data_18980
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18980
_Entry.PDB_ID 2M3Z
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 18980
_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 GLN N N 2 125.073 125.073 122.862 2.211 18980
2 1 1 . 1 1 2 2 GLN HA H 2 4.309 4.309 4.784 -0.475 18980
3 1 1 . 1 1 2 2 GLN CA C 2 52.755 52.755 55.077 -2.322 18980
4 1 1 . 1 1 2 2 GLN CB C 2 26.728 26.728 31.216 -4.488 18980
5 1 1 . 1 1 2 2 GLN H H 2 8.503 8.503 8.187 0.316 18980
6 1 1 . 1 1 3 3 LYS N N 3 123.202 123.202 120.653 2.549 18980
7 1 1 . 1 1 3 3 LYS HA H 3 4.271 4.271 4.537 -0.266 18980
8 1 1 . 1 1 3 3 LYS CA C 3 53.658 53.658 56.574 -2.916 18980
9 1 1 . 1 1 3 3 LYS CB C 3 30.442 30.442 33.429 -2.987 18980
10 1 1 . 1 1 3 3 LYS H H 3 8.414 8.414 8.990 -0.576 18980
11 1 1 . 1 1 4 4 GLY N N 4 109.574 109.574 107.706 1.868 18980
12 1 1 . 1 1 4 4 GLY CA C 4 42.455 42.455 43.971 -1.516 18980
13 1 1 . 1 1 4 4 GLY H H 4 8.394 8.394 7.797 0.597 18980
14 1 1 . 1 1 5 5 ASN N N 5 118.311 118.311 116.916 1.395 18980
15 1 1 . 1 1 5 5 ASN HA H 5 4.625 4.625 4.499 0.126 18980
16 1 1 . 1 1 5 5 ASN CA C 5 50.146 50.146 54.313 -4.167 18980
17 1 1 . 1 1 5 5 ASN CB C 5 36.059 36.059 38.298 -2.239 18980
18 1 1 . 1 1 5 5 ASN H H 5 8.240 8.240 8.221 0.019 18980
19 1 1 . 1 1 6 6 PHE N N 6 120.460 120.460 118.289 2.171 18980
20 1 1 . 1 1 6 6 PHE HA H 6 4.541 4.541 4.767 -0.226 18980
21 1 1 . 1 1 6 6 PHE CA C 6 55.112 55.112 56.453 -1.341 18980
22 1 1 . 1 1 6 6 PHE CB C 6 36.457 36.457 40.053 -3.596 18980
23 1 1 . 1 1 6 6 PHE H H 6 8.164 8.164 7.457 0.707 18980
24 1 1 . 1 1 7 7 ARG N N 7 121.606 121.606 120.983 0.623 18980
25 1 1 . 1 1 7 7 ARG HA H 7 4.193 4.193 4.238 -0.045 18980
26 1 1 . 1 1 7 7 ARG CA C 7 53.586 53.586 56.443 -2.857 18980
27 1 1 . 1 1 7 7 ARG CB C 7 27.788 27.788 28.252 -0.464 18980
28 1 1 . 1 1 7 7 ARG H H 7 8.184 8.184 8.893 -0.709 18980
29 1 1 . 1 1 8 8 ASN N N 8 118.773 118.773 119.084 -0.311 18980
30 1 1 . 1 1 8 8 ASN HA H 8 4.570 4.570 4.698 -0.128 18980
31 1 1 . 1 1 8 8 ASN CA C 8 50.518 50.518 54.276 -3.758 18980
32 1 1 . 1 1 8 8 ASN CB C 8 35.894 35.894 39.691 -3.797 18980
33 1 1 . 1 1 8 8 ASN H H 8 8.294 8.294 8.557 -0.263 18980
34 1 1 . 1 1 9 9 GLN N N 9 120.522 120.522 118.207 2.315 18980
35 1 1 . 1 1 9 9 GLN HA H 9 4.245 4.245 4.344 -0.099 18980
36 1 1 . 1 1 9 9 GLN CA C 9 53.202 53.202 56.005 -2.803 18980
37 1 1 . 1 1 9 9 GLN CB C 9 26.688 26.688 29.983 -3.295 18980
38 1 1 . 1 1 9 9 GLN H H 9 8.218 8.218 7.842 0.376 18980
39 1 1 . 1 1 10 10 ARG N N 10 121.826 121.826 122.877 -1.051 18980
40 1 1 . 1 1 10 10 ARG HA H 10 4.244 4.244 4.104 0.140 18980
41 1 1 . 1 1 10 10 ARG CA C 10 53.208 53.208 57.575 -4.367 18980
42 1 1 . 1 1 10 10 ARG CB C 10 27.939 27.939 29.891 -1.952 18980
43 1 1 . 1 1 10 10 ARG H H 10 8.273 8.273 8.166 0.107 18980
44 1 1 . 1 1 11 11 LYS N N 11 122.737 122.737 123.915 -1.178 18980
45 1 1 . 1 1 11 11 LYS HA H 11 4.263 4.263 3.936 0.328 18980
46 1 1 . 1 1 11 11 LYS CA C 11 53.578 53.578 58.604 -5.026 18980
47 1 1 . 1 1 11 11 LYS CB C 11 30.323 30.323 31.649 -1.326 18980
48 1 1 . 1 1 11 11 LYS H H 11 8.299 8.299 8.716 -0.417 18980
49 1 1 . 1 1 12 12 THR N N 12 116.442 116.442 113.321 3.121 18980
50 1 1 . 1 1 12 12 THR HA H 12 4.254 4.254 4.511 -0.257 18980
51 1 1 . 1 1 12 12 THR CA C 12 58.726 58.726 61.232 -2.506 18980
52 1 1 . 1 1 12 12 THR CB C 12 66.915 66.915 70.959 -4.044 18980
53 1 1 . 1 1 12 12 THR H H 12 8.088 8.088 7.971 0.117 18980
54 1 1 . 1 1 13 13 VAL N N 13 122.626 122.626 118.549 4.077 18980
55 1 1 . 1 1 13 13 VAL HA H 13 4.021 4.021 4.394 -0.373 18980
56 1 1 . 1 1 13 13 VAL CA C 13 58.497 58.497 59.824 -1.327 18980
57 1 1 . 1 1 13 13 VAL CB C 13 30.485 30.485 35.175 -4.690 18980
58 1 1 . 1 1 13 13 VAL H H 13 8.209 8.209 8.193 0.016 18980
59 1 1 . 1 1 14 14 LYS N N 14 123.504 123.504 128.343 -4.839 18980
60 1 1 . 1 1 14 14 LYS HA H 14 4.412 4.412 4.521 -0.109 18980
61 1 1 . 1 1 14 14 LYS CA C 14 51.599 51.599 54.413 -2.814 18980
62 1 1 . 1 1 14 14 LYS CB C 14 31.540 31.540 34.785 -3.244 18980
63 1 1 . 1 1 14 14 LYS H H 14 8.012 8.012 8.102 -0.090 18980
64 1 1 . 1 1 15 15 CYS N N 15 129.731 129.731 126.200 3.531 18980
65 1 1 . 1 1 15 15 CYS HA H 15 4.215 4.215 4.141 0.074 18980
66 1 1 . 1 1 15 15 CYS CA C 15 56.967 56.967 58.988 -2.021 18980
67 1 1 . 1 1 15 15 CYS CB C 15 27.829 27.829 27.534 0.295 18980
68 1 1 . 1 1 15 15 CYS H H 15 8.256 8.256 8.439 -0.183 18980
69 1 1 . 1 1 16 16 PHE N N 16 128.836 128.836 123.754 5.082 18980
70 1 1 . 1 1 16 16 PHE HA H 16 4.615 4.615 4.359 0.256 18980
71 1 1 . 1 1 16 16 PHE CA C 16 56.137 56.137 57.907 -1.770 18980
72 1 1 . 1 1 16 16 PHE CB C 16 37.103 37.103 38.884 -1.781 18980
73 1 1 . 1 1 16 16 PHE H H 16 9.299 9.299 8.449 0.850 18980
74 1 1 . 1 1 17 17 ASN N N 17 118.280 118.280 117.272 1.008 18980
75 1 1 . 1 1 17 17 ASN HA H 17 3.816 3.816 4.178 -0.362 18980
76 1 1 . 1 1 17 17 ASN CA C 17 53.075 53.075 55.157 -2.082 18980
77 1 1 . 1 1 17 17 ASN CB C 17 36.212 36.212 38.629 -2.417 18980
78 1 1 . 1 1 17 17 ASN H H 17 9.156 9.156 7.564 1.592 18980
79 1 1 . 1 1 18 18 CYS N N 18 116.876 116.876 113.681 3.195 18980
80 1 1 . 1 1 18 18 CYS HA H 18 4.696 4.696 4.928 -0.232 18980
81 1 1 . 1 1 18 18 CYS CA C 18 56.126 56.126 58.794 -2.668 18980
82 1 1 . 1 1 18 18 CYS CB C 18 29.066 29.066 27.796 1.270 18980
83 1 1 . 1 1 18 18 CYS H H 18 8.489 8.489 7.583 0.906 18980
84 1 1 . 1 1 19 19 GLY N N 19 112.394 112.394 109.971 2.423 18980
85 1 1 . 1 1 19 19 GLY CA C 19 43.589 43.589 44.930 -1.341 18980
86 1 1 . 1 1 19 19 GLY H H 19 7.703 7.703 8.294 -0.591 18980
87 1 1 . 1 1 20 20 LYS N N 20 120.951 120.951 122.053 -1.102 18980
88 1 1 . 1 1 20 20 LYS HA H 20 4.364 4.364 4.400 -0.036 18980
89 1 1 . 1 1 20 20 LYS CA C 20 53.066 53.066 55.837 -2.771 18980
90 1 1 . 1 1 20 20 LYS CB C 20 30.653 30.653 33.938 -3.285 18980
91 1 1 . 1 1 20 20 LYS H H 20 8.162 8.162 7.438 0.724 18980
92 1 1 . 1 1 21 21 GLU N N 21 119.095 119.095 121.955 -2.860 18980
93 1 1 . 1 1 21 21 GLU HA H 21 4.602 4.602 4.520 0.082 18980
94 1 1 . 1 1 21 21 GLU CA C 21 53.327 53.327 58.072 -4.745 18980
95 1 1 . 1 1 21 21 GLU CB C 21 28.049 28.049 30.324 -2.275 18980
96 1 1 . 1 1 21 21 GLU H H 21 8.454 8.454 8.644 -0.190 18980
97 1 1 . 1 1 22 22 GLY N N 22 107.727 107.727 108.560 -0.833 18980
98 1 1 . 1 1 22 22 GLY CA C 22 42.965 42.965 45.942 -2.977 18980
99 1 1 . 1 1 22 22 GLY H H 22 8.639 8.639 8.539 0.100 18980
100 1 1 . 1 1 23 23 HIS N N 23 113.019 113.019 115.897 -2.878 18980
101 1 1 . 1 1 23 23 HIS HA H 23 4.613 4.613 4.767 -0.154 18980
102 1 1 . 1 1 23 23 HIS CA C 23 52.409 52.409 54.664 -2.255 18980
103 1 1 . 1 1 23 23 HIS CB C 23 27.389 27.389 31.282 -3.893 18980
104 1 1 . 1 1 23 23 HIS H H 23 6.992 6.992 7.368 -0.376 18980
105 1 1 . 1 1 24 24 ILE N N 24 105.931 105.931 112.415 -6.484 18980
106 1 1 . 1 1 24 24 ILE HA H 24 4.313 4.313 4.340 -0.027 18980
107 1 1 . 1 1 24 24 ILE CA C 24 56.515 56.515 58.225 -1.710 18980
108 1 1 . 1 1 24 24 ILE CB C 24 38.320 38.320 41.561 -3.241 18980
109 1 1 . 1 1 24 24 ILE H H 24 7.578 7.578 7.989 -0.411 18980
110 1 1 . 1 1 25 25 ALA N N 25 122.665 122.665 124.993 -2.328 18980
111 1 1 . 1 1 25 25 ALA HA H 25 4.521 4.521 3.810 0.711 18980
112 1 1 . 1 1 25 25 ALA CA C 25 53.097 53.097 54.857 -1.760 18980
113 1 1 . 1 1 25 25 ALA CB C 25 16.460 16.460 18.029 -1.569 18980
114 1 1 . 1 1 25 25 ALA H H 25 8.944 8.944 8.420 0.524 18980
115 1 1 . 1 1 26 26 LYS N N 26 117.327 117.327 115.276 2.051 18980
