.245 25380
3537 1 8 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.205 -0.378 25380
3538 1 8 . 1 1 44 44 HIS C C 44 177.407 177.407 175.230 2.177 25380
3539 1 8 . 1 1 44 44 HIS CA C 44 61.025 61.025 57.155 3.870 25380
3540 1 8 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.341 1.289 25380
3541 1 8 . 1 1 44 44 HIS H H 44 9.407 9.407 8.213 1.194 25380
3542 1 8 . 1 1 45 45 LYS N N 45 114.990 114.990 118.881 -3.891 25380
3543 1 8 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.317 -0.434 25380
3544 1 8 . 1 1 45 45 LYS C C 45 178.284 178.284 177.564 0.720 25380
3545 1 8 . 1 1 45 45 LYS CA C 45 59.249 59.249 58.826 0.423 25380
3546 1 8 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.692 -0.858 25380
3547 1 8 . 1 1 45 45 LYS H H 45 8.960 8.960 8.082 0.878 25380
3548 1 8 . 1 1 46 46 ASP N N 46 120.411 120.411 119.524 0.887 25380
3549 1 8 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.436 -0.010 25380
3550 1 8 . 1 1 46 46 ASP C C 46 177.773 177.773 178.105 -0.332 25380
3551 1 8 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.452 -0.436 25380
3552 1 8 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.239 -0.342 25380
3553 1 8 . 1 1 46 46 ASP H H 46 6.777 6.777 8.579 -1.802 25380
3554 1 8 . 1 1 47 47 MET N N 47 118.178 118.178 119.011 -0.833 25380
3555 1 8 . 1 1 47 47 MET HA H 47 3.879 3.879 4.308 -0.429 25380
3556 1 8 . 1 1 47 47 MET C C 47 179.499 179.499 177.679 1.820 25380
3557 1 8 . 1 1 47 47 MET CA C 47 56.052 56.052 59.399 -3.347 25380
3558 1 8 . 1 1 47 47 MET CB C 47 29.601 29.601 32.753 -3.152 25380
3559 1 8 . 1 1 47 47 MET H H 47 7.367 7.367 8.214 -0.847 25380
3560 1 8 . 1 1 48 48 LEU N N 48 117.665 117.665 118.667 -1.002 25380
3561 1 8 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.836 0.011 25380
3562 1 8 . 1 1 48 48 LEU C C 48 179.843 179.843 178.831 1.012 25380
3563 1 8 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.426 0.154 25380
3564 1 8 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.488 -0.535 25380
3565 1 8 . 1 1 48 48 LEU H H 48 7.672 7.672 7.773 -0.101 25380
3566 1 8 . 1 1 49 49 LYS N N 49 119.326 119.326 118.493 0.833 25380
3567 1 8 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.548 0.579 25380
3568 1 8 . 1 1 49 49 LYS C C 49 179.684 179.684 178.374 1.310 25380
3569 1 8 . 1 1 49 49 LYS CA C 49 58.799 58.799 58.907 -0.108 25380
3570 1 8 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.856 -0.403 25380
3571 1 8 . 1 1 49 49 LYS H H 49 7.420 7.420 7.823 -0.403 25380
3572 1 8 . 1 1 50 50 ALA N N 50 122.022 122.022 122.834 -0.812 25380
3573 1 8 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.419 0.624 25380
3574 1 8 . 1 1 50 50 ALA C C 50 178.818 178.818 178.465 0.353 25380
3575 1 8 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.439 0.730 25380
3576 1 8 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.510 -0.210 25380
3577 1 8 . 1 1 50 50 ALA H H 50 7.551 7.551 7.953 -0.402 25380
3578 1 8 . 1 1 51 51 VAL N N 51 118.165 118.165 117.974 0.191 25380
3579 1 8 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.456 -0.014 25380
3580 1 8 . 1 1 51 51 VAL C C 51 178.646 178.646 177.951 0.695 25380
3581 1 8 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.270 0.936 25380
3582 1 8 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.744 0.709 25380
3583 1 8 . 1 1 51 51 VAL H H 51 7.226 7.226 7.225 0.001 25380
3584 1 8 . 1 1 52 52 ASP N N 52 122.298 122.298 120.368 1.930 25380
3585 1 8 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.287 0.084 25380
3586 1 8 . 1 1 52 52 ASP C C 52 177.898 177.898 179.055 -1.157 25380
3587 1 8 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.036 0.534 25380
3588 1 8 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.142 0.244 25380
3589 1 8 . 1 1 52 52 ASP H H 52 8.232 8.232 7.189 1.043 25380
3590 1 8 . 1 1 53 53 PHE N N 53 121.541 121.541 119.626 1.915 25380
3591 1 8 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.325 -0.004 25380
3592 1 8 . 1 1 53 53 PHE C C 53 177.224 177.224 177.936 -0.712 25380
3593 1 8 . 1 1 53 53 PHE CA C 53 61.080 61.080 59.583 1.497 25380
3594 1 8 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.897 1.803 25380
3595 1 8 . 1 1 53 53 PHE H H 53 8.240 8.240 7.759 0.481 25380
3596 1 8 . 1 1 54 54 PHE N N 54 115.925 115.925 117.070 -1.145 25380
3597 1 8 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.207 -0.552 25380
3598 1 8 . 1 1 54 54 PHE C C 54 178.269 178.269 177.226 1.043 25380
3599 1 8 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.526 4.674 25380
3600 1 8 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.846 0.732 25380
3601 1 8 . 1 1 54 54 PHE H H 54 7.755 7.755 7.823 -0.068 25380
3602 1 8 . 1 1 55 55 LYS N N 55 120.251 120.251 118.189 2.062 25380
3603 1 8 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.093 0.333 25380
3604 1 8 . 1 1 55 55 LYS C C 55 181.484 181.484 178.727 2.757 25380
3605 1 8 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.301 1.328 25380
3606 1 8 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.314 -0.575 25380
3607 1 8 . 1 1 55 55 LYS H H 55 8.213 8.213 7.417 0.796 25380
3608 1 8 . 1 1 56 56 GLU N N 56 120.146 120.146 118.283 1.863 25380
3609 1 8 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.159 -0.166 25380
3610 1 8 . 1 1 56 56 GLU C C 56 178.085 178.085 177.117 0.968 25380
3611 1 8 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.727 0.061 25380
3612 1 8 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.206 -1.610 25380
3613 1 8 . 1 1 56 56 GLU H H 56 7.850 7.850 7.844 0.006 25380
3614 1 8 . 1 1 57 57 LYS N N 57 115.940 115.940 119.113 -3.173 25380
3615 1 8 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.497 -0.394 25380
3616 1 8 . 1 1 57 57 LYS C C 57 176.225 176.225 176.405 -0.180 25380
3617 1 8 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.135 -0.563 25380
3618 1 8 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.818 -1.782 25380
3619 1 8 . 1 1 57 57 LYS H H 57 7.019 7.019 7.822 -0.803 25380
3620 1 8 . 1 1 58 58 GLY N N 58 106.593 106.593 111.711 -5.118 25380
3621 1 8 . 1 1 58 58 GLY C C 58 174.350 174.350 174.666 -0.316 25380
3622 1 8 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.026 0.474 25380
3623 1 8 . 1 1 58 58 GLY H H 58 7.883 7.883 8.764 -0.881 25380
3624 1 8 . 1 1 59 59 HIS N N 59 117.962 117.962 118.164 -0.202 25380
3625 1 8 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.361 0.506 25380
3626 1 8 . 1 1 59 59 HIS C C 59 173.271 173.271 175.457 -2.186 25380
3627 1 8 . 1 1 59 59 HIS CA C 59 54.778 54.778 57.065 -2.287 25380
3628 1 8 . 1 1 59 59 HIS CB C 59 31.685 31.685 30.756 0.929 25380
3629 1 8 . 1 1 59 59 HIS H H 59 8.218 8.218 7.743 0.475 25380
3630 1 8 . 1 1 60 60 THR N N 60 119.624 119.624 113.112 6.512 25380
3631 1 8 . 1 1 60 60 THR HA H 60 4.430 4.430 4.143 0.287 25380
3632 1 8 . 1 1 60 60 THR C C 60 171.430 171.430 174.150 -2.720 25380
3633 1 8 . 1 1 60 60 THR CA C 60 63.480 63.480 62.353 1.127 25380
3634 1 8 . 1 1 60 60 THR CB C 60 69.761 69.761 69.785 -0.024 25380
3635 1 8 . 1 1 60 60 THR H H 60 8.780 8.780 7.756 1.024 25380
3636 1 8 . 1 1 61 61 ALA N N 61 126.706 126.706 128.935 -2.229 25380
3637 1 8 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.470 0.776 25380
3638 1 8 . 1 1 61 61 ALA C C 61 174.753 174.753 176.482 -1.729 25380
3639 1 8 . 1 1 61 61 ALA CA C 61 49.772 49.772 53.397 -3.625 25380
3640 1 8 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.419 2.470 25380
3641 1 8 . 1 1 61 61 ALA H H 61 7.795 7.795 8.850 -1.055 25380
3642 1 8 . 1 1 62 62 TYR N N 62 117.859 117.859 115.691 2.168 25380
3643 1 8 . 1 1 62 62 TYR C C 62 173.431 173.431 172.970 0.461 25380
3644 1 8 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.383 -0.736 25380
3645 1 8 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.249 -1.700 25380
3646 1 8 . 1 1 62 62 TYR H H 62 8.711 8.711 7.849 0.862 25380
3647 1 8 . 1 1 63 63 LEU N N 63 125.044 125.044 125.700 -0.656 25380
3648 1 8 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.921 0.490 25380
3649 1 8 . 1 1 63 63 LEU C C 63 175.319 175.319 173.877 1.442 25380
3650 1 8 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.212 0.018 25380
3651 1 8 . 1 1 63 63 LEU CB C 63 45.701 45.701 45.030 0.671 25380
3652 1 8 . 1 1 63 63 LEU H H 63 8.746 8.746 7.544 1.202 25380
3653 1 8 . 1 1 64 64 ASP N N 64 125.463 125.463 123.621 1.842 25380
3654 1 8 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.896 0.303 25380
3655 1 8 . 1 1 64 64 ASP C C 64 174.512 174.512 174.546 -0.034 25380
3656 1 8 . 1 1 64 64 ASP CA C 64 52.700 52.700 51.977 0.723 25380
3657 1 8 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.733 -0.779 25380
3658 1 8 . 1 1 64 64 ASP H H 64 9.293 9.293 8.923 0.370 25380
3659 1 8 . 1 1 65 65 GLU N N 65 120.711 120.711 119.294 1.417 25380
3660 1 8 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.485 0.582 25380
3661 1 8 . 1 1 65 65 GLU C C 65 175.652 175.652 176.312 -0.660 25380
3662 1 8 . 1 1 65 65 GLU CA C 65 55.643 55.643 56.107 -0.464 25380
3663 1 8 . 1 1 65 65 GLU CB C 65 30.455 30.455 31.281 -0.826 25380
3664 1 8 . 1 1 65 65 GLU H H 65 8.715 8.715 8.555 0.160 25380
3665 1 8 . 1 1 66 66 VAL N N 66 122.936 122.936 117.664 5.272 25380
3666 1 8 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.279 0.151 25380
3667 1 8 . 1 1 66 66 VAL C C 66 175.065 175.065 176.044 -0.979 25380
3668 1 8 . 1 1 66 66 VAL CA C 66 60.991 60.991 60.921 0.070 25380
3669 1 8 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.755 1.525 25380
3670 1 8 . 1 1 66 66 VAL H H 66 9.156 9.156 8.583 0.573 25380
3671 1 8 . 1 1 67 67 ARG N N 67 126.104 126.104 120.680 5.424 25380
3672 1 8 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.169 0.372 25380
3673 1 8 . 1 1 67 67 ARG C C 67 176.708 176.708 177.974 -1.266 25380
3674 1 8 . 1 1 67 67 ARG CA C 67 56.080 56.080 58.978 -2.898 25380
3675 1 8 . 1 1 67 67 ARG CB C 67 30.908 30.908 30.020 0.888 25380
3676 1 8 . 1 1 67 67 ARG H H 67 8.734 8.734 8.690 0.044 25380
3677 1 8 . 1 1 68 68 VAL N N 68 120.707 120.707 113.195 7.512 25380
3678 1 8 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.129 0.023 25380
3679 1 8 . 1 1 68 68 VAL C C 68 175.931 175.931 175.661 0.270 25380
3680 1 8 . 1 1 68 68 VAL CA C 68 62.776 62.776 63.034 -0.258 25380
3681 1 8 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.130 1.359 25380
3682 1 8 . 1 1 68 68 VAL H H 68 8.384 8.384 7.809 0.575 25380
3683 1 8 . 1 1 69 69 SER N N 69 116.156 116.156 116.753 -0.597 25380
3684 1 8 . 1 1 69 69 SER HA H 69 4.693 4.693 4.671 0.022 25380
3685 1 8 . 1 1 69 69 SER C C 69 174.544 174.544 174.383 0.161 25380
3686 1 8 . 1 1 69 69 SER CA C 69 57.754 57.754 58.878 -1.124 25380
3687 1 8 . 1 1 69 69 SER CB C 69 64.831 64.831 61.883 2.948 25380
3688 1 8 . 1 1 69 69 SER H H 69 8.067 8.067 8.418 -0.351 25380
3689 1 8 . 1 1 70 70 THR N N 70 110.753 110.753 113.417 -2.664 25380
3690 1 8 . 1 1 70 70 THR HA H 70 4.152 4.152 4.411 -0.259 25380
3691 1 8 . 1 1 70 70 THR C C 70 174.865 174.865 175.536 -0.671 25380
3692 1 8 . 1 1 70 70 THR CA C 70 63.831 63.831 63.020 0.811 25380
3693 1 8 . 1 1 70 70 THR CB C 70 68.956 68.956 69.889 -0.933 25380
3694 1 8 . 1 1 70 70 THR H H 70 8.095 8.095 7.954 0.141 25380
3695 1 8 . 1 1 71 71 ASP N N 71 121.817 121.817 122.008 -0.191 25380
3696 1 8 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.609 -0.019 25380
3697 1 8 . 1 1 71 71 ASP C C 71 176.746 176.746 177.363 -0.617 25380
3698 1 8 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.659 -2.395 25380
3699 1 8 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.952 0.473 25380
3700 1 8 . 1 1 71 71 ASP H H 71 8.076 8.076 8.356 -0.280 25380
3701 1 8 . 1 1 72 72 GLU N N 72 123.635 123.635 115.645 7.990 25380
3702 1 8 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.572 -0.579 25380
3703 1 8 . 1 1 72 72 GLU C C 72 176.971 176.971 175.378 1.593 25380
3704 1 8 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.193 2.026 25380
3705 1 8 . 1 1 72 72 GLU CB C 72 29.702 29.702 31.945 -2.243 25380
3706 1 8 . 1 1 72 72 GLU H H 72 8.514 8.514 8.128 0.386 25380
3707 1 8 . 1 1 73 73 LYS N N 73 117.857 117.857 116.967 0.890 25380
3708 1 8 . 1 1 73 73 LYS HA H 73 4.643 4.643 4.029 0.614 25380
3709 1 8 . 1 1 73 73 LYS C C 73 176.508 176.508 174.963 1.545 25380
3710 1 8 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.545 -0.465 25380
3711 1 8 . 1 1 73 73 LYS CB C 73 32.203 32.203 30.875 1.328 25380
3712 1 8 . 1 1 73 73 LYS H H 73 8.423 8.423 7.808 0.615 25380
3713 1 8 . 1 1 74 74 ASP N N 74 120.580 120.580 116.217 4.363 25380
3714 1 8 . 1 1 74 74 ASP HA H 74 4.758 4.758 5.025 -0.267 25380
3715 1 8 . 1 1 74 74 ASP C C 74 174.059 174.059 176.352 -2.293 25380
3716 1 8 . 1 1 74 74 ASP CA C 74 53.279 53.279 55.208 -1.929 25380
3717 1 8 . 1 1 74 74 ASP CB C 74 40.578 40.578 42.308 -1.730 25380
3718 1 8 . 1 1 74 74 ASP H H 74 7.918 7.918 7.808 0.110 25380
3719 1 8 . 1 1 75 75 PHE N N 75 118.513 118.513 119.627 -1.114 25380
3720 1 8 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.388 -0.025 25380
3721 1 8 . 1 1 75 75 PHE C C 75 173.038 173.038 175.198 -2.160 25380
3722 1 8 . 1 1 75 75 PHE CA C 75 55.522 55.522 57.310 -1.788 25380
3723 1 8 . 1 1 75 75 PHE CB C 75 41.714 41.714 40.591 1.123 25380
3724 1 8 . 1 1 75 75 PHE H H 75 7.397 7.397 7.648 -0.251 25380
3725 1 8 . 1 1 76 76 LEU N N 76 116.773 116.773 123.875 -7.102 25380
3726 1 8 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.636 0.007 25380
3727 1 8 . 1 1 76 76 LEU C C 76 177.553 177.553 175.869 1.684 25380
3728 1 8 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.648 -1.029 25380
3729 1 8 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.403 2.298 25380
3730 1 8 . 1 1 76 76 LEU H H 76 8.774 8.774 9.264 -0.490 25380
3731 1 8 . 1 1 77 77 TYR N N 77 118.377 118.377 125.325 -6.948 25380
3732 1 8 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.770 0.645 25380
3733 1 8 . 1 1 77 77 TYR C C 77 175.479 175.479 173.305 2.174 25380
3734 1 8 . 1 1 77 77 TYR CA C 77 58.391 58.391 55.768 2.623 25380
3735 1 8 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.103 0.997 25380
3736 1 8 . 1 1 77 77 TYR H H 77 8.589 8.589 9.244 -0.655 25380
3737 1 8 . 1 1 78 78 GLU N N 78 123.875 123.875 129.475 -5.600 25380
3738 1 8 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.908 0.065 25380
3739 1 8 . 1 1 78 78 GLU C C 78 174.120 174.120 173.834 0.286 25380
3740 1 8 . 1 1 78 78 GLU CA C 78 54.378 54.378 53.902 0.476 25380
3741 1 8 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.441 -0.800 25380
3742 1 8 . 1 1 78 78 GLU H H 78 9.576 9.576 8.690 0.886 25380
3743 1 8 . 1 1 79 79 LEU N N 79 128.661 128.661 126.340 2.321 25380
3744 1 8 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.399 0.890 25380
3745 1 8 . 1 1 79 79 LEU C C 79 174.219 174.219 175.389 -1.170 25380
3746 1 8 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.807 -0.658 25380
3747 1 8 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.469 2.161 25380
3748 1 8 . 1 1 79 79 LEU H H 79 9.139 9.139 8.760 0.379 25380
3749 1 8 . 1 1 80 80 HIS N N 80 124.886 124.886 121.510 3.376 25380
3750 1 8 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.833 0.597 25380
3751 1 8 . 1 1 80 80 HIS C C 80 173.346 173.346 176.563 -3.217 25380
3752 1 8 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.812 -1.663 25380
3753 1 8 . 1 1 80 80 HIS CB C 80 30.768 30.768 30.920 -0.152 25380
3754 1 8 . 1 1 80 80 HIS H H 80 8.897 8.897 8.831 0.066 25380
3755 1 8 . 1 1 81 81 ILE N N 81 125.173 125.173 122.310 2.863 25380
3756 1 8 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.485 0.805 25380
3757 1 8 . 1 1 81 81 ILE C C 81 174.600 174.600 175.719 -1.119 25380
3758 1 8 . 1 1 81 81 ILE CA C 81 60.500 60.500 64.180 -3.680 25380
3759 1 8 . 1 1 81 81 ILE CB C 81 39.700 39.700 37.657 2.042 25380
3760 1 8 . 1 1 81 81 ILE H H 81 8.909 8.909 8.668 0.241 25380
3761 1 9 . 1 1 2 2 HIS N N 2 120.430 120.430 121.863 -1.433 25380
3762 1 9 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.777 -0.042 25380
3763 1 9 . 1 1 2 2 HIS C C 2 173.884 173.884 174.507 -0.623 25380
3764 1 9 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.236 -1.185 25380
3765 1 9 . 1 1 2 2 HIS CB C 2 28.666 28.666 30.529 -1.863 25380
3766 1 9 . 1 1 2 2 HIS H H 2 8.678 8.678 8.350 0.328 25380
3767 1 9 . 1 1 3 3 MET N N 3 122.377 122.377 124.130 -1.753 25380
3768 1 9 . 1 1 3 3 MET HA H 3 4.207 4.207 4.623 -0.416 25380
3769 1 9 . 1 1 3 3 MET C C 3 174.584 174.584 175.118 -0.534 25380
3770 1 9 . 1 1 3 3 MET CA C 3 56.550 56.550 55.063 1.487 25380
3771 1 9 . 1 1 3 3 MET CB C 3 33.426 33.426 33.179 0.247 25380
3772 1 9 . 1 1 3 3 MET H H 3 8.240 8.240 8.604 -0.364 25380
3773 1 9 . 1 1 4 4 LYS N N 4 123.568 123.568 116.841 6.727 25380
3774 1 9 . 1 1 4 4 LYS HA H 4 4.839 4.839 3.907 0.932 25380
3775 1 9 . 1 1 4 4 LYS C C 4 175.906 175.906 174.449 1.457 25380
3776 1 9 . 1 1 4 4 LYS CA C 4 54.800 54.800 56.769 -1.969 25380
3777 1 9 . 1 1 4 4 LYS CB C 4 34.900 34.900 30.332 4.568 25380
3778 1 9 . 1 1 4 4 LYS H H 4 8.351 8.351 8.564 -0.213 25380
3779 1 9 . 1 1 5 5 LEU N N 5 123.568 123.568 111.835 11.733 25380
3780 1 9 . 1 1 5 5 LEU HA H 5 4.839 4.839 4.836 0.003 25380
3781 1 9 . 1 1 5 5 LEU C C 5 175.900 175.900 175.185 0.715 25380
3782 1 9 . 1 1 5 5 LEU CA C 5 53.350 53.350 52.496 0.854 25380
3783 1 9 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.350 0.550 25380
3784 1 9 . 1 1 5 5 LEU H H 5 8.281 8.281 7.247 1.034 25380
3785 1 9 . 1 1 6 6 VAL N N 6 121.564 121.564 118.626 2.938 25380
3786 1 9 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.291 0.135 25380
3787 1 9 . 1 1 6 6 VAL C C 6 178.200 178.200 174.639 3.561 25380
3788 1 9 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.704 2.496 25380
3789 1 9 . 1 1 6 6 VAL CB C 6 33.200 33.200 34.901 -1.701 25380
3790 1 9 . 1 1 6 6 VAL H H 6 9.276 9.276 8.264 1.012 25380
3791 1 9 . 1 1 7 7 LEU N N 7 121.564 121.564 125.724 -4.160 25380
3792 1 9 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.292 -0.866 25380
3793 1 9 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.186 10.014 25380
3794 1 9 . 1 1 7 7 LEU CB C 7 33.200 33.200 45.673 -12.473 25380
3795 1 9 . 1 1 7 7 LEU H H 7 9.276 9.276 8.537 0.739 25380
3796 1 9 . 1 1 8 8 ALA C C 8 177.040 177.040 176.838 0.202 25380
3797 1 9 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.110 -0.409 25380
3798 1 9 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.937 0.927 25380
3799 1 9 . 1 1 9 9 LYS N N 9 119.845 119.845 121.290 -1.445 25380
3800 1 9 . 1 1 9 9 LYS HA H 9 4.128 4.128 4.255 -0.127 25380
3801 1 9 . 1 1 9 9 LYS C C 9 176.075 176.075 176.954 -0.879 25380
3802 1 9 . 1 1 9 9 LYS CA C 9 56.761 56.761 57.897 -1.136 25380
3803 1 9 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.215 0.704 25380
3804 1 9 . 1 1 9 9 LYS H H 9 8.545 8.545 8.692 -0.147 25380
3805 1 9 . 1 1 10 10 ASN N N 10 119.279 119.279 119.261 0.018 25380
3806 1 9 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.546 0.099 25380
3807 1 9 . 1 1 10 10 ASN C C 10 175.443 175.443 177.120 -1.677 25380
3808 1 9 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.901 -2.244 25380
3809 1 9 . 1 1 10 10 ASN CB C 10 38.777 38.777 38.286 0.491 25380
3810 1 9 . 1 1 10 10 ASN H H 10 8.592 8.592 8.280 0.312 25380
3811 1 9 . 1 1 11 11 THR N N 11 111.876 111.876 113.184 -1.308 25380
3812 1 9 . 1 1 11 11 THR HA H 11 4.311 4.311 4.402 -0.091 25380
3813 1 9 . 1 1 11 11 THR C C 11 174.666 174.666 175.272 -0.606 25380
3814 1 9 . 1 1 11 11 THR CA C 11 62.044 62.044 64.253 -2.209 25380
3815 1 9 . 1 1 11 11 THR CB C 11 69.895 69.895 69.305 0.590 25380
3816 1 9 . 1 1 11 11 THR H H 11 8.058 8.058 8.193 -0.135 25380
3817 1 9 . 1 1 12 12 ARG N N 12 121.152 121.152 121.284 -0.132 25380
3818 1 9 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.420 -0.158 25380
3819 1 9 . 1 1 12 12 ARG C C 12 176.714 176.714 176.101 0.613 25380
3820 1 9 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.081 0.741 25380
3821 1 9 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.310 -0.608 25380
3822 1 9 . 1 1 12 12 ARG H H 12 8.291 8.291 8.115 0.176 25380
3823 1 9 . 1 1 13 13 LYS N N 13 120.459 120.459 120.133 0.326 25380
3824 1 9 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.100 -0.204 25380
3825 1 9 . 1 1 13 13 LYS C C 13 176.682 176.682 176.233 0.449 25380
3826 1 9 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.171 -0.193 25380
3827 1 9 . 1 1 13 13 LYS CB C 13 32.498 32.498 31.401 1.097 25380
3828 1 9 . 1 1 13 13 LYS H H 13 8.286 8.286 8.489 -0.203 25380
3829 1 9 . 1 1 14 14 SER N N 14 114.568 114.568 115.414 -0.846 25380
3830 1 9 . 1 1 14 14 SER HA H 14 4.371 4.371 4.344 0.027 25380
3831 1 9 . 1 1 14 14 SER C C 14 173.990 173.990 175.268 -1.278 25380
3832 1 9 . 1 1 14 14 SER CA C 14 58.617 58.617 59.023 -0.406 25380
3833 1 9 . 1 1 14 14 SER CB C 14 63.933 63.933 63.741 0.192 25380
3834 1 9 . 1 1 14 14 SER H H 14 7.957 7.957 8.304 -0.347 25380
3835 1 9 . 1 1 15 15 ASP N N 15 121.565 121.565 119.108 2.457 25380
3836 1 9 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.737 -0.136 25380
3837 1 9 . 1 1 15 15 ASP C C 15 175.684 175.684 176.063 -0.379 25380
3838 1 9 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.986 0.163 25380
3839 1 9 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.212 1.017 25380
3840 1 9 . 1 1 15 15 ASP H H 15 8.166 8.166 8.432 -0.266 25380
3841 1 9 . 1 1 16 16 ALA N N 16 124.173 124.173 123.095 1.078 25380
3842 1 9 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.015 0.356 25380
3843 1 9 . 1 1 16 16 ALA C C 16 177.184 177.184 177.615 -0.431 25380
3844 1 9 . 1 1 16 16 ALA CA C 16 52.337 52.337 53.331 -0.994 25380
3845 1 9 . 1 1 16 16 ALA CB C 16 19.359 19.359 19.112 0.247 25380
3846 1 9 . 1 1 16 16 ALA H H 16 8.163 8.163 8.085 0.078 25380
3847 1 9 . 1 1 17 17 LYS N N 17 121.152 121.152 119.051 2.101 25380
3848 1 9 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.142 0.284 25380
3849 1 9 . 1 1 17 17 LYS C C 17 175.488 175.488 176.607 -1.119 25380
3850 1 9 . 1 1 17 17 LYS CA C 17 56.205 56.205 57.325 -1.121 25380
3851 1 9 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.849 1.447 25380
3852 1 9 . 1 1 17 17 LYS H H 17 8.363 8.363 7.762 0.601 25380
3853 1 9 . 1 1 18 18 SER N N 18 116.448 116.448 117.058 -0.610 25380
3854 1 9 . 1 1 18 18 SER HA H 18 5.355 5.355 4.285 1.070 25380
3855 1 9 . 1 1 18 18 SER C C 18 173.887 173.887 175.430 -1.543 25380
3856 1 9 . 1 1 18 18 SER CA C 18 57.248 57.248 59.667 -2.419 25380
3857 1 9 . 1 1 18 18 SER CB C 18 64.962 64.962 61.936 3.026 25380
3858 1 9 . 1 1 18 18 SER H H 18 8.206 8.206 8.992 -0.786 25380
3859 1 9 . 1 1 19 19 VAL N N 19 117.867 117.867 115.167 2.700 25380
3860 1 9 . 1 1 19 19 VAL HA H 19 3.620 3.620 4.105 -0.485 25380
3861 1 9 . 1 1 19 19 VAL C C 19 174.169 174.169 176.947 -2.778 25380
3862 1 9 . 1 1 19 19 VAL CA C 19 59.546 59.546 64.221 -4.675 25380
3863 1 9 . 1 1 19 19 VAL CB C 19 35.902 35.902 32.137 3.765 25380
3864 1 9 . 1 1 19 19 VAL H H 19 9.086 9.086 7.591 1.495 25380
3865 1 9 . 1 1 20 20 GLU N N 20 120.843 120.843 122.200 -1.357 25380
3866 1 9 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.339 0.529 25380
3867 1 9 . 1 1 20 20 GLU C C 20 178.747 178.747 178.540 0.207 25380
3868 1 9 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.465 -4.913 25380
3869 1 9 . 1 1 20 20 GLU CB C 20 31.099 31.099 28.734 2.365 25380
3870 1 9 . 1 1 20 20 GLU H H 20 8.841 8.841 8.886 -0.045 25380
3871 1 9 . 1 1 21 21 LEU N N 21 122.653 122.653 119.501 3.152 25380
3872 1 9 . 1 1 21 21 LEU HA H 21 3.443 3.443 4.187 -0.744 25380
3873 1 9 . 1 1 21 21 LEU C C 21 178.799 178.799 179.038 -0.239 25380
3874 1 9 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.884 0.823 25380
3875 1 9 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.501 -2.930 25380
3876 1 9 . 1 1 21 21 LEU H H 21 8.744 8.744 8.216 0.528 25380
3877 1 9 . 1 1 22 22 GLU N N 22 115.392 115.392 119.619 -4.227 25380
3878 1 9 . 1 1 22 22 GLU HA H 22 3.989 3.989 4.135 -0.146 25380
3879 1 9 . 1 1 22 22 GLU C C 22 179.328 179.328 179.222 0.106 25380
3880 1 9 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.613 0.467 25380
3881 1 9 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.399 -0.566 25380
3882 1 9 . 1 1 22 22 GLU H H 22 8.744 8.744 8.136 0.608 25380
3883 1 9 . 1 1 23 23 ASP N N 23 118.597 118.597 121.065 -2.468 25380
3884 1 9 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.484 0.127 25380
3885 1 9 . 1 1 23 23 ASP C C 23 179.139 179.139 178.843 0.296 25380
3886 1 9 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.288 0.232 25380
3887 1 9 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.523 -0.081 25380
3888 1 9 . 1 1 23 23 ASP H H 23 7.098 7.098 8.618 -1.520 25380
3889 1 9 . 1 1 24 24 LEU N N 24 119.869 119.869 121.651 -1.782 25380
3890 1 9 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.981 -0.047 25380
3891 1 9 . 1 1 24 24 LEU C C 24 179.045 179.045 179.089 -0.044 25380
3892 1 9 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.538 -0.989 25380
3893 1 9 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.772 -0.222 25380
3894 1 9 . 1 1 24 24 LEU H H 24 7.576 7.576 8.675 -1.099 25380
3895 1 9 . 1 1 25 25 TYR N N 25 118.100 118.100 118.858 -0.758 25380
3896 1 9 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.318 1.049 25380
3897 1 9 . 1 1 25 25 TYR C C 25 177.945 177.945 177.684 0.261 25380
3898 1 9 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.390 1.216 25380
3899 1 9 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.195 -0.247 25380
3900 1 9 . 1 1 25 25 TYR H H 25 8.320 8.320 7.763 0.557 25380
3901 1 9 . 1 1 26 26 HIS N N 26 119.440 119.440 116.389 3.051 25380
3902 1 9 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.579 -0.208 25380
3903 1 9 . 1 1 26 26 HIS C C 26 176.559 176.559 177.889 -1.330 25380
3904 1 9 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.779 -0.260 25380
3905 1 9 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.046 -1.918 25380
3906 1 9 . 1 1 26 26 HIS H H 26 8.383 8.383 8.442 -0.059 25380
3907 1 9 . 1 1 27 27 GLU N N 27 119.915 119.915 121.948 -2.033 25380
3908 1 9 . 1 1 27 27 GLU HA H 27 4.258 4.258 3.997 0.261 25380
3909 1 9 . 1 1 27 27 GLU C C 27 179.163 179.163 178.291 0.872 25380
3910 1 9 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.359 0.716 25380
3911 1 9 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.343 0.192 25380
3912 1 9 . 1 1 27 27 GLU H H 27 8.288 8.288 8.916 -0.628 25380
3913 1 9 . 1 1 28 28 PHE N N 28 120.500 120.500 120.144 0.356 25380
3914 1 9 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.242 0.730 25380
3915 1 9 . 1 1 28 28 PHE C C 28 177.386 177.386 176.483 0.903 25380
3916 1 9 . 1 1 28 28 PHE CA C 28 60.401 60.401 61.061 -0.660 25380
3917 1 9 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.080 0.488 25380
3918 1 9 . 1 1 28 28 PHE H H 28 8.568 8.568 7.692 0.876 25380
3919 1 9 . 1 1 29 29 SER N N 29 114.306 114.306 114.259 0.047 25380
3920 1 9 . 1 1 29 29 SER HA H 29 4.288 4.288 4.040 0.248 25380
3921 1 9 . 1 1 29 29 SER C C 29 175.656 175.656 175.989 -0.333 25380
3922 1 9 . 1 1 29 29 SER CA C 29 61.058 61.058 60.394 0.664 25380
3923 1 9 . 1 1 29 29 SER CB C 29 63.555 63.555 63.419 0.136 25380
3924 1 9 . 1 1 29 29 SER H H 29 8.479 8.479 7.750 0.729 25380
3925 1 9 . 1 1 30 30 GLU N N 30 118.322 118.322 119.538 -1.216 25380
3926 1 9 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.157 -0.065 25380
3927 1 9 . 1 1 30 30 GLU C C 30 177.312 177.312 176.624 0.688 25380
3928 1 9 . 1 1 30 30 GLU CA C 30 57.580 57.580 58.087 -0.507 25380
3929 1 9 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.563 -0.986 25380
3930 1 9 . 1 1 30 30 GLU H H 30 8.428 8.428 8.030 0.398 25380
3931 1 9 . 1 1 31 31 ASP N N 31 115.630 115.630 114.476 1.154 25380
3932 1 9 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.748 0.062 25380
3933 1 9 . 1 1 31 31 ASP C C 31 175.723 175.723 173.792 1.931 25380
3934 1 9 . 1 1 31 31 ASP CA C 31 53.974 53.974 53.016 0.959 25380
3935 1 9 . 1 1 31 31 ASP CB C 31 40.818 40.818 42.795 -1.977 25380
3936 1 9 . 1 1 31 31 ASP H H 31 7.303 7.303 8.013 -0.710 25380
3937 1 9 . 1 1 32 32 LYS N N 32 114.357 114.357 119.496 -5.139 25380
3938 1 9 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.466 -0.639 25380
3939 1 9 . 1 1 32 32 LYS C C 32 175.716 175.716 175.861 -0.145 25380
3940 1 9 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.598 0.564 25380
3941 1 9 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.573 -5.192 25380
3942 1 9 . 1 1 32 32 LYS H H 32 7.148 7.148 8.293 -1.145 25380
3943 1 9 . 1 1 33 33 ARG N N 33 120.929 120.929 124.297 -3.368 25380
3944 1 9 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.603 -0.402 25380
3945 1 9 . 1 1 33 33 ARG C C 33 173.982 173.982 174.061 -0.079 25380
3946 1 9 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.489 0.705 25380
3947 1 9 . 1 1 33 33 ARG CB C 33 30.642 30.642 34.238 -3.596 25380
3948 1 9 . 1 1 33 33 ARG H H 33 7.388 7.388 9.054 -1.666 25380
3949 1 9 . 1 1 34 34 SER N N 34 115.867 115.867 114.911 0.956 25380
3950 1 9 . 1 1 34 34 SER HA H 34 5.355 5.355 5.048 0.307 25380
3951 1 9 . 1 1 34 34 SER C C 34 172.754 172.754 172.794 -0.040 25380
3952 1 9 . 1 1 34 34 SER CA C 34 58.236 58.236 57.345 0.891 25380
3953 1 9 . 1 1 34 34 SER CB C 34 65.212 65.212 66.127 -0.915 25380
3954 1 9 . 1 1 34 34 SER H H 34 8.173 8.173 8.411 -0.238 25380
3955 1 9 . 1 1 35 35 ILE N N 35 119.621 119.621 119.080 0.541 25380
3956 1 9 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.625 0.238 25380
3957 1 9 . 1 1 35 35 ILE C C 35 174.069 174.069 174.280 -0.211 25380
3958 1 9 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.642 0.314 25380
3959 1 9 . 1 1 35 35 ILE CB C 35 40.655 40.655 42.187 -1.532 25380
3960 1 9 . 1 1 35 35 ILE H H 35 6.779 6.779 8.698 -1.919 25380
3961 1 9 . 1 1 36 36 PHE N N 36 124.305 124.305 120.599 3.706 25380
3962 1 9 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.734 -1.281 25380
3963 1 9 . 1 1 36 36 PHE C C 36 173.204 173.204 173.779 -0.575 25380
3964 1 9 . 1 1 36 36 PHE CA C 36 56.416 56.416 54.625 1.791 25380
3965 1 9 . 1 1 36 36 PHE CB C 36 44.817 44.817 41.997 2.820 25380
3966 1 9 . 1 1 36 36 PHE H H 36 8.411 8.411 8.508 -0.097 25380
3967 1 9 . 1 1 37 37 TYR N N 37 118.743 118.743 119.575 -0.832 25380
3968 1 9 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.136 0.434 25380
3969 1 9 . 1 1 37 37 TYR C C 37 175.455 175.455 174.628 0.827 25380
3970 1 9 . 1 1 37 37 TYR CA C 37 56.518 56.518 56.707 -0.189 25380
3971 1 9 . 1 1 37 37 TYR CB C 37 40.991 40.991 40.600 0.391 25380
3972 1 9 . 1 1 37 37 TYR H H 37 8.353 8.353 9.501 -1.148 25380
3973 1 9 . 1 1 38 38 PHE N N 38 119.236 119.236 126.915 -7.679 25380
3974 1 9 . 1 1 38 38 PHE HA H 38 5.160 5.160 5.102 0.058 25380
3975 1 9 . 1 1 38 38 PHE C C 38 174.650 174.650 173.586 1.064 25380
3976 1 9 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.877 0.965 25380
3977 1 9 . 1 1 38 38 PHE CB C 38 42.619 42.619 39.632 2.987 25380
3978 1 9 . 1 1 38 38 PHE H H 38 9.756 9.756 9.294 0.462 25380
3979 1 9 . 1 1 39 39 ALA N N 39 122.516 122.516 129.329 -6.813 25380
3980 1 9 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.670 -0.130 25380
3981 1 9 . 1 1 39 39 ALA C C 39 177.042 177.042 174.156 2.886 25380
3982 1 9 . 1 1 39 39 ALA CA C 39 50.843 50.843 48.994 1.849 25380
3983 1 9 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.928 -3.350 25380
3984 1 9 . 1 1 39 39 ALA H H 39 7.738 7.738 8.588 -0.850 25380
3985 1 9 . 1 1 40 40 PRO C C 40 175.411 175.411 177.017 -1.606 25380
3986 1 9 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.549 1.739 25380
3987 1 9 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.557 -1.453 25380
3988 1 9 . 1 1 41 41 THR N N 41 105.878 105.878 116.180 -10.302 25380
3989 1 9 . 1 1 41 41 THR HA H 41 4.190 4.190 3.726 0.464 25380
3990 1 9 . 1 1 41 41 THR C C 41 176.400 176.400 174.728 1.672 25380
3991 1 9 . 1 1 41 41 THR CA C 41 61.937 61.937 64.822 -2.885 25380
3992 1 9 . 1 1 41 41 THR CB C 41 68.331 68.331 68.733 -0.402 25380
3993 1 9 . 1 1 41 41 THR H H 41 6.715 6.715 8.048 -1.333 25380
3994 1 9 . 1 1 42 42 ASN N N 42 118.863 118.863 117.671 1.192 25380
3995 1 9 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.460 0.075 25380
3996 1 9 . 1 1 42 42 ASN C C 42 173.764 173.764 175.542 -1.778 25380
3997 1 9 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.527 -1.351 25380
3998 1 9 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.847 3.868 25380
3999 1 9 . 1 1 42 42 ASN H H 42 7.153 7.153 8.196 -1.043 25380
4000 1 9 . 1 1 43 43 ALA N N 43 126.174 126.174 118.038 8.136 25380
4001 1 9 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.307 0.118 25380
4002 1 9 . 1 1 43 43 ALA C C 43 179.308 179.308 176.388 2.920 25380
4003 1 9 . 1 1 43 43 ALA CA C 43 51.982 51.982 51.759 0.223 25380
4004 1 9 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.965 -1.671 25380
4005 1 9 . 1 1 43 43 ALA H H 43 9.465 9.465 7.831 1.634 25380
4006 1 9 . 1 1 44 44 HIS N N 44 126.251 126.251 116.899 9.352 25380
4007 1 9 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.252 -0.425 25380
4008 1 9 . 1 1 44 44 HIS C C 44 177.407 177.407 174.676 2.731 25380
4009 1 9 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.897 4.128 25380
4010 1 9 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.000 1.630 25380
4011 1 9 . 1 1 44 44 HIS H H 44 9.407 9.407 7.689 1.718 25380
4012 1 9 . 1 1 45 45 LYS N N 45 114.990 114.990 119.113 -4.123 25380
4013 1 9 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.098 -0.215 25380
4014 1 9 . 1 1 45 45 LYS C C 45 178.284 178.284 177.055 1.229 25380
4015 1 9 . 1 1 45 45 LYS CA C 45 59.249 59.249 57.868 1.381 25380
4016 1 9 . 1 1 45 45 LYS CB C 45 31.834 31.834 33.324 -1.490 25380
4017 1 9 . 1 1 45 45 LYS H H 45 8.960 8.960 7.833 1.127 25380
4018 1 9 . 1 1 46 46 ASP N N 46 120.411 120.411 119.839 0.572 25380
4019 1 9 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.326 0.100 25380
4020 1 9 . 1 1 46 46 ASP C C 46 177.773 177.773 178.300 -0.527 25380
4021 1 9 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.551 -0.535 25380
4022 1 9 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.090 -0.193 25380
4023 1 9 . 1 1 46 46 ASP H H 46 6.777 6.777 8.484 -1.707 25380
4024 1 9 . 1 1 47 47 MET N N 47 118.178 118.178 118.669 -0.491 25380
4025 1 9 . 1 1 47 47 MET HA H 47 3.879 3.879 4.099 -0.220 25380
4026 1 9 . 1 1 47 47 MET C C 47 179.499 179.499 177.548 1.951 25380
4027 1 9 . 1 1 47 47 MET CA C 47 56.052 56.052 59.138 -3.086 25380
4028 1 9 . 1 1 47 47 MET CB C 47 29.601 29.601 32.406 -2.805 25380
4029 1 9 . 1 1 47 47 MET H H 47 7.367 7.367 8.060 -0.693 25380
4030 1 9 . 1 1 48 48 LEU N N 48 117.665 117.665 119.027 -1.362 25380
4031 1 9 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.905 -0.058 25380
4032 1 9 . 1 1 48 48 LEU C C 48 179.843 179.843 178.265 1.578 25380
4033 1 9 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.751 -0.171 25380
4034 1 9 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.592 -0.639 25380
4035 1 9 . 1 1 48 48 LEU H H 48 7.672 7.672 7.603 0.069 25380
4036 1 9 . 1 1 49 49 LYS N N 49 119.326 119.326 118.208 1.118 25380
4037 1 9 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.605 0.522 25380
4038 1 9 . 1 1 49 49 LYS C C 49 179.684 179.684 178.191 1.493 25380
4039 1 9 . 1 1 49 49 LYS CA C 49 58.799 58.799 58.820 -0.021 25380
4040 1 9 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.810 -0.357 25380
4041 1 9 . 1 1 49 49 LYS H H 49 7.420 7.420 7.690 -0.270 25380
4042 1 9 . 1 1 50 50 ALA N N 50 122.022 122.022 123.085 -1.063 25380
4043 1 9 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.634 0.409 25380
4044 1 9 . 1 1 50 50 ALA C C 50 178.818 178.818 178.630 0.188 25380
4045 1 9 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.391 0.778 25380
4046 1 9 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.868 -0.568 25380
4047 1 9 . 1 1 50 50 ALA H H 50 7.551 7.551 7.726 -0.175 25380
4048 1 9 . 1 1 51 51 VAL N N 51 118.165 118.165 117.552 0.613 25380
4049 1 9 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.403 0.039 25380
4050 1 9 . 1 1 51 51 VAL C C 51 178.646 178.646 177.933 0.713 25380
4051 1 9 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.180 1.026 25380
4052 1 9 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.790 0.663 25380
4053 1 9 . 1 1 51 51 VAL H H 51 7.226 7.226 7.254 -0.028 25380
4054 1 9 . 1 1 52 52 ASP N N 52 122.298 122.298 120.174 2.124 25380
4055 1 9 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.314 0.057 25380
4056 1 9 . 1 1 52 52 ASP C C 52 177.898 177.898 179.064 -1.166 25380
4057 1 9 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.019 0.552 25380
4058 1 9 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.177 0.209 25380
4059 1 9 . 1 1 52 52 ASP H H 52 8.232 8.232 7.187 1.045 25380
4060 1 9 . 1 1 53 53 PHE N N 53 121.541 121.541 119.895 1.646 25380
4061 1 9 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.196 0.125 25380
4062 1 9 . 1 1 53 53 PHE C C 53 177.224 177.224 178.169 -0.945 25380
4063 1 9 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.724 2.356 25380
4064 1 9 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.793 1.907 25380
4065 1 9 . 1 1 53 53 PHE H H 53 8.240 8.240 7.753 0.487 25380
4066 1 9 . 1 1 54 54 PHE N N 54 115.925 115.925 117.564 -1.639 25380
4067 1 9 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.122 -0.467 25380
4068 1 9 . 1 1 54 54 PHE C C 54 178.269 178.269 177.839 0.430 25380
4069 1 9 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.836 4.364 25380
4070 1 9 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.506 1.072 25380
4071 1 9 . 1 1 54 54 PHE H H 54 7.755 7.755 7.641 0.114 25380
4072 1 9 . 1 1 55 55 LYS N N 55 120.251 120.251 118.852 1.399 25380
4073 1 9 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.071 0.355 25380
4074 1 9 . 1 1 55 55 LYS C C 55 181.484 181.484 178.734 2.750 25380
4075 1 9 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.804 0.825 25380
4076 1 9 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.235 -0.496 25380
4077 1 9 . 1 1 55 55 LYS H H 55 8.213 8.213 7.498 0.715 25380
4078 1 9 . 1 1 56 56 GLU N N 56 120.146 120.146 118.700 1.446 25380
4079 1 9 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.091 -0.098 25380
4080 1 9 . 1 1 56 56 GLU C C 56 178.085 178.085 178.109 -0.024 25380
4081 1 9 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.708 0.080 25380
4082 1 9 . 1 1 56 56 GLU CB C 56 28.596 28.596 29.874 -1.278 25380
4083 1 9 . 1 1 56 56 GLU H H 56 7.850 7.850 7.926 -0.076 25380
4084 1 9 . 1 1 57 57 LYS N N 57 115.940 115.940 117.476 -1.536 25380
4085 1 9 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.065 0.038 25380
4086 1 9 . 1 1 57 57 LYS C C 57 176.225 176.225 177.744 -1.519 25380
4087 1 9 . 1 1 57 57 LYS CA C 57 54.572 54.572 56.504 -1.932 25380
4088 1 9 . 1 1 57 57 LYS CB C 57 32.036 32.036 32.870 -0.834 25380
4089 1 9 . 1 1 57 57 LYS H H 57 7.019 7.019 8.274 -1.255 25380
4090 1 9 . 1 1 58 58 GLY N N 58 106.593 106.593 107.099 -0.506 25380
4091 1 9 . 1 1 58 58 GLY C C 58 174.350 174.350 174.539 -0.189 25380
4092 1 9 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.510 -0.010 25380
4093 1 9 . 1 1 58 58 GLY H H 58 7.883 7.883 8.162 -0.279 25380
4094 1 9 . 1 1 59 59 HIS N N 59 117.962 117.962 116.629 1.333 25380
4095 1 9 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.240 0.627 25380
4096 1 9 . 1 1 59 59 HIS C C 59 173.271 173.271 174.084 -0.813 25380
4097 1 9 . 1 1 59 59 HIS CA C 59 54.778 54.778 54.366 0.412 25380
4098 1 9 . 1 1 59 59 HIS CB C 59 31.685 31.685 30.999 0.686 25380
4099 1 9 . 1 1 59 59 HIS H H 59 8.218 8.218 8.308 -0.090 25380
4100 1 9 . 1 1 60 60 THR N N 60 119.624 119.624 109.294 10.330 25380
4101 1 9 . 1 1 60 60 THR HA H 60 4.430 4.430 4.620 -0.190 25380
4102 1 9 . 1 1 60 60 THR C C 60 171.430 171.430 173.826 -2.396 25380
4103 1 9 . 1 1 60 60 THR CA C 60 63.480 63.480 59.642 3.837 25380
4104 1 9 . 1 1 60 60 THR CB C 60 69.761 69.761 70.876 -1.115 25380
4105 1 9 . 1 1 60 60 THR H H 60 8.780 8.780 7.420 1.360 25380
4106 1 9 . 1 1 61 61 ALA N N 61 126.706 126.706 121.038 5.668 25380
4107 1 9 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.482 0.764 25380
4108 1 9 . 1 1 61 61 ALA C C 61 174.753 174.753 175.911 -1.158 25380
4109 1 9 . 1 1 61 61 ALA CA C 61 49.772 49.772 52.053 -2.281 25380
4110 1 9 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.975 1.914 25380
4111 1 9 . 1 1 61 61 ALA H H 61 7.795 7.795 8.446 -0.651 25380
4112 1 9 . 1 1 62 62 TYR N N 62 117.859 117.859 115.443 2.416 25380
4113 1 9 . 1 1 62 62 TYR C C 62 173.431 173.431 173.397 0.034 25380
4114 1 9 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.318 -0.671 25380
4115 1 9 . 1 1 62 62 TYR CB C 62 40.549 40.549 43.066 -2.517 25380
4116 1 9 . 1 1 62 62 TYR H H 62 8.711 8.711 8.173 0.538 25380
4117 1 9 . 1 1 63 63 LEU N N 63 125.044 125.044 122.975 2.069 25380
4118 1 9 . 1 1 63 63 LEU HA H 63 5.411 5.411 5.088 0.323 25380
4119 1 9 . 1 1 63 63 LEU C C 63 175.319 175.319 175.161 0.158 25380
4120 1 9 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.838 -0.608 25380
4121 1 9 . 1 1 63 63 LEU CB C 63 45.701 45.701 44.916 0.785 25380
4122 1 9 . 1 1 63 63 LEU H H 63 8.746 8.746 8.599 0.147 25380
4123 1 9 . 1 1 64 64 ASP N N 64 125.463 125.463 125.820 -0.357 25380
4124 1 9 . 1 1 64 64 ASP HA H 64 5.199 5.199 5.185 0.014 25380
4125 1 9 . 1 1 64 64 ASP C C 64 174.512 174.512 174.995 -0.483 25380
4126 1 9 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.984 -0.284 25380
4127 1 9 . 1 1 64 64 ASP CB C 64 43.954 43.954 43.865 0.089 25380
4128 1 9 . 1 1 64 64 ASP H H 64 9.293 9.293 9.103 0.190 25380
4129 1 9 . 1 1 65 65 GLU N N 65 120.711 120.711 118.830 1.881 25380
4130 1 9 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.389 0.678 25380
4131 1 9 . 1 1 65 65 GLU C C 65 175.652 175.652 176.137 -0.485 25380
4132 1 9 . 1 1 65 65 GLU CA C 65 55.643 55.643 56.382 -0.739 25380
4133 1 9 . 1 1 65 65 GLU CB C 65 30.455 30.455 30.688 -0.233 25380
4134 1 9 . 1 1 65 65 GLU H H 65 8.715 8.715 8.546 0.169 25380
4135 1 9 . 1 1 66 66 VAL N N 66 122.936 122.936 121.330 1.606 25380
4136 1 9 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.165 0.265 25380
4137 1 9 . 1 1 66 66 VAL C C 66 175.065 175.065 175.252 -0.187 25380
4138 1 9 . 1 1 66 66 VAL CA C 66 60.991 60.991 61.477 -0.486 25380
4139 1 9 . 1 1 66 66 VAL CB C 66 34.280 34.280 33.470 0.810 25380
4140 1 9 . 1 1 66 66 VAL H H 66 9.156 9.156 8.665 0.491 25380
4141 1 9 . 1 1 67 67 ARG N N 67 126.104 126.104 126.915 -0.811 25380
4142 1 9 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.390 0.151 25380
4143 1 9 . 1 1 67 67 ARG C C 67 176.708 176.708 175.705 1.003 25380
4144 1 9 . 1 1 67 67 ARG CA C 67 56.080 56.080 56.382 -0.302 25380
4145 1 9 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.607 1.301 25380
4146 1 9 . 1 1 67 67 ARG H H 67 8.734 8.734 8.683 0.051 25380
4147 1 9 . 1 1 68 68 VAL N N 68 120.707 120.707 117.340 3.367 25380
4148 1 9 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.368 -0.216 25380
4149 1 9 . 1 1 68 68 VAL C C 68 175.931 175.931 176.129 -0.198 25380
4150 1 9 . 1 1 68 68 VAL CA C 68 62.776 62.776 60.595 2.181 25380
4151 1 9 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.766 0.723 25380
4152 1 9 . 1 1 68 68 VAL H H 68 8.384 8.384 7.814 0.570 25380
4153 1 9 . 1 1 69 69 SER N N 69 116.156 116.156 117.077 -0.921 25380
4154 1 9 . 1 1 69 69 SER HA H 69 4.693 4.693 4.402 0.291 25380
4155 1 9 . 1 1 69 69 SER C C 69 174.544 174.544 175.750 -1.206 25380
4156 1 9 . 1 1 69 69 SER CA C 69 57.754 57.754 60.540 -2.786 25380
4157 1 9 . 1 1 69 69 SER CB C 69 64.831 64.831 62.961 1.870 25380
4158 1 9 . 1 1 69 69 SER H H 69 8.067 8.067 8.405 -0.338 25380
4159 1 9 . 1 1 70 70 THR N N 70 110.753 110.753 117.325 -6.572 25380
4160 1 9 . 1 1 70 70 THR HA H 70 4.152 4.152 4.139 0.013 25380
4161 1 9 . 1 1 70 70 THR C C 70 174.865 174.865 175.494 -0.629 25380
4162 1 9 . 1 1 70 70 THR CA C 70 63.831 63.831 65.237 -1.406 25380
4163 1 9 . 1 1 70 70 THR CB C 70 68.956 68.956 68.680 0.276 25380
4164 1 9 . 1 1 70 70 THR H H 70 8.095 8.095 8.188 -0.093 25380
4165 1 9 . 1 1 71 71 ASP N N 71 121.817 121.817 120.859 0.958 25380
4166 1 9 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.589 0.001 25380
4167 1 9 . 1 1 71 71 ASP C C 71 176.746 176.746 177.460 -0.714 25380
4168 1 9 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.564 -2.300 25380
4169 1 9 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.412 1.013 25380
4170 1 9 . 1 1 71 71 ASP H H 71 8.076 8.076 8.582 -0.506 25380
4171 1 9 . 1 1 72 72 GLU N N 72 123.635 123.635 116.643 6.992 25380
4172 1 9 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.621 -0.628 25380
4173 1 9 . 1 1 72 72 GLU C C 72 176.971 176.971 176.292 0.679 25380
4174 1 9 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.188 2.031 25380
4175 1 9 . 1 1 72 72 GLU CB C 72 29.702 29.702 32.338 -2.636 25380
4176 1 9 . 1 1 72 72 GLU H H 72 8.514 8.514 8.255 0.259 25380
4177 1 9 . 1 1 73 73 LYS N N 73 117.857 117.857 117.943 -0.086 25380
4178 1 9 . 1 1 73 73 LYS HA H 73 4.643 4.643 4.025 0.618 25380
4179 1 9 . 1 1 73 73 LYS C C 73 176.508 176.508 175.712 0.796 25380
4180 1 9 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.627 -0.547 25380
4181 1 9 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.517 0.686 25380
4182 1 9 . 1 1 73 73 LYS H H 73 8.423 8.423 7.723 0.700 25380
4183 1 9 . 1 1 74 74 ASP N N 74 120.580 120.580 115.931 4.649 25380
4184 1 9 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.642 0.116 25380
4185 1 9 . 1 1 74 74 ASP C C 74 174.059 174.059 175.895 -1.836 25380
4186 1 9 . 1 1 74 74 ASP CA C 74 53.279 53.279 55.490 -2.211 25380
4187 1 9 . 1 1 74 74 ASP CB C 74 40.578 40.578 40.623 -0.045 25380
4188 1 9 . 1 1 74 74 ASP H H 74 7.918 7.918 8.494 -0.576 25380
4189 1 9 . 1 1 75 75 PHE N N 75 118.513 118.513 118.231 0.282 25380
4190 1 9 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.794 -0.431 25380
4191 1 9 . 1 1 75 75 PHE C C 75 173.038 173.038 175.037 -1.999 25380
4192 1 9 . 1 1 75 75 PHE CA C 75 55.522 55.522 57.119 -1.597 25380
4193 1 9 . 1 1 75 75 PHE CB C 75 41.714 41.714 40.465 1.249 25380
4194 1 9 . 1 1 75 75 PHE H H 75 7.397 7.397 8.049 -0.652 25380
4195 1 9 . 1 1 76 76 LEU N N 76 116.773 116.773 123.588 -6.815 25380
4196 1 9 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.831 -0.188 25380
4197 1 9 . 1 1 76 76 LEU C C 76 177.553 177.553 175.320 2.233 25380
4198 1 9 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.263 -0.644 25380
4199 1 9 . 1 1 76 76 LEU CB C 76 45.701 45.701 44.637 1.064 25380
4200 1 9 . 1 1 76 76 LEU H H 76 8.774 8.774 9.334 -0.560 25380
4201 1 9 . 1 1 77 77 TYR N N 77 118.377 118.377 124.576 -6.199 25380
4202 1 9 . 1 1 77 77 TYR HA H 77 5.415 5.415 5.185 0.230 25380
4203 1 9 . 1 1 77 77 TYR C C 77 175.479 175.479 173.251 2.228 25380
4204 1 9 . 1 1 77 77 TYR CA C 77 58.391 58.391 56.782 1.609 25380
4205 1 9 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.851 0.249 25380
4206 1 9 . 1 1 77 77 TYR H H 77 8.589 8.589 9.323 -0.734 25380
4207 1 9 . 1 1 78 78 GLU N N 78 123.875 123.875 127.927 -4.052 25380
4208 1 9 . 1 1 78 78 GLU HA H 78 4.973 4.973 5.185 -0.212 25380
4209 1 9 . 1 1 78 78 GLU C C 78 174.120 174.120 173.920 0.200 25380
4210 1 9 . 1 1 78 78 GLU CA C 78 54.378 54.378 53.690 0.688 25380
4211 1 9 . 1 1 78 78 GLU CB C 78 32.640 32.640 34.419 -1.779 25380
4212 1 9 . 1 1 78 78 GLU H H 78 9.576 9.576 9.098 0.478 25380
4213 1 9 . 1 1 79 79 LEU N N 79 128.661 128.661 123.295 5.366 25380
4214 1 9 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.604 0.685 25380
4215 1 9 . 1 1 79 79 LEU C C 79 174.219 174.219 174.997 -0.778 25380
4216 1 9 . 1 1 79 79 LEU CA C 79 53.149 53.149 54.147 -0.998 25380
4217 1 9 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.828 1.802 25380
4218 1 9 . 1 1 79 79 LEU H H 79 9.139 9.139 8.683 0.456 25380
4219 1 9 . 1 1 80 80 HIS N N 80 124.886 124.886 122.190 2.696 25380
4220 1 9 . 1 1 80 80 HIS HA H 80 5.430 5.430 5.155 0.275 25380
4221 1 9 . 1 1 80 80 HIS C C 80 173.346 173.346 175.782 -2.436 25380
4222 1 9 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.992 -1.843 25380
4223 1 9 . 1 1 80 80 HIS CB C 80 30.768 30.768 30.696 0.072 25380
4224 1 9 . 1 1 80 80 HIS H H 80 8.897 8.897 8.983 -0.086 25380
4225 1 9 . 1 1 81 81 ILE N N 81 125.173 125.173 121.178 3.995 25380
4226 1 9 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.810 0.480 25380
4227 1 9 . 1 1 81 81 ILE C C 81 174.600 174.600 174.692 -0.092 25380
4228 1 9 . 1 1 81 81 ILE CA C 81 60.500 60.500 62.035 -1.535 25380
4229 1 9 . 1 1 81 81 ILE CB C 81 39.700 39.700 35.567 4.133 25380
4230 1 9 . 1 1 81 81 ILE H H 81 8.909 8.909 8.663 0.246 25380
4231 1 10 . 1 1 2 2 HIS N N 2 120.430 120.430 120.553 -0.123 25380
4232 1 10 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.932 -0.197 25380
4233 1 10 . 1 1 2 2 HIS C C 2 173.884 173.884 174.518 -0.634 25380
4234 1 10 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.286 -1.234 25380
4235 1 10 . 1 1 2 2 HIS CB C 2 28.666 28.666 31.134 -2.468 25380
4236 1 10 . 1 1 2 2 HIS H H 2 8.678 8.678 8.563 0.115 25380
4237 1 10 . 1 1 3 3 MET N N 3 122.377 122.377 122.001 0.376 25380
4238 1 10 . 1 1 3 3 MET HA H 3 4.207 4.207 4.719 -0.512 25380
4239 1 10 . 1 1 3 3 MET C C 3 174.584 174.584 176.426 -1.842 25380
4240 1 10 . 1 1 3 3 MET CA C 3 56.550 56.550 54.873 1.677 25380
4241 1 10 . 1 1 3 3 MET CB C 3 33.426 33.426 32.577 0.849 25380
4242 1 10 . 1 1 3 3 MET H H 3 8.240 8.240 8.609 -0.369 25380
4243 1 10 . 1 1 4 4 LYS N N 4 123.568 123.568 121.369 2.199 25380
4244 1 10 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.424 0.415 25380
4245 1 10 . 1 1 4 4 LYS C C 4 175.906 175.906 174.558 1.348 25380
4246 1 10 . 1 1 4 4 LYS CA C 4 54.800 54.800 56.483 -1.683 25380
4247 1 10 . 1 1 4 4 LYS CB C 4 34.900 34.900 32.614 2.286 25380
4248 1 10 . 1 1 4 4 LYS H H 4 8.351 8.351 8.499 -0.148 25380
4249 1 10 . 1 1 5 5 LEU N N 5 123.568 123.568 118.620 4.948 25380
4250 1 10 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.530 -0.691 25380
4251 1 10 . 1 1 5 5 LEU C C 5 175.900 175.900 176.705 -0.805 25380
4252 1 10 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.527 -0.177 25380
4253 1 10 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.627 0.273 25380
4254 1 10 . 1 1 5 5 LEU H H 5 8.281 8.281 7.407 0.874 25380
4255 1 10 . 1 1 6 6 VAL N N 6 121.564 121.564 121.969 -0.405 25380
4256 1 10 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.417 0.009 25380
4257 1 10 . 1 1 6 6 VAL C C 6 178.200 178.200 174.713 3.487 25380
4258 1 10 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.703 2.497 25380
4259 1 10 . 1 1 6 6 VAL CB C 6 33.200 33.200 34.016 -0.816 25380
4260 1 10 . 1 1 6 6 VAL H H 6 9.276 9.276 9.253 0.023 25380
4261 1 10 . 1 1 7 7 LEU N N 7 121.564 121.564 127.775 -6.211 25380
4262 1 10 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.367 -0.941 25380
4263 1 10 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.154 10.046 25380
4264 1 10 . 1 1 7 7 LEU CB C 7 33.200 33.200 43.953 -10.753 25380
4265 1 10 . 1 1 7 7 LEU H H 7 9.276 9.276 8.494 0.782 25380
4266 1 10 . 1 1 8 8 ALA C C 8 177.040 177.040 178.001 -0.961 25380
4267 1 10 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.165 -0.464 25380
4268 1 10 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.931 0.933 25380
4269 1 10 . 1 1 9 9 LYS N N 9 119.845 119.845 122.548 -2.703 25380
4270 1 10 . 1 1 9 9 LYS HA H 9 4.128 4.128 4.075 0.053 25380
4271 1 10 . 1 1 9 9 LYS C C 9 176.075 176.075 177.803 -1.728 25380
4272 1 10 . 1 1 9 9 LYS CA C 9 56.761 56.761 58.569 -1.808 25380
4273 1 10 . 1 1 9 9 LYS CB C 9 32.919 32.919 31.838 1.081 25380
4274 1 10 . 1 1 9 9 LYS H H 9 8.545 8.545 8.725 -0.180 25380
4275 1 10 . 1 1 10 10 ASN N N 10 119.279 119.279 120.344 -1.065 25380
4276 1 10 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.556 0.089 25380
4277 1 10 . 1 1 10 10 ASN C C 10 175.443 175.443 177.165 -1.722 25380
4278 1 10 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.931 -2.274 25380
4279 1 10 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.863 0.914 25380
4280 1 10 . 1 1 10 10 ASN H H 10 8.592 8.592 9.045 -0.453 25380
4281 1 10 . 1 1 11 11 THR N N 11 111.876 111.876 111.586 0.290 25380
4282 1 10 . 1 1 11 11 THR HA H 11 4.311 4.311 4.212 0.099 25380
4283 1 10 . 1 1 11 11 THR C C 11 174.666 174.666 175.984 -1.318 25380
4284 1 10 . 1 1 11 11 THR CA C 11 62.044 62.044 64.892 -2.848 25380
4285 1 10 . 1 1 11 11 THR CB C 11 69.895 69.895 69.349 0.546 25380
4286 1 10 . 1 1 11 11 THR H H 11 8.058 8.058 7.928 0.130 25380
4287 1 10 . 1 1 12 12 ARG N N 12 121.152 121.152 118.590 2.562 25380
4288 1 10 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.540 -0.278 25380
4289 1 10 . 1 1 12 12 ARG C C 12 176.714 176.714 175.469 1.245 25380
4290 1 10 . 1 1 12 12 ARG CA C 12 56.822 56.822 55.771 1.051 25380
4291 1 10 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.905 -1.203 25380
4292 1 10 . 1 1 12 12 ARG H H 12 8.291 8.291 7.778 0.513 25380
4293 1 10 . 1 1 13 13 LYS N N 13 120.459 120.459 119.722 0.737 25380
4294 1 10 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.013 -0.117 25380
4295 1 10 . 1 1 13 13 LYS C C 13 176.682 176.682 176.388 0.294 25380
4296 1 10 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.324 -0.346 25380
4297 1 10 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.627 1.871 25380
4298 1 10 . 1 1 13 13 LYS H H 13 8.286 8.286 8.465 -0.179 25380
4299 1 10 . 1 1 14 14 SER N N 14 114.568 114.568 114.908 -0.340 25380
4300 1 10 . 1 1 14 14 SER HA H 14 4.371 4.371 4.396 -0.025 25380
4301 1 10 . 1 1 14 14 SER C C 14 173.990 173.990 174.699 -0.709 25380
4302 1 10 . 1 1 14 14 SER CA C 14 58.617 58.617 58.833 -0.216 25380
4303 1 10 . 1 1 14 14 SER CB C 14 63.933 63.933 63.943 -0.010 25380
4304 1 10 . 1 1 14 14 SER H H 14 7.957 7.957 8.227 -0.270 25380
4305 1 10 . 1 1 15 15 ASP N N 15 121.565 121.565 119.667 1.898 25380
4306 1 10 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.786 -0.185 25380
4307 1 10 . 1 1 15 15 ASP C C 15 175.684 175.684 176.584 -0.900 25380
4308 1 10 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.754 0.395 25380
4309 1 10 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.031 1.198 25380
4310 1 10 . 1 1 15 15 ASP H H 15 8.166 8.166 8.389 -0.223 25380
4311 1 10 . 1 1 16 16 ALA N N 16 124.173 124.173 124.035 0.138 25380
4312 1 10 . 1 1 16 16 ALA HA H 16 4.371 4.371 3.990 0.381 25380
4313 1 10 . 1 1 16 16 ALA C C 16 177.184 177.184 178.734 -1.550 25380
4314 1 10 . 1 1 16 16 ALA CA C 16 52.337 52.337 54.846 -2.509 25380
4315 1 10 . 1 1 16 16 ALA CB C 16 19.359 19.359 18.869 0.490 25380
4316 1 10 . 1 1 16 16 ALA H H 16 8.163 8.163 8.455 -0.292 25380
4317 1 10 . 1 1 17 17 LYS N N 17 121.152 121.152 118.995 2.157 25380
4318 1 10 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.220 0.206 25380
4319 1 10 . 1 1 17 17 LYS C C 17 175.488 175.488 179.370 -3.882 25380
4320 1 10 . 1 1 17 17 LYS CA C 17 56.205 56.205 59.179 -2.974 25380
4321 1 10 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.377 1.919 25380
4322 1 10 . 1 1 17 17 LYS H H 17 8.363 8.363 8.363 0.000 25380
4323 1 10 . 1 1 18 18 SER N N 18 116.448 116.448 115.608 0.840 25380
4324 1 10 . 1 1 18 18 SER HA H 18 5.355 5.355 4.232 1.123 25380
4325 1 10 . 1 1 18 18 SER C C 18 173.887 173.887 176.761 -2.874 25380
4326 1 10 . 1 1 18 18 SER CA C 18 57.248 57.248 61.082 -3.834 25380
4327 1 10 . 1 1 18 18 SER CB C 18 64.962 64.962 63.008 1.954 25380
4328 1 10 . 1 1 18 18 SER H H 18 8.206 8.206 8.024 0.182 25380
4329 1 10 . 1 1 19 19 VAL N N 19 117.867 117.867 121.413 -3.546 25380
4330 1 10 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.773 -0.153 25380
4331 1 10 . 1 1 19 19 VAL C C 19 174.169 174.169 177.745 -3.576 25380
4332 1 10 . 1 1 19 19 VAL CA C 19 59.546 59.546 65.373 -5.827 25380
4333 1 10 . 1 1 19 19 VAL CB C 19 35.902 35.902 30.363 5.539 25380
4334 1 10 . 1 1 19 19 VAL H H 19 9.086 9.086 7.591 1.495 25380
4335 1 10 . 1 1 20 20 GLU N N 20 120.843 120.843 120.984 -0.141 25380
4336 1 10 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.233 0.635 25380
4337 1 10 . 1 1 20 20 GLU C C 20 178.747 178.747 178.987 -0.240 25380
4338 1 10 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.499 -4.947 25380
4339 1 10 . 1 1 20 20 GLU CB C 20 31.099 31.099 29.357 1.742 25380
4340 1 10 . 1 1 20 20 GLU H H 20 8.841 8.841 7.957 0.884 25380
4341 1 10 . 1 1 21 21 LEU N N 21 122.653 122.653 118.548 4.105 25380
4342 1 10 . 1 1 21 21 LEU HA H 21 3.443 3.443 4.002 -0.559 25380
4343 1 10 . 1 1 21 21 LEU C C 21 178.799 178.799 179.260 -0.461 25380
4344 1 10 . 1 1 21 21 LEU CA C 21 58.707 58.707 58.157 0.550 25380