116 1 1 . 1 1 26 26 LYS HA H 26 2.735 2.735 4.085 -1.350 18980
117 1 1 . 1 1 26 26 LYS CA C 26 55.268 55.268 58.490 -3.222 18980
118 1 1 . 1 1 26 26 LYS CB C 26 31.527 31.527 32.327 -0.800 18980
119 1 1 . 1 1 26 26 LYS H H 26 6.448 6.448 8.219 -1.771 18980
120 1 1 . 1 1 27 27 ASN N N 27 111.844 111.844 116.163 -4.319 18980
121 1 1 . 1 1 27 27 ASN HA H 27 4.844 4.844 4.693 0.151 18980
122 1 1 . 1 1 27 27 ASN CA C 27 48.766 48.766 53.084 -4.318 18980
123 1 1 . 1 1 27 27 ASN CB C 27 37.372 37.372 39.649 -2.277 18980
124 1 1 . 1 1 27 27 ASN H H 27 7.536 7.536 7.683 -0.147 18980
125 1 1 . 1 1 28 28 CYS N N 28 122.908 122.908 119.747 3.161 18980
126 1 1 . 1 1 28 28 CYS HA H 28 3.590 3.590 4.177 -0.587 18980
127 1 1 . 1 1 28 28 CYS CA C 28 58.923 58.923 60.229 -1.306 18980
128 1 1 . 1 1 28 28 CYS CB C 28 28.111 28.111 28.216 -0.105 18980
129 1 1 . 1 1 28 28 CYS H H 28 7.195 7.195 7.803 -0.608 18980
130 1 1 . 1 1 29 29 ARG N N 29 129.416 129.416 124.819 4.597 18980
131 1 1 . 1 1 29 29 ARG HA H 29 4.446 4.446 4.434 0.012 18980
132 1 1 . 1 1 29 29 ARG CA C 29 52.480 52.480 55.542 -3.062 18980
133 1 1 . 1 1 29 29 ARG CB C 29 27.564 27.564 30.584 -3.020 18980
134 1 1 . 1 1 29 29 ARG H H 29 8.885 8.885 8.530 0.355 18980
135 1 1 . 1 1 30 30 ALA N N 30 127.959 127.959 125.126 2.833 18980
136 1 1 . 1 1 30 30 ALA HA H 30 4.475 4.475 4.463 0.012 18980
137 1 1 . 1 1 30 30 ALA CA C 30 48.220 48.220 50.714 -2.494 18980
138 1 1 . 1 1 30 30 ALA CB C 30 15.112 15.112 18.614 -3.502 18980
139 1 1 . 1 1 30 30 ALA H H 30 8.744 8.744 7.434 1.310 18980
140 1 1 . 1 1 31 31 PRO HA H 31 4.238 4.238 4.498 -0.260 18980
141 1 1 . 1 1 31 31 PRO CA C 31 60.017 60.017 62.911 -2.894 18980
142 1 1 . 1 1 31 31 PRO CB C 31 28.726 28.726 32.854 -4.128 18980
143 1 1 . 1 1 32 32 ARG N N 32 123.635 123.635 122.999 0.636 18980
144 1 1 . 1 1 32 32 ARG HA H 32 4.391 4.391 4.675 -0.284 18980
145 1 1 . 1 1 32 32 ARG CA C 32 53.336 53.336 55.502 -2.166 18980
146 1 1 . 1 1 32 32 ARG CB C 32 27.689 27.689 31.407 -3.718 18980
147 1 1 . 1 1 32 32 ARG H H 32 8.740 8.740 8.455 0.285 18980
148 1 1 . 1 1 33 33 LYS N N 33 127.972 127.972 123.753 4.219 18980
149 1 1 . 1 1 33 33 LYS HA H 33 4.339 4.339 4.364 -0.025 18980
150 1 1 . 1 1 33 33 LYS CA C 33 53.372 53.372 56.622 -3.250 18980
151 1 1 . 1 1 33 33 LYS CB C 33 30.439 30.439 33.108 -2.668 18980
152 1 1 . 1 1 33 33 LYS H H 33 8.868 8.868 8.772 0.096 18980
153 1 1 . 1 1 34 34 LYS N N 34 120.697 120.697 120.175 0.522 18980
154 1 1 . 1 1 34 34 LYS HA H 34 4.393 4.393 4.353 0.040 18980
155 1 1 . 1 1 34 34 LYS CA C 34 54.385 54.385 56.036 -1.651 18980
156 1 1 . 1 1 34 34 LYS CB C 34 30.651 30.651 32.626 -1.975 18980
157 1 1 . 1 1 34 34 LYS H H 34 8.300 8.300 8.581 -0.281 18980
158 1 1 . 1 1 35 35 GLY N N 35 109.787 109.787 105.709 4.078 18980
159 1 1 . 1 1 35 35 GLY CA C 35 40.646 40.646 44.557 -3.911 18980
160 1 1 . 1 1 35 35 GLY H H 35 8.518 8.518 7.346 1.172 18980
161 1 1 . 1 1 36 36 CYS N N 36 122.657 122.657 119.880 2.777 18980
162 1 1 . 1 1 36 36 CYS HA H 36 3.994 3.994 4.116 -0.122 18980
163 1 1 . 1 1 36 36 CYS CA C 36 57.328 57.328 58.578 -1.250 18980
164 1 1 . 1 1 36 36 CYS CB C 36 27.259 27.259 28.074 -0.815 18980
165 1 1 . 1 1 36 36 CYS H H 36 8.249 8.249 8.042 0.207 18980
166 1 1 . 1 1 37 37 TRP N N 37 132.646 132.646 125.817 6.829 18980
167 1 1 . 1 1 37 37 TRP HA H 37 4.763 4.763 4.605 0.158 18980
168 1 1 . 1 1 37 37 TRP CA C 37 54.955 54.955 57.285 -2.330 18980
169 1 1 . 1 1 37 37 TRP CB C 37 26.102 26.102 29.157 -3.055 18980
170 1 1 . 1 1 37 37 TRP H H 37 9.218 9.218 8.308 0.910 18980
171 1 1 . 1 1 38 38 LYS N N 38 121.676 121.676 117.677 3.999 18980
172 1 1 . 1 1 38 38 LYS HA H 38 4.200 4.200 4.133 0.067 18980
173 1 1 . 1 1 38 38 LYS CA C 38 55.916 55.916 57.842 -1.926 18980
174 1 1 . 1 1 38 38 LYS CB C 38 31.288 31.288 33.392 -2.104 18980
175 1 1 . 1 1 38 38 LYS H H 38 9.626 9.626 7.765 1.861 18980
176 1 1 . 1 1 39 39 CYS N N 39 117.746 117.746 114.184 3.562 18980
177 1 1 . 1 1 39 39 CYS HA H 39 4.929 4.929 4.958 -0.029 18980
178 1 1 . 1 1 39 39 CYS CA C 39 56.058 56.058 57.091 -1.033 18980
179 1 1 . 1 1 39 39 CYS CB C 39 29.705 29.705 29.728 -0.023 18980
180 1 1 . 1 1 39 39 CYS H H 39 8.612 8.612 7.892 0.720 18980
181 1 1 . 1 1 40 40 GLY N N 40 113.510 113.510 110.800 2.710 18980
182 1 1 . 1 1 40 40 GLY CA C 40 43.398 43.398 45.175 -1.777 18980
183 1 1 . 1 1 40 40 GLY H H 40 8.050 8.050 8.001 0.049 18980
184 1 1 . 1 1 41 41 LYS N N 41 121.911 121.911 121.696 0.215 18980
185 1 1 . 1 1 41 41 LYS HA H 41 4.296 4.296 4.407 -0.111 18980
186 1 1 . 1 1 41 41 LYS CA C 41 54.068 54.068 55.815 -1.746 18980
187 1 1 . 1 1 41 41 LYS CB C 41 30.765 30.765 33.474 -2.709 18980
188 1 1 . 1 1 41 41 LYS H H 41 8.340 8.340 7.508 0.832 18980
189 1 1 . 1 1 42 42 GLU N N 42 119.418 119.418 119.694 -0.276 18980
190 1 1 . 1 1 42 42 GLU HA H 42 4.116 4.116 4.227 -0.111 18980
191 1 1 . 1 1 42 42 GLU CA C 42 54.054 54.054 56.416 -2.362 18980
192 1 1 . 1 1 42 42 GLU CB C 42 27.786 27.786 30.283 -2.497 18980
193 1 1 . 1 1 42 42 GLU H H 42 8.501 8.501 8.446 0.055 18980
194 1 1 . 1 1 43 43 GLY N N 43 107.782 107.782 108.843 -1.061 18980
195 1 1 . 1 1 43 43 GLY CA C 43 42.789 42.789 45.658 -2.869 18980
196 1 1 . 1 1 43 43 GLY H H 43 8.719 8.719 8.584 0.135 18980
197 1 1 . 1 1 44 44 HIS N N 44 111.284 111.284 115.613 -4.329 18980
198 1 1 . 1 1 44 44 HIS HA H 44 4.587 4.587 4.722 -0.135 18980
199 1 1 . 1 1 44 44 HIS CA C 44 52.665 52.665 54.133 -1.468 18980
200 1 1 . 1 1 44 44 HIS CB C 44 27.416 27.416 30.487 -3.071 18980
201 1 1 . 1 1 44 44 HIS H H 44 6.810 6.810 7.712 -0.902 18980
202 1 1 . 1 1 45 45 GLN N N 45 117.297 117.297 118.963 -1.666 18980
203 1 1 . 1 1 45 45 GLN HA H 45 3.773 3.773 4.421 -0.648 18980
204 1 1 . 1 1 45 45 GLN CA C 45 51.454 51.454 54.238 -2.784 18980
205 1 1 . 1 1 45 45 GLN CB C 45 28.905 28.905 30.586 -1.681 18980
206 1 1 . 1 1 45 45 GLN H H 45 8.781 8.781 8.689 0.092 18980
207 1 1 . 1 1 46 46 MET N N 46 117.926 117.926 120.122 -2.196 18980
208 1 1 . 1 1 46 46 MET HA H 46 4.820 4.820 4.337 0.483 18980
209 1 1 . 1 1 46 46 MET CA C 46 57.542 57.542 58.032 -0.491 18980
210 1 1 . 1 1 46 46 MET CB C 46 29.549 29.549 32.407 -2.857 18980
211 1 1 . 1 1 46 46 MET H H 46 9.008 9.008 8.540 0.468 18980
212 1 1 . 1 1 47 47 LYS N N 47 117.631 117.631 115.770 1.861 18980
213 1 1 . 1 1 47 47 LYS HA H 47 3.448 3.448 4.241 -0.793 18980
214 1 1 . 1 1 47 47 LYS CA C 47 54.988 54.988 57.589 -2.601 18980
215 1 1 . 1 1 47 47 LYS CB C 47 28.285 28.285 32.012 -3.727 18980
216 1 1 . 1 1 47 47 LYS H H 47 6.430 6.430 7.585 -1.155 18980
217 1 1 . 1 1 48 48 ASP N N 48 117.363 117.363 120.441 -3.078 18980
218 1 1 . 1 1 48 48 ASP HA H 48 4.780 4.780 4.605 0.175 18980
219 1 1 . 1 1 48 48 ASP CA C 48 50.600 50.600 54.835 -4.235 18980
220 1 1 . 1 1 48 48 ASP CB C 48 40.029 40.029 41.718 -1.688 18980
221 1 1 . 1 1 48 48 ASP H H 48 7.560 7.560 8.098 -0.538 18980
222 1 1 . 1 1 49 49 CYS N N 49 122.910 122.910 120.488 2.422 18980
223 1 1 . 1 1 49 49 CYS HA H 49 3.682 3.682 4.376 -0.694 18980
224 1 1 . 1 1 49 49 CYS CA C 49 59.557 59.557 58.520 1.037 18980
225 1 1 . 1 1 49 49 CYS CB C 49 28.040 28.040 24.742 3.297 18980
226 1 1 . 1 1 49 49 CYS H H 49 7.091 7.091 8.056 -0.965 18980
227 1 1 . 1 1 50 50 THR N N 50 119.675 119.675 117.477 2.198 18980
228 1 1 . 1 1 50 50 THR HA H 50 4.293 4.293 4.440 -0.147 18980
229 1 1 . 1 1 50 50 THR CA C 50 58.855 58.855 61.867 -3.012 18980
230 1 1 . 1 1 50 50 THR CB C 50 66.355 66.355 69.292 -2.937 18980
231 1 1 . 1 1 50 50 THR H H 50 8.139 8.139 8.044 0.095 18980
232 1 1 . 1 1 51 51 GLU N N 51 124.935 124.935 122.488 2.447 18980
233 1 1 . 1 1 51 51 GLU HA H 51 4.164 4.164 4.320 -0.156 18980
234 1 1 . 1 1 51 51 GLU CA C 51 54.061 54.061 56.018 -1.957 18980
235 1 1 . 1 1 51 51 GLU CB C 51 27.130 27.130 30.174 -3.044 18980
236 1 1 . 1 1 51 51 GLU H H 51 8.551 8.551 8.242 0.309 18980
237 1 1 . 1 1 52 52 ARG N N 52 122.624 122.624 122.115 0.509 18980
238 1 1 . 1 1 52 52 ARG HA H 52 4.248 4.248 4.340 -0.092 18980
239 1 1 . 1 1 52 52 ARG CA C 52 53.402 53.402 56.179 -2.777 18980
240 1 1 . 1 1 52 52 ARG CB C 52 28.028 28.028 30.635 -2.607 18980
241 1 1 . 1 1 52 52 ARG H H 52 8.287 8.287 8.556 -0.269 18980
242 1 1 . 1 1 53 53 GLN N N 53 121.647 121.647 120.341 1.306 18980
243 1 1 . 1 1 53 53 GLN HA H 53 4.248 4.248 4.262 -0.014 18980
244 1 1 . 1 1 53 53 GLN CA C 53 52.946 52.946 55.670 -2.724 18980
245 1 1 . 1 1 53 53 GLN CB C 53 26.794 26.794 29.523 -2.729 18980
246 1 1 . 1 1 53 53 GLN H H 53 8.381 8.381 8.569 -0.188 18980
247 1 1 . 1 1 54 54 ALA N N 54 125.878 125.878 123.648 2.230 18980
248 1 1 . 1 1 54 54 ALA HA H 54 4.296 4.296 4.917 -0.621 18980
249 1 1 . 1 1 54 54 ALA CA C 54 49.575 49.575 51.698 -2.123 18980
250 1 1 . 1 1 54 54 ALA CB C 54 16.704 16.704 21.437 -4.733 18980
251 1 1 . 1 1 54 54 ALA H H 54 8.338 8.338 8.823 -0.485 18980
252 1 2 . 1 1 2 2 GLN N N 2 125.073 125.073 124.424 0.649 18980
253 1 2 . 1 1 2 2 GLN HA H 2 4.309 4.309 4.605 -0.296 18980
254 1 2 . 1 1 2 2 GLN CA C 2 52.755 52.755 55.121 -2.366 18980
255 1 2 . 1 1 2 2 GLN CB C 2 26.728 26.728 31.503 -4.775 18980
256 1 2 . 1 1 2 2 GLN H H 2 8.503 8.503 8.333 0.170 18980
257 1 2 . 1 1 3 3 LYS N N 3 123.202 123.202 120.888 2.314 18980
258 1 2 . 1 1 3 3 LYS HA H 3 4.271 4.271 4.172 0.099 18980
259 1 2 . 1 1 3 3 LYS CA C 3 53.658 53.658 56.326 -2.668 18980
260 1 2 . 1 1 3 3 LYS CB C 3 30.442 30.442 32.404 -1.962 18980
261 1 2 . 1 1 3 3 LYS H H 3 8.414 8.414 8.567 -0.153 18980
262 1 2 . 1 1 4 4 GLY N N 4 109.574 109.574 108.155 1.419 18980
263 1 2 . 1 1 4 4 GLY CA C 4 42.455 42.455 44.130 -1.675 18980
264 1 2 . 1 1 4 4 GLY H H 4 8.394 8.394 7.544 0.850 18980
265 1 2 . 1 1 5 5 ASN N N 5 118.311 118.311 119.368 -1.057 18980
266 1 2 . 1 1 5 5 ASN HA H 5 4.625 4.625 4.590 0.035 18980
267 1 2 . 1 1 5 5 ASN CA C 5 50.146 50.146 53.087 -2.941 18980
268 1 2 . 1 1 5 5 ASN CB C 5 36.059 36.059 38.714 -2.655 18980
269 1 2 . 1 1 5 5 ASN H H 5 8.240 8.240 8.089 0.151 18980
270 1 2 . 1 1 6 6 PHE N N 6 120.460 120.460 124.565 -4.105 18980
271 1 2 . 1 1 6 6 PHE HA H 6 4.541 4.541 4.477 0.064 18980
272 1 2 . 1 1 6 6 PHE CA C 6 55.112 55.112 56.947 -1.835 18980
273 1 2 . 1 1 6 6 PHE CB C 6 36.457 36.457 39.823 -3.366 18980
274 1 2 . 1 1 6 6 PHE H H 6 8.164 8.164 8.148 0.016 18980
275 1 2 . 1 1 7 7 ARG N N 7 121.606 121.606 122.183 -0.577 18980
276 1 2 . 1 1 7 7 ARG HA H 7 4.193 4.193 4.341 -0.148 18980
277 1 2 . 1 1 7 7 ARG CA C 7 53.586 53.586 56.004 -2.418 18980
278 1 2 . 1 1 7 7 ARG CB C 7 27.788 27.788 27.574 0.214 18980
279 1 2 . 1 1 7 7 ARG H H 7 8.184 8.184 9.000 -0.816 18980
280 1 2 . 1 1 8 8 ASN N N 8 118.773 118.773 119.517 -0.744 18980
281 1 2 . 1 1 8 8 ASN HA H 8 4.570 4.570 4.744 -0.174 18980
282 1 2 . 1 1 8 8 ASN CA C 8 50.518 50.518 54.455 -3.937 18980
283 1 2 . 1 1 8 8 ASN CB C 8 35.894 35.894 39.410 -3.516 18980
284 1 2 . 1 1 8 8 ASN H H 8 8.294 8.294 8.658 -0.364 18980
285 1 2 . 1 1 9 9 GLN N N 9 120.522 120.522 119.472 1.050 18980
286 1 2 . 1 1 9 9 GLN HA H 9 4.245 4.245 4.365 -0.120 18980
287 1 2 . 1 1 9 9 GLN CA C 9 53.202 53.202 56.884 -3.682 18980
288 1 2 . 1 1 9 9 GLN CB C 9 26.688 26.688 29.163 -2.475 18980
289 1 2 . 1 1 9 9 GLN H H 9 8.218 8.218 8.301 -0.083 18980
290 1 2 . 1 1 10 10 ARG N N 10 121.826 121.826 121.977 -0.151 18980
291 1 2 . 1 1 10 10 ARG HA H 10 4.244 4.244 4.340 -0.096 18980
292 1 2 . 1 1 10 10 ARG CA C 10 53.208 53.208 56.078 -2.869 18980
293 1 2 . 1 1 10 10 ARG CB C 10 27.939 27.939 30.627 -2.688 18980
294 1 2 . 1 1 10 10 ARG H H 10 8.273 8.273 8.271 0.002 18980
295 1 2 . 1 1 11 11 LYS N N 11 122.737 122.737 123.840 -1.103 18980
296 1 2 . 1 1 11 11 LYS HA H 11 4.263 4.263 4.026 0.237 18980
297 1 2 . 1 1 11 11 LYS CA C 11 53.578 53.578 58.281 -4.703 18980
298 1 2 . 1 1 11 11 LYS CB C 11 30.323 30.323 31.530 -1.207 18980
299 1 2 . 1 1 11 11 LYS H H 11 8.299 8.299 8.894 -0.595 18980
300 1 2 . 1 1 12 12 THR N N 12 116.442 116.442 113.259 3.183 18980
301 1 2 . 1 1 12 12 THR HA H 12 4.254 4.254 4.475 -0.221 18980
302 1 2 . 1 1 12 12 THR CA C 12 58.726 58.726 61.247 -2.521 18980
303 1 2 . 1 1 12 12 THR CB C 12 66.915 66.915 70.501 -3.586 18980
304 1 2 . 1 1 12 12 THR H H 12 8.088 8.088 7.881 0.207 18980
305 1 2 . 1 1 13 13 VAL N N 13 122.626 122.626 118.897 3.729 18980
306 1 2 . 1 1 13 13 VAL HA H 13 4.021 4.021 4.428 -0.407 18980
307 1 2 . 1 1 13 13 VAL CA C 13 58.497 58.497 60.339 -1.842 18980
308 1 2 . 1 1 13 13 VAL CB C 13 30.485 30.485 35.178 -4.692 18980
309 1 2 . 1 1 13 13 VAL H H 13 8.209 8.209 8.210 -0.001 18980
310 1 2 . 1 1 14 14 LYS N N 14 123.504 123.504 128.014 -4.510 18980
311 1 2 . 1 1 14 14 LYS HA H 14 4.412 4.412 4.521 -0.109 18980
312 1 2 . 1 1 14 14 LYS CA C 14 51.599 51.599 54.242 -2.643 18980
313 1 2 . 1 1 14 14 LYS CB C 14 31.540 31.540 34.820 -3.280 18980
314 1 2 . 1 1 14 14 LYS H H 14 8.012 8.012 8.071 -0.059 18980
315 1 2 . 1 1 15 15 CYS N N 15 129.731 129.731 126.212 3.519 18980
316 1 2 . 1 1 15 15 CYS HA H 15 4.215 4.215 4.062 0.153 18980
317 1 2 . 1 1 15 15 CYS CA C 15 56.967 56.967 58.698 -1.731 18980
318 1 2 . 1 1 15 15 CYS CB C 15 27.829 27.829 27.573 0.256 18980
319 1 2 . 1 1 15 15 CYS H H 15 8.256 8.256 8.468 -0.212 18980
320 1 2 . 1 1 16 16 PHE N N 16 128.836 128.836 123.623 5.213 18980
321 1 2 . 1 1 16 16 PHE HA H 16 4.615 4.615 4.318 0.297 18980
322 1 2 . 1 1 16 16 PHE CA C 16 56.137 56.137 57.480 -1.343 18980
323 1 2 . 1 1 16 16 PHE CB C 16 37.103 37.103 38.738 -1.635 18980
324 1 2 . 1 1 16 16 PHE H H 16 9.299 9.299 8.255 1.044 18980
325 1 2 . 1 1 17 17 ASN N N 17 118.280 118.280 117.093 1.187 18980
326 1 2 . 1 1 17 17 ASN HA H 17 3.816 3.816 4.054 -0.238 18980
327 1 2 . 1 1 17 17 ASN CA C 17 53.075 53.075 55.409 -2.334 18980
328 1 2 . 1 1 17 17 ASN CB C 17 36.212 36.212 38.833 -2.621 18980
329 1 2 . 1 1 17 17 ASN H H 17 9.156 9.156 7.461 1.695 18980
330 1 2 . 1 1 18 18 CYS N N 18 116.876 116.876 114.122 2.754 18980
331 1 2 . 1 1 18 18 CYS HA H 18 4.696 4.696 4.757 -0.061 18980
332 1 2 . 1 1 18 18 CYS CA C 18 56.126 56.126 57.849 -1.723 18980
333 1 2 . 1 1 18 18 CYS CB C 18 29.066 29.066 28.426 0.640 18980
334 1 2 . 1 1 18 18 CYS H H 18 8.489 8.489 7.417 1.072 18980
335 1 2 . 1 1 19 19 GLY N N 19 112.394 112.394 111.375 1.019 18980
336 1 2 . 1 1 19 19 GLY CA C 19 43.589 43.589 45.452 -1.863 18980
337 1 2 . 1 1 19 19 GLY H H 19 7.703 7.703 8.138 -0.435 18980
338 1 2 . 1 1 20 20 LYS N N 20 120.951 120.951 120.432 0.519 18980
339 1 2 . 1 1 20 20 LYS HA H 20 4.364 4.364 4.482 -0.118 18980
340 1 2 . 1 1 20 20 LYS CA C 20 53.066 53.066 54.685 -1.619 18980
341 1 2 . 1 1 20 20 LYS CB C 20 30.653 30.653 34.194 -3.541 18980
342 1 2 . 1 1 20 20 LYS H H 20 8.162 8.162 7.277 0.885 18980
343 1 2 . 1 1 21 21 GLU N N 21 119.095 119.095 120.180 -1.085 18980
344 1 2 . 1 1 21 21 GLU HA H 21 4.602 4.602 4.448 0.154 18980
345 1 2 . 1 1 21 21 GLU CA C 21 53.327 53.327 58.006 -4.679 18980