4345 1 10 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.712 -3.141 25380
4346 1 10 . 1 1 21 21 LEU H H 21 8.744 8.744 8.332 0.412 25380
4347 1 10 . 1 1 22 22 GLU N N 22 115.392 115.392 119.377 -3.985 25380
4348 1 10 . 1 1 22 22 GLU HA H 22 3.989 3.989 4.073 -0.084 25380
4349 1 10 . 1 1 22 22 GLU C C 22 179.328 179.328 179.295 0.033 25380
4350 1 10 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.578 0.502 25380
4351 1 10 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.338 -0.504 25380
4352 1 10 . 1 1 22 22 GLU H H 22 8.744 8.744 7.689 1.055 25380
4353 1 10 . 1 1 23 23 ASP N N 23 118.597 118.597 121.046 -2.449 25380
4354 1 10 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.514 0.097 25380
4355 1 10 . 1 1 23 23 ASP C C 23 179.139 179.139 178.960 0.179 25380
4356 1 10 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.340 0.179 25380
4357 1 10 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.539 -0.097 25380
4358 1 10 . 1 1 23 23 ASP H H 23 7.098 7.098 8.518 -1.420 25380
4359 1 10 . 1 1 24 24 LEU N N 24 119.869 119.869 120.863 -0.994 25380
4360 1 10 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.857 0.077 25380
4361 1 10 . 1 1 24 24 LEU C C 24 179.045 179.045 178.938 0.107 25380
4362 1 10 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.260 -0.711 25380
4363 1 10 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.722 -0.172 25380
4364 1 10 . 1 1 24 24 LEU H H 24 7.576 7.576 8.527 -0.951 25380
4365 1 10 . 1 1 25 25 TYR N N 25 118.100 118.100 119.047 -0.947 25380
4366 1 10 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.119 1.248 25380
4367 1 10 . 1 1 25 25 TYR C C 25 177.945 177.945 177.689 0.256 25380
4368 1 10 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.383 1.223 25380
4369 1 10 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.275 -0.327 25380
4370 1 10 . 1 1 25 25 TYR H H 25 8.320 8.320 7.506 0.814 25380
4371 1 10 . 1 1 26 26 HIS N N 26 119.440 119.440 118.207 1.233 25380
4372 1 10 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.582 -0.211 25380
4373 1 10 . 1 1 26 26 HIS C C 26 176.559 176.559 177.901 -1.342 25380
4374 1 10 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.407 0.112 25380
4375 1 10 . 1 1 26 26 HIS CB C 26 28.128 28.128 29.931 -1.803 25380
4376 1 10 . 1 1 26 26 HIS H H 26 8.383 8.383 8.895 -0.512 25380
4377 1 10 . 1 1 27 27 GLU N N 27 119.915 119.915 121.697 -1.782 25380
4378 1 10 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.054 0.204 25380
4379 1 10 . 1 1 27 27 GLU C C 27 179.163 179.163 178.397 0.766 25380
4380 1 10 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.417 0.658 25380
4381 1 10 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.678 -0.143 25380
4382 1 10 . 1 1 27 27 GLU H H 27 8.288 8.288 8.773 -0.485 25380
4383 1 10 . 1 1 28 28 PHE N N 28 120.500 120.500 120.410 0.090 25380
4384 1 10 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.297 0.675 25380
4385 1 10 . 1 1 28 28 PHE C C 28 177.386 177.386 177.748 -0.362 25380
4386 1 10 . 1 1 28 28 PHE CA C 28 60.401 60.401 61.213 -0.812 25380
4387 1 10 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.137 0.431 25380
4388 1 10 . 1 1 28 28 PHE H H 28 8.568 8.568 8.078 0.490 25380
4389 1 10 . 1 1 29 29 SER N N 29 114.306 114.306 114.536 -0.230 25380
4390 1 10 . 1 1 29 29 SER HA H 29 4.288 4.288 3.950 0.338 25380
4391 1 10 . 1 1 29 29 SER C C 29 175.656 175.656 176.386 -0.730 25380
4392 1 10 . 1 1 29 29 SER CA C 29 61.058 61.058 60.818 0.240 25380
4393 1 10 . 1 1 29 29 SER CB C 29 63.555 63.555 63.034 0.521 25380
4394 1 10 . 1 1 29 29 SER H H 29 8.479 8.479 7.953 0.526 25380
4395 1 10 . 1 1 30 30 GLU N N 30 118.322 118.322 120.739 -2.417 25380
4396 1 10 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.208 -0.116 25380
4397 1 10 . 1 1 30 30 GLU C C 30 177.312 177.312 176.849 0.463 25380
4398 1 10 . 1 1 30 30 GLU CA C 30 57.580 57.580 58.154 -0.573 25380
4399 1 10 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.589 -1.012 25380
4400 1 10 . 1 1 30 30 GLU H H 30 8.428 8.428 8.037 0.391 25380
4401 1 10 . 1 1 31 31 ASP N N 31 115.630 115.630 117.516 -1.886 25380
4402 1 10 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.930 -0.120 25380
4403 1 10 . 1 1 31 31 ASP C C 31 175.723 175.723 174.120 1.603 25380
4404 1 10 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.894 1.080 25380
4405 1 10 . 1 1 31 31 ASP CB C 31 40.818 40.818 43.601 -2.783 25380
4406 1 10 . 1 1 31 31 ASP H H 31 7.303 7.303 8.264 -0.961 25380
4407 1 10 . 1 1 32 32 LYS N N 32 114.357 114.357 120.900 -6.543 25380
4408 1 10 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.529 -0.702 25380
4409 1 10 . 1 1 32 32 LYS C C 32 175.716 175.716 176.032 -0.316 25380
4410 1 10 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.073 1.089 25380
4411 1 10 . 1 1 32 32 LYS CB C 32 28.381 28.381 32.967 -4.586 25380
4412 1 10 . 1 1 32 32 LYS H H 32 7.148 7.148 8.350 -1.202 25380
4413 1 10 . 1 1 33 33 ARG N N 33 120.929 120.929 125.297 -4.368 25380
4414 1 10 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.595 -0.394 25380
4415 1 10 . 1 1 33 33 ARG C C 33 173.982 173.982 173.735 0.247 25380
4416 1 10 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.805 0.389 25380
4417 1 10 . 1 1 33 33 ARG CB C 33 30.642 30.642 33.617 -2.975 25380
4418 1 10 . 1 1 33 33 ARG H H 33 7.388 7.388 8.663 -1.275 25380
4419 1 10 . 1 1 34 34 SER N N 34 115.867 115.867 116.639 -0.772 25380
4420 1 10 . 1 1 34 34 SER HA H 34 5.355 5.355 4.823 0.532 25380
4421 1 10 . 1 1 34 34 SER C C 34 172.754 172.754 172.999 -0.245 25380
4422 1 10 . 1 1 34 34 SER CA C 34 58.236 58.236 56.770 1.466 25380
4423 1 10 . 1 1 34 34 SER CB C 34 65.212 65.212 66.352 -1.140 25380
4424 1 10 . 1 1 34 34 SER H H 34 8.173 8.173 8.310 -0.137 25380
4425 1 10 . 1 1 35 35 ILE N N 35 119.621 119.621 114.221 5.400 25380
4426 1 10 . 1 1 35 35 ILE HA H 35 4.863 4.863 5.068 -0.205 25380
4427 1 10 . 1 1 35 35 ILE C C 35 174.069 174.069 173.693 0.376 25380
4428 1 10 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.040 0.916 25380
4429 1 10 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.797 -1.142 25380
4430 1 10 . 1 1 35 35 ILE H H 35 6.779 6.779 8.545 -1.766 25380
4431 1 10 . 1 1 36 36 PHE N N 36 124.305 124.305 120.655 3.650 25380
4432 1 10 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.650 -1.197 25380
4433 1 10 . 1 1 36 36 PHE C C 36 173.204 173.204 174.966 -1.762 25380
4434 1 10 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.179 0.237 25380
4435 1 10 . 1 1 36 36 PHE CB C 36 44.817 44.817 41.371 3.446 25380
4436 1 10 . 1 1 36 36 PHE H H 36 8.411 8.411 8.912 -0.501 25380
4437 1 10 . 1 1 37 37 TYR N N 37 118.743 118.743 127.181 -8.438 25380
4438 1 10 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.340 0.230 25380
4439 1 10 . 1 1 37 37 TYR C C 37 175.455 175.455 173.867 1.588 25380
4440 1 10 . 1 1 37 37 TYR CA C 37 56.518 56.518 56.049 0.469 25380
4441 1 10 . 1 1 37 37 TYR CB C 37 40.991 40.991 40.679 0.312 25380
4442 1 10 . 1 1 37 37 TYR H H 37 8.353 8.353 9.562 -1.209 25380
4443 1 10 . 1 1 38 38 PHE N N 38 119.236 119.236 130.688 -11.452 25380
4444 1 10 . 1 1 38 38 PHE HA H 38 5.160 5.160 5.325 -0.165 25380
4445 1 10 . 1 1 38 38 PHE C C 38 174.650 174.650 173.041 1.609 25380
4446 1 10 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.442 1.400 25380
4447 1 10 . 1 1 38 38 PHE CB C 38 42.619 42.619 39.778 2.841 25380
4448 1 10 . 1 1 38 38 PHE H H 38 9.756 9.756 9.034 0.722 25380
4449 1 10 . 1 1 39 39 ALA N N 39 122.516 122.516 129.527 -7.011 25380
4450 1 10 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.649 -0.109 25380
4451 1 10 . 1 1 39 39 ALA C C 39 177.042 177.042 174.003 3.039 25380
4452 1 10 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.290 1.553 25380
4453 1 10 . 1 1 39 39 ALA CB C 39 18.578 18.578 22.128 -3.550 25380
4454 1 10 . 1 1 39 39 ALA H H 39 7.738 7.738 8.658 -0.920 25380
4455 1 10 . 1 1 40 40 PRO C C 40 175.411 175.411 177.569 -2.158 25380
4456 1 10 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.670 1.618 25380
4457 1 10 . 1 1 40 40 PRO CB C 40 31.104 31.104 33.493 -2.389 25380
4458 1 10 . 1 1 41 41 THR N N 41 105.878 105.878 116.504 -10.626 25380
4459 1 10 . 1 1 41 41 THR HA H 41 4.190 4.190 3.900 0.290 25380
4460 1 10 . 1 1 41 41 THR C C 41 176.400 176.400 176.507 -0.107 25380
4461 1 10 . 1 1 41 41 THR CA C 41 61.937 61.937 66.547 -4.610 25380
4462 1 10 . 1 1 41 41 THR CB C 41 68.331 68.331 68.656 -0.325 25380
4463 1 10 . 1 1 41 41 THR H H 41 6.715 6.715 8.354 -1.639 25380
4464 1 10 . 1 1 42 42 ASN N N 42 118.863 118.863 119.303 -0.440 25380
4465 1 10 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.600 -0.065 25380
4466 1 10 . 1 1 42 42 ASN C C 42 173.764 173.764 176.526 -2.762 25380
4467 1 10 . 1 1 42 42 ASN CA C 42 54.176 54.176 54.935 -0.759 25380
4468 1 10 . 1 1 42 42 ASN CB C 42 41.715 41.715 38.215 3.500 25380
4469 1 10 . 1 1 42 42 ASN H H 42 7.153 7.153 8.320 -1.167 25380
4470 1 10 . 1 1 43 43 ALA N N 43 126.174 126.174 119.065 7.109 25380
4471 1 10 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.439 -0.014 25380
4472 1 10 . 1 1 43 43 ALA C C 43 179.308 179.308 176.956 2.352 25380
4473 1 10 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.205 -0.223 25380
4474 1 10 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.525 -1.231 25380
4475 1 10 . 1 1 43 43 ALA H H 43 9.465 9.465 7.712 1.753 25380
4476 1 10 . 1 1 44 44 HIS N N 44 126.251 126.251 116.329 9.922 25380
4477 1 10 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.294 -0.467 25380
4478 1 10 . 1 1 44 44 HIS C C 44 177.407 177.407 174.860 2.547 25380
4479 1 10 . 1 1 44 44 HIS CA C 44 61.025 61.025 57.020 4.005 25380
4480 1 10 . 1 1 44 44 HIS CB C 44 28.630 28.630 28.432 0.198 25380
4481 1 10 . 1 1 44 44 HIS H H 44 9.407 9.407 8.097 1.310 25380
4482 1 10 . 1 1 45 45 LYS N N 45 114.990 114.990 118.749 -3.759 25380
4483 1 10 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.254 -0.371 25380
4484 1 10 . 1 1 45 45 LYS C C 45 178.284 178.284 177.383 0.901 25380
4485 1 10 . 1 1 45 45 LYS CA C 45 59.249 59.249 58.583 0.666 25380
4486 1 10 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.842 -1.008 25380
4487 1 10 . 1 1 45 45 LYS H H 45 8.960 8.960 8.161 0.799 25380
4488 1 10 . 1 1 46 46 ASP N N 46 120.411 120.411 119.603 0.808 25380
4489 1 10 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.441 -0.015 25380
4490 1 10 . 1 1 46 46 ASP C C 46 177.773 177.773 178.040 -0.267 25380
4491 1 10 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.270 -0.254 25380
4492 1 10 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.198 -0.301 25380
4493 1 10 . 1 1 46 46 ASP H H 46 6.777 6.777 8.526 -1.749 25380
4494 1 10 . 1 1 47 47 MET N N 47 118.178 118.178 118.862 -0.684 25380
4495 1 10 . 1 1 47 47 MET HA H 47 3.879 3.879 4.329 -0.450 25380
4496 1 10 . 1 1 47 47 MET C C 47 179.499 179.499 177.786 1.713 25380
4497 1 10 . 1 1 47 47 MET CA C 47 56.052 56.052 58.571 -2.518 25380
4498 1 10 . 1 1 47 47 MET CB C 47 29.601 29.601 32.459 -2.858 25380
4499 1 10 . 1 1 47 47 MET H H 47 7.367 7.367 7.715 -0.348 25380
4500 1 10 . 1 1 48 48 LEU N N 48 117.665 117.665 120.269 -2.604 25380
4501 1 10 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.944 -0.097 25380
4502 1 10 . 1 1 48 48 LEU C C 48 179.843 179.843 178.356 1.487 25380
4503 1 10 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.867 -0.287 25380
4504 1 10 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.640 -0.687 25380
4505 1 10 . 1 1 48 48 LEU H H 48 7.672 7.672 7.473 0.199 25380
4506 1 10 . 1 1 49 49 LYS N N 49 119.326 119.326 118.595 0.731 25380
4507 1 10 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.463 0.664 25380
4508 1 10 . 1 1 49 49 LYS C C 49 179.684 179.684 178.262 1.422 25380
4509 1 10 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.114 -0.315 25380
4510 1 10 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.750 -0.297 25380
4511 1 10 . 1 1 49 49 LYS H H 49 7.420 7.420 7.458 -0.038 25380
4512 1 10 . 1 1 50 50 ALA N N 50 122.022 122.022 122.772 -0.750 25380
4513 1 10 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.389 0.654 25380
4514 1 10 . 1 1 50 50 ALA C C 50 178.818 178.818 178.454 0.364 25380
4515 1 10 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.662 0.507 25380
4516 1 10 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.374 -0.074 25380
4517 1 10 . 1 1 50 50 ALA H H 50 7.551 7.551 7.718 -0.167 25380
4518 1 10 . 1 1 51 51 VAL N N 51 118.165 118.165 117.438 0.727 25380
4519 1 10 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.450 -0.008 25380
4520 1 10 . 1 1 51 51 VAL C C 51 178.646 178.646 178.100 0.546 25380
4521 1 10 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.274 0.932 25380
4522 1 10 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.796 0.657 25380
4523 1 10 . 1 1 51 51 VAL H H 51 7.226 7.226 7.265 -0.039 25380
4524 1 10 . 1 1 52 52 ASP N N 52 122.298 122.298 120.331 1.967 25380
4525 1 10 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.301 0.070 25380
4526 1 10 . 1 1 52 52 ASP C C 52 177.898 177.898 179.029 -1.131 25380
4527 1 10 . 1 1 52 52 ASP CA C 52 57.571 57.571 56.916 0.655 25380
4528 1 10 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.213 0.173 25380
4529 1 10 . 1 1 52 52 ASP H H 52 8.232 8.232 7.253 0.979 25380
4530 1 10 . 1 1 53 53 PHE N N 53 121.541 121.541 120.384 1.157 25380
4531 1 10 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.354 -0.033 25380
4532 1 10 . 1 1 53 53 PHE C C 53 177.224 177.224 178.131 -0.907 25380
4533 1 10 . 1 1 53 53 PHE CA C 53 61.080 61.080 59.062 2.018 25380
4534 1 10 . 1 1 53 53 PHE CB C 53 39.700 39.700 38.004 1.696 25380
4535 1 10 . 1 1 53 53 PHE H H 53 8.240 8.240 8.129 0.111 25380
4536 1 10 . 1 1 54 54 PHE N N 54 115.925 115.925 117.575 -1.650 25380
4537 1 10 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.103 -0.448 25380
4538 1 10 . 1 1 54 54 PHE C C 54 178.269 178.269 178.025 0.244 25380
4539 1 10 . 1 1 54 54 PHE CA C 54 64.200 64.200 60.086 4.114 25380
4540 1 10 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.669 0.909 25380
4541 1 10 . 1 1 54 54 PHE H H 54 7.755 7.755 8.133 -0.378 25380
4542 1 10 . 1 1 55 55 LYS N N 55 120.251 120.251 118.885 1.366 25380
4543 1 10 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.030 0.396 25380
4544 1 10 . 1 1 55 55 LYS C C 55 181.484 181.484 178.842 2.642 25380
4545 1 10 . 1 1 55 55 LYS CA C 55 59.629 59.629 59.146 0.483 25380
4546 1 10 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.059 -0.320 25380
4547 1 10 . 1 1 55 55 LYS H H 55 8.213 8.213 7.458 0.755 25380
4548 1 10 . 1 1 56 56 GLU N N 56 120.146 120.146 118.429 1.717 25380
4549 1 10 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.107 -0.114 25380
4550 1 10 . 1 1 56 56 GLU C C 56 178.085 178.085 178.247 -0.162 25380
4551 1 10 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.620 0.168 25380
4552 1 10 . 1 1 56 56 GLU CB C 56 28.596 28.596 29.812 -1.216 25380
4553 1 10 . 1 1 56 56 GLU H H 56 7.850 7.850 7.664 0.186 25380
4554 1 10 . 1 1 57 57 LYS N N 57 115.940 115.940 117.545 -1.605 25380
4555 1 10 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.132 -0.029 25380
4556 1 10 . 1 1 57 57 LYS C C 57 176.225 176.225 178.025 -1.800 25380
4557 1 10 . 1 1 57 57 LYS CA C 57 54.572 54.572 56.753 -2.181 25380
4558 1 10 . 1 1 57 57 LYS CB C 57 32.036 32.036 32.881 -0.845 25380
4559 1 10 . 1 1 57 57 LYS H H 57 7.019 7.019 8.136 -1.117 25380
4560 1 10 . 1 1 58 58 GLY N N 58 106.593 106.593 107.589 -0.996 25380
4561 1 10 . 1 1 58 58 GLY C C 58 174.350 174.350 174.649 -0.299 25380
4562 1 10 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.756 -0.256 25380
4563 1 10 . 1 1 58 58 GLY H H 58 7.883 7.883 8.029 -0.146 25380
4564 1 10 . 1 1 59 59 HIS N N 59 117.962 117.962 117.047 0.915 25380
4565 1 10 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.221 0.646 25380
4566 1 10 . 1 1 59 59 HIS C C 59 173.271 173.271 175.063 -1.792 25380
4567 1 10 . 1 1 59 59 HIS CA C 59 54.778 54.778 56.406 -1.628 25380
4568 1 10 . 1 1 59 59 HIS CB C 59 31.685 31.685 30.623 1.062 25380
4569 1 10 . 1 1 59 59 HIS H H 59 8.218 8.218 8.094 0.124 25380
4570 1 10 . 1 1 60 60 THR N N 60 119.624 119.624 113.482 6.142 25380
4571 1 10 . 1 1 60 60 THR HA H 60 4.430 4.430 4.105 0.325 25380
4572 1 10 . 1 1 60 60 THR C C 60 171.430 171.430 174.139 -2.709 25380
4573 1 10 . 1 1 60 60 THR CA C 60 63.480 63.480 62.436 1.044 25380
4574 1 10 . 1 1 60 60 THR CB C 60 69.761 69.761 69.790 -0.029 25380
4575 1 10 . 1 1 60 60 THR H H 60 8.780 8.780 7.714 1.066 25380
4576 1 10 . 1 1 61 61 ALA N N 61 126.706 126.706 129.173 -2.467 25380
4577 1 10 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.489 0.757 25380
4578 1 10 . 1 1 61 61 ALA C C 61 174.753 174.753 176.622 -1.869 25380
4579 1 10 . 1 1 61 61 ALA CA C 61 49.772 49.772 53.282 -3.510 25380
4580 1 10 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.438 2.451 25380
4581 1 10 . 1 1 61 61 ALA H H 61 7.795 7.795 8.968 -1.173 25380
4582 1 10 . 1 1 62 62 TYR N N 62 117.859 117.859 116.296 1.563 25380
4583 1 10 . 1 1 62 62 TYR C C 62 173.431 173.431 173.109 0.322 25380
4584 1 10 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.352 -0.705 25380
4585 1 10 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.531 -1.982 25380
4586 1 10 . 1 1 62 62 TYR H H 62 8.711 8.711 7.974 0.737 25380
4587 1 10 . 1 1 63 63 LEU N N 63 125.044 125.044 125.616 -0.572 25380
4588 1 10 . 1 1 63 63 LEU HA H 63 5.411 5.411 5.127 0.284 25380
4589 1 10 . 1 1 63 63 LEU C C 63 175.319 175.319 173.800 1.519 25380
4590 1 10 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.327 -0.097 25380
4591 1 10 . 1 1 63 63 LEU CB C 63 45.701 45.701 45.358 0.343 25380
4592 1 10 . 1 1 63 63 LEU H H 63 8.746 8.746 7.474 1.272 25380
4593 1 10 . 1 1 64 64 ASP N N 64 125.463 125.463 124.167 1.296 25380
4594 1 10 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.947 0.252 25380
4595 1 10 . 1 1 64 64 ASP C C 64 174.512 174.512 174.681 -0.169 25380
4596 1 10 . 1 1 64 64 ASP CA C 64 52.700 52.700 51.806 0.894 25380
4597 1 10 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.772 -0.818 25380
4598 1 10 . 1 1 64 64 ASP H H 64 9.293 9.293 8.871 0.422 25380
4599 1 10 . 1 1 65 65 GLU N N 65 120.711 120.711 119.977 0.734 25380
4600 1 10 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.395 0.672 25380
4601 1 10 . 1 1 65 65 GLU C C 65 175.652 175.652 176.314 -0.662 25380
4602 1 10 . 1 1 65 65 GLU CA C 65 55.643 55.643 57.141 -1.498 25380
4603 1 10 . 1 1 65 65 GLU CB C 65 30.455 30.455 31.188 -0.733 25380
4604 1 10 . 1 1 65 65 GLU H H 65 8.715 8.715 8.613 0.102 25380
4605 1 10 . 1 1 66 66 VAL N N 66 122.936 122.936 121.696 1.240 25380
4606 1 10 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.089 0.341 25380
4607 1 10 . 1 1 66 66 VAL C C 66 175.065 175.065 175.524 -0.459 25380
4608 1 10 . 1 1 66 66 VAL CA C 66 60.991 60.991 62.481 -1.490 25380
4609 1 10 . 1 1 66 66 VAL CB C 66 34.280 34.280 33.115 1.165 25380
4610 1 10 . 1 1 66 66 VAL H H 66 9.156 9.156 8.494 0.662 25380
4611 1 10 . 1 1 67 67 ARG N N 67 126.104 126.104 127.968 -1.864 25380
4612 1 10 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.526 0.015 25380
4613 1 10 . 1 1 67 67 ARG C C 67 176.708 176.708 175.778 0.930 25380
4614 1 10 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.016 1.064 25380
4615 1 10 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.069 1.839 25380
4616 1 10 . 1 1 67 67 ARG H H 67 8.734 8.734 8.682 0.052 25380
4617 1 10 . 1 1 68 68 VAL N N 68 120.707 120.707 116.890 3.817 25380
4618 1 10 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.479 -0.327 25380
4619 1 10 . 1 1 68 68 VAL C C 68 175.931 175.931 176.315 -0.384 25380
4620 1 10 . 1 1 68 68 VAL CA C 68 62.776 62.776 60.509 2.267 25380
4621 1 10 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.850 0.639 25380
4622 1 10 . 1 1 68 68 VAL H H 68 8.384 8.384 7.822 0.562 25380
4623 1 10 . 1 1 69 69 SER N N 69 116.156 116.156 117.482 -1.326 25380
4624 1 10 . 1 1 69 69 SER HA H 69 4.693 4.693 4.336 0.357 25380
4625 1 10 . 1 1 69 69 SER C C 69 174.544 174.544 176.393 -1.849 25380
4626 1 10 . 1 1 69 69 SER CA C 69 57.754 57.754 61.455 -3.701 25380
4627 1 10 . 1 1 69 69 SER CB C 69 64.831 64.831 62.792 2.038 25380
4628 1 10 . 1 1 69 69 SER H H 69 8.067 8.067 8.340 -0.273 25380
4629 1 10 . 1 1 70 70 THR N N 70 110.753 110.753 116.566 -5.813 25380
4630 1 10 . 1 1 70 70 THR HA H 70 4.152 4.152 4.200 -0.048 25380
4631 1 10 . 1 1 70 70 THR C C 70 174.865 174.865 175.378 -0.513 25380
4632 1 10 . 1 1 70 70 THR CA C 70 63.831 63.831 64.954 -1.123 25380
4633 1 10 . 1 1 70 70 THR CB C 70 68.956 68.956 68.532 0.424 25380
4634 1 10 . 1 1 70 70 THR H H 70 8.095 8.095 8.043 0.052 25380
4635 1 10 . 1 1 71 71 ASP N N 71 121.817 121.817 120.520 1.297 25380
4636 1 10 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.574 0.016 25380
4637 1 10 . 1 1 71 71 ASP C C 71 176.746 176.746 176.817 -0.071 25380
4638 1 10 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.097 -1.833 25380
4639 1 10 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.901 0.524 25380
4640 1 10 . 1 1 71 71 ASP H H 71 8.076 8.076 8.368 -0.292 25380
4641 1 10 . 1 1 72 72 GLU N N 72 123.635 123.635 116.298 7.337 25380
4642 1 10 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.460 -0.467 25380
4643 1 10 . 1 1 72 72 GLU C C 72 176.971 176.971 175.792 1.179 25380
4644 1 10 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.187 2.032 25380
4645 1 10 . 1 1 72 72 GLU CB C 72 29.702 29.702 32.082 -2.380 25380
4646 1 10 . 1 1 72 72 GLU H H 72 8.514 8.514 8.285 0.229 25380
4647 1 10 . 1 1 73 73 LYS N N 73 117.857 117.857 119.562 -1.705 25380
4648 1 10 . 1 1 73 73 LYS HA H 73 4.643 4.643 3.960 0.683 25380
4649 1 10 . 1 1 73 73 LYS C C 73 176.508 176.508 174.927 1.581 25380
4650 1 10 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.652 -0.572 25380
4651 1 10 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.221 0.982 25380
4652 1 10 . 1 1 73 73 LYS H H 73 8.423 8.423 8.148 0.275 25380
4653 1 10 . 1 1 74 74 ASP N N 74 120.580 120.580 113.663 6.917 25380
4654 1 10 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.704 0.054 25380
4655 1 10 . 1 1 74 74 ASP C C 74 174.059 174.059 174.746 -0.687 25380
4656 1 10 . 1 1 74 74 ASP CA C 74 53.279 53.279 53.033 0.246 25380
4657 1 10 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.156 -0.578 25380
4658 1 10 . 1 1 74 74 ASP H H 74 7.918 7.918 8.456 -0.538 25380
4659 1 10 . 1 1 75 75 PHE N N 75 118.513 118.513 120.334 -1.821 25380
4660 1 10 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.354 0.009 25380
4661 1 10 . 1 1 75 75 PHE C C 75 173.038 173.038 175.430 -2.392 25380
4662 1 10 . 1 1 75 75 PHE CA C 75 55.522 55.522 56.651 -1.129 25380
4663 1 10 . 1 1 75 75 PHE CB C 75 41.714 41.714 39.533 2.181 25380
4664 1 10 . 1 1 75 75 PHE H H 75 7.397 7.397 7.735 -0.338 25380
4665 1 10 . 1 1 76 76 LEU N N 76 116.773 116.773 124.225 -7.452 25380
4666 1 10 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.660 -0.017 25380
4667 1 10 . 1 1 76 76 LEU C C 76 177.553 177.553 176.264 1.289 25380
4668 1 10 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.644 -1.025 25380
4669 1 10 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.039 2.662 25380
4670 1 10 . 1 1 76 76 LEU H H 76 8.774 8.774 9.215 -0.441 25380
4671 1 10 . 1 1 77 77 TYR N N 77 118.377 118.377 126.168 -7.791 25380
4672 1 10 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.298 1.117 25380
4673 1 10 . 1 1 77 77 TYR C C 77 175.479 175.479 173.377 2.102 25380
4674 1 10 . 1 1 77 77 TYR CA C 77 58.391 58.391 56.569 1.822 25380
4675 1 10 . 1 1 77 77 TYR CB C 77 41.100 41.100 38.861 2.239 25380
4676 1 10 . 1 1 77 77 TYR H H 77 8.589 8.589 9.082 -0.493 25380
4677 1 10 . 1 1 78 78 GLU N N 78 123.875 123.875 129.176 -5.301 25380
4678 1 10 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.905 0.068 25380
4679 1 10 . 1 1 78 78 GLU C C 78 174.120 174.120 174.068 0.052 25380
4680 1 10 . 1 1 78 78 GLU CA C 78 54.378 54.378 54.251 0.127 25380
4681 1 10 . 1 1 78 78 GLU CB C 78 32.640 32.640 32.992 -0.352 25380
4682 1 10 . 1 1 78 78 GLU H H 78 9.576 9.576 8.666 0.910 25380
4683 1 10 . 1 1 79 79 LEU N N 79 128.661 128.661 126.869 1.792 25380
4684 1 10 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.480 0.809 25380
4685 1 10 . 1 1 79 79 LEU C C 79 174.219 174.219 175.619 -1.400 25380
4686 1 10 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.997 -0.848 25380
4687 1 10 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.483 2.147 25380
4688 1 10 . 1 1 79 79 LEU H H 79 9.139 9.139 8.968 0.171 25380
4689 1 10 . 1 1 80 80 HIS N N 80 124.886 124.886 121.928 2.958 25380
4690 1 10 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.902 0.528 25380
4691 1 10 . 1 1 80 80 HIS C C 80 173.346 173.346 175.364 -2.018 25380
4692 1 10 . 1 1 80 80 HIS CA C 80 53.149 53.149 53.621 -0.472 25380
4693 1 10 . 1 1 80 80 HIS CB C 80 30.768 30.768 32.193 -1.425 25380
4694 1 10 . 1 1 80 80 HIS H H 80 8.897 8.897 9.067 -0.170 25380
4695 1 10 . 1 1 81 81 ILE N N 81 125.173 125.173 123.518 1.655 25380
4696 1 10 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.919 0.371 25380
4697 1 10 . 1 1 81 81 ILE C C 81 174.600 174.600 176.001 -1.401 25380
4698 1 10 . 1 1 81 81 ILE CA C 81 60.500 60.500 62.017 -1.517 25380
4699 1 10 . 1 1 81 81 ILE CB C 81 39.700 39.700 35.661 4.039 25380
4700 1 10 . 1 1 81 81 ILE H H 81 8.909 8.909 8.245 0.664 25380
4701 1 11 . 1 1 2 2 HIS N N 2 120.430 120.430 123.976 -3.546 25380
4702 1 11 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.971 -0.236 25380
4703 1 11 . 1 1 2 2 HIS C C 2 173.884 173.884 174.141 -0.257 25380
4704 1 11 . 1 1 2 2 HIS CA C 2 55.052 55.052 55.655 -0.603 25380
4705 1 11 . 1 1 2 2 HIS CB C 2 28.666 28.666 31.814 -3.148 25380
4706 1 11 . 1 1 2 2 HIS H H 2 8.678 8.678 8.527 0.151 25380
4707 1 11 . 1 1 3 3 MET N N 3 122.377 122.377 119.851 2.526 25380
4708 1 11 . 1 1 3 3 MET HA H 3 4.207 4.207 4.701 -0.494 25380
4709 1 11 . 1 1 3 3 MET C C 3 174.584 174.584 176.300 -1.716 25380
4710 1 11 . 1 1 3 3 MET CA C 3 56.550 56.550 56.104 0.446 25380
4711 1 11 . 1 1 3 3 MET CB C 3 33.426 33.426 34.227 -0.801 25380
4712 1 11 . 1 1 3 3 MET H H 3 8.240 8.240 8.529 -0.289 25380
4713 1 11 . 1 1 4 4 LYS N N 4 123.568 123.568 119.115 4.453 25380
4714 1 11 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.426 0.413 25380
4715 1 11 . 1 1 4 4 LYS C C 4 175.906 175.906 175.418 0.488 25380
4716 1 11 . 1 1 4 4 LYS CA C 4 54.800 54.800 56.888 -2.088 25380
4717 1 11 . 1 1 4 4 LYS CB C 4 34.900 34.900 32.895 2.005 25380
4718 1 11 . 1 1 4 4 LYS H H 4 8.351 8.351 8.089 0.262 25380
4719 1 11 . 1 1 5 5 LEU N N 5 123.568 123.568 120.187 3.381 25380
4720 1 11 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.633 -0.794 25380
4721 1 11 . 1 1 5 5 LEU C C 5 175.900 175.900 175.666 0.234 25380
4722 1 11 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.794 -0.444 25380
4723 1 11 . 1 1 5 5 LEU CB C 5 45.900 45.900 44.721 1.179 25380
4724 1 11 . 1 1 5 5 LEU H H 5 8.281 8.281 7.651 0.630 25380
4725 1 11 . 1 1 6 6 VAL N N 6 121.564 121.564 126.546 -4.982 25380
4726 1 11 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.265 0.161 25380
4727 1 11 . 1 1 6 6 VAL C C 6 178.200 178.200 174.761 3.439 25380
4728 1 11 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.669 2.531 25380
4729 1 11 . 1 1 6 6 VAL CB C 6 33.200 33.200 34.047 -0.847 25380
4730 1 11 . 1 1 6 6 VAL H H 6 9.276 9.276 9.314 -0.038 25380
4731 1 11 . 1 1 7 7 LEU N N 7 121.564 121.564 125.879 -4.315 25380
4732 1 11 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.243 -0.817 25380
4733 1 11 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.199 10.001 25380
4734 1 11 . 1 1 7 7 LEU CB C 7 33.200 33.200 44.819 -11.619 25380
4735 1 11 . 1 1 7 7 LEU H H 7 9.276 9.276 8.737 0.539 25380
4736 1 11 . 1 1 8 8 ALA C C 8 177.040 177.040 178.677 -1.637 25380
4737 1 11 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.514 -0.813 25380
4738 1 11 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.949 0.915 25380
4739 1 11 . 1 1 9 9 LYS N N 9 119.845 119.845 124.221 -4.376 25380
4740 1 11 . 1 1 9 9 LYS HA H 9 4.128 4.128 3.951 0.177 25380
4741 1 11 . 1 1 9 9 LYS C C 9 176.075 176.075 178.277 -2.202 25380
4742 1 11 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.060 -2.299 25380
4743 1 11 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.211 0.708 25380
4744 1 11 . 1 1 9 9 LYS H H 9 8.545 8.545 8.932 -0.387 25380
4745 1 11 . 1 1 10 10 ASN N N 10 119.279 119.279 118.422 0.857 25380
4746 1 11 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.545 0.100 25380
4747 1 11 . 1 1 10 10 ASN C C 10 175.443 175.443 177.478 -2.035 25380
4748 1 11 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.987 -2.330 25380
4749 1 11 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.870 0.907 25380
4750 1 11 . 1 1 10 10 ASN H H 10 8.592 8.592 9.116 -0.524 25380
4751 1 11 . 1 1 11 11 THR N N 11 111.876 111.876 114.923 -3.047 25380
4752 1 11 . 1 1 11 11 THR HA H 11 4.311 4.311 4.120 0.191 25380
4753 1 11 . 1 1 11 11 THR C C 11 174.666 174.666 175.826 -1.160 25380
4754 1 11 . 1 1 11 11 THR CA C 11 62.044 62.044 65.170 -3.126 25380
4755 1 11 . 1 1 11 11 THR CB C 11 69.895 69.895 68.862 1.033 25380
4756 1 11 . 1 1 11 11 THR H H 11 8.058 8.058 8.279 -0.221 25380
4757 1 11 . 1 1 12 12 ARG N N 12 121.152 121.152 118.313 2.839 25380
4758 1 11 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.471 -0.209 25380
4759 1 11 . 1 1 12 12 ARG C C 12 176.714 176.714 175.870 0.844 25380
4760 1 11 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.064 0.758 25380
4761 1 11 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.677 -0.975 25380
4762 1 11 . 1 1 12 12 ARG H H 12 8.291 8.291 7.899 0.392 25380
4763 1 11 . 1 1 13 13 LYS N N 13 120.459 120.459 118.743 1.716 25380
4764 1 11 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.064 -0.168 25380
4765 1 11 . 1 1 13 13 LYS C C 13 176.682 176.682 176.578 0.104 25380
4766 1 11 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.620 -0.642 25380
4767 1 11 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.949 1.549 25380
4768 1 11 . 1 1 13 13 LYS H H 13 8.286 8.286 8.389 -0.103 25380
4769 1 11 . 1 1 14 14 SER N N 14 114.568 114.568 113.428 1.140 25380
4770 1 11 . 1 1 14 14 SER HA H 14 4.371 4.371 4.417 -0.046 25380
4771 1 11 . 1 1 14 14 SER C C 14 173.990 173.990 175.012 -1.022 25380
4772 1 11 . 1 1 14 14 SER CA C 14 58.617 58.617 58.718 -0.101 25380
4773 1 11 . 1 1 14 14 SER CB C 14 63.933 63.933 64.014 -0.081 25380
4774 1 11 . 1 1 14 14 SER H H 14 7.957 7.957 8.292 -0.335 25380
4775 1 11 . 1 1 15 15 ASP N N 15 121.565 121.565 119.318 2.247 25380
4776 1 11 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.721 -0.120 25380
4777 1 11 . 1 1 15 15 ASP C C 15 175.684 175.684 175.909 -0.225 25380
4778 1 11 . 1 1 15 15 ASP CA C 15 54.149 54.149 54.423 -0.274 25380
4779 1 11 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.403 0.827 25380
4780 1 11 . 1 1 15 15 ASP H H 15 8.166 8.166 8.540 -0.374 25380
4781 1 11 . 1 1 16 16 ALA N N 16 124.173 124.173 122.886 1.287 25380
4782 1 11 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.356 0.015 25380
4783 1 11 . 1 1 16 16 ALA C C 16 177.184 177.184 177.352 -0.168 25380
4784 1 11 . 1 1 16 16 ALA CA C 16 52.337 52.337 51.965 0.372 25380
4785 1 11 . 1 1 16 16 ALA CB C 16 19.359 19.359 19.150 0.209 25380
4786 1 11 . 1 1 16 16 ALA H H 16 8.163 8.163 8.131 0.032 25380
4787 1 11 . 1 1 17 17 LYS N N 17 121.152 121.152 119.411 1.741 25380
4788 1 11 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.152 0.274 25380
4789 1 11 . 1 1 17 17 LYS C C 17 175.488 175.488 176.763 -1.275 25380
4790 1 11 . 1 1 17 17 LYS CA C 17 56.205 56.205 57.135 -0.930 25380
4791 1 11 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.771 1.525 25380
4792 1 11 . 1 1 17 17 LYS H H 17 8.363 8.363 7.746 0.617 25380
4793 1 11 . 1 1 18 18 SER N N 18 116.448 116.448 115.262 1.186 25380
4794 1 11 . 1 1 18 18 SER HA H 18 5.355 5.355 4.119 1.236 25380
4795 1 11 . 1 1 18 18 SER C C 18 173.887 173.887 175.644 -1.757 25380
4796 1 11 . 1 1 18 18 SER CA C 18 57.248 57.248 59.227 -1.979 25380
4797 1 11 . 1 1 18 18 SER CB C 18 64.962 64.962 61.995 2.967 25380
4798 1 11 . 1 1 18 18 SER H H 18 8.206 8.206 8.794 -0.588 25380
4799 1 11 . 1 1 19 19 VAL N N 19 117.867 117.867 120.315 -2.448 25380
4800 1 11 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.629 -0.009 25380
4801 1 11 . 1 1 19 19 VAL C C 19 174.169 174.169 177.211 -3.042 25380
4802 1 11 . 1 1 19 19 VAL CA C 19 59.546 59.546 66.009 -6.463 25380
4803 1 11 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.660 4.242 25380
4804 1 11 . 1 1 19 19 VAL H H 19 9.086 9.086 7.447 1.639 25380
4805 1 11 . 1 1 20 20 GLU N N 20 120.843 120.843 119.606 1.237 25380
4806 1 11 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.041 0.827 25380
4807 1 11 . 1 1 20 20 GLU C C 20 178.747 178.747 178.261 0.486 25380
4808 1 11 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.511 -4.959 25380
4809 1 11 . 1 1 20 20 GLU CB C 20 31.099 31.099 28.804 2.295 25380
4810 1 11 . 1 1 20 20 GLU H H 20 8.841 8.841 8.563 0.278 25380
4811 1 11 . 1 1 21 21 LEU N N 21 122.653 122.653 119.125 3.528 25380
4812 1 11 . 1 1 21 21 LEU HA H 21 3.443 3.443 3.966 -0.523 25380
4813 1 11 . 1 1 21 21 LEU C C 21 178.799 178.799 178.931 -0.132 25380
4814 1 11 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.958 0.749 25380
4815 1 11 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.625 -3.054 25380
4816 1 11 . 1 1 21 21 LEU H H 21 8.744 8.744 7.520 1.224 25380
4817 1 11 . 1 1 22 22 GLU N N 22 115.392 115.392 119.618 -4.226 25380
4818 1 11 . 1 1 22 22 GLU HA H 22 3.989 3.989 4.051 -0.062 25380
4819 1 11 . 1 1 22 22 GLU C C 22 179.328 179.328 179.064 0.264 25380
4820 1 11 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.718 0.362 25380
4821 1 11 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.541 -0.707 25380
4822 1 11 . 1 1 22 22 GLU H H 22 8.744 8.744 7.531 1.213 25380
4823 1 11 . 1 1 23 23 ASP N N 23 118.597 118.597 120.842 -2.245 25380
4824 1 11 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.443 0.168 25380
4825 1 11 . 1 1 23 23 ASP C C 23 179.139 179.139 178.836 0.303 25380
4826 1 11 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.168 0.351 25380
4827 1 11 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.364 0.078 25380
4828 1 11 . 1 1 23 23 ASP H H 23 7.098 7.098 8.376 -1.278 25380
4829 1 11 . 1 1 24 24 LEU N N 24 119.869 119.869 121.263 -1.394 25380
4830 1 11 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.641 0.293 25380
4831 1 11 . 1 1 24 24 LEU C C 24 179.045 179.045 178.640 0.405 25380
4832 1 11 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.539 -0.990 25380
4833 1 11 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.482 0.068 25380
4834 1 11 . 1 1 24 24 LEU H H 24 7.576 7.576 8.484 -0.908 25380
4835 1 11 . 1 1 25 25 TYR N N 25 118.100 118.100 118.331 -0.231 25380
4836 1 11 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.455 0.912 25380
4837 1 11 . 1 1 25 25 TYR C C 25 177.945 177.945 177.681 0.264 25380
4838 1 11 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.050 1.556 25380
4839 1 11 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.043 -0.095 25380
4840 1 11 . 1 1 25 25 TYR H H 25 8.320 8.320 7.315 1.005 25380
4841 1 11 . 1 1 26 26 HIS N N 26 119.440 119.440 117.237 2.203 25380
4842 1 11 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.518 -0.147 25380
4843 1 11 . 1 1 26 26 HIS C C 26 176.559 176.559 178.000 -1.441 25380
4844 1 11 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.278 0.241 25380
4845 1 11 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.005 -1.877 25380
4846 1 11 . 1 1 26 26 HIS H H 26 8.383 8.383 8.455 -0.072 25380
4847 1 11 . 1 1 27 27 GLU N N 27 119.915 119.915 121.119 -1.204 25380
4848 1 11 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.067 0.191 25380
4849 1 11 . 1 1 27 27 GLU C C 27 179.163 179.163 178.512 0.651 25380
4850 1 11 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.169 0.906 25380
4851 1 11 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.022 0.513 25380
4852 1 11 . 1 1 27 27 GLU H H 27 8.288 8.288 8.938 -0.650 25380
4853 1 11 . 1 1 28 28 PHE N N 28 120.500 120.500 120.186 0.314 25380
4854 1 11 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.116 0.856 25380
4855 1 11 . 1 1 28 28 PHE C C 28 177.386 177.386 176.787 0.599 25380
4856 1 11 . 1 1 28 28 PHE CA C 28 60.401 60.401 61.243 -0.842 25380
4857 1 11 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.185 0.383 25380
4858 1 11 . 1 1 28 28 PHE H H 28 8.568 8.568 7.992 0.576 25380
4859 1 11 . 1 1 29 29 SER N N 29 114.306 114.306 114.068 0.238 25380
4860 1 11 . 1 1 29 29 SER HA H 29 4.288 4.288 4.105 0.183 25380
4861 1 11 . 1 1 29 29 SER C C 29 175.656 175.656 176.517 -0.861 25380
4862 1 11 . 1 1 29 29 SER CA C 29 61.058 61.058 60.212 0.845 25380
4863 1 11 . 1 1 29 29 SER CB C 29 63.555 63.555 63.594 -0.039 25380
4864 1 11 . 1 1 29 29 SER H H 29 8.479 8.479 7.797 0.682 25380
4865 1 11 . 1 1 30 30 GLU N N 30 118.322 118.322 120.755 -2.433 25380
4866 1 11 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.161 -0.069 25380
4867 1 11 . 1 1 30 30 GLU C C 30 177.312 177.312 176.834 0.478 25380
4868 1 11 . 1 1 30 30 GLU CA C 30 57.580 57.580 58.102 -0.522 25380
4869 1 11 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.425 -0.848 25380
4870 1 11 . 1 1 30 30 GLU H H 30 8.428 8.428 8.168 0.260 25380
4871 1 11 . 1 1 31 31 ASP N N 31 115.630 115.630 115.049 0.581 25380
4872 1 11 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.757 0.053 25380
4873 1 11 . 1 1 31 31 ASP C C 31 175.723 175.723 173.816 1.907 25380
4874 1 11 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.687 1.287 25380
4875 1 11 . 1 1 31 31 ASP CB C 31 40.818 40.818 42.769 -1.951 25380
4876 1 11 . 1 1 31 31 ASP H H 31 7.303 7.303 7.983 -0.680 25380
4877 1 11 . 1 1 32 32 LYS N N 32 114.357 114.357 119.368 -5.011 25380
4878 1 11 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.435 -0.608 25380
4879 1 11 . 1 1 32 32 LYS C C 32 175.716 175.716 175.873 -0.157 25380
4880 1 11 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.474 0.688 25380
4881 1 11 . 1 1 32 32 LYS CB C 32 28.381 28.381 34.285 -5.904 25380
4882 1 11 . 1 1 32 32 LYS H H 32 7.148 7.148 8.329 -1.181 25380
4883 1 11 . 1 1 33 33 ARG N N 33 120.929 120.929 125.070 -4.141 25380
4884 1 11 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.649 -0.448 25380
4885 1 11 . 1 1 33 33 ARG C C 33 173.982 173.982 173.525 0.457 25380
4886 1 11 . 1 1 33 33 ARG CA C 33 56.194 56.194 56.285 -0.091 25380
4887 1 11 . 1 1 33 33 ARG CB C 33 30.642 30.642 33.797 -3.155 25380
4888 1 11 . 1 1 33 33 ARG H H 33 7.388 7.388 8.828 -1.440 25380
4889 1 11 . 1 1 34 34 SER N N 34 115.867 115.867 116.434 -0.567 25380
4890 1 11 . 1 1 34 34 SER HA H 34 5.355 5.355 4.666 0.689 25380
4891 1 11 . 1 1 34 34 SER C C 34 172.754 172.754 172.115 0.639 25380
4892 1 11 . 1 1 34 34 SER CA C 34 58.236 58.236 57.621 0.615 25380
4893 1 11 . 1 1 34 34 SER CB C 34 65.212 65.212 64.761 0.451 25380
4894 1 11 . 1 1 34 34 SER H H 34 8.173 8.173 8.486 -0.313 25380
4895 1 11 . 1 1 35 35 ILE N N 35 119.621 119.621 122.570 -2.949 25380
4896 1 11 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.916 -0.053 25380
4897 1 11 . 1 1 35 35 ILE C C 35 174.069 174.069 173.967 0.102 25380
4898 1 11 . 1 1 35 35 ILE CA C 35 59.956 59.956 60.087 -0.130 25380
4899 1 11 . 1 1 35 35 ILE CB C 35 40.655 40.655 42.886 -2.231 25380
4900 1 11 . 1 1 35 35 ILE H H 35 6.779 6.779 8.559 -1.780 25380
4901 1 11 . 1 1 36 36 PHE N N 36 124.305 124.305 121.618 2.687 25380
4902 1 11 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.988 -1.535 25380
4903 1 11 . 1 1 36 36 PHE C C 36 173.204 173.204 174.871 -1.667 25380
4904 1 11 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.159 0.257 25380
4905 1 11 . 1 1 36 36 PHE CB C 36 44.817 44.817 42.942 1.875 25380
4906 1 11 . 1 1 36 36 PHE H H 36 8.411 8.411 9.156 -0.745 25380
4907 1 11 . 1 1 37 37 TYR N N 37 118.743 118.743 125.217 -6.474 25380
4908 1 11 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.231 0.339 25380
4909 1 11 . 1 1 37 37 TYR C C 37 175.455 175.455 173.636 1.819 25380
4910 1 11 . 1 1 37 37 TYR CA C 37 56.518 56.518 55.096 1.423 25380
4911 1 11 . 1 1 37 37 TYR CB C 37 40.991 40.991 41.440 -0.449 25380
4912 1 11 . 1 1 37 37 TYR H H 37 8.353 8.353 9.621 -1.268 25380
4913 1 11 . 1 1 38 38 PHE N N 38 119.236 119.236 130.502 -11.266 25380
4914 1 11 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.479 0.681 25380
4915 1 11 . 1 1 38 38 PHE C C 38 174.650 174.650 172.662 1.988 25380
4916 1 11 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.230 1.612 25380
4917 1 11 . 1 1 38 38 PHE CB C 38 42.619 42.619 39.523 3.096 25380
4918 1 11 . 1 1 38 38 PHE H H 38 9.756 9.756 8.972 0.784 25380
4919 1 11 . 1 1 39 39 ALA N N 39 122.516 122.516 128.870 -6.354 25380
4920 1 11 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.466 0.074 25380
4921 1 11 . 1 1 39 39 ALA C C 39 177.042 177.042 173.835 3.207 25380
4922 1 11 . 1 1 39 39 ALA CA C 39 50.843 50.843 48.593 2.250 25380
4923 1 11 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.574 -2.996 25380
4924 1 11 . 1 1 39 39 ALA H H 39 7.738 7.738 8.129 -0.391 25380
4925 1 11 . 1 1 40 40 PRO C C 40 175.411 175.411 177.035 -1.624 25380
4926 1 11 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.136 2.151 25380
4927 1 11 . 1 1 40 40 PRO CB C 40 31.104 31.104 33.206 -2.102 25380
4928 1 11 . 1 1 41 41 THR N N 41 105.878 105.878 116.757 -10.879 25380
4929 1 11 . 1 1 41 41 THR HA H 41 4.190 4.190 3.788 0.402 25380
4930 1 11 . 1 1 41 41 THR C C 41 176.400 176.400 174.787 1.613 25380
4931 1 11 . 1 1 41 41 THR CA C 41 61.937 61.937 65.561 -3.624 25380
4932 1 11 . 1 1 41 41 THR CB C 41 68.331 68.331 68.747 -0.416 25380
4933 1 11 . 1 1 41 41 THR H H 41 6.715 6.715 8.286 -1.571 25380
4934 1 11 . 1 1 42 42 ASN N N 42 118.863 118.863 117.922 0.941 25380
4935 1 11 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.463 0.072 25380
4936 1 11 . 1 1 42 42 ASN C C 42 173.764 173.764 175.784 -2.020 25380
4937 1 11 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.206 -1.030 25380
4938 1 11 . 1 1 42 42 ASN CB C 42 41.715 41.715 38.020 3.695 25380
4939 1 11 . 1 1 42 42 ASN H H 42 7.153 7.153 8.275 -1.122 25380
4940 1 11 . 1 1 43 43 ALA N N 43 126.174 126.174 118.949 7.225 25380
4941 1 11 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.364 0.061 25380
4942 1 11 . 1 1 43 43 ALA C C 43 179.308 179.308 176.752 2.556 25380
4943 1 11 . 1 1 43 43 ALA CA C 43 51.982 51.982 51.709 0.273 25380
4944 1 11 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.792 -1.498 25380
4945 1 11 . 1 1 43 43 ALA H H 43 9.465 9.465 7.787 1.678 25380
4946 1 11 . 1 1 44 44 HIS N N 44 126.251 126.251 116.919 9.332 25380
4947 1 11 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.273 -0.446 25380
4948 1 11 . 1 1 44 44 HIS C C 44 177.407 177.407 174.701 2.706 25380
4949 1 11 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.794 4.231 25380
4950 1 11 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.016 1.614 25380
4951 1 11 . 1 1 44 44 HIS H H 44 9.407 9.407 7.639 1.768 25380
4952 1 11 . 1 1 45 45 LYS N N 45 114.990 114.990 119.247 -4.257 25380
4953 1 11 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.146 -0.263 25380
4954 1 11 . 1 1 45 45 LYS C C 45 178.284 178.284 177.099 1.185 25380
4955 1 11 . 1 1 45 45 LYS CA C 45 59.249 59.249 57.631 1.618 25380
4956 1 11 . 1 1 45 45 LYS CB C 45 31.834 31.834 33.189 -1.355 25380
4957 1 11 . 1 1 45 45 LYS H H 45 8.960 8.960 7.863 1.097 25380
4958 1 11 . 1 1 46 46 ASP N N 46 120.411 120.411 119.670 0.741 25380
4959 1 11 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.430 -0.004 25380
4960 1 11 . 1 1 46 46 ASP C C 46 177.773 177.773 178.254 -0.481 25380
4961 1 11 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.662 -0.646 25380
4962 1 11 . 1 1 46 46 ASP CB C 46 39.897 39.897 39.863 0.034 25380
4963 1 11 . 1 1 46 46 ASP H H 46 6.777 6.777 8.314 -1.537 25380
4964 1 11 . 1 1 47 47 MET N N 47 118.178 118.178 118.799 -0.621 25380
4965 1 11 . 1 1 47 47 MET HA H 47 3.879 3.879 4.239 -0.360 25380
4966 1 11 . 1 1 47 47 MET C C 47 179.499 179.499 177.567 1.932 25380
4967 1 11 . 1 1 47 47 MET CA C 47 56.052 56.052 59.266 -3.214 25380
4968 1 11 . 1 1 47 47 MET CB C 47 29.601 29.601 32.647 -3.046 25380
4969 1 11 . 1 1 47 47 MET H H 47 7.367 7.367 7.992 -0.625 25380
4970 1 11 . 1 1 48 48 LEU N N 48 117.665 117.665 119.498 -1.833 25380
4971 1 11 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.927 -0.080 25380
4972 1 11 . 1 1 48 48 LEU C C 48 179.843 179.843 178.228 1.615 25380
4973 1 11 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.838 -0.258 25380
4974 1 11 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.478 -0.525 25380
4975 1 11 . 1 1 48 48 LEU H H 48 7.672 7.672 7.672 0.000 25380
4976 1 11 . 1 1 49 49 LYS N N 49 119.326 119.326 118.692 0.634 25380
4977 1 11 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.466 0.661 25380
4978 1 11 . 1 1 49 49 LYS C C 49 179.684 179.684 178.239 1.445 25380
4979 1 11 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.201 -0.402 25380
4980 1 11 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.628 -0.175 25380
4981 1 11 . 1 1 49 49 LYS H H 49 7.420 7.420 7.798 -0.378 25380
4982 1 11 . 1 1 50 50 ALA N N 50 122.022 122.022 122.573 -0.551 25380
4983 1 11 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.497 0.546 25380
4984 1 11 . 1 1 50 50 ALA C C 50 178.818 178.818 179.163 -0.345 25380
4985 1 11 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.745 0.424 25380
4986 1 11 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.777 -0.477 25380
4987 1 11 . 1 1 50 50 ALA H H 50 7.551 7.551 7.867 -0.316 25380
4988 1 11 . 1 1 51 51 VAL N N 51 118.165 118.165 117.731 0.434 25380
4989 1 11 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.593 -0.151 25380
4990 1 11 . 1 1 51 51 VAL C C 51 178.646 178.646 178.038 0.608 25380
4991 1 11 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.451 0.755 25380
4992 1 11 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.908 0.545 25380
4993 1 11 . 1 1 51 51 VAL H H 51 7.226 7.226 7.756 -0.530 25380
4994 1 11 . 1 1 52 52 ASP N N 52 122.298 122.298 120.439 1.859 25380
4995 1 11 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.384 -0.013 25380
4996 1 11 . 1 1 52 52 ASP C C 52 177.898 177.898 179.215 -1.317 25380
4997 1 11 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.049 0.522 25380
4998 1 11 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.343 0.043 25380
4999 1 11 . 1 1 52 52 ASP H H 52 8.232 8.232 7.423 0.809 25380
5000 1 11 . 1 1 53 53 PHE N N 53 121.541 121.541 120.092 1.449 25380
5001 1 11 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.221 0.100 25380
5002 1 11 . 1 1 53 53 PHE C C 53 177.224 177.224 178.011 -0.787 25380
5003 1 11 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.881 2.199 25380
5004 1 11 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.877 1.823 25380
5005 1 11 . 1 1 53 53 PHE H H 53 8.240 8.240 8.176 0.064 25380
5006 1 11 . 1 1 54 54 PHE N N 54 115.925 115.925 116.718 -0.793 25380
5007 1 11 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.190 -0.535 25380
5008 1 11 . 1 1 54 54 PHE C C 54 178.269 178.269 177.687 0.582 25380
5009 1 11 . 1 1 54 54 PHE CA C 54 64.200 64.200 60.289 3.910 25380
5010 1 11 . 1 1 54 54 PHE CB C 54 38.578 38.578 38.001 0.577 25380
5011 1 11 . 1 1 54 54 PHE H H 54 7.755 7.755 8.134 -0.379 25380
5012 1 11 . 1 1 55 55 LYS N N 55 120.251 120.251 118.129 2.122 25380
5013 1 11 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.100 0.326 25380
5014 1 11 . 1 1 55 55 LYS C C 55 181.484 181.484 178.069 3.415 25380
5015 1 11 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.428 1.201 25380
5016 1 11 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.504 -0.765 25380
5017 1 11 . 1 1 55 55 LYS H H 55 8.213 8.213 7.647 0.566 25380
5018 1 11 . 1 1 56 56 GLU N N 56 120.146 120.146 118.033 2.113 25380
5019 1 11 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.105 -0.112 25380
5020 1 11 . 1 1 56 56 GLU C C 56 178.085 178.085 177.378 0.707 25380
5021 1 11 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.569 0.219 25380
5022 1 11 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.121 -1.525 25380
5023 1 11 . 1 1 56 56 GLU H H 56 7.850 7.850 7.843 0.007 25380
5024 1 11 . 1 1 57 57 LYS N N 57 115.940 115.940 118.880 -2.940 25380
5025 1 11 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.454 -0.351 25380
5026 1 11 . 1 1 57 57 LYS C C 57 176.225 176.225 177.255 -1.030 25380
5027 1 11 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.034 -0.462 25380
5028 1 11 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.770 -1.734 25380
5029 1 11 . 1 1 57 57 LYS H H 57 7.019 7.019 7.981 -0.962 25380
5030 1 11 . 1 1 58 58 GLY N N 58 106.593 106.593 109.668 -3.075 25380
5031 1 11 . 1 1 58 58 GLY C C 58 174.350 174.350 174.893 -0.543 25380
5032 1 11 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.926 -0.426 25380
5033 1 11 . 1 1 58 58 GLY H H 58 7.883 7.883 8.538 -0.655 25380
5034 1 11 . 1 1 59 59 HIS N N 59 117.962 117.962 117.664 0.298 25380
5035 1 11 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.202 0.665 25380
5036 1 11 . 1 1 59 59 HIS C C 59 173.271 173.271 175.838 -2.567 25380
5037 1 11 . 1 1 59 59 HIS CA C 59 54.778 54.778 58.036 -3.258 25380
5038 1 11 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.647 2.038 25380
5039 1 11 . 1 1 59 59 HIS H H 59 8.218 8.218 7.881 0.337 25380
5040 1 11 . 1 1 60 60 THR N N 60 119.624 119.624 110.937 8.687 25380
5041 1 11 . 1 1 60 60 THR HA H 60 4.430 4.430 3.889 0.541 25380
5042 1 11 . 1 1 60 60 THR C C 60 171.430 171.430 173.729 -2.299 25380
5043 1 11 . 1 1 60 60 THR CA C 60 63.480 63.480 62.515 0.965 25380
5044 1 11 . 1 1 60 60 THR CB C 60 69.761 69.761 69.484 0.277 25380
5045 1 11 . 1 1 60 60 THR H H 60 8.780 8.780 7.864 0.916 25380
5046 1 11 . 1 1 61 61 ALA N N 61 126.706 126.706 126.954 -0.248 25380
5047 1 11 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.271 0.975 25380
5048 1 11 . 1 1 61 61 ALA C C 61 174.753 174.753 176.974 -2.221 25380
5049 1 11 . 1 1 61 61 ALA CA C 61 49.772 49.772 53.002 -3.230 25380
5050 1 11 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.751 2.138 25380
5051 1 11 . 1 1 61 61 ALA H H 61 7.795 7.795 8.381 -0.586 25380
5052 1 11 . 1 1 62 62 TYR N N 62 117.859 117.859 116.120 1.739 25380
5053 1 11 . 1 1 62 62 TYR C C 62 173.431 173.431 173.445 -0.014 25380
5054 1 11 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.155 -0.508 25380
5055 1 11 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.523 -1.974 25380
5056 1 11 . 1 1 62 62 TYR H H 62 8.711 8.711 7.696 1.015 25380
5057 1 11 . 1 1 63 63 LEU N N 63 125.044 125.044 123.044 2.000 25380
5058 1 11 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.821 0.590 25380
5059 1 11 . 1 1 63 63 LEU C C 63 175.319 175.319 174.938 0.381 25380
5060 1 11 . 1 1 63 63 LEU CA C 63 53.230 53.230 54.140 -0.910 25380
5061 1 11 . 1 1 63 63 LEU CB C 63 45.701 45.701 44.741 0.960 25380
5062 1 11 . 1 1 63 63 LEU H H 63 8.746 8.746 8.410 0.336 25380
5063 1 11 . 1 1 64 64 ASP N N 64 125.463 125.463 125.041 0.422 25380
5064 1 11 . 1 1 64 64 ASP HA H 64 5.199 5.199 5.087 0.112 25380
5065 1 11 . 1 1 64 64 ASP C C 64 174.512 174.512 174.562 -0.050 25380
5066 1 11 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.620 0.080 25380
5067 1 11 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.665 -0.711 25380
5068 1 11 . 1 1 64 64 ASP H H 64 9.293 9.293 9.033 0.260 25380
5069 1 11 . 1 1 65 65 GLU N N 65 120.711 120.711 119.821 0.890 25380
5070 1 11 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.339 0.728 25380
5071 1 11 . 1 1 65 65 GLU C C 65 175.652 175.652 175.962 -0.310 25380
5072 1 11 . 1 1 65 65 GLU CA C 65 55.643 55.643 56.642 -0.999 25380
5073 1 11 . 1 1 65 65 GLU CB C 65 30.455 30.455 30.551 -0.096 25380
5074 1 11 . 1 1 65 65 GLU H H 65 8.715 8.715 8.564 0.151 25380
5075 1 11 . 1 1 66 66 VAL N N 66 122.936 122.936 121.363 1.573 25380
5076 1 11 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.270 0.160 25380
5077 1 11 . 1 1 66 66 VAL C C 66 175.065 175.065 175.472 -0.407 25380
5078 1 11 . 1 1 66 66 VAL CA C 66 60.991 60.991 61.151 -0.160 25380
5079 1 11 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.922 1.358 25380
5080 1 11 . 1 1 66 66 VAL H H 66 9.156 9.156 8.517 0.639 25380
5081 1 11 . 1 1 67 67 ARG N N 67 126.104 126.104 126.746 -0.642 25380
5082 1 11 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.416 0.125 25380
5083 1 11 . 1 1 67 67 ARG C C 67 176.708 176.708 175.757 0.951 25380
5084 1 11 . 1 1 67 67 ARG CA C 67 56.080 56.080 56.407 -0.327 25380
5085 1 11 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.565 1.343 25380
5086 1 11 . 1 1 67 67 ARG H H 67 8.734 8.734 8.725 0.009 25380
5087 1 11 . 1 1 68 68 VAL N N 68 120.707 120.707 116.377 4.330 25380
5088 1 11 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.489 -0.337 25380
5089 1 11 . 1 1 68 68 VAL C C 68 175.931 175.931 176.254 -0.323 25380
5090 1 11 . 1 1 68 68 VAL CA C 68 62.776 62.776 60.511 2.265 25380
5091 1 11 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.165 1.324 25380
5092 1 11 . 1 1 68 68 VAL H H 68 8.384 8.384 7.806 0.578 25380
5093 1 11 . 1 1 69 69 SER N N 69 116.156 116.156 118.371 -2.215 25380
5094 1 11 . 1 1 69 69 SER HA H 69 4.693 4.693 4.401 0.292 25380
5095 1 11 . 1 1 69 69 SER C C 69 174.544 174.544 175.943 -1.399 25380
5096 1 11 . 1 1 69 69 SER CA C 69 57.754 57.754 60.852 -3.098 25380
5097 1 11 . 1 1 69 69 SER CB C 69 64.831 64.831 62.669 2.163 25380
5098 1 11 . 1 1 69 69 SER H H 69 8.067 8.067 8.061 0.006 25380
5099 1 11 . 1 1 70 70 THR N N 70 110.753 110.753 112.381 -1.628 25380
5100 1 11 . 1 1 70 70 THR HA H 70 4.152 4.152 4.142 0.010 25380
5101 1 11 . 1 1 70 70 THR C C 70 174.865 174.865 175.457 -0.592 25380
5102 1 11 . 1 1 70 70 THR CA C 70 63.831 63.831 64.722 -0.891 25380
5103 1 11 . 1 1 70 70 THR CB C 70 68.956 68.956 68.677 0.279 25380
5104 1 11 . 1 1 70 70 THR H H 70 8.095 8.095 8.032 0.063 25380
5105 1 11 . 1 1 71 71 ASP N N 71 121.817 121.817 120.895 0.922 25380
5106 1 11 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.610 -0.020 25380
5107 1 11 . 1 1 71 71 ASP C C 71 176.746 176.746 176.742 0.004 25380
5108 1 11 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.132 -1.868 25380
5109 1 11 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.687 0.738 25380
5110 1 11 . 1 1 71 71 ASP H H 71 8.076 8.076 8.212 -0.136 25380
5111 1 11 . 1 1 72 72 GLU N N 72 123.635 123.635 117.157 6.478 25380
5112 1 11 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.545 -0.552 25380
5113 1 11 . 1 1 72 72 GLU C C 72 176.971 176.971 175.698 1.273 25380
5114 1 11 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.701 1.518 25380
5115 1 11 . 1 1 72 72 GLU CB C 72 29.702 29.702 32.105 -2.402 25380
5116 1 11 . 1 1 72 72 GLU H H 72 8.514 8.514 8.363 0.151 25380
5117 1 11 . 1 1 73 73 LYS N N 73 117.857 117.857 118.967 -1.110 25380
5118 1 11 . 1 1 73 73 LYS HA H 73 4.643 4.643 4.023 0.620 25380
5119 1 11 . 1 1 73 73 LYS C C 73 176.508 176.508 174.470 2.038 25380
5120 1 11 . 1 1 73 73 LYS CA C 73 57.080 57.080 56.918 0.162 25380
5121 1 11 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.617 0.586 25380
5122 1 11 . 1 1 73 73 LYS H H 73 8.423 8.423 7.745 0.678 25380
5123 1 11 . 1 1 74 74 ASP N N 74 120.580 120.580 114.704 5.876 25380
5124 1 11 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.812 -0.054 25380
5125 1 11 . 1 1 74 74 ASP C C 74 174.059 174.059 175.391 -1.332 25380
5126 1 11 . 1 1 74 74 ASP CA C 74 53.279 53.279 54.470 -1.191 25380
5127 1 11 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.749 -1.171 25380
5128 1 11 . 1 1 74 74 ASP H H 74 7.918 7.918 8.501 -0.583 25380
5129 1 11 . 1 1 75 75 PHE N N 75 118.513 118.513 119.422 -0.909 25380
5130 1 11 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.893 -0.530 25380
5131 1 11 . 1 1 75 75 PHE C C 75 173.038 173.038 175.002 -1.964 25380
5132 1 11 . 1 1 75 75 PHE CA C 75 55.522 55.522 57.191 -1.669 25380
5133 1 11 . 1 1 75 75 PHE CB C 75 41.714 41.714 41.459 0.255 25380
5134 1 11 . 1 1 75 75 PHE H H 75 7.397 7.397 8.035 -0.638 25380
5135 1 11 . 1 1 76 76 LEU N N 76 116.773 116.773 123.766 -6.993 25380
5136 1 11 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.804 -0.161 25380
5137 1 11 . 1 1 76 76 LEU C C 76 177.553 177.553 175.398 2.155 25380