346 1 2 . 1 1 21 21 GLU CB C 21 28.049 28.049 30.170 -2.121 18980
347 1 2 . 1 1 21 21 GLU H H 21 8.454 8.454 8.743 -0.289 18980
348 1 2 . 1 1 22 22 GLY N N 22 107.727 107.727 108.713 -0.986 18980
349 1 2 . 1 1 22 22 GLY CA C 22 42.965 42.965 45.991 -3.026 18980
350 1 2 . 1 1 22 22 GLY H H 22 8.639 8.639 8.450 0.189 18980
351 1 2 . 1 1 23 23 HIS N N 23 113.019 113.019 115.058 -2.039 18980
352 1 2 . 1 1 23 23 HIS HA H 23 4.613 4.613 5.060 -0.447 18980
353 1 2 . 1 1 23 23 HIS CA C 23 52.409 52.409 54.864 -2.455 18980
354 1 2 . 1 1 23 23 HIS CB C 23 27.389 27.389 31.577 -4.188 18980
355 1 2 . 1 1 23 23 HIS H H 23 6.992 6.992 7.199 -0.207 18980
356 1 2 . 1 1 24 24 ILE N N 24 105.931 105.931 113.366 -7.435 18980
357 1 2 . 1 1 24 24 ILE HA H 24 4.313 4.313 4.316 -0.003 18980
358 1 2 . 1 1 24 24 ILE CA C 24 56.515 56.515 58.372 -1.857 18980
359 1 2 . 1 1 24 24 ILE CB C 24 38.320 38.320 41.645 -3.325 18980
360 1 2 . 1 1 24 24 ILE H H 24 7.578 7.578 8.766 -1.188 18980
361 1 2 . 1 1 25 25 ALA N N 25 122.665 122.665 124.681 -2.016 18980
362 1 2 . 1 1 25 25 ALA HA H 25 4.521 4.521 3.794 0.727 18980
363 1 2 . 1 1 25 25 ALA CA C 25 53.097 53.097 54.809 -1.712 18980
364 1 2 . 1 1 25 25 ALA CB C 25 16.460 16.460 17.783 -1.323 18980
365 1 2 . 1 1 25 25 ALA H H 25 8.944 8.944 8.342 0.602 18980
366 1 2 . 1 1 26 26 LYS N N 26 117.327 117.327 117.693 -0.366 18980
367 1 2 . 1 1 26 26 LYS HA H 26 2.735 2.735 4.117 -1.382 18980
368 1 2 . 1 1 26 26 LYS CA C 26 55.268 55.268 59.270 -4.003 18980
369 1 2 . 1 1 26 26 LYS CB C 26 31.527 31.527 32.373 -0.846 18980
370 1 2 . 1 1 26 26 LYS H H 26 6.448 6.448 8.410 -1.962 18980
371 1 2 . 1 1 27 27 ASN N N 27 111.844 111.844 114.424 -2.580 18980
372 1 2 . 1 1 27 27 ASN HA H 27 4.844 4.844 4.734 0.110 18980
373 1 2 . 1 1 27 27 ASN CA C 27 48.766 48.766 52.138 -3.372 18980
374 1 2 . 1 1 27 27 ASN CB C 27 37.372 37.372 38.350 -0.978 18980
375 1 2 . 1 1 27 27 ASN H H 27 7.536 7.536 7.770 -0.234 18980
376 1 2 . 1 1 28 28 CYS N N 28 122.908 122.908 119.598 3.310 18980
377 1 2 . 1 1 28 28 CYS HA H 28 3.590 3.590 4.091 -0.501 18980
378 1 2 . 1 1 28 28 CYS CA C 28 58.923 58.923 60.316 -1.393 18980
379 1 2 . 1 1 28 28 CYS CB C 28 28.111 28.111 27.954 0.157 18980
380 1 2 . 1 1 28 28 CYS H H 28 7.195 7.195 7.997 -0.802 18980
381 1 2 . 1 1 29 29 ARG N N 29 129.416 129.416 126.540 2.876 18980
382 1 2 . 1 1 29 29 ARG HA H 29 4.446 4.446 4.533 -0.087 18980
383 1 2 . 1 1 29 29 ARG CA C 29 52.480 52.480 55.628 -3.148 18980
384 1 2 . 1 1 29 29 ARG CB C 29 27.564 27.564 29.961 -2.397 18980
385 1 2 . 1 1 29 29 ARG H H 29 8.885 8.885 8.564 0.321 18980
386 1 2 . 1 1 30 30 ALA N N 30 127.959 127.959 125.615 2.344 18980
387 1 2 . 1 1 30 30 ALA HA H 30 4.475 4.475 4.542 -0.067 18980
388 1 2 . 1 1 30 30 ALA CA C 30 48.220 48.220 50.269 -2.049 18980
389 1 2 . 1 1 30 30 ALA CB C 30 15.112 15.112 18.165 -3.053 18980
390 1 2 . 1 1 30 30 ALA H H 30 8.744 8.744 7.456 1.288 18980
391 1 2 . 1 1 31 31 PRO HA H 31 4.238 4.238 4.439 -0.201 18980
392 1 2 . 1 1 31 31 PRO CA C 31 60.017 60.017 62.972 -2.955 18980
393 1 2 . 1 1 31 31 PRO CB C 31 28.726 28.726 32.431 -3.705 18980
394 1 2 . 1 1 32 32 ARG N N 32 123.635 123.635 122.108 1.527 18980
395 1 2 . 1 1 32 32 ARG HA H 32 4.391 4.391 4.839 -0.448 18980
396 1 2 . 1 1 32 32 ARG CA C 32 53.336 53.336 55.479 -2.143 18980
397 1 2 . 1 1 32 32 ARG CB C 32 27.689 27.689 32.087 -4.398 18980
398 1 2 . 1 1 32 32 ARG H H 32 8.740 8.740 8.354 0.386 18980
399 1 2 . 1 1 33 33 LYS N N 33 127.972 127.972 124.739 3.233 18980
400 1 2 . 1 1 33 33 LYS HA H 33 4.339 4.339 4.232 0.107 18980
401 1 2 . 1 1 33 33 LYS CA C 33 53.372 53.372 57.122 -3.750 18980
402 1 2 . 1 1 33 33 LYS CB C 33 30.439 30.439 33.137 -2.698 18980
403 1 2 . 1 1 33 33 LYS H H 33 8.868 8.868 8.590 0.278 18980
404 1 2 . 1 1 34 34 LYS N N 34 120.697 120.697 119.923 0.774 18980
405 1 2 . 1 1 34 34 LYS HA H 34 4.393 4.393 4.363 0.030 18980
406 1 2 . 1 1 34 34 LYS CA C 34 54.385 54.385 56.257 -1.872 18980
407 1 2 . 1 1 34 34 LYS CB C 34 30.651 30.651 32.244 -1.593 18980
408 1 2 . 1 1 34 34 LYS H H 34 8.300 8.300 8.576 -0.276 18980
409 1 2 . 1 1 35 35 GLY N N 35 109.787 109.787 106.450 3.337 18980
410 1 2 . 1 1 35 35 GLY CA C 35 40.646 40.646 44.437 -3.791 18980
411 1 2 . 1 1 35 35 GLY H H 35 8.518 8.518 7.387 1.131 18980
412 1 2 . 1 1 36 36 CYS N N 36 122.657 122.657 121.103 1.554 18980
413 1 2 . 1 1 36 36 CYS HA H 36 3.994 3.994 4.178 -0.184 18980
414 1 2 . 1 1 36 36 CYS CA C 36 57.328 57.328 58.451 -1.123 18980
415 1 2 . 1 1 36 36 CYS CB C 36 27.259 27.259 27.439 -0.180 18980
416 1 2 . 1 1 36 36 CYS H H 36 8.249 8.249 8.233 0.016 18980
417 1 2 . 1 1 37 37 TRP N N 37 132.646 132.646 125.842 6.804 18980
418 1 2 . 1 1 37 37 TRP HA H 37 4.763 4.763 4.594 0.169 18980
419 1 2 . 1 1 37 37 TRP CA C 37 54.955 54.955 57.469 -2.514 18980
420 1 2 . 1 1 37 37 TRP CB C 37 26.102 26.102 29.120 -3.018 18980
421 1 2 . 1 1 37 37 TRP H H 37 9.218 9.218 8.415 0.803 18980
422 1 2 . 1 1 38 38 LYS N N 38 121.676 121.676 116.600 5.076 18980
423 1 2 . 1 1 38 38 LYS HA H 38 4.200 4.200 4.251 -0.051 18980
424 1 2 . 1 1 38 38 LYS CA C 38 55.916 55.916 56.892 -0.977 18980
425 1 2 . 1 1 38 38 LYS CB C 38 31.288 31.288 33.654 -2.366 18980
426 1 2 . 1 1 38 38 LYS H H 38 9.626 9.626 7.797 1.829 18980
427 1 2 . 1 1 39 39 CYS N N 39 117.746 117.746 113.156 4.590 18980
428 1 2 . 1 1 39 39 CYS HA H 39 4.929 4.929 4.884 0.045 18980
429 1 2 . 1 1 39 39 CYS CA C 39 56.058 56.058 57.535 -1.477 18980
430 1 2 . 1 1 39 39 CYS CB C 39 29.705 29.705 29.478 0.227 18980
431 1 2 . 1 1 39 39 CYS H H 39 8.612 8.612 7.687 0.925 18980
432 1 2 . 1 1 40 40 GLY N N 40 113.510 113.510 111.156 2.354 18980
433 1 2 . 1 1 40 40 GLY CA C 40 43.398 43.398 45.416 -2.018 18980
434 1 2 . 1 1 40 40 GLY H H 40 8.050 8.050 7.954 0.096 18980
435 1 2 . 1 1 41 41 LYS N N 41 121.911 121.911 121.640 0.271 18980
436 1 2 . 1 1 41 41 LYS HA H 41 4.296 4.296 4.344 -0.048 18980
437 1 2 . 1 1 41 41 LYS CA C 41 54.068 54.068 55.886 -1.817 18980
438 1 2 . 1 1 41 41 LYS CB C 41 30.765 30.765 33.382 -2.617 18980
439 1 2 . 1 1 41 41 LYS H H 41 8.340 8.340 7.474 0.866 18980
440 1 2 . 1 1 42 42 GLU N N 42 119.418 119.418 119.523 -0.105 18980
441 1 2 . 1 1 42 42 GLU HA H 42 4.116 4.116 4.021 0.095 18980
442 1 2 . 1 1 42 42 GLU CA C 42 54.054 54.054 56.669 -2.615 18980
443 1 2 . 1 1 42 42 GLU CB C 42 27.786 27.786 30.055 -2.269 18980
444 1 2 . 1 1 42 42 GLU H H 42 8.501 8.501 8.415 0.086 18980
445 1 2 . 1 1 43 43 GLY N N 43 107.782 107.782 111.774 -3.992 18980
446 1 2 . 1 1 43 43 GLY CA C 43 42.789 42.789 45.576 -2.787 18980
447 1 2 . 1 1 43 43 GLY H H 43 8.719 8.719 8.658 0.061 18980
448 1 2 . 1 1 44 44 HIS N N 44 111.284 111.284 121.318 -10.034 18980
449 1 2 . 1 1 44 44 HIS HA H 44 4.587 4.587 4.657 -0.070 18980
450 1 2 . 1 1 44 44 HIS CA C 44 52.665 52.665 54.895 -2.230 18980
451 1 2 . 1 1 44 44 HIS CB C 44 27.416 27.416 30.654 -3.238 18980
452 1 2 . 1 1 44 44 HIS H H 44 6.810 6.810 7.893 -1.083 18980
453 1 2 . 1 1 45 45 GLN N N 45 117.297 117.297 118.399 -1.102 18980
454 1 2 . 1 1 45 45 GLN HA H 45 3.773 3.773 4.389 -0.616 18980
455 1 2 . 1 1 45 45 GLN CA C 45 51.454 51.454 54.292 -2.838 18980
456 1 2 . 1 1 45 45 GLN CB C 45 28.905 28.905 30.680 -1.776 18980
457 1 2 . 1 1 45 45 GLN H H 45 8.781 8.781 8.710 0.071 18980
458 1 2 . 1 1 46 46 MET N N 46 117.926 117.926 120.986 -3.060 18980
459 1 2 . 1 1 46 46 MET HA H 46 4.820 4.820 4.313 0.507 18980
460 1 2 . 1 1 46 46 MET CA C 46 57.542 57.542 58.863 -1.321 18980