5138 1 11 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.107 -0.488 25380
5139 1 11 . 1 1 76 76 LEU CB C 76 45.701 45.701 44.528 1.173 25380
5140 1 11 . 1 1 76 76 LEU H H 76 8.774 8.774 9.359 -0.585 25380
5141 1 11 . 1 1 77 77 TYR N N 77 118.377 118.377 124.985 -6.608 25380
5142 1 11 . 1 1 77 77 TYR HA H 77 5.415 5.415 5.043 0.372 25380
5143 1 11 . 1 1 77 77 TYR C C 77 175.479 175.479 173.318 2.161 25380
5144 1 11 . 1 1 77 77 TYR CA C 77 58.391 58.391 55.298 3.093 25380
5145 1 11 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.413 0.687 25380
5146 1 11 . 1 1 77 77 TYR H H 77 8.589 8.589 9.356 -0.767 25380
5147 1 11 . 1 1 78 78 GLU N N 78 123.875 123.875 128.058 -4.183 25380
5148 1 11 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.459 0.514 25380
5149 1 11 . 1 1 78 78 GLU C C 78 174.120 174.120 173.952 0.168 25380
5150 1 11 . 1 1 78 78 GLU CA C 78 54.378 54.378 53.883 0.495 25380
5151 1 11 . 1 1 78 78 GLU CB C 78 32.640 32.640 32.901 -0.261 25380
5152 1 11 . 1 1 78 78 GLU H H 78 9.576 9.576 8.599 0.977 25380
5153 1 11 . 1 1 79 79 LEU N N 79 128.661 128.661 124.482 4.179 25380
5154 1 11 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.375 0.914 25380
5155 1 11 . 1 1 79 79 LEU C C 79 174.219 174.219 175.218 -0.999 25380
5156 1 11 . 1 1 79 79 LEU CA C 79 53.149 53.149 54.181 -1.032 25380
5157 1 11 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.031 2.599 25380
5158 1 11 . 1 1 79 79 LEU H H 79 9.139 9.139 8.494 0.645 25380
5159 1 11 . 1 1 80 80 HIS N N 80 124.886 124.886 123.006 1.880 25380
5160 1 11 . 1 1 80 80 HIS HA H 80 5.430 5.430 5.020 0.410 25380
5161 1 11 . 1 1 80 80 HIS C C 80 173.346 173.346 175.592 -2.246 25380
5162 1 11 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.761 -1.612 25380
5163 1 11 . 1 1 80 80 HIS CB C 80 30.768 30.768 31.623 -0.855 25380
5164 1 11 . 1 1 80 80 HIS H H 80 8.897 8.897 8.936 -0.039 25380
5165 1 11 . 1 1 81 81 ILE N N 81 125.173 125.173 122.227 2.946 25380
5166 1 11 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.911 0.379 25380
5167 1 11 . 1 1 81 81 ILE C C 81 174.600 174.600 175.470 -0.870 25380
5168 1 11 . 1 1 81 81 ILE CA C 81 60.500 60.500 62.196 -1.696 25380
5169 1 11 . 1 1 81 81 ILE CB C 81 39.700 39.700 35.457 4.243 25380
5170 1 11 . 1 1 81 81 ILE H H 81 8.909 8.909 8.541 0.368 25380
5171 1 12 . 1 1 2 2 HIS N N 2 120.430 120.430 124.055 -3.625 25380
5172 1 12 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.929 -0.194 25380
5173 1 12 . 1 1 2 2 HIS C C 2 173.884 173.884 174.081 -0.197 25380
5174 1 12 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.218 -1.166 25380
5175 1 12 . 1 1 2 2 HIS CB C 2 28.666 28.666 30.572 -1.906 25380
5176 1 12 . 1 1 2 2 HIS H H 2 8.678 8.678 8.731 -0.053 25380
5177 1 12 . 1 1 3 3 MET N N 3 122.377 122.377 126.751 -4.374 25380
5178 1 12 . 1 1 3 3 MET HA H 3 4.207 4.207 4.689 -0.482 25380
5179 1 12 . 1 1 3 3 MET C C 3 174.584 174.584 175.120 -0.536 25380
5180 1 12 . 1 1 3 3 MET CA C 3 56.550 56.550 55.226 1.324 25380
5181 1 12 . 1 1 3 3 MET CB C 3 33.426 33.426 33.693 -0.267 25380
5182 1 12 . 1 1 3 3 MET H H 3 8.240 8.240 8.665 -0.425 25380
5183 1 12 . 1 1 4 4 LYS N N 4 123.568 123.568 123.234 0.334 25380
5184 1 12 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.168 0.671 25380
5185 1 12 . 1 1 4 4 LYS C C 4 175.906 175.906 175.218 0.688 25380
5186 1 12 . 1 1 4 4 LYS CA C 4 54.800 54.800 56.006 -1.206 25380
5187 1 12 . 1 1 4 4 LYS CB C 4 34.900 34.900 30.685 4.215 25380
5188 1 12 . 1 1 4 4 LYS H H 4 8.351 8.351 6.457 1.894 25380
5189 1 12 . 1 1 5 5 LEU N N 5 123.568 123.568 116.982 6.586 25380
5190 1 12 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.962 -1.123 25380
5191 1 12 . 1 1 5 5 LEU C C 5 175.900 175.900 175.590 0.310 25380
5192 1 12 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.323 0.027 25380
5193 1 12 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.865 0.035 25380
5194 1 12 . 1 1 5 5 LEU H H 5 8.281 8.281 8.285 -0.004 25380
5195 1 12 . 1 1 6 6 VAL N N 6 121.564 121.564 121.160 0.404 25380
5196 1 12 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.514 -0.088 25380
5197 1 12 . 1 1 6 6 VAL C C 6 178.200 178.200 175.132 3.068 25380
5198 1 12 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.667 2.533 25380
5199 1 12 . 1 1 6 6 VAL CB C 6 33.200 33.200 34.636 -1.437 25380
5200 1 12 . 1 1 6 6 VAL H H 6 9.276 9.276 9.179 0.097 25380
5201 1 12 . 1 1 7 7 LEU N N 7 121.564 121.564 127.477 -5.913 25380
5202 1 12 . 1 1 7 7 LEU HA H 7 4.426 4.426 4.862 -0.436 25380
5203 1 12 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.317 9.883 25380
5204 1 12 . 1 1 7 7 LEU CB C 7 33.200 33.200 43.852 -10.652 25380
5205 1 12 . 1 1 7 7 LEU H H 7 9.276 9.276 8.553 0.723 25380
5206 1 12 . 1 1 8 8 ALA C C 8 177.040 177.040 177.360 -0.320 25380
5207 1 12 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.583 -0.882 25380
5208 1 12 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.738 1.125 25380
5209 1 12 . 1 1 9 9 LYS N N 9 119.845 119.845 122.633 -2.788 25380
5210 1 12 . 1 1 9 9 LYS HA H 9 4.128 4.128 3.956 0.172 25380
5211 1 12 . 1 1 9 9 LYS C C 9 176.075 176.075 178.075 -2.000 25380
5212 1 12 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.772 -3.011 25380
5213 1 12 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.568 0.351 25380
5214 1 12 . 1 1 9 9 LYS H H 9 8.545 8.545 8.807 -0.262 25380
5215 1 12 . 1 1 10 10 ASN N N 10 119.279 119.279 117.302 1.977 25380
5216 1 12 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.499 0.146 25380
5217 1 12 . 1 1 10 10 ASN C C 10 175.443 175.443 176.661 -1.218 25380
5218 1 12 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.981 -2.325 25380
5219 1 12 . 1 1 10 10 ASN CB C 10 38.777 38.777 38.091 0.686 25380
5220 1 12 . 1 1 10 10 ASN H H 10 8.592 8.592 9.122 -0.530 25380
5221 1 12 . 1 1 11 11 THR N N 11 111.876 111.876 113.987 -2.111 25380
5222 1 12 . 1 1 11 11 THR HA H 11 4.311 4.311 4.181 0.130 25380
5223 1 12 . 1 1 11 11 THR C C 11 174.666 174.666 175.715 -1.049 25380
5224 1 12 . 1 1 11 11 THR CA C 11 62.044 62.044 64.697 -2.653 25380
5225 1 12 . 1 1 11 11 THR CB C 11 69.895 69.895 69.051 0.844 25380
5226 1 12 . 1 1 11 11 THR H H 11 8.058 8.058 8.389 -0.331 25380
5227 1 12 . 1 1 12 12 ARG N N 12 121.152 121.152 119.601 1.551 25380
5228 1 12 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.361 -0.099 25380
5229 1 12 . 1 1 12 12 ARG C C 12 176.714 176.714 176.291 0.423 25380
5230 1 12 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.452 0.370 25380
5231 1 12 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.122 -0.419 25380
5232 1 12 . 1 1 12 12 ARG H H 12 8.291 8.291 7.864 0.427 25380
5233 1 12 . 1 1 13 13 LYS N N 13 120.459 120.459 117.845 2.614 25380
5234 1 12 . 1 1 13 13 LYS HA H 13 3.896 3.896 3.996 -0.100 25380
5235 1 12 . 1 1 13 13 LYS C C 13 176.682 176.682 174.822 1.860 25380
5236 1 12 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.478 -0.500 25380
5237 1 12 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.503 1.995 25380
5238 1 12 . 1 1 13 13 LYS H H 13 8.286 8.286 8.655 -0.369 25380
5239 1 12 . 1 1 14 14 SER N N 14 114.568 114.568 115.641 -1.073 25380
5240 1 12 . 1 1 14 14 SER HA H 14 4.371 4.371 4.726 -0.355 25380
5241 1 12 . 1 1 14 14 SER C C 14 173.990 173.990 173.131 0.859 25380
5242 1 12 . 1 1 14 14 SER CA C 14 58.617 58.617 57.652 0.965 25380
5243 1 12 . 1 1 14 14 SER CB C 14 63.933 63.933 63.969 -0.036 25380
5244 1 12 . 1 1 14 14 SER H H 14 7.957 7.957 8.100 -0.143 25380
5245 1 12 . 1 1 15 15 ASP N N 15 121.565 121.565 120.732 0.833 25380
5246 1 12 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.396 0.205 25380
5247 1 12 . 1 1 15 15 ASP C C 15 175.684 175.684 176.581 -0.897 25380
5248 1 12 . 1 1 15 15 ASP CA C 15 54.149 54.149 55.152 -1.003 25380
5249 1 12 . 1 1 15 15 ASP CB C 15 41.229 41.229 39.797 1.432 25380
5250 1 12 . 1 1 15 15 ASP H H 15 8.166 8.166 8.679 -0.513 25380
5251 1 12 . 1 1 16 16 ALA N N 16 124.173 124.173 120.648 3.525 25380
5252 1 12 . 1 1 16 16 ALA HA H 16 4.371 4.371 3.996 0.375 25380
5253 1 12 . 1 1 16 16 ALA C C 16 177.184 177.184 178.522 -1.338 25380
5254 1 12 . 1 1 16 16 ALA CA C 16 52.337 52.337 54.566 -2.229 25380
5255 1 12 . 1 1 16 16 ALA CB C 16 19.359 19.359 19.092 0.267 25380
5256 1 12 . 1 1 16 16 ALA H H 16 8.163 8.163 8.397 -0.234 25380
5257 1 12 . 1 1 17 17 LYS N N 17 121.152 121.152 115.656 5.496 25380
5258 1 12 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.395 0.031 25380
5259 1 12 . 1 1 17 17 LYS C C 17 175.488 175.488 177.675 -2.187 25380
5260 1 12 . 1 1 17 17 LYS CA C 17 56.205 56.205 57.418 -1.213 25380
5261 1 12 . 1 1 17 17 LYS CB C 17 34.296 34.296 31.873 2.423 25380
5262 1 12 . 1 1 17 17 LYS H H 17 8.363 8.363 8.332 0.031 25380
5263 1 12 . 1 1 18 18 SER N N 18 116.448 116.448 116.651 -0.203 25380
5264 1 12 . 1 1 18 18 SER HA H 18 5.355 5.355 4.177 1.178 25380
5265 1 12 . 1 1 18 18 SER C C 18 173.887 173.887 176.217 -2.330 25380
5266 1 12 . 1 1 18 18 SER CA C 18 57.248 57.248 61.087 -3.839 25380
5267 1 12 . 1 1 18 18 SER CB C 18 64.962 64.962 62.727 2.235 25380
5268 1 12 . 1 1 18 18 SER H H 18 8.206 8.206 7.684 0.522 25380
5269 1 12 . 1 1 19 19 VAL N N 19 117.867 117.867 123.029 -5.162 25380
5270 1 12 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.664 -0.044 25380
5271 1 12 . 1 1 19 19 VAL C C 19 174.169 174.169 177.667 -3.498 25380
5272 1 12 . 1 1 19 19 VAL CA C 19 59.546 59.546 66.590 -7.044 25380
5273 1 12 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.541 4.361 25380
5274 1 12 . 1 1 19 19 VAL H H 19 9.086 9.086 7.585 1.501 25380
5275 1 12 . 1 1 20 20 GLU N N 20 120.843 120.843 120.160 0.683 25380
5276 1 12 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.192 0.676 25380
5277 1 12 . 1 1 20 20 GLU C C 20 178.747 178.747 178.630 0.117 25380
5278 1 12 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.491 -4.939 25380
5279 1 12 . 1 1 20 20 GLU CB C 20 31.099 31.099 29.155 1.944 25380
5280 1 12 . 1 1 20 20 GLU H H 20 8.841 8.841 8.264 0.577 25380
5281 1 12 . 1 1 21 21 LEU N N 21 122.653 122.653 119.058 3.595 25380
5282 1 12 . 1 1 21 21 LEU HA H 21 3.443 3.443 3.971 -0.528 25380
5283 1 12 . 1 1 21 21 LEU C C 21 178.799 178.799 179.425 -0.626 25380
5284 1 12 . 1 1 21 21 LEU CA C 21 58.707 58.707 58.008 0.699 25380
5285 1 12 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.723 -3.152 25380
5286 1 12 . 1 1 21 21 LEU H H 21 8.744 8.744 7.617 1.127 25380
5287 1 12 . 1 1 22 22 GLU N N 22 115.392 115.392 119.065 -3.673 25380
5288 1 12 . 1 1 22 22 GLU HA H 22 3.989 3.989 4.084 -0.095 25380
5289 1 12 . 1 1 22 22 GLU C C 22 179.328 179.328 179.551 -0.223 25380
5290 1 12 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.636 0.444 25380
5291 1 12 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.478 -0.644 25380
5292 1 12 . 1 1 22 22 GLU H H 22 8.744 8.744 7.682 1.062 25380
5293 1 12 . 1 1 23 23 ASP N N 23 118.597 118.597 121.244 -2.647 25380
5294 1 12 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.605 0.006 25380
5295 1 12 . 1 1 23 23 ASP C C 23 179.139 179.139 178.886 0.253 25380
5296 1 12 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.258 0.261 25380
5297 1 12 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.546 -0.104 25380
5298 1 12 . 1 1 23 23 ASP H H 23 7.098 7.098 8.695 -1.597 25380
5299 1 12 . 1 1 24 24 LEU N N 24 119.869 119.869 120.623 -0.754 25380
5300 1 12 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.936 -0.002 25380
5301 1 12 . 1 1 24 24 LEU C C 24 179.045 179.045 178.941 0.104 25380
5302 1 12 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.315 -0.766 25380
5303 1 12 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.790 -0.240 25380
5304 1 12 . 1 1 24 24 LEU H H 24 7.576 7.576 8.569 -0.993 25380
5305 1 12 . 1 1 25 25 TYR N N 25 118.100 118.100 119.357 -1.257 25380
5306 1 12 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.696 0.671 25380
5307 1 12 . 1 1 25 25 TYR C C 25 177.945 177.945 177.842 0.103 25380
5308 1 12 . 1 1 25 25 TYR CA C 25 62.606 62.606 60.953 1.653 25380
5309 1 12 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.161 -0.213 25380
5310 1 12 . 1 1 25 25 TYR H H 25 8.320 8.320 7.406 0.914 25380
5311 1 12 . 1 1 26 26 HIS N N 26 119.440 119.440 118.267 1.173 25380
5312 1 12 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.477 -0.106 25380
5313 1 12 . 1 1 26 26 HIS C C 26 176.559 176.559 178.076 -1.517 25380
5314 1 12 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.813 -0.294 25380
5315 1 12 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.032 -1.904 25380
5316 1 12 . 1 1 26 26 HIS H H 26 8.383 8.383 8.690 -0.307 25380
5317 1 12 . 1 1 27 27 GLU N N 27 119.915 119.915 121.682 -1.767 25380
5318 1 12 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.264 -0.006 25380
5319 1 12 . 1 1 27 27 GLU C C 27 179.163 179.163 178.635 0.528 25380
5320 1 12 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.034 1.041 25380
5321 1 12 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.728 -0.193 25380
5322 1 12 . 1 1 27 27 GLU H H 27 8.288 8.288 9.004 -0.716 25380
5323 1 12 . 1 1 28 28 PHE N N 28 120.500 120.500 120.783 -0.283 25380
5324 1 12 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.469 0.503 25380
5325 1 12 . 1 1 28 28 PHE C C 28 177.386 177.386 177.176 0.210 25380
5326 1 12 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.823 -0.422 25380
5327 1 12 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.454 0.114 25380
5328 1 12 . 1 1 28 28 PHE H H 28 8.568 8.568 8.019 0.549 25380
5329 1 12 . 1 1 29 29 SER N N 29 114.306 114.306 114.937 -0.631 25380
5330 1 12 . 1 1 29 29 SER HA H 29 4.288 4.288 4.122 0.166 25380
5331 1 12 . 1 1 29 29 SER C C 29 175.656 175.656 176.689 -1.033 25380
5332 1 12 . 1 1 29 29 SER CA C 29 61.058 61.058 60.395 0.663 25380
5333 1 12 . 1 1 29 29 SER CB C 29 63.555 63.555 63.518 0.037 25380
5334 1 12 . 1 1 29 29 SER H H 29 8.479 8.479 7.941 0.538 25380
5335 1 12 . 1 1 30 30 GLU N N 30 118.322 118.322 121.436 -3.114 25380
5336 1 12 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.124 -0.032 25380
5337 1 12 . 1 1 30 30 GLU C C 30 177.312 177.312 176.857 0.455 25380
5338 1 12 . 1 1 30 30 GLU CA C 30 57.580 57.580 58.302 -0.722 25380
5339 1 12 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.395 -0.818 25380
5340 1 12 . 1 1 30 30 GLU H H 30 8.428 8.428 8.062 0.366 25380
5341 1 12 . 1 1 31 31 ASP N N 31 115.630 115.630 114.308 1.322 25380
5342 1 12 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.771 0.039 25380
5343 1 12 . 1 1 31 31 ASP C C 31 175.723 175.723 173.748 1.975 25380
5344 1 12 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.939 1.035 25380
5345 1 12 . 1 1 31 31 ASP CB C 31 40.818 40.818 43.650 -2.832 25380
5346 1 12 . 1 1 31 31 ASP H H 31 7.303 7.303 8.027 -0.724 25380
5347 1 12 . 1 1 32 32 LYS N N 32 114.357 114.357 118.703 -4.346 25380
5348 1 12 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.474 -0.647 25380
5349 1 12 . 1 1 32 32 LYS C C 32 175.716 175.716 175.632 0.084 25380
5350 1 12 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.351 0.811 25380
5351 1 12 . 1 1 32 32 LYS CB C 32 28.381 28.381 34.189 -5.808 25380
5352 1 12 . 1 1 32 32 LYS H H 32 7.148 7.148 8.199 -1.051 25380
5353 1 12 . 1 1 33 33 ARG N N 33 120.929 120.929 125.951 -5.022 25380
5354 1 12 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.646 -0.445 25380
5355 1 12 . 1 1 33 33 ARG C C 33 173.982 173.982 173.591 0.391 25380
5356 1 12 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.858 0.336 25380
5357 1 12 . 1 1 33 33 ARG CB C 33 30.642 30.642 34.062 -3.420 25380
5358 1 12 . 1 1 33 33 ARG H H 33 7.388 7.388 8.815 -1.427 25380
5359 1 12 . 1 1 34 34 SER N N 34 115.867 115.867 113.753 2.114 25380
5360 1 12 . 1 1 34 34 SER HA H 34 5.355 5.355 4.781 0.574 25380
5361 1 12 . 1 1 34 34 SER C C 34 172.754 172.754 172.352 0.402 25380
5362 1 12 . 1 1 34 34 SER CA C 34 58.236 58.236 56.913 1.323 25380
5363 1 12 . 1 1 34 34 SER CB C 34 65.212 65.212 66.275 -1.063 25380
5364 1 12 . 1 1 34 34 SER H H 34 8.173 8.173 8.062 0.111 25380
5365 1 12 . 1 1 35 35 ILE N N 35 119.621 119.621 113.760 5.861 25380
5366 1 12 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.794 0.069 25380
5367 1 12 . 1 1 35 35 ILE C C 35 174.069 174.069 173.689 0.380 25380
5368 1 12 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.376 0.581 25380
5369 1 12 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.581 -0.926 25380
5370 1 12 . 1 1 35 35 ILE H H 35 6.779 6.779 8.342 -1.563 25380
5371 1 12 . 1 1 36 36 PHE N N 36 124.305 124.305 121.413 2.892 25380
5372 1 12 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.645 -1.192 25380
5373 1 12 . 1 1 36 36 PHE C C 36 173.204 173.204 175.205 -2.001 25380
5374 1 12 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.974 -0.558 25380
5375 1 12 . 1 1 36 36 PHE CB C 36 44.817 44.817 41.999 2.818 25380
5376 1 12 . 1 1 36 36 PHE H H 36 8.411 8.411 9.048 -0.637 25380
5377 1 12 . 1 1 37 37 TYR N N 37 118.743 118.743 124.450 -5.707 25380
5378 1 12 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.390 0.180 25380
5379 1 12 . 1 1 37 37 TYR C C 37 175.455 175.455 173.813 1.642 25380
5380 1 12 . 1 1 37 37 TYR CA C 37 56.518 56.518 56.011 0.507 25380
5381 1 12 . 1 1 37 37 TYR CB C 37 40.991 40.991 41.838 -0.847 25380
5382 1 12 . 1 1 37 37 TYR H H 37 8.353 8.353 9.476 -1.123 25380
5383 1 12 . 1 1 38 38 PHE N N 38 119.236 119.236 130.178 -10.942 25380
5384 1 12 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.407 0.753 25380
5385 1 12 . 1 1 38 38 PHE C C 38 174.650 174.650 172.712 1.938 25380
5386 1 12 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.378 1.464 25380
5387 1 12 . 1 1 38 38 PHE CB C 38 42.619 42.619 39.353 3.266 25380
5388 1 12 . 1 1 38 38 PHE H H 38 9.756 9.756 8.766 0.990 25380
5389 1 12 . 1 1 39 39 ALA N N 39 122.516 122.516 129.415 -6.899 25380
5390 1 12 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.439 0.101 25380
5391 1 12 . 1 1 39 39 ALA C C 39 177.042 177.042 174.121 2.921 25380
5392 1 12 . 1 1 39 39 ALA CA C 39 50.843 50.843 48.662 2.181 25380
5393 1 12 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.617 -3.039 25380
5394 1 12 . 1 1 39 39 ALA H H 39 7.738 7.738 8.480 -0.742 25380
5395 1 12 . 1 1 40 40 PRO C C 40 175.411 175.411 176.965 -1.554 25380
5396 1 12 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.990 1.298 25380
5397 1 12 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.747 -1.643 25380
5398 1 12 . 1 1 41 41 THR N N 41 105.878 105.878 116.006 -10.128 25380
5399 1 12 . 1 1 41 41 THR HA H 41 4.190 4.190 3.664 0.526 25380
5400 1 12 . 1 1 41 41 THR C C 41 176.400 176.400 174.977 1.423 25380
5401 1 12 . 1 1 41 41 THR CA C 41 61.937 61.937 65.159 -3.222 25380
5402 1 12 . 1 1 41 41 THR CB C 41 68.331 68.331 68.739 -0.408 25380
5403 1 12 . 1 1 41 41 THR H H 41 6.715 6.715 8.151 -1.436 25380
5404 1 12 . 1 1 42 42 ASN N N 42 118.863 118.863 117.495 1.368 25380
5405 1 12 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.577 -0.042 25380
5406 1 12 . 1 1 42 42 ASN C C 42 173.764 173.764 175.099 -1.335 25380
5407 1 12 . 1 1 42 42 ASN CA C 42 54.176 54.176 54.535 -0.359 25380
5408 1 12 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.639 4.077 25380
5409 1 12 . 1 1 42 42 ASN H H 42 7.153 7.153 8.241 -1.088 25380
5410 1 12 . 1 1 43 43 ALA N N 43 126.174 126.174 121.294 4.880 25380
5411 1 12 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.470 -0.045 25380
5412 1 12 . 1 1 43 43 ALA C C 43 179.308 179.308 176.668 2.640 25380
5413 1 12 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.075 -0.093 25380
5414 1 12 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.690 -1.396 25380
5415 1 12 . 1 1 43 43 ALA H H 43 9.465 9.465 7.636 1.829 25380
5416 1 12 . 1 1 44 44 HIS N N 44 126.251 126.251 116.392 9.859 25380
5417 1 12 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.147 -0.320 25380
5418 1 12 . 1 1 44 44 HIS C C 44 177.407 177.407 174.831 2.576 25380
5419 1 12 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.779 4.246 25380
5420 1 12 . 1 1 44 44 HIS CB C 44 28.630 28.630 26.917 1.713 25380
5421 1 12 . 1 1 44 44 HIS H H 44 9.407 9.407 7.862 1.545 25380
5422 1 12 . 1 1 45 45 LYS N N 45 114.990 114.990 119.438 -4.448 25380
5423 1 12 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.232 -0.349 25380
5424 1 12 . 1 1 45 45 LYS C C 45 178.284 178.284 177.222 1.062 25380
5425 1 12 . 1 1 45 45 LYS CA C 45 59.249 59.249 58.567 0.682 25380
5426 1 12 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.816 -0.982 25380
5427 1 12 . 1 1 45 45 LYS H H 45 8.960 8.960 7.893 1.067 25380
5428 1 12 . 1 1 46 46 ASP N N 46 120.411 120.411 119.449 0.962 25380
5429 1 12 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.440 -0.014 25380
5430 1 12 . 1 1 46 46 ASP C C 46 177.773 177.773 178.142 -0.369 25380
5431 1 12 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.221 -0.205 25380
5432 1 12 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.187 -0.290 25380
5433 1 12 . 1 1 46 46 ASP H H 46 6.777 6.777 8.576 -1.799 25380
5434 1 12 . 1 1 47 47 MET N N 47 118.178 118.178 118.824 -0.646 25380
5435 1 12 . 1 1 47 47 MET HA H 47 3.879 3.879 4.295 -0.416 25380
5436 1 12 . 1 1 47 47 MET C C 47 179.499 179.499 177.740 1.759 25380
5437 1 12 . 1 1 47 47 MET CA C 47 56.052 56.052 59.089 -3.037 25380
5438 1 12 . 1 1 47 47 MET CB C 47 29.601 29.601 32.703 -3.102 25380
5439 1 12 . 1 1 47 47 MET H H 47 7.367 7.367 7.984 -0.617 25380
5440 1 12 . 1 1 48 48 LEU N N 48 117.665 117.665 119.486 -1.821 25380
5441 1 12 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.960 -0.113 25380
5442 1 12 . 1 1 48 48 LEU C C 48 179.843 179.843 178.362 1.481 25380
5443 1 12 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.776 -0.196 25380
5444 1 12 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.595 -0.642 25380
5445 1 12 . 1 1 48 48 LEU H H 48 7.672 7.672 7.526 0.146 25380
5446 1 12 . 1 1 49 49 LYS N N 49 119.326 119.326 118.426 0.900 25380
5447 1 12 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.525 0.602 25380
5448 1 12 . 1 1 49 49 LYS C C 49 179.684 179.684 178.259 1.425 25380
5449 1 12 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.059 -0.260 25380
5450 1 12 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.808 -0.355 25380
5451 1 12 . 1 1 49 49 LYS H H 49 7.420 7.420 7.626 -0.206 25380
5452 1 12 . 1 1 50 50 ALA N N 50 122.022 122.022 122.565 -0.543 25380
5453 1 12 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.370 0.673 25380
5454 1 12 . 1 1 50 50 ALA C C 50 178.818 178.818 178.671 0.147 25380
5455 1 12 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.704 0.465 25380
5456 1 12 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.532 -0.232 25380
5457 1 12 . 1 1 50 50 ALA H H 50 7.551 7.551 7.643 -0.092 25380
5458 1 12 . 1 1 51 51 VAL N N 51 118.165 118.165 118.013 0.152 25380
5459 1 12 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.598 -0.156 25380
5460 1 12 . 1 1 51 51 VAL C C 51 178.646 178.646 178.117 0.529 25380
5461 1 12 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.476 0.730 25380
5462 1 12 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.810 0.643 25380
5463 1 12 . 1 1 51 51 VAL H H 51 7.226 7.226 7.392 -0.166 25380
5464 1 12 . 1 1 52 52 ASP N N 52 122.298 122.298 120.421 1.877 25380
5465 1 12 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.316 0.055 25380
5466 1 12 . 1 1 52 52 ASP C C 52 177.898 177.898 179.045 -1.147 25380
5467 1 12 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.075 0.496 25380
5468 1 12 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.108 0.278 25380
5469 1 12 . 1 1 52 52 ASP H H 52 8.232 8.232 7.316 0.916 25380
5470 1 12 . 1 1 53 53 PHE N N 53 121.541 121.541 120.063 1.478 25380
5471 1 12 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.191 0.130 25380
5472 1 12 . 1 1 53 53 PHE C C 53 177.224 177.224 178.106 -0.882 25380
5473 1 12 . 1 1 53 53 PHE CA C 53 61.080 61.080 59.064 2.016 25380
5474 1 12 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.895 1.805 25380
5475 1 12 . 1 1 53 53 PHE H H 53 8.240 8.240 7.843 0.397 25380
5476 1 12 . 1 1 54 54 PHE N N 54 115.925 115.925 117.527 -1.602 25380
5477 1 12 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.204 -0.549 25380
5478 1 12 . 1 1 54 54 PHE C C 54 178.269 178.269 177.239 1.030 25380
5479 1 12 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.795 4.405 25380
5480 1 12 . 1 1 54 54 PHE CB C 54 38.578 38.578 38.116 0.462 25380
5481 1 12 . 1 1 54 54 PHE H H 54 7.755 7.755 7.854 -0.099 25380
5482 1 12 . 1 1 55 55 LYS N N 55 120.251 120.251 117.515 2.736 25380
5483 1 12 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.009 0.417 25380
5484 1 12 . 1 1 55 55 LYS C C 55 181.484 181.484 178.503 2.981 25380
5485 1 12 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.941 0.688 25380
5486 1 12 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.476 -0.737 25380
5487 1 12 . 1 1 55 55 LYS H H 55 8.213 8.213 7.645 0.568 25380
5488 1 12 . 1 1 56 56 GLU N N 56 120.146 120.146 117.847 2.299 25380
5489 1 12 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.132 -0.139 25380
5490 1 12 . 1 1 56 56 GLU C C 56 178.085 178.085 177.589 0.496 25380
5491 1 12 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.451 0.337 25380
5492 1 12 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.167 -1.571 25380
5493 1 12 . 1 1 56 56 GLU H H 56 7.850 7.850 8.004 -0.154 25380
5494 1 12 . 1 1 57 57 LYS N N 57 115.940 115.940 118.944 -3.004 25380
5495 1 12 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.453 -0.350 25380
5496 1 12 . 1 1 57 57 LYS C C 57 176.225 176.225 176.695 -0.470 25380
5497 1 12 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.101 -0.529 25380
5498 1 12 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.732 -1.696 25380
5499 1 12 . 1 1 57 57 LYS H H 57 7.019 7.019 7.804 -0.785 25380
5500 1 12 . 1 1 58 58 GLY N N 58 106.593 106.593 109.074 -2.481 25380
5501 1 12 . 1 1 58 58 GLY C C 58 174.350 174.350 174.897 -0.547 25380
5502 1 12 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.306 0.194 25380
5503 1 12 . 1 1 58 58 GLY H H 58 7.883 7.883 8.389 -0.506 25380
5504 1 12 . 1 1 59 59 HIS N N 59 117.962 117.962 116.180 1.782 25380
5505 1 12 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.217 0.650 25380
5506 1 12 . 1 1 59 59 HIS C C 59 173.271 173.271 174.389 -1.118 25380
5507 1 12 . 1 1 59 59 HIS CA C 59 54.778 54.778 55.769 -0.991 25380
5508 1 12 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.184 2.501 25380
5509 1 12 . 1 1 59 59 HIS H H 59 8.218 8.218 8.216 0.002 25380
5510 1 12 . 1 1 60 60 THR N N 60 119.624 119.624 108.539 11.085 25380
5511 1 12 . 1 1 60 60 THR HA H 60 4.430 4.430 4.133 0.297 25380
5512 1 12 . 1 1 60 60 THR C C 60 171.430 171.430 173.449 -2.019 25380
5513 1 12 . 1 1 60 60 THR CA C 60 63.480 63.480 60.684 2.796 25380
5514 1 12 . 1 1 60 60 THR CB C 60 69.761 69.761 70.750 -0.989 25380
5515 1 12 . 1 1 60 60 THR H H 60 8.780 8.780 7.324 1.456 25380
5516 1 12 . 1 1 61 61 ALA N N 61 126.706 126.706 120.913 5.793 25380
5517 1 12 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.362 0.884 25380
5518 1 12 . 1 1 61 61 ALA C C 61 174.753 174.753 175.510 -0.757 25380
5519 1 12 . 1 1 61 61 ALA CA C 61 49.772 49.772 52.556 -2.784 25380
5520 1 12 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.499 2.390 25380
5521 1 12 . 1 1 61 61 ALA H H 61 7.795 7.795 7.842 -0.047 25380
5522 1 12 . 1 1 62 62 TYR N N 62 117.859 117.859 116.838 1.021 25380
5523 1 12 . 1 1 62 62 TYR C C 62 173.431 173.431 173.684 -0.253 25380
5524 1 12 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.192 -0.545 25380
5525 1 12 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.502 -1.953 25380
5526 1 12 . 1 1 62 62 TYR H H 62 8.711 8.711 8.004 0.707 25380
5527 1 12 . 1 1 63 63 LEU N N 63 125.044 125.044 122.101 2.943 25380
5528 1 12 . 1 1 63 63 LEU HA H 63 5.411 5.411 5.363 0.048 25380
5529 1 12 . 1 1 63 63 LEU C C 63 175.319 175.319 174.859 0.460 25380
5530 1 12 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.465 -0.235 25380
5531 1 12 . 1 1 63 63 LEU CB C 63 45.701 45.701 45.529 0.172 25380
5532 1 12 . 1 1 63 63 LEU H H 63 8.746 8.746 8.473 0.273 25380
5533 1 12 . 1 1 64 64 ASP N N 64 125.463 125.463 123.151 2.312 25380
5534 1 12 . 1 1 64 64 ASP HA H 64 5.199 5.199 5.046 0.153 25380
5535 1 12 . 1 1 64 64 ASP C C 64 174.512 174.512 174.270 0.242 25380
5536 1 12 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.397 0.303 25380
5537 1 12 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.456 -0.502 25380
5538 1 12 . 1 1 64 64 ASP H H 64 9.293 9.293 9.059 0.234 25380
5539 1 12 . 1 1 65 65 GLU N N 65 120.711 120.711 120.568 0.143 25380
5540 1 12 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.323 0.744 25380
5541 1 12 . 1 1 65 65 GLU C C 65 175.652 175.652 176.416 -0.764 25380
5542 1 12 . 1 1 65 65 GLU CA C 65 55.643 55.643 57.381 -1.738 25380
5543 1 12 . 1 1 65 65 GLU CB C 65 30.455 30.455 30.819 -0.364 25380
5544 1 12 . 1 1 65 65 GLU H H 65 8.715 8.715 8.551 0.164 25380
5545 1 12 . 1 1 66 66 VAL N N 66 122.936 122.936 122.287 0.649 25380
5546 1 12 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.004 0.426 25380
5547 1 12 . 1 1 66 66 VAL C C 66 175.065 175.065 176.138 -1.073 25380
5548 1 12 . 1 1 66 66 VAL CA C 66 60.991 60.991 64.229 -3.238 25380
5549 1 12 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.520 1.760 25380
5550 1 12 . 1 1 66 66 VAL H H 66 9.156 9.156 9.006 0.150 25380
5551 1 12 . 1 1 67 67 ARG N N 67 126.104 126.104 128.564 -2.460 25380
5552 1 12 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.452 0.089 25380
5553 1 12 . 1 1 67 67 ARG C C 67 176.708 176.708 175.633 1.075 25380
5554 1 12 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.458 0.622 25380
5555 1 12 . 1 1 67 67 ARG CB C 67 30.908 30.908 28.542 2.366 25380
5556 1 12 . 1 1 67 67 ARG H H 67 8.734 8.734 8.854 -0.120 25380
5557 1 12 . 1 1 68 68 VAL N N 68 120.707 120.707 116.495 4.212 25380
5558 1 12 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.625 -0.473 25380
5559 1 12 . 1 1 68 68 VAL C C 68 175.931 175.931 176.055 -0.124 25380
5560 1 12 . 1 1 68 68 VAL CA C 68 62.776 62.776 60.973 1.803 25380
5561 1 12 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.190 1.299 25380
5562 1 12 . 1 1 68 68 VAL H H 68 8.384 8.384 7.892 0.492 25380
5563 1 12 . 1 1 69 69 SER N N 69 116.156 116.156 118.509 -2.353 25380
5564 1 12 . 1 1 69 69 SER HA H 69 4.693 4.693 4.302 0.391 25380
5565 1 12 . 1 1 69 69 SER C C 69 174.544 174.544 176.506 -1.962 25380
5566 1 12 . 1 1 69 69 SER CA C 69 57.754 57.754 62.289 -4.535 25380
5567 1 12 . 1 1 69 69 SER CB C 69 64.831 64.831 62.708 2.123 25380
5568 1 12 . 1 1 69 69 SER H H 69 8.067 8.067 7.851 0.216 25380
5569 1 12 . 1 1 70 70 THR N N 70 110.753 110.753 116.982 -6.229 25380
5570 1 12 . 1 1 70 70 THR HA H 70 4.152 4.152 4.122 0.030 25380
5571 1 12 . 1 1 70 70 THR C C 70 174.865 174.865 175.380 -0.515 25380
5572 1 12 . 1 1 70 70 THR CA C 70 63.831 63.831 66.053 -2.222 25380
5573 1 12 . 1 1 70 70 THR CB C 70 68.956 68.956 68.481 0.476 25380
5574 1 12 . 1 1 70 70 THR H H 70 8.095 8.095 8.506 -0.411 25380
5575 1 12 . 1 1 71 71 ASP N N 71 121.817 121.817 120.733 1.084 25380
5576 1 12 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.576 0.014 25380
5577 1 12 . 1 1 71 71 ASP C C 71 176.746 176.746 176.911 -0.165 25380
5578 1 12 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.109 -1.845 25380
5579 1 12 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.825 0.600 25380
5580 1 12 . 1 1 71 71 ASP H H 71 8.076 8.076 8.382 -0.306 25380
5581 1 12 . 1 1 72 72 GLU N N 72 123.635 123.635 116.377 7.258 25380
5582 1 12 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.574 -0.581 25380
5583 1 12 . 1 1 72 72 GLU C C 72 176.971 176.971 175.759 1.212 25380
5584 1 12 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.404 1.815 25380
5585 1 12 . 1 1 72 72 GLU CB C 72 29.702 29.702 31.672 -1.970 25380
5586 1 12 . 1 1 72 72 GLU H H 72 8.514 8.514 8.055 0.459 25380
5587 1 12 . 1 1 73 73 LYS N N 73 117.857 117.857 117.803 0.054 25380
5588 1 12 . 1 1 73 73 LYS HA H 73 4.643 4.643 4.071 0.572 25380
5589 1 12 . 1 1 73 73 LYS C C 73 176.508 176.508 175.927 0.581 25380
5590 1 12 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.617 -0.537 25380
5591 1 12 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.397 0.806 25380
5592 1 12 . 1 1 73 73 LYS H H 73 8.423 8.423 8.584 -0.161 25380
5593 1 12 . 1 1 74 74 ASP N N 74 120.580 120.580 117.117 3.463 25380
5594 1 12 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.654 0.104 25380
5595 1 12 . 1 1 74 74 ASP C C 74 174.059 174.059 175.915 -1.856 25380
5596 1 12 . 1 1 74 74 ASP CA C 74 53.279 53.279 56.032 -2.753 25380
5597 1 12 . 1 1 74 74 ASP CB C 74 40.578 40.578 42.183 -1.605 25380
5598 1 12 . 1 1 74 74 ASP H H 74 7.918 7.918 8.605 -0.687 25380
5599 1 12 . 1 1 75 75 PHE N N 75 118.513 118.513 118.934 -0.421 25380
5600 1 12 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.700 -0.337 25380
5601 1 12 . 1 1 75 75 PHE C C 75 173.038 173.038 175.417 -2.379 25380
5602 1 12 . 1 1 75 75 PHE CA C 75 55.522 55.522 57.229 -1.707 25380
5603 1 12 . 1 1 75 75 PHE CB C 75 41.714 41.714 40.029 1.685 25380
5604 1 12 . 1 1 75 75 PHE H H 75 7.397 7.397 8.031 -0.634 25380
5605 1 12 . 1 1 76 76 LEU N N 76 116.773 116.773 124.660 -7.887 25380
5606 1 12 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.602 0.041 25380
5607 1 12 . 1 1 76 76 LEU C C 76 177.553 177.553 175.407 2.146 25380
5608 1 12 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.681 -1.062 25380
5609 1 12 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.490 2.211 25380
5610 1 12 . 1 1 76 76 LEU H H 76 8.774 8.774 9.062 -0.288 25380
5611 1 12 . 1 1 77 77 TYR N N 77 118.377 118.377 124.608 -6.231 25380
5612 1 12 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.914 0.501 25380
5613 1 12 . 1 1 77 77 TYR C C 77 175.479 175.479 173.270 2.209 25380
5614 1 12 . 1 1 77 77 TYR CA C 77 58.391 58.391 56.036 2.355 25380
5615 1 12 . 1 1 77 77 TYR CB C 77 41.100 41.100 41.322 -0.222 25380
5616 1 12 . 1 1 77 77 TYR H H 77 8.589 8.589 9.262 -0.673 25380
5617 1 12 . 1 1 78 78 GLU N N 78 123.875 123.875 128.760 -4.885 25380
5618 1 12 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.817 0.156 25380
5619 1 12 . 1 1 78 78 GLU C C 78 174.120 174.120 174.080 0.040 25380
5620 1 12 . 1 1 78 78 GLU CA C 78 54.378 54.378 53.747 0.631 25380
5621 1 12 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.394 -0.754 25380
5622 1 12 . 1 1 78 78 GLU H H 78 9.576 9.576 8.467 1.109 25380
5623 1 12 . 1 1 79 79 LEU N N 79 128.661 128.661 122.657 6.004 25380
5624 1 12 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.775 0.514 25380
5625 1 12 . 1 1 79 79 LEU C C 79 174.219 174.219 175.066 -0.847 25380
5626 1 12 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.331 -0.182 25380
5627 1 12 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.051 2.579 25380
5628 1 12 . 1 1 79 79 LEU H H 79 9.139 9.139 8.763 0.376 25380
5629 1 12 . 1 1 80 80 HIS N N 80 124.886 124.886 122.215 2.671 25380
5630 1 12 . 1 1 80 80 HIS HA H 80 5.430 5.430 5.166 0.264 25380
5631 1 12 . 1 1 80 80 HIS C C 80 173.346 173.346 177.086 -3.740 25380
5632 1 12 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.310 -1.161 25380
5633 1 12 . 1 1 80 80 HIS CB C 80 30.768 30.768 30.582 0.186 25380
5634 1 12 . 1 1 80 80 HIS H H 80 8.897 8.897 8.821 0.076 25380
5635 1 12 . 1 1 81 81 ILE N N 81 125.173 125.173 123.641 1.532 25380
5636 1 12 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.530 0.760 25380
5637 1 12 . 1 1 81 81 ILE C C 81 174.600 174.600 176.280 -1.680 25380
5638 1 12 . 1 1 81 81 ILE CA C 81 60.500 60.500 64.338 -3.838 25380
5639 1 12 . 1 1 81 81 ILE CB C 81 39.700 39.700 38.151 1.549 25380
5640 1 12 . 1 1 81 81 ILE H H 81 8.909 8.909 9.394 -0.485 25380
5641 1 13 . 1 1 2 2 HIS N N 2 120.430 120.430 119.997 0.433 25380
5642 1 13 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.473 0.262 25380
5643 1 13 . 1 1 2 2 HIS C C 2 173.884 173.884 174.252 -0.368 25380
5644 1 13 . 1 1 2 2 HIS CA C 2 55.052 55.052 57.922 -2.870 25380
5645 1 13 . 1 1 2 2 HIS CB C 2 28.666 28.666 28.432 0.234 25380
5646 1 13 . 1 1 2 2 HIS H H 2 8.678 8.678 8.691 -0.013 25380
5647 1 13 . 1 1 3 3 MET N N 3 122.377 122.377 113.168 9.209 25380
5648 1 13 . 1 1 3 3 MET HA H 3 4.207 4.207 4.687 -0.480 25380
5649 1 13 . 1 1 3 3 MET C C 3 174.584 174.584 175.590 -1.006 25380
5650 1 13 . 1 1 3 3 MET CA C 3 56.550 56.550 55.867 0.683 25380
5651 1 13 . 1 1 3 3 MET CB C 3 33.426 33.426 33.444 -0.018 25380
5652 1 13 . 1 1 3 3 MET H H 3 8.240 8.240 7.753 0.487 25380
5653 1 13 . 1 1 4 4 LYS N N 4 123.568 123.568 121.951 1.617 25380
5654 1 13 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.649 0.190 25380
5655 1 13 . 1 1 4 4 LYS C C 4 175.906 175.906 174.839 1.067 25380
5656 1 13 . 1 1 4 4 LYS CA C 4 54.800 54.800 55.637 -0.837 25380
5657 1 13 . 1 1 4 4 LYS CB C 4 34.900 34.900 32.285 2.615 25380
5658 1 13 . 1 1 4 4 LYS H H 4 8.351 8.351 8.342 0.009 25380
5659 1 13 . 1 1 5 5 LEU N N 5 123.568 123.568 114.673 8.895 25380
5660 1 13 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.736 -0.897 25380
5661 1 13 . 1 1 5 5 LEU C C 5 175.900 175.900 175.275 0.625 25380
5662 1 13 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.172 0.178 25380
5663 1 13 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.771 0.129 25380
5664 1 13 . 1 1 5 5 LEU H H 5 8.281 8.281 7.216 1.065 25380
5665 1 13 . 1 1 6 6 VAL N N 6 121.564 121.564 119.208 2.356 25380
5666 1 13 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.222 0.204 25380
5667 1 13 . 1 1 6 6 VAL C C 6 178.200 178.200 174.549 3.651 25380
5668 1 13 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.781 2.419 25380
5669 1 13 . 1 1 6 6 VAL CB C 6 33.200 33.200 33.955 -0.755 25380
5670 1 13 . 1 1 6 6 VAL H H 6 9.276 9.276 8.594 0.682 25380
5671 1 13 . 1 1 7 7 LEU N N 7 121.564 121.564 125.966 -4.402 25380
5672 1 13 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.264 -0.838 25380
5673 1 13 . 1 1 7 7 LEU CA C 7 63.200 63.200 52.819 10.381 25380
5674 1 13 . 1 1 7 7 LEU CB C 7 33.200 33.200 45.397 -12.197 25380
5675 1 13 . 1 1 7 7 LEU H H 7 9.276 9.276 8.514 0.762 25380
5676 1 13 . 1 1 8 8 ALA C C 8 177.040 177.040 177.829 -0.789 25380
5677 1 13 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.638 -0.937 25380
5678 1 13 . 1 1 8 8 ALA CB C 8 20.864 20.864 20.034 0.830 25380
5679 1 13 . 1 1 9 9 LYS N N 9 119.845 119.845 123.797 -3.952 25380
5680 1 13 . 1 1 9 9 LYS HA H 9 4.128 4.128 4.003 0.125 25380
5681 1 13 . 1 1 9 9 LYS C C 9 176.075 176.075 178.698 -2.623 25380
5682 1 13 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.327 -2.566 25380
5683 1 13 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.572 0.346 25380
5684 1 13 . 1 1 9 9 LYS H H 9 8.545 8.545 8.943 -0.398 25380
5685 1 13 . 1 1 10 10 ASN N N 10 119.279 119.279 116.976 2.303 25380
5686 1 13 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.510 0.135 25380
5687 1 13 . 1 1 10 10 ASN C C 10 175.443 175.443 176.982 -1.539 25380
5688 1 13 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.524 -1.867 25380
5689 1 13 . 1 1 10 10 ASN CB C 10 38.777 38.777 38.311 0.466 25380
5690 1 13 . 1 1 10 10 ASN H H 10 8.592 8.592 9.481 -0.889 25380
5691 1 13 . 1 1 11 11 THR N N 11 111.876 111.876 110.812 1.064 25380
5692 1 13 . 1 1 11 11 THR HA H 11 4.311 4.311 4.257 0.054 25380
5693 1 13 . 1 1 11 11 THR C C 11 174.666 174.666 175.950 -1.284 25380
5694 1 13 . 1 1 11 11 THR CA C 11 62.044 62.044 63.953 -1.909 25380
5695 1 13 . 1 1 11 11 THR CB C 11 69.895 69.895 69.326 0.568 25380
5696 1 13 . 1 1 11 11 THR H H 11 8.058 8.058 8.264 -0.206 25380
5697 1 13 . 1 1 12 12 ARG N N 12 121.152 121.152 119.240 1.912 25380
5698 1 13 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.448 -0.186 25380
5699 1 13 . 1 1 12 12 ARG C C 12 176.714 176.714 175.857 0.857 25380
5700 1 13 . 1 1 12 12 ARG CA C 12 56.822 56.822 55.961 0.861 25380
5701 1 13 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.923 -1.221 25380
5702 1 13 . 1 1 12 12 ARG H H 12 8.291 8.291 7.656 0.635 25380
5703 1 13 . 1 1 13 13 LYS N N 13 120.459 120.459 117.679 2.780 25380
5704 1 13 . 1 1 13 13 LYS HA H 13 3.896 3.896 3.980 -0.084 25380
5705 1 13 . 1 1 13 13 LYS C C 13 176.682 176.682 177.117 -0.435 25380
5706 1 13 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.581 -0.603 25380
5707 1 13 . 1 1 13 13 LYS CB C 13 32.498 32.498 31.580 0.918 25380
5708 1 13 . 1 1 13 13 LYS H H 13 8.286 8.286 8.230 0.056 25380
5709 1 13 . 1 1 14 14 SER N N 14 114.568 114.568 112.886 1.682 25380
5710 1 13 . 1 1 14 14 SER HA H 14 4.371 4.371 4.264 0.107 25380
5711 1 13 . 1 1 14 14 SER C C 14 173.990 173.990 175.055 -1.065 25380
5712 1 13 . 1 1 14 14 SER CA C 14 58.617 58.617 60.293 -1.676 25380
5713 1 13 . 1 1 14 14 SER CB C 14 63.933 63.933 63.300 0.632 25380
5714 1 13 . 1 1 14 14 SER H H 14 7.957 7.957 8.360 -0.403 25380
5715 1 13 . 1 1 15 15 ASP N N 15 121.565 121.565 116.576 4.989 25380
5716 1 13 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.659 -0.058 25380
5717 1 13 . 1 1 15 15 ASP C C 15 175.684 175.684 175.800 -0.116 25380
5718 1 13 . 1 1 15 15 ASP CA C 15 54.149 54.149 54.309 -0.160 25380
5719 1 13 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.503 0.726 25380
5720 1 13 . 1 1 15 15 ASP H H 15 8.166 8.166 8.220 -0.054 25380
5721 1 13 . 1 1 16 16 ALA N N 16 124.173 124.173 122.585 1.588 25380
5722 1 13 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.244 0.127 25380
5723 1 13 . 1 1 16 16 ALA C C 16 177.184 177.184 177.388 -0.204 25380
5724 1 13 . 1 1 16 16 ALA CA C 16 52.337 52.337 52.469 -0.132 25380
5725 1 13 . 1 1 16 16 ALA CB C 16 19.359 19.359 19.168 0.191 25380
5726 1 13 . 1 1 16 16 ALA H H 16 8.163 8.163 8.181 -0.018 25380
5727 1 13 . 1 1 17 17 LYS N N 17 121.152 121.152 117.636 3.516 25380
5728 1 13 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.203 0.223 25380
5729 1 13 . 1 1 17 17 LYS C C 17 175.488 175.488 176.530 -1.042 25380
5730 1 13 . 1 1 17 17 LYS CA C 17 56.205 56.205 56.644 -0.439 25380
5731 1 13 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.509 1.787 25380
5732 1 13 . 1 1 17 17 LYS H H 17 8.363 8.363 7.409 0.954 25380
5733 1 13 . 1 1 18 18 SER N N 18 116.448 116.448 113.981 2.467 25380
5734 1 13 . 1 1 18 18 SER HA H 18 5.355 5.355 4.051 1.304 25380
5735 1 13 . 1 1 18 18 SER C C 18 173.887 173.887 175.409 -1.522 25380
5736 1 13 . 1 1 18 18 SER CA C 18 57.248 57.248 59.424 -2.176 25380
5737 1 13 . 1 1 18 18 SER CB C 18 64.962 64.962 62.457 2.505 25380
5738 1 13 . 1 1 18 18 SER H H 18 8.206 8.206 8.979 -0.773 25380
5739 1 13 . 1 1 19 19 VAL N N 19 117.867 117.867 115.873 1.994 25380
5740 1 13 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.802 -0.182 25380
5741 1 13 . 1 1 19 19 VAL C C 19 174.169 174.169 177.140 -2.971 25380
5742 1 13 . 1 1 19 19 VAL CA C 19 59.546 59.546 64.766 -5.220 25380
5743 1 13 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.279 4.623 25380
5744 1 13 . 1 1 19 19 VAL H H 19 9.086 9.086 7.444 1.642 25380
5745 1 13 . 1 1 20 20 GLU N N 20 120.843 120.843 120.798 0.045 25380
5746 1 13 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.073 0.795 25380
5747 1 13 . 1 1 20 20 GLU C C 20 178.747 178.747 178.617 0.130 25380
5748 1 13 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.533 -4.981 25380
5749 1 13 . 1 1 20 20 GLU CB C 20 31.099 31.099 28.915 2.184 25380
5750 1 13 . 1 1 20 20 GLU H H 20 8.841 8.841 8.704 0.137 25380
5751 1 13 . 1 1 21 21 LEU N N 21 122.653 122.653 119.442 3.211 25380
5752 1 13 . 1 1 21 21 LEU HA H 21 3.443 3.443 4.095 -0.652 25380
5753 1 13 . 1 1 21 21 LEU C C 21 178.799 178.799 179.039 -0.240 25380
5754 1 13 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.914 0.793 25380
5755 1 13 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.546 -2.975 25380
5756 1 13 . 1 1 21 21 LEU H H 21 8.744 8.744 7.511 1.233 25380
5757 1 13 . 1 1 22 22 GLU N N 22 115.392 115.392 119.835 -4.443 25380
5758 1 13 . 1 1 22 22 GLU HA H 22 3.989 3.989 4.055 -0.066 25380
5759 1 13 . 1 1 22 22 GLU C C 22 179.328 179.328 179.154 0.174 25380
5760 1 13 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.838 0.242 25380
5761 1 13 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.511 -0.677 25380
5762 1 13 . 1 1 22 22 GLU H H 22 8.744 8.744 7.595 1.149 25380
5763 1 13 . 1 1 23 23 ASP N N 23 118.597 118.597 121.165 -2.568 25380
5764 1 13 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.450 0.161 25380
5765 1 13 . 1 1 23 23 ASP C C 23 179.139 179.139 178.835 0.304 25380
5766 1 13 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.290 0.229 25380
5767 1 13 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.462 -0.020 25380
5768 1 13 . 1 1 23 23 ASP H H 23 7.098 7.098 8.613 -1.515 25380
5769 1 13 . 1 1 24 24 LEU N N 24 119.869 119.869 121.308 -1.439 25380
5770 1 13 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.702 0.232 25380
5771 1 13 . 1 1 24 24 LEU C C 24 179.045 179.045 178.648 0.397 25380
5772 1 13 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.534 -0.985 25380
5773 1 13 . 1 1 24 24 LEU CB C 24 41.550 41.550 42.218 -0.668 25380
5774 1 13 . 1 1 24 24 LEU H H 24 7.576 7.576 8.593 -1.017 25380
5775 1 13 . 1 1 25 25 TYR N N 25 118.100 118.100 119.013 -0.913 25380
5776 1 13 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.030 1.337 25380
5777 1 13 . 1 1 25 25 TYR C C 25 177.945 177.945 177.559 0.386 25380
5778 1 13 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.911 0.695 25380
5779 1 13 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.275 -0.327 25380
5780 1 13 . 1 1 25 25 TYR H H 25 8.320 8.320 7.492 0.828 25380
5781 1 13 . 1 1 26 26 HIS N N 26 119.440 119.440 117.822 1.618 25380
5782 1 13 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.431 -0.060 25380
5783 1 13 . 1 1 26 26 HIS C C 26 176.559 176.559 178.111 -1.552 25380
5784 1 13 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.785 -0.266 25380
5785 1 13 . 1 1 26 26 HIS CB C 26 28.128 28.128 29.919 -1.790 25380
5786 1 13 . 1 1 26 26 HIS H H 26 8.383 8.383 8.578 -0.195 25380
5787 1 13 . 1 1 27 27 GLU N N 27 119.915 119.915 121.505 -1.590 25380
5788 1 13 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.033 0.225 25380
5789 1 13 . 1 1 27 27 GLU C C 27 179.163 179.163 178.536 0.627 25380
5790 1 13 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.083 0.992 25380
5791 1 13 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.541 -0.006 25380
5792 1 13 . 1 1 27 27 GLU H H 27 8.288 8.288 8.759 -0.471 25380
5793 1 13 . 1 1 28 28 PHE N N 28 120.500 120.500 121.085 -0.585 25380
5794 1 13 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.453 0.519 25380
5795 1 13 . 1 1 28 28 PHE C C 28 177.386 177.386 177.302 0.084 25380
5796 1 13 . 1 1 28 28 PHE CA C 28 60.401 60.401 59.740 0.661 25380
5797 1 13 . 1 1 28 28 PHE CB C 28 39.568 39.568 38.962 0.605 25380
5798 1 13 . 1 1 28 28 PHE H H 28 8.568 8.568 7.930 0.638 25380
5799 1 13 . 1 1 29 29 SER N N 29 114.306 114.306 114.563 -0.257 25380
5800 1 13 . 1 1 29 29 SER HA H 29 4.288 4.288 4.069 0.219 25380
5801 1 13 . 1 1 29 29 SER C C 29 175.656 175.656 176.447 -0.791 25380
5802 1 13 . 1 1 29 29 SER CA C 29 61.058 61.058 60.154 0.904 25380
5803 1 13 . 1 1 29 29 SER CB C 29 63.555 63.555 63.380 0.175 25380
5804 1 13 . 1 1 29 29 SER H H 29 8.479 8.479 7.779 0.700 25380
5805 1 13 . 1 1 30 30 GLU N N 30 118.322 118.322 120.460 -2.138 25380
5806 1 13 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.188 -0.096 25380
5807 1 13 . 1 1 30 30 GLU C C 30 177.312 177.312 176.590 0.722 25380
5808 1 13 . 1 1 30 30 GLU CA C 30 57.580 57.580 58.235 -0.655 25380
5809 1 13 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.529 -0.952 25380
5810 1 13 . 1 1 30 30 GLU H H 30 8.428 8.428 8.002 0.426 25380
5811 1 13 . 1 1 31 31 ASP N N 31 115.630 115.630 116.220 -0.590 25380
5812 1 13 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.853 -0.043 25380
5813 1 13 . 1 1 31 31 ASP C C 31 175.723 175.723 173.594 2.129 25380
5814 1 13 . 1 1 31 31 ASP CA C 31 53.974 53.974 53.200 0.774 25380
5815 1 13 . 1 1 31 31 ASP CB C 31 40.818 40.818 44.235 -3.417 25380
5816 1 13 . 1 1 31 31 ASP H H 31 7.303 7.303 8.030 -0.727 25380
5817 1 13 . 1 1 32 32 LYS N N 32 114.357 114.357 119.481 -5.124 25380
5818 1 13 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.739 -0.912 25380
5819 1 13 . 1 1 32 32 LYS C C 32 175.716 175.716 175.720 -0.004 25380
5820 1 13 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.249 0.913 25380
5821 1 13 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.901 -5.520 25380
5822 1 13 . 1 1 32 32 LYS H H 32 7.148 7.148 8.375 -1.227 25380
5823 1 13 . 1 1 33 33 ARG N N 33 120.929 120.929 122.982 -2.053 25380
5824 1 13 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.660 -0.459 25380
5825 1 13 . 1 1 33 33 ARG C C 33 173.982 173.982 173.238 0.744 25380
5826 1 13 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.378 0.816 25380
5827 1 13 . 1 1 33 33 ARG CB C 33 30.642 30.642 32.996 -2.354 25380
5828 1 13 . 1 1 33 33 ARG H H 33 7.388 7.388 8.816 -1.428 25380
5829 1 13 . 1 1 34 34 SER N N 34 115.867 115.867 115.084 0.783 25380
5830 1 13 . 1 1 34 34 SER HA H 34 5.355 5.355 5.208 0.147 25380
5831 1 13 . 1 1 34 34 SER C C 34 172.754 172.754 173.136 -0.382 25380
5832 1 13 . 1 1 34 34 SER CA C 34 58.236 58.236 57.017 1.219 25380
5833 1 13 . 1 1 34 34 SER CB C 34 65.212 65.212 66.415 -1.203 25380
5834 1 13 . 1 1 34 34 SER H H 34 8.173 8.173 8.408 -0.235 25380
5835 1 13 . 1 1 35 35 ILE N N 35 119.621 119.621 119.484 0.137 25380
5836 1 13 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.881 -0.018 25380
5837 1 13 . 1 1 35 35 ILE C C 35 174.069 174.069 174.248 -0.179 25380
5838 1 13 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.885 0.071 25380
5839 1 13 . 1 1 35 35 ILE CB C 35 40.655 40.655 42.806 -2.151 25380
5840 1 13 . 1 1 35 35 ILE H H 35 6.779 6.779 8.734 -1.955 25380
5841 1 13 . 1 1 36 36 PHE N N 36 124.305 124.305 122.934 1.371 25380
5842 1 13 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.691 -1.238 25380
5843 1 13 . 1 1 36 36 PHE C C 36 173.204 173.204 175.184 -1.980 25380
5844 1 13 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.458 -0.042 25380
5845 1 13 . 1 1 36 36 PHE CB C 36 44.817 44.817 41.730 3.087 25380
5846 1 13 . 1 1 36 36 PHE H H 36 8.411 8.411 9.207 -0.796 25380
5847 1 13 . 1 1 37 37 TYR N N 37 118.743 118.743 126.824 -8.081 25380
5848 1 13 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.080 0.490 25380
5849 1 13 . 1 1 37 37 TYR C C 37 175.455 175.455 174.063 1.392 25380
5850 1 13 . 1 1 37 37 TYR CA C 37 56.518 56.518 55.606 0.912 25380
5851 1 13 . 1 1 37 37 TYR CB C 37 40.991 40.991 39.964 1.027 25380
5852 1 13 . 1 1 37 37 TYR H H 37 8.353 8.353 9.385 -1.032 25380
5853 1 13 . 1 1 38 38 PHE N N 38 119.236 119.236 130.598 -11.362 25380
5854 1 13 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.666 0.494 25380
5855 1 13 . 1 1 38 38 PHE C C 38 174.650 174.650 173.285 1.365 25380
5856 1 13 . 1 1 38 38 PHE CA C 38 56.842 56.842 54.440 2.402 25380
5857 1 13 . 1 1 38 38 PHE CB C 38 42.619 42.619 39.160 3.459 25380
5858 1 13 . 1 1 38 38 PHE H H 38 9.756 9.756 9.481 0.275 25380
5859 1 13 . 1 1 39 39 ALA N N 39 122.516 122.516 130.457 -7.941 25380
5860 1 13 . 1 1 39 39 ALA HA H 39 4.540 4.540 5.120 -0.580 25380
5861 1 13 . 1 1 39 39 ALA C C 39 177.042 177.042 174.485 2.557 25380
5862 1 13 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.075 1.768 25380
5863 1 13 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.926 -3.348 25380
5864 1 13 . 1 1 39 39 ALA H H 39 7.738 7.738 8.906 -1.168 25380
5865 1 13 . 1 1 40 40 PRO C C 40 175.411 175.411 177.026 -1.615 25380
5866 1 13 . 1 1 40 40 PRO CA C 40 64.288 64.288 63.006 1.282 25380
5867 1 13 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.823 -1.719 25380
5868 1 13 . 1 1 41 41 THR N N 41 105.878 105.878 118.174 -12.296 25380
5869 1 13 . 1 1 41 41 THR HA H 41 4.190 4.190 4.049 0.141 25380
5870 1 13 . 1 1 41 41 THR C C 41 176.400 176.400 176.622 -0.222 25380
5871 1 13 . 1 1 41 41 THR CA C 41 61.937 61.937 65.410 -3.473 25380
5872 1 13 . 1 1 41 41 THR CB C 41 68.331 68.331 68.840 -0.509 25380
5873 1 13 . 1 1 41 41 THR H H 41 6.715 6.715 8.862 -2.147 25380
5874 1 13 . 1 1 42 42 ASN N N 42 118.863 118.863 118.936 -0.073 25380
5875 1 13 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.544 -0.009 25380
5876 1 13 . 1 1 42 42 ASN C C 42 173.764 173.764 175.843 -2.079 25380
5877 1 13 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.623 -1.447 25380
5878 1 13 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.817 3.898 25380
5879 1 13 . 1 1 42 42 ASN H H 42 7.153 7.153 8.731 -1.578 25380
5880 1 13 . 1 1 43 43 ALA N N 43 126.174 126.174 118.873 7.301 25380
5881 1 13 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.393 0.032 25380
5882 1 13 . 1 1 43 43 ALA C C 43 179.308 179.308 177.189 2.119 25380
5883 1 13 . 1 1 43 43 ALA CA C 43 51.982 51.982 51.960 0.022 25380
5884 1 13 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.448 -1.154 25380
5885 1 13 . 1 1 43 43 ALA H H 43 9.465 9.465 8.002 1.463 25380
5886 1 13 . 1 1 44 44 HIS N N 44 126.251 126.251 115.277 10.974 25380
5887 1 13 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.098 -0.271 25380
5888 1 13 . 1 1 44 44 HIS C C 44 177.407 177.407 176.737 0.670 25380
5889 1 13 . 1 1 44 44 HIS CA C 44 61.025 61.025 58.559 2.466 25380
5890 1 13 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.919 0.711 25380
5891 1 13 . 1 1 44 44 HIS H H 44 9.407 9.407 8.181 1.226 25380
5892 1 13 . 1 1 45 45 LYS N N 45 114.990 114.990 120.546 -5.556 25380
5893 1 13 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.005 -0.122 25380
5894 1 13 . 1 1 45 45 LYS C C 45 178.284 178.284 177.844 0.440 25380
5895 1 13 . 1 1 45 45 LYS CA C 45 59.249 59.249 59.820 -0.571 25380
5896 1 13 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.237 -0.403 25380
5897 1 13 . 1 1 45 45 LYS H H 45 8.960 8.960 8.349 0.611 25380
5898 1 13 . 1 1 46 46 ASP N N 46 120.411 120.411 118.849 1.562 25380
5899 1 13 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.402 0.024 25380
5900 1 13 . 1 1 46 46 ASP C C 46 177.773 177.773 178.226 -0.453 25380
5901 1 13 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.114 -0.098 25380
5902 1 13 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.280 -0.383 25380
5903 1 13 . 1 1 46 46 ASP H H 46 6.777 6.777 8.423 -1.646 25380
5904 1 13 . 1 1 47 47 MET N N 47 118.178 118.178 120.274 -2.096 25380
5905 1 13 . 1 1 47 47 MET HA H 47 3.879 3.879 3.775 0.104 25380
5906 1 13 . 1 1 47 47 MET C C 47 179.499 179.499 177.727 1.772 25380
5907 1 13 . 1 1 47 47 MET CA C 47 56.052 56.052 59.306 -3.253 25380
5908 1 13 . 1 1 47 47 MET CB C 47 29.601 29.601 32.413 -2.812 25380
5909 1 13 . 1 1 47 47 MET H H 47 7.367 7.367 8.255 -0.888 25380
5910 1 13 . 1 1 48 48 LEU N N 48 117.665 117.665 119.102 -1.437 25380
5911 1 13 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.763 0.084 25380
5912 1 13 . 1 1 48 48 LEU C C 48 179.843 179.843 178.708 1.135 25380
5913 1 13 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.461 0.119 25380
5914 1 13 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.333 -0.380 25380
5915 1 13 . 1 1 48 48 LEU H H 48 7.672 7.672 7.463 0.209 25380
5916 1 13 . 1 1 49 49 LYS N N 49 119.326 119.326 118.609 0.717 25380
5917 1 13 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.525 0.602 25380
5918 1 13 . 1 1 49 49 LYS C C 49 179.684 179.684 178.315 1.369 25380
5919 1 13 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.002 -0.203 25380
5920 1 13 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.817 -0.364 25380
5921 1 13 . 1 1 49 49 LYS H H 49 7.420 7.420 7.683 -0.263 25380
5922 1 13 . 1 1 50 50 ALA N N 50 122.022 122.022 122.133 -0.111 25380
5923 1 13 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.587 0.456 25380
5924 1 13 . 1 1 50 50 ALA C C 50 178.818 178.818 178.691 0.127 25380
5925 1 13 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.703 0.466 25380
5926 1 13 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.666 -0.366 25380
5927 1 13 . 1 1 50 50 ALA H H 50 7.551 7.551 7.760 -0.209 25380
5928 1 13 . 1 1 51 51 VAL N N 51 118.165 118.165 117.874 0.291 25380
5929 1 13 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.555 -0.113 25380
5930 1 13 . 1 1 51 51 VAL C C 51 178.646 178.646 178.003 0.643 25380
5931 1 13 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.304 0.902 25380
5932 1 13 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.783 0.670 25380
5933 1 13 . 1 1 51 51 VAL H H 51 7.226 7.226 7.371 -0.145 25380
5934 1 13 . 1 1 52 52 ASP N N 52 122.298 122.298 120.327 1.971 25380
5935 1 13 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.334 0.037 25380
5936 1 13 . 1 1 52 52 ASP C C 52 177.898 177.898 179.118 -1.220 25380
5937 1 13 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.016 0.555 25380
5938 1 13 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.153 0.233 25380
5939 1 13 . 1 1 52 52 ASP H H 52 8.232 8.232 7.197 1.035 25380
5940 1 13 . 1 1 53 53 PHE N N 53 121.541 121.541 119.974 1.567 25380
5941 1 13 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.441 -0.120 25380
5942 1 13 . 1 1 53 53 PHE C C 53 177.224 177.224 178.219 -0.995 25380
5943 1 13 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.816 2.264 25380
5944 1 13 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.873 1.827 25380
5945 1 13 . 1 1 53 53 PHE H H 53 8.240 8.240 7.905 0.335 25380
5946 1 13 . 1 1 54 54 PHE N N 54 115.925 115.925 117.032 -1.107 25380
5947 1 13 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.342 -0.687 25380
5948 1 13 . 1 1 54 54 PHE C C 54 178.269 178.269 177.286 0.983 25380
5949 1 13 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.783 4.417 25380
5950 1 13 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.990 0.588 25380
5951 1 13 . 1 1 54 54 PHE H H 54 7.755 7.755 7.517 0.238 25380
5952 1 13 . 1 1 55 55 LYS N N 55 120.251 120.251 117.580 2.671 25380
5953 1 13 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.123 0.303 25380
5954 1 13 . 1 1 55 55 LYS C C 55 181.484 181.484 178.488 2.996 25380
5955 1 13 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.595 1.034 25380
5956 1 13 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.313 -0.574 25380
5957 1 13 . 1 1 55 55 LYS H H 55 8.213 8.213 7.563 0.650 25380
5958 1 13 . 1 1 56 56 GLU N N 56 120.146 120.146 117.969 2.177 25380
5959 1 13 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.211 -0.218 25380
5960 1 13 . 1 1 56 56 GLU C C 56 178.085 178.085 177.489 0.596 25380
5961 1 13 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.596 0.192 25380
5962 1 13 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.349 -1.754 25380
5963 1 13 . 1 1 56 56 GLU H H 56 7.850 7.850 7.871 -0.021 25380
5964 1 13 . 1 1 57 57 LYS N N 57 115.940 115.940 118.955 -3.015 25380
5965 1 13 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.593 -0.490 25380
5966 1 13 . 1 1 57 57 LYS C C 57 176.225 176.225 176.784 -0.559 25380
5967 1 13 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.056 -0.484 25380
5968 1 13 . 1 1 57 57 LYS CB C 57 32.036 32.036 34.084 -2.048 25380
5969 1 13 . 1 1 57 57 LYS H H 57 7.019 7.019 8.135 -1.116 25380
5970 1 13 . 1 1 58 58 GLY N N 58 106.593 106.593 111.841 -5.248 25380
5971 1 13 . 1 1 58 58 GLY C C 58 174.350 174.350 175.040 -0.690 25380
5972 1 13 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.829 -0.329 25380
5973 1 13 . 1 1 58 58 GLY H H 58 7.883 7.883 8.695 -0.812 25380
5974 1 13 . 1 1 59 59 HIS N N 59 117.962 117.962 117.159 0.803 25380
5975 1 13 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.850 0.017 25380
5976 1 13 . 1 1 59 59 HIS C C 59 173.271 173.271 176.173 -2.902 25380
5977 1 13 . 1 1 59 59 HIS CA C 59 54.778 54.778 57.442 -2.664 25380
5978 1 13 . 1 1 59 59 HIS CB C 59 31.685 31.685 30.343 1.342 25380
5979 1 13 . 1 1 59 59 HIS H H 59 8.218 8.218 7.990 0.228 25380
5980 1 13 . 1 1 60 60 THR N N 60 119.624 119.624 112.129 7.495 25380
5981 1 13 . 1 1 60 60 THR HA H 60 4.430 4.430 3.960 0.470 25380
5982 1 13 . 1 1 60 60 THR C C 60 171.430 171.430 174.187 -2.757 25380
5983 1 13 . 1 1 60 60 THR CA C 60 63.480 63.480 62.705 0.775 25380
5984 1 13 . 1 1 60 60 THR CB C 60 69.761 69.761 69.425 0.336 25380
5985 1 13 . 1 1 60 60 THR H H 60 8.780 8.780 7.994 0.786 25380
5986 1 13 . 1 1 61 61 ALA N N 61 126.706 126.706 129.044 -2.338 25380
5987 1 13 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.239 1.007 25380
5988 1 13 . 1 1 61 61 ALA C C 61 174.753 174.753 176.801 -2.048 25380
5989 1 13 . 1 1 61 61 ALA CA C 61 49.772 49.772 53.590 -3.818 25380
5990 1 13 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.219 2.670 25380
5991 1 13 . 1 1 61 61 ALA H H 61 7.795 7.795 8.640 -0.845 25380
5992 1 13 . 1 1 62 62 TYR N N 62 117.859 117.859 115.127 2.732 25380
5993 1 13 . 1 1 62 62 TYR C C 62 173.431 173.431 172.886 0.545 25380
5994 1 13 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.424 -0.777 25380
5995 1 13 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.254 -1.705 25380
5996 1 13 . 1 1 62 62 TYR H H 62 8.711 8.711 7.664 1.047 25380
5997 1 13 . 1 1 63 63 LEU N N 63 125.044 125.044 125.174 -0.130 25380
5998 1 13 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.625 0.786 25380
5999 1 13 . 1 1 63 63 LEU C C 63 175.319 175.319 173.996 1.323 25380
6000 1 13 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.522 -0.292 25380
6001 1 13 . 1 1 63 63 LEU CB C 63 45.701 45.701 44.802 0.899 25380
6002 1 13 . 1 1 63 63 LEU H H 63 8.746 8.746 7.386 1.360 25380
6003 1 13 . 1 1 64 64 ASP N N 64 125.463 125.463 124.887 0.576 25380
6004 1 13 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.990 0.209 25380
6005 1 13 . 1 1 64 64 ASP C C 64 174.512 174.512 174.670 -0.158 25380
6006 1 13 . 1 1 64 64 ASP CA C 64 52.700 52.700 51.852 0.848 25380
6007 1 13 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.869 -0.915 25380
6008 1 13 . 1 1 64 64 ASP H H 64 9.293 9.293 8.824 0.469 25380
6009 1 13 . 1 1 65 65 GLU N N 65 120.711 120.711 119.733 0.978 25380
6010 1 13 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.394 0.673 25380
6011 1 13 . 1 1 65 65 GLU C C 65 175.652 175.652 176.485 -0.833 25380
6012 1 13 . 1 1 65 65 GLU CA C 65 55.643 55.643 56.603 -0.960 25380
6013 1 13 . 1 1 65 65 GLU CB C 65 30.455 30.455 31.041 -0.586 25380
6014 1 13 . 1 1 65 65 GLU H H 65 8.715 8.715 8.554 0.161 25380
6015 1 13 . 1 1 66 66 VAL N N 66 122.936 122.936 117.030 5.906 25380
6016 1 13 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.232 0.198 25380
6017 1 13 . 1 1 66 66 VAL C C 66 175.065 175.065 176.037 -0.972 25380
6018 1 13 . 1 1 66 66 VAL CA C 66 60.991 60.991 61.990 -0.999 25380
6019 1 13 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.447 1.833 25380
6020 1 13 . 1 1 66 66 VAL H H 66 9.156 9.156 8.400 0.756 25380
6021 1 13 . 1 1 67 67 ARG N N 67 126.104 126.104 125.063 1.041 25380
6022 1 13 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.454 0.087 25380
6023 1 13 . 1 1 67 67 ARG C C 67 176.708 176.708 175.629 1.079 25380
6024 1 13 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.271 0.809 25380
6025 1 13 . 1 1 67 67 ARG CB C 67 30.908 30.908 28.497 2.411 25380
6026 1 13 . 1 1 67 67 ARG H H 67 8.734 8.734 8.745 -0.011 25380
6027 1 13 . 1 1 68 68 VAL N N 68 120.707 120.707 115.997 4.710 25380
6028 1 13 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.583 -0.431 25380
6029 1 13 . 1 1 68 68 VAL C C 68 175.931 175.931 175.856 0.075 25380
6030 1 13 . 1 1 68 68 VAL CA C 68 62.776 62.776 60.306 2.470 25380
6031 1 13 . 1 1 68 68 VAL CB C 68 32.489 32.489 30.838 1.651 25380
6032 1 13 . 1 1 68 68 VAL H H 68 8.384 8.384 7.728 0.656 25380
6033 1 13 . 1 1 69 69 SER N N 69 116.156 116.156 118.735 -2.579 25380
6034 1 13 . 1 1 69 69 SER HA H 69 4.693 4.693 4.355 0.338 25380
6035 1 13 . 1 1 69 69 SER C C 69 174.544 174.544 176.088 -1.544 25380
6036 1 13 . 1 1 69 69 SER CA C 69 57.754 57.754 60.952 -3.198 25380
6037 1 13 . 1 1 69 69 SER CB C 69 64.831 64.831 62.671 2.160 25380
6038 1 13 . 1 1 69 69 SER H H 69 8.067 8.067 8.003 0.064 25380
6039 1 13 . 1 1 70 70 THR N N 70 110.753 110.753 117.533 -6.780 25380
6040 1 13 . 1 1 70 70 THR HA H 70 4.152 4.152 4.130 0.022 25380
6041 1 13 . 1 1 70 70 THR C C 70 174.865 174.865 175.424 -0.559 25380
6042 1 13 . 1 1 70 70 THR CA C 70 63.831 63.831 65.430 -1.599 25380
6043 1 13 . 1 1 70 70 THR CB C 70 68.956 68.956 68.588 0.368 25380
6044 1 13 . 1 1 70 70 THR H H 70 8.095 8.095 8.176 -0.081 25380
6045 1 13 . 1 1 71 71 ASP N N 71 121.817 121.817 119.946 1.871 25380
6046 1 13 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.587 0.003 25380
6047 1 13 . 1 1 71 71 ASP C C 71 176.746 176.746 176.519 0.227 25380
6048 1 13 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.158 -1.894 25380
6049 1 13 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.672 0.753 25380
6050 1 13 . 1 1 71 71 ASP H H 71 8.076 8.076 8.256 -0.180 25380
6051 1 13 . 1 1 72 72 GLU N N 72 123.635 123.635 116.706 6.929 25380
6052 1 13 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.373 -0.380 25380
6053 1 13 . 1 1 72 72 GLU C C 72 176.971 176.971 175.685 1.286 25380
6054 1 13 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.518 1.701 25380
6055 1 13 . 1 1 72 72 GLU CB C 72 29.702 29.702 32.097 -2.395 25380
6056 1 13 . 1 1 72 72 GLU H H 72 8.514 8.514 8.381 0.133 25380
6057 1 13 . 1 1 73 73 LYS N N 73 117.857 117.857 119.442 -1.585 25380
6058 1 13 . 1 1 73 73 LYS HA H 73 4.643 4.643 3.983 0.660 25380
6059 1 13 . 1 1 73 73 LYS C C 73 176.508 176.508 175.375 1.133 25380
6060 1 13 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.175 -0.095 25380
6061 1 13 . 1 1 73 73 LYS CB C 73 32.203 32.203 30.828 1.375 25380
6062 1 13 . 1 1 73 73 LYS H H 73 8.423 8.423 7.852 0.571 25380
6063 1 13 . 1 1 74 74 ASP N N 74 120.580 120.580 115.817 4.763 25380
6064 1 13 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.548 0.210 25380
6065 1 13 . 1 1 74 74 ASP C C 74 174.059 174.059 175.381 -1.322 25380
6066 1 13 . 1 1 74 74 ASP CA C 74 53.279 53.279 56.074 -2.795 25380
6067 1 13 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.116 -0.538 25380
6068 1 13 . 1 1 74 74 ASP H H 74 7.918 7.918 8.578 -0.660 25380
6069 1 13 . 1 1 75 75 PHE N N 75 118.513 118.513 118.183 0.330 25380
6070 1 13 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.700 -0.337 25380
6071 1 13 . 1 1 75 75 PHE C C 75 173.038 173.038 175.347 -2.309 25380
6072 1 13 . 1 1 75 75 PHE CA C 75 55.522 55.522 56.506 -0.984 25380
6073 1 13 . 1 1 75 75 PHE CB C 75 41.714 41.714 41.014 0.700 25380
6074 1 13 . 1 1 75 75 PHE H H 75 7.397 7.397 7.622 -0.225 25380
6075 1 13 . 1 1 76 76 LEU N N 76 116.773 116.773 124.088 -7.315 25380
6076 1 13 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.842 -0.199 25380
6077 1 13 . 1 1 76 76 LEU C C 76 177.553 177.553 175.837 1.716 25380
6078 1 13 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.363 -0.744 25380
6079 1 13 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.352 2.349 25380
6080 1 13 . 1 1 76 76 LEU H H 76 8.774 8.774 9.159 -0.385 25380
6081 1 13 . 1 1 77 77 TYR N N 77 118.377 118.377 126.159 -7.782 25380
6082 1 13 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.917 0.498 25380
6083 1 13 . 1 1 77 77 TYR C C 77 175.479 175.479 173.331 2.148 25380
6084 1 13 . 1 1 77 77 TYR CA C 77 58.391 58.391 55.834 2.557 25380
6085 1 13 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.526 0.574 25380
6086 1 13 . 1 1 77 77 TYR H H 77 8.589 8.589 9.265 -0.676 25380
6087 1 13 . 1 1 78 78 GLU N N 78 123.875 123.875 129.119 -5.244 25380
6088 1 13 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.656 0.317 25380
6089 1 13 . 1 1 78 78 GLU C C 78 174.120 174.120 173.436 0.684 25380
6090 1 13 . 1 1 78 78 GLU CA C 78 54.378 54.378 54.364 0.014 25380
6091 1 13 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.712 -1.072 25380
6092 1 13 . 1 1 78 78 GLU H H 78 9.576 9.576 8.721 0.855 25380
6093 1 13 . 1 1 79 79 LEU N N 79 128.661 128.661 126.035 2.626 25380
6094 1 13 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.347 0.942 25380
6095 1 13 . 1 1 79 79 LEU C C 79 174.219 174.219 174.896 -0.677 25380
6096 1 13 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.794 -0.645 25380
6097 1 13 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.475 2.155 25380
6098 1 13 . 1 1 79 79 LEU H H 79 9.139 9.139 8.606 0.533 25380
6099 1 13 . 1 1 80 80 HIS N N 80 124.886 124.886 122.625 2.261 25380
6100 1 13 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.839 0.591 25380
6101 1 13 . 1 1 80 80 HIS C C 80 173.346 173.346 175.120 -1.774 25380
6102 1 13 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.787 -1.638 25380
6103 1 13 . 1 1 80 80 HIS CB C 80 30.768 30.768 31.100 -0.332 25380
6104 1 13 . 1 1 80 80 HIS H H 80 8.897 8.897 9.108 -0.211 25380
6105 1 13 . 1 1 81 81 ILE N N 81 125.173 125.173 121.992 3.181 25380
6106 1 13 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.455 0.835 25380
6107 1 13 . 1 1 81 81 ILE C C 81 174.600 174.600 175.230 -0.630 25380
6108 1 13 . 1 1 81 81 ILE CA C 81 60.500 60.500 61.377 -0.877 25380
6109 1 13 . 1 1 81 81 ILE CB C 81 39.700 39.700 35.111 4.589 25380
6110 1 13 . 1 1 81 81 ILE H H 81 8.909 8.909 7.867 1.042 25380
6111 1 14 . 1 1 2 2 HIS N N 2 120.430 120.430 122.747 -2.317 25380
6112 1 14 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.844 -0.109 25380
6113 1 14 . 1 1 2 2 HIS C C 2 173.884 173.884 174.062 -0.178 25380
6114 1 14 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.251 -1.199 25380
6115 1 14 . 1 1 2 2 HIS CB C 2 28.666 28.666 30.357 -1.690 25380
6116 1 14 . 1 1 2 2 HIS H H 2 8.678 8.678 8.544 0.134 25380
6117 1 14 . 1 1 3 3 MET N N 3 122.377 122.377 123.418 -1.041 25380
6118 1 14 . 1 1 3 3 MET HA H 3 4.207 4.207 4.756 -0.549 25380
6119 1 14 . 1 1 3 3 MET C C 3 174.584 174.584 176.235 -1.651 25380
6120 1 14 . 1 1 3 3 MET CA C 3 56.550 56.550 54.889 1.661 25380
6121 1 14 . 1 1 3 3 MET CB C 3 33.426 33.426 33.386 0.040 25380
6122 1 14 . 1 1 3 3 MET H H 3 8.240 8.240 8.738 -0.498 25380
6123 1 14 . 1 1 4 4 LYS N N 4 123.568 123.568 120.440 3.128 25380
6124 1 14 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.322 0.517 25380
6125 1 14 . 1 1 4 4 LYS C C 4 175.906 175.906 175.173 0.733 25380
6126 1 14 . 1 1 4 4 LYS CA C 4 54.800 54.800 56.356 -1.556 25380
6127 1 14 . 1 1 4 4 LYS CB C 4 34.900 34.900 32.765 2.135 25380
6128 1 14 . 1 1 4 4 LYS H H 4 8.351 8.351 8.229 0.122 25380
6129 1 14 . 1 1 5 5 LEU N N 5 123.568 123.568 115.260 8.308 25380
6130 1 14 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.820 -0.981 25380
6131 1 14 . 1 1 5 5 LEU C C 5 175.900 175.900 175.583 0.317 25380
6132 1 14 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.197 0.153 25380
6133 1 14 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.440 0.460 25380
6134 1 14 . 1 1 5 5 LEU H H 5 8.281 8.281 7.348 0.933 25380
6135 1 14 . 1 1 6 6 VAL N N 6 121.564 121.564 118.895 2.669 25380
6136 1 14 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.576 -0.150 25380
6137 1 14 . 1 1 6 6 VAL C C 6 178.200 178.200 175.162 3.038 25380
6138 1 14 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.295 2.905 25380
6139 1 14 . 1 1 6 6 VAL CB C 6 33.200 33.200 35.479 -2.279 25380
6140 1 14 . 1 1 6 6 VAL H H 6 9.276 9.276 9.144 0.132 25380
6141 1 14 . 1 1 7 7 LEU N N 7 121.564 121.564 125.020 -3.456 25380
6142 1 14 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.326 -0.900 25380
6143 1 14 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.199 10.001 25380
6144 1 14 . 1 1 7 7 LEU CB C 7 33.200 33.200 45.085 -11.885 25380
6145 1 14 . 1 1 7 7 LEU H H 7 9.276 9.276 8.813 0.463 25380
6146 1 14 . 1 1 8 8 ALA C C 8 177.040 177.040 177.818 -0.778 25380
6147 1 14 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.177 -0.476 25380
6148 1 14 . 1 1 8 8 ALA CB C 8 20.864 20.864 20.174 0.690 25380
6149 1 14 . 1 1 9 9 LYS N N 9 119.845 119.845 123.942 -4.097 25380
6150 1 14 . 1 1 9 9 LYS HA H 9 4.128 4.128 3.937 0.191 25380
6151 1 14 . 1 1 9 9 LYS C C 9 176.075 176.075 178.491 -2.416 25380
6152 1 14 . 1 1 9 9 LYS CA C 9 56.761 56.761 60.003 -3.242 25380
6153 1 14 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.577 0.342 25380
6154 1 14 . 1 1 9 9 LYS H H 9 8.545 8.545 8.807 -0.262 25380
6155 1 14 . 1 1 10 10 ASN N N 10 119.279 119.279 117.619 1.660 25380
6156 1 14 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.528 0.117 25380
6157 1 14 . 1 1 10 10 ASN C C 10 175.443 175.443 177.530 -2.087 25380
6158 1 14 . 1 1 10 10 ASN CA C 10 53.657 53.657 56.035 -2.378 25380
6159 1 14 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.798 0.979 25380
6160 1 14 . 1 1 10 10 ASN H H 10 8.592 8.592 9.045 -0.453 25380
6161 1 14 . 1 1 11 11 THR N N 11 111.876 111.876 111.838 0.038 25380
6162 1 14 . 1 1 11 11 THR HA H 11 4.311 4.311 4.128 0.183 25380
6163 1 14 . 1 1 11 11 THR C C 11 174.666 174.666 175.975 -1.309 25380
6164 1 14 . 1 1 11 11 THR CA C 11 62.044 62.044 64.313 -2.269 25380
6165 1 14 . 1 1 11 11 THR CB C 11 69.895 69.895 68.910 0.985 25380
6166 1 14 . 1 1 11 11 THR H H 11 8.058 8.058 8.294 -0.236 25380
6167 1 14 . 1 1 12 12 ARG N N 12 121.152 121.152 120.107 1.045 25380
6168 1 14 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.322 -0.060 25380
6169 1 14 . 1 1 12 12 ARG C C 12 176.714 176.714 176.584 0.130 25380
6170 1 14 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.651 0.171 25380
6171 1 14 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.205 -0.503 25380
6172 1 14 . 1 1 12 12 ARG H H 12 8.291 8.291 7.685 0.606 25380
6173 1 14 . 1 1 13 13 LYS N N 13 120.459 120.459 117.849 2.610 25380
6174 1 14 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.035 -0.139 25380
6175 1 14 . 1 1 13 13 LYS C C 13 176.682 176.682 176.404 0.278 25380
6176 1 14 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.207 -0.229 25380
6177 1 14 . 1 1 13 13 LYS CB C 13 32.498 32.498 31.145 1.353 25380
6178 1 14 . 1 1 13 13 LYS H H 13 8.286 8.286 8.644 -0.358 25380
6179 1 14 . 1 1 14 14 SER N N 14 114.568 114.568 114.421 0.147 25380
6180 1 14 . 1 1 14 14 SER HA H 14 4.371 4.371 4.417 -0.046 25380
6181 1 14 . 1 1 14 14 SER C C 14 173.990 173.990 174.849 -0.859 25380
6182 1 14 . 1 1 14 14 SER CA C 14 58.617 58.617 59.411 -0.794 25380
6183 1 14 . 1 1 14 14 SER CB C 14 63.933 63.933 63.962 -0.029 25380
6184 1 14 . 1 1 14 14 SER H H 14 7.957 7.957 8.347 -0.390 25380
6185 1 14 . 1 1 15 15 ASP N N 15 121.565 121.565 119.424 2.141 25380
6186 1 14 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.713 -0.112 25380
6187 1 14 . 1 1 15 15 ASP C C 15 175.684 175.684 176.751 -1.067 25380
6188 1 14 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.712 0.437 25380
6189 1 14 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.474 0.755 25380
6190 1 14 . 1 1 15 15 ASP H H 15 8.166 8.166 8.379 -0.213 25380
6191 1 14 . 1 1 16 16 ALA N N 16 124.173 124.173 123.437 0.736 25380
6192 1 14 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.130 0.241 25380
6193 1 14 . 1 1 16 16 ALA C C 16 177.184 177.184 179.071 -1.887 25380
6194 1 14 . 1 1 16 16 ALA CA C 16 52.337 52.337 54.200 -1.863 25380
6195 1 14 . 1 1 16 16 ALA CB C 16 19.359 19.359 18.785 0.574 25380
6196 1 14 . 1 1 16 16 ALA H H 16 8.163 8.163 8.277 -0.114 25380
6197 1 14 . 1 1 17 17 LYS N N 17 121.152 121.152 119.614 1.538 25380
6198 1 14 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.162 0.264 25380
6199 1 14 . 1 1 17 17 LYS C C 17 175.488 175.488 178.580 -3.092 25380
6200 1 14 . 1 1 17 17 LYS CA C 17 56.205 56.205 59.160 -2.955 25380
6201 1 14 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.449 1.847 25380
6202 1 14 . 1 1 17 17 LYS H H 17 8.363 8.363 8.343 0.020 25380
6203 1 14 . 1 1 18 18 SER N N 18 116.448 116.448 114.774 1.674 25380
6204 1 14 . 1 1 18 18 SER HA H 18 5.355 5.355 4.181 1.174 25380
6205 1 14 . 1 1 18 18 SER C C 18 173.887 173.887 176.439 -2.552 25380
6206 1 14 . 1 1 18 18 SER CA C 18 57.248 57.248 61.217 -3.969 25380
6207 1 14 . 1 1 18 18 SER CB C 18 64.962 64.962 62.734 2.228 25380
6208 1 14 . 1 1 18 18 SER H H 18 8.206 8.206 7.839 0.367 25380
6209 1 14 . 1 1 19 19 VAL N N 19 117.867 117.867 121.551 -3.684 25380
6210 1 14 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.758 -0.138 25380
6211 1 14 . 1 1 19 19 VAL C C 19 174.169 174.169 177.974 -3.805 25380
6212 1 14 . 1 1 19 19 VAL CA C 19 59.546 59.546 66.007 -6.461 25380
6213 1 14 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.102 4.800 25380
6214 1 14 . 1 1 19 19 VAL H H 19 9.086 9.086 7.328 1.758 25380
6215 1 14 . 1 1 20 20 GLU N N 20 120.843 120.843 120.055 0.788 25380
6216 1 14 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.072 0.796 25380
6217 1 14 . 1 1 20 20 GLU C C 20 178.747 178.747 179.020 -0.273 25380
6218 1 14 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.447 -4.895 25380
6219 1 14 . 1 1 20 20 GLU CB C 20 31.099 31.099 28.805 2.294 25380
6220 1 14 . 1 1 20 20 GLU H H 20 8.841 8.841 7.876 0.965 25380
6221 1 14 . 1 1 21 21 LEU N N 21 122.653 122.653 120.600 2.053 25380
6222 1 14 . 1 1 21 21 LEU HA H 21 3.443 3.443 3.995 -0.552 25380
6223 1 14 . 1 1 21 21 LEU C C 21 178.799 178.799 179.490 -0.691 25380
6224 1 14 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.862 0.845 25380
6225 1 14 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.818 -3.247 25380
6226 1 14 . 1 1 21 21 LEU H H 21 8.744 8.744 7.412 1.332 25380
6227 1 14 . 1 1 22 22 GLU N N 22 115.392 115.392 118.707 -3.315 25380
6228 1 14 . 1 1 22 22 GLU HA H 22 3.989 3.989 3.947 0.042 25380
6229 1 14 . 1 1 22 22 GLU C C 22 179.328 179.328 178.673 0.655 25380
6230 1 14 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.160 0.920 25380
6231 1 14 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.348 -0.514 25380
6232 1 14 . 1 1 22 22 GLU H H 22 8.744 8.744 8.009 0.735 25380
6233 1 14 . 1 1 23 23 ASP N N 23 118.597 118.597 121.036 -2.439 25380
6234 1 14 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.332 0.279 25380
6235 1 14 . 1 1 23 23 ASP C C 23 179.139 179.139 178.473 0.666 25380
6236 1 14 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.173 0.346 25380
6237 1 14 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.328 0.114 25380
6238 1 14 . 1 1 23 23 ASP H H 23 7.098 7.098 8.493 -1.395 25380
6239 1 14 . 1 1 24 24 LEU N N 24 119.869 119.869 120.483 -0.614 25380
6240 1 14 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.518 0.416 25380
6241 1 14 . 1 1 24 24 LEU C C 24 179.045 179.045 178.748 0.297 25380
6242 1 14 . 1 1 24 24 LEU CA C 24 57.549 57.549 57.920 -0.371 25380
6243 1 14 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.342 0.208 25380
6244 1 14 . 1 1 24 24 LEU H H 24 7.576 7.576 7.955 -0.379 25380
6245 1 14 . 1 1 25 25 TYR N N 25 118.100 118.100 117.168 0.932 25380
6246 1 14 . 1 1 25 25 TYR HA H 25 4.367 4.367 2.990 1.377 25380
6247 1 14 . 1 1 25 25 TYR C C 25 177.945 177.945 178.176 -0.231 25380
6248 1 14 . 1 1 25 25 TYR CA C 25 62.606 62.606 62.593 0.013 25380
6249 1 14 . 1 1 25 25 TYR CB C 25 37.948 37.948 37.805 0.143 25380
6250 1 14 . 1 1 25 25 TYR H H 25 8.320 8.320 7.299 1.021 25380
6251 1 14 . 1 1 26 26 HIS N N 26 119.440 119.440 118.051 1.389 25380
6252 1 14 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.388 -0.017 25380
6253 1 14 . 1 1 26 26 HIS C C 26 176.559 176.559 178.220 -1.661 25380
6254 1 14 . 1 1 26 26 HIS CA C 26 59.519 59.519 58.232 1.287 25380
6255 1 14 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.207 -2.079 25380
6256 1 14 . 1 1 26 26 HIS H H 26 8.383 8.383 8.307 0.076 25380
6257 1 14 . 1 1 27 27 GLU N N 27 119.915 119.915 120.358 -0.443 25380
6258 1 14 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.025 0.233 25380
6259 1 14 . 1 1 27 27 GLU C C 27 179.163 179.163 178.662 0.501 25380
6260 1 14 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.240 0.835 25380
6261 1 14 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.462 0.073 25380
6262 1 14 . 1 1 27 27 GLU H H 27 8.288 8.288 8.491 -0.203 25380
6263 1 14 . 1 1 28 28 PHE N N 28 120.500 120.500 119.941 0.559 25380
6264 1 14 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.355 0.617 25380
6265 1 14 . 1 1 28 28 PHE C C 28 177.386 177.386 176.559 0.827 25380
6266 1 14 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.272 0.129 25380
6267 1 14 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.063 0.505 25380
6268 1 14 . 1 1 28 28 PHE H H 28 8.568 8.568 7.654 0.914 25380
6269 1 14 . 1 1 29 29 SER N N 29 114.306 114.306 114.205 0.101 25380
6270 1 14 . 1 1 29 29 SER HA H 29 4.288 4.288 4.393 -0.105 25380
6271 1 14 . 1 1 29 29 SER C C 29 175.656 175.656 176.565 -0.909 25380
6272 1 14 . 1 1 29 29 SER CA C 29 61.058 61.058 60.183 0.875 25380
6273 1 14 . 1 1 29 29 SER CB C 29 63.555 63.555 63.859 -0.304 25380
6274 1 14 . 1 1 29 29 SER H H 29 8.479 8.479 7.958 0.521 25380
6275 1 14 . 1 1 30 30 GLU N N 30 118.322 118.322 120.325 -2.003 25380
6276 1 14 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.297 -0.205 25380
6277 1 14 . 1 1 30 30 GLU C C 30 177.312 177.312 176.651 0.661 25380
6278 1 14 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.762 -0.182 25380
6279 1 14 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.613 -1.036 25380
6280 1 14 . 1 1 30 30 GLU H H 30 8.428 8.428 8.390 0.038 25380
6281 1 14 . 1 1 31 31 ASP N N 31 115.630 115.630 116.119 -0.489 25380
6282 1 14 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.799 0.011 25380
6283 1 14 . 1 1 31 31 ASP C C 31 175.723 175.723 173.984 1.739 25380
6284 1 14 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.786 1.188 25380
6285 1 14 . 1 1 31 31 ASP CB C 31 40.818 40.818 43.159 -2.341 25380
6286 1 14 . 1 1 31 31 ASP H H 31 7.303 7.303 8.163 -0.860 25380
6287 1 14 . 1 1 32 32 LYS N N 32 114.357 114.357 119.518 -5.161 25380
6288 1 14 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.539 -0.712 25380
6289 1 14 . 1 1 32 32 LYS C C 32 175.716 175.716 175.828 -0.112 25380
6290 1 14 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.617 0.545 25380
6291 1 14 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.751 -5.370 25380
6292 1 14 . 1 1 32 32 LYS H H 32 7.148 7.148 8.385 -1.237 25380
6293 1 14 . 1 1 33 33 ARG N N 33 120.929 120.929 122.793 -1.864 25380
6294 1 14 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.679 -0.478 25380
6295 1 14 . 1 1 33 33 ARG C C 33 173.982 173.982 173.451 0.531 25380
6296 1 14 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.228 0.966 25380
6297 1 14 . 1 1 33 33 ARG CB C 33 30.642 30.642 33.774 -3.132 25380
6298 1 14 . 1 1 33 33 ARG H H 33 7.388 7.388 8.913 -1.525 25380
6299 1 14 . 1 1 34 34 SER N N 34 115.867 115.867 114.924 0.943 25380
6300 1 14 . 1 1 34 34 SER HA H 34 5.355 5.355 4.816 0.539 25380
6301 1 14 . 1 1 34 34 SER C C 34 172.754 172.754 172.893 -0.139 25380
6302 1 14 . 1 1 34 34 SER CA C 34 58.236 58.236 56.268 1.968 25380
6303 1 14 . 1 1 34 34 SER CB C 34 65.212 65.212 65.679 -0.467 25380
6304 1 14 . 1 1 34 34 SER H H 34 8.173 8.173 8.021 0.152 25380
6305 1 14 . 1 1 35 35 ILE N N 35 119.621 119.621 112.879 6.742 25380
6306 1 14 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.956 -0.093 25380
6307 1 14 . 1 1 35 35 ILE C C 35 174.069 174.069 173.573 0.496 25380
6308 1 14 . 1 1 35 35 ILE CA C 35 59.956 59.956 58.771 1.185 25380
6309 1 14 . 1 1 35 35 ILE CB C 35 40.655 40.655 42.022 -1.367 25380
6310 1 14 . 1 1 35 35 ILE H H 35 6.779 6.779 8.444 -1.665 25380
6311 1 14 . 1 1 36 36 PHE N N 36 124.305 124.305 120.367 3.938 25380
6312 1 14 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.596 -1.143 25380
6313 1 14 . 1 1 36 36 PHE C C 36 173.204 173.204 174.884 -1.680 25380
6314 1 14 . 1 1 36 36 PHE CA C 36 56.416 56.416 55.241 1.175 25380
6315 1 14 . 1 1 36 36 PHE CB C 36 44.817 44.817 40.005 4.812 25380
6316 1 14 . 1 1 36 36 PHE H H 36 8.411 8.411 8.774 -0.363 25380
6317 1 14 . 1 1 37 37 TYR N N 37 118.743 118.743 125.266 -6.523 25380
6318 1 14 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.102 0.468 25380
6319 1 14 . 1 1 37 37 TYR C C 37 175.455 175.455 173.643 1.812 25380
6320 1 14 . 1 1 37 37 TYR CA C 37 56.518 56.518 55.024 1.494 25380
6321 1 14 . 1 1 37 37 TYR CB C 37 40.991 40.991 40.532 0.459 25380
6322 1 14 . 1 1 37 37 TYR H H 37 8.353 8.353 9.285 -0.932 25380
6323 1 14 . 1 1 38 38 PHE N N 38 119.236 119.236 127.498 -8.262 25380
6324 1 14 . 1 1 38 38 PHE HA H 38 5.160 5.160 5.029 0.131 25380
6325 1 14 . 1 1 38 38 PHE C C 38 174.650 174.650 173.947 0.703 25380
6326 1 14 . 1 1 38 38 PHE CA C 38 56.842 56.842 56.155 0.687 25380
6327 1 14 . 1 1 38 38 PHE CB C 38 42.619 42.619 40.045 2.574 25380
6328 1 14 . 1 1 38 38 PHE H H 38 9.756 9.756 9.135 0.621 25380
6329 1 14 . 1 1 39 39 ALA N N 39 122.516 122.516 125.022 -2.506 25380
6330 1 14 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.595 -0.055 25380
6331 1 14 . 1 1 39 39 ALA C C 39 177.042 177.042 174.175 2.867 25380
6332 1 14 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.753 1.090 25380
6333 1 14 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.402 -2.824 25380
6334 1 14 . 1 1 39 39 ALA H H 39 7.738 7.738 8.843 -1.105 25380
6335 1 14 . 1 1 40 40 PRO C C 40 175.411 175.411 177.358 -1.947 25380
6336 1 14 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.843 1.446 25380
6337 1 14 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.874 -1.770 25380
6338 1 14 . 1 1 41 41 THR N N 41 105.878 105.878 116.261 -10.383 25380
6339 1 14 . 1 1 41 41 THR HA H 41 4.190 4.190 3.823 0.367 25380
6340 1 14 . 1 1 41 41 THR C C 41 176.400 176.400 175.412 0.988 25380
6341 1 14 . 1 1 41 41 THR CA C 41 61.937 61.937 65.410 -3.473 25380
6342 1 14 . 1 1 41 41 THR CB C 41 68.331 68.331 68.495 -0.164 25380
6343 1 14 . 1 1 41 41 THR H H 41 6.715 6.715 8.410 -1.695 25380
6344 1 14 . 1 1 42 42 ASN N N 42 118.863 118.863 118.811 0.052 25380
6345 1 14 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.475 0.060 25380
6346 1 14 . 1 1 42 42 ASN C C 42 173.764 173.764 175.314 -1.550 25380
6347 1 14 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.595 -1.419 25380
6348 1 14 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.547 4.168 25380
6349 1 14 . 1 1 42 42 ASN H H 42 7.153 7.153 8.608 -1.455 25380
6350 1 14 . 1 1 43 43 ALA N N 43 126.174 126.174 119.493 6.681 25380
6351 1 14 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.450 -0.025 25380
6352 1 14 . 1 1 43 43 ALA C C 43 179.308 179.308 176.394 2.914 25380
6353 1 14 . 1 1 43 43 ALA CA C 43 51.982 51.982 51.745 0.237 25380
6354 1 14 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.468 -1.174 25380
6355 1 14 . 1 1 43 43 ALA H H 43 9.465 9.465 7.820 1.645 25380
6356 1 14 . 1 1 44 44 HIS N N 44 126.251 126.251 115.642 10.609 25380
6357 1 14 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.348 -0.521 25380
6358 1 14 . 1 1 44 44 HIS C C 44 177.407 177.407 174.833 2.574 25380
6359 1 14 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.795 4.230 25380
6360 1 14 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.451 1.179 25380
6361 1 14 . 1 1 44 44 HIS H H 44 9.407 9.407 7.690 1.717 25380
6362 1 14 . 1 1 45 45 LYS N N 45 114.990 114.990 118.396 -3.406 25380
6363 1 14 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.387 -0.504 25380
6364 1 14 . 1 1 45 45 LYS C C 45 178.284 178.284 177.103 1.181 25380
6365 1 14 . 1 1 45 45 LYS CA C 45 59.249 59.249 58.043 1.206 25380
6366 1 14 . 1 1 45 45 LYS CB C 45 31.834 31.834 33.523 -1.689 25380
6367 1 14 . 1 1 45 45 LYS H H 45 8.960 8.960 8.017 0.943 25380
6368 1 14 . 1 1 46 46 ASP N N 46 120.411 120.411 119.822 0.589 25380
6369 1 14 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.444 -0.018 25380
6370 1 14 . 1 1 46 46 ASP C C 46 177.773 177.773 178.112 -0.339 25380
6371 1 14 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.406 -0.390 25380
6372 1 14 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.234 -0.337 25380
6373 1 14 . 1 1 46 46 ASP H H 46 6.777 6.777 8.621 -1.844 25380
6374 1 14 . 1 1 47 47 MET N N 47 118.178 118.178 118.783 -0.605 25380
6375 1 14 . 1 1 47 47 MET HA H 47 3.879 3.879 4.258 -0.379 25380
6376 1 14 . 1 1 47 47 MET C C 47 179.499 179.499 177.680 1.819 25380
6377 1 14 . 1 1 47 47 MET CA C 47 56.052 56.052 59.289 -3.237 25380
6378 1 14 . 1 1 47 47 MET CB C 47 29.601 29.601 32.723 -3.122 25380
6379 1 14 . 1 1 47 47 MET H H 47 7.367 7.367 8.051 -0.684 25380
6380 1 14 . 1 1 48 48 LEU N N 48 117.665 117.665 119.293 -1.628 25380
6381 1 14 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.968 -0.121 25380
6382 1 14 . 1 1 48 48 LEU C C 48 179.843 179.843 178.334 1.509 25380
6383 1 14 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.806 -0.226 25380
6384 1 14 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.581 -0.628 25380
6385 1 14 . 1 1 48 48 LEU H H 48 7.672 7.672 7.772 -0.100 25380
6386 1 14 . 1 1 49 49 LYS N N 49 119.326 119.326 118.644 0.682 25380
6387 1 14 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.502 0.625 25380
6388 1 14 . 1 1 49 49 LYS C C 49 179.684 179.684 178.276 1.408 25380
6389 1 14 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.177 -0.378 25380
6390 1 14 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.789 -0.336 25380
6391 1 14 . 1 1 49 49 LYS H H 49 7.420 7.420 7.691 -0.271 25380
6392 1 14 . 1 1 50 50 ALA N N 50 122.022 122.022 122.550 -0.528 25380
6393 1 14 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.502 0.541 25380
6394 1 14 . 1 1 50 50 ALA C C 50 178.818 178.818 179.213 -0.395 25380
6395 1 14 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.823 0.346 25380
6396 1 14 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.816 -0.516 25380
6397 1 14 . 1 1 50 50 ALA H H 50 7.551 7.551 7.805 -0.254 25380
6398 1 14 . 1 1 51 51 VAL N N 51 118.165 118.165 118.564 -0.399 25380
6399 1 14 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.623 -0.181 25380
6400 1 14 . 1 1 51 51 VAL C C 51 178.646 178.646 178.196 0.450 25380
6401 1 14 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.582 0.624 25380
6402 1 14 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.834 0.619 25380
6403 1 14 . 1 1 51 51 VAL H H 51 7.226 7.226 7.593 -0.367 25380
6404 1 14 . 1 1 52 52 ASP N N 52 122.298 122.298 120.509 1.789 25380
6405 1 14 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.370 0.001 25380
6406 1 14 . 1 1 52 52 ASP C C 52 177.898 177.898 179.141 -1.243 25380
6407 1 14 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.185 0.386 25380
6408 1 14 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.278 0.108 25380
6409 1 14 . 1 1 52 52 ASP H H 52 8.232 8.232 7.378 0.854 25380
6410 1 14 . 1 1 53 53 PHE N N 53 121.541 121.541 119.735 1.806 25380
6411 1 14 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.217 0.104 25380
6412 1 14 . 1 1 53 53 PHE C C 53 177.224 177.224 178.062 -0.838 25380
6413 1 14 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.971 2.108 25380
6414 1 14 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.906 1.794 25380
6415 1 14 . 1 1 53 53 PHE H H 53 8.240 8.240 8.110 0.130 25380
6416 1 14 . 1 1 54 54 PHE N N 54 115.925 115.925 116.994 -1.069 25380
6417 1 14 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.251 -0.596 25380
6418 1 14 . 1 1 54 54 PHE C C 54 178.269 178.269 177.606 0.663 25380
6419 1 14 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.652 4.548 25380
6420 1 14 . 1 1 54 54 PHE CB C 54 38.578 38.578 38.003 0.575 25380
6421 1 14 . 1 1 54 54 PHE H H 54 7.755 7.755 8.181 -0.426 25380
6422 1 14 . 1 1 55 55 LYS N N 55 120.251 120.251 118.250 2.001 25380
6423 1 14 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.115 0.311 25380
6424 1 14 . 1 1 55 55 LYS C C 55 181.484 181.484 178.217 3.267 25380
6425 1 14 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.742 0.887 25380
6426 1 14 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.468 -0.729 25380
6427 1 14 . 1 1 55 55 LYS H H 55 8.213 8.213 7.568 0.645 25380
6428 1 14 . 1 1 56 56 GLU N N 56 120.146 120.146 117.935 2.211 25380
6429 1 14 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.151 -0.158 25380
6430 1 14 . 1 1 56 56 GLU C C 56 178.085 178.085 177.578 0.507 25380
6431 1 14 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.472 0.316 25380
6432 1 14 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.027 -1.431 25380
6433 1 14 . 1 1 56 56 GLU H H 56 7.850 7.850 7.965 -0.115 25380
6434 1 14 . 1 1 57 57 LYS N N 57 115.940 115.940 118.094 -2.154 25380
6435 1 14 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.494 -0.391 25380
6436 1 14 . 1 1 57 57 LYS C C 57 176.225 176.225 177.007 -0.782 25380
6437 1 14 . 1 1 57 57 LYS CA C 57 54.572 54.572 54.946 -0.374 25380
6438 1 14 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.618 -1.582 25380
6439 1 14 . 1 1 57 57 LYS H H 57 7.019 7.019 7.497 -0.478 25380
6440 1 14 . 1 1 58 58 GLY N N 58 106.593 106.593 108.789 -2.196 25380
6441 1 14 . 1 1 58 58 GLY C C 58 174.350 174.350 174.754 -0.404 25380
6442 1 14 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.639 -0.139 25380
6443 1 14 . 1 1 58 58 GLY H H 58 7.883 7.883 8.462 -0.579 25380
6444 1 14 . 1 1 59 59 HIS N N 59 117.962 117.962 117.468 0.494 25380
6445 1 14 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.812 0.055 25380
6446 1 14 . 1 1 59 59 HIS C C 59 173.271 173.271 175.532 -2.261 25380
6447 1 14 . 1 1 59 59 HIS CA C 59 54.778 54.778 58.299 -3.521 25380
6448 1 14 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.876 1.809 25380
6449 1 14 . 1 1 59 59 HIS H H 59 8.218 8.218 7.951 0.267 25380
6450 1 14 . 1 1 60 60 THR N N 60 119.624 119.624 111.509 8.115 25380
6451 1 14 . 1 1 60 60 THR HA H 60 4.430 4.430 3.907 0.523 25380
6452 1 14 . 1 1 60 60 THR C C 60 171.430 171.430 173.797 -2.367 25380
6453 1 14 . 1 1 60 60 THR CA C 60 63.480 63.480 62.804 0.676 25380
6454 1 14 . 1 1 60 60 THR CB C 60 69.761 69.761 69.679 0.082 25380
6455 1 14 . 1 1 60 60 THR H H 60 8.780 8.780 7.889 0.891 25380
6456 1 14 . 1 1 61 61 ALA N N 61 126.706 126.706 128.927 -2.221 25380
6457 1 14 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.147 1.099 25380
6458 1 14 . 1 1 61 61 ALA C C 61 174.753 174.753 176.720 -1.967 25380
6459 1 14 . 1 1 61 61 ALA CA C 61 49.772 49.772 52.713 -2.941 25380
6460 1 14 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.420 2.469 25380
6461 1 14 . 1 1 61 61 ALA H H 61 7.795 7.795 8.353 -0.558 25380
6462 1 14 . 1 1 62 62 TYR N N 62 117.859 117.859 115.901 1.958 25380
6463 1 14 . 1 1 62 62 TYR C C 62 173.431 173.431 173.489 -0.058 25380
6464 1 14 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.450 -0.803 25380
6465 1 14 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.465 -1.916 25380
6466 1 14 . 1 1 62 62 TYR H H 62 8.711 8.711 7.652 1.059 25380
6467 1 14 . 1 1 63 63 LEU N N 63 125.044 125.044 123.316 1.728 25380
6468 1 14 . 1 1 63 63 LEU HA H 63 5.411 5.411 5.306 0.105 25380
6469 1 14 . 1 1 63 63 LEU C C 63 175.319 175.319 175.541 -0.222 25380
6470 1 14 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.740 -0.510 25380
6471 1 14 . 1 1 63 63 LEU CB C 63 45.701 45.701 45.313 0.388 25380
6472 1 14 . 1 1 63 63 LEU H H 63 8.746 8.746 8.554 0.192 25380
6473 1 14 . 1 1 64 64 ASP N N 64 125.463 125.463 123.729 1.734 25380
6474 1 14 . 1 1 64 64 ASP HA H 64 5.199 5.199 5.002 0.197 25380
6475 1 14 . 1 1 64 64 ASP C C 64 174.512 174.512 174.536 -0.024 25380
6476 1 14 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.362 0.338 25380
6477 1 14 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.225 -0.271 25380
6478 1 14 . 1 1 64 64 ASP H H 64 9.293 9.293 9.108 0.185 25380
6479 1 14 . 1 1 65 65 GLU N N 65 120.711 120.711 119.274 1.437 25380
6480 1 14 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.399 0.668 25380
6481 1 14 . 1 1 65 65 GLU C C 65 175.652 175.652 175.791 -0.139 25380
6482 1 14 . 1 1 65 65 GLU CA C 65 55.643 55.643 56.308 -0.665 25380
6483 1 14 . 1 1 65 65 GLU CB C 65 30.455 30.455 31.272 -0.817 25380
6484 1 14 . 1 1 65 65 GLU H H 65 8.715 8.715 8.465 0.250 25380
6485 1 14 . 1 1 66 66 VAL N N 66 122.936 122.936 120.823 2.113 25380
6486 1 14 . 1 1 66 66 VAL HA H 66 4.430 4.430 3.947 0.483 25380
6487 1 14 . 1 1 66 66 VAL C C 66 175.065 175.065 176.440 -1.375 25380
6488 1 14 . 1 1 66 66 VAL CA C 66 60.991 60.991 62.150 -1.159 25380
6489 1 14 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.458 1.822 25380
6490 1 14 . 1 1 66 66 VAL H H 66 9.156 9.156 8.841 0.315 25380
6491 1 14 . 1 1 67 67 ARG N N 67 126.104 126.104 124.937 1.167 25380
6492 1 14 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.326 0.215 25380
6493 1 14 . 1 1 67 67 ARG C C 67 176.708 176.708 176.435 0.273 25380
6494 1 14 . 1 1 67 67 ARG CA C 67 56.080 56.080 56.001 0.079 25380
6495 1 14 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.195 1.712 25380
6496 1 14 . 1 1 67 67 ARG H H 67 8.734 8.734 8.579 0.155 25380
6497 1 14 . 1 1 68 68 VAL N N 68 120.707 120.707 113.466 7.241 25380
6498 1 14 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.263 -0.111 25380
6499 1 14 . 1 1 68 68 VAL C C 68 175.931 175.931 176.528 -0.597 25380
6500 1 14 . 1 1 68 68 VAL CA C 68 62.776 62.776 62.329 0.447 25380
6501 1 14 . 1 1 68 68 VAL CB C 68 32.489 32.489 30.376 2.113 25380
6502 1 14 . 1 1 68 68 VAL H H 68 8.384 8.384 7.768 0.616 25380
6503 1 14 . 1 1 69 69 SER N N 69 116.156 116.156 117.381 -1.225 25380
6504 1 14 . 1 1 69 69 SER HA H 69 4.693 4.693 4.259 0.434 25380
6505 1 14 . 1 1 69 69 SER C C 69 174.544 174.544 176.501 -1.957 25380
6506 1 14 . 1 1 69 69 SER CA C 69 57.754 57.754 61.889 -4.135 25380
6507 1 14 . 1 1 69 69 SER CB C 69 64.831 64.831 62.781 2.050 25380
6508 1 14 . 1 1 69 69 SER H H 69 8.067 8.067 8.472 -0.405 25380
6509 1 14 . 1 1 70 70 THR N N 70 110.753 110.753 112.543 -1.790 25380
6510 1 14 . 1 1 70 70 THR HA H 70 4.152 4.152 4.096 0.056 25380
6511 1 14 . 1 1 70 70 THR C C 70 174.865 174.865 175.574 -0.709 25380
6512 1 14 . 1 1 70 70 THR CA C 70 63.831 63.831 64.647 -0.816 25380
6513 1 14 . 1 1 70 70 THR CB C 70 68.956 68.956 68.491 0.465 25380
6514 1 14 . 1 1 70 70 THR H H 70 8.095 8.095 8.368 -0.273 25380
6515 1 14 . 1 1 71 71 ASP N N 71 121.817 121.817 121.328 0.489 25380
6516 1 14 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.696 -0.106 25380
6517 1 14 . 1 1 71 71 ASP C C 71 176.746 176.746 177.229 -0.483 25380
6518 1 14 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.078 -1.814 25380
6519 1 14 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.811 0.614 25380
6520 1 14 . 1 1 71 71 ASP H H 71 8.076 8.076 8.174 -0.098 25380
6521 1 14 . 1 1 72 72 GLU N N 72 123.635 123.635 117.306 6.329 25380
6522 1 14 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.439 -0.446 25380
6523 1 14 . 1 1 72 72 GLU C C 72 176.971 176.971 176.377 0.594 25380
6524 1 14 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.730 1.489 25380
6525 1 14 . 1 1 72 72 GLU CB C 72 29.702 29.702 31.427 -1.726 25380
6526 1 14 . 1 1 72 72 GLU H H 72 8.514 8.514 8.248 0.266 25380
6527 1 14 . 1 1 73 73 LYS N N 73 117.857 117.857 116.718 1.139 25380
6528 1 14 . 1 1 73 73 LYS HA H 73 4.643 4.643 4.145 0.498 25380
6529 1 14 . 1 1 73 73 LYS C C 73 176.508 176.508 176.209 0.299 25380
6530 1 14 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.328 -0.248 25380
6531 1 14 . 1 1 73 73 LYS CB C 73 32.203 32.203 30.584 1.619 25380
6532 1 14 . 1 1 73 73 LYS H H 73 8.423 8.423 8.550 -0.127 25380
6533 1 14 . 1 1 74 74 ASP N N 74 120.580 120.580 117.093 3.487 25380
6534 1 14 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.835 -0.077 25380
6535 1 14 . 1 1 74 74 ASP C C 74 174.059 174.059 175.232 -1.173 25380
6536 1 14 . 1 1 74 74 ASP CA C 74 53.279 53.279 56.170 -2.891 25380
6537 1 14 . 1 1 74 74 ASP CB C 74 40.578 40.578 42.588 -2.010 25380
6538 1 14 . 1 1 74 74 ASP H H 74 7.918 7.918 8.582 -0.664 25380
6539 1 14 . 1 1 75 75 PHE N N 75 118.513 118.513 119.786 -1.273 25380
6540 1 14 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.090 0.273 25380
6541 1 14 . 1 1 75 75 PHE C C 75 173.038 173.038 173.003 0.035 25380
6542 1 14 . 1 1 75 75 PHE CA C 75 55.522 55.522 55.286 0.236 25380
6543 1 14 . 1 1 75 75 PHE CB C 75 41.714 41.714 39.967 1.747 25380
6544 1 14 . 1 1 75 75 PHE H H 75 7.397 7.397 7.998 -0.601 25380
6545 1 14 . 1 1 76 76 LEU N N 76 116.773 116.773 128.688 -11.915 25380
6546 1 14 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.848 -0.205 25380
6547 1 14 . 1 1 76 76 LEU C C 76 177.553 177.553 174.652 2.901 25380
6548 1 14 . 1 1 76 76 LEU CA C 76 53.619 53.619 53.835 -0.216 25380
6549 1 14 . 1 1 76 76 LEU CB C 76 45.701 45.701 45.666 0.035 25380
6550 1 14 . 1 1 76 76 LEU H H 76 8.774 8.774 9.316 -0.542 25380
6551 1 14 . 1 1 77 77 TYR N N 77 118.377 118.377 125.934 -7.557 25380
6552 1 14 . 1 1 77 77 TYR HA H 77 5.415 5.415 5.002 0.413 25380
6553 1 14 . 1 1 77 77 TYR C C 77 175.479 175.479 173.347 2.132 25380
6554 1 14 . 1 1 77 77 TYR CA C 77 58.391 58.391 56.513 1.878 25380
6555 1 14 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.158 0.942 25380
6556 1 14 . 1 1 77 77 TYR H H 77 8.589 8.589 9.301 -0.712 25380
6557 1 14 . 1 1 78 78 GLU N N 78 123.875 123.875 128.559 -4.684 25380
6558 1 14 . 1 1 78 78 GLU HA H 78 4.973 4.973 5.061 -0.088 25380
6559 1 14 . 1 1 78 78 GLU C C 78 174.120 174.120 174.011 0.109 25380
6560 1 14 . 1 1 78 78 GLU CA C 78 54.378 54.378 53.566 0.812 25380
6561 1 14 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.682 -1.042 25380
6562 1 14 . 1 1 78 78 GLU H H 78 9.576 9.576 8.611 0.965 25380
6563 1 14 . 1 1 79 79 LEU N N 79 128.661 128.661 124.522 4.139 25380
6564 1 14 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.409 0.880 25380
6565 1 14 . 1 1 79 79 LEU C C 79 174.219 174.219 174.893 -0.674 25380
6566 1 14 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.594 -0.445 25380
6567 1 14 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.966 1.664 25380
6568 1 14 . 1 1 79 79 LEU H H 79 9.139 9.139 8.498 0.641 25380
6569 1 14 . 1 1 80 80 HIS N N 80 124.886 124.886 122.419 2.467 25380
6570 1 14 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.850 0.580 25380
6571 1 14 . 1 1 80 80 HIS C C 80 173.346 173.346 175.530 -2.184 25380
6572 1 14 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.946 -1.797 25380
6573 1 14 . 1 1 80 80 HIS CB C 80 30.768 30.768 30.966 -0.198 25380
6574 1 14 . 1 1 80 80 HIS H H 80 8.897 8.897 9.090 -0.193 25380
6575 1 14 . 1 1 81 81 ILE N N 81 125.173 125.173 121.141 4.032 25380
6576 1 14 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.581 0.709 25380
6577 1 14 . 1 1 81 81 ILE C C 81 174.600 174.600 175.020 -0.420 25380
6578 1 14 . 1 1 81 81 ILE CA C 81 60.500 60.500 61.444 -0.944 25380
6579 1 14 . 1 1 81 81 ILE CB C 81 39.700 39.700 35.219 4.481 25380
6580 1 14 . 1 1 81 81 ILE H H 81 8.909 8.909 8.053 0.856 25380
6581 1 15 . 1 1 2 2 HIS N N 2 120.430 120.430 120.539 -0.109 25380
6582 1 15 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.962 -0.227 25380
6583 1 15 . 1 1 2 2 HIS C C 2 173.884 173.884 174.710 -0.826 25380
6584 1 15 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.352 -1.300 25380
6585 1 15 . 1 1 2 2 HIS CB C 2 28.666 28.666 31.557 -2.891 25380
6586 1 15 . 1 1 2 2 HIS H H 2 8.678 8.678 8.201 0.477 25380
6587 1 15 . 1 1 3 3 MET N N 3 122.377 122.377 120.752 1.625 25380
6588 1 15 . 1 1 3 3 MET HA H 3 4.207 4.207 4.593 -0.386 25380
6589 1 15 . 1 1 3 3 MET C C 3 174.584 174.584 175.495 -0.911 25380
6590 1 15 . 1 1 3 3 MET CA C 3 56.550 56.550 55.426 1.124 25380
6591 1 15 . 1 1 3 3 MET CB C 3 33.426 33.426 33.250 0.176 25380
6592 1 15 . 1 1 3 3 MET H H 3 8.240 8.240 8.959 -0.719 25380
6593 1 15 . 1 1 4 4 LYS N N 4 123.568 123.568 117.596 5.972 25380
6594 1 15 . 1 1 4 4 LYS HA H 4 4.839 4.839 3.916 0.923 25380
6595 1 15 . 1 1 4 4 LYS C C 4 175.906 175.906 174.664 1.242 25380
6596 1 15 . 1 1 4 4 LYS CA C 4 54.800 54.800 57.295 -2.495 25380
6597 1 15 . 1 1 4 4 LYS CB C 4 34.900 34.900 30.202 4.698 25380
6598 1 15 . 1 1 4 4 LYS H H 4 8.351 8.351 8.594 -0.243 25380
6599 1 15 . 1 1 5 5 LEU N N 5 123.568 123.568 112.776 10.792 25380
6600 1 15 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.696 -0.857 25380
6601 1 15 . 1 1 5 5 LEU C C 5 175.900 175.900 175.136 0.764 25380
6602 1 15 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.288 0.062 25380
6603 1 15 . 1 1 5 5 LEU CB C 5 45.900 45.900 46.022 -0.122 25380
6604 1 15 . 1 1 5 5 LEU H H 5 8.281 8.281 7.554 0.727 25380
6605 1 15 . 1 1 6 6 VAL N N 6 121.564 121.564 120.099 1.465 25380
6606 1 15 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.372 0.054 25380
6607 1 15 . 1 1 6 6 VAL C C 6 178.200 178.200 174.829 3.371 25380
6608 1 15 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.841 2.359 25380
6609 1 15 . 1 1 6 6 VAL CB C 6 33.200 33.200 33.813 -0.613 25380
6610 1 15 . 1 1 6 6 VAL H H 6 9.276 9.276 8.761 0.515 25380
6611 1 15 . 1 1 7 7 LEU N N 7 121.564 121.564 127.749 -6.185 25380
6612 1 15 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.183 -0.757 25380
6613 1 15 . 1 1 7 7 LEU CA C 7 63.200 63.200 52.898 10.303 25380
6614 1 15 . 1 1 7 7 LEU CB C 7 33.200 33.200 44.530 -11.330 25380
6615 1 15 . 1 1 7 7 LEU H H 7 9.276 9.276 8.407 0.869 25380
6616 1 15 . 1 1 8 8 ALA C C 8 177.040 177.040 177.259 -0.219 25380
6617 1 15 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.333 -0.632 25380
6618 1 15 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.916 0.948 25380
6619 1 15 . 1 1 9 9 LYS N N 9 119.845 119.845 123.412 -3.567 25380
6620 1 15 . 1 1 9 9 LYS HA H 9 4.128 4.128 4.072 0.056 25380
6621 1 15 . 1 1 9 9 LYS C C 9 176.075 176.075 178.253 -2.178 25380
6622 1 15 . 1 1 9 9 LYS CA C 9 56.761 56.761 58.998 -2.237 25380
6623 1 15 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.788 0.131 25380
6624 1 15 . 1 1 9 9 LYS H H 9 8.545 8.545 8.510 0.035 25380
6625 1 15 . 1 1 10 10 ASN N N 10 119.279 119.279 118.968 0.311 25380
6626 1 15 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.550 0.095 25380
6627 1 15 . 1 1 10 10 ASN C C 10 175.443 175.443 177.632 -2.189 25380
6628 1 15 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.892 -2.235 25380
6629 1 15 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.879 0.898 25380
6630 1 15 . 1 1 10 10 ASN H H 10 8.592 8.592 8.990 -0.398 25380
6631 1 15 . 1 1 11 11 THR N N 11 111.876 111.876 114.802 -2.926 25380
6632 1 15 . 1 1 11 11 THR HA H 11 4.311 4.311 4.145 0.166 25380
6633 1 15 . 1 1 11 11 THR C C 11 174.666 174.666 175.255 -0.589 25380
6634 1 15 . 1 1 11 11 THR CA C 11 62.044 62.044 65.378 -3.334 25380
6635 1 15 . 1 1 11 11 THR CB C 11 69.895 69.895 68.935 0.960 25380
6636 1 15 . 1 1 11 11 THR H H 11 8.058 8.058 8.419 -0.361 25380
6637 1 15 . 1 1 12 12 ARG N N 12 121.152 121.152 117.525 3.627 25380
6638 1 15 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.401 -0.139 25380
6639 1 15 . 1 1 12 12 ARG C C 12 176.714 176.714 176.030 0.684 25380
6640 1 15 . 1 1 12 12 ARG CA C 12 56.822 56.822 55.927 0.895 25380
6641 1 15 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.203 -0.501 25380
6642 1 15 . 1 1 12 12 ARG H H 12 8.291 8.291 7.990 0.301 25380
6643 1 15 . 1 1 13 13 LYS N N 13 120.459 120.459 118.532 1.927 25380
6644 1 15 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.066 -0.170 25380
6645 1 15 . 1 1 13 13 LYS C C 13 176.682 176.682 176.426 0.256 25380
6646 1 15 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.398 -0.420 25380
6647 1 15 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.236 2.262 25380
6648 1 15 . 1 1 13 13 LYS H H 13 8.286 8.286 8.333 -0.047 25380
6649 1 15 . 1 1 14 14 SER N N 14 114.568 114.568 114.536 0.032 25380
6650 1 15 . 1 1 14 14 SER HA H 14 4.371 4.371 4.399 -0.028 25380
6651 1 15 . 1 1 14 14 SER C C 14 173.990 173.990 174.737 -0.747 25380
6652 1 15 . 1 1 14 14 SER CA C 14 58.617 58.617 58.760 -0.143 25380
6653 1 15 . 1 1 14 14 SER CB C 14 63.933 63.933 64.168 -0.235 25380
6654 1 15 . 1 1 14 14 SER H H 14 7.957 7.957 8.332 -0.375 25380
6655 1 15 . 1 1 15 15 ASP N N 15 121.565 121.565 120.305 1.260 25380
6656 1 15 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.661 -0.060 25380
6657 1 15 . 1 1 15 15 ASP C C 15 175.684 175.684 176.495 -0.811 25380
6658 1 15 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.623 0.526 25380
6659 1 15 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.222 1.007 25380
6660 1 15 . 1 1 15 15 ASP H H 15 8.166 8.166 8.287 -0.121 25380
6661 1 15 . 1 1 16 16 ALA N N 16 124.173 124.173 123.287 0.886 25380
6662 1 15 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.084 0.287 25380
6663 1 15 . 1 1 16 16 ALA C C 16 177.184 177.184 179.181 -1.997 25380
6664 1 15 . 1 1 16 16 ALA CA C 16 52.337 52.337 54.480 -2.143 25380
6665 1 15 . 1 1 16 16 ALA CB C 16 19.359 19.359 18.985 0.373 25380
6666 1 15 . 1 1 16 16 ALA H H 16 8.163 8.163 8.150 0.013 25380
6667 1 15 . 1 1 17 17 LYS N N 17 121.152 121.152 119.983 1.169 25380
6668 1 15 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.138 0.288 25380
6669 1 15 . 1 1 17 17 LYS C C 17 175.488 175.488 179.066 -3.578 25380
6670 1 15 . 1 1 17 17 LYS CA C 17 56.205 56.205 58.821 -2.616 25380
6671 1 15 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.091 2.205 25380
6672 1 15 . 1 1 17 17 LYS H H 17 8.363 8.363 8.385 -0.022 25380
6673 1 15 . 1 1 18 18 SER N N 18 116.448 116.448 115.005 1.443 25380
6674 1 15 . 1 1 18 18 SER HA H 18 5.355 5.355 4.276 1.079 25380
6675 1 15 . 1 1 18 18 SER C C 18 173.887 173.887 176.706 -2.819 25380
6676 1 15 . 1 1 18 18 SER CA C 18 57.248 57.248 60.237 -2.989 25380
6677 1 15 . 1 1 18 18 SER CB C 18 64.962 64.962 62.907 2.055 25380
6678 1 15 . 1 1 18 18 SER H H 18 8.206 8.206 8.216 -0.010 25380
6679 1 15 . 1 1 19 19 VAL N N 19 117.867 117.867 121.810 -3.943 25380
6680 1 15 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.803 -0.183 25380
6681 1 15 . 1 1 19 19 VAL C C 19 174.169 174.169 177.671 -3.502 25380
6682 1 15 . 1 1 19 19 VAL CA C 19 59.546 59.546 65.588 -6.042 25380
6683 1 15 . 1 1 19 19 VAL CB C 19 35.902 35.902 30.898 5.004 25380
6684 1 15 . 1 1 19 19 VAL H H 19 9.086 9.086 7.744 1.342 25380
6685 1 15 . 1 1 20 20 GLU N N 20 120.843 120.843 120.278 0.565 25380
6686 1 15 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.275 0.593 25380
6687 1 15 . 1 1 20 20 GLU C C 20 178.747 178.747 179.036 -0.289 25380
6688 1 15 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.319 -4.768 25380
6689 1 15 . 1 1 20 20 GLU CB C 20 31.099 31.099 29.375 1.724 25380
6690 1 15 . 1 1 20 20 GLU H H 20 8.841 8.841 8.403 0.438 25380
6691 1 15 . 1 1 21 21 LEU N N 21 122.653 122.653 119.347 3.306 25380
6692 1 15 . 1 1 21 21 LEU HA H 21 3.443 3.443 4.040 -0.597 25380
6693 1 15 . 1 1 21 21 LEU C C 21 178.799 178.799 179.293 -0.494 25380
6694 1 15 . 1 1 21 21 LEU CA C 21 58.707 58.707 58.041 0.666 25380
6695 1 15 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.679 -3.108 25380
6696 1 15 . 1 1 21 21 LEU H H 21 8.744 8.744 7.959 0.785 25380
6697 1 15 . 1 1 22 22 GLU N N 22 115.392 115.392 119.285 -3.893 25380
6698 1 15 . 1 1 22 22 GLU HA H 22 3.989 3.989 4.003 -0.014 25380
6699 1 15 . 1 1 22 22 GLU C C 22 179.328 179.328 179.137 0.191 25380
6700 1 15 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.668 0.412 25380
6701 1 15 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.386 -0.552 25380
6702 1 15 . 1 1 22 22 GLU H H 22 8.744 8.744 7.621 1.123 25380
6703 1 15 . 1 1 23 23 ASP N N 23 118.597 118.597 120.656 -2.059 25380
6704 1 15 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.480 0.131 25380
6705 1 15 . 1 1 23 23 ASP C C 23 179.139 179.139 179.015 0.124 25380
6706 1 15 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.209 0.310 25380
6707 1 15 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.441 0.002 25380
6708 1 15 . 1 1 23 23 ASP H H 23 7.098 7.098 8.462 -1.364 25380
6709 1 15 . 1 1 24 24 LEU N N 24 119.869 119.869 120.983 -1.114 25380
6710 1 15 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.937 -0.003 25380
6711 1 15 . 1 1 24 24 LEU C C 24 179.045 179.045 178.797 0.248 25380
6712 1 15 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.290 -0.741 25380
6713 1 15 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.702 -0.152 25380
6714 1 15 . 1 1 24 24 LEU H H 24 7.576 7.576 8.465 -0.889 25380
6715 1 15 . 1 1 25 25 TYR N N 25 118.100 118.100 118.673 -0.573 25380
6716 1 15 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.287 1.080 25380
6717 1 15 . 1 1 25 25 TYR C C 25 177.945 177.945 177.867 0.078 25380
6718 1 15 . 1 1 25 25 TYR CA C 25 62.606 62.606 60.755 1.851 25380
6719 1 15 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.181 -0.233 25380
6720 1 15 . 1 1 25 25 TYR H H 25 8.320 8.320 7.443 0.877 25380
6721 1 15 . 1 1 26 26 HIS N N 26 119.440 119.440 119.742 -0.302 25380
6722 1 15 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.322 0.049 25380
6723 1 15 . 1 1 26 26 HIS C C 26 176.559 176.559 177.831 -1.272 25380
6724 1 15 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.758 -0.239 25380
6725 1 15 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.255 -2.127 25380
6726 1 15 . 1 1 26 26 HIS H H 26 8.383 8.383 8.839 -0.456 25380
6727 1 15 . 1 1 27 27 GLU N N 27 119.915 119.915 120.063 -0.148 25380
6728 1 15 . 1 1 27 27 GLU HA H 27 4.258 4.258 3.964 0.294 25380
6729 1 15 . 1 1 27 27 GLU C C 27 179.163 179.163 178.754 0.409 25380
6730 1 15 . 1 1 27 27 GLU CA C 27 60.075 60.075 58.767 1.308 25380