461 1 2 . 1 1 46 46 MET CB C 46 29.549 29.549 32.420 -2.871 18980
462 1 2 . 1 1 46 46 MET H H 46 9.008 9.008 8.708 0.300 18980
463 1 2 . 1 1 47 47 LYS N N 47 117.631 117.631 116.557 1.074 18980
464 1 2 . 1 1 47 47 LYS HA H 47 3.448 3.448 4.165 -0.717 18980
465 1 2 . 1 1 47 47 LYS CA C 47 54.988 54.988 57.688 -2.700 18980
466 1 2 . 1 1 47 47 LYS CB C 47 28.285 28.285 31.790 -3.505 18980
467 1 2 . 1 1 47 47 LYS H H 47 6.430 6.430 8.011 -1.581 18980
468 1 2 . 1 1 48 48 ASP N N 48 117.363 117.363 120.178 -2.815 18980
469 1 2 . 1 1 48 48 ASP HA H 48 4.780 4.780 4.589 0.191 18980
470 1 2 . 1 1 48 48 ASP CA C 48 50.600 50.600 54.944 -4.344 18980
471 1 2 . 1 1 48 48 ASP CB C 48 40.029 40.029 41.916 -1.887 18980
472 1 2 . 1 1 48 48 ASP H H 48 7.560 7.560 7.800 -0.240 18980
473 1 2 . 1 1 49 49 CYS N N 49 122.910 122.910 118.176 4.734 18980
474 1 2 . 1 1 49 49 CYS HA H 49 3.682 3.682 4.140 -0.458 18980
475 1 2 . 1 1 49 49 CYS CA C 49 59.557 59.557 60.520 -0.963 18980
476 1 2 . 1 1 49 49 CYS CB C 49 28.040 28.040 28.461 -0.421 18980
477 1 2 . 1 1 49 49 CYS H H 49 7.091 7.091 7.660 -0.570 18980
478 1 2 . 1 1 50 50 THR N N 50 119.675 119.675 116.032 3.643 18980
479 1 2 . 1 1 50 50 THR HA H 50 4.293 4.293 4.309 -0.016 18980
480 1 2 . 1 1 50 50 THR CA C 50 58.855 58.855 61.832 -2.977 18980
481 1 2 . 1 1 50 50 THR CB C 50 66.355 66.355 69.520 -3.165 18980
482 1 2 . 1 1 50 50 THR H H 50 8.139 8.139 8.323 -0.184 18980
483 1 2 . 1 1 51 51 GLU N N 51 124.935 124.935 122.598 2.337 18980
484 1 2 . 1 1 51 51 GLU HA H 51 4.164 4.164 4.512 -0.348 18980
485 1 2 . 1 1 51 51 GLU CA C 51 54.061 54.061 55.960 -1.899 18980
486 1 2 . 1 1 51 51 GLU CB C 51 27.130 27.130 31.141 -4.011 18980
487 1 2 . 1 1 51 51 GLU H H 51 8.551 8.551 7.585 0.966 18980
488 1 2 . 1 1 52 52 ARG N N 52 122.624 122.624 121.593 1.031 18980
489 1 2 . 1 1 52 52 ARG HA H 52 4.248 4.248 4.533 -0.285 18980
490 1 2 . 1 1 52 52 ARG CA C 52 53.402 53.402 55.608 -2.206 18980
491 1 2 . 1 1 52 52 ARG CB C 52 28.028 28.028 30.643 -2.615 18980
492 1 2 . 1 1 52 52 ARG H H 52 8.287 8.287 8.642 -0.355 18980
493 1 2 . 1 1 53 53 GLN N N 53 121.647 121.647 120.838 0.809 18980
494 1 2 . 1 1 53 53 GLN HA H 53 4.248 4.248 4.434 -0.186 18980
495 1 2 . 1 1 53 53 GLN CA C 53 52.946 52.946 55.627 -2.681 18980
496 1 2 . 1 1 53 53 GLN CB C 53 26.794 26.794 29.039 -2.245 18980
497 1 2 . 1 1 53 53 GLN H H 53 8.381 8.381 7.781 0.600 18980
498 1 2 . 1 1 54 54 ALA N N 54 125.878 125.878 125.307 0.571 18980
499 1 2 . 1 1 54 54 ALA HA H 54 4.296 4.296 4.238 0.058 18980
500 1 2 . 1 1 54 54 ALA CA C 54 49.575 49.575 52.785 -3.209 18980
501 1 2 . 1 1 54 54 ALA CB C 54 16.704 16.704 18.917 -2.213 18980
502 1 2 . 1 1 54 54 ALA H H 54 8.338 8.338 8.430 -0.092 18980
503 1 3 . 1 1 2 2 GLN N N 2 125.073 125.073 122.844 2.229 18980
504 1 3 . 1 1 2 2 GLN HA H 2 4.309 4.309 4.543 -0.234 18980
505 1 3 . 1 1 2 2 GLN CA C 2 52.755 52.755 54.759 -2.004 18980
506 1 3 . 1 1 2 2 GLN CB C 2 26.728 26.728 31.999 -5.271 18980
507 1 3 . 1 1 2 2 GLN H H 2 8.503 8.503 8.405 0.098 18980
508 1 3 . 1 1 3 3 LYS N N 3 123.202 123.202 122.230 0.972 18980
509 1 3 . 1 1 3 3 LYS HA H 3 4.271 4.271 4.003 0.268 18980
510 1 3 . 1 1 3 3 LYS CA C 3 53.658 53.658 57.593 -3.935 18980
511 1 3 . 1 1 3 3 LYS CB C 3 30.442 30.442 32.226 -1.784 18980
512 1 3 . 1 1 3 3 LYS H H 3 8.414 8.414 8.707 -0.293 18980
513 1 3 . 1 1 4 4 GLY N N 4 109.574 109.574 106.433 3.141 18980
514 1 3 . 1 1 4 4 GLY CA C 4 42.455 42.455 44.244 -1.789 18980
515 1 3 . 1 1 4 4 GLY H H 4 8.394 8.394 7.993 0.401 18980
516 1 3 . 1 1 5 5 ASN N N 5 118.311 118.311 118.988 -0.677 18980
517 1 3 . 1 1 5 5 ASN HA H 5 4.625 4.625 4.483 0.142 18980
518 1 3 . 1 1 5 5 ASN CA C 5 50.146 50.146 53.332 -3.186 18980
519 1 3 . 1 1 5 5 ASN CB C 5 36.059 36.059 38.971 -2.913 18980
520 1 3 . 1 1 5 5 ASN H H 5 8.240 8.240 7.708 0.532 18980
521 1 3 . 1 1 6 6 PHE N N 6 120.460 120.460 118.532 1.928 18980
522 1 3 . 1 1 6 6 PHE HA H 6 4.541 4.541 4.765 -0.224 18980
523 1 3 . 1 1 6 6 PHE CA C 6 55.112 55.112 56.637 -1.525 18980
524 1 3 . 1 1 6 6 PHE CB C 6 36.457 36.457 41.872 -5.415 18980
525 1 3 . 1 1 6 6 PHE H H 6 8.164 8.164 8.046 0.118 18980
526 1 3 . 1 1 7 7 ARG N N 7 121.606 121.606 122.672 -1.066 18980
527 1 3 . 1 1 7 7 ARG HA H 7 4.193 4.193 4.299 -0.106 18980
528 1 3 . 1 1 7 7 ARG CA C 7 53.586 53.586 56.323 -2.737 18980
529 1 3 . 1 1 7 7 ARG CB C 7 27.788 27.788 28.070 -0.282 18980
530 1 3 . 1 1 7 7 ARG H H 7 8.184 8.184 8.999 -0.815 18980
531 1 3 . 1 1 8 8 ASN N N 8 118.773 118.773 118.350 0.423 18980
532 1 3 . 1 1 8 8 ASN HA H 8 4.570 4.570 4.637 -0.067 18980
533 1 3 . 1 1 8 8 ASN CA C 8 50.518 50.518 55.004 -4.486 18980
534 1 3 . 1 1 8 8 ASN CB C 8 35.894 35.894 39.704 -3.810 18980
535 1 3 . 1 1 8 8 ASN H H 8 8.294 8.294 8.249 0.045 18980
536 1 3 . 1 1 9 9 GLN N N 9 120.522 120.522 115.700 4.822 18980
537 1 3 . 1 1 9 9 GLN HA H 9 4.245 4.245 4.440 -0.195 18980
538 1 3 . 1 1 9 9 GLN CA C 9 53.202 53.202 55.998 -2.796 18980
539 1 3 . 1 1 9 9 GLN CB C 9 26.688 26.688 30.556 -3.868 18980
540 1 3 . 1 1 9 9 GLN H H 9 8.218 8.218 8.085 0.133 18980
541 1 3 . 1 1 10 10 ARG N N 10 121.826 121.826 121.985 -0.159 18980
542 1 3 . 1 1 10 10 ARG HA H 10 4.244 4.244 4.208 0.036 18980
543 1 3 . 1 1 10 10 ARG CA C 10 53.208 53.208 57.131 -3.923 18980
544 1 3 . 1 1 10 10 ARG CB C 10 27.939 27.939 30.224 -2.285 18980
545 1 3 . 1 1 10 10 ARG H H 10 8.273 8.273 8.369 -0.096 18980
546 1 3 . 1 1 11 11 LYS N N 11 122.737 122.737 122.126 0.611 18980
547 1 3 . 1 1 11 11 LYS HA H 11 4.263 4.263 3.997 0.266 18980
548 1 3 . 1 1 11 11 LYS CA C 11 53.578 53.578 58.470 -4.892 18980
549 1 3 . 1 1 11 11 LYS CB C 11 30.323 30.323 31.436 -1.113 18980
550 1 3 . 1 1 11 11 LYS H H 11 8.299 8.299 8.969 -0.670 18980
551 1 3 . 1 1 12 12 THR N N 12 116.442 116.442 111.139 5.303 18980
552 1 3 . 1 1 12 12 THR HA H 12 4.254 4.254 4.424 -0.170 18980
553 1 3 . 1 1 12 12 THR CA C 12 58.726 58.726 61.051 -2.325 18980
554 1 3 . 1 1 12 12 THR CB C 12 66.915 66.915 70.297 -3.382 18980
555 1 3 . 1 1 12 12 THR H H 12 8.088 8.088 7.789 0.299 18980
556 1 3 . 1 1 13 13 VAL N N 13 122.626 122.626 119.803 2.823 18980
557 1 3 . 1 1 13 13 VAL HA H 13 4.021 4.021 4.427 -0.406 18980
558 1 3 . 1 1 13 13 VAL CA C 13 58.497 58.497 59.774 -1.277 18980
559 1 3 . 1 1 13 13 VAL CB C 13 30.485 30.485 34.977 -4.492 18980
560 1 3 . 1 1 13 13 VAL H H 13 8.209 8.209 8.127 0.082 18980
561 1 3 . 1 1 14 14 LYS N N 14 123.504 123.504 127.873 -4.369 18980
562 1 3 . 1 1 14 14 LYS HA H 14 4.412 4.412 4.410 0.002 18980
563 1 3 . 1 1 14 14 LYS CA C 14 51.599 51.599 54.380 -2.781 18980
564 1 3 . 1 1 14 14 LYS CB C 14 31.540 31.540 33.580 -2.040 18980
565 1 3 . 1 1 14 14 LYS H H 14 8.012 8.012 8.111 -0.099 18980
566 1 3 . 1 1 15 15 CYS N N 15 129.731 129.731 126.415 3.316 18980
567 1 3 . 1 1 15 15 CYS HA H 15 4.215 4.215 4.125 0.090 18980
568 1 3 . 1 1 15 15 CYS CA C 15 56.967 56.967 59.332 -2.365 18980
569 1 3 . 1 1 15 15 CYS CB C 15 27.829 27.829 28.350 -0.521 18980
570 1 3 . 1 1 15 15 CYS H H 15 8.256 8.256 8.181 0.075 18980
571 1 3 . 1 1 16 16 PHE N N 16 128.836 128.836 123.539 5.297 18980
572 1 3 . 1 1 16 16 PHE HA H 16 4.615 4.615 4.318 0.297 18980
573 1 3 . 1 1 16 16 PHE CA C 16 56.137 56.137 58.588 -2.451 18980
574 1 3 . 1 1 16 16 PHE CB C 16 37.103 37.103 38.794 -1.691 18980
575 1 3 . 1 1 16 16 PHE H H 16 9.299 9.299 8.407 0.892 18980
576 1 3 . 1 1 17 17 ASN N N 17 118.280 118.280 117.664 0.616 18980
577 1 3 . 1 1 17 17 ASN HA H 17 3.816 3.816 4.406 -0.590 18980
578 1 3 . 1 1 17 17 ASN CA C 17 53.075 53.075 55.035 -1.960 18980
579 1 3 . 1 1 17 17 ASN CB C 17 36.212 36.212 39.019 -2.807 18980
580 1 3 . 1 1 17 17 ASN H H 17 9.156 9.156 7.579 1.577 18980
581 1 3 . 1 1 18 18 CYS N N 18 116.876 116.876 113.383 3.493 18980
582 1 3 . 1 1 18 18 CYS HA H 18 4.696 4.696 4.814 -0.118 18980
583 1 3 . 1 1 18 18 CYS CA C 18 56.126 56.126 57.661 -1.535 18980
584 1 3 . 1 1 18 18 CYS CB C 18 29.066 29.066 28.205 0.861 18980
585 1 3 . 1 1 18 18 CYS H H 18 8.489 8.489 7.440 1.049 18980
586 1 3 . 1 1 19 19 GLY N N 19 112.394 112.394 110.304 2.090 18980
587 1 3 . 1 1 19 19 GLY CA C 19 43.589 43.589 45.202 -1.613 18980
588 1 3 . 1 1 19 19 GLY H H 19 7.703 7.703 8.367 -0.664 18980
589 1 3 . 1 1 20 20 LYS N N 20 120.951 120.951 121.512 -0.561 18980
590 1 3 . 1 1 20 20 LYS HA H 20 4.364 4.364 4.378 -0.014 18980
591 1 3 . 1 1 20 20 LYS CA C 20 53.066 53.066 55.174 -2.108 18980
592 1 3 . 1 1 20 20 LYS CB C 20 30.653 30.653 33.481 -2.828 18980
593 1 3 . 1 1 20 20 LYS H H 20 8.162 8.162 7.283 0.879 18980
594 1 3 . 1 1 21 21 GLU N N 21 119.095 119.095 120.818 -1.723 18980
595 1 3 . 1 1 21 21 GLU HA H 21 4.602 4.602 4.268 0.334 18980
596 1 3 . 1 1 21 21 GLU CA C 21 53.327 53.327 58.353 -5.026 18980
597 1 3 . 1 1 21 21 GLU CB C 21 28.049 28.049 30.074 -2.025 18980
598 1 3 . 1 1 21 21 GLU H H 21 8.454 8.454 8.807 -0.353 18980
599 1 3 . 1 1 22 22 GLY N N 22 107.727 107.727 108.833 -1.106 18980
600 1 3 . 1 1 22 22 GLY CA C 22 42.965 42.965 45.792 -2.827 18980
601 1 3 . 1 1 22 22 GLY H H 22 8.639 8.639 8.403 0.236 18980
602 1 3 . 1 1 23 23 HIS N N 23 113.019 113.019 116.288 -3.269 18980
603 1 3 . 1 1 23 23 HIS HA H 23 4.613 4.613 4.769 -0.156 18980
604 1 3 . 1 1 23 23 HIS CA C 23 52.409 52.409 54.670 -2.261 18980
605 1 3 . 1 1 23 23 HIS CB C 23 27.389 27.389 31.544 -4.155 18980
606 1 3 . 1 1 23 23 HIS H H 23 6.992 6.992 7.367 -0.375 18980
607 1 3 . 1 1 24 24 ILE N N 24 105.931 105.931 113.084 -7.153 18980
608 1 3 . 1 1 24 24 ILE HA H 24 4.313 4.313 4.343 -0.030 18980
609 1 3 . 1 1 24 24 ILE CA C 24 56.515 56.515 58.189 -1.674 18980
610 1 3 . 1 1 24 24 ILE CB C 24 38.320 38.320 41.324 -3.004 18980
611 1 3 . 1 1 24 24 ILE H H 24 7.578 7.578 7.964 -0.386 18980
612 1 3 . 1 1 25 25 ALA N N 25 122.665 122.665 125.070 -2.405 18980
613 1 3 . 1 1 25 25 ALA HA H 25 4.521 4.521 3.796 0.725 18980
614 1 3 . 1 1 25 25 ALA CA C 25 53.097 53.097 54.870 -1.773 18980
615 1 3 . 1 1 25 25 ALA CB C 25 16.460 16.460 18.043 -1.583 18980
616 1 3 . 1 1 25 25 ALA H H 25 8.944 8.944 8.423 0.521 18980
617 1 3 . 1 1 26 26 LYS N N 26 117.327 117.327 115.726 1.601 18980
618 1 3 . 1 1 26 26 LYS HA H 26 2.735 2.735 4.074 -1.339 18980
619 1 3 . 1 1 26 26 LYS CA C 26 55.268 55.268 58.490 -3.222 18980
620 1 3 . 1 1 26 26 LYS CB C 26 31.527 31.527 32.334 -0.806 18980
621 1 3 . 1 1 26 26 LYS H H 26 6.448 6.448 8.222 -1.774 18980
622 1 3 . 1 1 27 27 ASN N N 27 111.844 111.844 116.256 -4.412 18980
623 1 3 . 1 1 27 27 ASN HA H 27 4.844 4.844 4.669 0.175 18980
624 1 3 . 1 1 27 27 ASN CA C 27 48.766 48.766 53.108 -4.342 18980
625 1 3 . 1 1 27 27 ASN CB C 27 37.372 37.372 39.557 -2.186 18980
626 1 3 . 1 1 27 27 ASN H H 27 7.536 7.536 7.668 -0.132 18980
627 1 3 . 1 1 28 28 CYS N N 28 122.908 122.908 120.061 2.847 18980
628 1 3 . 1 1 28 28 CYS HA H 28 3.590 3.590 4.087 -0.497 18980
629 1 3 . 1 1 28 28 CYS CA C 28 58.923 58.923 60.148 -1.225 18980
630 1 3 . 1 1 28 28 CYS CB C 28 28.111 28.111 28.177 -0.066 18980
631 1 3 . 1 1 28 28 CYS H H 28 7.195 7.195 7.817 -0.622 18980
632 1 3 . 1 1 29 29 ARG N N 29 129.416 129.416 126.574 2.842 18980
633 1 3 . 1 1 29 29 ARG HA H 29 4.446 4.446 4.375 0.071 18980
634 1 3 . 1 1 29 29 ARG CA C 29 52.480 52.480 55.790 -3.310 18980
635 1 3 . 1 1 29 29 ARG CB C 29 27.564 27.564 30.345 -2.781 18980
636 1 3 . 1 1 29 29 ARG H H 29 8.885 8.885 8.532 0.353 18980
637 1 3 . 1 1 30 30 ALA N N 30 127.959 127.959 125.012 2.947 18980
638 1 3 . 1 1 30 30 ALA HA H 30 4.475 4.475 4.465 0.010 18980
639 1 3 . 1 1 30 30 ALA CA C 30 48.220 48.220 50.718 -2.498 18980
640 1 3 . 1 1 30 30 ALA CB C 30 15.112 15.112 18.244 -3.132 18980
641 1 3 . 1 1 30 30 ALA H H 30 8.744 8.744 7.359 1.385 18980
642 1 3 . 1 1 31 31 PRO HA H 31 4.238 4.238 4.366 -0.128 18980
643 1 3 . 1 1 31 31 PRO CA C 31 60.017 60.017 63.167 -3.150 18980
644 1 3 . 1 1 31 31 PRO CB C 31 28.726 28.726 32.373 -3.647 18980
645 1 3 . 1 1 32 32 ARG N N 32 123.635 123.635 122.547 1.088 18980
646 1 3 . 1 1 32 32 ARG HA H 32 4.391 4.391 4.694 -0.303 18980
647 1 3 . 1 1 32 32 ARG CA C 32 53.336 53.336 55.391 -2.055 18980
648 1 3 . 1 1 32 32 ARG CB C 32 27.689 27.689 31.566 -3.877 18980
649 1 3 . 1 1 32 32 ARG H H 32 8.740 8.740 8.432 0.308 18980
650 1 3 . 1 1 33 33 LYS N N 33 127.972 127.972 123.838 4.134 18980
651 1 3 . 1 1 33 33 LYS HA H 33 4.339 4.339 4.364 -0.025 18980
652 1 3 . 1 1 33 33 LYS CA C 33 53.372 53.372 56.627 -3.255 18980
653 1 3 . 1 1 33 33 LYS CB C 33 30.439 30.439 33.103 -2.664 18980
654 1 3 . 1 1 33 33 LYS H H 33 8.868 8.868 8.787 0.081 18980
655 1 3 . 1 1 34 34 LYS N N 34 120.697 120.697 120.306 0.391 18980
656 1 3 . 1 1 34 34 LYS HA H 34 4.393 4.393 4.355 0.038 18980
657 1 3 . 1 1 34 34 LYS CA C 34 54.385 54.385 55.979 -1.594 18980
658 1 3 . 1 1 34 34 LYS CB C 34 30.651 30.651 32.604 -1.953 18980
659 1 3 . 1 1 34 34 LYS H H 34 8.300 8.300 8.568 -0.268 18980
660 1 3 . 1 1 35 35 GLY N N 35 109.787 109.787 105.661 4.126 18980
661 1 3 . 1 1 35 35 GLY CA C 35 40.646 40.646 44.580 -3.934 18980
662 1 3 . 1 1 35 35 GLY H H 35 8.518 8.518 7.333 1.185 18980
663 1 3 . 1 1 36 36 CYS N N 36 122.657 122.657 119.716 2.941 18980
664 1 3 . 1 1 36 36 CYS HA H 36 3.994 3.994 4.062 -0.068 18980
665 1 3 . 1 1 36 36 CYS CA C 36 57.328 57.328 58.597 -1.269 18980
666 1 3 . 1 1 36 36 CYS CB C 36 27.259 27.259 28.198 -0.939 18980
667 1 3 . 1 1 36 36 CYS H H 36 8.249 8.249 8.074 0.175 18980
668 1 3 . 1 1 37 37 TRP N N 37 132.646 132.646 125.773 6.873 18980
669 1 3 . 1 1 37 37 TRP HA H 37 4.763 4.763 4.605 0.158 18980
670 1 3 . 1 1 37 37 TRP CA C 37 54.955 54.955 57.424 -2.469 18980
671 1 3 . 1 1 37 37 TRP CB C 37 26.102 26.102 29.272 -3.170 18980
672 1 3 . 1 1 37 37 TRP H H 37 9.218 9.218 8.280 0.938 18980
673 1 3 . 1 1 38 38 LYS N N 38 121.676 121.676 117.643 4.033 18980
674 1 3 . 1 1 38 38 LYS HA H 38 4.200 4.200 3.963 0.237 18980
675 1 3 . 1 1 38 38 LYS CA C 38 55.916 55.916 57.823 -1.907 18980
676 1 3 . 1 1 38 38 LYS CB C 38 31.288 31.288 33.297 -2.009 18980
677 1 3 . 1 1 38 38 LYS H H 38 9.626 9.626 7.776 1.850 18980
678 1 3 . 1 1 39 39 CYS N N 39 117.746 117.746 114.692 3.054 18980
679 1 3 . 1 1 39 39 CYS HA H 39 4.929 4.929 4.814 0.115 18980
680 1 3 . 1 1 39 39 CYS CA C 39 56.058 56.058 57.373 -1.315 18980
681 1 3 . 1 1 39 39 CYS CB C 39 29.705 29.705 29.386 0.320 18980
682 1 3 . 1 1 39 39 CYS H H 39 8.612 8.612 7.809 0.803 18980
683 1 3 . 1 1 40 40 GLY N N 40 113.510 113.510 110.213 3.297 18980
684 1 3 . 1 1 40 40 GLY CA C 40 43.398 43.398 45.337 -1.939 18980
685 1 3 . 1 1 40 40 GLY H H 40 8.050 8.050 8.362 -0.312 18980
686 1 3 . 1 1 41 41 LYS N N 41 121.911 121.911 121.676 0.235 18980
687 1 3 . 1 1 41 41 LYS HA H 41 4.296 4.296 4.430 -0.134 18980
688 1 3 . 1 1 41 41 LYS CA C 41 54.068 54.068 55.880 -1.812 18980
689 1 3 . 1 1 41 41 LYS CB C 41 30.765 30.765 33.487 -2.722 18980
690 1 3 . 1 1 41 41 LYS H H 41 8.340 8.340 7.537 0.803 18980