6731 1 15 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.691 -0.156 25380
6732 1 15 . 1 1 27 27 GLU H H 27 8.288 8.288 8.883 -0.595 25380
6733 1 15 . 1 1 28 28 PHE N N 28 120.500 120.500 121.515 -1.015 25380
6734 1 15 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.324 0.648 25380
6735 1 15 . 1 1 28 28 PHE C C 28 177.386 177.386 176.956 0.430 25380
6736 1 15 . 1 1 28 28 PHE CA C 28 60.401 60.401 61.017 -0.616 25380
6737 1 15 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.383 0.185 25380
6738 1 15 . 1 1 28 28 PHE H H 28 8.568 8.568 8.442 0.126 25380
6739 1 15 . 1 1 29 29 SER N N 29 114.306 114.306 113.973 0.333 25380
6740 1 15 . 1 1 29 29 SER HA H 29 4.288 4.288 4.058 0.230 25380
6741 1 15 . 1 1 29 29 SER C C 29 175.656 175.656 176.186 -0.530 25380
6742 1 15 . 1 1 29 29 SER CA C 29 61.058 61.058 59.841 1.217 25380
6743 1 15 . 1 1 29 29 SER CB C 29 63.555 63.555 63.330 0.225 25380
6744 1 15 . 1 1 29 29 SER H H 29 8.479 8.479 7.949 0.530 25380
6745 1 15 . 1 1 30 30 GLU N N 30 118.322 118.322 121.236 -2.914 25380
6746 1 15 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.046 0.046 25380
6747 1 15 . 1 1 30 30 GLU C C 30 177.312 177.312 176.512 0.800 25380
6748 1 15 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.785 -0.205 25380
6749 1 15 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.355 -0.778 25380
6750 1 15 . 1 1 30 30 GLU H H 30 8.428 8.428 7.680 0.748 25380
6751 1 15 . 1 1 31 31 ASP N N 31 115.630 115.630 116.284 -0.654 25380
6752 1 15 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.794 0.016 25380
6753 1 15 . 1 1 31 31 ASP C C 31 175.723 175.723 173.524 2.199 25380
6754 1 15 . 1 1 31 31 ASP CA C 31 53.974 53.974 53.059 0.914 25380
6755 1 15 . 1 1 31 31 ASP CB C 31 40.818 40.818 44.025 -3.207 25380
6756 1 15 . 1 1 31 31 ASP H H 31 7.303 7.303 7.868 -0.565 25380
6757 1 15 . 1 1 32 32 LYS N N 32 114.357 114.357 120.356 -5.999 25380
6758 1 15 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.436 -0.609 25380
6759 1 15 . 1 1 32 32 LYS C C 32 175.716 175.716 175.752 -0.036 25380
6760 1 15 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.481 0.681 25380
6761 1 15 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.454 -5.073 25380
6762 1 15 . 1 1 32 32 LYS H H 32 7.148 7.148 8.249 -1.101 25380
6763 1 15 . 1 1 33 33 ARG N N 33 120.929 120.929 123.102 -2.173 25380
6764 1 15 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.689 -0.488 25380
6765 1 15 . 1 1 33 33 ARG C C 33 173.982 173.982 173.731 0.251 25380
6766 1 15 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.107 1.087 25380
6767 1 15 . 1 1 33 33 ARG CB C 33 30.642 30.642 33.409 -2.767 25380
6768 1 15 . 1 1 33 33 ARG H H 33 7.388 7.388 8.854 -1.466 25380
6769 1 15 . 1 1 34 34 SER N N 34 115.867 115.867 115.029 0.838 25380
6770 1 15 . 1 1 34 34 SER HA H 34 5.355 5.355 4.462 0.893 25380
6771 1 15 . 1 1 34 34 SER C C 34 172.754 172.754 172.759 -0.005 25380
6772 1 15 . 1 1 34 34 SER CA C 34 58.236 58.236 56.810 1.426 25380
6773 1 15 . 1 1 34 34 SER CB C 34 65.212 65.212 65.814 -0.602 25380
6774 1 15 . 1 1 34 34 SER H H 34 8.173 8.173 8.164 0.009 25380
6775 1 15 . 1 1 35 35 ILE N N 35 119.621 119.621 120.058 -0.437 25380
6776 1 15 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.614 0.249 25380
6777 1 15 . 1 1 35 35 ILE C C 35 174.069 174.069 174.273 -0.204 25380
6778 1 15 . 1 1 35 35 ILE CA C 35 59.956 59.956 60.234 -0.278 25380
6779 1 15 . 1 1 35 35 ILE CB C 35 40.655 40.655 42.198 -1.543 25380
6780 1 15 . 1 1 35 35 ILE H H 35 6.779 6.779 8.526 -1.747 25380
6781 1 15 . 1 1 36 36 PHE N N 36 124.305 124.305 125.506 -1.201 25380
6782 1 15 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.502 -1.049 25380
6783 1 15 . 1 1 36 36 PHE C C 36 173.204 173.204 175.160 -1.956 25380
6784 1 15 . 1 1 36 36 PHE CA C 36 56.416 56.416 57.076 -0.660 25380
6785 1 15 . 1 1 36 36 PHE CB C 36 44.817 44.817 41.437 3.380 25380
6786 1 15 . 1 1 36 36 PHE H H 36 8.411 8.411 9.108 -0.697 25380
6787 1 15 . 1 1 37 37 TYR N N 37 118.743 118.743 125.676 -6.933 25380
6788 1 15 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.230 0.340 25380
6789 1 15 . 1 1 37 37 TYR C C 37 175.455 175.455 174.011 1.444 25380
6790 1 15 . 1 1 37 37 TYR CA C 37 56.518 56.518 56.459 0.059 25380
6791 1 15 . 1 1 37 37 TYR CB C 37 40.991 40.991 41.539 -0.548 25380
6792 1 15 . 1 1 37 37 TYR H H 37 8.353 8.353 9.518 -1.165 25380
6793 1 15 . 1 1 38 38 PHE N N 38 119.236 119.236 130.050 -10.814 25380
6794 1 15 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.485 0.675 25380
6795 1 15 . 1 1 38 38 PHE C C 38 174.650 174.650 172.894 1.756 25380
6796 1 15 . 1 1 38 38 PHE CA C 38 56.842 56.842 54.939 1.903 25380
6797 1 15 . 1 1 38 38 PHE CB C 38 42.619 42.619 39.362 3.257 25380
6798 1 15 . 1 1 38 38 PHE H H 38 9.756 9.756 9.154 0.602 25380
6799 1 15 . 1 1 39 39 ALA N N 39 122.516 122.516 129.477 -6.961 25380
6800 1 15 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.965 -0.425 25380
6801 1 15 . 1 1 39 39 ALA C C 39 177.042 177.042 174.313 2.729 25380
6802 1 15 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.247 1.596 25380
6803 1 15 . 1 1 39 39 ALA CB C 39 18.578 18.578 22.242 -3.664 25380
6804 1 15 . 1 1 39 39 ALA H H 39 7.738 7.738 8.776 -1.038 25380
6805 1 15 . 1 1 40 40 PRO C C 40 175.411 175.411 177.233 -1.822 25380
6806 1 15 . 1 1 40 40 PRO CA C 40 64.288 64.288 63.058 1.230 25380
6807 1 15 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.806 -1.702 25380
6808 1 15 . 1 1 41 41 THR N N 41 105.878 105.878 117.932 -12.054 25380
6809 1 15 . 1 1 41 41 THR HA H 41 4.190 4.190 3.729 0.461 25380
6810 1 15 . 1 1 41 41 THR C C 41 176.400 176.400 175.021 1.379 25380
6811 1 15 . 1 1 41 41 THR CA C 41 61.937 61.937 65.745 -3.808 25380
6812 1 15 . 1 1 41 41 THR CB C 41 68.331 68.331 68.668 -0.337 25380
6813 1 15 . 1 1 41 41 THR H H 41 6.715 6.715 8.227 -1.512 25380
6814 1 15 . 1 1 42 42 ASN N N 42 118.863 118.863 117.162 1.701 25380
6815 1 15 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.646 -0.111 25380
6816 1 15 . 1 1 42 42 ASN C C 42 173.764 173.764 176.452 -2.688 25380
6817 1 15 . 1 1 42 42 ASN CA C 42 54.176 54.176 54.994 -0.818 25380
6818 1 15 . 1 1 42 42 ASN CB C 42 41.715 41.715 38.294 3.421 25380
6819 1 15 . 1 1 42 42 ASN H H 42 7.153 7.153 8.191 -1.038 25380
6820 1 15 . 1 1 43 43 ALA N N 43 126.174 126.174 121.548 4.626 25380
6821 1 15 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.180 0.245 25380
6822 1 15 . 1 1 43 43 ALA C C 43 179.308 179.308 177.685 1.623 25380
6823 1 15 . 1 1 43 43 ALA CA C 43 51.982 51.982 53.436 -1.454 25380
6824 1 15 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.050 -0.756 25380
6825 1 15 . 1 1 43 43 ALA H H 43 9.465 9.465 8.180 1.285 25380
6826 1 15 . 1 1 44 44 HIS N N 44 126.251 126.251 112.692 13.559 25380
6827 1 15 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.260 -0.433 25380
6828 1 15 . 1 1 44 44 HIS C C 44 177.407 177.407 176.667 0.740 25380
6829 1 15 . 1 1 44 44 HIS CA C 44 61.025 61.025 57.834 3.191 25380
6830 1 15 . 1 1 44 44 HIS CB C 44 28.630 28.630 28.163 0.467 25380
6831 1 15 . 1 1 44 44 HIS H H 44 9.407 9.407 8.198 1.209 25380
6832 1 15 . 1 1 45 45 LYS N N 45 114.990 114.990 120.384 -5.394 25380
6833 1 15 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.062 -0.179 25380
6834 1 15 . 1 1 45 45 LYS C C 45 178.284 178.284 177.961 0.323 25380
6835 1 15 . 1 1 45 45 LYS CA C 45 59.249 59.249 59.579 -0.330 25380
6836 1 15 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.222 -0.388 25380
6837 1 15 . 1 1 45 45 LYS H H 45 8.960 8.960 8.457 0.503 25380
6838 1 15 . 1 1 46 46 ASP N N 46 120.411 120.411 117.883 2.528 25380
6839 1 15 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.440 -0.014 25380
6840 1 15 . 1 1 46 46 ASP C C 46 177.773 177.773 178.187 -0.414 25380
6841 1 15 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.113 -0.097 25380
6842 1 15 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.186 -0.289 25380
6843 1 15 . 1 1 46 46 ASP H H 46 6.777 6.777 8.594 -1.817 25380
6844 1 15 . 1 1 47 47 MET N N 47 118.178 118.178 120.269 -2.091 25380
6845 1 15 . 1 1 47 47 MET HA H 47 3.879 3.879 4.037 -0.158 25380
6846 1 15 . 1 1 47 47 MET C C 47 179.499 179.499 177.901 1.598 25380
6847 1 15 . 1 1 47 47 MET CA C 47 56.052 56.052 59.117 -3.065 25380
6848 1 15 . 1 1 47 47 MET CB C 47 29.601 29.601 32.624 -3.023 25380
6849 1 15 . 1 1 47 47 MET H H 47 7.367 7.367 7.877 -0.510 25380
6850 1 15 . 1 1 48 48 LEU N N 48 117.665 117.665 119.074 -1.409 25380
6851 1 15 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.781 0.066 25380
6852 1 15 . 1 1 48 48 LEU C C 48 179.843 179.843 178.724 1.119 25380
6853 1 15 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.560 0.020 25380
6854 1 15 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.346 -0.393 25380
6855 1 15 . 1 1 48 48 LEU H H 48 7.672 7.672 8.384 -0.712 25380
6856 1 15 . 1 1 49 49 LYS N N 49 119.326 119.326 118.463 0.863 25380
6857 1 15 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.502 0.625 25380
6858 1 15 . 1 1 49 49 LYS C C 49 179.684 179.684 178.322 1.362 25380
6859 1 15 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.023 -0.224 25380
6860 1 15 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.754 -0.301 25380
6861 1 15 . 1 1 49 49 LYS H H 49 7.420 7.420 7.577 -0.157 25380
6862 1 15 . 1 1 50 50 ALA N N 50 122.022 122.022 122.256 -0.234 25380
6863 1 15 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.415 0.628 25380
6864 1 15 . 1 1 50 50 ALA C C 50 178.818 178.818 178.501 0.317 25380
6865 1 15 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.544 0.625 25380
6866 1 15 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.373 -0.073 25380
6867 1 15 . 1 1 50 50 ALA H H 50 7.551 7.551 7.656 -0.105 25380
6868 1 15 . 1 1 51 51 VAL N N 51 118.165 118.165 117.831 0.334 25380
6869 1 15 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.526 -0.084 25380
6870 1 15 . 1 1 51 51 VAL C C 51 178.646 178.646 178.006 0.640 25380
6871 1 15 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.337 0.869 25380
6872 1 15 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.796 0.657 25380
6873 1 15 . 1 1 51 51 VAL H H 51 7.226 7.226 7.204 0.022 25380
6874 1 15 . 1 1 52 52 ASP N N 52 122.298 122.298 120.349 1.949 25380
6875 1 15 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.296 0.075 25380
6876 1 15 . 1 1 52 52 ASP C C 52 177.898 177.898 179.012 -1.114 25380
6877 1 15 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.016 0.555 25380
6878 1 15 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.175 0.211 25380
6879 1 15 . 1 1 52 52 ASP H H 52 8.232 8.232 7.251 0.981 25380
6880 1 15 . 1 1 53 53 PHE N N 53 121.541 121.541 119.965 1.576 25380
6881 1 15 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.343 -0.022 25380
6882 1 15 . 1 1 53 53 PHE C C 53 177.224 177.224 178.099 -0.875 25380
6883 1 15 . 1 1 53 53 PHE CA C 53 61.080 61.080 59.050 2.030 25380
6884 1 15 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.918 1.782 25380
6885 1 15 . 1 1 53 53 PHE H H 53 8.240 8.240 7.798 0.442 25380
6886 1 15 . 1 1 54 54 PHE N N 54 115.925 115.925 116.907 -0.982 25380
6887 1 15 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.194 -0.539 25380
6888 1 15 . 1 1 54 54 PHE C C 54 178.269 178.269 177.208 1.061 25380
6889 1 15 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.979 4.221 25380
6890 1 15 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.997 0.581 25380
6891 1 15 . 1 1 54 54 PHE H H 54 7.755 7.755 7.685 0.070 25380
6892 1 15 . 1 1 55 55 LYS N N 55 120.251 120.251 117.750 2.501 25380
6893 1 15 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.021 0.405 25380
6894 1 15 . 1 1 55 55 LYS C C 55 181.484 181.484 178.502 2.982 25380
6895 1 15 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.951 0.678 25380
6896 1 15 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.367 -0.628 25380
6897 1 15 . 1 1 55 55 LYS H H 55 8.213 8.213 7.446 0.767 25380
6898 1 15 . 1 1 56 56 GLU N N 56 120.146 120.146 117.555 2.591 25380
6899 1 15 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.160 -0.167 25380
6900 1 15 . 1 1 56 56 GLU C C 56 178.085 178.085 177.528 0.557 25380
6901 1 15 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.470 0.318 25380
6902 1 15 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.234 -1.638 25380
6903 1 15 . 1 1 56 56 GLU H H 56 7.850 7.850 7.724 0.126 25380
6904 1 15 . 1 1 57 57 LYS N N 57 115.940 115.940 119.047 -3.107 25380
6905 1 15 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.493 -0.390 25380
6906 1 15 . 1 1 57 57 LYS C C 57 176.225 176.225 176.529 -0.304 25380
6907 1 15 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.142 -0.570 25380
6908 1 15 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.800 -1.764 25380
6909 1 15 . 1 1 57 57 LYS H H 57 7.019 7.019 7.798 -0.779 25380
6910 1 15 . 1 1 58 58 GLY N N 58 106.593 106.593 110.288 -3.695 25380
6911 1 15 . 1 1 58 58 GLY C C 58 174.350 174.350 174.868 -0.518 25380
6912 1 15 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.367 0.133 25380
6913 1 15 . 1 1 58 58 GLY H H 58 7.883 7.883 8.492 -0.609 25380
6914 1 15 . 1 1 59 59 HIS N N 59 117.962 117.962 117.939 0.023 25380
6915 1 15 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.041 0.826 25380
6916 1 15 . 1 1 59 59 HIS C C 59 173.271 173.271 175.497 -2.226 25380
6917 1 15 . 1 1 59 59 HIS CA C 59 54.778 54.778 57.157 -2.380 25380
6918 1 15 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.643 2.042 25380
6919 1 15 . 1 1 59 59 HIS H H 59 8.218 8.218 7.798 0.420 25380
6920 1 15 . 1 1 60 60 THR N N 60 119.624 119.624 112.395 7.229 25380
6921 1 15 . 1 1 60 60 THR HA H 60 4.430 4.430 3.910 0.520 25380
6922 1 15 . 1 1 60 60 THR C C 60 171.430 171.430 174.260 -2.830 25380
6923 1 15 . 1 1 60 60 THR CA C 60 63.480 63.480 62.748 0.732 25380
6924 1 15 . 1 1 60 60 THR CB C 60 69.761 69.761 69.492 0.269 25380
6925 1 15 . 1 1 60 60 THR H H 60 8.780 8.780 7.656 1.124 25380
6926 1 15 . 1 1 61 61 ALA N N 61 126.706 126.706 130.458 -3.752 25380
6927 1 15 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.276 0.970 25380
6928 1 15 . 1 1 61 61 ALA C C 61 174.753 174.753 176.895 -2.142 25380
6929 1 15 . 1 1 61 61 ALA CA C 61 49.772 49.772 53.934 -4.162 25380
6930 1 15 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.167 2.722 25380
6931 1 15 . 1 1 61 61 ALA H H 61 7.795 7.795 8.959 -1.164 25380
6932 1 15 . 1 1 62 62 TYR N N 62 117.859 117.859 115.591 2.268 25380
6933 1 15 . 1 1 62 62 TYR C C 62 173.431 173.431 173.025 0.406 25380
6934 1 15 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.312 -0.665 25380
6935 1 15 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.140 -1.591 25380
6936 1 15 . 1 1 62 62 TYR H H 62 8.711 8.711 7.872 0.839 25380
6937 1 15 . 1 1 63 63 LEU N N 63 125.044 125.044 125.158 -0.114 25380
6938 1 15 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.613 0.798 25380
6939 1 15 . 1 1 63 63 LEU C C 63 175.319 175.319 173.858 1.461 25380
6940 1 15 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.047 0.183 25380
6941 1 15 . 1 1 63 63 LEU CB C 63 45.701 45.701 45.186 0.515 25380
6942 1 15 . 1 1 63 63 LEU H H 63 8.746 8.746 7.572 1.174 25380
6943 1 15 . 1 1 64 64 ASP N N 64 125.463 125.463 123.366 2.097 25380
6944 1 15 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.975 0.224 25380
6945 1 15 . 1 1 64 64 ASP C C 64 174.512 174.512 174.644 -0.132 25380
6946 1 15 . 1 1 64 64 ASP CA C 64 52.700 52.700 51.947 0.753 25380
6947 1 15 . 1 1 64 64 ASP CB C 64 43.954 43.954 45.303 -1.349 25380
6948 1 15 . 1 1 64 64 ASP H H 64 9.293 9.293 8.754 0.539 25380
6949 1 15 . 1 1 65 65 GLU N N 65 120.711 120.711 120.057 0.654 25380
6950 1 15 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.379 0.688 25380
6951 1 15 . 1 1 65 65 GLU C C 65 175.652 175.652 176.433 -0.781 25380
6952 1 15 . 1 1 65 65 GLU CA C 65 55.643 55.643 56.556 -0.913 25380
6953 1 15 . 1 1 65 65 GLU CB C 65 30.455 30.455 31.198 -0.743 25380
6954 1 15 . 1 1 65 65 GLU H H 65 8.715 8.715 8.584 0.131 25380
6955 1 15 . 1 1 66 66 VAL N N 66 122.936 122.936 117.735 5.201 25380
6956 1 15 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.349 0.081 25380
6957 1 15 . 1 1 66 66 VAL C C 66 175.065 175.065 176.105 -1.040 25380
6958 1 15 . 1 1 66 66 VAL CA C 66 60.991 60.991 61.430 -0.439 25380
6959 1 15 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.732 1.548 25380
6960 1 15 . 1 1 66 66 VAL H H 66 9.156 9.156 8.611 0.545 25380
6961 1 15 . 1 1 67 67 ARG N N 67 126.104 126.104 124.946 1.158 25380
6962 1 15 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.561 -0.020 25380
6963 1 15 . 1 1 67 67 ARG C C 67 176.708 176.708 175.630 1.078 25380
6964 1 15 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.541 0.539 25380
6965 1 15 . 1 1 67 67 ARG CB C 67 30.908 30.908 28.939 1.969 25380
6966 1 15 . 1 1 67 67 ARG H H 67 8.734 8.734 8.676 0.058 25380
6967 1 15 . 1 1 68 68 VAL N N 68 120.707 120.707 117.022 3.685 25380
6968 1 15 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.618 -0.466 25380
6969 1 15 . 1 1 68 68 VAL C C 68 175.931 175.931 176.125 -0.194 25380
6970 1 15 . 1 1 68 68 VAL CA C 68 62.776 62.776 60.765 2.011 25380
6971 1 15 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.078 1.411 25380
6972 1 15 . 1 1 68 68 VAL H H 68 8.384 8.384 7.885 0.499 25380
6973 1 15 . 1 1 69 69 SER N N 69 116.156 116.156 119.315 -3.159 25380
6974 1 15 . 1 1 69 69 SER HA H 69 4.693 4.693 4.235 0.458 25380
6975 1 15 . 1 1 69 69 SER C C 69 174.544 174.544 176.627 -2.083 25380
6976 1 15 . 1 1 69 69 SER CA C 69 57.754 57.754 61.803 -4.049 25380
6977 1 15 . 1 1 69 69 SER CB C 69 64.831 64.831 62.463 2.368 25380
6978 1 15 . 1 1 69 69 SER H H 69 8.067 8.067 7.931 0.136 25380
6979 1 15 . 1 1 70 70 THR N N 70 110.753 110.753 116.399 -5.646 25380
6980 1 15 . 1 1 70 70 THR HA H 70 4.152 4.152 4.220 -0.068 25380
6981 1 15 . 1 1 70 70 THR C C 70 174.865 174.865 175.371 -0.506 25380
6982 1 15 . 1 1 70 70 THR CA C 70 63.831 63.831 65.160 -1.329 25380
6983 1 15 . 1 1 70 70 THR CB C 70 68.956 68.956 68.467 0.489 25380
6984 1 15 . 1 1 70 70 THR H H 70 8.095 8.095 8.113 -0.018 25380
6985 1 15 . 1 1 71 71 ASP N N 71 121.817 121.817 120.619 1.198 25380
6986 1 15 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.588 0.002 25380
6987 1 15 . 1 1 71 71 ASP C C 71 176.746 176.746 176.729 0.017 25380
6988 1 15 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.039 -1.775 25380
6989 1 15 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.909 0.516 25380
6990 1 15 . 1 1 71 71 ASP H H 71 8.076 8.076 8.323 -0.247 25380
6991 1 15 . 1 1 72 72 GLU N N 72 123.635 123.635 115.553 8.082 25380
6992 1 15 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.568 -0.575 25380
6993 1 15 . 1 1 72 72 GLU C C 72 176.971 176.971 175.164 1.807 25380
6994 1 15 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.025 2.194 25380
6995 1 15 . 1 1 72 72 GLU CB C 72 29.702 29.702 31.683 -1.982 25380
6996 1 15 . 1 1 72 72 GLU H H 72 8.514 8.514 8.003 0.511 25380
6997 1 15 . 1 1 73 73 LYS N N 73 117.857 117.857 117.879 -0.022 25380
6998 1 15 . 1 1 73 73 LYS HA H 73 4.643 4.643 3.946 0.697 25380
6999 1 15 . 1 1 73 73 LYS C C 73 176.508 176.508 175.591 0.917 25380
7000 1 15 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.758 -0.678 25380
7001 1 15 . 1 1 73 73 LYS CB C 73 32.203 32.203 30.847 1.356 25380
7002 1 15 . 1 1 73 73 LYS H H 73 8.423 8.423 8.287 0.136 25380
7003 1 15 . 1 1 74 74 ASP N N 74 120.580 120.580 117.166 3.414 25380
7004 1 15 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.656 0.102 25380
7005 1 15 . 1 1 74 74 ASP C C 74 174.059 174.059 175.979 -1.920 25380
7006 1 15 . 1 1 74 74 ASP CA C 74 53.279 53.279 55.393 -2.114 25380
7007 1 15 . 1 1 74 74 ASP CB C 74 40.578 40.578 42.027 -1.449 25380
7008 1 15 . 1 1 74 74 ASP H H 74 7.918 7.918 8.468 -0.550 25380
7009 1 15 . 1 1 75 75 PHE N N 75 118.513 118.513 119.536 -1.023 25380
7010 1 15 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.715 -0.352 25380
7011 1 15 . 1 1 75 75 PHE C C 75 173.038 173.038 176.133 -3.095 25380
7012 1 15 . 1 1 75 75 PHE CA C 75 55.522 55.522 57.469 -1.947 25380
7013 1 15 . 1 1 75 75 PHE CB C 75 41.714 41.714 40.260 1.454 25380
7014 1 15 . 1 1 75 75 PHE H H 75 7.397 7.397 8.059 -0.662 25380
7015 1 15 . 1 1 76 76 LEU N N 76 116.773 116.773 123.183 -6.410 25380
7016 1 15 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.728 -0.085 25380
7017 1 15 . 1 1 76 76 LEU C C 76 177.553 177.553 176.191 1.362 25380
7018 1 15 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.559 -0.940 25380
7019 1 15 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.345 2.356 25380
7020 1 15 . 1 1 76 76 LEU H H 76 8.774 8.774 9.251 -0.477 25380
7021 1 15 . 1 1 77 77 TYR N N 77 118.377 118.377 124.439 -6.062 25380
7022 1 15 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.436 0.979 25380
7023 1 15 . 1 1 77 77 TYR C C 77 175.479 175.479 173.202 2.277 25380
7024 1 15 . 1 1 77 77 TYR CA C 77 58.391 58.391 56.220 2.171 25380
7025 1 15 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.154 0.946 25380
7026 1 15 . 1 1 77 77 TYR H H 77 8.589 8.589 9.247 -0.658 25380
7027 1 15 . 1 1 78 78 GLU N N 78 123.875 123.875 129.308 -5.433 25380
7028 1 15 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.885 0.088 25380
7029 1 15 . 1 1 78 78 GLU C C 78 174.120 174.120 173.857 0.263 25380
7030 1 15 . 1 1 78 78 GLU CA C 78 54.378 54.378 54.016 0.362 25380
7031 1 15 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.815 -1.175 25380
7032 1 15 . 1 1 78 78 GLU H H 78 9.576 9.576 8.747 0.829 25380
7033 1 15 . 1 1 79 79 LEU N N 79 128.661 128.661 126.830 1.831 25380
7034 1 15 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.457 0.832 25380
7035 1 15 . 1 1 79 79 LEU C C 79 174.219 174.219 175.528 -1.309 25380
7036 1 15 . 1 1 79 79 LEU CA C 79 53.149 53.149 54.069 -0.920 25380
7037 1 15 . 1 1 79 79 LEU CB C 79 46.630 46.630 43.353 3.277 25380
7038 1 15 . 1 1 79 79 LEU H H 79 9.139 9.139 8.665 0.473 25380
7039 1 15 . 1 1 80 80 HIS N N 80 124.886 124.886 122.817 2.069 25380
7040 1 15 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.929 0.501 25380
7041 1 15 . 1 1 80 80 HIS C C 80 173.346 173.346 175.511 -2.165 25380
7042 1 15 . 1 1 80 80 HIS CA C 80 53.149 53.149 53.773 -0.624 25380
7043 1 15 . 1 1 80 80 HIS CB C 80 30.768 30.768 31.989 -1.221 25380
7044 1 15 . 1 1 80 80 HIS H H 80 8.897 8.897 9.146 -0.248 25380
7045 1 15 . 1 1 81 81 ILE N N 81 125.173 125.173 124.787 0.386 25380
7046 1 15 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.862 0.428 25380
7047 1 15 . 1 1 81 81 ILE C C 81 174.600 174.600 174.136 0.464 25380
7048 1 15 . 1 1 81 81 ILE CA C 81 60.500 60.500 61.911 -1.411 25380
7049 1 15 . 1 1 81 81 ILE CB C 81 39.700 39.700 37.116 2.584 25380
7050 1 15 . 1 1 81 81 ILE H H 81 8.909 8.909 8.259 0.650 25380
7051 1 16 . 1 1 2 2 HIS N N 2 120.430 120.430 127.155 -6.725 25380
7052 1 16 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.848 -0.113 25380
7053 1 16 . 1 1 2 2 HIS C C 2 173.884 173.884 174.946 -1.062 25380
7054 1 16 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.163 -1.111 25380
7055 1 16 . 1 1 2 2 HIS CB C 2 28.666 28.666 30.253 -1.587 25380
7056 1 16 . 1 1 2 2 HIS H H 2 8.678 8.678 8.734 -0.056 25380
7057 1 16 . 1 1 3 3 MET N N 3 122.377 122.377 124.968 -2.591 25380
7058 1 16 . 1 1 3 3 MET HA H 3 4.207 4.207 4.772 -0.565 25380
7059 1 16 . 1 1 3 3 MET C C 3 174.584 174.584 176.424 -1.840 25380
7060 1 16 . 1 1 3 3 MET CA C 3 56.550 56.550 54.374 2.176 25380
7061 1 16 . 1 1 3 3 MET CB C 3 33.426 33.426 32.894 0.532 25380
7062 1 16 . 1 1 3 3 MET H H 3 8.240 8.240 8.474 -0.234 25380
7063 1 16 . 1 1 4 4 LYS N N 4 123.568 123.568 119.692 3.876 25380
7064 1 16 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.070 0.769 25380
7065 1 16 . 1 1 4 4 LYS C C 4 175.906 175.906 176.165 -0.259 25380
7066 1 16 . 1 1 4 4 LYS CA C 4 54.800 54.800 57.467 -2.667 25380
7067 1 16 . 1 1 4 4 LYS CB C 4 34.900 34.900 32.660 2.240 25380
7068 1 16 . 1 1 4 4 LYS H H 4 8.351 8.351 7.136 1.215 25380
7069 1 16 . 1 1 5 5 LEU N N 5 123.568 123.568 118.088 5.480 25380
7070 1 16 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.249 -0.410 25380
7071 1 16 . 1 1 5 5 LEU C C 5 175.900 175.900 177.454 -1.554 25380
7072 1 16 . 1 1 5 5 LEU CA C 5 53.350 53.350 54.647 -1.297 25380
7073 1 16 . 1 1 5 5 LEU CB C 5 45.900 45.900 43.682 2.218 25380
7074 1 16 . 1 1 5 5 LEU H H 5 8.281 8.281 7.803 0.478 25380
7075 1 16 . 1 1 6 6 VAL N N 6 121.564 121.564 118.347 3.217 25380
7076 1 16 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.524 -0.098 25380
7077 1 16 . 1 1 6 6 VAL C C 6 178.200 178.200 174.525 3.675 25380
7078 1 16 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.763 2.437 25380
7079 1 16 . 1 1 6 6 VAL CB C 6 33.200 33.200 35.865 -2.665 25380
7080 1 16 . 1 1 6 6 VAL H H 6 9.276 9.276 8.988 0.288 25380
7081 1 16 . 1 1 7 7 LEU N N 7 121.564 121.564 124.100 -2.536 25380
7082 1 16 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.089 -0.663 25380
7083 1 16 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.180 10.020 25380
7084 1 16 . 1 1 7 7 LEU CB C 7 33.200 33.200 45.006 -11.806 25380
7085 1 16 . 1 1 7 7 LEU H H 7 9.276 9.276 8.600 0.676 25380
7086 1 16 . 1 1 8 8 ALA C C 8 177.040 177.040 178.011 -0.971 25380
7087 1 16 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.019 -0.318 25380
7088 1 16 . 1 1 8 8 ALA CB C 8 20.864 20.864 20.004 0.860 25380
7089 1 16 . 1 1 9 9 LYS N N 9 119.845 119.845 121.786 -1.941 25380
7090 1 16 . 1 1 9 9 LYS HA H 9 4.128 4.128 3.995 0.133 25380
7091 1 16 . 1 1 9 9 LYS C C 9 176.075 176.075 178.669 -2.594 25380
7092 1 16 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.495 -2.734 25380
7093 1 16 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.470 0.449 25380
7094 1 16 . 1 1 9 9 LYS H H 9 8.545 8.545 8.869 -0.324 25380
7095 1 16 . 1 1 10 10 ASN N N 10 119.279 119.279 117.210 2.069 25380
7096 1 16 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.502 0.143 25380
7097 1 16 . 1 1 10 10 ASN C C 10 175.443 175.443 177.554 -2.111 25380
7098 1 16 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.944 -2.287 25380
7099 1 16 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.990 0.787 25380
7100 1 16 . 1 1 10 10 ASN H H 10 8.592 8.592 9.197 -0.605 25380
7101 1 16 . 1 1 11 11 THR N N 11 111.876 111.876 109.317 2.559 25380
7102 1 16 . 1 1 11 11 THR HA H 11 4.311 4.311 4.394 -0.083 25380
7103 1 16 . 1 1 11 11 THR C C 11 174.666 174.666 175.696 -1.030 25380
7104 1 16 . 1 1 11 11 THR CA C 11 62.044 62.044 63.423 -1.379 25380
7105 1 16 . 1 1 11 11 THR CB C 11 69.895 69.895 69.354 0.541 25380
7106 1 16 . 1 1 11 11 THR H H 11 8.058 8.058 8.205 -0.147 25380
7107 1 16 . 1 1 12 12 ARG N N 12 121.152 121.152 121.563 -0.411 25380
7108 1 16 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.420 -0.158 25380
7109 1 16 . 1 1 12 12 ARG C C 12 176.714 176.714 176.640 0.074 25380
7110 1 16 . 1 1 12 12 ARG CA C 12 56.822 56.822 55.940 0.882 25380
7111 1 16 . 1 1 12 12 ARG CB C 12 30.702 30.702 30.661 0.041 25380
7112 1 16 . 1 1 12 12 ARG H H 12 8.291 8.291 7.985 0.306 25380
7113 1 16 . 1 1 13 13 LYS N N 13 120.459 120.459 121.327 -0.868 25380
7114 1 16 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.073 -0.177 25380
7115 1 16 . 1 1 13 13 LYS C C 13 176.682 176.682 177.248 -0.566 25380
7116 1 16 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.371 -0.393 25380
7117 1 16 . 1 1 13 13 LYS CB C 13 32.498 32.498 32.169 0.329 25380
7118 1 16 . 1 1 13 13 LYS H H 13 8.286 8.286 7.970 0.316 25380
7119 1 16 . 1 1 14 14 SER N N 14 114.568 114.568 121.859 -7.291 25380
7120 1 16 . 1 1 14 14 SER HA H 14 4.371 4.371 4.415 -0.044 25380
7121 1 16 . 1 1 14 14 SER C C 14 173.990 173.990 174.585 -0.595 25380
7122 1 16 . 1 1 14 14 SER CA C 14 58.617 58.617 58.730 -0.113 25380
7123 1 16 . 1 1 14 14 SER CB C 14 63.933 63.933 64.313 -0.380 25380
7124 1 16 . 1 1 14 14 SER H H 14 7.957 7.957 8.741 -0.784 25380
7125 1 16 . 1 1 15 15 ASP N N 15 121.565 121.565 119.115 2.450 25380
7126 1 16 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.807 -0.206 25380
7127 1 16 . 1 1 15 15 ASP C C 15 175.684 175.684 176.481 -0.797 25380
7128 1 16 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.785 0.364 25380
7129 1 16 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.856 0.373 25380
7130 1 16 . 1 1 15 15 ASP H H 15 8.166 8.166 8.350 -0.184 25380
7131 1 16 . 1 1 16 16 ALA N N 16 124.173 124.173 122.576 1.597 25380
7132 1 16 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.287 0.084 25380
7133 1 16 . 1 1 16 16 ALA C C 16 177.184 177.184 178.863 -1.679 25380
7134 1 16 . 1 1 16 16 ALA CA C 16 52.337 52.337 53.146 -0.809 25380
7135 1 16 . 1 1 16 16 ALA CB C 16 19.359 19.359 18.654 0.705 25380
7136 1 16 . 1 1 16 16 ALA H H 16 8.163 8.163 8.388 -0.225 25380
7137 1 16 . 1 1 17 17 LYS N N 17 121.152 121.152 119.496 1.656 25380
7138 1 16 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.132 0.294 25380
7139 1 16 . 1 1 17 17 LYS C C 17 175.488 175.488 178.006 -2.518 25380
7140 1 16 . 1 1 17 17 LYS CA C 17 56.205 56.205 59.070 -2.865 25380
7141 1 16 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.453 1.843 25380
7142 1 16 . 1 1 17 17 LYS H H 17 8.363 8.363 8.231 0.132 25380
7143 1 16 . 1 1 18 18 SER N N 18 116.448 116.448 111.967 4.481 25380
7144 1 16 . 1 1 18 18 SER HA H 18 5.355 5.355 4.717 0.638 25380
7145 1 16 . 1 1 18 18 SER C C 18 173.887 173.887 175.538 -1.651 25380
7146 1 16 . 1 1 18 18 SER CA C 18 57.248 57.248 57.828 -0.580 25380
7147 1 16 . 1 1 18 18 SER CB C 18 64.962 64.962 64.399 0.563 25380
7148 1 16 . 1 1 18 18 SER H H 18 8.206 8.206 8.015 0.191 25380
7149 1 16 . 1 1 19 19 VAL N N 19 117.867 117.867 123.368 -5.501 25380
7150 1 16 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.713 -0.093 25380
7151 1 16 . 1 1 19 19 VAL C C 19 174.169 174.169 177.254 -3.085 25380
7152 1 16 . 1 1 19 19 VAL CA C 19 59.546 59.546 66.772 -7.226 25380
7153 1 16 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.916 3.986 25380
7154 1 16 . 1 1 19 19 VAL H H 19 9.086 9.086 7.346 1.740 25380
7155 1 16 . 1 1 20 20 GLU N N 20 120.843 120.843 119.636 1.207 25380
7156 1 16 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.232 0.636 25380
7157 1 16 . 1 1 20 20 GLU C C 20 178.747 178.747 178.633 0.114 25380
7158 1 16 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.460 -4.908 25380
7159 1 16 . 1 1 20 20 GLU CB C 20 31.099 31.099 29.168 1.931 25380
7160 1 16 . 1 1 20 20 GLU H H 20 8.841 8.841 8.720 0.121 25380
7161 1 16 . 1 1 21 21 LEU N N 21 122.653 122.653 119.500 3.153 25380
7162 1 16 . 1 1 21 21 LEU HA H 21 3.443 3.443 4.016 -0.573 25380
7163 1 16 . 1 1 21 21 LEU C C 21 178.799 178.799 179.287 -0.488 25380
7164 1 16 . 1 1 21 21 LEU CA C 21 58.707 58.707 58.100 0.607 25380
7165 1 16 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.685 -3.114 25380
7166 1 16 . 1 1 21 21 LEU H H 21 8.744 8.744 7.666 1.078 25380
7167 1 16 . 1 1 22 22 GLU N N 22 115.392 115.392 119.103 -3.711 25380
7168 1 16 . 1 1 22 22 GLU HA H 22 3.989 3.989 3.742 0.247 25380
7169 1 16 . 1 1 22 22 GLU C C 22 179.328 179.328 178.793 0.535 25380
7170 1 16 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.456 0.624 25380
7171 1 16 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.252 -0.418 25380
7172 1 16 . 1 1 22 22 GLU H H 22 8.744 8.744 7.581 1.163 25380
7173 1 16 . 1 1 23 23 ASP N N 23 118.597 118.597 120.633 -2.036 25380
7174 1 16 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.542 0.069 25380
7175 1 16 . 1 1 23 23 ASP C C 23 179.139 179.139 178.978 0.161 25380
7176 1 16 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.093 0.426 25380
7177 1 16 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.559 -0.117 25380
7178 1 16 . 1 1 23 23 ASP H H 23 7.098 7.098 8.399 -1.301 25380
7179 1 16 . 1 1 24 24 LEU N N 24 119.869 119.869 121.121 -1.252 25380
7180 1 16 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.752 0.182 25380
7181 1 16 . 1 1 24 24 LEU C C 24 179.045 179.045 178.933 0.112 25380
7182 1 16 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.315 -0.766 25380
7183 1 16 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.830 -0.280 25380
7184 1 16 . 1 1 24 24 LEU H H 24 7.576 7.576 8.596 -1.020 25380
7185 1 16 . 1 1 25 25 TYR N N 25 118.100 118.100 118.891 -0.791 25380
7186 1 16 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.518 0.849 25380
7187 1 16 . 1 1 25 25 TYR C C 25 177.945 177.945 177.738 0.207 25380
7188 1 16 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.324 1.282 25380
7189 1 16 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.443 -0.495 25380
7190 1 16 . 1 1 25 25 TYR H H 25 8.320 8.320 7.417 0.903 25380
7191 1 16 . 1 1 26 26 HIS N N 26 119.440 119.440 118.500 0.940 25380
7192 1 16 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.435 -0.064 25380
7193 1 16 . 1 1 26 26 HIS C C 26 176.559 176.559 178.151 -1.592 25380
7194 1 16 . 1 1 26 26 HIS CA C 26 59.519 59.519 58.572 0.947 25380
7195 1 16 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.310 -2.182 25380
7196 1 16 . 1 1 26 26 HIS H H 26 8.383 8.383 8.497 -0.114 25380
7197 1 16 . 1 1 27 27 GLU N N 27 119.915 119.915 120.334 -0.419 25380
7198 1 16 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.072 0.186 25380
7199 1 16 . 1 1 27 27 GLU C C 27 179.163 179.163 178.591 0.572 25380
7200 1 16 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.399 0.676 25380
7201 1 16 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.733 -0.198 25380
7202 1 16 . 1 1 27 27 GLU H H 27 8.288 8.288 9.007 -0.719 25380
7203 1 16 . 1 1 28 28 PHE N N 28 120.500 120.500 119.491 1.009 25380
7204 1 16 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.237 0.735 25380
7205 1 16 . 1 1 28 28 PHE C C 28 177.386 177.386 176.652 0.734 25380
7206 1 16 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.907 -0.506 25380
7207 1 16 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.416 0.152 25380
7208 1 16 . 1 1 28 28 PHE H H 28 8.568 8.568 7.772 0.796 25380
7209 1 16 . 1 1 29 29 SER N N 29 114.306 114.306 114.205 0.101 25380
7210 1 16 . 1 1 29 29 SER HA H 29 4.288 4.288 4.153 0.135 25380
7211 1 16 . 1 1 29 29 SER C C 29 175.656 175.656 176.103 -0.447 25380
7212 1 16 . 1 1 29 29 SER CA C 29 61.058 61.058 60.257 0.801 25380
7213 1 16 . 1 1 29 29 SER CB C 29 63.555 63.555 63.595 -0.040 25380
7214 1 16 . 1 1 29 29 SER H H 29 8.479 8.479 8.109 0.370 25380
7215 1 16 . 1 1 30 30 GLU N N 30 118.322 118.322 120.393 -2.071 25380
7216 1 16 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.240 -0.148 25380
7217 1 16 . 1 1 30 30 GLU C C 30 177.312 177.312 176.513 0.799 25380
7218 1 16 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.777 -0.197 25380
7219 1 16 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.622 -1.045 25380
7220 1 16 . 1 1 30 30 GLU H H 30 8.428 8.428 7.992 0.436 25380
7221 1 16 . 1 1 31 31 ASP N N 31 115.630 115.630 117.798 -2.168 25380
7222 1 16 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.854 -0.044 25380
7223 1 16 . 1 1 31 31 ASP C C 31 175.723 175.723 173.814 1.909 25380
7224 1 16 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.720 1.254 25380
7225 1 16 . 1 1 31 31 ASP CB C 31 40.818 40.818 43.828 -3.010 25380
7226 1 16 . 1 1 31 31 ASP H H 31 7.303 7.303 7.897 -0.594 25380
7227 1 16 . 1 1 32 32 LYS N N 32 114.357 114.357 120.844 -6.487 25380
7228 1 16 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.509 -0.682 25380
7229 1 16 . 1 1 32 32 LYS C C 32 175.716 175.716 175.929 -0.213 25380
7230 1 16 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.405 0.757 25380
7231 1 16 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.931 -5.550 25380
7232 1 16 . 1 1 32 32 LYS H H 32 7.148 7.148 8.236 -1.088 25380
7233 1 16 . 1 1 33 33 ARG N N 33 120.929 120.929 125.024 -4.095 25380
7234 1 16 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.603 -0.402 25380
7235 1 16 . 1 1 33 33 ARG C C 33 173.982 173.982 173.794 0.188 25380
7236 1 16 . 1 1 33 33 ARG CA C 33 56.194 56.194 54.984 1.210 25380
7237 1 16 . 1 1 33 33 ARG CB C 33 30.642 30.642 34.261 -3.619 25380
7238 1 16 . 1 1 33 33 ARG H H 33 7.388 7.388 8.979 -1.591 25380
7239 1 16 . 1 1 34 34 SER N N 34 115.867 115.867 114.969 0.898 25380
7240 1 16 . 1 1 34 34 SER HA H 34 5.355 5.355 4.695 0.660 25380
7241 1 16 . 1 1 34 34 SER C C 34 172.754 172.754 172.182 0.572 25380
7242 1 16 . 1 1 34 34 SER CA C 34 58.236 58.236 56.897 1.339 25380
7243 1 16 . 1 1 34 34 SER CB C 34 65.212 65.212 65.895 -0.683 25380
7244 1 16 . 1 1 34 34 SER H H 34 8.173 8.173 8.383 -0.210 25380
7245 1 16 . 1 1 35 35 ILE N N 35 119.621 119.621 117.891 1.730 25380
7246 1 16 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.899 -0.036 25380
7247 1 16 . 1 1 35 35 ILE C C 35 174.069 174.069 173.959 0.110 25380
7248 1 16 . 1 1 35 35 ILE CA C 35 59.956 59.956 58.645 1.311 25380
7249 1 16 . 1 1 35 35 ILE CB C 35 40.655 40.655 42.747 -2.092 25380
7250 1 16 . 1 1 35 35 ILE H H 35 6.779 6.779 8.296 -1.517 25380
7251 1 16 . 1 1 36 36 PHE N N 36 124.305 124.305 122.196 2.109 25380
7252 1 16 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.404 -0.951 25380
7253 1 16 . 1 1 36 36 PHE C C 36 173.204 173.204 174.698 -1.494 25380
7254 1 16 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.605 -0.189 25380
7255 1 16 . 1 1 36 36 PHE CB C 36 44.817 44.817 42.879 1.938 25380
7256 1 16 . 1 1 36 36 PHE H H 36 8.411 8.411 9.191 -0.780 25380
7257 1 16 . 1 1 37 37 TYR N N 37 118.743 118.743 126.781 -8.038 25380
7258 1 16 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.177 0.393 25380
7259 1 16 . 1 1 37 37 TYR C C 37 175.455 175.455 173.948 1.507 25380
7260 1 16 . 1 1 37 37 TYR CA C 37 56.518 56.518 56.181 0.337 25380
7261 1 16 . 1 1 37 37 TYR CB C 37 40.991 40.991 40.501 0.490 25380
7262 1 16 . 1 1 37 37 TYR H H 37 8.353 8.353 9.554 -1.201 25380
7263 1 16 . 1 1 38 38 PHE N N 38 119.236 119.236 130.425 -11.189 25380
7264 1 16 . 1 1 38 38 PHE HA H 38 5.160 5.160 3.934 1.226 25380
7265 1 16 . 1 1 38 38 PHE C C 38 174.650 174.650 172.625 2.025 25380
7266 1 16 . 1 1 38 38 PHE CA C 38 56.842 56.842 56.240 0.602 25380
7267 1 16 . 1 1 38 38 PHE CB C 38 42.619 42.619 38.238 4.381 25380
7268 1 16 . 1 1 38 38 PHE H H 38 9.756 9.756 8.753 1.003 25380
7269 1 16 . 1 1 39 39 ALA N N 39 122.516 122.516 128.914 -6.398 25380
7270 1 16 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.423 0.117 25380
7271 1 16 . 1 1 39 39 ALA C C 39 177.042 177.042 174.512 2.530 25380
7272 1 16 . 1 1 39 39 ALA CA C 39 50.843 50.843 48.581 2.261 25380
7273 1 16 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.833 -3.255 25380
7274 1 16 . 1 1 39 39 ALA H H 39 7.738 7.738 8.358 -0.620 25380
7275 1 16 . 1 1 40 40 PRO C C 40 175.411 175.411 176.772 -1.361 25380
7276 1 16 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.385 1.903 25380
7277 1 16 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.492 -1.387 25380
7278 1 16 . 1 1 41 41 THR N N 41 105.878 105.878 116.377 -10.499 25380
7279 1 16 . 1 1 41 41 THR HA H 41 4.190 4.190 3.895 0.295 25380
7280 1 16 . 1 1 41 41 THR C C 41 176.400 176.400 175.268 1.132 25380
7281 1 16 . 1 1 41 41 THR CA C 41 61.937 61.937 64.827 -2.890 25380
7282 1 16 . 1 1 41 41 THR CB C 41 68.331 68.331 68.815 -0.484 25380
7283 1 16 . 1 1 41 41 THR H H 41 6.715 6.715 8.311 -1.596 25380
7284 1 16 . 1 1 42 42 ASN N N 42 118.863 118.863 118.517 0.346 25380
7285 1 16 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.384 0.151 25380
7286 1 16 . 1 1 42 42 ASN C C 42 173.764 173.764 175.455 -1.691 25380
7287 1 16 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.569 -1.393 25380
7288 1 16 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.578 4.136 25380
7289 1 16 . 1 1 42 42 ASN H H 42 7.153 7.153 8.435 -1.282 25380
7290 1 16 . 1 1 43 43 ALA N N 43 126.174 126.174 118.771 7.403 25380
7291 1 16 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.335 0.090 25380
7292 1 16 . 1 1 43 43 ALA C C 43 179.308 179.308 176.528 2.780 25380
7293 1 16 . 1 1 43 43 ALA CA C 43 51.982 51.982 51.593 0.389 25380
7294 1 16 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.671 -1.377 25380
7295 1 16 . 1 1 43 43 ALA H H 43 9.465 9.465 7.645 1.820 25380
7296 1 16 . 1 1 44 44 HIS N N 44 126.251 126.251 115.982 10.269 25380
7297 1 16 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.325 -0.498 25380
7298 1 16 . 1 1 44 44 HIS C C 44 177.407 177.407 174.462 2.945 25380
7299 1 16 . 1 1 44 44 HIS CA C 44 61.025 61.025 57.136 3.889 25380
7300 1 16 . 1 1 44 44 HIS CB C 44 28.630 28.630 26.822 1.808 25380
7301 1 16 . 1 1 44 44 HIS H H 44 9.407 9.407 7.710 1.697 25380
7302 1 16 . 1 1 45 45 LYS N N 45 114.990 114.990 118.747 -3.757 25380
7303 1 16 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.388 -0.505 25380
7304 1 16 . 1 1 45 45 LYS C C 45 178.284 178.284 177.065 1.219 25380
7305 1 16 . 1 1 45 45 LYS CA C 45 59.249 59.249 57.943 1.306 25380
7306 1 16 . 1 1 45 45 LYS CB C 45 31.834 31.834 33.645 -1.811 25380
7307 1 16 . 1 1 45 45 LYS H H 45 8.960 8.960 8.010 0.950 25380
7308 1 16 . 1 1 46 46 ASP N N 46 120.411 120.411 120.631 -0.220 25380
7309 1 16 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.428 -0.002 25380
7310 1 16 . 1 1 46 46 ASP C C 46 177.773 177.773 178.288 -0.515 25380
7311 1 16 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.550 -0.534 25380
7312 1 16 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.258 -0.361 25380
7313 1 16 . 1 1 46 46 ASP H H 46 6.777 6.777 8.694 -1.917 25380
7314 1 16 . 1 1 47 47 MET N N 47 118.178 118.178 116.321 1.857 25380
7315 1 16 . 1 1 47 47 MET HA H 47 3.879 3.879 4.455 -0.576 25380
7316 1 16 . 1 1 47 47 MET C C 47 179.499 179.499 177.660 1.839 25380
7317 1 16 . 1 1 47 47 MET CA C 47 56.052 56.052 59.237 -3.185 25380
7318 1 16 . 1 1 47 47 MET CB C 47 29.601 29.601 32.404 -2.803 25380
7319 1 16 . 1 1 47 47 MET H H 47 7.367 7.367 8.066 -0.699 25380
7320 1 16 . 1 1 48 48 LEU N N 48 117.665 117.665 120.374 -2.709 25380
7321 1 16 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.869 -0.022 25380
7322 1 16 . 1 1 48 48 LEU C C 48 179.843 179.843 179.007 0.836 25380
7323 1 16 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.291 0.290 25380
7324 1 16 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.315 -0.362 25380
7325 1 16 . 1 1 48 48 LEU H H 48 7.672 7.672 7.588 0.084 25380
7326 1 16 . 1 1 49 49 LYS N N 49 119.326 119.326 118.557 0.769 25380
7327 1 16 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.586 0.541 25380
7328 1 16 . 1 1 49 49 LYS C C 49 179.684 179.684 178.303 1.381 25380
7329 1 16 . 1 1 49 49 LYS CA C 49 58.799 58.799 58.952 -0.153 25380
7330 1 16 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.849 -0.396 25380
7331 1 16 . 1 1 49 49 LYS H H 49 7.420 7.420 7.883 -0.463 25380
7332 1 16 . 1 1 50 50 ALA N N 50 122.022 122.022 122.384 -0.362 25380
7333 1 16 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.262 0.781 25380
7334 1 16 . 1 1 50 50 ALA C C 50 178.818 178.818 178.510 0.308 25380
7335 1 16 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.518 0.651 25380
7336 1 16 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.394 -0.094 25380
7337 1 16 . 1 1 50 50 ALA H H 50 7.551 7.551 7.790 -0.239 25380
7338 1 16 . 1 1 51 51 VAL N N 51 118.165 118.165 117.848 0.317 25380
7339 1 16 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.489 -0.047 25380
7340 1 16 . 1 1 51 51 VAL C C 51 178.646 178.646 177.981 0.665 25380
7341 1 16 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.304 0.902 25380
7342 1 16 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.688 0.765 25380
7343 1 16 . 1 1 51 51 VAL H H 51 7.226 7.226 7.336 -0.110 25380
7344 1 16 . 1 1 52 52 ASP N N 52 122.298 122.298 120.325 1.973 25380
7345 1 16 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.294 0.077 25380
7346 1 16 . 1 1 52 52 ASP C C 52 177.898 177.898 179.055 -1.157 25380
7347 1 16 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.045 0.526 25380
7348 1 16 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.139 0.247 25380
7349 1 16 . 1 1 52 52 ASP H H 52 8.232 8.232 7.206 1.026 25380
7350 1 16 . 1 1 53 53 PHE N N 53 121.541 121.541 119.728 1.813 25380
7351 1 16 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.321 0.000 25380
7352 1 16 . 1 1 53 53 PHE C C 53 177.224 177.224 178.181 -0.957 25380
7353 1 16 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.376 2.704 25380
7354 1 16 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.618 2.082 25380
7355 1 16 . 1 1 53 53 PHE H H 53 8.240 8.240 7.389 0.851 25380
7356 1 16 . 1 1 54 54 PHE N N 54 115.925 115.925 116.974 -1.049 25380
7357 1 16 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.110 -0.455 25380
7358 1 16 . 1 1 54 54 PHE C C 54 178.269 178.269 177.695 0.574 25380
7359 1 16 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.679 4.521 25380
7360 1 16 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.744 0.834 25380
7361 1 16 . 1 1 54 54 PHE H H 54 7.755 7.755 7.911 -0.156 25380
7362 1 16 . 1 1 55 55 LYS N N 55 120.251 120.251 118.241 2.010 25380
7363 1 16 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.077 0.349 25380
7364 1 16 . 1 1 55 55 LYS C C 55 181.484 181.484 178.223 3.261 25380
7365 1 16 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.752 0.877 25380
7366 1 16 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.361 -0.622 25380
7367 1 16 . 1 1 55 55 LYS H H 55 8.213 8.213 7.443 0.770 25380
7368 1 16 . 1 1 56 56 GLU N N 56 120.146 120.146 117.382 2.764 25380
7369 1 16 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.091 -0.098 25380
7370 1 16 . 1 1 56 56 GLU C C 56 178.085 178.085 177.405 0.680 25380
7371 1 16 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.340 0.448 25380
7372 1 16 . 1 1 56 56 GLU CB C 56 28.596 28.596 29.957 -1.361 25380
7373 1 16 . 1 1 56 56 GLU H H 56 7.850 7.850 7.791 0.059 25380
7374 1 16 . 1 1 57 57 LYS N N 57 115.940 115.940 118.983 -3.043 25380
7375 1 16 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.242 -0.140 25380
7376 1 16 . 1 1 57 57 LYS C C 57 176.225 176.225 176.657 -0.432 25380
7377 1 16 . 1 1 57 57 LYS CA C 57 54.572 54.572 54.817 -0.245 25380
7378 1 16 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.226 -1.190 25380
7379 1 16 . 1 1 57 57 LYS H H 57 7.019 7.019 7.505 -0.486 25380
7380 1 16 . 1 1 58 58 GLY N N 58 106.593 106.593 107.948 -1.355 25380
7381 1 16 . 1 1 58 58 GLY C C 58 174.350 174.350 175.009 -0.659 25380
7382 1 16 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.566 -0.066 25380
7383 1 16 . 1 1 58 58 GLY H H 58 7.883 7.883 8.491 -0.608 25380
7384 1 16 . 1 1 59 59 HIS N N 59 117.962 117.962 117.019 0.943 25380
7385 1 16 . 1 1 59 59 HIS HA H 59 4.867 4.867 3.967 0.900 25380
7386 1 16 . 1 1 59 59 HIS C C 59 173.271 173.271 175.013 -1.742 25380
7387 1 16 . 1 1 59 59 HIS CA C 59 54.778 54.778 56.772 -1.994 25380
7388 1 16 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.904 1.781 25380
7389 1 16 . 1 1 59 59 HIS H H 59 8.218 8.218 7.974 0.244 25380
7390 1 16 . 1 1 60 60 THR N N 60 119.624 119.624 110.888 8.736 25380
7391 1 16 . 1 1 60 60 THR HA H 60 4.430 4.430 4.251 0.179 25380
7392 1 16 . 1 1 60 60 THR C C 60 171.430 171.430 174.543 -3.113 25380
7393 1 16 . 1 1 60 60 THR CA C 60 63.480 63.480 60.131 3.349 25380
7394 1 16 . 1 1 60 60 THR CB C 60 69.761 69.761 70.174 -0.413 25380
7395 1 16 . 1 1 60 60 THR H H 60 8.780 8.780 7.526 1.254 25380
7396 1 16 . 1 1 61 61 ALA N N 61 126.706 126.706 130.325 -3.619 25380
7397 1 16 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.225 1.021 25380
7398 1 16 . 1 1 61 61 ALA C C 61 174.753 174.753 176.992 -2.239 25380
7399 1 16 . 1 1 61 61 ALA CA C 61 49.772 49.772 54.271 -4.499 25380
7400 1 16 . 1 1 61 61 ALA CB C 61 22.889 22.889 19.703 3.186 25380
7401 1 16 . 1 1 61 61 ALA H H 61 7.795 7.795 8.694 -0.899 25380
7402 1 16 . 1 1 62 62 TYR N N 62 117.859 117.859 115.705 2.154 25380
7403 1 16 . 1 1 62 62 TYR C C 62 173.431 173.431 173.271 0.160 25380
7404 1 16 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.796 -1.149 25380
7405 1 16 . 1 1 62 62 TYR CB C 62 40.549 40.549 41.391 -0.842 25380
7406 1 16 . 1 1 62 62 TYR H H 62 8.711 8.711 7.917 0.794 25380
7407 1 16 . 1 1 63 63 LEU N N 63 125.044 125.044 124.420 0.624 25380
7408 1 16 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.631 0.780 25380
7409 1 16 . 1 1 63 63 LEU C C 63 175.319 175.319 174.010 1.309 25380
7410 1 16 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.332 -0.102 25380
7411 1 16 . 1 1 63 63 LEU CB C 63 45.701 45.701 45.056 0.645 25380
7412 1 16 . 1 1 63 63 LEU H H 63 8.746 8.746 7.639 1.107 25380
7413 1 16 . 1 1 64 64 ASP N N 64 125.463 125.463 123.566 1.897 25380
7414 1 16 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.817 0.382 25380
7415 1 16 . 1 1 64 64 ASP C C 64 174.512 174.512 174.827 -0.315 25380
7416 1 16 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.092 0.609 25380
7417 1 16 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.670 -0.716 25380
7418 1 16 . 1 1 64 64 ASP H H 64 9.293 9.293 8.766 0.527 25380
7419 1 16 . 1 1 65 65 GLU N N 65 120.711 120.711 119.663 1.048 25380
7420 1 16 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.374 0.693 25380
7421 1 16 . 1 1 65 65 GLU C C 65 175.652 175.652 176.278 -0.626 25380
7422 1 16 . 1 1 65 65 GLU CA C 65 55.643 55.643 57.040 -1.397 25380
7423 1 16 . 1 1 65 65 GLU CB C 65 30.455 30.455 31.085 -0.630 25380
7424 1 16 . 1 1 65 65 GLU H H 65 8.715 8.715 8.587 0.128 25380
7425 1 16 . 1 1 66 66 VAL N N 66 122.936 122.936 121.269 1.667 25380
7426 1 16 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.158 0.272 25380
7427 1 16 . 1 1 66 66 VAL C C 66 175.065 175.065 175.506 -0.441 25380
7428 1 16 . 1 1 66 66 VAL CA C 66 60.991 60.991 62.465 -1.474 25380
7429 1 16 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.798 1.482 25380
7430 1 16 . 1 1 66 66 VAL H H 66 9.156 9.156 8.524 0.632 25380
7431 1 16 . 1 1 67 67 ARG N N 67 126.104 126.104 128.640 -2.536 25380
7432 1 16 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.442 0.099 25380
7433 1 16 . 1 1 67 67 ARG C C 67 176.708 176.708 175.860 0.848 25380
7434 1 16 . 1 1 67 67 ARG CA C 67 56.080 56.080 56.514 -0.434 25380
7435 1 16 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.479 1.429 25380
7436 1 16 . 1 1 67 67 ARG H H 67 8.734 8.734 8.812 -0.078 25380
7437 1 16 . 1 1 68 68 VAL N N 68 120.707 120.707 117.761 2.946 25380
7438 1 16 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.525 -0.373 25380
7439 1 16 . 1 1 68 68 VAL C C 68 175.931 175.931 176.046 -0.115 25380
7440 1 16 . 1 1 68 68 VAL CA C 68 62.776 62.776 60.769 2.007 25380
7441 1 16 . 1 1 68 68 VAL CB C 68 32.489 32.489 30.645 1.845 25380
7442 1 16 . 1 1 68 68 VAL H H 68 8.384 8.384 7.947 0.437 25380
7443 1 16 . 1 1 69 69 SER N N 69 116.156 116.156 118.929 -2.773 25380
7444 1 16 . 1 1 69 69 SER HA H 69 4.693 4.693 4.337 0.356 25380
7445 1 16 . 1 1 69 69 SER C C 69 174.544 174.544 176.020 -1.476 25380
7446 1 16 . 1 1 69 69 SER CA C 69 57.754 57.754 60.905 -3.151 25380
7447 1 16 . 1 1 69 69 SER CB C 69 64.831 64.831 62.798 2.033 25380
7448 1 16 . 1 1 69 69 SER H H 69 8.067 8.067 8.091 -0.024 25380
7449 1 16 . 1 1 70 70 THR N N 70 110.753 110.753 113.482 -2.729 25380
7450 1 16 . 1 1 70 70 THR HA H 70 4.152 4.152 4.186 -0.034 25380
7451 1 16 . 1 1 70 70 THR C C 70 174.865 174.865 175.001 -0.136 25380
7452 1 16 . 1 1 70 70 THR CA C 70 63.831 63.831 63.985 -0.154 25380
7453 1 16 . 1 1 70 70 THR CB C 70 68.956 68.956 68.854 0.102 25380
7454 1 16 . 1 1 70 70 THR H H 70 8.095 8.095 7.979 0.116 25380
7455 1 16 . 1 1 71 71 ASP N N 71 121.817 121.817 120.969 0.848 25380
7456 1 16 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.583 0.007 25380
7457 1 16 . 1 1 71 71 ASP C C 71 176.746 176.746 177.115 -0.369 25380
7458 1 16 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.287 -2.023 25380
7459 1 16 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.782 0.643 25380
7460 1 16 . 1 1 71 71 ASP H H 71 8.076 8.076 8.340 -0.264 25380
7461 1 16 . 1 1 72 72 GLU N N 72 123.635 123.635 116.526 7.109 25380
7462 1 16 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.444 -0.451 25380
7463 1 16 . 1 1 72 72 GLU C C 72 176.971 176.971 175.634 1.337 25380
7464 1 16 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.656 1.563 25380
7465 1 16 . 1 1 72 72 GLU CB C 72 29.702 29.702 32.199 -2.497 25380
7466 1 16 . 1 1 72 72 GLU H H 72 8.514 8.514 8.206 0.308 25380
7467 1 16 . 1 1 73 73 LYS N N 73 117.857 117.857 117.902 -0.045 25380
7468 1 16 . 1 1 73 73 LYS HA H 73 4.643 4.643 3.970 0.673 25380
7469 1 16 . 1 1 73 73 LYS C C 73 176.508 176.508 176.494 0.014 25380
7470 1 16 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.747 -0.667 25380
7471 1 16 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.058 1.145 25380
7472 1 16 . 1 1 73 73 LYS H H 73 8.423 8.423 7.720 0.703 25380
7473 1 16 . 1 1 74 74 ASP N N 74 120.580 120.580 116.435 4.145 25380
7474 1 16 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.349 0.409 25380
7475 1 16 . 1 1 74 74 ASP C C 74 174.059 174.059 176.001 -1.942 25380
7476 1 16 . 1 1 74 74 ASP CA C 74 53.279 53.279 57.377 -4.098 25380
7477 1 16 . 1 1 74 74 ASP CB C 74 40.578 40.578 40.915 -0.337 25380
7478 1 16 . 1 1 74 74 ASP H H 74 7.918 7.918 8.614 -0.696 25380
7479 1 16 . 1 1 75 75 PHE N N 75 118.513 118.513 116.985 1.528 25380
7480 1 16 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.568 -0.205 25380
7481 1 16 . 1 1 75 75 PHE C C 75 173.038 173.038 175.577 -2.539 25380
7482 1 16 . 1 1 75 75 PHE CA C 75 55.522 55.522 57.298 -1.776 25380
7483 1 16 . 1 1 75 75 PHE CB C 75 41.714 41.714 40.291 1.423 25380
7484 1 16 . 1 1 75 75 PHE H H 75 7.397 7.397 7.914 -0.517 25380
7485 1 16 . 1 1 76 76 LEU N N 76 116.773 116.773 124.349 -7.576 25380
7486 1 16 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.607 0.036 25380
7487 1 16 . 1 1 76 76 LEU C C 76 177.553 177.553 175.529 2.024 25380
7488 1 16 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.683 -1.064 25380
7489 1 16 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.359 2.342 25380
7490 1 16 . 1 1 76 76 LEU H H 76 8.774 8.774 9.027 -0.253 25380
7491 1 16 . 1 1 77 77 TYR N N 77 118.377 118.377 123.738 -5.361 25380
7492 1 16 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.713 0.702 25380
7493 1 16 . 1 1 77 77 TYR C C 77 175.479 175.479 173.003 2.476 25380
7494 1 16 . 1 1 77 77 TYR CA C 77 58.391 58.391 56.371 2.020 25380
7495 1 16 . 1 1 77 77 TYR CB C 77 41.100 41.100 42.261 -1.161 25380
7496 1 16 . 1 1 77 77 TYR H H 77 8.589 8.589 9.296 -0.707 25380
7497 1 16 . 1 1 78 78 GLU N N 78 123.875 123.875 126.386 -2.511 25380
7498 1 16 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.724 0.249 25380
7499 1 16 . 1 1 78 78 GLU C C 78 174.120 174.120 173.556 0.564 25380
7500 1 16 . 1 1 78 78 GLU CA C 78 54.378 54.378 54.112 0.265 25380
7501 1 16 . 1 1 78 78 GLU CB C 78 32.640 32.640 34.355 -1.715 25380
7502 1 16 . 1 1 78 78 GLU H H 78 9.576 9.576 7.954 1.622 25380
7503 1 16 . 1 1 79 79 LEU N N 79 128.661 128.661 123.134 5.527 25380
7504 1 16 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.468 0.821 25380
7505 1 16 . 1 1 79 79 LEU C C 79 174.219 174.219 174.982 -0.763 25380
7506 1 16 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.940 -0.791 25380
7507 1 16 . 1 1 79 79 LEU CB C 79 46.630 46.630 45.746 0.884 25380
7508 1 16 . 1 1 79 79 LEU H H 79 9.139 9.139 8.621 0.518 25380
7509 1 16 . 1 1 80 80 HIS N N 80 124.886 124.886 121.584 3.302 25380
7510 1 16 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.987 0.443 25380
7511 1 16 . 1 1 80 80 HIS C C 80 173.346 173.346 175.653 -2.307 25380
7512 1 16 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.848 -1.699 25380
7513 1 16 . 1 1 80 80 HIS CB C 80 30.768 30.768 30.545 0.223 25380
7514 1 16 . 1 1 80 80 HIS H H 80 8.897 8.897 8.723 0.174 25380
7515 1 16 . 1 1 81 81 ILE N N 81 125.173 125.173 122.573 2.600 25380
7516 1 16 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.790 0.500 25380
7517 1 16 . 1 1 81 81 ILE C C 81 174.600 174.600 176.156 -1.556 25380
7518 1 16 . 1 1 81 81 ILE CA C 81 60.500 60.500 64.106 -3.606 25380
7519 1 16 . 1 1 81 81 ILE CB C 81 39.700 39.700 37.745 1.955 25380
7520 1 16 . 1 1 81 81 ILE H H 81 8.909 8.909 8.985 -0.076 25380
7521 1 17 . 1 1 2 2 HIS N N 2 120.430 120.430 123.111 -2.681 25380
7522 1 17 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.548 0.187 25380
7523 1 17 . 1 1 2 2 HIS C C 2 173.884 173.884 175.663 -1.779 25380
7524 1 17 . 1 1 2 2 HIS CA C 2 55.052 55.052 58.201 -3.149 25380
7525 1 17 . 1 1 2 2 HIS CB C 2 28.666 28.666 30.209 -1.543 25380
7526 1 17 . 1 1 2 2 HIS H H 2 8.678 8.678 8.756 -0.078 25380
7527 1 17 . 1 1 3 3 MET N N 3 122.377 122.377 116.486 5.891 25380
7528 1 17 . 1 1 3 3 MET HA H 3 4.207 4.207 4.578 -0.371 25380
7529 1 17 . 1 1 3 3 MET C C 3 174.584 174.584 175.474 -0.890 25380
7530 1 17 . 1 1 3 3 MET CA C 3 56.550 56.550 56.238 0.312 25380
7531 1 17 . 1 1 3 3 MET CB C 3 33.426 33.426 34.017 -0.591 25380
7532 1 17 . 1 1 3 3 MET H H 3 8.240 8.240 8.134 0.106 25380
7533 1 17 . 1 1 4 4 LYS N N 4 123.568 123.568 119.954 3.614 25380
7534 1 17 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.599 0.240 25380
7535 1 17 . 1 1 4 4 LYS C C 4 175.906 175.906 175.057 0.849 25380
7536 1 17 . 1 1 4 4 LYS CA C 4 54.800 54.800 55.791 -0.991 25380
7537 1 17 . 1 1 4 4 LYS CB C 4 34.900 34.900 32.536 2.364 25380
7538 1 17 . 1 1 4 4 LYS H H 4 8.351 8.351 8.183 0.168 25380
7539 1 17 . 1 1 5 5 LEU N N 5 123.568 123.568 121.337 2.231 25380
7540 1 17 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.763 -0.924 25380
7541 1 17 . 1 1 5 5 LEU C C 5 175.900 175.900 175.370 0.530 25380
7542 1 17 . 1 1 5 5 LEU CA C 5 53.350 53.350 54.137 -0.787 25380
7543 1 17 . 1 1 5 5 LEU CB C 5 45.900 45.900 46.402 -0.502 25380
7544 1 17 . 1 1 5 5 LEU H H 5 8.281 8.281 7.462 0.819 25380
7545 1 17 . 1 1 6 6 VAL N N 6 121.564 121.564 118.259 3.305 25380
7546 1 17 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.542 -0.116 25380
7547 1 17 . 1 1 6 6 VAL C C 6 178.200 178.200 174.867 3.333 25380
7548 1 17 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.600 2.599 25380
7549 1 17 . 1 1 6 6 VAL CB C 6 33.200 33.200 34.794 -1.594 25380
7550 1 17 . 1 1 6 6 VAL H H 6 9.276 9.276 9.125 0.151 25380
7551 1 17 . 1 1 7 7 LEU N N 7 121.564 121.564 124.324 -2.760 25380
7552 1 17 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.217 -0.791 25380
7553 1 17 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.604 9.596 25380
7554 1 17 . 1 1 7 7 LEU CB C 7 33.200 33.200 44.924 -11.724 25380
7555 1 17 . 1 1 7 7 LEU H H 7 9.276 9.276 8.543 0.733 25380
7556 1 17 . 1 1 8 8 ALA C C 8 177.040 177.040 177.829 -0.789 25380
7557 1 17 . 1 1 8 8 ALA CA C 8 51.701 51.701 51.928 -0.227 25380
7558 1 17 . 1 1 8 8 ALA CB C 8 20.864 20.864 20.224 0.640 25380
7559 1 17 . 1 1 9 9 LYS N N 9 119.845 119.845 122.505 -2.660 25380
7560 1 17 . 1 1 9 9 LYS HA H 9 4.128 4.128 4.041 0.087 25380
7561 1 17 . 1 1 9 9 LYS C C 9 176.075 176.075 177.716 -1.641 25380
7562 1 17 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.032 -2.271 25380
7563 1 17 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.090 0.828 25380
7564 1 17 . 1 1 9 9 LYS H H 9 8.545 8.545 8.939 -0.394 25380
7565 1 17 . 1 1 10 10 ASN N N 10 119.279 119.279 115.536 3.743 25380
7566 1 17 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.803 -0.158 25380
7567 1 17 . 1 1 10 10 ASN C C 10 175.443 175.443 175.608 -0.165 25380
7568 1 17 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.027 -1.370 25380
7569 1 17 . 1 1 10 10 ASN CB C 10 38.777 38.777 38.952 -0.175 25380
7570 1 17 . 1 1 10 10 ASN H H 10 8.592 8.592 8.325 0.267 25380
7571 1 17 . 1 1 11 11 THR N N 11 111.876 111.876 114.528 -2.652 25380
7572 1 17 . 1 1 11 11 THR HA H 11 4.311 4.311 4.497 -0.186 25380
7573 1 17 . 1 1 11 11 THR C C 11 174.666 174.666 175.367 -0.701 25380
7574 1 17 . 1 1 11 11 THR CA C 11 62.044 62.044 63.474 -1.429 25380
7575 1 17 . 1 1 11 11 THR CB C 11 69.895 69.895 69.965 -0.070 25380
7576 1 17 . 1 1 11 11 THR H H 11 8.058 8.058 7.618 0.440 25380
7577 1 17 . 1 1 12 12 ARG N N 12 121.152 121.152 121.662 -0.510 25380
7578 1 17 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.224 0.038 25380
7579 1 17 . 1 1 12 12 ARG C C 12 176.714 176.714 175.916 0.798 25380
7580 1 17 . 1 1 12 12 ARG CA C 12 56.822 56.822 57.437 -0.615 25380
7581 1 17 . 1 1 12 12 ARG CB C 12 30.702 30.702 30.865 -0.163 25380
7582 1 17 . 1 1 12 12 ARG H H 12 8.291 8.291 8.235 0.056 25380
7583 1 17 . 1 1 13 13 LYS N N 13 120.459 120.459 116.844 3.615 25380
7584 1 17 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.128 -0.232 25380
7585 1 17 . 1 1 13 13 LYS C C 13 176.682 176.682 176.520 0.162 25380
7586 1 17 . 1 1 13 13 LYS CA C 13 56.978 56.978 56.950 0.028 25380
7587 1 17 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.801 1.697 25380
7588 1 17 . 1 1 13 13 LYS H H 13 8.286 8.286 8.404 -0.118 25380
7589 1 17 . 1 1 14 14 SER N N 14 114.568 114.568 113.604 0.964 25380
7590 1 17 . 1 1 14 14 SER HA H 14 4.371 4.371 4.405 -0.034 25380
7591 1 17 . 1 1 14 14 SER C C 14 173.990 173.990 174.707 -0.717 25380
7592 1 17 . 1 1 14 14 SER CA C 14 58.617 58.617 59.239 -0.622 25380
7593 1 17 . 1 1 14 14 SER CB C 14 63.933 63.933 64.076 -0.143 25380
7594 1 17 . 1 1 14 14 SER H H 14 7.957 7.957 8.408 -0.451 25380
7595 1 17 . 1 1 15 15 ASP N N 15 121.565 121.565 119.814 1.751 25380
7596 1 17 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.768 -0.167 25380
7597 1 17 . 1 1 15 15 ASP C C 15 175.684 175.684 175.970 -0.286 25380
7598 1 17 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.316 0.833 25380
7599 1 17 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.520 0.709 25380
7600 1 17 . 1 1 15 15 ASP H H 15 8.166 8.166 7.982 0.184 25380
7601 1 17 . 1 1 16 16 ALA N N 16 124.173 124.173 123.347 0.826 25380
7602 1 17 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.108 0.263 25380
7603 1 17 . 1 1 16 16 ALA C C 16 177.184 177.184 178.911 -1.727 25380
7604 1 17 . 1 1 16 16 ALA CA C 16 52.337 52.337 54.409 -2.072 25380
7605 1 17 . 1 1 16 16 ALA CB C 16 19.359 19.359 19.180 0.179 25380
7606 1 17 . 1 1 16 16 ALA H H 16 8.163 8.163 8.250 -0.087 25380
7607 1 17 . 1 1 17 17 LYS N N 17 121.152 121.152 117.491 3.661 25380
7608 1 17 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.067 0.359 25380
7609 1 17 . 1 1 17 17 LYS C C 17 175.488 175.488 178.611 -3.123 25380
7610 1 17 . 1 1 17 17 LYS CA C 17 56.205 56.205 59.251 -3.046 25380
7611 1 17 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.295 2.001 25380
7612 1 17 . 1 1 17 17 LYS H H 17 8.363 8.363 8.483 -0.120 25380
7613 1 17 . 1 1 18 18 SER N N 18 116.448 116.448 113.202 3.246 25380
7614 1 17 . 1 1 18 18 SER HA H 18 5.355 5.355 4.369 0.986 25380
7615 1 17 . 1 1 18 18 SER C C 18 173.887 173.887 176.281 -2.394 25380
7616 1 17 . 1 1 18 18 SER CA C 18 57.248 57.248 59.642 -2.394 25380
7617 1 17 . 1 1 18 18 SER CB C 18 64.962 64.962 63.019 1.943 25380
7618 1 17 . 1 1 18 18 SER H H 18 8.206 8.206 8.003 0.203 25380
7619 1 17 . 1 1 19 19 VAL N N 19 117.867 117.867 122.459 -4.592 25380
7620 1 17 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.638 -0.018 25380
7621 1 17 . 1 1 19 19 VAL C C 19 174.169 174.169 177.350 -3.181 25380
7622 1 17 . 1 1 19 19 VAL CA C 19 59.546 59.546 66.748 -7.202 25380
7623 1 17 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.754 4.148 25380
7624 1 17 . 1 1 19 19 VAL H H 19 9.086 9.086 8.105 0.981 25380
7625 1 17 . 1 1 20 20 GLU N N 20 120.843 120.843 119.233 1.610 25380
7626 1 17 . 1 1 20 20 GLU HA H 20 4.868 4.868 3.990 0.878 25380
7627 1 17 . 1 1 20 20 GLU C C 20 178.747 178.747 178.562 0.185 25380
7628 1 17 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.332 -4.780 25380
7629 1 17 . 1 1 20 20 GLU CB C 20 31.099 31.099 28.653 2.446 25380
7630 1 17 . 1 1 20 20 GLU H H 20 8.841 8.841 8.537 0.304 25380
7631 1 17 . 1 1 21 21 LEU N N 21 122.653 122.653 120.865 1.788 25380
7632 1 17 . 1 1 21 21 LEU HA H 21 3.443 3.443 3.945 -0.502 25380
7633 1 17 . 1 1 21 21 LEU C C 21 178.799 178.799 179.203 -0.404 25380
7634 1 17 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.562 1.145 25380
7635 1 17 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.743 -3.172 25380
7636 1 17 . 1 1 21 21 LEU H H 21 8.744 8.744 7.499 1.245 25380
7637 1 17 . 1 1 22 22 GLU N N 22 115.392 115.392 118.653 -3.261 25380
7638 1 17 . 1 1 22 22 GLU HA H 22 3.989 3.989 3.673 0.316 25380
7639 1 17 . 1 1 22 22 GLU C C 22 179.328 179.328 178.497 0.831 25380
7640 1 17 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.357 0.723 25380
7641 1 17 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.292 -0.458 25380
7642 1 17 . 1 1 22 22 GLU H H 22 8.744 8.744 7.521 1.223 25380
7643 1 17 . 1 1 23 23 ASP N N 23 118.597 118.597 120.807 -2.210 25380
7644 1 17 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.441 0.170 25380
7645 1 17 . 1 1 23 23 ASP C C 23 179.139 179.139 178.534 0.605 25380
7646 1 17 . 1 1 23 23 ASP CA C 23 57.519 57.519 56.684 0.835 25380
7647 1 17 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.695 -0.253 25380
7648 1 17 . 1 1 23 23 ASP H H 23 7.098 7.098 8.114 -1.016 25380
7649 1 17 . 1 1 24 24 LEU N N 24 119.869 119.869 120.386 -0.517 25380
7650 1 17 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.986 -0.052 25380
7651 1 17 . 1 1 24 24 LEU C C 24 179.045 179.045 179.094 -0.049 25380
7652 1 17 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.084 -0.535 25380
7653 1 17 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.837 -0.288 25380
7654 1 17 . 1 1 24 24 LEU H H 24 7.576 7.576 8.248 -0.672 25380
7655 1 17 . 1 1 25 25 TYR N N 25 118.100 118.100 119.132 -1.032 25380
7656 1 17 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.318 1.049 25380
7657 1 17 . 1 1 25 25 TYR C C 25 177.945 177.945 177.613 0.332 25380
7658 1 17 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.572 1.034 25380
7659 1 17 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.283 -0.335 25380
7660 1 17 . 1 1 25 25 TYR H H 25 8.320 8.320 7.208 1.112 25380
7661 1 17 . 1 1 26 26 HIS N N 26 119.440 119.440 118.153 1.287 25380
7662 1 17 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.535 -0.164 25380
7663 1 17 . 1 1 26 26 HIS C C 26 176.559 176.559 177.898 -1.339 25380
7664 1 17 . 1 1 26 26 HIS CA C 26 59.519 59.519 58.143 1.376 25380
7665 1 17 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.349 -2.221 25380
7666 1 17 . 1 1 26 26 HIS H H 26 8.383 8.383 8.291 0.092 25380
7667 1 17 . 1 1 27 27 GLU N N 27 119.915 119.915 121.090 -1.175 25380
7668 1 17 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.009 0.249 25380
7669 1 17 . 1 1 27 27 GLU C C 27 179.163 179.163 178.264 0.899 25380
7670 1 17 . 1 1 27 27 GLU CA C 27 60.075 60.075 58.923 1.151 25380
7671 1 17 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.544 -0.009 25380
7672 1 17 . 1 1 27 27 GLU H H 27 8.288 8.288 8.858 -0.570 25380
7673 1 17 . 1 1 28 28 PHE N N 28 120.500 120.500 120.949 -0.449 25380
7674 1 17 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.368 0.604 25380
7675 1 17 . 1 1 28 28 PHE C C 28 177.386 177.386 177.290 0.096 25380
7676 1 17 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.364 0.037 25380
7677 1 17 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.046 0.522 25380
7678 1 17 . 1 1 28 28 PHE H H 28 8.568 8.568 7.973 0.595 25380
7679 1 17 . 1 1 29 29 SER N N 29 114.306 114.306 114.750 -0.444 25380
7680 1 17 . 1 1 29 29 SER HA H 29 4.288 4.288 4.332 -0.044 25380
7681 1 17 . 1 1 29 29 SER C C 29 175.656 175.656 176.584 -0.928 25380
7682 1 17 . 1 1 29 29 SER CA C 29 61.058 61.058 60.560 0.497 25380
7683 1 17 . 1 1 29 29 SER CB C 29 63.555 63.555 63.505 0.050 25380
7684 1 17 . 1 1 29 29 SER H H 29 8.479 8.479 8.043 0.436 25380
7685 1 17 . 1 1 30 30 GLU N N 30 118.322 118.322 120.562 -2.240 25380
7686 1 17 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.205 -0.113 25380
7687 1 17 . 1 1 30 30 GLU C C 30 177.312 177.312 176.712 0.600 25380
7688 1 17 . 1 1 30 30 GLU CA C 30 57.580 57.580 58.204 -0.624 25380
7689 1 17 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.575 -0.998 25380
7690 1 17 . 1 1 30 30 GLU H H 30 8.428 8.428 7.909 0.519 25380
7691 1 17 . 1 1 31 31 ASP N N 31 115.630 115.630 116.261 -0.631 25380
7692 1 17 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.819 -0.009 25380
7693 1 17 . 1 1 31 31 ASP C C 31 175.723 175.723 173.612 2.111 25380
7694 1 17 . 1 1 31 31 ASP CA C 31 53.974 53.974 53.213 0.761 25380
7695 1 17 . 1 1 31 31 ASP CB C 31 40.818 40.818 44.300 -3.482 25380
7696 1 17 . 1 1 31 31 ASP H H 31 7.303 7.303 8.042 -0.739 25380
7697 1 17 . 1 1 32 32 LYS N N 32 114.357 114.357 119.341 -4.984 25380
7698 1 17 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.446 -0.619 25380
7699 1 17 . 1 1 32 32 LYS C C 32 175.716 175.716 175.944 -0.228 25380
7700 1 17 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.464 0.698 25380
7701 1 17 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.700 -5.319 25380
7702 1 17 . 1 1 32 32 LYS H H 32 7.148 7.148 8.384 -1.236 25380
7703 1 17 . 1 1 33 33 ARG N N 33 120.929 120.929 124.883 -3.954 25380
7704 1 17 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.632 -0.431 25380
7705 1 17 . 1 1 33 33 ARG C C 33 173.982 173.982 173.816 0.166 25380
7706 1 17 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.873 0.321 25380
7707 1 17 . 1 1 33 33 ARG CB C 33 30.642 30.642 35.119 -4.477 25380
7708 1 17 . 1 1 33 33 ARG H H 33 7.388 7.388 8.826 -1.438 25380
7709 1 17 . 1 1 34 34 SER N N 34 115.867 115.867 114.475 1.392 25380
7710 1 17 . 1 1 34 34 SER HA H 34 5.355 5.355 5.229 0.126 25380
7711 1 17 . 1 1 34 34 SER C C 34 172.754 172.754 172.834 -0.080 25380
7712 1 17 . 1 1 34 34 SER CA C 34 58.236 58.236 56.971 1.265 25380
7713 1 17 . 1 1 34 34 SER CB C 34 65.212 65.212 66.034 -0.822 25380
7714 1 17 . 1 1 34 34 SER H H 34 8.173 8.173 8.373 -0.200 25380
7715 1 17 . 1 1 35 35 ILE N N 35 119.621 119.621 120.881 -1.260 25380
7716 1 17 . 1 1 35 35 ILE HA H 35 4.863 4.863 5.135 -0.272 25380
7717 1 17 . 1 1 35 35 ILE C C 35 174.069 174.069 173.420 0.649 25380
7718 1 17 . 1 1 35 35 ILE CA C 35 59.956 59.956 58.848 1.108 25380
7719 1 17 . 1 1 35 35 ILE CB C 35 40.655 40.655 42.573 -1.918 25380
7720 1 17 . 1 1 35 35 ILE H H 35 6.779 6.779 8.642 -1.863 25380
7721 1 17 . 1 1 36 36 PHE N N 36 124.305 124.305 124.933 -0.628 25380
7722 1 17 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.901 -1.448 25380
7723 1 17 . 1 1 36 36 PHE C C 36 173.204 173.204 175.003 -1.799 25380
7724 1 17 . 1 1 36 36 PHE CA C 36 56.416 56.416 55.917 0.499 25380
7725 1 17 . 1 1 36 36 PHE CB C 36 44.817 44.817 41.594 3.223 25380
7726 1 17 . 1 1 36 36 PHE H H 36 8.411 8.411 9.180 -0.769 25380
7727 1 17 . 1 1 37 37 TYR N N 37 118.743 118.743 126.279 -7.536 25380
7728 1 17 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.246 0.324 25380
7729 1 17 . 1 1 37 37 TYR C C 37 175.455 175.455 173.910 1.545 25380
7730 1 17 . 1 1 37 37 TYR CA C 37 56.518 56.518 54.905 1.613 25380
7731 1 17 . 1 1 37 37 TYR CB C 37 40.991 40.991 40.616 0.375 25380
7732 1 17 . 1 1 37 37 TYR H H 37 8.353 8.353 9.371 -1.018 25380
7733 1 17 . 1 1 38 38 PHE N N 38 119.236 119.236 130.663 -11.427 25380
7734 1 17 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.335 0.825 25380
7735 1 17 . 1 1 38 38 PHE C C 38 174.650 174.650 172.804 1.846 25380
7736 1 17 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.857 0.985 25380
7737 1 17 . 1 1 38 38 PHE CB C 38 42.619 42.619 38.678 3.942 25380
7738 1 17 . 1 1 38 38 PHE H H 38 9.756 9.756 8.948 0.808 25380
7739 1 17 . 1 1 39 39 ALA N N 39 122.516 122.516 129.254 -6.738 25380
7740 1 17 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.360 0.180 25380
7741 1 17 . 1 1 39 39 ALA C C 39 177.042 177.042 173.953 3.089 25380
7742 1 17 . 1 1 39 39 ALA CA C 39 50.843 50.843 48.694 2.149 25380
7743 1 17 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.391 -2.813 25380
7744 1 17 . 1 1 39 39 ALA H H 39 7.738 7.738 8.285 -0.547 25380
7745 1 17 . 1 1 40 40 PRO C C 40 175.411 175.411 177.281 -1.870 25380
7746 1 17 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.683 1.605 25380
7747 1 17 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.776 -1.672 25380
7748 1 17 . 1 1 41 41 THR N N 41 105.878 105.878 116.521 -10.643 25380
7749 1 17 . 1 1 41 41 THR HA H 41 4.190 4.190 3.898 0.292 25380
7750 1 17 . 1 1 41 41 THR C C 41 176.400 176.400 175.253 1.147 25380
7751 1 17 . 1 1 41 41 THR CA C 41 61.937 61.937 64.950 -3.013 25380
7752 1 17 . 1 1 41 41 THR CB C 41 68.331 68.331 68.636 -0.305 25380
7753 1 17 . 1 1 41 41 THR H H 41 6.715 6.715 7.918 -1.203 25380
7754 1 17 . 1 1 42 42 ASN N N 42 118.863 118.863 118.471 0.392 25380
7755 1 17 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.426 0.109 25380
7756 1 17 . 1 1 42 42 ASN C C 42 173.764 173.764 175.808 -2.044 25380
7757 1 17 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.626 -1.450 25380
7758 1 17 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.665 4.050 25380
7759 1 17 . 1 1 42 42 ASN H H 42 7.153 7.153 8.281 -1.128 25380
7760 1 17 . 1 1 43 43 ALA N N 43 126.174 126.174 121.063 5.111 25380
7761 1 17 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.264 0.161 25380
7762 1 17 . 1 1 43 43 ALA C C 43 179.308 179.308 176.906 2.402 25380
7763 1 17 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.862 -0.880 25380
7764 1 17 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.156 -0.862 25380
7765 1 17 . 1 1 43 43 ALA H H 43 9.465 9.465 7.954 1.511 25380
7766 1 17 . 1 1 44 44 HIS N N 44 126.251 126.251 112.861 13.390 25380
7767 1 17 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.280 -0.453 25380
7768 1 17 . 1 1 44 44 HIS C C 44 177.407 177.407 176.239 1.168 25380
7769 1 17 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.933 4.092 25380
7770 1 17 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.568 1.062 25380
7771 1 17 . 1 1 44 44 HIS H H 44 9.407 9.407 8.054 1.353 25380
7772 1 17 . 1 1 45 45 LYS N N 45 114.990 114.990 120.479 -5.489 25380
7773 1 17 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.040 -0.157 25380
7774 1 17 . 1 1 45 45 LYS C C 45 178.284 178.284 177.948 0.336 25380
7775 1 17 . 1 1 45 45 LYS CA C 45 59.249 59.249 59.575 -0.327 25380
7776 1 17 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.235 -0.401 25380
7777 1 17 . 1 1 45 45 LYS H H 45 8.960 8.960 8.398 0.562 25380
7778 1 17 . 1 1 46 46 ASP N N 46 120.411 120.411 117.677 2.734 25380
7779 1 17 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.435 -0.009 25380
7780 1 17 . 1 1 46 46 ASP C C 46 177.773 177.773 178.283 -0.510 25380
7781 1 17 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.441 -0.425 25380
7782 1 17 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.246 -0.349 25380
7783 1 17 . 1 1 46 46 ASP H H 46 6.777 6.777 8.539 -1.762 25380
7784 1 17 . 1 1 47 47 MET N N 47 118.178 118.178 120.272 -2.094 25380
7785 1 17 . 1 1 47 47 MET HA H 47 3.879 3.879 4.198 -0.319 25380
7786 1 17 . 1 1 47 47 MET C C 47 179.499 179.499 177.902 1.597 25380
7787 1 17 . 1 1 47 47 MET CA C 47 56.052 56.052 59.228 -3.176 25380
7788 1 17 . 1 1 47 47 MET CB C 47 29.601 29.601 32.591 -2.990 25380
7789 1 17 . 1 1 47 47 MET H H 47 7.367 7.367 7.892 -0.525 25380
7790 1 17 . 1 1 48 48 LEU N N 48 117.665 117.665 119.420 -1.755 25380
7791 1 17 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.821 0.026 25380
7792 1 17 . 1 1 48 48 LEU C C 48 179.843 179.843 178.825 1.018 25380
7793 1 17 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.707 -0.127 25380
7794 1 17 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.465 -0.512 25380
7795 1 17 . 1 1 48 48 LEU H H 48 7.672 7.672 8.303 -0.631 25380
7796 1 17 . 1 1 49 49 LYS N N 49 119.326 119.326 118.525 0.801 25380
7797 1 17 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.557 0.570 25380
7798 1 17 . 1 1 49 49 LYS C C 49 179.684 179.684 178.489 1.195 25380
7799 1 17 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.095 -0.296 25380
7800 1 17 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.823 -0.371 25380
7801 1 17 . 1 1 49 49 LYS H H 49 7.420 7.420 7.915 -0.495 25380
7802 1 17 . 1 1 50 50 ALA N N 50 122.022 122.022 122.930 -0.908 25380
7803 1 17 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.602 0.441 25380
7804 1 17 . 1 1 50 50 ALA C C 50 178.818 178.818 178.943 -0.125 25380
7805 1 17 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.901 0.268 25380
7806 1 17 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.994 -0.694 25380
7807 1 17 . 1 1 50 50 ALA H H 50 7.551 7.551 8.154 -0.603 25380
7808 1 17 . 1 1 51 51 VAL N N 51 118.165 118.165 118.534 -0.369 25380
7809 1 17 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.695 -0.253 25380
7810 1 17 . 1 1 51 51 VAL C C 51 178.646 178.646 178.197 0.449 25380
7811 1 17 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.597 0.609 25380
7812 1 17 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.849 0.604 25380
7813 1 17 . 1 1 51 51 VAL H H 51 7.226 7.226 7.658 -0.432 25380
7814 1 17 . 1 1 52 52 ASP N N 52 122.298 122.298 120.541 1.757 25380
7815 1 17 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.363 0.008 25380
7816 1 17 . 1 1 52 52 ASP C C 52 177.898 177.898 179.104 -1.206 25380
7817 1 17 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.147 0.424 25380
7818 1 17 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.215 0.171 25380
7819 1 17 . 1 1 52 52 ASP H H 52 8.232 8.232 7.456 0.776 25380
7820 1 17 . 1 1 53 53 PHE N N 53 121.541 121.541 120.184 1.357 25380
7821 1 17 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.394 -0.073 25380
7822 1 17 . 1 1 53 53 PHE C C 53 177.224 177.224 178.157 -0.933 25380
7823 1 17 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.743 2.337 25380
7824 1 17 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.936 1.764 25380
7825 1 17 . 1 1 53 53 PHE H H 53 8.240 8.240 7.927 0.313 25380
7826 1 17 . 1 1 54 54 PHE N N 54 115.925 115.925 117.594 -1.669 25380
7827 1 17 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.182 -0.527 25380
7828 1 17 . 1 1 54 54 PHE C C 54 178.269 178.269 177.718 0.551 25380
7829 1 17 . 1 1 54 54 PHE CA C 54 64.200 64.200 60.045 4.155 25380
7830 1 17 . 1 1 54 54 PHE CB C 54 38.578 38.578 38.028 0.550 25380
7831 1 17 . 1 1 54 54 PHE H H 54 7.755 7.755 8.368 -0.613 25380
7832 1 17 . 1 1 55 55 LYS N N 55 120.251 120.251 118.031 2.220 25380
7833 1 17 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.097 0.329 25380
7834 1 17 . 1 1 55 55 LYS C C 55 181.484 181.484 178.273 3.211 25380
7835 1 17 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.832 0.797 25380
7836 1 17 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.415 -0.676 25380
7837 1 17 . 1 1 55 55 LYS H H 55 8.213 8.213 7.535 0.678 25380
7838 1 17 . 1 1 56 56 GLU N N 56 120.146 120.146 117.813 2.333 25380
7839 1 17 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.177 -0.184 25380
7840 1 17 . 1 1 56 56 GLU C C 56 178.085 178.085 177.569 0.516 25380
7841 1 17 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.324 0.464 25380
7842 1 17 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.079 -1.484 25380
7843 1 17 . 1 1 56 56 GLU H H 56 7.850 7.850 7.876 -0.026 25380
7844 1 17 . 1 1 57 57 LYS N N 57 115.940 115.940 118.327 -2.387 25380
7845 1 17 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.477 -0.374 25380
7846 1 17 . 1 1 57 57 LYS C C 57 176.225 176.225 177.085 -0.860 25380
7847 1 17 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.016 -0.444 25380
7848 1 17 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.551 -1.515 25380
7849 1 17 . 1 1 57 57 LYS H H 57 7.019 7.019 7.604 -0.585 25380
7850 1 17 . 1 1 58 58 GLY N N 58 106.593 106.593 108.857 -2.264 25380
7851 1 17 . 1 1 58 58 GLY C C 58 174.350 174.350 175.022 -0.672 25380
7852 1 17 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.848 -0.348 25380
7853 1 17 . 1 1 58 58 GLY H H 58 7.883 7.883 8.437 -0.553 25380
7854 1 17 . 1 1 59 59 HIS N N 59 117.962 117.962 117.510 0.452 25380
7855 1 17 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.557 0.310 25380
7856 1 17 . 1 1 59 59 HIS C C 59 173.271 173.271 175.787 -2.516 25380
7857 1 17 . 1 1 59 59 HIS CA C 59 54.778 54.778 58.492 -3.714 25380
7858 1 17 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.927 1.758 25380
7859 1 17 . 1 1 59 59 HIS H H 59 8.218 8.218 7.955 0.263 25380
7860 1 17 . 1 1 60 60 THR N N 60 119.624 119.624 110.899 8.725 25380
7861 1 17 . 1 1 60 60 THR HA H 60 4.430 4.430 3.959 0.471 25380
7862 1 17 . 1 1 60 60 THR C C 60 171.430 171.430 173.692 -2.262 25380
7863 1 17 . 1 1 60 60 THR CA C 60 63.480 63.480 61.766 1.714 25380
7864 1 17 . 1 1 60 60 THR CB C 60 69.761 69.761 69.520 0.241 25380
7865 1 17 . 1 1 60 60 THR H H 60 8.780 8.780 7.828 0.952 25380
7866 1 17 . 1 1 61 61 ALA N N 61 126.706 126.706 129.641 -2.935 25380
7867 1 17 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.174 1.072 25380
7868 1 17 . 1 1 61 61 ALA C C 61 174.753 174.753 176.773 -2.020 25380
7869 1 17 . 1 1 61 61 ALA CA C 61 49.772 49.772 52.995 -3.224 25380
7870 1 17 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.440 2.449 25380
7871 1 17 . 1 1 61 61 ALA H H 61 7.795 7.795 8.473 -0.678 25380
7872 1 17 . 1 1 62 62 TYR N N 62 117.859 117.859 115.726 2.133 25380
7873 1 17 . 1 1 62 62 TYR C C 62 173.431 173.431 173.520 -0.089 25380
7874 1 17 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.201 -0.554 25380
7875 1 17 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.722 -2.173 25380
7876 1 17 . 1 1 62 62 TYR H H 62 8.711 8.711 7.752 0.959 25380
7877 1 17 . 1 1 63 63 LEU N N 63 125.044 125.044 122.997 2.047 25380
7878 1 17 . 1 1 63 63 LEU HA H 63 5.411 5.411 5.108 0.303 25380
7879 1 17 . 1 1 63 63 LEU C C 63 175.319 175.319 175.349 -0.030 25380
7880 1 17 . 1 1 63 63 LEU CA C 63 53.230 53.230 54.019 -0.789 25380
7881 1 17 . 1 1 63 63 LEU CB C 63 45.701 45.701 45.087 0.614 25380
7882 1 17 . 1 1 63 63 LEU H H 63 8.746 8.746 8.563 0.183 25380
7883 1 17 . 1 1 64 64 ASP N N 64 125.463 125.463 124.791 0.672 25380
7884 1 17 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.959 0.240 25380
7885 1 17 . 1 1 64 64 ASP C C 64 174.512 174.512 174.613 -0.101 25380
7886 1 17 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.704 -0.004 25380
7887 1 17 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.123 -0.169 25380
7888 1 17 . 1 1 64 64 ASP H H 64 9.293 9.293 9.157 0.136 25380
7889 1 17 . 1 1 65 65 GLU N N 65 120.711 120.711 120.537 0.174 25380
7890 1 17 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.322 0.745 25380
7891 1 17 . 1 1 65 65 GLU C C 65 175.652 175.652 176.277 -0.625 25380
7892 1 17 . 1 1 65 65 GLU CA C 65 55.643 55.643 57.588 -1.945 25380
7893 1 17 . 1 1 65 65 GLU CB C 65 30.455 30.455 30.666 -0.211 25380
7894 1 17 . 1 1 65 65 GLU H H 65 8.715 8.715 8.555 0.160 25380
7895 1 17 . 1 1 66 66 VAL N N 66 122.936 122.936 122.754 0.182 25380
7896 1 17 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.075 0.355 25380
7897 1 17 . 1 1 66 66 VAL C C 66 175.065 175.065 176.026 -0.961 25380
7898 1 17 . 1 1 66 66 VAL CA C 66 60.991 60.991 63.606 -2.615 25380
7899 1 17 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.679 1.601 25380
7900 1 17 . 1 1 66 66 VAL H H 66 9.156 9.156 8.818 0.338 25380
7901 1 17 . 1 1 67 67 ARG N N 67 126.104 126.104 128.992 -2.888 25380
7902 1 17 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.410 0.131 25380
7903 1 17 . 1 1 67 67 ARG C C 67 176.708 176.708 175.683 1.025 25380
7904 1 17 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.647 0.433 25380
7905 1 17 . 1 1 67 67 ARG CB C 67 30.908 30.908 28.481 2.427 25380
7906 1 17 . 1 1 67 67 ARG H H 67 8.734 8.734 8.876 -0.142 25380
7907 1 17 . 1 1 68 68 VAL N N 68 120.707 120.707 115.961 4.746 25380
7908 1 17 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.597 -0.445 25380
7909 1 17 . 1 1 68 68 VAL C C 68 175.931 175.931 176.657 -0.726 25380
7910 1 17 . 1 1 68 68 VAL CA C 68 62.776 62.776 61.550 1.226 25380
7911 1 17 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.462 1.027 25380
7912 1 17 . 1 1 68 68 VAL H H 68 8.384 8.384 7.811 0.573 25380
7913 1 17 . 1 1 69 69 SER N N 69 116.156 116.156 118.828 -2.672 25380
7914 1 17 . 1 1 69 69 SER HA H 69 4.693 4.693 4.244 0.449 25380
7915 1 17 . 1 1 69 69 SER C C 69 174.544 174.544 176.602 -2.058 25380
7916 1 17 . 1 1 69 69 SER CA C 69 57.754 57.754 62.477 -4.723 25380
7917 1 17 . 1 1 69 69 SER CB C 69 64.831 64.831 62.777 2.054 25380
7918 1 17 . 1 1 69 69 SER H H 69 8.067 8.067 8.437 -0.370 25380
7919 1 17 . 1 1 70 70 THR N N 70 110.753 110.753 117.372 -6.619 25380
7920 1 17 . 1 1 70 70 THR HA H 70 4.152 4.152 4.066 0.086 25380
7921 1 17 . 1 1 70 70 THR C C 70 174.865 174.865 175.471 -0.606 25380
7922 1 17 . 1 1 70 70 THR CA C 70 63.831 63.831 66.094 -2.263 25380
7923 1 17 . 1 1 70 70 THR CB C 70 68.956 68.956 68.582 0.374 25380
7924 1 17 . 1 1 70 70 THR H H 70 8.095 8.095 8.479 -0.384 25380
7925 1 17 . 1 1 71 71 ASP N N 71 121.817 121.817 120.310 1.507 25380
7926 1 17 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.585 0.005 25380
7927 1 17 . 1 1 71 71 ASP C C 71 176.746 176.746 176.688 0.058 25380
7928 1 17 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.035 -1.771 25380
7929 1 17 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.971 0.454 25380
7930 1 17 . 1 1 71 71 ASP H H 71 8.076 8.076 8.474 -0.398 25380
7931 1 17 . 1 1 72 72 GLU N N 72 123.635 123.635 114.187 9.448 25380
7932 1 17 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.508 -0.515 25380
7933 1 17 . 1 1 72 72 GLU C C 72 176.971 176.971 175.376 1.595 25380
7934 1 17 . 1 1 72 72 GLU CA C 72 58.219 58.219 55.407 2.812 25380
7935 1 17 . 1 1 72 72 GLU CB C 72 29.702 29.702 30.193 -0.491 25380
7936 1 17 . 1 1 72 72 GLU H H 72 8.514 8.514 8.172 0.342 25380
7937 1 17 . 1 1 73 73 LYS N N 73 117.857 117.857 118.023 -0.166 25380
7938 1 17 . 1 1 73 73 LYS HA H 73 4.643 4.643 4.060 0.583 25380
7939 1 17 . 1 1 73 73 LYS C C 73 176.508 176.508 175.376 1.132 25380
7940 1 17 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.737 -0.657 25380
7941 1 17 . 1 1 73 73 LYS CB C 73 32.203 32.203 30.662 1.541 25380
7942 1 17 . 1 1 73 73 LYS H H 73 8.423 8.423 8.683 -0.260 25380
7943 1 17 . 1 1 74 74 ASP N N 74 120.580 120.580 116.666 3.914 25380
7944 1 17 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.678 0.080 25380
7945 1 17 . 1 1 74 74 ASP C C 74 174.059 174.059 175.615 -1.556 25380
7946 1 17 . 1 1 74 74 ASP CA C 74 53.279 53.279 55.401 -2.122 25380
7947 1 17 . 1 1 74 74 ASP CB C 74 40.578 40.578 42.964 -2.386 25380
7948 1 17 . 1 1 74 74 ASP H H 74 7.918 7.918 8.461 -0.543 25380
7949 1 17 . 1 1 75 75 PHE N N 75 118.513 118.513 119.325 -0.812 25380
7950 1 17 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.635 -0.272 25380
7951 1 17 . 1 1 75 75 PHE C C 75 173.038 173.038 175.698 -2.660 25380
7952 1 17 . 1 1 75 75 PHE CA C 75 55.522 55.522 57.431 -1.909 25380
7953 1 17 . 1 1 75 75 PHE CB C 75 41.714 41.714 40.650 1.064 25380
7954 1 17 . 1 1 75 75 PHE H H 75 7.397 7.397 8.040 -0.643 25380
7955 1 17 . 1 1 76 76 LEU N N 76 116.773 116.773 124.134 -7.361 25380
7956 1 17 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.557 0.086 25380
7957 1 17 . 1 1 76 76 LEU C C 76 177.553 177.553 175.656 1.897 25380
7958 1 17 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.558 -0.939 25380
7959 1 17 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.345 2.356 25380
7960 1 17 . 1 1 76 76 LEU H H 76 8.774 8.774 9.114 -0.340 25380
7961 1 17 . 1 1 77 77 TYR N N 77 118.377 118.377 125.338 -6.961 25380
7962 1 17 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.685 0.730 25380
7963 1 17 . 1 1 77 77 TYR C C 77 175.479 175.479 173.386 2.093 25380
7964 1 17 . 1 1 77 77 TYR CA C 77 58.391 58.391 56.276 2.115 25380
7965 1 17 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.062 1.038 25380
7966 1 17 . 1 1 77 77 TYR H H 77 8.589 8.589 9.277 -0.688 25380
7967 1 17 . 1 1 78 78 GLU N N 78 123.875 123.875 129.472 -5.597 25380
7968 1 17 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.832 0.141 25380
7969 1 17 . 1 1 78 78 GLU C C 78 174.120 174.120 173.828 0.292 25380
7970 1 17 . 1 1 78 78 GLU CA C 78 54.378 54.378 54.052 0.326 25380
7971 1 17 . 1 1 78 78 GLU CB C 78 32.640 32.640 32.703 -0.063 25380
7972 1 17 . 1 1 78 78 GLU H H 78 9.576 9.576 8.374 1.202 25380
7973 1 17 . 1 1 79 79 LEU N N 79 128.661 128.661 122.450 6.211 25380
7974 1 17 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.730 0.559 25380
7975 1 17 . 1 1 79 79 LEU C C 79 174.219 174.219 174.823 -0.604 25380
7976 1 17 . 1 1 79 79 LEU CA C 79 53.149 53.149 52.991 0.158 25380
7977 1 17 . 1 1 79 79 LEU CB C 79 46.630 46.630 43.934 2.696 25380
7978 1 17 . 1 1 79 79 LEU H H 79 9.139 9.139 8.827 0.312 25380
7979 1 17 . 1 1 80 80 HIS N N 80 124.886 124.886 121.589 3.297 25380
7980 1 17 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.938 0.492 25380
7981 1 17 . 1 1 80 80 HIS C C 80 173.346 173.346 175.727 -2.381 25380
7982 1 17 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.254 -1.105 25380
7983 1 17 . 1 1 80 80 HIS CB C 80 30.768 30.768 30.734 0.034 25380
7984 1 17 . 1 1 80 80 HIS H H 80 8.897 8.897 9.259 -0.362 25380
7985 1 17 . 1 1 81 81 ILE N N 81 125.173 125.173 120.786 4.387 25380
7986 1 17 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.683 0.607 25380
7987 1 17 . 1 1 81 81 ILE C C 81 174.600 174.600 174.414 0.186 25380
7988 1 17 . 1 1 81 81 ILE CA C 81 60.500 60.500 61.867 -1.367 25380
7989 1 17 . 1 1 81 81 ILE CB C 81 39.700 39.700 35.106 4.593 25380
7990 1 17 . 1 1 81 81 ILE H H 81 8.909 8.909 8.129 0.780 25380
7991 1 18 . 1 1 2 2 HIS N N 2 120.430 120.430 121.214 -0.784 25380
7992 1 18 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.801 -0.066 25380
7993 1 18 . 1 1 2 2 HIS C C 2 173.884 173.884 174.699 -0.815 25380
7994 1 18 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.724 -1.672 25380
7995 1 18 . 1 1 2 2 HIS CB C 2 28.666 28.666 30.984 -2.318 25380
7996 1 18 . 1 1 2 2 HIS H H 2 8.678 8.678 8.637 0.041 25380
7997 1 18 . 1 1 3 3 MET N N 3 122.377 122.377 123.667 -1.290 25380
7998 1 18 . 1 1 3 3 MET HA H 3 4.207 4.207 4.603 -0.396 25380
7999 1 18 . 1 1 3 3 MET C C 3 174.584 174.584 176.850 -2.266 25380
8000 1 18 . 1 1 3 3 MET CA C 3 56.550 56.550 56.655 -0.105 25380
8001 1 18 . 1 1 3 3 MET CB C 3 33.426 33.426 33.981 -0.555 25380
8002 1 18 . 1 1 3 3 MET H H 3 8.240 8.240 8.698 -0.458 25380
8003 1 18 . 1 1 4 4 LYS N N 4 123.568 123.568 119.323 4.245 25380
8004 1 18 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.480 0.359 25380
8005 1 18 . 1 1 4 4 LYS C C 4 175.906 175.906 175.176 0.730 25380
8006 1 18 . 1 1 4 4 LYS CA C 4 54.800 54.800 55.906 -1.105 25380
8007 1 18 . 1 1 4 4 LYS CB C 4 34.900 34.900 32.572 2.328 25380
8008 1 18 . 1 1 4 4 LYS H H 4 8.351 8.351 8.322 0.029 25380
8009 1 18 . 1 1 5 5 LEU N N 5 123.568 123.568 119.082 4.486 25380
8010 1 18 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.547 -0.708 25380
8011 1 18 . 1 1 5 5 LEU C C 5 175.900 175.900 176.170 -0.270 25380
8012 1 18 . 1 1 5 5 LEU CA C 5 53.350 53.350 54.194 -0.844 25380
8013 1 18 . 1 1 5 5 LEU CB C 5 45.900 45.900 46.448 -0.548 25380
8014 1 18 . 1 1 5 5 LEU H H 5 8.281 8.281 7.873 0.408 25380
8015 1 18 . 1 1 6 6 VAL N N 6 121.564 121.564 122.125 -0.561 25380
8016 1 18 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.368 0.058 25380
8017 1 18 . 1 1 6 6 VAL C C 6 178.200 178.200 174.939 3.261 25380
8018 1 18 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.555 2.645 25380
8019 1 18 . 1 1 6 6 VAL CB C 6 33.200 33.200 34.466 -1.266 25380
8020 1 18 . 1 1 6 6 VAL H H 6 9.276 9.276 9.516 -0.240 25380
8021 1 18 . 1 1 7 7 LEU N N 7 121.564 121.564 127.291 -5.727 25380
8022 1 18 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.416 -0.990 25380
8023 1 18 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.053 10.147 25380
8024 1 18 . 1 1 7 7 LEU CB C 7 33.200 33.200 44.847 -11.647 25380
8025 1 18 . 1 1 7 7 LEU H H 7 9.276 9.276 8.555 0.721 25380
8026 1 18 . 1 1 8 8 ALA C C 8 177.040 177.040 177.610 -0.570 25380
8027 1 18 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.090 -0.389 25380
8028 1 18 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.884 0.980 25380
8029 1 18 . 1 1 9 9 LYS N N 9 119.845 119.845 122.764 -2.919 25380
8030 1 18 . 1 1 9 9 LYS HA H 9 4.128 4.128 4.125 0.003 25380
8031 1 18 . 1 1 9 9 LYS C C 9 176.075 176.075 178.122 -2.047 25380
8032 1 18 . 1 1 9 9 LYS CA C 9 56.761 56.761 58.508 -1.747 25380
8033 1 18 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.356 0.563 25380
8034 1 18 . 1 1 9 9 LYS H H 9 8.545 8.545 8.381 0.164 25380
8035 1 18 . 1 1 10 10 ASN N N 10 119.279 119.279 120.238 -0.959 25380
8036 1 18 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.521 0.124 25380
8037 1 18 . 1 1 10 10 ASN C C 10 175.443 175.443 177.370 -1.927 25380
8038 1 18 . 1 1 10 10 ASN CA C 10 53.657 53.657 56.000 -2.343 25380
8039 1 18 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.701 1.076 25380
8040 1 18 . 1 1 10 10 ASN H H 10 8.592 8.592 8.656 -0.064 25380
8041 1 18 . 1 1 11 11 THR N N 11 111.876 111.876 111.313 0.563 25380
8042 1 18 . 1 1 11 11 THR HA H 11 4.311 4.311 4.196 0.115 25380
8043 1 18 . 1 1 11 11 THR C C 11 174.666 174.666 175.909 -1.243 25380
8044 1 18 . 1 1 11 11 THR CA C 11 62.044 62.044 64.088 -2.044 25380
8045 1 18 . 1 1 11 11 THR CB C 11 69.895 69.895 68.998 0.897 25380
8046 1 18 . 1 1 11 11 THR H H 11 8.058 8.058 8.279 -0.221 25380
8047 1 18 . 1 1 12 12 ARG N N 12 121.152 121.152 119.218 1.934 25380
8048 1 18 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.393 -0.131 25380
8049 1 18 . 1 1 12 12 ARG C C 12 176.714 176.714 176.236 0.478 25380
8050 1 18 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.189 0.633 25380
8051 1 18 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.322 -0.620 25380
8052 1 18 . 1 1 12 12 ARG H H 12 8.291 8.291 7.756 0.535 25380
8053 1 18 . 1 1 13 13 LYS N N 13 120.459 120.459 118.140 2.319 25380
8054 1 18 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.070 -0.174 25380
8055 1 18 . 1 1 13 13 LYS C C 13 176.682 176.682 175.907 0.775 25380
8056 1 18 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.191 -0.213 25380
8057 1 18 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.102 2.396 25380
8058 1 18 . 1 1 13 13 LYS H H 13 8.286 8.286 8.419 -0.133 25380
8059 1 18 . 1 1 14 14 SER N N 14 114.568 114.568 116.366 -1.798 25380
8060 1 18 . 1 1 14 14 SER HA H 14 4.371 4.371 4.460 -0.089 25380
8061 1 18 . 1 1 14 14 SER C C 14 173.990 173.990 174.219 -0.229 25380
8062 1 18 . 1 1 14 14 SER CA C 14 58.617 58.617 57.920 0.697 25380
8063 1 18 . 1 1 14 14 SER CB C 14 63.933 63.933 63.809 0.124 25380
8064 1 18 . 1 1 14 14 SER H H 14 7.957 7.957 8.350 -0.393 25380
8065 1 18 . 1 1 15 15 ASP N N 15 121.565 121.565 119.299 2.266 25380
8066 1 18 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.807 -0.206 25380
8067 1 18 . 1 1 15 15 ASP C C 15 175.684 175.684 177.133 -1.449 25380
8068 1 18 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.920 0.229 25380
8069 1 18 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.995 0.234 25380
8070 1 18 . 1 1 15 15 ASP H H 15 8.166 8.166 8.469 -0.303 25380
8071 1 18 . 1 1 16 16 ALA N N 16 124.173 124.173 124.124 0.049 25380
8072 1 18 . 1 1 16 16 ALA HA H 16 4.371 4.371 3.934 0.437 25380
8073 1 18 . 1 1 16 16 ALA C C 16 177.184 177.184 179.197 -2.013 25380
8074 1 18 . 1 1 16 16 ALA CA C 16 52.337 52.337 54.670 -2.333 25380
8075 1 18 . 1 1 16 16 ALA CB C 16 19.359 19.359 18.823 0.536 25380
8076 1 18 . 1 1 16 16 ALA H H 16 8.163 8.163 8.310 -0.147 25380
8077 1 18 . 1 1 17 17 LYS N N 17 121.152 121.152 119.407 1.745 25380
8078 1 18 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.292 0.134 25380
8079 1 18 . 1 1 17 17 LYS C C 17 175.488 175.488 178.937 -3.449 25380
8080 1 18 . 1 1 17 17 LYS CA C 17 56.205 56.205 58.825 -2.620 25380
8081 1 18 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.210 2.086 25380
8082 1 18 . 1 1 17 17 LYS H H 17 8.363 8.363 8.331 0.032 25380
8083 1 18 . 1 1 18 18 SER N N 18 116.448 116.448 115.077 1.371 25380
8084 1 18 . 1 1 18 18 SER HA H 18 5.355 5.355 4.221 1.134 25380
8085 1 18 . 1 1 18 18 SER C C 18 173.887 173.887 176.367 -2.480 25380
8086 1 18 . 1 1 18 18 SER CA C 18 57.248 57.248 60.712 -3.464 25380
8087 1 18 . 1 1 18 18 SER CB C 18 64.962 64.962 62.901 2.061 25380
8088 1 18 . 1 1 18 18 SER H H 18 8.206 8.206 7.920 0.286 25380
8089 1 18 . 1 1 19 19 VAL N N 19 117.867 117.867 122.296 -4.429 25380
8090 1 18 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.707 -0.087 25380
8091 1 18 . 1 1 19 19 VAL C C 19 174.169 174.169 177.611 -3.442 25380
8092 1 18 . 1 1 19 19 VAL CA C 19 59.546 59.546 65.592 -6.046 25380
8093 1 18 . 1 1 19 19 VAL CB C 19 35.902 35.902 30.772 5.130 25380
8094 1 18 . 1 1 19 19 VAL H H 19 9.086 9.086 7.333 1.753 25380
8095 1 18 . 1 1 20 20 GLU N N 20 120.843 120.843 120.221 0.622 25380
8096 1 18 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.018 0.850 25380
8097 1 18 . 1 1 20 20 GLU C C 20 178.747 178.747 178.767 -0.020 25380
8098 1 18 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.310 -4.758 25380
8099 1 18 . 1 1 20 20 GLU CB C 20 31.099 31.099 29.025 2.074 25380
8100 1 18 . 1 1 20 20 GLU H H 20 8.841 8.841 7.581 1.260 25380
8101 1 18 . 1 1 21 21 LEU N N 21 122.653 122.653 119.260 3.393 25380
8102 1 18 . 1 1 21 21 LEU HA H 21 3.443 3.443 3.966 -0.523 25380
8103 1 18 . 1 1 21 21 LEU C C 21 178.799 178.799 179.305 -0.506 25380
8104 1 18 . 1 1 21 21 LEU CA C 21 58.707 58.707 58.061 0.646 25380
8105 1 18 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.730 -3.159 25380
8106 1 18 . 1 1 21 21 LEU H H 21 8.744 8.744 7.562 1.182 25380
8107 1 18 . 1 1 22 22 GLU N N 22 115.392 115.392 118.914 -3.522 25380
8108 1 18 . 1 1 22 22 GLU HA H 22 3.989 3.989 3.673 0.316 25380
8109 1 18 . 1 1 22 22 GLU C C 22 179.328 179.328 178.686 0.642 25380
8110 1 18 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.365 0.715 25380
8111 1 18 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.295 -0.461 25380
8112 1 18 . 1 1 22 22 GLU H H 22 8.744 8.744 7.591 1.153 25380
8113 1 18 . 1 1 23 23 ASP N N 23 118.597 118.597 120.360 -1.763 25380
8114 1 18 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.378 0.233 25380
8115 1 18 . 1 1 23 23 ASP C C 23 179.139 179.139 178.604 0.535 25380
8116 1 18 . 1 1 23 23 ASP CA C 23 57.519 57.519 56.737 0.782 25380
8117 1 18 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.349 0.093 25380
8118 1 18 . 1 1 23 23 ASP H H 23 7.098 7.098 8.368 -1.270 25380
8119 1 18 . 1 1 24 24 LEU N N 24 119.869 119.869 121.389 -1.520 25380
8120 1 18 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.397 0.536 25380
8121 1 18 . 1 1 24 24 LEU C C 24 179.045 179.045 178.536 0.509 25380
8122 1 18 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.717 -1.168 25380
8123 1 18 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.424 0.126 25380
8124 1 18 . 1 1 24 24 LEU H H 24 7.576 7.576 8.414 -0.838 25380
8125 1 18 . 1 1 25 25 TYR N N 25 118.100 118.100 116.326 1.774 25380
8126 1 18 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.697 0.670 25380
8127 1 18 . 1 1 25 25 TYR C C 25 177.945 177.945 178.851 -0.906 25380
8128 1 18 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.826 0.780 25380
8129 1 18 . 1 1 25 25 TYR CB C 25 37.948 37.948 37.776 0.172 25380
8130 1 18 . 1 1 25 25 TYR H H 25 8.320 8.320 7.339 0.981 25380
8131 1 18 . 1 1 26 26 HIS N N 26 119.440 119.440 118.591 0.849 25380
8132 1 18 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.468 -0.097 25380
8133 1 18 . 1 1 26 26 HIS C C 26 176.559 176.559 178.021 -1.462 25380
8134 1 18 . 1 1 26 26 HIS CA C 26 59.519 59.519 58.062 1.457 25380
8135 1 18 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.220 -2.091 25380
8136 1 18 . 1 1 26 26 HIS H H 26 8.383 8.383 8.295 0.088 25380
8137 1 18 . 1 1 27 27 GLU N N 27 119.915 119.915 120.997 -1.082 25380
8138 1 18 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.001 0.257 25380
8139 1 18 . 1 1 27 27 GLU C C 27 179.163 179.163 178.470 0.693 25380
8140 1 18 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.254 0.821 25380
8141 1 18 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.487 0.048 25380
8142 1 18 . 1 1 27 27 GLU H H 27 8.288 8.288 8.804 -0.516 25380
8143 1 18 . 1 1 28 28 PHE N N 28 120.500 120.500 120.910 -0.410 25380
8144 1 18 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.337 0.635 25380
8145 1 18 . 1 1 28 28 PHE C C 28 177.386 177.386 177.470 -0.084 25380
8146 1 18 . 1 1 28 28 PHE CA C 28 60.401 60.401 61.161 -0.760 25380
8147 1 18 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.403 0.165 25380
8148 1 18 . 1 1 28 28 PHE H H 28 8.568 8.568 8.011 0.557 25380
8149 1 18 . 1 1 29 29 SER N N 29 114.306 114.306 114.194 0.112 25380
8150 1 18 . 1 1 29 29 SER HA H 29 4.288 4.288 4.244 0.044 25380
8151 1 18 . 1 1 29 29 SER C C 29 175.656 175.656 176.507 -0.851 25380
8152 1 18 . 1 1 29 29 SER CA C 29 61.058 61.058 60.585 0.473 25380
8153 1 18 . 1 1 29 29 SER CB C 29 63.555 63.555 63.843 -0.288 25380
8154 1 18 . 1 1 29 29 SER H H 29 8.479 8.479 8.288 0.191 25380
8155 1 18 . 1 1 30 30 GLU N N 30 118.322 118.322 119.984 -1.662 25380
8156 1 18 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.303 -0.211 25380
8157 1 18 . 1 1 30 30 GLU C C 30 177.312 177.312 176.441 0.871 25380
8158 1 18 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.606 -0.026 25380
8159 1 18 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.816 -1.239 25380
8160 1 18 . 1 1 30 30 GLU H H 30 8.428 8.428 8.313 0.115 25380
8161 1 18 . 1 1 31 31 ASP N N 31 115.630 115.630 118.318 -2.688 25380
8162 1 18 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.788 0.022 25380
8163 1 18 . 1 1 31 31 ASP C C 31 175.723 175.723 173.553 2.170 25380
8164 1 18 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.882 1.092 25380
8165 1 18 . 1 1 31 31 ASP CB C 31 40.818 40.818 44.024 -3.206 25380
8166 1 18 . 1 1 31 31 ASP H H 31 7.303 7.303 8.130 -0.827 25380
8167 1 18 . 1 1 32 32 LYS N N 32 114.357 114.357 121.032 -6.675 25380
8168 1 18 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.468 -0.641 25380
8169 1 18 . 1 1 32 32 LYS C C 32 175.716 175.716 176.120 -0.404 25380
8170 1 18 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.955 0.207 25380
8171 1 18 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.579 -5.198 25380
8172 1 18 . 1 1 32 32 LYS H H 32 7.148 7.148 8.369 -1.221 25380
8173 1 18 . 1 1 33 33 ARG N N 33 120.929 120.929 125.496 -4.567 25380
8174 1 18 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.606 -0.405 25380
8175 1 18 . 1 1 33 33 ARG C C 33 173.982 173.982 173.657 0.325 25380
8176 1 18 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.624 0.570 25380
8177 1 18 . 1 1 33 33 ARG CB C 33 30.642 30.642 33.628 -2.986 25380
8178 1 18 . 1 1 33 33 ARG H H 33 7.388 7.388 8.781 -1.393 25380
8179 1 18 . 1 1 34 34 SER N N 34 115.867 115.867 114.990 0.877 25380
8180 1 18 . 1 1 34 34 SER HA H 34 5.355 5.355 4.817 0.538 25380
8181 1 18 . 1 1 34 34 SER C C 34 172.754 172.754 172.757 -0.003 25380
8182 1 18 . 1 1 34 34 SER CA C 34 58.236 58.236 57.295 0.941 25380
8183 1 18 . 1 1 34 34 SER CB C 34 65.212 65.212 66.364 -1.151 25380
8184 1 18 . 1 1 34 34 SER H H 34 8.173 8.173 8.315 -0.142 25380
8185 1 18 . 1 1 35 35 ILE N N 35 119.621 119.621 113.945 5.676 25380
8186 1 18 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.741 0.122 25380
8187 1 18 . 1 1 35 35 ILE C C 35 174.069 174.069 173.265 0.804 25380
8188 1 18 . 1 1 35 35 ILE CA C 35 59.956 59.956 58.968 0.988 25380
8189 1 18 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.543 -0.888 25380
8190 1 18 . 1 1 35 35 ILE H H 35 6.779 6.779 8.682 -1.903 25380
8191 1 18 . 1 1 36 36 PHE N N 36 124.305 124.305 117.470 6.835 25380
8192 1 18 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.844 -1.391 25380
8193 1 18 . 1 1 36 36 PHE C C 36 173.204 173.204 174.779 -1.575 25380
8194 1 18 . 1 1 36 36 PHE CA C 36 56.416 56.416 55.303 1.113 25380
8195 1 18 . 1 1 36 36 PHE CB C 36 44.817 44.817 42.452 2.365 25380
8196 1 18 . 1 1 36 36 PHE H H 36 8.411 8.411 8.630 -0.219 25380
8197 1 18 . 1 1 37 37 TYR N N 37 118.743 118.743 122.548 -3.805 25380
8198 1 18 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.373 0.197 25380
8199 1 18 . 1 1 37 37 TYR C C 37 175.455 175.455 173.618 1.837 25380
8200 1 18 . 1 1 37 37 TYR CA C 37 56.518 56.518 54.843 1.675 25380
8201 1 18 . 1 1 37 37 TYR CB C 37 40.991 40.991 41.221 -0.230 25380
8202 1 18 . 1 1 37 37 TYR H H 37 8.353 8.353 9.275 -0.922 25380
8203 1 18 . 1 1 38 38 PHE N N 38 119.236 119.236 128.137 -8.901 25380
8204 1 18 . 1 1 38 38 PHE HA H 38 5.160 5.160 5.016 0.144 25380
8205 1 18 . 1 1 38 38 PHE C C 38 174.650 174.650 173.893 0.757 25380
8206 1 18 . 1 1 38 38 PHE CA C 38 56.842 56.842 56.286 0.556 25380
8207 1 18 . 1 1 38 38 PHE CB C 38 42.619 42.619 39.214 3.405 25380
8208 1 18 . 1 1 38 38 PHE H H 38 9.756 9.756 9.292 0.464 25380
8209 1 18 . 1 1 39 39 ALA N N 39 122.516 122.516 125.994 -3.478 25380
8210 1 18 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.712 -0.172 25380
8211 1 18 . 1 1 39 39 ALA C C 39 177.042 177.042 174.072 2.970 25380
8212 1 18 . 1 1 39 39 ALA CA C 39 50.843 50.843 48.980 1.863 25380
8213 1 18 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.095 -2.517 25380
8214 1 18 . 1 1 39 39 ALA H H 39 7.738 7.738 8.716 -0.978 25380
8215 1 18 . 1 1 40 40 PRO C C 40 175.411 175.411 177.653 -2.242 25380
8216 1 18 . 1 1 40 40 PRO CA C 40 64.288 64.288 63.148 1.140 25380
8217 1 18 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.790 -1.686 25380
8218 1 18 . 1 1 41 41 THR N N 41 105.878 105.878 116.826 -10.948 25380
8219 1 18 . 1 1 41 41 THR HA H 41 4.190 4.190 4.072 0.118 25380
8220 1 18 . 1 1 41 41 THR C C 41 176.400 176.400 175.359 1.041 25380
8221 1 18 . 1 1 41 41 THR CA C 41 61.937 61.937 65.035 -3.098 25380
8222 1 18 . 1 1 41 41 THR CB C 41 68.331 68.331 68.765 -0.434 25380
8223 1 18 . 1 1 41 41 THR H H 41 6.715 6.715 8.324 -1.609 25380
8224 1 18 . 1 1 42 42 ASN N N 42 118.863 118.863 118.586 0.277 25380
8225 1 18 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.486 0.049 25380
8226 1 18 . 1 1 42 42 ASN C C 42 173.764 173.764 176.120 -2.356 25380
8227 1 18 . 1 1 42 42 ASN CA C 42 54.176 54.176 54.724 -0.548 25380
8228 1 18 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.886 3.829 25380
8229 1 18 . 1 1 42 42 ASN H H 42 7.153 7.153 8.139 -0.986 25380
8230 1 18 . 1 1 43 43 ALA N N 43 126.174 126.174 120.256 5.918 25380
8231 1 18 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.411 0.014 25380
8232 1 18 . 1 1 43 43 ALA C C 43 179.308 179.308 176.892 2.416 25380
8233 1 18 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.801 -0.819 25380
8234 1 18 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.202 -0.908 25380
8235 1 18 . 1 1 43 43 ALA H H 43 9.465 9.465 7.992 1.473 25380
8236 1 18 . 1 1 44 44 HIS N N 44 126.251 126.251 115.723 10.528 25380
8237 1 18 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.302 -0.475 25380
8238 1 18 . 1 1 44 44 HIS C C 44 177.407 177.407 174.769 2.638 25380
8239 1 18 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.788 4.237 25380
8240 1 18 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.754 0.876 25380
8241 1 18 . 1 1 44 44 HIS H H 44 9.407 9.407 7.954 1.453 25380
8242 1 18 . 1 1 45 45 LYS N N 45 114.990 114.990 119.484 -4.494 25380
8243 1 18 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.482 -0.599 25380
8244 1 18 . 1 1 45 45 LYS C C 45 178.284 178.284 177.449 0.835 25380
8245 1 18 . 1 1 45 45 LYS CA C 45 59.249 59.249 57.864 1.385 25380
8246 1 18 . 1 1 45 45 LYS CB C 45 31.834 31.834 33.239 -1.405 25380
8247 1 18 . 1 1 45 45 LYS H H 45 8.960 8.960 8.138 0.822 25380
8248 1 18 . 1 1 46 46 ASP N N 46 120.411 120.411 120.304 0.107 25380
8249 1 18 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.513 -0.087 25380
8250 1 18 . 1 1 46 46 ASP C C 46 177.773 177.773 178.332 -0.559 25380
8251 1 18 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.356 -0.340 25380
8252 1 18 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.152 -0.255 25380
8253 1 18 . 1 1 46 46 ASP H H 46 6.777 6.777 8.673 -1.896 25380
8254 1 18 . 1 1 47 47 MET N N 47 118.178 118.178 118.123 0.055 25380
8255 1 18 . 1 1 47 47 MET HA H 47 3.879 3.879 4.309 -0.430 25380
8256 1 18 . 1 1 47 47 MET C C 47 179.499 179.499 177.698 1.801 25380
8257 1 18 . 1 1 47 47 MET CA C 47 56.052 56.052 57.931 -1.879 25380
8258 1 18 . 1 1 47 47 MET CB C 47 29.601 29.601 31.928 -2.327 25380
8259 1 18 . 1 1 47 47 MET H H 47 7.367 7.367 8.098 -0.731 25380
8260 1 18 . 1 1 48 48 LEU N N 48 117.665 117.665 120.011 -2.346 25380
8261 1 18 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.936 -0.089 25380
8262 1 18 . 1 1 48 48 LEU C C 48 179.843 179.843 178.392 1.451 25380
8263 1 18 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.805 -0.225 25380
8264 1 18 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.622 -0.669 25380
8265 1 18 . 1 1 48 48 LEU H H 48 7.672 7.672 7.529 0.143 25380
8266 1 18 . 1 1 49 49 LYS N N 49 119.326 119.326 118.564 0.762 25380
8267 1 18 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.487 0.640 25380
8268 1 18 . 1 1 49 49 LYS C C 49 179.684 179.684 178.371 1.313 25380
8269 1 18 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.185 -0.386 25380
8270 1 18 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.839 -0.386 25380
8271 1 18 . 1 1 49 49 LYS H H 49 7.420 7.420 7.807 -0.387 25380
8272 1 18 . 1 1 50 50 ALA N N 50 122.022 122.022 122.658 -0.636 25380
8273 1 18 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.397 0.646 25380
8274 1 18 . 1 1 50 50 ALA C C 50 178.818 178.818 178.975 -0.157 25380
8275 1 18 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.822 0.347 25380
8276 1 18 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.700 -0.400 25380
8277 1 18 . 1 1 50 50 ALA H H 50 7.551 7.551 7.759 -0.208 25380
8278 1 18 . 1 1 51 51 VAL N N 51 118.165 118.165 118.138 0.027 25380
8279 1 18 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.516 -0.074 25380
8280 1 18 . 1 1 51 51 VAL C C 51 178.646 178.646 178.194 0.452 25380
8281 1 18 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.391 0.815 25380
8282 1 18 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.777 0.676 25380
8283 1 18 . 1 1 51 51 VAL H H 51 7.226 7.226 7.412 -0.186 25380
8284 1 18 . 1 1 52 52 ASP N N 52 122.298 122.298 120.410 1.888 25380
8285 1 18 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.322 0.048 25380
8286 1 18 . 1 1 52 52 ASP C C 52 177.898 177.898 179.102 -1.204 25380
8287 1 18 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.104 0.467 25380
8288 1 18 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.176 0.210 25380
8289 1 18 . 1 1 52 52 ASP H H 52 8.232 8.232 7.333 0.899 25380
8290 1 18 . 1 1 53 53 PHE N N 53 121.541 121.541 120.231 1.310 25380
8291 1 18 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.271 0.050 25380
8292 1 18 . 1 1 53 53 PHE C C 53 177.224 177.224 178.189 -0.965 25380
8293 1 18 . 1 1 53 53 PHE CA C 53 61.080 61.080 58.870 2.210 25380
8294 1 18 . 1 1 53 53 PHE CB C 53 39.700 39.700 38.079 1.621 25380
8295 1 18 . 1 1 53 53 PHE H H 53 8.240 8.240 8.060 0.180 25380
8296 1 18 . 1 1 54 54 PHE N N 54 115.925 115.925 118.143 -2.218 25380
8297 1 18 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.183 -0.528 25380
8298 1 18 . 1 1 54 54 PHE C C 54 178.269 178.269 178.116 0.153 25380
8299 1 18 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.486 4.713 25380
8300 1 18 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.688 0.890 25380
8301 1 18 . 1 1 54 54 PHE H H 54 7.755 7.755 8.463 -0.708 25380
8302 1 18 . 1 1 55 55 LYS N N 55 120.251 120.251 118.813 1.438 25380
8303 1 18 . 1 1 55 55 LYS HA H 55 4.426 4.426 3.942 0.484 25380
8304 1 18 . 1 1 55 55 LYS C C 55 181.484 181.484 178.842 2.642 25380
8305 1 18 . 1 1 55 55 LYS CA C 55 59.629 59.629 59.497 0.132 25380
8306 1 18 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.283 -0.544 25380
8307 1 18 . 1 1 55 55 LYS H H 55 8.213 8.213 7.552 0.661 25380
8308 1 18 . 1 1 56 56 GLU N N 56 120.146 120.146 118.647 1.499 25380
8309 1 18 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.115 -0.122 25380
8310 1 18 . 1 1 56 56 GLU C C 56 178.085 178.085 178.696 -0.611 25380
8311 1 18 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.654 0.134 25380
8312 1 18 . 1 1 56 56 GLU CB C 56 28.596 28.596 29.741 -1.145 25380
8313 1 18 . 1 1 56 56 GLU H H 56 7.850 7.850 7.984 -0.134 25380
8314 1 18 . 1 1 57 57 LYS N N 57 115.940 115.940 116.140 -0.200 25380
8315 1 18 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.182 -0.079 25380
8316 1 18 . 1 1 57 57 LYS C C 57 176.225 176.225 177.969 -1.744 25380
8317 1 18 . 1 1 57 57 LYS CA C 57 54.572 54.572 57.527 -2.955 25380
8318 1 18 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.191 -1.155 25380
8319 1 18 . 1 1 57 57 LYS H H 57 7.019 7.019 8.063 -1.044 25380
8320 1 18 . 1 1 58 58 GLY N N 58 106.593 106.593 106.589 0.004 25380
8321 1 18 . 1 1 58 58 GLY C C 58 174.350 174.350 174.617 -0.267 25380
8322 1 18 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.845 -0.345 25380