691 1 3 . 1 1 42 42 GLU N N 42 119.418 119.418 119.489 -0.071 18980
692 1 3 . 1 1 42 42 GLU HA H 42 4.116 4.116 4.172 -0.056 18980
693 1 3 . 1 1 42 42 GLU CA C 42 54.054 54.054 56.342 -2.288 18980
694 1 3 . 1 1 42 42 GLU CB C 42 27.786 27.786 30.373 -2.587 18980
695 1 3 . 1 1 42 42 GLU H H 42 8.501 8.501 8.489 0.012 18980
696 1 3 . 1 1 43 43 GLY N N 43 107.782 107.782 108.125 -0.343 18980
697 1 3 . 1 1 43 43 GLY CA C 43 42.789 42.789 45.903 -3.114 18980
698 1 3 . 1 1 43 43 GLY H H 43 8.719 8.719 8.854 -0.135 18980
699 1 3 . 1 1 44 44 HIS N N 44 111.284 111.284 115.384 -4.100 18980
700 1 3 . 1 1 44 44 HIS HA H 44 4.587 4.587 4.694 -0.107 18980
701 1 3 . 1 1 44 44 HIS CA C 44 52.665 52.665 54.276 -1.611 18980
702 1 3 . 1 1 44 44 HIS CB C 44 27.416 27.416 30.246 -2.830 18980
703 1 3 . 1 1 44 44 HIS H H 44 6.810 6.810 7.740 -0.930 18980
704 1 3 . 1 1 45 45 GLN N N 45 117.297 117.297 118.909 -1.612 18980
705 1 3 . 1 1 45 45 GLN HA H 45 3.773 3.773 4.422 -0.649 18980
706 1 3 . 1 1 45 45 GLN CA C 45 51.454 51.454 54.075 -2.621 18980
707 1 3 . 1 1 45 45 GLN CB C 45 28.905 28.905 30.703 -1.798 18980
708 1 3 . 1 1 45 45 GLN H H 45 8.781 8.781 8.643 0.138 18980
709 1 3 . 1 1 46 46 MET N N 46 117.926 117.926 122.004 -4.078 18980
710 1 3 . 1 1 46 46 MET HA H 46 4.820 4.820 4.305 0.515 18980
711 1 3 . 1 1 46 46 MET CA C 46 57.542 57.542 57.718 -0.176 18980
712 1 3 . 1 1 46 46 MET CB C 46 29.549 29.549 32.272 -2.723 18980
713 1 3 . 1 1 46 46 MET H H 46 9.008 9.008 8.539 0.469 18980
714 1 3 . 1 1 47 47 LYS N N 47 117.631 117.631 115.924 1.707 18980
715 1 3 . 1 1 47 47 LYS HA H 47 3.448 3.448 4.158 -0.710 18980
716 1 3 . 1 1 47 47 LYS CA C 47 54.988 54.988 57.674 -2.686 18980
717 1 3 . 1 1 47 47 LYS CB C 47 28.285 28.285 32.134 -3.849 18980
718 1 3 . 1 1 47 47 LYS H H 47 6.430 6.430 7.722 -1.292 18980
719 1 3 . 1 1 48 48 ASP N N 48 117.363 117.363 119.265 -1.902 18980
720 1 3 . 1 1 48 48 ASP HA H 48 4.780 4.780 4.626 0.154 18980
721 1 3 . 1 1 48 48 ASP CA C 48 50.600 50.600 55.397 -4.797 18980
722 1 3 . 1 1 48 48 ASP CB C 48 40.029 40.029 41.670 -1.641 18980
723 1 3 . 1 1 48 48 ASP H H 48 7.560 7.560 7.882 -0.322 18980
724 1 3 . 1 1 49 49 CYS N N 49 122.910 122.910 120.968 1.942 18980
725 1 3 . 1 1 49 49 CYS HA H 49 3.682 3.682 4.553 -0.871 18980
726 1 3 . 1 1 49 49 CYS CA C 49 59.557 59.557 58.044 1.513 18980
727 1 3 . 1 1 49 49 CYS CB C 49 28.040 28.040 24.363 3.676 18980
728 1 3 . 1 1 49 49 CYS H H 49 7.091 7.091 8.013 -0.922 18980
729 1 3 . 1 1 50 50 THR N N 50 119.675 119.675 117.822 1.853 18980
730 1 3 . 1 1 50 50 THR HA H 50 4.293 4.293 4.310 -0.017 18980
731 1 3 . 1 1 50 50 THR CA C 50 58.855 58.855 64.504 -5.649 18980
732 1 3 . 1 1 50 50 THR CB C 50 66.355 66.355 69.252 -2.897 18980
733 1 3 . 1 1 50 50 THR H H 50 8.139 8.139 8.123 0.016 18980
734 1 3 . 1 1 51 51 GLU N N 51 124.935 124.935 122.254 2.681 18980
735 1 3 . 1 1 51 51 GLU HA H 51 4.164 4.164 4.397 -0.233 18980
736 1 3 . 1 1 51 51 GLU CA C 51 54.061 54.061 55.494 -1.433 18980
737 1 3 . 1 1 51 51 GLU CB C 51 27.130 27.130 30.757 -3.627 18980
738 1 3 . 1 1 51 51 GLU H H 51 8.551 8.551 8.030 0.521 18980
739 1 3 . 1 1 52 52 ARG N N 52 122.624 122.624 119.787 2.837 18980
740 1 3 . 1 1 52 52 ARG HA H 52 4.248 4.248 4.585 -0.337 18980
741 1 3 . 1 1 52 52 ARG CA C 52 53.402 53.402 54.909 -1.507 18980
742 1 3 . 1 1 52 52 ARG CB C 52 28.028 28.028 30.846 -2.818 18980
743 1 3 . 1 1 52 52 ARG H H 52 8.287 8.287 8.546 -0.259 18980
744 1 3 . 1 1 53 53 GLN N N 53 121.647 121.647 120.115 1.532 18980
745 1 3 . 1 1 53 53 GLN HA H 53 4.248 4.248 4.594 -0.346 18980
746 1 3 . 1 1 53 53 GLN CA C 53 52.946 52.946 55.233 -2.287 18980
747 1 3 . 1 1 53 53 GLN CB C 53 26.794 26.794 31.984 -5.190 18980
748 1 3 . 1 1 53 53 GLN H H 53 8.381 8.381 8.412 -0.031 18980
749 1 3 . 1 1 54 54 ALA N N 54 125.878 125.878 124.086 1.792 18980
750 1 3 . 1 1 54 54 ALA HA H 54 4.296 4.296 4.722 -0.426 18980
751 1 3 . 1 1 54 54 ALA CA C 54 49.575 49.575 51.757 -2.182 18980
752 1 3 . 1 1 54 54 ALA CB C 54 16.704 16.704 21.572 -4.868 18980
753 1 3 . 1 1 54 54 ALA H H 54 8.338 8.338 8.561 -0.223 18980
754 1 4 . 1 1 2 2 GLN N N 2 125.073 125.073 120.616 4.457 18980
755 1 4 . 1 1 2 2 GLN HA H 2 4.309 4.309 4.433 -0.124 18980
756 1 4 . 1 1 2 2 GLN CA C 2 52.755 52.755 55.825 -3.070 18980
757 1 4 . 1 1 2 2 GLN CB C 2 26.728 26.728 29.388 -2.660 18980
758 1 4 . 1 1 2 2 GLN H H 2 8.503 8.503 8.424 0.079 18980
759 1 4 . 1 1 3 3 LYS N N 3 123.202 123.202 122.759 0.443 18980
760 1 4 . 1 1 3 3 LYS HA H 3 4.271 4.271 4.155 0.116 18980
761 1 4 . 1 1 3 3 LYS CA C 3 53.658 53.658 57.082 -3.424 18980
762 1 4 . 1 1 3 3 LYS CB C 3 30.442 30.442 32.873 -2.431 18980
763 1 4 . 1 1 3 3 LYS H H 3 8.414 8.414 8.822 -0.408 18980
764 1 4 . 1 1 4 4 GLY N N 4 109.574 109.574 106.717 2.857 18980
765 1 4 . 1 1 4 4 GLY CA C 4 42.455 42.455 44.135 -1.680 18980
766 1 4 . 1 1 4 4 GLY H H 4 8.394 8.394 8.079 0.315 18980
767 1 4 . 1 1 5 5 ASN N N 5 118.311 118.311 118.439 -0.128 18980
768 1 4 . 1 1 5 5 ASN HA H 5 4.625 4.625 4.643 -0.018 18980
769 1 4 . 1 1 5 5 ASN CA C 5 50.146 50.146 52.978 -2.832 18980
770 1 4 . 1 1 5 5 ASN CB C 5 36.059 36.059 38.997 -2.938 18980
771 1 4 . 1 1 5 5 ASN H H 5 8.240 8.240 8.128 0.112 18980
772 1 4 . 1 1 6 6 PHE N N 6 120.460 120.460 120.407 0.053 18980
773 1 4 . 1 1 6 6 PHE HA H 6 4.541 4.541 4.924 -0.383 18980
774 1 4 . 1 1 6 6 PHE CA C 6 55.112 55.112 56.788 -1.676 18980
775 1 4 . 1 1 6 6 PHE CB C 6 36.457 36.457 41.599 -5.142 18980
776 1 4 . 1 1 6 6 PHE H H 6 8.164 8.164 8.229 -0.065 18980
777 1 4 . 1 1 7 7 ARG N N 7 121.606 121.606 120.167 1.439 18980
778 1 4 . 1 1 7 7 ARG HA H 7 4.193 4.193 4.327 -0.134 18980
779 1 4 . 1 1 7 7 ARG CA C 7 53.586 53.586 57.045 -3.459 18980
780 1 4 . 1 1 7 7 ARG CB C 7 27.788 27.788 29.533 -1.745 18980
781 1 4 . 1 1 7 7 ARG H H 7 8.184 8.184 8.803 -0.619 18980
782 1 4 . 1 1 8 8 ASN N N 8 118.773 118.773 116.605 2.168 18980
783 1 4 . 1 1 8 8 ASN HA H 8 4.570 4.570 4.657 -0.087 18980
784 1 4 . 1 1 8 8 ASN CA C 8 50.518 50.518 54.861 -4.343 18980
785 1 4 . 1 1 8 8 ASN CB C 8 35.894 35.894 37.340 -1.446 18980
786 1 4 . 1 1 8 8 ASN H H 8 8.294 8.294 9.089 -0.795 18980
787 1 4 . 1 1 9 9 GLN N N 9 120.522 120.522 117.752 2.770 18980
788 1 4 . 1 1 9 9 GLN HA H 9 4.245 4.245 4.480 -0.235 18980
789 1 4 . 1 1 9 9 GLN CA C 9 53.202 53.202 55.576 -2.374 18980
790 1 4 . 1 1 9 9 GLN CB C 9 26.688 26.688 31.346 -4.658 18980
791 1 4 . 1 1 9 9 GLN H H 9 8.218 8.218 7.920 0.298 18980
792 1 4 . 1 1 10 10 ARG N N 10 121.826 121.826 122.460 -0.634 18980
793 1 4 . 1 1 10 10 ARG HA H 10 4.244 4.244 4.359 -0.115 18980
794 1 4 . 1 1 10 10 ARG CA C 10 53.208 53.208 55.651 -2.443 18980
795 1 4 . 1 1 10 10 ARG CB C 10 27.939 27.939 29.224 -1.285 18980
796 1 4 . 1 1 10 10 ARG H H 10 8.273 8.273 8.068 0.205 18980
797 1 4 . 1 1 11 11 LYS N N 11 122.737 122.737 119.959 2.778 18980
798 1 4 . 1 1 11 11 LYS HA H 11 4.263 4.263 3.940 0.323 18980
799 1 4 . 1 1 11 11 LYS CA C 11 53.578 53.578 58.618 -5.040 18980
800 1 4 . 1 1 11 11 LYS CB C 11 30.323 30.323 31.237 -0.914 18980
801 1 4 . 1 1 11 11 LYS H H 11 8.299 8.299 8.337 -0.038 18980
802 1 4 . 1 1 12 12 THR N N 12 116.442 116.442 116.903 -0.461 18980
803 1 4 . 1 1 12 12 THR HA H 12 4.254 4.254 4.284 -0.030 18980
804 1 4 . 1 1 12 12 THR CA C 12 58.726 58.726 63.881 -5.155 18980
805 1 4 . 1 1 12 12 THR CB C 12 66.915 66.915 69.623 -2.708 18980
806 1 4 . 1 1 12 12 THR H H 12 8.088 8.088 7.930 0.158 18980