8323 1 18 . 1 1 58 58 GLY H H 58 7.883 7.883 7.757 0.126 25380
8324 1 18 . 1 1 59 59 HIS N N 59 117.962 117.962 119.525 -1.563 25380
8325 1 18 . 1 1 59 59 HIS HA H 59 4.867 4.867 3.585 1.282 25380
8326 1 18 . 1 1 59 59 HIS C C 59 173.271 173.271 175.741 -2.470 25380
8327 1 18 . 1 1 59 59 HIS CA C 59 54.778 54.778 57.887 -3.109 25380
8328 1 18 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.121 2.564 25380
8329 1 18 . 1 1 59 59 HIS H H 59 8.218 8.218 8.248 -0.030 25380
8330 1 18 . 1 1 60 60 THR N N 60 119.624 119.624 111.638 7.986 25380
8331 1 18 . 1 1 60 60 THR HA H 60 4.430 4.430 4.003 0.427 25380
8332 1 18 . 1 1 60 60 THR C C 60 171.430 171.430 173.806 -2.376 25380
8333 1 18 . 1 1 60 60 THR CA C 60 63.480 63.480 62.468 1.012 25380
8334 1 18 . 1 1 60 60 THR CB C 60 69.761 69.761 69.245 0.516 25380
8335 1 18 . 1 1 60 60 THR H H 60 8.780 8.780 7.783 0.997 25380
8336 1 18 . 1 1 61 61 ALA N N 61 126.706 126.706 128.690 -1.984 25380
8337 1 18 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.317 0.929 25380
8338 1 18 . 1 1 61 61 ALA C C 61 174.753 174.753 176.752 -1.999 25380
8339 1 18 . 1 1 61 61 ALA CA C 61 49.772 49.772 53.478 -3.706 25380
8340 1 18 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.594 2.295 25380
8341 1 18 . 1 1 61 61 ALA H H 61 7.795 7.795 8.796 -1.001 25380
8342 1 18 . 1 1 62 62 TYR N N 62 117.859 117.859 115.940 1.919 25380
8343 1 18 . 1 1 62 62 TYR C C 62 173.431 173.431 172.988 0.443 25380
8344 1 18 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.578 -0.930 25380
8345 1 18 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.051 -1.502 25380
8346 1 18 . 1 1 62 62 TYR H H 62 8.711 8.711 7.829 0.882 25380
8347 1 18 . 1 1 63 63 LEU N N 63 125.044 125.044 123.938 1.106 25380
8348 1 18 . 1 1 63 63 LEU HA H 63 5.411 5.411 5.220 0.191 25380
8349 1 18 . 1 1 63 63 LEU C C 63 175.319 175.319 174.071 1.248 25380
8350 1 18 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.330 -0.100 25380
8351 1 18 . 1 1 63 63 LEU CB C 63 45.701 45.701 45.297 0.404 25380
8352 1 18 . 1 1 63 63 LEU H H 63 8.746 8.746 7.519 1.227 25380
8353 1 18 . 1 1 64 64 ASP N N 64 125.463 125.463 122.962 2.501 25380
8354 1 18 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.939 0.260 25380
8355 1 18 . 1 1 64 64 ASP C C 64 174.512 174.512 174.518 -0.006 25380
8356 1 18 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.499 0.201 25380
8357 1 18 . 1 1 64 64 ASP CB C 64 43.954 43.954 45.185 -1.231 25380
8358 1 18 . 1 1 64 64 ASP H H 64 9.293 9.293 8.960 0.333 25380
8359 1 18 . 1 1 65 65 GLU N N 65 120.711 120.711 119.119 1.592 25380
8360 1 18 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.562 0.505 25380
8361 1 18 . 1 1 65 65 GLU C C 65 175.652 175.652 175.657 -0.005 25380
8362 1 18 . 1 1 65 65 GLU CA C 65 55.643 55.643 56.195 -0.552 25380
8363 1 18 . 1 1 65 65 GLU CB C 65 30.455 30.455 31.757 -1.302 25380
8364 1 18 . 1 1 65 65 GLU H H 65 8.715 8.715 8.529 0.186 25380
8365 1 18 . 1 1 66 66 VAL N N 66 122.936 122.936 120.123 2.813 25380
8366 1 18 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.028 0.402 25380
8367 1 18 . 1 1 66 66 VAL C C 66 175.065 175.065 175.399 -0.334 25380
8368 1 18 . 1 1 66 66 VAL CA C 66 60.991 60.991 60.732 0.259 25380
8369 1 18 . 1 1 66 66 VAL CB C 66 34.280 34.280 33.066 1.214 25380
8370 1 18 . 1 1 66 66 VAL H H 66 9.156 9.156 8.547 0.609 25380
8371 1 18 . 1 1 67 67 ARG N N 67 126.104 126.104 126.542 -0.438 25380
8372 1 18 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.332 0.209 25380
8373 1 18 . 1 1 67 67 ARG C C 67 176.708 176.708 175.518 1.190 25380
8374 1 18 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.690 0.390 25380
8375 1 18 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.056 1.852 25380
8376 1 18 . 1 1 67 67 ARG H H 67 8.734 8.734 8.578 0.156 25380
8377 1 18 . 1 1 68 68 VAL N N 68 120.707 120.707 116.138 4.569 25380
8378 1 18 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.524 -0.372 25380
8379 1 18 . 1 1 68 68 VAL C C 68 175.931 175.931 176.494 -0.563 25380
8380 1 18 . 1 1 68 68 VAL CA C 68 62.776 62.776 62.192 0.584 25380
8381 1 18 . 1 1 68 68 VAL CB C 68 32.489 32.489 32.590 -0.101 25380
8382 1 18 . 1 1 68 68 VAL H H 68 8.384 8.384 7.674 0.710 25380
8383 1 18 . 1 1 69 69 SER N N 69 116.156 116.156 119.400 -3.244 25380
8384 1 18 . 1 1 69 69 SER HA H 69 4.693 4.693 4.313 0.380 25380
8385 1 18 . 1 1 69 69 SER C C 69 174.544 174.544 176.820 -2.276 25380
8386 1 18 . 1 1 69 69 SER CA C 69 57.754 57.754 63.025 -5.271 25380
8387 1 18 . 1 1 69 69 SER CB C 69 64.831 64.831 63.109 1.722 25380
8388 1 18 . 1 1 69 69 SER H H 69 8.067 8.067 8.435 -0.368 25380
8389 1 18 . 1 1 70 70 THR N N 70 110.753 110.753 116.994 -6.241 25380
8390 1 18 . 1 1 70 70 THR HA H 70 4.152 4.152 4.095 0.057 25380
8391 1 18 . 1 1 70 70 THR C C 70 174.865 174.865 175.592 -0.727 25380
8392 1 18 . 1 1 70 70 THR CA C 70 63.831 63.831 65.816 -1.985 25380
8393 1 18 . 1 1 70 70 THR CB C 70 68.956 68.956 68.528 0.428 25380
8394 1 18 . 1 1 70 70 THR H H 70 8.095 8.095 8.544 -0.449 25380
8395 1 18 . 1 1 71 71 ASP N N 71 121.817 121.817 120.500 1.317 25380
8396 1 18 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.561 0.029 25380
8397 1 18 . 1 1 71 71 ASP C C 71 176.746 176.746 176.786 -0.040 25380
8398 1 18 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.134 -1.870 25380
8399 1 18 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.838 0.587 25380
8400 1 18 . 1 1 71 71 ASP H H 71 8.076 8.076 8.365 -0.289 25380
8401 1 18 . 1 1 72 72 GLU N N 72 123.635 123.635 115.531 8.104 25380
8402 1 18 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.548 -0.555 25380
8403 1 18 . 1 1 72 72 GLU C C 72 176.971 176.971 175.390 1.581 25380
8404 1 18 . 1 1 72 72 GLU CA C 72 58.219 58.219 55.918 2.301 25380
8405 1 18 . 1 1 72 72 GLU CB C 72 29.702 29.702 31.850 -2.148 25380
8406 1 18 . 1 1 72 72 GLU H H 72 8.514 8.514 7.846 0.668 25380
8407 1 18 . 1 1 73 73 LYS N N 73 117.857 117.857 121.705 -3.848 25380
8408 1 18 . 1 1 73 73 LYS HA H 73 4.643 4.643 4.060 0.583 25380
8409 1 18 . 1 1 73 73 LYS C C 73 176.508 176.508 175.480 1.028 25380
8410 1 18 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.356 -0.276 25380
8411 1 18 . 1 1 73 73 LYS CB C 73 32.203 32.203 32.277 -0.074 25380
8412 1 18 . 1 1 73 73 LYS H H 73 8.423 8.423 8.241 0.182 25380
8413 1 18 . 1 1 74 74 ASP N N 74 120.580 120.580 121.925 -1.345 25380
8414 1 18 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.816 -0.058 25380
8415 1 18 . 1 1 74 74 ASP C C 74 174.059 174.059 174.646 -0.587 25380
8416 1 18 . 1 1 74 74 ASP CA C 74 53.279 53.279 52.634 0.645 25380
8417 1 18 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.385 -0.807 25380
8418 1 18 . 1 1 74 74 ASP H H 74 7.918 7.918 8.801 -0.883 25380
8419 1 18 . 1 1 75 75 PHE N N 75 118.513 118.513 122.461 -3.948 25380
8420 1 18 . 1 1 75 75 PHE HA H 75 5.363 5.363 4.882 0.481 25380
8421 1 18 . 1 1 75 75 PHE C C 75 173.038 173.038 173.336 -0.298 25380
8422 1 18 . 1 1 75 75 PHE CA C 75 55.522 55.522 55.029 0.493 25380
8423 1 18 . 1 1 75 75 PHE CB C 75 41.714 41.714 39.332 2.382 25380
8424 1 18 . 1 1 75 75 PHE H H 75 7.397 7.397 7.575 -0.178 25380
8425 1 18 . 1 1 76 76 LEU N N 76 116.773 116.773 128.796 -12.023 25380
8426 1 18 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.808 -0.165 25380
8427 1 18 . 1 1 76 76 LEU C C 76 177.553 177.553 174.879 2.674 25380
8428 1 18 . 1 1 76 76 LEU CA C 76 53.619 53.619 53.800 -0.181 25380
8429 1 18 . 1 1 76 76 LEU CB C 76 45.701 45.701 45.550 0.151 25380
8430 1 18 . 1 1 76 76 LEU H H 76 8.774 8.774 9.201 -0.427 25380
8431 1 18 . 1 1 77 77 TYR N N 77 118.377 118.377 125.353 -6.976 25380
8432 1 18 . 1 1 77 77 TYR HA H 77 5.415 5.415 5.163 0.252 25380
8433 1 18 . 1 1 77 77 TYR C C 77 175.479 175.479 173.237 2.242 25380
8434 1 18 . 1 1 77 77 TYR CA C 77 58.391 58.391 56.537 1.854 25380
8435 1 18 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.566 0.534 25380
8436 1 18 . 1 1 77 77 TYR H H 77 8.589 8.589 9.338 -0.749 25380
8437 1 18 . 1 1 78 78 GLU N N 78 123.875 123.875 128.555 -4.680 25380
8438 1 18 . 1 1 78 78 GLU HA H 78 4.973 4.973 5.144 -0.171 25380
8439 1 18 . 1 1 78 78 GLU C C 78 174.120 174.120 173.977 0.143 25380
8440 1 18 . 1 1 78 78 GLU CA C 78 54.378 54.378 53.525 0.853 25380
8441 1 18 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.803 -1.163 25380
8442 1 18 . 1 1 78 78 GLU H H 78 9.576 9.576 8.530 1.046 25380
8443 1 18 . 1 1 79 79 LEU N N 79 128.661 128.661 125.223 3.438 25380
8444 1 18 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.482 0.807 25380
8445 1 18 . 1 1 79 79 LEU C C 79 174.219 174.219 174.894 -0.675 25380
8446 1 18 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.567 -0.418 25380
8447 1 18 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.599 2.030 25380
8448 1 18 . 1 1 79 79 LEU H H 79 9.139 9.139 8.643 0.496 25380
8449 1 18 . 1 1 80 80 HIS N N 80 124.886 124.886 123.121 1.765 25380
8450 1 18 . 1 1 80 80 HIS HA H 80 5.430 5.430 5.010 0.420 25380
8451 1 18 . 1 1 80 80 HIS C C 80 173.346 173.346 175.742 -2.396 25380
8452 1 18 . 1 1 80 80 HIS CA C 80 53.149 53.149 55.060 -1.911 25380
8453 1 18 . 1 1 80 80 HIS CB C 80 30.768 30.768 31.710 -0.942 25380
8454 1 18 . 1 1 80 80 HIS H H 80 8.897 8.897 9.026 -0.129 25380
8455 1 18 . 1 1 81 81 ILE N N 81 125.173 125.173 125.347 -0.174 25380
8456 1 18 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.845 0.445 25380
8457 1 18 . 1 1 81 81 ILE C C 81 174.600 174.600 174.036 0.564 25380
8458 1 18 . 1 1 81 81 ILE CA C 81 60.500 60.500 62.085 -1.585 25380
8459 1 18 . 1 1 81 81 ILE CB C 81 39.700 39.700 37.171 2.529 25380
8460 1 18 . 1 1 81 81 ILE H H 81 8.909 8.909 8.318 0.591 25380
8461 1 19 . 1 1 2 2 HIS N N 2 120.430 120.430 121.004 -0.574 25380
8462 1 19 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.403 0.332 25380
8463 1 19 . 1 1 2 2 HIS C C 2 173.884 173.884 173.830 0.054 25380
8464 1 19 . 1 1 2 2 HIS CA C 2 55.052 55.052 57.905 -2.853 25380
8465 1 19 . 1 1 2 2 HIS CB C 2 28.666 28.666 28.804 -0.138 25380
8466 1 19 . 1 1 2 2 HIS H H 2 8.678 8.678 8.568 0.110 25380
8467 1 19 . 1 1 3 3 MET N N 3 122.377 122.377 118.468 3.909 25380
8468 1 19 . 1 1 3 3 MET HA H 3 4.207 4.207 4.599 -0.392 25380
8469 1 19 . 1 1 3 3 MET C C 3 174.584 174.584 175.355 -0.771 25380
8470 1 19 . 1 1 3 3 MET CA C 3 56.550 56.550 55.435 1.115 25380
8471 1 19 . 1 1 3 3 MET CB C 3 33.426 33.426 33.282 0.144 25380
8472 1 19 . 1 1 3 3 MET H H 3 8.240 8.240 7.966 0.274 25380
8473 1 19 . 1 1 4 4 LYS N N 4 123.568 123.568 121.071 2.497 25380
8474 1 19 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.501 0.338 25380
8475 1 19 . 1 1 4 4 LYS C C 4 175.906 175.906 174.975 0.931 25380
8476 1 19 . 1 1 4 4 LYS CA C 4 54.800 54.800 55.571 -0.771 25380
8477 1 19 . 1 1 4 4 LYS CB C 4 34.900 34.900 32.370 2.530 25380
8478 1 19 . 1 1 4 4 LYS H H 4 8.351 8.351 8.127 0.224 25380
8479 1 19 . 1 1 5 5 LEU N N 5 123.568 123.568 115.820 7.748 25380
8480 1 19 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.688 -0.849 25380
8481 1 19 . 1 1 5 5 LEU C C 5 175.900 175.900 175.356 0.544 25380
8482 1 19 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.003 0.347 25380
8483 1 19 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.571 0.329 25380
8484 1 19 . 1 1 5 5 LEU H H 5 8.281 8.281 7.478 0.803 25380
8485 1 19 . 1 1 6 6 VAL N N 6 121.564 121.564 121.317 0.247 25380
8486 1 19 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.237 0.189 25380
8487 1 19 . 1 1 6 6 VAL C C 6 178.200 178.200 174.668 3.532 25380
8488 1 19 . 1 1 6 6 VAL CA C 6 63.200 63.200 61.093 2.107 25380
8489 1 19 . 1 1 6 6 VAL CB C 6 33.200 33.200 32.775 0.425 25380
8490 1 19 . 1 1 6 6 VAL H H 6 9.276 9.276 8.824 0.452 25380
8491 1 19 . 1 1 7 7 LEU N N 7 121.564 121.564 127.679 -6.115 25380
8492 1 19 . 1 1 7 7 LEU HA H 7 4.426 4.426 4.709 -0.283 25380
8493 1 19 . 1 1 7 7 LEU CA C 7 63.200 63.200 54.024 9.176 25380
8494 1 19 . 1 1 7 7 LEU CB C 7 33.200 33.200 42.498 -9.298 25380
8495 1 19 . 1 1 7 7 LEU H H 7 9.276 9.276 8.599 0.677 25380
8496 1 19 . 1 1 8 8 ALA C C 8 177.040 177.040 177.648 -0.608 25380
8497 1 19 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.115 -0.414 25380
8498 1 19 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.969 0.895 25380
8499 1 19 . 1 1 9 9 LYS N N 9 119.845 119.845 124.765 -4.920 25380
8500 1 19 . 1 1 9 9 LYS HA H 9 4.128 4.128 3.909 0.220 25380
8501 1 19 . 1 1 9 9 LYS C C 9 176.075 176.075 178.124 -2.049 25380
8502 1 19 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.643 -2.882 25380
8503 1 19 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.429 0.490 25380
8504 1 19 . 1 1 9 9 LYS H H 9 8.545 8.545 8.796 -0.251 25380
8505 1 19 . 1 1 10 10 ASN N N 10 119.279 119.279 116.986 2.293 25380
8506 1 19 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.476 0.169 25380
8507 1 19 . 1 1 10 10 ASN C C 10 175.443 175.443 176.320 -0.877 25380
8508 1 19 . 1 1 10 10 ASN CA C 10 53.657 53.657 56.061 -2.404 25380
8509 1 19 . 1 1 10 10 ASN CB C 10 38.777 38.777 38.528 0.249 25380
8510 1 19 . 1 1 10 10 ASN H H 10 8.592 8.592 8.400 0.192 25380
8511 1 19 . 1 1 11 11 THR N N 11 111.876 111.876 107.225 4.651 25380
8512 1 19 . 1 1 11 11 THR HA H 11 4.311 4.311 4.526 -0.215 25380
8513 1 19 . 1 1 11 11 THR C C 11 174.666 174.666 176.043 -1.377 25380
8514 1 19 . 1 1 11 11 THR CA C 11 62.044 62.044 62.294 -0.250 25380
8515 1 19 . 1 1 11 11 THR CB C 11 69.895 69.895 69.818 0.077 25380
8516 1 19 . 1 1 11 11 THR H H 11 8.058 8.058 8.090 -0.032 25380
8517 1 19 . 1 1 12 12 ARG N N 12 121.152 121.152 120.627 0.525 25380
8518 1 19 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.420 -0.158 25380
8519 1 19 . 1 1 12 12 ARG C C 12 176.714 176.714 176.242 0.472 25380
8520 1 19 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.347 0.475 25380
8521 1 19 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.357 -0.655 25380
8522 1 19 . 1 1 12 12 ARG H H 12 8.291 8.291 7.667 0.624 25380
8523 1 19 . 1 1 13 13 LYS N N 13 120.459 120.459 118.667 1.792 25380
8524 1 19 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.050 -0.154 25380
8525 1 19 . 1 1 13 13 LYS C C 13 176.682 176.682 176.539 0.143 25380
8526 1 19 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.256 -0.278 25380
8527 1 19 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.454 2.044 25380
8528 1 19 . 1 1 13 13 LYS H H 13 8.286 8.286 8.129 0.157 25380
8529 1 19 . 1 1 14 14 SER N N 14 114.568 114.568 114.124 0.444 25380
8530 1 19 . 1 1 14 14 SER HA H 14 4.371 4.371 4.363 0.008 25380
8531 1 19 . 1 1 14 14 SER C C 14 173.990 173.990 175.061 -1.071 25380
8532 1 19 . 1 1 14 14 SER CA C 14 58.617 58.617 58.762 -0.145 25380
8533 1 19 . 1 1 14 14 SER CB C 14 63.933 63.933 63.821 0.112 25380
8534 1 19 . 1 1 14 14 SER H H 14 7.957 7.957 8.339 -0.382 25380
8535 1 19 . 1 1 15 15 ASP N N 15 121.565 121.565 120.090 1.475 25380
8536 1 19 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.748 -0.147 25380
8537 1 19 . 1 1 15 15 ASP C C 15 175.684 175.684 175.861 -0.177 25380
8538 1 19 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.877 0.272 25380
8539 1 19 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.203 1.026 25380
8540 1 19 . 1 1 15 15 ASP H H 15 8.166 8.166 8.384 -0.218 25380
8541 1 19 . 1 1 16 16 ALA N N 16 124.173 124.173 123.886 0.287 25380
8542 1 19 . 1 1 16 16 ALA HA H 16 4.371 4.371 3.953 0.418 25380
8543 1 19 . 1 1 16 16 ALA C C 16 177.184 177.184 177.557 -0.373 25380
8544 1 19 . 1 1 16 16 ALA CA C 16 52.337 52.337 54.109 -1.772 25380
8545 1 19 . 1 1 16 16 ALA CB C 16 19.359 19.359 19.294 0.065 25380
8546 1 19 . 1 1 16 16 ALA H H 16 8.163 8.163 8.295 -0.132 25380
8547 1 19 . 1 1 17 17 LYS N N 17 121.152 121.152 118.583 2.569 25380
8548 1 19 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.037 0.389 25380
8549 1 19 . 1 1 17 17 LYS C C 17 175.488 175.488 176.595 -1.107 25380
8550 1 19 . 1 1 17 17 LYS CA C 17 56.205 56.205 57.086 -0.881 25380
8551 1 19 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.183 2.113 25380
8552 1 19 . 1 1 17 17 LYS H H 17 8.363 8.363 7.616 0.747 25380
8553 1 19 . 1 1 18 18 SER N N 18 116.448 116.448 112.140 4.308 25380
8554 1 19 . 1 1 18 18 SER HA H 18 5.355 5.355 3.936 1.419 25380
8555 1 19 . 1 1 18 18 SER C C 18 173.887 173.887 174.866 -0.979 25380
8556 1 19 . 1 1 18 18 SER CA C 18 57.248 57.248 59.696 -2.448 25380
8557 1 19 . 1 1 18 18 SER CB C 18 64.962 64.962 62.629 2.333 25380
8558 1 19 . 1 1 18 18 SER H H 18 8.206 8.206 8.914 -0.708 25380
8559 1 19 . 1 1 19 19 VAL N N 19 117.867 117.867 119.865 -1.998 25380
8560 1 19 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.709 -0.089 25380
8561 1 19 . 1 1 19 19 VAL C C 19 174.169 174.169 176.381 -2.212 25380
8562 1 19 . 1 1 19 19 VAL CA C 19 59.546 59.546 65.877 -6.331 25380
8563 1 19 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.815 4.087 25380
8564 1 19 . 1 1 19 19 VAL H H 19 9.086 9.086 7.454 1.632 25380
8565 1 19 . 1 1 20 20 GLU N N 20 120.843 120.843 119.709 1.134 25380
8566 1 19 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.174 0.694 25380
8567 1 19 . 1 1 20 20 GLU C C 20 178.747 178.747 178.492 0.255 25380
8568 1 19 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.469 -4.917 25380
8569 1 19 . 1 1 20 20 GLU CB C 20 31.099 31.099 29.069 2.030 25380
8570 1 19 . 1 1 20 20 GLU H H 20 8.841 8.841 8.737 0.104 25380
8571 1 19 . 1 1 21 21 LEU N N 21 122.653 122.653 118.220 4.433 25380
8572 1 19 . 1 1 21 21 LEU HA H 21 3.443 3.443 4.015 -0.572 25380
8573 1 19 . 1 1 21 21 LEU C C 21 178.799 178.799 179.205 -0.406 25380
8574 1 19 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.857 0.850 25380
8575 1 19 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.665 -3.094 25380
8576 1 19 . 1 1 21 21 LEU H H 21 8.744 8.744 7.614 1.130 25380
8577 1 19 . 1 1 22 22 GLU N N 22 115.392 115.392 119.392 -4.000 25380
8578 1 19 . 1 1 22 22 GLU HA H 22 3.989 3.989 3.976 0.013 25380
8579 1 19 . 1 1 22 22 GLU C C 22 179.328 179.328 179.201 0.127 25380
8580 1 19 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.633 0.447 25380
8581 1 19 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.375 -0.541 25380
8582 1 19 . 1 1 22 22 GLU H H 22 8.744 8.744 7.602 1.142 25380
8583 1 19 . 1 1 23 23 ASP N N 23 118.597 118.597 120.899 -2.302 25380
8584 1 19 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.558 0.053 25380
8585 1 19 . 1 1 23 23 ASP C C 23 179.139 179.139 178.932 0.207 25380
8586 1 19 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.387 0.132 25380
8587 1 19 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.483 -0.040 25380
8588 1 19 . 1 1 23 23 ASP H H 23 7.098 7.098 8.402 -1.304 25380
8589 1 19 . 1 1 24 24 LEU N N 24 119.869 119.869 120.841 -0.972 25380
8590 1 19 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.702 0.232 25380
8591 1 19 . 1 1 24 24 LEU C C 24 179.045 179.045 178.942 0.103 25380
8592 1 19 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.309 -0.760 25380
8593 1 19 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.835 -0.285 25380
8594 1 19 . 1 1 24 24 LEU H H 24 7.576 7.576 8.459 -0.883 25380
8595 1 19 . 1 1 25 25 TYR N N 25 118.100 118.100 118.871 -0.771 25380
8596 1 19 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.454 0.913 25380
8597 1 19 . 1 1 25 25 TYR C C 25 177.945 177.945 177.768 0.177 25380
8598 1 19 . 1 1 25 25 TYR CA C 25 62.606 62.606 60.791 1.815 25380
8599 1 19 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.376 -0.428 25380
8600 1 19 . 1 1 25 25 TYR H H 25 8.320 8.320 7.423 0.897 25380
8601 1 19 . 1 1 26 26 HIS N N 26 119.440 119.440 119.801 -0.361 25380
8602 1 19 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.522 -0.151 25380
8603 1 19 . 1 1 26 26 HIS C C 26 176.559 176.559 177.844 -1.285 25380
8604 1 19 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.384 0.135 25380
8605 1 19 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.312 -2.184 25380
8606 1 19 . 1 1 26 26 HIS H H 26 8.383 8.383 8.779 -0.396 25380
8607 1 19 . 1 1 27 27 GLU N N 27 119.915 119.915 120.451 -0.536 25380
8608 1 19 . 1 1 27 27 GLU HA H 27 4.258 4.258 3.923 0.335 25380
8609 1 19 . 1 1 27 27 GLU C C 27 179.163 179.163 178.732 0.431 25380
8610 1 19 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.327 0.748 25380
8611 1 19 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.588 -0.053 25380
8612 1 19 . 1 1 27 27 GLU H H 27 8.288 8.288 9.030 -0.742 25380
8613 1 19 . 1 1 28 28 PHE N N 28 120.500 120.500 120.219 0.281 25380
8614 1 19 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.203 0.769 25380
8615 1 19 . 1 1 28 28 PHE C C 28 177.386 177.386 176.635 0.751 25380
8616 1 19 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.931 -0.529 25380
8617 1 19 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.179 0.389 25380
8618 1 19 . 1 1 28 28 PHE H H 28 8.568 8.568 7.835 0.733 25380
8619 1 19 . 1 1 29 29 SER N N 29 114.306 114.306 114.027 0.279 25380
8620 1 19 . 1 1 29 29 SER HA H 29 4.288 4.288 4.264 0.024 25380
8621 1 19 . 1 1 29 29 SER C C 29 175.656 175.656 176.045 -0.389 25380
8622 1 19 . 1 1 29 29 SER CA C 29 61.058 61.058 60.304 0.753 25380
8623 1 19 . 1 1 29 29 SER CB C 29 63.555 63.555 63.424 0.131 25380
8624 1 19 . 1 1 29 29 SER H H 29 8.479 8.479 7.987 0.492 25380
8625 1 19 . 1 1 30 30 GLU N N 30 118.322 118.322 121.102 -2.780 25380
8626 1 19 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.141 -0.049 25380
8627 1 19 . 1 1 30 30 GLU C C 30 177.312 177.312 176.491 0.821 25380
8628 1 19 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.516 0.064 25380
8629 1 19 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.525 -0.948 25380
8630 1 19 . 1 1 30 30 GLU H H 30 8.428 8.428 7.877 0.551 25380
8631 1 19 . 1 1 31 31 ASP N N 31 115.630 115.630 117.057 -1.427 25380
8632 1 19 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.819 -0.009 25380
8633 1 19 . 1 1 31 31 ASP C C 31 175.723 175.723 173.658 2.065 25380
8634 1 19 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.837 1.137 25380
8635 1 19 . 1 1 31 31 ASP CB C 31 40.818 40.818 44.108 -3.290 25380
8636 1 19 . 1 1 31 31 ASP H H 31 7.303 7.303 8.063 -0.760 25380
8637 1 19 . 1 1 32 32 LYS N N 32 114.357 114.357 120.982 -6.625 25380
8638 1 19 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.376 -0.549 25380
8639 1 19 . 1 1 32 32 LYS C C 32 175.716 175.716 175.917 -0.201 25380
8640 1 19 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.742 0.420 25380
8641 1 19 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.770 -5.389 25380
8642 1 19 . 1 1 32 32 LYS H H 32 7.148 7.148 8.347 -1.199 25380
8643 1 19 . 1 1 33 33 ARG N N 33 120.929 120.929 125.294 -4.365 25380
8644 1 19 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.603 -0.402 25380
8645 1 19 . 1 1 33 33 ARG C C 33 173.982 173.982 173.266 0.716 25380
8646 1 19 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.227 0.967 25380
8647 1 19 . 1 1 33 33 ARG CB C 33 30.642 30.642 33.869 -3.227 25380
8648 1 19 . 1 1 33 33 ARG H H 33 7.388 7.388 8.578 -1.190 25380
8649 1 19 . 1 1 34 34 SER N N 34 115.867 115.867 114.220 1.647 25380
8650 1 19 . 1 1 34 34 SER HA H 34 5.355 5.355 4.814 0.541 25380
8651 1 19 . 1 1 34 34 SER C C 34 172.754 172.754 172.537 0.217 25380
8652 1 19 . 1 1 34 34 SER CA C 34 58.236 58.236 57.248 0.988 25380
8653 1 19 . 1 1 34 34 SER CB C 34 65.212 65.212 65.530 -0.318 25380
8654 1 19 . 1 1 34 34 SER H H 34 8.173 8.173 8.241 -0.068 25380
8655 1 19 . 1 1 35 35 ILE N N 35 119.621 119.621 114.764 4.857 25380
8656 1 19 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.908 -0.045 25380
8657 1 19 . 1 1 35 35 ILE C C 35 174.069 174.069 173.329 0.740 25380
8658 1 19 . 1 1 35 35 ILE CA C 35 59.956 59.956 58.953 1.004 25380
8659 1 19 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.573 -0.918 25380
8660 1 19 . 1 1 35 35 ILE H H 35 6.779 6.779 8.495 -1.716 25380
8661 1 19 . 1 1 36 36 PHE N N 36 124.305 124.305 118.781 5.524 25380
8662 1 19 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.793 -1.340 25380
8663 1 19 . 1 1 36 36 PHE C C 36 173.204 173.204 175.036 -1.832 25380
8664 1 19 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.186 0.230 25380
8665 1 19 . 1 1 36 36 PHE CB C 36 44.817 44.817 42.328 2.489 25380
8666 1 19 . 1 1 36 36 PHE H H 36 8.411 8.411 8.771 -0.360 25380
8667 1 19 . 1 1 37 37 TYR N N 37 118.743 118.743 125.100 -6.357 25380
8668 1 19 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.140 0.430 25380
8669 1 19 . 1 1 37 37 TYR C C 37 175.455 175.455 173.691 1.764 25380
8670 1 19 . 1 1 37 37 TYR CA C 37 56.518 56.518 56.275 0.243 25380
8671 1 19 . 1 1 37 37 TYR CB C 37 40.991 40.991 41.519 -0.528 25380
8672 1 19 . 1 1 37 37 TYR H H 37 8.353 8.353 9.480 -1.127 25380
8673 1 19 . 1 1 38 38 PHE N N 38 119.236 119.236 130.540 -11.304 25380
8674 1 19 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.919 0.241 25380
8675 1 19 . 1 1 38 38 PHE C C 38 174.650 174.650 172.968 1.682 25380
8676 1 19 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.048 1.794 25380
8677 1 19 . 1 1 38 38 PHE CB C 38 42.619 42.619 40.046 2.573 25380
8678 1 19 . 1 1 38 38 PHE H H 38 9.756 9.756 9.106 0.650 25380
8679 1 19 . 1 1 39 39 ALA N N 39 122.516 122.516 129.095 -6.579 25380
8680 1 19 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.958 -0.418 25380
8681 1 19 . 1 1 39 39 ALA C C 39 177.042 177.042 174.469 2.573 25380
8682 1 19 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.679 1.164 25380
8683 1 19 . 1 1 39 39 ALA CB C 39 18.578 18.578 22.374 -3.796 25380
8684 1 19 . 1 1 39 39 ALA H H 39 7.738 7.738 8.766 -1.028 25380
8685 1 19 . 1 1 40 40 PRO C C 40 175.411 175.411 177.252 -1.841 25380
8686 1 19 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.907 1.381 25380
8687 1 19 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.516 -1.412 25380
8688 1 19 . 1 1 41 41 THR N N 41 105.878 105.878 117.522 -11.644 25380
8689 1 19 . 1 1 41 41 THR HA H 41 4.190 4.190 3.658 0.532 25380
8690 1 19 . 1 1 41 41 THR C C 41 176.400 176.400 174.489 1.911 25380
8691 1 19 . 1 1 41 41 THR CA C 41 61.937 61.937 65.438 -3.501 25380
8692 1 19 . 1 1 41 41 THR CB C 41 68.331 68.331 68.695 -0.364 25380
8693 1 19 . 1 1 41 41 THR H H 41 6.715 6.715 8.047 -1.332 25380
8694 1 19 . 1 1 42 42 ASN N N 42 118.863 118.863 117.598 1.265 25380
8695 1 19 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.448 0.087 25380
8696 1 19 . 1 1 42 42 ASN C C 42 173.764 173.764 175.767 -2.003 25380
8697 1 19 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.484 -1.308 25380
8698 1 19 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.887 3.828 25380
8699 1 19 . 1 1 42 42 ASN H H 42 7.153 7.153 8.329 -1.176 25380
8700 1 19 . 1 1 43 43 ALA N N 43 126.174 126.174 118.858 7.316 25380
8701 1 19 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.439 -0.014 25380
8702 1 19 . 1 1 43 43 ALA C C 43 179.308 179.308 176.670 2.638 25380
8703 1 19 . 1 1 43 43 ALA CA C 43 51.982 51.982 51.761 0.220 25380
8704 1 19 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.697 -1.403 25380
8705 1 19 . 1 1 43 43 ALA H H 43 9.465 9.465 7.737 1.728 25380
8706 1 19 . 1 1 44 44 HIS N N 44 126.251 126.251 115.006 11.245 25380
8707 1 19 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.333 -0.506 25380
8708 1 19 . 1 1 44 44 HIS C C 44 177.407 177.407 175.574 1.833 25380
8709 1 19 . 1 1 44 44 HIS CA C 44 61.025 61.025 57.181 3.844 25380
8710 1 19 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.340 1.290 25380
8711 1 19 . 1 1 44 44 HIS H H 44 9.407 9.407 7.827 1.580 25380
8712 1 19 . 1 1 45 45 LYS N N 45 114.990 114.990 120.090 -5.100 25380
8713 1 19 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.185 -0.302 25380
8714 1 19 . 1 1 45 45 LYS C C 45 178.284 178.284 177.595 0.689 25380
8715 1 19 . 1 1 45 45 LYS CA C 45 59.249 59.249 59.340 -0.091 25380
8716 1 19 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.602 -0.768 25380
8717 1 19 . 1 1 45 45 LYS H H 45 8.960 8.960 8.188 0.772 25380
8718 1 19 . 1 1 46 46 ASP N N 46 120.411 120.411 118.799 1.612 25380
8719 1 19 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.441 -0.015 25380
8720 1 19 . 1 1 46 46 ASP C C 46 177.773 177.773 178.085 -0.312 25380
8721 1 19 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.156 -0.140 25380
8722 1 19 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.193 -0.296 25380
8723 1 19 . 1 1 46 46 ASP H H 46 6.777 6.777 8.575 -1.798 25380
8724 1 19 . 1 1 47 47 MET N N 47 118.178 118.178 119.496 -1.318 25380
8725 1 19 . 1 1 47 47 MET HA H 47 3.879 3.879 4.027 -0.148 25380
8726 1 19 . 1 1 47 47 MET C C 47 179.499 179.499 177.673 1.826 25380
8727 1 19 . 1 1 47 47 MET CA C 47 56.052 56.052 59.076 -3.024 25380
8728 1 19 . 1 1 47 47 MET CB C 47 29.601 29.601 32.536 -2.935 25380
8729 1 19 . 1 1 47 47 MET H H 47 7.367 7.367 8.087 -0.720 25380
8730 1 19 . 1 1 48 48 LEU N N 48 117.665 117.665 119.149 -1.484 25380
8731 1 19 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.868 -0.021 25380
8732 1 19 . 1 1 48 48 LEU C C 48 179.843 179.843 178.888 0.955 25380
8733 1 19 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.519 0.062 25380
8734 1 19 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.435 -0.482 25380
8735 1 19 . 1 1 48 48 LEU H H 48 7.672 7.672 7.583 0.089 25380
8736 1 19 . 1 1 49 49 LYS N N 49 119.326 119.326 118.712 0.614 25380
8737 1 19 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.984 0.143 25380
8738 1 19 . 1 1 49 49 LYS C C 49 179.684 179.684 179.009 0.675 25380
8739 1 19 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.560 -0.761 25380
8740 1 19 . 1 1 49 49 LYS CB C 49 31.453 31.453 32.281 -0.827 25380
8741 1 19 . 1 1 49 49 LYS H H 49 7.420 7.420 7.740 -0.320 25380
8742 1 19 . 1 1 50 50 ALA N N 50 122.022 122.022 122.425 -0.403 25380
8743 1 19 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.604 0.439 25380
8744 1 19 . 1 1 50 50 ALA C C 50 178.818 178.818 178.886 -0.068 25380
8745 1 19 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.755 0.414 25380
8746 1 19 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.504 -0.204 25380
8747 1 19 . 1 1 50 50 ALA H H 50 7.551 7.551 7.529 0.022 25380
8748 1 19 . 1 1 51 51 VAL N N 51 118.165 118.165 118.063 0.102 25380
8749 1 19 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.619 -0.177 25380
8750 1 19 . 1 1 51 51 VAL C C 51 178.646 178.646 178.123 0.523 25380
8751 1 19 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.417 0.789 25380
8752 1 19 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.841 0.612 25380
8753 1 19 . 1 1 51 51 VAL H H 51 7.226 7.226 7.533 -0.307 25380
8754 1 19 . 1 1 52 52 ASP N N 52 122.298 122.298 120.659 1.639 25380
8755 1 19 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.322 0.049 25380
8756 1 19 . 1 1 52 52 ASP C C 52 177.898 177.898 178.997 -1.099 25380
8757 1 19 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.166 0.405 25380
8758 1 19 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.243 0.143 25380
8759 1 19 . 1 1 52 52 ASP H H 52 8.232 8.232 7.437 0.795 25380
8760 1 19 . 1 1 53 53 PHE N N 53 121.541 121.541 119.869 1.672 25380
8761 1 19 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.120 0.201 25380
8762 1 19 . 1 1 53 53 PHE C C 53 177.224 177.224 177.819 -0.595 25380
8763 1 19 . 1 1 53 53 PHE CA C 53 61.080 61.080 61.913 -0.833 25380
8764 1 19 . 1 1 53 53 PHE CB C 53 39.700 39.700 38.772 0.928 25380
8765 1 19 . 1 1 53 53 PHE H H 53 8.240 8.240 8.091 0.149 25380
8766 1 19 . 1 1 54 54 PHE N N 54 115.925 115.925 116.923 -0.998 25380
8767 1 19 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.251 -0.596 25380
8768 1 19 . 1 1 54 54 PHE C C 54 178.269 178.269 177.272 0.997 25380
8769 1 19 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.913 4.287 25380
8770 1 19 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.993 0.585 25380
8771 1 19 . 1 1 54 54 PHE H H 54 7.755 7.755 7.893 -0.138 25380
8772 1 19 . 1 1 55 55 LYS N N 55 120.251 120.251 117.741 2.510 25380
8773 1 19 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.098 0.328 25380
8774 1 19 . 1 1 55 55 LYS C C 55 181.484 181.484 178.216 3.268 25380
8775 1 19 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.705 0.924 25380
8776 1 19 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.497 -0.758 25380
8777 1 19 . 1 1 55 55 LYS H H 55 8.213 8.213 7.468 0.745 25380
8778 1 19 . 1 1 56 56 GLU N N 56 120.146 120.146 117.466 2.680 25380
8779 1 19 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.089 -0.096 25380
8780 1 19 . 1 1 56 56 GLU C C 56 178.085 178.085 177.521 0.564 25380
8781 1 19 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.325 0.463 25380
8782 1 19 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.025 -1.429 25380
8783 1 19 . 1 1 56 56 GLU H H 56 7.850 7.850 7.841 0.009 25380
8784 1 19 . 1 1 57 57 LYS N N 57 115.940 115.940 118.832 -2.892 25380
8785 1 19 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.442 -0.339 25380
8786 1 19 . 1 1 57 57 LYS C C 57 176.225 176.225 177.078 -0.853 25380
8787 1 19 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.014 -0.442 25380
8788 1 19 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.262 -1.226 25380
8789 1 19 . 1 1 57 57 LYS H H 57 7.019 7.019 8.026 -1.007 25380
8790 1 19 . 1 1 58 58 GLY N N 58 106.593 106.593 107.984 -1.391 25380
8791 1 19 . 1 1 58 58 GLY C C 58 174.350 174.350 175.523 -1.173 25380
8792 1 19 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.191 0.309 25380
8793 1 19 . 1 1 58 58 GLY H H 58 7.883 7.883 8.439 -0.556 25380
8794 1 19 . 1 1 59 59 HIS N N 59 117.962 117.962 117.849 0.113 25380
8795 1 19 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.563 0.304 25380
8796 1 19 . 1 1 59 59 HIS C C 59 173.271 173.271 174.711 -1.440 25380
8797 1 19 . 1 1 59 59 HIS CA C 59 54.778 54.778 55.626 -0.848 25380
8798 1 19 . 1 1 59 59 HIS CB C 59 31.685 31.685 28.387 3.298 25380
8799 1 19 . 1 1 59 59 HIS H H 59 8.218 8.218 8.434 -0.216 25380
8800 1 19 . 1 1 60 60 THR N N 60 119.624 119.624 109.322 10.302 25380
8801 1 19 . 1 1 60 60 THR HA H 60 4.430 4.430 4.642 -0.212 25380
8802 1 19 . 1 1 60 60 THR C C 60 171.430 171.430 173.957 -2.527 25380
8803 1 19 . 1 1 60 60 THR CA C 60 63.480 63.480 60.581 2.899 25380
8804 1 19 . 1 1 60 60 THR CB C 60 69.761 69.761 71.592 -1.831 25380
8805 1 19 . 1 1 60 60 THR H H 60 8.780 8.780 7.228 1.552 25380
8806 1 19 . 1 1 61 61 ALA N N 61 126.706 126.706 122.775 3.931 25380
8807 1 19 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.445 0.801 25380
8808 1 19 . 1 1 61 61 ALA C C 61 174.753 174.753 176.397 -1.644 25380
8809 1 19 . 1 1 61 61 ALA CA C 61 49.772 49.772 52.093 -2.321 25380
8810 1 19 . 1 1 61 61 ALA CB C 61 22.889 22.889 21.288 1.601 25380
8811 1 19 . 1 1 61 61 ALA H H 61 7.795 7.795 8.614 -0.819 25380
8812 1 19 . 1 1 62 62 TYR N N 62 117.859 117.859 117.157 0.702 25380
8813 1 19 . 1 1 62 62 TYR C C 62 173.431 173.431 173.806 -0.375 25380
8814 1 19 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.794 -1.147 25380
8815 1 19 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.833 -2.284 25380
8816 1 19 . 1 1 62 62 TYR H H 62 8.711 8.711 8.147 0.564 25380
8817 1 19 . 1 1 63 63 LEU N N 63 125.044 125.044 123.679 1.365 25380
8818 1 19 . 1 1 63 63 LEU HA H 63 5.411 5.411 5.037 0.374 25380
8819 1 19 . 1 1 63 63 LEU C C 63 175.319 175.319 175.311 0.008 25380
8820 1 19 . 1 1 63 63 LEU CA C 63 53.230 53.230 54.019 -0.789 25380
8821 1 19 . 1 1 63 63 LEU CB C 63 45.701 45.701 44.791 0.910 25380
8822 1 19 . 1 1 63 63 LEU H H 63 8.746 8.746 8.551 0.195 25380
8823 1 19 . 1 1 64 64 ASP N N 64 125.463 125.463 125.210 0.253 25380
8824 1 19 . 1 1 64 64 ASP HA H 64 5.199 5.199 5.026 0.173 25380
8825 1 19 . 1 1 64 64 ASP C C 64 174.512 174.512 174.391 0.121 25380
8826 1 19 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.630 0.070 25380
8827 1 19 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.312 -0.358 25380
8828 1 19 . 1 1 64 64 ASP H H 64 9.293 9.293 9.196 0.097 25380
8829 1 19 . 1 1 65 65 GLU N N 65 120.711 120.711 118.966 1.745 25380
8830 1 19 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.425 0.642 25380
8831 1 19 . 1 1 65 65 GLU C C 65 175.652 175.652 176.791 -1.139 25380
8832 1 19 . 1 1 65 65 GLU CA C 65 55.643 55.643 56.767 -1.124 25380
8833 1 19 . 1 1 65 65 GLU CB C 65 30.455 30.455 30.721 -0.266 25380
8834 1 19 . 1 1 65 65 GLU H H 65 8.715 8.715 8.520 0.195 25380
8835 1 19 . 1 1 66 66 VAL N N 66 122.936 122.936 118.595 4.341 25380
8836 1 19 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.189 0.241 25380
8837 1 19 . 1 1 66 66 VAL C C 66 175.065 175.065 175.943 -0.878 25380
8838 1 19 . 1 1 66 66 VAL CA C 66 60.991 60.991 61.173 -0.182 25380
8839 1 19 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.706 1.574 25380
8840 1 19 . 1 1 66 66 VAL H H 66 9.156 9.156 8.695 0.461 25380
8841 1 19 . 1 1 67 67 ARG N N 67 126.104 126.104 119.749 6.355 25380
8842 1 19 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.434 0.107 25380
8843 1 19 . 1 1 67 67 ARG C C 67 176.708 176.708 176.999 -0.291 25380
8844 1 19 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.673 0.407 25380
8845 1 19 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.854 1.054 25380
8846 1 19 . 1 1 67 67 ARG H H 67 8.734 8.734 8.630 0.104 25380
8847 1 19 . 1 1 68 68 VAL N N 68 120.707 120.707 114.702 6.005 25380
8848 1 19 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.300 -0.148 25380
8849 1 19 . 1 1 68 68 VAL C C 68 175.931 175.931 176.846 -0.915 25380
8850 1 19 . 1 1 68 68 VAL CA C 68 62.776 62.776 63.394 -0.618 25380
8851 1 19 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.368 1.121 25380
8852 1 19 . 1 1 68 68 VAL H H 68 8.384 8.384 7.840 0.544 25380
8853 1 19 . 1 1 69 69 SER N N 69 116.156 116.156 116.750 -0.594 25380
8854 1 19 . 1 1 69 69 SER HA H 69 4.693 4.693 4.323 0.370 25380
8855 1 19 . 1 1 69 69 SER C C 69 174.544 174.544 175.799 -1.255 25380
8856 1 19 . 1 1 69 69 SER CA C 69 57.754 57.754 61.248 -3.494 25380
8857 1 19 . 1 1 69 69 SER CB C 69 64.831 64.831 62.370 2.461 25380
8858 1 19 . 1 1 69 69 SER H H 69 8.067 8.067 8.420 -0.353 25380
8859 1 19 . 1 1 70 70 THR N N 70 110.753 110.753 111.274 -0.521 25380
8860 1 19 . 1 1 70 70 THR HA H 70 4.152 4.152 4.168 -0.016 25380
8861 1 19 . 1 1 70 70 THR C C 70 174.865 174.865 175.457 -0.592 25380
8862 1 19 . 1 1 70 70 THR CA C 70 63.831 63.831 64.474 -0.643 25380
8863 1 19 . 1 1 70 70 THR CB C 70 68.956 68.956 69.137 -0.181 25380
8864 1 19 . 1 1 70 70 THR H H 70 8.095 8.095 7.760 0.335 25380
8865 1 19 . 1 1 71 71 ASP N N 71 121.817 121.817 120.237 1.580 25380
8866 1 19 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.632 -0.042 25380
8867 1 19 . 1 1 71 71 ASP C C 71 176.746 176.746 177.341 -0.595 25380
8868 1 19 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.216 -1.952 25380
8869 1 19 . 1 1 71 71 ASP CB C 71 41.425 41.425 41.131 0.294 25380
8870 1 19 . 1 1 71 71 ASP H H 71 8.076 8.076 8.519 -0.443 25380
8871 1 19 . 1 1 72 72 GLU N N 72 123.635 123.635 115.838 7.797 25380
8872 1 19 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.544 -0.551 25380
8873 1 19 . 1 1 72 72 GLU C C 72 176.971 176.971 175.891 1.080 25380
8874 1 19 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.215 2.003 25380
8875 1 19 . 1 1 72 72 GLU CB C 72 29.702 29.702 32.333 -2.631 25380
8876 1 19 . 1 1 72 72 GLU H H 72 8.514 8.514 8.417 0.097 25380
8877 1 19 . 1 1 73 73 LYS N N 73 117.857 117.857 115.525 2.332 25380
8878 1 19 . 1 1 73 73 LYS HA H 73 4.643 4.643 4.046 0.597 25380
8879 1 19 . 1 1 73 73 LYS C C 73 176.508 176.508 175.562 0.946 25380
8880 1 19 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.912 -0.832 25380
8881 1 19 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.233 0.970 25380
8882 1 19 . 1 1 73 73 LYS H H 73 8.423 8.423 7.781 0.642 25380
8883 1 19 . 1 1 74 74 ASP N N 74 120.580 120.580 117.702 2.878 25380
8884 1 19 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.548 0.210 25380
8885 1 19 . 1 1 74 74 ASP C C 74 174.059 174.059 175.600 -1.541 25380
8886 1 19 . 1 1 74 74 ASP CA C 74 53.279 53.279 55.571 -2.292 25380
8887 1 19 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.368 -0.790 25380
8888 1 19 . 1 1 74 74 ASP H H 74 7.918 7.918 8.423 -0.505 25380
8889 1 19 . 1 1 75 75 PHE N N 75 118.513 118.513 118.173 0.340 25380
8890 1 19 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.255 0.108 25380
8891 1 19 . 1 1 75 75 PHE C C 75 173.038 173.038 175.606 -2.568 25380
8892 1 19 . 1 1 75 75 PHE CA C 75 55.522 55.522 56.946 -1.424 25380
8893 1 19 . 1 1 75 75 PHE CB C 75 41.714 41.714 40.663 1.051 25380
8894 1 19 . 1 1 75 75 PHE H H 75 7.397 7.397 7.928 -0.531 25380
8895 1 19 . 1 1 76 76 LEU N N 76 116.773 116.773 123.830 -7.057 25380
8896 1 19 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.706 -0.063 25380
8897 1 19 . 1 1 76 76 LEU C C 76 177.553 177.553 176.071 1.482 25380
8898 1 19 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.714 -1.095 25380
8899 1 19 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.119 2.582 25380
8900 1 19 . 1 1 76 76 LEU H H 76 8.774 8.774 8.995 -0.221 25380
8901 1 19 . 1 1 77 77 TYR N N 77 118.377 118.377 126.309 -7.932 25380
8902 1 19 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.692 0.723 25380
8903 1 19 . 1 1 77 77 TYR C C 77 175.479 175.479 173.455 2.024 25380
8904 1 19 . 1 1 77 77 TYR CA C 77 58.391 58.391 56.322 2.069 25380
8905 1 19 . 1 1 77 77 TYR CB C 77 41.100 41.100 39.561 1.539 25380
8906 1 19 . 1 1 77 77 TYR H H 77 8.589 8.589 9.253 -0.664 25380
8907 1 19 . 1 1 78 78 GLU N N 78 123.875 123.875 128.775 -4.900 25380
8908 1 19 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.680 0.293 25380
8909 1 19 . 1 1 78 78 GLU C C 78 174.120 174.120 174.006 0.114 25380
8910 1 19 . 1 1 78 78 GLU CA C 78 54.378 54.378 54.204 0.174 25380
8911 1 19 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.051 -0.411 25380
8912 1 19 . 1 1 78 78 GLU H H 78 9.576 9.576 8.767 0.809 25380
8913 1 19 . 1 1 79 79 LEU N N 79 128.661 128.661 126.629 2.032 25380
8914 1 19 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.427 0.862 25380
8915 1 19 . 1 1 79 79 LEU C C 79 174.219 174.219 175.195 -0.976 25380
8916 1 19 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.460 -0.311 25380
8917 1 19 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.451 2.179 25380
8918 1 19 . 1 1 79 79 LEU H H 79 9.139 9.139 8.835 0.304 25380
8919 1 19 . 1 1 80 80 HIS N N 80 124.886 124.886 122.141 2.745 25380
8920 1 19 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.982 0.448 25380
8921 1 19 . 1 1 80 80 HIS C C 80 173.346 173.346 175.242 -1.896 25380
8922 1 19 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.773 -1.624 25380
8923 1 19 . 1 1 80 80 HIS CB C 80 30.768 30.768 31.648 -0.880 25380
8924 1 19 . 1 1 80 80 HIS H H 80 8.897 8.897 8.732 0.165 25380
8925 1 19 . 1 1 81 81 ILE N N 81 125.173 125.173 120.822 4.351 25380
8926 1 19 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.690 0.600 25380
8927 1 19 . 1 1 81 81 ILE C C 81 174.600 174.600 174.537 0.063 25380
8928 1 19 . 1 1 81 81 ILE CA C 81 60.500 60.500 61.985 -1.485 25380
8929 1 19 . 1 1 81 81 ILE CB C 81 39.700 39.700 35.764 3.937 25380
8930 1 19 . 1 1 81 81 ILE H H 81 8.909 8.909 8.633 0.276 25380
8931 1 20 . 1 1 2 2 HIS N N 2 120.430 120.430 125.945 -5.515 25380
8932 1 20 . 1 1 2 2 HIS HA H 2 4.735 4.735 5.008 -0.273 25380
8933 1 20 . 1 1 2 2 HIS C C 2 173.884 173.884 174.408 -0.524 25380
8934 1 20 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.648 -1.595 25380
8935 1 20 . 1 1 2 2 HIS CB C 2 28.666 28.666 30.732 -2.066 25380
8936 1 20 . 1 1 2 2 HIS H H 2 8.678 8.678 8.677 0.001 25380
8937 1 20 . 1 1 3 3 MET N N 3 122.377 122.377 123.861 -1.484 25380
8938 1 20 . 1 1 3 3 MET HA H 3 4.207 4.207 4.620 -0.413 25380
8939 1 20 . 1 1 3 3 MET C C 3 174.584 174.584 175.205 -0.621 25380
8940 1 20 . 1 1 3 3 MET CA C 3 56.550 56.550 54.999 1.551 25380
8941 1 20 . 1 1 3 3 MET CB C 3 33.426 33.426 34.077 -0.651 25380
8942 1 20 . 1 1 3 3 MET H H 3 8.240 8.240 8.312 -0.072 25380
8943 1 20 . 1 1 4 4 LYS N N 4 123.568 123.568 117.917 5.651 25380
8944 1 20 . 1 1 4 4 LYS HA H 4 4.839 4.839 3.804 1.036 25380
8945 1 20 . 1 1 4 4 LYS C C 4 175.906 175.906 174.469 1.437 25380
8946 1 20 . 1 1 4 4 LYS CA C 4 54.800 54.800 56.781 -1.981 25380
8947 1 20 . 1 1 4 4 LYS CB C 4 34.900 34.900 29.509 5.391 25380
8948 1 20 . 1 1 4 4 LYS H H 4 8.351 8.351 7.125 1.226 25380
8949 1 20 . 1 1 5 5 LEU N N 5 123.568 123.568 112.577 10.991 25380
8950 1 20 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.591 -0.752 25380
8951 1 20 . 1 1 5 5 LEU C C 5 175.900 175.900 175.855 0.045 25380
8952 1 20 . 1 1 5 5 LEU CA C 5 53.350 53.350 52.227 1.123 25380
8953 1 20 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.915 -0.015 25380
8954 1 20 . 1 1 5 5 LEU H H 5 8.281 8.281 7.342 0.939 25380
8955 1 20 . 1 1 6 6 VAL N N 6 121.564 121.564 120.734 0.830 25380
8956 1 20 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.235 0.191 25380
8957 1 20 . 1 1 6 6 VAL C C 6 178.200 178.200 174.853 3.347 25380
8958 1 20 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.546 2.654 25380
8959 1 20 . 1 1 6 6 VAL CB C 6 33.200 33.200 33.057 0.143 25380
8960 1 20 . 1 1 6 6 VAL H H 6 9.276 9.276 8.543 0.733 25380
8961 1 20 . 1 1 7 7 LEU N N 7 121.564 121.564 127.598 -6.034 25380
8962 1 20 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.228 -0.802 25380
8963 1 20 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.230 9.970 25380
8964 1 20 . 1 1 7 7 LEU CB C 7 33.200 33.200 44.236 -11.036 25380
8965 1 20 . 1 1 7 7 LEU H H 7 9.276 9.276 8.572 0.704 25380
8966 1 20 . 1 1 8 8 ALA C C 8 177.040 177.040 178.141 -1.101 25380
8967 1 20 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.727 -1.026 25380
8968 1 20 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.770 1.094 25380
8969 1 20 . 1 1 9 9 LYS N N 9 119.845 119.845 125.023 -5.178 25380
8970 1 20 . 1 1 9 9 LYS HA H 9 4.128 4.128 3.919 0.209 25380
8971 1 20 . 1 1 9 9 LYS C C 9 176.075 176.075 178.399 -2.324 25380
8972 1 20 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.757 -2.995 25380
8973 1 20 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.603 0.315 25380
8974 1 20 . 1 1 9 9 LYS H H 9 8.545 8.545 8.669 -0.124 25380
8975 1 20 . 1 1 10 10 ASN N N 10 119.279 119.279 117.587 1.692 25380
8976 1 20 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.542 0.103 25380
8977 1 20 . 1 1 10 10 ASN C C 10 175.443 175.443 177.707 -2.264 25380
8978 1 20 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.800 -2.143 25380
8979 1 20 . 1 1 10 10 ASN CB C 10 38.777 38.777 37.847 0.930 25380
8980 1 20 . 1 1 10 10 ASN H H 10 8.592 8.592 8.739 -0.147 25380
8981 1 20 . 1 1 11 11 THR N N 11 111.876 111.876 114.446 -2.570 25380
8982 1 20 . 1 1 11 11 THR HA H 11 4.311 4.311 4.127 0.184 25380
8983 1 20 . 1 1 11 11 THR C C 11 174.666 174.666 174.968 -0.302 25380
8984 1 20 . 1 1 11 11 THR CA C 11 62.044 62.044 65.482 -3.438 25380
8985 1 20 . 1 1 11 11 THR CB C 11 69.895 69.895 68.996 0.899 25380
8986 1 20 . 1 1 11 11 THR H H 11 8.058 8.058 8.319 -0.261 25380
8987 1 20 . 1 1 12 12 ARG N N 12 121.152 121.152 119.035 2.117 25380
8988 1 20 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.364 -0.102 25380
8989 1 20 . 1 1 12 12 ARG C C 12 176.714 176.714 175.991 0.723 25380
8990 1 20 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.210 0.612 25380
8991 1 20 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.537 -0.835 25380
8992 1 20 . 1 1 12 12 ARG H H 12 8.291 8.291 7.709 0.582 25380
8993 1 20 . 1 1 13 13 LYS N N 13 120.459 120.459 119.319 1.140 25380
8994 1 20 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.072 -0.176 25380
8995 1 20 . 1 1 13 13 LYS C C 13 176.682 176.682 176.226 0.456 25380
8996 1 20 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.271 -0.293 25380
8997 1 20 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.529 1.969 25380
8998 1 20 . 1 1 13 13 LYS H H 13 8.286 8.286 8.567 -0.281 25380
8999 1 20 . 1 1 14 14 SER N N 14 114.568 114.568 115.502 -0.934 25380
9000 1 20 . 1 1 14 14 SER HA H 14 4.371 4.371 4.362 0.009 25380
9001 1 20 . 1 1 14 14 SER C C 14 173.990 173.990 175.039 -1.049 25380
9002 1 20 . 1 1 14 14 SER CA C 14 58.617 58.617 59.275 -0.658 25380
9003 1 20 . 1 1 14 14 SER CB C 14 63.933 63.933 63.586 0.347 25380
9004 1 20 . 1 1 14 14 SER H H 14 7.957 7.957 8.280 -0.323 25380
9005 1 20 . 1 1 15 15 ASP N N 15 121.565 121.565 119.945 1.620 25380
9006 1 20 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.736 -0.135 25380
9007 1 20 . 1 1 15 15 ASP C C 15 175.684 175.684 176.997 -1.313 25380
9008 1 20 . 1 1 15 15 ASP CA C 15 54.149 54.149 53.868 0.281 25380
9009 1 20 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.012 1.217 25380
9010 1 20 . 1 1 15 15 ASP H H 15 8.166 8.166 8.442 -0.276 25380
9011 1 20 . 1 1 16 16 ALA N N 16 124.173 124.173 123.276 0.897 25380
9012 1 20 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.033 0.338 25380
9013 1 20 . 1 1 16 16 ALA C C 16 177.184 177.184 177.636 -0.452 25380
9014 1 20 . 1 1 16 16 ALA CA C 16 52.337 52.337 54.263 -1.926 25380
9015 1 20 . 1 1 16 16 ALA CB C 16 19.359 19.359 18.715 0.644 25380
9016 1 20 . 1 1 16 16 ALA H H 16 8.163 8.163 8.239 -0.076 25380
9017 1 20 . 1 1 17 17 LYS N N 17 121.152 121.152 119.295 1.857 25380
9018 1 20 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.268 0.158 25380
9019 1 20 . 1 1 17 17 LYS C C 17 175.488 175.488 175.903 -0.415 25380
9020 1 20 . 1 1 17 17 LYS CA C 17 56.205 56.205 56.399 -0.194 25380
9021 1 20 . 1 1 17 17 LYS CB C 17 34.296 34.296 30.879 3.417 25380
9022 1 20 . 1 1 17 17 LYS H H 17 8.363 8.363 8.520 -0.157 25380
9023 1 20 . 1 1 18 18 SER N N 18 116.448 116.448 116.399 0.049 25380
9024 1 20 . 1 1 18 18 SER HA H 18 5.355 5.355 4.537 0.818 25380
9025 1 20 . 1 1 18 18 SER C C 18 173.887 173.887 175.780 -1.893 25380
9026 1 20 . 1 1 18 18 SER CA C 18 57.248 57.248 58.957 -1.709 25380
9027 1 20 . 1 1 18 18 SER CB C 18 64.962 64.962 64.863 0.099 25380
9028 1 20 . 1 1 18 18 SER H H 18 8.206 8.206 8.598 -0.392 25380
9029 1 20 . 1 1 19 19 VAL N N 19 117.867 117.867 122.948 -5.081 25380
9030 1 20 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.696 -0.076 25380
9031 1 20 . 1 1 19 19 VAL C C 19 174.169 174.169 177.566 -3.397 25380
9032 1 20 . 1 1 19 19 VAL CA C 19 59.546 59.546 65.634 -6.088 25380
9033 1 20 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.077 4.825 25380
9034 1 20 . 1 1 19 19 VAL H H 19 9.086 9.086 7.706 1.380 25380
9035 1 20 . 1 1 20 20 GLU N N 20 120.843 120.843 119.998 0.845 25380
9036 1 20 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.199 0.669 25380
9037 1 20 . 1 1 20 20 GLU C C 20 178.747 178.747 179.100 -0.353 25380
9038 1 20 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.450 -4.898 25380
9039 1 20 . 1 1 20 20 GLU CB C 20 31.099 31.099 29.015 2.084 25380
9040 1 20 . 1 1 20 20 GLU H H 20 8.841 8.841 8.584 0.257 25380
9041 1 20 . 1 1 21 21 LEU N N 21 122.653 122.653 120.732 1.921 25380
9042 1 20 . 1 1 21 21 LEU HA H 21 3.443 3.443 3.934 -0.491 25380
9043 1 20 . 1 1 21 21 LEU C C 21 178.799 178.799 179.120 -0.321 25380
9044 1 20 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.737 0.970 25380
9045 1 20 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.619 -3.048 25380
9046 1 20 . 1 1 21 21 LEU H H 21 8.744 8.744 7.568 1.176 25380
9047 1 20 . 1 1 22 22 GLU N N 22 115.392 115.392 119.362 -3.970 25380
9048 1 20 . 1 1 22 22 GLU HA H 22 3.989 3.989 3.669 0.320 25380
9049 1 20 . 1 1 22 22 GLU C C 22 179.328 179.328 178.326 1.002 25380
9050 1 20 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.208 0.872 25380
9051 1 20 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.386 -0.552 25380
9052 1 20 . 1 1 22 22 GLU H H 22 8.744 8.744 7.650 1.094 25380
9053 1 20 . 1 1 23 23 ASP N N 23 118.597 118.597 120.851 -2.254 25380
9054 1 20 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.541 0.070 25380
9055 1 20 . 1 1 23 23 ASP C C 23 179.139 179.139 179.041 0.098 25380
9056 1 20 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.334 0.185 25380
9057 1 20 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.620 -0.178 25380
9058 1 20 . 1 1 23 23 ASP H H 23 7.098 7.098 8.347 -1.249 25380
9059 1 20 . 1 1 24 24 LEU N N 24 119.869 119.869 120.813 -0.944 25380
9060 1 20 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.849 0.085 25380
9061 1 20 . 1 1 24 24 LEU C C 24 179.045 179.045 179.016 0.029 25380
9062 1 20 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.348 -0.799 25380
9063 1 20 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.720 -0.170 25380
9064 1 20 . 1 1 24 24 LEU H H 24 7.576 7.576 8.577 -1.001 25380
9065 1 20 . 1 1 25 25 TYR N N 25 118.100 118.100 119.289 -1.189 25380
9066 1 20 . 1 1 25 25 TYR HA H 25 4.367 4.367 4.558 -0.191 25380
9067 1 20 . 1 1 25 25 TYR C C 25 177.945 177.945 178.046 -0.101 25380
9068 1 20 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.956 0.650 25380
9069 1 20 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.669 -0.721 25380
9070 1 20 . 1 1 25 25 TYR H H 25 8.320 8.320 7.463 0.857 25380
9071 1 20 . 1 1 26 26 HIS N N 26 119.440 119.440 118.615 0.825 25380
9072 1 20 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.343 0.028 25380
9073 1 20 . 1 1 26 26 HIS C C 26 176.559 176.559 178.154 -1.595 25380
9074 1 20 . 1 1 26 26 HIS CA C 26 59.519 59.519 58.593 0.927 25380
9075 1 20 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.314 -2.186 25380
9076 1 20 . 1 1 26 26 HIS H H 26 8.383 8.383 8.520 -0.137 25380
9077 1 20 . 1 1 27 27 GLU N N 27 119.915 119.915 120.607 -0.692 25380
9078 1 20 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.270 -0.012 25380
9079 1 20 . 1 1 27 27 GLU C C 27 179.163 179.163 178.899 0.264 25380
9080 1 20 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.228 0.847 25380
9081 1 20 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.998 -0.463 25380
9082 1 20 . 1 1 27 27 GLU H H 27 8.288 8.288 8.967 -0.679 25380
9083 1 20 . 1 1 28 28 PHE N N 28 120.500 120.500 120.292 0.208 25380
9084 1 20 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.843 0.129 25380
9085 1 20 . 1 1 28 28 PHE C C 28 177.386 177.386 177.130 0.256 25380
9086 1 20 . 1 1 28 28 PHE CA C 28 60.401 60.401 59.852 0.549 25380
9087 1 20 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.089 0.479 25380
9088 1 20 . 1 1 28 28 PHE H H 28 8.568 8.568 8.361 0.207 25380
9089 1 20 . 1 1 29 29 SER N N 29 114.306 114.306 114.863 -0.557 25380
9090 1 20 . 1 1 29 29 SER HA H 29 4.288 4.288 3.485 0.803 25380
9091 1 20 . 1 1 29 29 SER C C 29 175.656 175.656 176.355 -0.699 25380
9092 1 20 . 1 1 29 29 SER CA C 29 61.058 61.058 59.950 1.108 25380
9093 1 20 . 1 1 29 29 SER CB C 29 63.555 63.555 62.912 0.643 25380
9094 1 20 . 1 1 29 29 SER H H 29 8.479 8.479 7.174 1.305 25380
9095 1 20 . 1 1 30 30 GLU N N 30 118.322 118.322 120.249 -1.927 25380
9096 1 20 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.199 -0.107 25380
9097 1 20 . 1 1 30 30 GLU C C 30 177.312 177.312 176.696 0.616 25380
9098 1 20 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.615 -0.035 25380
9099 1 20 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.577 -1.000 25380
9100 1 20 . 1 1 30 30 GLU H H 30 8.428 8.428 8.043 0.385 25380
9101 1 20 . 1 1 31 31 ASP N N 31 115.630 115.630 116.644 -1.014 25380
9102 1 20 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.915 -0.105 25380
9103 1 20 . 1 1 31 31 ASP C C 31 175.723 175.723 173.988 1.735 25380
9104 1 20 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.844 1.130 25380
9105 1 20 . 1 1 31 31 ASP CB C 31 40.818 40.818 43.176 -2.358 25380
9106 1 20 . 1 1 31 31 ASP H H 31 7.303 7.303 8.013 -0.710 25380
9107 1 20 . 1 1 32 32 LYS N N 32 114.357 114.357 118.313 -3.956 25380
9108 1 20 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.573 -0.746 25380
9109 1 20 . 1 1 32 32 LYS C C 32 175.716 175.716 175.716 0.000 25380
9110 1 20 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.554 0.608 25380
9111 1 20 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.945 -5.564 25380
9112 1 20 . 1 1 32 32 LYS H H 32 7.148 7.148 8.442 -1.294 25380
9113 1 20 . 1 1 33 33 ARG N N 33 120.929 120.929 122.763 -1.834 25380
9114 1 20 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.641 -0.440 25380
9115 1 20 . 1 1 33 33 ARG C C 33 173.982 173.982 173.753 0.229 25380
9116 1 20 . 1 1 33 33 ARG CA C 33 56.194 56.194 54.852 1.342 25380
9117 1 20 . 1 1 33 33 ARG CB C 33 30.642 30.642 35.259 -4.617 25380
9118 1 20 . 1 1 33 33 ARG H H 33 7.388 7.388 9.020 -1.632 25380
9119 1 20 . 1 1 34 34 SER N N 34 115.867 115.867 113.300 2.567 25380
9120 1 20 . 1 1 34 34 SER HA H 34 5.355 5.355 4.840 0.515 25380
9121 1 20 . 1 1 34 34 SER C C 34 172.754 172.754 172.634 0.120 25380
9122 1 20 . 1 1 34 34 SER CA C 34 58.236 58.236 57.106 1.130 25380
9123 1 20 . 1 1 34 34 SER CB C 34 65.212 65.212 65.945 -0.733 25380
9124 1 20 . 1 1 34 34 SER H H 34 8.173 8.173 8.327 -0.154 25380
9125 1 20 . 1 1 35 35 ILE N N 35 119.621 119.621 113.357 6.264 25380
9126 1 20 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.871 -0.008 25380
9127 1 20 . 1 1 35 35 ILE C C 35 174.069 174.069 173.196 0.873 25380
9128 1 20 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.369 0.587 25380
9129 1 20 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.553 -0.898 25380
9130 1 20 . 1 1 35 35 ILE H H 35 6.779 6.779 8.535 -1.756 25380
9131 1 20 . 1 1 36 36 PHE N N 36 124.305 124.305 118.517 5.788 25380
9132 1 20 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.643 -1.190 25380
9133 1 20 . 1 1 36 36 PHE C C 36 173.204 173.204 175.235 -2.031 25380
9134 1 20 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.224 0.192 25380
9135 1 20 . 1 1 36 36 PHE CB C 36 44.817 44.817 42.715 2.102 25380
9136 1 20 . 1 1 36 36 PHE H H 36 8.411 8.411 8.528 -0.117 25380
9137 1 20 . 1 1 37 37 TYR N N 37 118.743 118.743 122.817 -4.074 25380
9138 1 20 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.186 0.384 25380
9139 1 20 . 1 1 37 37 TYR C C 37 175.455 175.455 174.985 0.470 25380
9140 1 20 . 1 1 37 37 TYR CA C 37 56.518 56.518 56.626 -0.108 25380
9141 1 20 . 1 1 37 37 TYR CB C 37 40.991 40.991 40.323 0.668 25380
9142 1 20 . 1 1 37 37 TYR H H 37 8.353 8.353 9.717 -1.364 25380
9143 1 20 . 1 1 38 38 PHE N N 38 119.236 119.236 126.105 -6.869 25380
9144 1 20 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.930 0.230 25380
9145 1 20 . 1 1 38 38 PHE C C 38 174.650 174.650 173.404 1.246 25380
9146 1 20 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.442 1.400 25380
9147 1 20 . 1 1 38 38 PHE CB C 38 42.619 42.619 40.521 2.098 25380
9148 1 20 . 1 1 38 38 PHE H H 38 9.756 9.756 9.214 0.542 25380
9149 1 20 . 1 1 39 39 ALA N N 39 122.516 122.516 129.667 -7.151 25380
9150 1 20 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.734 -0.194 25380
9151 1 20 . 1 1 39 39 ALA C C 39 177.042 177.042 174.035 3.007 25380
9152 1 20 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.311 1.532 25380
9153 1 20 . 1 1 39 39 ALA CB C 39 18.578 18.578 22.109 -3.531 25380
9154 1 20 . 1 1 39 39 ALA H H 39 7.738 7.738 8.587 -0.849 25380
9155 1 20 . 1 1 40 40 PRO C C 40 175.411 175.411 177.010 -1.599 25380
9156 1 20 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.810 1.478 25380
9157 1 20 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.365 -1.261 25380
9158 1 20 . 1 1 41 41 THR N N 41 105.878 105.878 117.994 -12.116 25380
9159 1 20 . 1 1 41 41 THR HA H 41 4.190 4.190 3.683 0.507 25380
9160 1 20 . 1 1 41 41 THR C C 41 176.400 176.400 175.433 0.967 25380
9161 1 20 . 1 1 41 41 THR CA C 41 61.937 61.937 64.708 -2.771 25380
9162 1 20 . 1 1 41 41 THR CB C 41 68.331 68.331 68.653 -0.322 25380
9163 1 20 . 1 1 41 41 THR H H 41 6.715 6.715 8.192 -1.477 25380
9164 1 20 . 1 1 42 42 ASN N N 42 118.863 118.863 118.207 0.656 25380
9165 1 20 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.446 0.089 25380
9166 1 20 . 1 1 42 42 ASN C C 42 173.764 173.764 176.147 -2.383 25380
9167 1 20 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.874 -1.698 25380
9168 1 20 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.560 4.155 25380
9169 1 20 . 1 1 42 42 ASN H H 42 7.153 7.153 8.391 -1.238 25380
9170 1 20 . 1 1 43 43 ALA N N 43 126.174 126.174 120.289 5.885 25380
9171 1 20 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.348 0.077 25380
9172 1 20 . 1 1 43 43 ALA C C 43 179.308 179.308 176.862 2.446 25380
9173 1 20 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.467 -0.485 25380
9174 1 20 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.390 -1.096 25380
9175 1 20 . 1 1 43 43 ALA H H 43 9.465 9.465 7.904 1.561 25380
9176 1 20 . 1 1 44 44 HIS N N 44 126.251 126.251 115.278 10.973 25380
9177 1 20 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.257 -0.430 25380
9178 1 20 . 1 1 44 44 HIS C C 44 177.407 177.407 174.930 2.477 25380
9179 1 20 . 1 1 44 44 HIS CA C 44 61.025 61.025 56.958 4.067 25380
9180 1 20 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.314 1.316 25380
9181 1 20 . 1 1 44 44 HIS H H 44 9.407 9.407 8.025 1.382 25380
9182 1 20 . 1 1 45 45 LYS N N 45 114.990 114.990 119.305 -4.315 25380
9183 1 20 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.231 -0.348 25380
9184 1 20 . 1 1 45 45 LYS C C 45 178.284 178.284 176.977 1.307 25380
9185 1 20 . 1 1 45 45 LYS CA C 45 59.249 59.249 57.859 1.389 25380
9186 1 20 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.997 -1.163 25380
9187 1 20 . 1 1 45 45 LYS H H 45 8.960 8.960 7.924 1.036 25380
9188 1 20 . 1 1 46 46 ASP N N 46 120.411 120.411 119.842 0.569 25380
9189 1 20 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.437 -0.011 25380
9190 1 20 . 1 1 46 46 ASP C C 46 177.773 177.773 178.189 -0.416 25380
9191 1 20 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.436 -0.420 25380
9192 1 20 . 1 1 46 46 ASP CB C 46 39.897 39.897 39.602 0.295 25380
9193 1 20 . 1 1 46 46 ASP H H 46 6.777 6.777 8.365 -1.588 25380
9194 1 20 . 1 1 47 47 MET N N 47 118.178 118.178 118.847 -0.669 25380
9195 1 20 . 1 1 47 47 MET HA H 47 3.879 3.879 4.226 -0.347 25380
9196 1 20 . 1 1 47 47 MET C C 47 179.499 179.499 177.824 1.675 25380
9197 1 20 . 1 1 47 47 MET CA C 47 56.052 56.052 59.051 -2.999 25380
9198 1 20 . 1 1 47 47 MET CB C 47 29.601 29.601 32.706 -3.105 25380
9199 1 20 . 1 1 47 47 MET H H 47 7.367 7.367 7.814 -0.447 25380
9200 1 20 . 1 1 48 48 LEU N N 48 117.665 117.665 119.144 -1.479 25380
9201 1 20 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.905 -0.058 25380
9202 1 20 . 1 1 48 48 LEU C C 48 179.843 179.843 178.279 1.564 25380
9203 1 20 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.735 -0.155 25380
9204 1 20 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.538 -0.585 25380
9205 1 20 . 1 1 48 48 LEU H H 48 7.672 7.672 7.746 -0.074 25380
9206 1 20 . 1 1 49 49 LYS N N 49 119.326 119.326 118.385 0.941 25380
9207 1 20 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.477 0.650 25380
9208 1 20 . 1 1 49 49 LYS C C 49 179.684 179.684 178.234 1.450 25380
9209 1 20 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.089 -0.290 25380
9210 1 20 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.813 -0.360 25380
9211 1 20 . 1 1 49 49 LYS H H 49 7.420 7.420 7.456 -0.036 25380
9212 1 20 . 1 1 50 50 ALA N N 50 122.022 122.022 122.679 -0.657 25380
9213 1 20 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.665 0.378 25380
9214 1 20 . 1 1 50 50 ALA C C 50 178.818 178.818 178.627 0.191 25380
9215 1 20 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.663 0.506 25380
9216 1 20 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.893 -0.593 25380
9217 1 20 . 1 1 50 50 ALA H H 50 7.551 7.551 7.490 0.061 25380
9218 1 20 . 1 1 51 51 VAL N N 51 118.165 118.165 117.639 0.526 25380
9219 1 20 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.476 -0.034 25380
9220 1 20 . 1 1 51 51 VAL C C 51 178.646 178.646 178.087 0.559 25380
9221 1 20 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.234 0.972 25380
9222 1 20 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.776 0.677 25380
9223 1 20 . 1 1 51 51 VAL H H 51 7.226 7.226 7.254 -0.028 25380
9224 1 20 . 1 1 52 52 ASP N N 52 122.298 122.298 120.376 1.922 25380
9225 1 20 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.298 0.073 25380
9226 1 20 . 1 1 52 52 ASP C C 52 177.898 177.898 179.003 -1.105 25380
9227 1 20 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.022 0.549 25380
9228 1 20 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.146 0.240 25380
9229 1 20 . 1 1 52 52 ASP H H 52 8.232 8.232 7.253 0.979 25380
9230 1 20 . 1 1 53 53 PHE N N 53 121.541 121.541 119.685 1.856 25380
9231 1 20 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.217 0.104 25380
9232 1 20 . 1 1 53 53 PHE C C 53 177.224 177.224 178.046 -0.822 25380
9233 1 20 . 1 1 53 53 PHE CA C 53 61.080 61.080 59.179 1.901 25380
9234 1 20 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.913 1.786 25380
9235 1 20 . 1 1 53 53 PHE H H 53 8.240 8.240 7.687 0.553 25380
9236 1 20 . 1 1 54 54 PHE N N 54 115.925 115.925 116.976 -1.051 25380
9237 1 20 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.173 -0.518 25380
9238 1 20 . 1 1 54 54 PHE C C 54 178.269 178.269 177.442 0.827 25380
9239 1 20 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.845 4.355 25380
9240 1 20 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.707 0.871 25380
9241 1 20 . 1 1 54 54 PHE H H 54 7.755 7.755 7.779 -0.024 25380
9242 1 20 . 1 1 55 55 LYS N N 55 120.251 120.251 117.748 2.503 25380
9243 1 20 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.088 0.338 25380
9244 1 20 . 1 1 55 55 LYS C C 55 181.484 181.484 178.472 3.012 25380
9245 1 20 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.826 0.803 25380
9246 1 20 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.392 -0.653 25380
9247 1 20 . 1 1 55 55 LYS H H 55 8.213 8.213 7.435 0.778 25380
9248 1 20 . 1 1 56 56 GLU N N 56 120.146 120.146 117.881 2.265 25380
9249 1 20 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.174 -0.181 25380
9250 1 20 . 1 1 56 56 GLU C C 56 178.085 178.085 177.534 0.551 25380
9251 1 20 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.546 0.242 25380
9252 1 20 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.279 -1.683 25380
9253 1 20 . 1 1 56 56 GLU H H 56 7.850 7.850 7.920 -0.070 25380
9254 1 20 . 1 1 57 57 LYS N N 57 115.940 115.940 118.302 -2.362 25380
9255 1 20 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.667 -0.564 25380
9256 1 20 . 1 1 57 57 LYS C C 57 176.225 176.225 177.682 -1.457 25380
9257 1 20 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.127 -0.555 25380
9258 1 20 . 1 1 57 57 LYS CB C 57 32.036 32.036 34.111 -2.075 25380
9259 1 20 . 1 1 57 57 LYS H H 57 7.019 7.019 8.034 -1.015 25380
9260 1 20 . 1 1 58 58 GLY N N 58 106.593 106.593 111.146 -4.553 25380
9261 1 20 . 1 1 58 58 GLY C C 58 174.350 174.350 175.247 -0.897 25380
9262 1 20 . 1 1 58 58 GLY CA C 58 45.500 45.500 46.043 -0.543 25380
9263 1 20 . 1 1 58 58 GLY H H 58 7.883 7.883 9.090 -1.207 25380
9264 1 20 . 1 1 59 59 HIS N N 59 117.962 117.962 120.053 -2.091 25380
9265 1 20 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.492 0.375 25380
9266 1 20 . 1 1 59 59 HIS C C 59 173.271 173.271 174.592 -1.321 25380
9267 1 20 . 1 1 59 59 HIS CA C 59 54.778 54.778 55.654 -0.876 25380
9268 1 20 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.041 2.644 25380
9269 1 20 . 1 1 59 59 HIS H H 59 8.218 8.218 7.787 0.431 25380
9270 1 20 . 1 1 60 60 THR N N 60 119.624 119.624 108.983 10.641 25380
9271 1 20 . 1 1 60 60 THR HA H 60 4.430 4.430 4.382 0.048 25380
9272 1 20 . 1 1 60 60 THR C C 60 171.430 171.430 173.593 -2.163 25380
9273 1 20 . 1 1 60 60 THR CA C 60 63.480 63.480 60.096 3.384 25380
9274 1 20 . 1 1 60 60 THR CB C 60 69.761 69.761 71.045 -1.284 25380
9275 1 20 . 1 1 60 60 THR H H 60 8.780 8.780 7.251 1.529 25380
9276 1 20 . 1 1 61 61 ALA N N 61 126.706 126.706 122.075 4.631 25380
9277 1 20 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.232 1.014 25380
9278 1 20 . 1 1 61 61 ALA C C 61 174.753 174.753 175.496 -0.743 25380
9279 1 20 . 1 1 61 61 ALA CA C 61 49.772 49.772 52.383 -2.611 25380
9280 1 20 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.748 2.141 25380
9281 1 20 . 1 1 61 61 ALA H H 61 7.795 7.795 8.112 -0.317 25380
9282 1 20 . 1 1 62 62 TYR N N 62 117.859 117.859 116.948 0.911 25380
9283 1 20 . 1 1 62 62 TYR C C 62 173.431 173.431 173.830 -0.399 25380
9284 1 20 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.255 -0.608 25380
9285 1 20 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.523 -1.974 25380
9286 1 20 . 1 1 62 62 TYR H H 62 8.711 8.711 8.120 0.591 25380
9287 1 20 . 1 1 63 63 LEU N N 63 125.044 125.044 123.196 1.848 25380
9288 1 20 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.756 0.655 25380
9289 1 20 . 1 1 63 63 LEU C C 63 175.319 175.319 174.935 0.384 25380
9290 1 20 . 1 1 63 63 LEU CA C 63 53.230 53.230 54.057 -0.827 25380
9291 1 20 . 1 1 63 63 LEU CB C 63 45.701 45.701 44.442 1.259 25380
9292 1 20 . 1 1 63 63 LEU H H 63 8.746 8.746 8.384 0.362 25380
9293 1 20 . 1 1 64 64 ASP N N 64 125.463 125.463 126.000 -0.537 25380
9294 1 20 . 1 1 64 64 ASP HA H 64 5.199 5.199 5.025 0.174 25380
9295 1 20 . 1 1 64 64 ASP C C 64 174.512 174.512 174.596 -0.084 25380
9296 1 20 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.387 0.313 25380
9297 1 20 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.310 -0.356 25380
9298 1 20 . 1 1 64 64 ASP H H 64 9.293 9.293 9.028 0.265 25380
9299 1 20 . 1 1 65 65 GLU N N 65 120.711 120.711 119.438 1.273 25380
9300 1 20 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.301 0.766 25380
9301 1 20 . 1 1 65 65 GLU C C 65 175.652 175.652 176.298 -0.646 25380
9302 1 20 . 1 1 65 65 GLU CA C 65 55.643 55.643 57.053 -1.410 25380
9303 1 20 . 1 1 65 65 GLU CB C 65 30.455 30.455 30.538 -0.083 25380
9304 1 20 . 1 1 65 65 GLU H H 65 8.715 8.715 8.523 0.192 25380
9305 1 20 . 1 1 66 66 VAL N N 66 122.936 122.936 120.560 2.376 25380
9306 1 20 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.090 0.340 25380
9307 1 20 . 1 1 66 66 VAL C C 66 175.065 175.065 175.865 -0.800 25380
9308 1 20 . 1 1 66 66 VAL CA C 66 60.991 60.991 61.638 -0.647 25380
9309 1 20 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.691 1.589 25380
9310 1 20 . 1 1 66 66 VAL H H 66 9.156 9.156 8.426 0.730 25380
9311 1 20 . 1 1 67 67 ARG N N 67 126.104 126.104 126.688 -0.584 25380
9312 1 20 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.414 0.127 25380
9313 1 20 . 1 1 67 67 ARG C C 67 176.708 176.708 175.817 0.891 25380
9314 1 20 . 1 1 67 67 ARG CA C 67 56.080 56.080 55.614 0.466 25380
9315 1 20 . 1 1 67 67 ARG CB C 67 30.908 30.908 28.684 2.224 25380
9316 1 20 . 1 1 67 67 ARG H H 67 8.734 8.734 8.691 0.043 25380
9317 1 20 . 1 1 68 68 VAL N N 68 120.707 120.707 113.661 7.046 25380
9318 1 20 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.541 -0.389 25380
9319 1 20 . 1 1 68 68 VAL C C 68 175.931 175.931 175.171 0.760 25380
9320 1 20 . 1 1 68 68 VAL CA C 68 62.776 62.776 61.458 1.318 25380
9321 1 20 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.880 0.609 25380
9322 1 20 . 1 1 68 68 VAL H H 68 8.384 8.384 7.972 0.412 25380
9323 1 20 . 1 1 69 69 SER N N 69 116.156 116.156 115.546 0.610 25380
9324 1 20 . 1 1 69 69 SER HA H 69 4.693 4.693 4.898 -0.205 25380
9325 1 20 . 1 1 69 69 SER C C 69 174.544 174.544 175.489 -0.945 25380
9326 1 20 . 1 1 69 69 SER CA C 69 57.754 57.754 57.999 -0.245 25380
9327 1 20 . 1 1 69 69 SER CB C 69 64.831 64.831 63.464 1.367 25380
9328 1 20 . 1 1 69 69 SER H H 69 8.067 8.067 8.164 -0.097 25380
9329 1 20 . 1 1 70 70 THR N N 70 110.753 110.753 114.123 -3.370 25380
9330 1 20 . 1 1 70 70 THR HA H 70 4.152 4.152 4.302 -0.150 25380
9331 1 20 . 1 1 70 70 THR C C 70 174.865 174.865 175.284 -0.419 25380
9332 1 20 . 1 1 70 70 THR CA C 70 63.831 63.831 64.067 -0.236 25380
9333 1 20 . 1 1 70 70 THR CB C 70 68.956 68.956 69.070 -0.114 25380
9334 1 20 . 1 1 70 70 THR H H 70 8.095 8.095 7.891 0.204 25380
9335 1 20 . 1 1 71 71 ASP N N 71 121.817 121.817 121.095 0.722 25380
9336 1 20 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.578 0.012 25380
9337 1 20 . 1 1 71 71 ASP C C 71 176.746 176.746 176.995 -0.249 25380
9338 1 20 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.204 -1.940 25380
9339 1 20 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.886 0.539 25380
9340 1 20 . 1 1 71 71 ASP H H 71 8.076 8.076 8.413 -0.337 25380
9341 1 20 . 1 1 72 72 GLU N N 72 123.635 123.635 115.313 8.322 25380
9342 1 20 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.499 -0.506 25380
9343 1 20 . 1 1 72 72 GLU C C 72 176.971 176.971 175.287 1.684 25380
9344 1 20 . 1 1 72 72 GLU CA C 72 58.219 58.219 55.955 2.264 25380
9345 1 20 . 1 1 72 72 GLU CB C 72 29.702 29.702 32.096 -2.394 25380
9346 1 20 . 1 1 72 72 GLU H H 72 8.514 8.514 8.268 0.246 25380
9347 1 20 . 1 1 73 73 LYS N N 73 117.857 117.857 117.763 0.094 25380
9348 1 20 . 1 1 73 73 LYS HA H 73 4.643 4.643 4.109 0.534 25380
9349 1 20 . 1 1 73 73 LYS C C 73 176.508 176.508 176.123 0.385 25380
9350 1 20 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.631 -0.551 25380
9351 1 20 . 1 1 73 73 LYS CB C 73 32.203 32.203 30.938 1.265 25380
9352 1 20 . 1 1 73 73 LYS H H 73 8.423 8.423 7.781 0.642 25380
9353 1 20 . 1 1 74 74 ASP N N 74 120.580 120.580 117.557 3.023 25380
9354 1 20 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.731 0.027 25380
9355 1 20 . 1 1 74 74 ASP C C 74 174.059 174.059 175.581 -1.522 25380
9356 1 20 . 1 1 74 74 ASP CA C 74 53.279 53.279 55.099 -1.820 25380
9357 1 20 . 1 1 74 74 ASP CB C 74 40.578 40.578 42.419 -1.841 25380
9358 1 20 . 1 1 74 74 ASP H H 74 7.918 7.918 8.526 -0.608 25380
9359 1 20 . 1 1 75 75 PHE N N 75 118.513 118.513 118.830 -0.317 25380
9360 1 20 . 1 1 75 75 PHE HA H 75 5.363 5.363 6.028 -0.665 25380
9361 1 20 . 1 1 75 75 PHE C C 75 173.038 173.038 174.930 -1.892 25380
9362 1 20 . 1 1 75 75 PHE CA C 75 55.522 55.522 56.943 -1.421 25380
9363 1 20 . 1 1 75 75 PHE CB C 75 41.714 41.714 42.577 -0.863 25380
9364 1 20 . 1 1 75 75 PHE H H 75 7.397 7.397 7.595 -0.198 25380
9365 1 20 . 1 1 76 76 LEU N N 76 116.773 116.773 123.179 -6.406 25380
9366 1 20 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.951 -0.308 25380
9367 1 20 . 1 1 76 76 LEU C C 76 177.553 177.553 175.437 2.116 25380
9368 1 20 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.015 -0.396 25380
9369 1 20 . 1 1 76 76 LEU CB C 76 45.701 45.701 44.094 1.607 25380
9370 1 20 . 1 1 76 76 LEU H H 76 8.774 8.774 9.317 -0.543 25380
9371 1 20 . 1 1 77 77 TYR N N 77 118.377 118.377 126.465 -8.088 25380
9372 1 20 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.749 0.666 25380
9373 1 20 . 1 1 77 77 TYR C C 77 175.479 175.479 173.308 2.171 25380
9374 1 20 . 1 1 77 77 TYR CA C 77 58.391 58.391 56.367 2.023 25380
9375 1 20 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.203 0.897 25380
9376 1 20 . 1 1 77 77 TYR H H 77 8.589 8.589 9.281 -0.692 25380
9377 1 20 . 1 1 78 78 GLU N N 78 123.875 123.875 129.667 -5.792 25380
9378 1 20 . 1 1 78 78 GLU HA H 78 4.973 4.973 5.100 -0.127 25380
9379 1 20 . 1 1 78 78 GLU C C 78 174.120 174.120 174.017 0.103 25380
9380 1 20 . 1 1 78 78 GLU CA C 78 54.378 54.378 54.370 0.008 25380
9381 1 20 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.587 -0.947 25380
9382 1 20 . 1 1 78 78 GLU H H 78 9.576 9.576 8.442 1.134 25380
9383 1 20 . 1 1 79 79 LEU N N 79 128.661 128.661 126.630 2.031 25380
9384 1 20 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.549 0.740 25380
9385 1 20 . 1 1 79 79 LEU C C 79 174.219 174.219 175.211 -0.992 25380
9386 1 20 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.723 -0.574 25380
9387 1 20 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.903 1.727 25380
9388 1 20 . 1 1 79 79 LEU H H 79 9.139 9.139 8.860 0.279 25380
9389 1 20 . 1 1 80 80 HIS N N 80 124.886 124.886 121.076 3.810 25380
9390 1 20 . 1 1 80 80 HIS HA H 80 5.430 5.430 5.019 0.411 25380
9391 1 20 . 1 1 80 80 HIS C C 80 173.346 173.346 176.543 -3.197 25380
9392 1 20 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.452 -1.303 25380
9393 1 20 . 1 1 80 80 HIS CB C 80 30.768 30.768 31.146 -0.378 25380
9394 1 20 . 1 1 80 80 HIS H H 80 8.897 8.897 8.819 0.078 25380
9395 1 20 . 1 1 81 81 ILE N N 81 125.173 125.173 122.803 2.370 25380
9396 1 20 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.569 0.721 25380
9397 1 20 . 1 1 81 81 ILE C C 81 174.600 174.600 176.054 -1.454 25380
9398 1 20 . 1 1 81 81 ILE CA C 81 60.500 60.500 64.822 -4.322 25380
9399 1 20 . 1 1 81 81 ILE CB C 81 39.700 39.700 37.712 1.988 25380
9400 1 20 . 1 1 81 81 ILE H H 81 8.909 8.909 9.166 -0.257 25380
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 78 4.355 -0.181 4.379 25380
2 1 1 "Average Difference" HA 78 0.458 -0.070 0.456 25380
3 1 1 "Average Difference" C 79 1.375 -0.010 1.383 25380
4 1 1 "Average Difference" CA 80 2.091 0.106 2.102 25380
5 1 1 "Average Difference" CB 79 2.279 -0.045 2.294 25380
6 1 1 "Average Difference" HN 78 0.769 0.023 0.774 25380
7 1 2 "Average Difference" N 78 4.256 0.063 4.283 25380
8 1 2 "Average Difference" HA 78 0.457 -0.098 0.449 25380
9 1 2 "Average Difference" C 79 1.449 0.109 1.454 25380
10 1 2 "Average Difference" CA 80 2.088 0.292 2.081 25380
11 1 2 "Average Difference" CB 79 2.117 -0.067 2.129 25380
12 1 2 "Average Difference" HN 78 0.812 -0.006 0.817 25380
13 1 3 "Average Difference" N 78 4.134 0.106 4.159 25380
14 1 3 "Average Difference" HA 78 0.482 -0.103 0.474 25380
15 1 3 "Average Difference" C 79 1.414 -0.083 1.421 25380
16 1 3 "Average Difference" CA 80 2.114 0.036 2.127 25380
17 1 3 "Average Difference" CB 79 2.215 0.043 2.229 25380
18 1 3 "Average Difference" HN 78 0.809 -0.019 0.814 25380
19 1 4 "Average Difference" N 78 3.988 0.159 4.010 25380
20 1 4 "Average Difference" HA 78 0.503 -0.125 0.491 25380
21 1 4 "Average Difference" C 79 1.475 0.141 1.477 25380
22 1 4 "Average Difference" CA 80 2.296 0.225 2.300 25380
23 1 4 "Average Difference" CB 79 2.138 0.016 2.152 25380
24 1 4 "Average Difference" HN 78 0.748 0.009 0.753 25380
25 1 5 "Average Difference" N 78 4.106 -0.083 4.131 25380
26 1 5 "Average Difference" HA 78 0.476 -0.073 0.474 25380
27 1 5 "Average Difference" C 79 1.407 0.080 1.414 25380
28 1 5 "Average Difference" CA 80 2.145 0.095 2.157 25380
29 1 5 "Average Difference" CB 79 2.248 -0.060 2.262 25380
30 1 5 "Average Difference" HN 78 0.777 0.025 0.782 25380
31 1 6 "Average Difference" N 78 4.104 0.031 4.131 25380
32 1 6 "Average Difference" HA 78 0.468 -0.094 0.461 25380
33 1 6 "Average Difference" C 79 1.466 0.134 1.469 25380
34 1 6 "Average Difference" CA 80 2.190 0.113 2.201 25380
35 1 6 "Average Difference" CB 79 2.119 0.005 2.133 25380
36 1 6 "Average Difference" HN 78 0.775 0.007 0.780 25380
37 1 7 "Average Difference" N 78 4.019 0.423 4.023 25380
38 1 7 "Average Difference" HA 78 0.459 -0.074 0.456 25380
39 1 7 "Average Difference" C 79 1.432 0.003 1.441 25380
40 1 7 "Average Difference" CA 80 2.164 0.115 2.175 25380
41 1 7 "Average Difference" CB 79 2.123 0.023 2.136 25380
42 1 7 "Average Difference" HN 78 0.769 0.014 0.773 25380
43 1 8 "Average Difference" N 78 3.945 -0.024 3.970 25380
44 1 8 "Average Difference" HA 78 0.454 -0.087 0.449 25380
45 1 8 "Average Difference" C 79 1.435 0.063 1.443 25380
46 1 8 "Average Difference" CA 80 2.147 0.149 2.156 25380
47 1 8 "Average Difference" CB 79 2.070 0.045 2.082 25380
48 1 8 "Average Difference" HN 78 0.777 0.006 0.782 25380
49 1 9 "Average Difference" N 78 3.906 -0.360 3.915 25380
50 1 9 "Average Difference" HA 78 0.426 -0.077 0.422 25380
51 1 9 "Average Difference" C 79 1.316 -0.051 1.323 25380
52 1 9 "Average Difference" CA 80 2.040 0.020 2.053 25380
53 1 9 "Average Difference" CB 79 2.259 0.055 2.273 25380
54 1 9 "Average Difference" HN 78 0.772 0.029 0.777 25380
55 1 10 "Average Difference" N 78 3.910 0.426 3.911 25380
56 1 10 "Average Difference" HA 78 0.456 -0.085 0.451 25380
57 1 10 "Average Difference" C 79 1.525 0.204 1.521 25380
58 1 10 "Average Difference" CA 80 2.151 0.167 2.158 25380
59 1 10 "Average Difference" CB 79 2.171 -0.032 2.184 25380
60 1 10 "Average Difference" HN 78 0.763 0.015 0.768 25380
61 1 11 "Average Difference" N 78 3.787 0.224 3.805 25380
62 1 11 "Average Difference" HA 78 0.475 -0.094 0.469 25380
63 1 11 "Average Difference" C 79 1.472 0.004 1.481 25380
64 1 11 "Average Difference" CA 80 2.133 0.116 2.143 25380
65 1 11 "Average Difference" CB 79 2.217 0.058 2.231 25380
66 1 11 "Average Difference" HN 78 0.774 0.020 0.778 25380
67 1 12 "Average Difference" N 78 4.111 0.102 4.136 25380
68 1 12 "Average Difference" HA 78 0.441 -0.078 0.436 25380
69 1 12 "Average Difference" C 79 1.454 0.029 1.463 25380
70 1 12 "Average Difference" CA 80 2.269 0.226 2.272 25380
71 1 12 "Average Difference" CB 79 2.196 0.019 2.210 25380
72 1 12 "Average Difference" HN 78 0.788 0.011 0.793 25380
73 1 13 "Average Difference" N 78 4.329 -0.093 4.356 25380
74 1 13 "Average Difference" HA 78 0.479 -0.087 0.474 25380
75 1 13 "Average Difference" C 79 1.370 0.078 1.377 25380
76 1 13 "Average Difference" CA 80 2.087 0.142 2.095 25380
77 1 13 "Average Difference" CB 79 2.282 -0.020 2.297 25380
78 1 13 "Average Difference" HN 78 0.840 0.007 0.846 25380
79 1 14 "Average Difference" N 78 3.861 -0.210 3.881 25380
80 1 14 "Average Difference" HA 78 0.471 -0.081 0.467 25380
81 1 14 "Average Difference" C 79 1.484 0.147 1.486 25380
82 1 14 "Average Difference" CA 80 2.201 0.153 2.209 25380
83 1 14 "Average Difference" CB 79 2.278 -0.004 2.292 25380
84 1 14 "Average Difference" HN 78 0.783 0.014 0.787 25380
85 1 15 "Average Difference" N 78 4.157 0.224 4.178 25380
86 1 15 "Average Difference" HA 78 0.483 -0.119 0.471 25380
87 1 15 "Average Difference" C 79 1.516 0.159 1.518 25380
88 1 15 "Average Difference" CA 80 2.178 0.216 2.181 25380
89 1 15 "Average Difference" CB 79 2.268 -0.018 2.282 25380
90 1 15 "Average Difference" HN 78 0.752 0.021 0.756 25380
91 1 16 "Average Difference" N 78 4.013 0.174 4.036 25380
92 1 16 "Average Difference" HA 78 0.457 -0.121 0.444 25380
93 1 16 "Average Difference" C 79 1.507 0.137 1.510 25380
94 1 16 "Average Difference" CA 80 2.282 0.129 2.292 25380
95 1 16 "Average Difference" CB 79 2.222 0.098 2.234 25380
96 1 16 "Average Difference" HN 78 0.825 -0.034 0.829 25380
97 1 17 "Average Difference" N 78 4.174 0.141 4.199 25380
98 1 17 "Average Difference" HA 78 0.452 -0.078 0.448 25380
99 1 17 "Average Difference" C 79 1.446 0.116 1.450 25380
100 1 17 "Average Difference" CA 80 2.229 0.240 2.230 25380
101 1 17 "Average Difference" CB 79 2.285 0.010 2.300 25380
102 1 17 "Average Difference" HN 78 0.727 0.036 0.731 25380
103 1 18 "Average Difference" N 78 3.955 0.331 3.967 25380
104 1 18 "Average Difference" HA 78 0.464 -0.093 0.458 25380
105 1 18 "Average Difference" C 79 1.527 0.122 1.532 25380
106 1 18 "Average Difference" CA 80 2.182 0.136 2.192 25380
107 1 18 "Average Difference" CB 79 2.165 0.086 2.177 25380
108 1 18 "Average Difference" HN 78 0.785 0.010 0.790 25380
109 1 19 "Average Difference" N 78 4.295 -0.417 4.302 25380
110 1 19 "Average Difference" HA 78 0.438 -0.094 0.431 25380
111 1 19 "Average Difference" C 79 1.312 0.029 1.320 25380
112 1 19 "Average Difference" CA 80 2.006 0.160 2.012 25380
113 1 19 "Average Difference" CB 79 2.061 0.005 2.074 25380
114 1 19 "Average Difference" HN 78 0.762 -0.003 0.767 25380
115 1 20 "Average Difference" N 78 4.195 -0.070 4.221 25380
116 1 20 "Average Difference" HA 78 0.441 -0.051 0.441 25380
117 1 20 "Average Difference" C 79 1.407 0.061 1.415 25380
118 1 20 "Average Difference" CA 80 2.113 0.042 2.126 25380
119 1 20 "Average Difference" CB 79 2.249 0.066 2.263 25380
120 1 20 "Average Difference" HN 78 0.791 -0.020 0.796 25380
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 25380
_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 HIS N N 2 120.430 120.430 122.138 -1.708 25380
2 1 . 1 1 2 2 HIS HA H 2 4.735 4.735 4.779 -0.044 25380
3 1 . 1 1 2 2 HIS C C 2 173.884 173.884 174.620 -0.736 25380
4 1 . 1 1 2 2 HIS CA C 2 55.052 55.052 56.666 -1.614 25380
5 1 . 1 1 2 2 HIS CB C 2 28.666 28.666 30.360 -1.694 25380
6 1 . 1 1 2 2 HIS H H 2 8.678 8.678 8.562 0.116 25380
7 1 . 1 1 3 3 MET N N 3 122.377 122.377 121.364 1.013 25380
8 1 . 1 1 3 3 MET HA H 3 4.207 4.207 4.651 -0.444 25380
9 1 . 1 1 3 3 MET C C 3 174.584 174.584 175.867 -1.283 25380
10 1 . 1 1 3 3 MET CA C 3 56.550 56.550 55.448 1.102 25380
11 1 . 1 1 3 3 MET CB C 3 33.426 33.426 33.341 0.085 25380
12 1 . 1 1 3 3 MET H H 3 8.240 8.240 8.448 -0.208 25380
13 1 . 1 1 4 4 LYS N N 4 123.568 123.568 119.434 4.134 25380
14 1 . 1 1 4 4 LYS HA H 4 4.839 4.839 4.282 0.557 25380
15 1 . 1 1 4 4 LYS C C 4 175.906 175.906 174.904 1.002 25380
16 1 . 1 1 4 4 LYS CA C 4 54.800 54.800 56.492 -1.692 25380
17 1 . 1 1 4 4 LYS CB C 4 34.900 34.900 31.751 3.149 25380
18 1 . 1 1 4 4 LYS H H 4 8.351 8.351 8.086 0.265 25380
19 1 . 1 1 5 5 LEU N N 5 123.568 123.568 116.443 7.125 25380
20 1 . 1 1 5 5 LEU HA H 5 4.839 4.839 5.639 -0.800 25380
21 1 . 1 1 5 5 LEU C C 5 175.900 175.900 175.945 -0.045 25380
22 1 . 1 1 5 5 LEU CA C 5 53.350 53.350 53.383 -0.033 25380
23 1 . 1 1 5 5 LEU CB C 5 45.900 45.900 45.627 0.273 25380
24 1 . 1 1 5 5 LEU H H 5 8.281 8.281 7.569 0.712 25380
25 1 . 1 1 6 6 VAL N N 6 121.564 121.564 121.039 0.525 25380
26 1 . 1 1 6 6 VAL HA H 6 4.426 4.426 4.391 0.035 25380
27 1 . 1 1 6 6 VAL C C 6 178.200 178.200 174.781 3.419 25380
28 1 . 1 1 6 6 VAL CA C 6 63.200 63.200 60.785 2.415 25380
29 1 . 1 1 6 6 VAL CB C 6 33.200 33.200 34.316 -1.116 25380
30 1 . 1 1 6 6 VAL H H 6 9.276 9.276 9.023 0.253 25380
31 1 . 1 1 7 7 LEU N N 7 121.564 121.564 126.386 -4.822 25380
32 1 . 1 1 7 7 LEU HA H 7 4.426 4.426 5.118 -0.692 25380
33 1 . 1 1 7 7 LEU CA C 7 63.200 63.200 53.283 9.917 25380
34 1 . 1 1 7 7 LEU CB C 7 33.200 33.200 44.364 -11.164 25380
35 1 . 1 1 7 7 LEU H H 7 9.276 9.276 8.559 0.717 25380
36 1 . 1 1 8 8 ALA C C 8 177.040 177.040 177.857 -0.817 25380
37 1 . 1 1 8 8 ALA CA C 8 51.701 51.701 52.321 -0.620 25380
38 1 . 1 1 8 8 ALA CB C 8 20.864 20.864 19.938 0.925 25380
39 1 . 1 1 9 9 LYS N N 9 119.845 119.845 123.309 -3.464 25380
40 1 . 1 1 9 9 LYS HA H 9 4.128 4.128 4.023 0.105 25380
41 1 . 1 1 9 9 LYS C C 9 176.075 176.075 178.177 -2.102 25380
42 1 . 1 1 9 9 LYS CA C 9 56.761 56.761 59.098 -2.337 25380
43 1 . 1 1 9 9 LYS CB C 9 32.919 32.919 32.360 0.559 25380
44 1 . 1 1 9 9 LYS H H 9 8.545 8.545 8.694 -0.149 25380
45 1 . 1 1 10 10 ASN N N 10 119.279 119.279 118.350 0.929 25380
46 1 . 1 1 10 10 ASN HA H 10 4.645 4.645 4.538 0.107 25380
47 1 . 1 1 10 10 ASN C C 10 175.443 175.443 177.137 -1.694 25380
48 1 . 1 1 10 10 ASN CA C 10 53.657 53.657 55.865 -2.208 25380
49 1 . 1 1 10 10 ASN CB C 10 38.777 38.777 38.046 0.731 25380
50 1 . 1 1 10 10 ASN H H 10 8.592 8.592 8.835 -0.243 25380
51 1 . 1 1 11 11 THR N N 11 111.876 111.876 112.079 -0.203 25380
52 1 . 1 1 11 11 THR HA H 11 4.311 4.311 4.269 0.042 25380
53 1 . 1 1 11 11 THR C C 11 174.666 174.666 175.675 -1.009 25380
54 1 . 1 1 11 11 THR CA C 11 62.044 62.044 64.228 -2.184 25380
55 1 . 1 1 11 11 THR CB C 11 69.895 69.895 69.212 0.683 25380
56 1 . 1 1 11 11 THR H H 11 8.058 8.058 8.210 -0.152 25380
57 1 . 1 1 12 12 ARG N N 12 121.152 121.152 119.838 1.314 25380
58 1 . 1 1 12 12 ARG HA H 12 4.262 4.262 4.403 -0.141 25380
59 1 . 1 1 12 12 ARG C C 12 176.714 176.714 176.179 0.535 25380
60 1 . 1 1 12 12 ARG CA C 12 56.822 56.822 56.231 0.591 25380
61 1 . 1 1 12 12 ARG CB C 12 30.702 30.702 31.285 -0.583 25380
62 1 . 1 1 12 12 ARG H H 12 8.291 8.291 7.849 0.442 25380
63 1 . 1 1 13 13 LYS N N 13 120.459 120.459 118.911 1.548 25380
64 1 . 1 1 13 13 LYS HA H 13 3.896 3.896 4.052 -0.156 25380
65 1 . 1 1 13 13 LYS C C 13 176.682 176.682 176.539 0.143 25380
66 1 . 1 1 13 13 LYS CA C 13 56.978 56.978 57.347 -0.369 25380
67 1 . 1 1 13 13 LYS CB C 13 32.498 32.498 30.963 1.535 25380
68 1 . 1 1 13 13 LYS H H 13 8.286 8.286 8.376 -0.090 25380
69 1 . 1 1 14 14 SER N N 14 114.568 114.568 115.429 -0.861 25380
70 1 . 1 1 14 14 SER HA H 14 4.371 4.371 4.385 -0.014 25380
71 1 . 1 1 14 14 SER C C 14 173.990 173.990 174.788 -0.798 25380
72 1 . 1 1 14 14 SER CA C 14 58.617 58.617 59.110 -0.493 25380
73 1 . 1 1 14 14 SER CB C 14 63.933 63.933 63.843 0.090 25380
74 1 . 1 1 14 14 SER H H 14 7.957 7.957 8.366 -0.409 25380
75 1 . 1 1 15 15 ASP N N 15 121.565 121.565 119.088 2.477 25380
76 1 . 1 1 15 15 ASP HA H 15 4.601 4.601 4.711 -0.110 25380
77 1 . 1 1 15 15 ASP C C 15 175.684 175.684 176.232 -0.548 25380
78 1 . 1 1 15 15 ASP CA C 15 54.149 54.149 54.003 0.146 25380
79 1 . 1 1 15 15 ASP CB C 15 41.229 41.229 40.258 0.971 25380
80 1 . 1 1 15 15 ASP H H 15 8.166 8.166 8.340 -0.174 25380
81 1 . 1 1 16 16 ALA N N 16 124.173 124.173 123.123 1.050 25380
82 1 . 1 1 16 16 ALA HA H 16 4.371 4.371 4.127 0.244 25380
83 1 . 1 1 16 16 ALA C C 16 177.184 177.184 177.964 -0.780 25380
84 1 . 1 1 16 16 ALA CA C 16 52.337 52.337 53.549 -1.212 25380
85 1 . 1 1 16 16 ALA CB C 16 19.359 19.359 18.874 0.485 25380
86 1 . 1 1 16 16 ALA H H 16 8.163 8.163 8.241 -0.078 25380
87 1 . 1 1 17 17 LYS N N 17 121.152 121.152 119.020 2.132 25380
88 1 . 1 1 17 17 LYS HA H 17 4.426 4.426 4.200 0.226 25380
89 1 . 1 1 17 17 LYS C C 17 175.488 175.488 177.178 -1.690 25380
90 1 . 1 1 17 17 LYS CA C 17 56.205 56.205 57.693 -1.488 25380
91 1 . 1 1 17 17 LYS CB C 17 34.296 34.296 32.347 1.949 25380
92 1 . 1 1 17 17 LYS H H 17 8.363 8.363 8.105 0.258 25380
93 1 . 1 1 18 18 SER N N 18 116.448 116.448 114.837 1.611 25380
94 1 . 1 1 18 18 SER HA H 18 5.355 5.355 4.266 1.090 25380
95 1 . 1 1 18 18 SER C C 18 173.887 173.887 175.695 -1.808 25380
96 1 . 1 1 18 18 SER CA C 18 57.248 57.248 59.476 -2.228 25380
97 1 . 1 1 18 18 SER CB C 18 64.962 64.962 63.072 1.890 25380
98 1 . 1 1 18 18 SER H H 18 8.206 8.206 8.466 -0.260 25380
99 1 . 1 1 19 19 VAL N N 19 117.867 117.867 120.900 -3.033 25380
100 1 . 1 1 19 19 VAL HA H 19 3.620 3.620 3.730 -0.110 25380
101 1 . 1 1 19 19 VAL C C 19 174.169 174.169 177.272 -3.103 25380
102 1 . 1 1 19 19 VAL CA C 19 59.546 59.546 65.905 -6.359 25380
103 1 . 1 1 19 19 VAL CB C 19 35.902 35.902 31.506 4.396 25380
104 1 . 1 1 19 19 VAL H H 19 9.086 9.086 7.611 1.475 25380
105 1 . 1 1 20 20 GLU N N 20 120.843 120.843 120.119 0.724 25380
106 1 . 1 1 20 20 GLU HA H 20 4.868 4.868 4.153 0.715 25380
107 1 . 1 1 20 20 GLU C C 20 178.747 178.747 178.685 0.063 25380
108 1 . 1 1 20 20 GLU CA C 20 54.552 54.552 59.505 -4.953 25380
109 1 . 1 1 20 20 GLU CB C 20 31.099 31.099 28.942 2.157 25380
110 1 . 1 1 20 20 GLU H H 20 8.841 8.841 8.516 0.325 25380
111 1 . 1 1 21 21 LEU N N 21 122.653 122.653 119.469 3.184 25380
112 1 . 1 1 21 21 LEU HA H 21 3.443 3.443 4.005 -0.562 25380
113 1 . 1 1 21 21 LEU C C 21 178.799 178.799 179.216 -0.417 25380
114 1 . 1 1 21 21 LEU CA C 21 58.707 58.707 57.882 0.825 25380
115 1 . 1 1 21 21 LEU CB C 21 38.571 38.571 41.642 -3.071 25380
116 1 . 1 1 21 21 LEU H H 21 8.744 8.744 7.703 1.041 25380
117 1 . 1 1 22 22 GLU N N 22 115.392 115.392 119.306 -3.914 25380
118 1 . 1 1 22 22 GLU HA H 22 3.989 3.989 3.941 0.048 25380
119 1 . 1 1 22 22 GLU C C 22 179.328 179.328 179.012 0.316 25380
120 1 . 1 1 22 22 GLU CA C 22 60.080 60.080 59.545 0.535 25380
121 1 . 1 1 22 22 GLU CB C 22 28.834 28.834 29.392 -0.558 25380
122 1 . 1 1 22 22 GLU H H 22 8.744 8.744 7.663 1.081 25380
123 1 . 1 1 23 23 ASP N N 23 118.597 118.597 120.891 -2.294 25380
124 1 . 1 1 23 23 ASP HA H 23 4.611 4.611 4.486 0.125 25380
125 1 . 1 1 23 23 ASP C C 23 179.139 179.139 178.818 0.321 25380
126 1 . 1 1 23 23 ASP CA C 23 57.519 57.519 57.163 0.356 25380
127 1 . 1 1 23 23 ASP CB C 23 40.442 40.442 40.509 -0.067 25380
128 1 . 1 1 23 23 ASP H H 23 7.098 7.098 8.470 -1.372 25380
129 1 . 1 1 24 24 LEU N N 24 119.869 119.869 120.939 -1.070 25380
130 1 . 1 1 24 24 LEU HA H 24 3.934 3.934 3.773 0.161 25380
131 1 . 1 1 24 24 LEU C C 24 179.045 179.045 178.844 0.201 25380
132 1 . 1 1 24 24 LEU CA C 24 57.549 57.549 58.336 -0.787 25380
133 1 . 1 1 24 24 LEU CB C 24 41.550 41.550 41.700 -0.150 25380
134 1 . 1 1 24 24 LEU H H 24 7.576 7.576 8.463 -0.887 25380
135 1 . 1 1 25 25 TYR N N 25 118.100 118.100 118.536 -0.436 25380
136 1 . 1 1 25 25 TYR HA H 25 4.367 4.367 3.323 1.044 25380
137 1 . 1 1 25 25 TYR C C 25 177.945 177.945 177.832 0.113 25380
138 1 . 1 1 25 25 TYR CA C 25 62.606 62.606 61.512 1.094 25380
139 1 . 1 1 25 25 TYR CB C 25 37.948 37.948 38.216 -0.268 25380
140 1 . 1 1 25 25 TYR H H 25 8.320 8.320 7.414 0.906 25380
141 1 . 1 1 26 26 HIS N N 26 119.440 119.440 118.349 1.091 25380
142 1 . 1 1 26 26 HIS HA H 26 4.371 4.371 4.452 -0.081 25380
143 1 . 1 1 26 26 HIS C C 26 176.559 176.559 177.989 -1.430 25380
144 1 . 1 1 26 26 HIS CA C 26 59.519 59.519 59.167 0.352 25380
145 1 . 1 1 26 26 HIS CB C 26 28.128 28.128 30.141 -2.013 25380
146 1 . 1 1 26 26 HIS H H 26 8.383 8.383 8.505 -0.122 25380
147 1 . 1 1 27 27 GLU N N 27 119.915 119.915 120.977 -1.062 25380
148 1 . 1 1 27 27 GLU HA H 27 4.258 4.258 4.042 0.216 25380
149 1 . 1 1 27 27 GLU C C 27 179.163 179.163 178.573 0.590 25380
150 1 . 1 1 27 27 GLU CA C 27 60.075 60.075 59.217 0.858 25380
151 1 . 1 1 27 27 GLU CB C 27 29.535 29.535 29.557 -0.022 25380
152 1 . 1 1 27 27 GLU H H 27 8.288 8.288 8.880 -0.592 25380
153 1 . 1 1 28 28 PHE N N 28 120.500 120.500 120.365 0.135 25380
154 1 . 1 1 28 28 PHE HA H 28 4.972 4.972 4.356 0.616 25380
155 1 . 1 1 28 28 PHE C C 28 177.386 177.386 176.966 0.420 25380
156 1 . 1 1 28 28 PHE CA C 28 60.401 60.401 60.702 -0.300 25380
157 1 . 1 1 28 28 PHE CB C 28 39.568 39.568 39.215 0.353 25380
158 1 . 1 1 28 28 PHE H H 28 8.568 8.568 7.983 0.585 25380
159 1 . 1 1 29 29 SER N N 29 114.306 114.306 114.371 -0.065 25380
160 1 . 1 1 29 29 SER HA H 29 4.288 4.288 4.130 0.158 25380
161 1 . 1 1 29 29 SER C C 29 175.656 175.656 176.350 -0.694 25380
162 1 . 1 1 29 29 SER CA C 29 61.058 61.058 60.301 0.757 25380
163 1 . 1 1 29 29 SER CB C 29 63.555 63.555 63.428 0.127 25380
164 1 . 1 1 29 29 SER H H 29 8.479 8.479 7.869 0.610 25380
165 1 . 1 1 30 30 GLU N N 30 118.322 118.322 120.601 -2.279 25380
166 1 . 1 1 30 30 GLU HA H 30 4.092 4.092 4.197 -0.105 25380
167 1 . 1 1 30 30 GLU C C 30 177.312 177.312 176.617 0.695 25380
168 1 . 1 1 30 30 GLU CA C 30 57.580 57.580 57.907 -0.327 25380
169 1 . 1 1 30 30 GLU CB C 30 29.577 29.577 30.585 -1.008 25380
170 1 . 1 1 30 30 GLU H H 30 8.428 8.428 8.019 0.409 25380
171 1 . 1 1 31 31 ASP N N 31 115.630 115.630 116.436 -0.806 25380
172 1 . 1 1 31 31 ASP HA H 31 4.810 4.810 4.825 -0.015 25380
173 1 . 1 1 31 31 ASP C C 31 175.723 175.723 173.752 1.971 25380
174 1 . 1 1 31 31 ASP CA C 31 53.974 53.974 52.957 1.017 25380
175 1 . 1 1 31 31 ASP CB C 31 40.818 40.818 43.716 -2.898 25380
176 1 . 1 1 31 31 ASP H H 31 7.303 7.303 8.032 -0.729 25380
177 1 . 1 1 32 32 LYS N N 32 114.357 114.357 120.125 -5.768 25380
178 1 . 1 1 32 32 LYS HA H 32 3.827 3.827 4.478 -0.651 25380
179 1 . 1 1 32 32 LYS C C 32 175.716 175.716 175.876 -0.160 25380
180 1 . 1 1 32 32 LYS CA C 32 56.162 56.162 55.562 0.600 25380
181 1 . 1 1 32 32 LYS CB C 32 28.381 28.381 33.650 -5.269 25380
182 1 . 1 1 32 32 LYS H H 32 7.148 7.148 8.337 -1.189 25380
183 1 . 1 1 33 33 ARG N N 33 120.929 120.929 124.289 -3.360 25380
184 1 . 1 1 33 33 ARG HA H 33 4.201 4.201 4.642 -0.441 25380
185 1 . 1 1 33 33 ARG C C 33 173.982 173.982 173.636 0.346 25380
186 1 . 1 1 33 33 ARG CA C 33 56.194 56.194 55.361 0.833 25380
187 1 . 1 1 33 33 ARG CB C 33 30.642 30.642 33.866 -3.224 25380
188 1 . 1 1 33 33 ARG H H 33 7.388 7.388 8.799 -1.411 25380
189 1 . 1 1 34 34 SER N N 34 115.867 115.867 114.901 0.966 25380
190 1 . 1 1 34 34 SER HA H 34 5.355 5.355 4.880 0.475 25380
191 1 . 1 1 34 34 SER C C 34 172.754 172.754 172.719 0.035 25380
192 1 . 1 1 34 34 SER CA C 34 58.236 58.236 56.974 1.262 25380
193 1 . 1 1 34 34 SER CB C 34 65.212 65.212 66.035 -0.823 25380
194 1 . 1 1 34 34 SER H H 34 8.173 8.173 8.303 -0.130 25380
195 1 . 1 1 35 35 ILE N N 35 119.621 119.621 116.381 3.240 25380
196 1 . 1 1 35 35 ILE HA H 35 4.863 4.863 4.907 -0.044 25380
197 1 . 1 1 35 35 ILE C C 35 174.069 174.069 173.718 0.352 25380
198 1 . 1 1 35 35 ILE CA C 35 59.956 59.956 59.285 0.671 25380
199 1 . 1 1 35 35 ILE CB C 35 40.655 40.655 41.964 -1.309 25380
200 1 . 1 1 35 35 ILE H H 35 6.779 6.779 8.572 -1.793 25380
201 1 . 1 1 36 36 PHE N N 36 124.305 124.305 121.256 3.049 25380
202 1 . 1 1 36 36 PHE HA H 36 4.453 4.453 5.697 -1.244 25380
203 1 . 1 1 36 36 PHE C C 36 173.204 173.204 174.919 -1.715 25380
204 1 . 1 1 36 36 PHE CA C 36 56.416 56.416 56.174 0.242 25380
205 1 . 1 1 36 36 PHE CB C 36 44.817 44.817 42.031 2.786 25380
206 1 . 1 1 36 36 PHE H H 36 8.411 8.411 9.000 -0.589 25380
207 1 . 1 1 37 37 TYR N N 37 118.743 118.743 124.908 -6.165 25380
208 1 . 1 1 37 37 TYR HA H 37 5.570 5.570 5.242 0.328 25380
209 1 . 1 1 37 37 TYR C C 37 175.455 175.455 173.924 1.531 25380
210 1 . 1 1 37 37 TYR CA C 37 56.518 56.518 55.739 0.779 25380
211 1 . 1 1 37 37 TYR CB C 37 40.991 40.991 40.934 0.057 25380
212 1 . 1 1 37 37 TYR H H 37 8.353 8.353 9.455 -1.102 25380
213 1 . 1 1 38 38 PHE N N 38 119.236 119.236 129.514 -10.278 25380
214 1 . 1 1 38 38 PHE HA H 38 5.160 5.160 4.764 0.396 25380
215 1 . 1 1 38 38 PHE C C 38 174.650 174.650 173.215 1.435 25380
216 1 . 1 1 38 38 PHE CA C 38 56.842 56.842 55.411 1.431 25380
217 1 . 1 1 38 38 PHE CB C 38 42.619 42.619 39.212 3.407 25380
218 1 . 1 1 38 38 PHE H H 38 9.756 9.756 9.141 0.615 25380
219 1 . 1 1 39 39 ALA N N 39 122.516 122.516 128.453 -5.937 25380
220 1 . 1 1 39 39 ALA HA H 39 4.540 4.540 4.704 -0.164 25380
221 1 . 1 1 39 39 ALA C C 39 177.042 177.042 174.165 2.877 25380
222 1 . 1 1 39 39 ALA CA C 39 50.843 50.843 49.087 1.756 25380
223 1 . 1 1 39 39 ALA CB C 39 18.578 18.578 21.750 -3.172 25380
224 1 . 1 1 39 39 ALA H H 39 7.738 7.738 8.618 -0.880 25380
225 1 . 1 1 40 40 PRO C C 40 175.411 175.411 177.204 -1.793 25380
226 1 . 1 1 40 40 PRO CA C 40 64.288 64.288 62.810 1.478 25380
227 1 . 1 1 40 40 PRO CB C 40 31.104 31.104 32.770 -1.666 25380
228 1 . 1 1 41 41 THR N N 41 105.878 105.878 117.093 -11.215 25380
229 1 . 1 1 41 41 THR HA H 41 4.190 4.190 3.843 0.347 25380
230 1 . 1 1 41 41 THR C C 41 176.400 176.400 175.320 1.080 25380
231 1 . 1 1 41 41 THR CA C 41 61.937 61.937 65.319 -3.382 25380
232 1 . 1 1 41 41 THR CB C 41 68.331 68.331 68.688 -0.357 25380
233 1 . 1 1 41 41 THR H H 41 6.715 6.715 8.310 -1.595 25380
234 1 . 1 1 42 42 ASN N N 42 118.863 118.863 118.228 0.635 25380
235 1 . 1 1 42 42 ASN HA H 42 4.535 4.535 4.469 0.066 25380
236 1 . 1 1 42 42 ASN C C 42 173.764 173.764 175.815 -2.051 25380
237 1 . 1 1 42 42 ASN CA C 42 54.176 54.176 55.334 -1.158 25380
238 1 . 1 1 42 42 ASN CB C 42 41.715 41.715 37.796 3.919 25380
239 1 . 1 1 42 42 ASN H H 42 7.153 7.153 8.337 -1.184 25380
240 1 . 1 1 43 43 ALA N N 43 126.174 126.174 119.537 6.637 25380
241 1 . 1 1 43 43 ALA HA H 43 4.425 4.425 4.374 0.051 25380
242 1 . 1 1 43 43 ALA C C 43 179.308 179.308 176.809 2.499 25380
243 1 . 1 1 43 43 ALA CA C 43 51.982 51.982 52.231 -0.249 25380
244 1 . 1 1 43 43 ALA CB C 43 18.294 18.294 19.515 -1.221 25380
245 1 . 1 1 43 43 ALA H H 43 9.465 9.465 7.803 1.662 25380
246 1 . 1 1 44 44 HIS N N 44 126.251 126.251 115.541 10.710 25380
247 1 . 1 1 44 44 HIS HA H 44 3.827 3.827 4.268 -0.441 25380
248 1 . 1 1 44 44 HIS C C 44 177.407 177.407 175.199 2.208 25380
249 1 . 1 1 44 44 HIS CA C 44 61.025 61.025 57.050 3.975 25380
250 1 . 1 1 44 44 HIS CB C 44 28.630 28.630 27.366 1.264 25380
251 1 . 1 1 44 44 HIS H H 44 9.407 9.407 7.917 1.490 25380
252 1 . 1 1 45 45 LYS N N 45 114.990 114.990 119.494 -4.504 25380
253 1 . 1 1 45 45 LYS HA H 45 3.883 3.883 4.232 -0.349 25380
254 1 . 1 1 45 45 LYS C C 45 178.284 178.284 177.422 0.862 25380
255 1 . 1 1 45 45 LYS CA C 45 59.249 59.249 58.604 0.645 25380
256 1 . 1 1 45 45 LYS CB C 45 31.834 31.834 32.889 -1.055 25380
257 1 . 1 1 45 45 LYS H H 45 8.960 8.960 8.101 0.859 25380
258 1 . 1 1 46 46 ASP N N 46 120.411 120.411 119.430 0.981 25380
259 1 . 1 1 46 46 ASP HA H 46 4.426 4.426 4.439 -0.013 25380
260 1 . 1 1 46 46 ASP C C 46 177.773 177.773 178.193 -0.420 25380
261 1 . 1 1 46 46 ASP CA C 46 57.016 57.016 57.355 -0.339 25380
262 1 . 1 1 46 46 ASP CB C 46 39.897 39.897 40.133 -0.236 25380
263 1 . 1 1 46 46 ASP H H 46 6.777 6.777 8.544 -1.767 25380
264 1 . 1 1 47 47 MET N N 47 118.178 118.178 119.059 -0.881 25380
265 1 . 1 1 47 47 MET HA H 47 3.879 3.879 4.176 -0.297 25380
266 1 . 1 1 47 47 MET C C 47 179.499 179.499 177.703 1.796 25380
267 1 . 1 1 47 47 MET CA C 47 56.052 56.052 59.075 -3.023 25380
268 1 . 1 1 47 47 MET CB C 47 29.601 29.601 32.552 -2.951 25380
269 1 . 1 1 47 47 MET H H 47 7.367 7.367 8.005 -0.638 25380
270 1 . 1 1 48 48 LEU N N 48 117.665 117.665 119.364 -1.699 25380
271 1 . 1 1 48 48 LEU HA H 48 3.847 3.847 3.883 -0.036 25380
272 1 . 1 1 48 48 LEU C C 48 179.843 179.843 178.528 1.315 25380
273 1 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.676 -0.096 25380
274 1 . 1 1 48 48 LEU CB C 48 40.953 40.953 41.491 -0.538 25380
275 1 . 1 1 48 48 LEU H H 48 7.672 7.672 7.708 -0.036 25380
276 1 . 1 1 49 49 LYS N N 49 119.326 119.326 118.506 0.820 25380
277 1 . 1 1 49 49 LYS HA H 49 4.127 4.127 3.560 0.567 25380
278 1 . 1 1 49 49 LYS C C 49 179.684 179.684 178.358 1.326 25380
279 1 . 1 1 49 49 LYS CA C 49 58.799 58.799 59.030 -0.231 25380
280 1 . 1 1 49 49 LYS CB C 49 31.453 31.453 31.814 -0.361 25380
281 1 . 1 1 49 49 LYS H H 49 7.420 7.420 7.696 -0.276 25380
282 1 . 1 1 50 50 ALA N N 50 122.022 122.022 122.628 -0.606 25380
283 1 . 1 1 50 50 ALA HA H 50 4.043 4.043 3.554 0.489 25380
284 1 . 1 1 50 50 ALA C C 50 178.818 178.818 178.813 0.005 25380
285 1 . 1 1 50 50 ALA CA C 50 55.169 55.169 54.697 0.472 25380
286 1 . 1 1 50 50 ALA CB C 50 17.300 17.300 17.693 -0.393 25380
287 1 . 1 1 50 50 ALA H H 50 7.551 7.551 7.767 -0.216 25380
288 1 . 1 1 51 51 VAL N N 51 118.165 118.165 117.953 0.212 25380
289 1 . 1 1 51 51 VAL HA H 51 3.442 3.442 3.546 -0.104 25380
290 1 . 1 1 51 51 VAL C C 51 178.646 178.646 178.082 0.564 25380
291 1 . 1 1 51 51 VAL CA C 51 67.206 67.206 66.368 0.838 25380
292 1 . 1 1 51 51 VAL CB C 51 31.453 31.453 30.798 0.655 25380
293 1 . 1 1 51 51 VAL H H 51 7.226 7.226 7.415 -0.189 25380
294 1 . 1 1 52 52 ASP N N 52 122.298 122.298 120.424 1.874 25380
295 1 . 1 1 52 52 ASP HA H 52 4.371 4.371 4.332 0.039 25380
296 1 . 1 1 52 52 ASP C C 52 177.898 177.898 179.069 -1.171 25380
297 1 . 1 1 52 52 ASP CA C 52 57.571 57.571 57.076 0.495 25380
298 1 . 1 1 52 52 ASP CB C 52 40.386 40.386 40.191 0.195 25380
299 1 . 1 1 52 52 ASP H H 52 8.232 8.232 7.320 0.912 25380
300 1 . 1 1 53 53 PHE N N 53 121.541 121.541 119.962 1.579 25380
301 1 . 1 1 53 53 PHE HA H 53 4.321 4.321 4.302 0.019 25380
302 1 . 1 1 53 53 PHE C C 53 177.224 177.224 178.107 -0.883 25380
303 1 . 1 1 53 53 PHE CA C 53 61.080 61.080 59.080 2.000 25380
304 1 . 1 1 53 53 PHE CB C 53 39.700 39.700 37.949 1.751 25380
305 1 . 1 1 53 53 PHE H H 53 8.240 8.240 7.851 0.389 25380
306 1 . 1 1 54 54 PHE N N 54 115.925 115.925 117.354 -1.429 25380
307 1 . 1 1 54 54 PHE HA H 54 3.655 3.655 4.199 -0.544 25380
308 1 . 1 1 54 54 PHE C C 54 178.269 178.269 177.464 0.805 25380
309 1 . 1 1 54 54 PHE CA C 54 64.200 64.200 59.936 4.264 25380
310 1 . 1 1 54 54 PHE CB C 54 38.578 38.578 37.987 0.591 25380
311 1 . 1 1 54 54 PHE H H 54 7.755 7.755 7.943 -0.188 25380
312 1 . 1 1 55 55 LYS N N 55 120.251 120.251 118.056 2.195 25380
313 1 . 1 1 55 55 LYS HA H 55 4.426 4.426 4.063 0.363 25380
314 1 . 1 1 55 55 LYS C C 55 181.484 181.484 178.465 3.019 25380
315 1 . 1 1 55 55 LYS CA C 55 59.629 59.629 58.820 0.809 25380
316 1 . 1 1 55 55 LYS CB C 55 31.739 31.739 32.385 -0.646 25380
317 1 . 1 1 55 55 LYS H H 55 8.213 8.213 7.516 0.697 25380
318 1 . 1 1 56 56 GLU N N 56 120.146 120.146 117.882 2.264 25380
319 1 . 1 1 56 56 GLU HA H 56 3.993 3.993 4.143 -0.150 25380
320 1 . 1 1 56 56 GLU C C 56 178.085 178.085 177.598 0.487 25380
321 1 . 1 1 56 56 GLU CA C 56 58.788 58.788 58.504 0.284 25380
322 1 . 1 1 56 56 GLU CB C 56 28.596 28.596 30.113 -1.517 25380
323 1 . 1 1 56 56 GLU H H 56 7.850 7.850 7.882 -0.032 25380
324 1 . 1 1 57 57 LYS N N 57 115.940 115.940 118.645 -2.705 25380
325 1 . 1 1 57 57 LYS HA H 57 4.103 4.103 4.414 -0.312 25380
326 1 . 1 1 57 57 LYS C C 57 176.225 176.225 177.043 -0.818 25380
327 1 . 1 1 57 57 LYS CA C 57 54.572 54.572 55.340 -0.768 25380
328 1 . 1 1 57 57 LYS CB C 57 32.036 32.036 33.548 -1.512 25380
329 1 . 1 1 57 57 LYS H H 57 7.019 7.019 7.866 -0.847 25380
330 1 . 1 1 58 58 GLY N N 58 106.593 106.593 109.661 -3.068 25380
331 1 . 1 1 58 58 GLY C C 58 174.350 174.350 174.895 -0.545 25380
332 1 . 1 1 58 58 GLY CA C 58 45.500 45.500 45.579 -0.079 25380
333 1 . 1 1 58 58 GLY H H 58 7.883 7.883 8.470 -0.587 25380
334 1 . 1 1 59 59 HIS N N 59 117.962 117.962 117.673 0.289 25380
335 1 . 1 1 59 59 HIS HA H 59 4.867 4.867 4.277 0.590 25380
336 1 . 1 1 59 59 HIS C C 59 173.271 173.271 175.367 -2.096 25380
337 1 . 1 1 59 59 HIS CA C 59 54.778 54.778 57.100 -2.322 25380
338 1 . 1 1 59 59 HIS CB C 59 31.685 31.685 29.783 1.902 25380
339 1 . 1 1 59 59 HIS H H 59 8.218 8.218 7.981 0.237 25380
340 1 . 1 1 60 60 THR N N 60 119.624 119.624 111.181 8.443 25380
341 1 . 1 1 60 60 THR HA H 60 4.430 4.430 4.137 0.293 25380
342 1 . 1 1 60 60 THR C C 60 171.430 171.430 173.993 -2.563 25380
343 1 . 1 1 60 60 THR CA C 60 63.480 63.480 61.827 1.653 25380
344 1 . 1 1 60 60 THR CB C 60 69.761 69.761 69.982 -0.221 25380
345 1 . 1 1 60 60 THR H H 60 8.780 8.780 7.659 1.121 25380
346 1 . 1 1 61 61 ALA N N 61 126.706 126.706 127.214 -0.508 25380
347 1 . 1 1 61 61 ALA HA H 61 5.246 5.246 4.296 0.950 25380
348 1 . 1 1 61 61 ALA C C 61 174.753 174.753 176.575 -1.822 25380
349 1 . 1 1 61 61 ALA CA C 61 49.772 49.772 53.109 -3.337 25380
350 1 . 1 1 61 61 ALA CB C 61 22.889 22.889 20.488 2.401 25380
351 1 . 1 1 61 61 ALA H H 61 7.795 7.795 8.590 -0.795 25380
352 1 . 1 1 62 62 TYR N N 62 117.859 117.859 116.209 1.650 25380
353 1 . 1 1 62 62 TYR C C 62 173.431 173.431 173.317 0.114 25380
354 1 . 1 1 62 62 TYR CA C 62 56.647 56.647 57.341 -0.694 25380
355 1 . 1 1 62 62 TYR CB C 62 40.549 40.549 42.340 -1.791 25380
356 1 . 1 1 62 62 TYR H H 62 8.711 8.711 7.890 0.821 25380
357 1 . 1 1 63 63 LEU N N 63 125.044 125.044 124.120 0.924 25380
358 1 . 1 1 63 63 LEU HA H 63 5.411 5.411 4.899 0.512 25380
359 1 . 1 1 63 63 LEU C C 63 175.319 175.319 174.570 0.749 25380
360 1 . 1 1 63 63 LEU CA C 63 53.230 53.230 53.592 -0.362 25380
361 1 . 1 1 63 63 LEU CB C 63 45.701 45.701 44.979 0.722 25380
362 1 . 1 1 63 63 LEU H H 63 8.746 8.746 8.028 0.718 25380
363 1 . 1 1 64 64 ASP N N 64 125.463 125.463 124.296 1.167 25380
364 1 . 1 1 64 64 ASP HA H 64 5.199 5.199 4.958 0.241 25380
365 1 . 1 1 64 64 ASP C C 64 174.512 174.512 174.511 0.001 25380
366 1 . 1 1 64 64 ASP CA C 64 52.700 52.700 52.379 0.322 25380
367 1 . 1 1 64 64 ASP CB C 64 43.954 43.954 44.542 -0.588 25380
368 1 . 1 1 64 64 ASP H H 64 9.293 9.293 8.946 0.347 25380
369 1 . 1 1 65 65 GLU N N 65 120.711 120.711 119.810 0.901 25380
370 1 . 1 1 65 65 GLU HA H 65 5.067 5.067 4.387 0.680 25380
371 1 . 1 1 65 65 GLU C C 65 175.652 175.652 176.274 -0.622 25380
372 1 . 1 1 65 65 GLU CA C 65 55.643 55.643 56.803 -1.160 25380
373 1 . 1 1 65 65 GLU CB C 65 30.455 30.455 30.951 -0.496 25380
374 1 . 1 1 65 65 GLU H H 65 8.715 8.715 8.543 0.172 25380
375 1 . 1 1 66 66 VAL N N 66 122.936 122.936 120.361 2.575 25380
376 1 . 1 1 66 66 VAL HA H 66 4.430 4.430 4.174 0.256 25380
377 1 . 1 1 66 66 VAL C C 66 175.065 175.065 175.831 -0.766 25380
378 1 . 1 1 66 66 VAL CA C 66 60.991 60.991 61.958 -0.967 25380
379 1 . 1 1 66 66 VAL CB C 66 34.280 34.280 32.828 1.452 25380
380 1 . 1 1 66 66 VAL H H 66 9.156 9.156 8.594 0.562 25380
381 1 . 1 1 67 67 ARG N N 67 126.104 126.104 125.764 0.340 25380
382 1 . 1 1 67 67 ARG HA H 67 4.541 4.541 4.396 0.145 25380
383 1 . 1 1 67 67 ARG C C 67 176.708 176.708 176.150 0.558 25380
384 1 . 1 1 67 67 ARG CA C 67 56.080 56.080 56.103 -0.023 25380
385 1 . 1 1 67 67 ARG CB C 67 30.908 30.908 29.192 1.716 25380
386 1 . 1 1 67 67 ARG H H 67 8.734 8.734 8.718 0.016 25380
387 1 . 1 1 68 68 VAL N N 68 120.707 120.707 115.947 4.760 25380
388 1 . 1 1 68 68 VAL HA H 68 4.152 4.152 4.434 -0.282 25380
389 1 . 1 1 68 68 VAL C C 68 175.931 175.931 176.226 -0.295 25380
390 1 . 1 1 68 68 VAL CA C 68 62.776 62.776 61.580 1.196 25380
391 1 . 1 1 68 68 VAL CB C 68 32.489 32.489 31.204 1.285 25380
392 1 . 1 1 68 68 VAL H H 68 8.384 8.384 7.846 0.538 25380
393 1 . 1 1 69 69 SER N N 69 116.156 116.156 117.868 -1.712 25380
394 1 . 1 1 69 69 SER HA H 69 4.693 4.693 4.354 0.339 25380
395 1 . 1 1 69 69 SER C C 69 174.544 174.544 176.124 -1.580 25380
396 1 . 1 1 69 69 SER CA C 69 57.754 57.754 61.252 -3.498 25380
397 1 . 1 1 69 69 SER CB C 69 64.831 64.831 62.787 2.044 25380
398 1 . 1 1 69 69 SER H H 69 8.067 8.067 8.100 -0.033 25380
399 1 . 1 1 70 70 THR N N 70 110.753 110.753 114.710 -3.957 25380
400 1 . 1 1 70 70 THR HA H 70 4.152 4.152 4.160 -0.008 25380
401 1 . 1 1 70 70 THR C C 70 174.865 174.865 175.446 -0.581 25380
402 1 . 1 1 70 70 THR CA C 70 63.831 63.831 64.885 -1.054 25380
403 1 . 1 1 70 70 THR CB C 70 68.956 68.956 68.761 0.195 25380
404 1 . 1 1 70 70 THR H H 70 8.095 8.095 8.125 -0.030 25380
405 1 . 1 1 71 71 ASP N N 71 121.817 121.817 120.877 0.940 25380
406 1 . 1 1 71 71 ASP HA H 71 4.590 4.590 4.598 -0.008 25380
407 1 . 1 1 71 71 ASP C C 71 176.746 176.746 177.000 -0.254 25380
408 1 . 1 1 71 71 ASP CA C 71 54.264 54.264 56.180 -1.916 25380
409 1 . 1 1 71 71 ASP CB C 71 41.425 41.425 40.849 0.576 25380
410 1 . 1 1 71 71 ASP H H 71 8.076 8.076 8.357 -0.281 25380
411 1 . 1 1 72 72 GLU N N 72 123.635 123.635 116.060 7.575 25380
412 1 . 1 1 72 72 GLU HA H 72 3.993 3.993 4.521 -0.528 25380
413 1 . 1 1 72 72 GLU C C 72 176.971 176.971 175.601 1.370 25380
414 1 . 1 1 72 72 GLU CA C 72 58.219 58.219 56.261 1.958 25380
415 1 . 1 1 72 72 GLU CB C 72 29.702 29.702 31.865 -2.163 25380
416 1 . 1 1 72 72 GLU H H 72 8.514 8.514 8.176 0.338 25380
417 1 . 1 1 73 73 LYS N N 73 117.857 117.857 118.253 -0.396 25380
418 1 . 1 1 73 73 LYS HA H 73 4.643 4.643 4.013 0.630 25380
419 1 . 1 1 73 73 LYS C C 73 176.508 176.508 175.444 1.064 25380
420 1 . 1 1 73 73 LYS CA C 73 57.080 57.080 57.468 -0.388 25380
421 1 . 1 1 73 73 LYS CB C 73 32.203 32.203 31.169 1.034 25380
422 1 . 1 1 73 73 LYS H H 73 8.423 8.423 8.055 0.368 25380
423 1 . 1 1 74 74 ASP N N 74 120.580 120.580 116.300 4.280 25380
424 1 . 1 1 74 74 ASP HA H 74 4.758 4.758 4.645 0.113 25380
425 1 . 1 1 74 74 ASP C C 74 174.059 174.059 175.450 -1.390 25380
426 1 . 1 1 74 74 ASP CA C 74 53.279 53.279 55.025 -1.746 25380
427 1 . 1 1 74 74 ASP CB C 74 40.578 40.578 41.601 -1.023 25380
428 1 . 1 1 74 74 ASP H H 74 7.918 7.918 8.458 -0.540 25380
429 1 . 1 1 75 75 PHE N N 75 118.513 118.513 119.108 -0.595 25380
430 1 . 1 1 75 75 PHE HA H 75 5.363 5.363 5.549 -0.186 25380
431 1 . 1 1 75 75 PHE C C 75 173.038 173.038 175.036 -1.998 25380
432 1 . 1 1 75 75 PHE CA C 75 55.522 55.522 56.749 -1.227 25380
433 1 . 1 1 75 75 PHE CB C 75 41.714 41.714 40.655 1.059 25380
434 1 . 1 1 75 75 PHE H H 75 7.397 7.397 7.847 -0.450 25380
435 1 . 1 1 76 76 LEU N N 76 116.773 116.773 124.525 -7.752 25380
436 1 . 1 1 76 76 LEU HA H 76 4.643 4.643 4.732 -0.089 25380
437 1 . 1 1 76 76 LEU C C 76 177.553 177.553 175.531 2.022 25380
438 1 . 1 1 76 76 LEU CA C 76 53.619 53.619 54.334 -0.715 25380
439 1 . 1 1 76 76 LEU CB C 76 45.701 45.701 43.929 1.772 25380
440 1 . 1 1 76 76 LEU H H 76 8.774 8.774 9.183 -0.409 25380
441 1 . 1 1 77 77 TYR N N 77 118.377 118.377 125.419 -7.041 25380
442 1 . 1 1 77 77 TYR HA H 77 5.415 5.415 4.813 0.602 25380
443 1 . 1 1 77 77 TYR C C 77 175.479 175.479 173.293 2.186 25380
444 1 . 1 1 77 77 TYR CA C 77 58.391 58.391 55.944 2.447 25380
445 1 . 1 1 77 77 TYR CB C 77 41.100 41.100 40.264 0.836 25380
446 1 . 1 1 77 77 TYR H H 77 8.589 8.589 9.263 -0.674 25380
447 1 . 1 1 78 78 GLU N N 78 123.875 123.875 128.866 -4.991 25380
448 1 . 1 1 78 78 GLU HA H 78 4.973 4.973 4.866 0.107 25380
449 1 . 1 1 78 78 GLU C C 78 174.120 174.120 173.877 0.243 25380
450 1 . 1 1 78 78 GLU CA C 78 54.378 54.378 53.977 0.401 25380
451 1 . 1 1 78 78 GLU CB C 78 32.640 32.640 33.503 -0.863 25380
452 1 . 1 1 78 78 GLU H H 78 9.576 9.576 8.644 0.932 25380
453 1 . 1 1 79 79 LEU N N 79 128.661 128.661 125.253 3.408 25380
454 1 . 1 1 79 79 LEU HA H 79 5.289 5.289 4.486 0.803 25380
455 1 . 1 1 79 79 LEU C C 79 174.219 174.219 175.160 -0.941 25380
456 1 . 1 1 79 79 LEU CA C 79 53.149 53.149 53.748 -0.599 25380
457 1 . 1 1 79 79 LEU CB C 79 46.630 46.630 44.315 2.315 25380
458 1 . 1 1 79 79 LEU H H 79 9.139 9.139 8.742 0.397 25380
459 1 . 1 1 80 80 HIS N N 80 124.886 124.886 122.219 2.667 25380
460 1 . 1 1 80 80 HIS HA H 80 5.430 5.430 4.959 0.471 25380
461 1 . 1 1 80 80 HIS C C 80 173.346 173.346 175.768 -2.422 25380
462 1 . 1 1 80 80 HIS CA C 80 53.149 53.149 54.656 -1.507 25380
463 1 . 1 1 80 80 HIS CB C 80 30.768 30.768 31.340 -0.572 25380
464 1 . 1 1 80 80 HIS H H 80 8.897 8.897 8.996 -0.099 25380
465 1 . 1 1 81 81 ILE N N 81 125.173 125.173 122.431 2.742 25380
466 1 . 1 1 81 81 ILE HA H 81 4.290 4.290 3.709 0.581 25380
467 1 . 1 1 81 81 ILE C C 81 174.600 174.600 175.207 -0.607 25380
468 1 . 1 1 81 81 ILE CA C 81 60.500 60.500 62.748 -2.248 25380
469 1 . 1 1 81 81 ILE CB C 81 39.700 39.700 36.534 3.166 25380
470 1 . 1 1 81 81 ILE H H 81 8.909 8.909 8.510 0.399 25380
stop_
save_