807 1 4 . 1 1 13 13 VAL N N 13 122.626 122.626 120.088 2.538 18980
808 1 4 . 1 1 13 13 VAL HA H 13 4.021 4.021 4.516 -0.495 18980
809 1 4 . 1 1 13 13 VAL CA C 13 58.497 58.497 59.836 -1.339 18980
810 1 4 . 1 1 13 13 VAL CB C 13 30.485 30.485 34.601 -4.116 18980
811 1 4 . 1 1 13 13 VAL H H 13 8.209 8.209 8.052 0.157 18980
812 1 4 . 1 1 14 14 LYS N N 14 123.504 123.504 126.255 -2.751 18980
813 1 4 . 1 1 14 14 LYS HA H 14 4.412 4.412 4.503 -0.091 18980
814 1 4 . 1 1 14 14 LYS CA C 14 51.599 51.599 54.633 -3.034 18980
815 1 4 . 1 1 14 14 LYS CB C 14 31.540 31.540 35.234 -3.694 18980
816 1 4 . 1 1 14 14 LYS H H 14 8.012 8.012 8.190 -0.178 18980
817 1 4 . 1 1 15 15 CYS N N 15 129.731 129.731 125.444 4.287 18980
818 1 4 . 1 1 15 15 CYS HA H 15 4.215 4.215 4.215 0.000 18980
819 1 4 . 1 1 15 15 CYS CA C 15 56.967 56.967 59.016 -2.049 18980
820 1 4 . 1 1 15 15 CYS CB C 15 27.829 27.829 28.648 -0.819 18980
821 1 4 . 1 1 15 15 CYS H H 15 8.256 8.256 8.366 -0.110 18980
822 1 4 . 1 1 16 16 PHE N N 16 128.836 128.836 123.449 5.387 18980
823 1 4 . 1 1 16 16 PHE HA H 16 4.615 4.615 4.350 0.265 18980
824 1 4 . 1 1 16 16 PHE CA C 16 56.137 56.137 58.326 -2.189 18980
825 1 4 . 1 1 16 16 PHE CB C 16 37.103 37.103 38.791 -1.688 18980
826 1 4 . 1 1 16 16 PHE H H 16 9.299 9.299 8.408 0.891 18980
827 1 4 . 1 1 17 17 ASN N N 17 118.280 118.280 117.669 0.611 18980
828 1 4 . 1 1 17 17 ASN HA H 17 3.816 3.816 4.302 -0.486 18980
829 1 4 . 1 1 17 17 ASN CA C 17 53.075 53.075 55.188 -2.113 18980
830 1 4 . 1 1 17 17 ASN CB C 17 36.212 36.212 38.903 -2.691 18980
831 1 4 . 1 1 17 17 ASN H H 17 9.156 9.156 7.502 1.654 18980
832 1 4 . 1 1 18 18 CYS N N 18 116.876 116.876 114.860 2.016 18980
833 1 4 . 1 1 18 18 CYS HA H 18 4.696 4.696 4.763 -0.067 18980
834 1 4 . 1 1 18 18 CYS CA C 18 56.126 56.126 58.834 -2.708 18980
835 1 4 . 1 1 18 18 CYS CB C 18 29.066 29.066 27.558 1.508 18980
836 1 4 . 1 1 18 18 CYS H H 18 8.489 8.489 7.546 0.943 18980
837 1 4 . 1 1 19 19 GLY N N 19 112.394 112.394 110.217 2.177 18980
838 1 4 . 1 1 19 19 GLY CA C 19 43.589 43.589 45.200 -1.611 18980
839 1 4 . 1 1 19 19 GLY H H 19 7.703 7.703 8.256 -0.553 18980
840 1 4 . 1 1 20 20 LYS N N 20 120.951 120.951 121.153 -0.202 18980
841 1 4 . 1 1 20 20 LYS HA H 20 4.364 4.364 4.427 -0.063 18980
842 1 4 . 1 1 20 20 LYS CA C 20 53.066 53.066 55.258 -2.192 18980
843 1 4 . 1 1 20 20 LYS CB C 20 30.653 30.653 33.565 -2.912 18980
844 1 4 . 1 1 20 20 LYS H H 20 8.162 8.162 7.296 0.866 18980
845 1 4 . 1 1 21 21 GLU N N 21 119.095 119.095 119.891 -0.796 18980
846 1 4 . 1 1 21 21 GLU HA H 21 4.602 4.602 4.280 0.322 18980
847 1 4 . 1 1 21 21 GLU CA C 21 53.327 53.327 58.109 -4.782 18980
848 1 4 . 1 1 21 21 GLU CB C 21 28.049 28.049 30.190 -2.141 18980
849 1 4 . 1 1 21 21 GLU H H 21 8.454 8.454 8.652 -0.198 18980
850 1 4 . 1 1 22 22 GLY N N 22 107.727 107.727 108.793 -1.066 18980
851 1 4 . 1 1 22 22 GLY CA C 22 42.965 42.965 46.080 -3.115 18980
852 1 4 . 1 1 22 22 GLY H H 22 8.639 8.639 8.473 0.166 18980
853 1 4 . 1 1 23 23 HIS N N 23 113.019 113.019 115.584 -2.565 18980
854 1 4 . 1 1 23 23 HIS HA H 23 4.613 4.613 4.751 -0.138 18980
855 1 4 . 1 1 23 23 HIS CA C 23 52.409 52.409 54.584 -2.175 18980
856 1 4 . 1 1 23 23 HIS CB C 23 27.389 27.389 31.447 -4.058 18980
857 1 4 . 1 1 23 23 HIS H H 23 6.992 6.992 7.301 -0.309 18980
858 1 4 . 1 1 24 24 ILE N N 24 105.931 105.931 112.988 -7.057 18980
859 1 4 . 1 1 24 24 ILE HA H 24 4.313 4.313 4.324 -0.011 18980
860 1 4 . 1 1 24 24 ILE CA C 24 56.515 56.515 58.282 -1.767 18980
861 1 4 . 1 1 24 24 ILE CB C 24 38.320 38.320 41.421 -3.101 18980
862 1 4 . 1 1 24 24 ILE H H 24 7.578 7.578 7.949 -0.371 18980
863 1 4 . 1 1 25 25 ALA N N 25 122.665 122.665 125.252 -2.587 18980
864 1 4 . 1 1 25 25 ALA HA H 25 4.521 4.521 3.806 0.715 18980
865 1 4 . 1 1 25 25 ALA CA C 25 53.097 53.097 54.810 -1.713 18980
866 1 4 . 1 1 25 25 ALA CB C 25 16.460 16.460 17.977 -1.517 18980
867 1 4 . 1 1 25 25 ALA H H 25 8.944 8.944 8.412 0.532 18980
868 1 4 . 1 1 26 26 LYS N N 26 117.327 117.327 116.100 1.227 18980
869 1 4 . 1 1 26 26 LYS HA H 26 2.735 2.735 4.070 -1.335 18980
870 1 4 . 1 1 26 26 LYS CA C 26 55.268 55.268 58.932 -3.664 18980
871 1 4 . 1 1 26 26 LYS CB C 26 31.527 31.527 32.273 -0.746 18980
872 1 4 . 1 1 26 26 LYS H H 26 6.448 6.448 8.296 -1.848 18980
873 1 4 . 1 1 27 27 ASN N N 27 111.844 111.844 117.170 -5.326 18980
874 1 4 . 1 1 27 27 ASN HA H 27 4.844 4.844 4.712 0.132 18980
875 1 4 . 1 1 27 27 ASN CA C 27 48.766 48.766 53.048 -4.282 18980
876 1 4 . 1 1 27 27 ASN CB C 27 37.372 37.372 39.627 -2.255 18980
877 1 4 . 1 1 27 27 ASN H H 27 7.536 7.536 7.726 -0.190 18980
878 1 4 . 1 1 28 28 CYS N N 28 122.908 122.908 119.534 3.374 18980
879 1 4 . 1 1 28 28 CYS HA H 28 3.590 3.590 4.143 -0.553 18980
880 1 4 . 1 1 28 28 CYS CA C 28 58.923 58.923 59.586 -0.663 18980
881 1 4 . 1 1 28 28 CYS CB C 28 28.111 28.111 28.030 0.081 18980
882 1 4 . 1 1 28 28 CYS H H 28 7.195 7.195 7.782 -0.587 18980
883 1 4 . 1 1 29 29 ARG N N 29 129.416 129.416 125.346 4.070 18980
884 1 4 . 1 1 29 29 ARG HA H 29 4.446 4.446 4.475 -0.029 18980
885 1 4 . 1 1 29 29 ARG CA C 29 52.480 52.480 55.410 -2.930 18980
886 1 4 . 1 1 29 29 ARG CB C 29 27.564 27.564 30.324 -2.760 18980
887 1 4 . 1 1 29 29 ARG H H 29 8.885 8.885 8.405 0.480 18980
888 1 4 . 1 1 30 30 ALA N N 30 127.959 127.959 126.255 1.704 18980
889 1 4 . 1 1 30 30 ALA HA H 30 4.475 4.475 4.467 0.008 18980
890 1 4 . 1 1 30 30 ALA CA C 30 48.220 48.220 50.752 -2.532 18980
891 1 4 . 1 1 30 30 ALA CB C 30 15.112 15.112 18.306 -3.194 18980
892 1 4 . 1 1 30 30 ALA H H 30 8.744 8.744 7.569 1.175 18980
893 1 4 . 1 1 31 31 PRO HA H 31 4.238 4.238 4.448 -0.210 18980
894 1 4 . 1 1 31 31 PRO CA C 31 60.017 60.017 62.965 -2.947 18980
895 1 4 . 1 1 31 31 PRO CB C 31 28.726 28.726 32.564 -3.838 18980
896 1 4 . 1 1 32 32 ARG N N 32 123.635 123.635 122.411 1.224 18980
897 1 4 . 1 1 32 32 ARG HA H 32 4.391 4.391 4.698 -0.307 18980
898 1 4 . 1 1 32 32 ARG CA C 32 53.336 53.336 55.337 -2.001 18980
899 1 4 . 1 1 32 32 ARG CB C 32 27.689 27.689 31.434 -3.745 18980
900 1 4 . 1 1 32 32 ARG H H 32 8.740 8.740 8.435 0.305 18980
901 1 4 . 1 1 33 33 LYS N N 33 127.972 127.972 123.800 4.172 18980
902 1 4 . 1 1 33 33 LYS HA H 33 4.339 4.339 4.380 -0.041 18980
903 1 4 . 1 1 33 33 LYS CA C 33 53.372 53.372 56.604 -3.232 18980
904 1 4 . 1 1 33 33 LYS CB C 33 30.439 30.439 33.153 -2.713 18980
905 1 4 . 1 1 33 33 LYS H H 33 8.868 8.868 8.909 -0.041 18980
906 1 4 . 1 1 34 34 LYS N N 34 120.697 120.697 120.582 0.115 18980
907 1 4 . 1 1 34 34 LYS HA H 34 4.393 4.393 4.359 0.034 18980
908 1 4 . 1 1 34 34 LYS CA C 34 54.385 54.385 55.965 -1.580 18980
909 1 4 . 1 1 34 34 LYS CB C 34 30.651 30.651 32.483 -1.833 18980
910 1 4 . 1 1 34 34 LYS H H 34 8.300 8.300 8.587 -0.287 18980
911 1 4 . 1 1 35 35 GLY N N 35 109.787 109.787 105.726 4.061 18980
912 1 4 . 1 1 35 35 GLY CA C 35 40.646 40.646 44.632 -3.986 18980
913 1 4 . 1 1 35 35 GLY H H 35 8.518 8.518 7.338 1.180 18980
914 1 4 . 1 1 36 36 CYS N N 36 122.657 122.657 119.688 2.969 18980
915 1 4 . 1 1 36 36 CYS HA H 36 3.994 3.994 4.084 -0.090 18980
916 1 4 . 1 1 36 36 CYS CA C 36 57.328 57.328 58.590 -1.262 18980
917 1 4 . 1 1 36 36 CYS CB C 36 27.259 27.259 28.251 -0.992 18980
918 1 4 . 1 1 36 36 CYS H H 36 8.249 8.249 8.035 0.214 18980
919 1 4 . 1 1 37 37 TRP N N 37 132.646 132.646 125.789 6.857 18980
920 1 4 . 1 1 37 37 TRP HA H 37 4.763 4.763 4.587 0.176 18980
921 1 4 . 1 1 37 37 TRP CA C 37 54.955 54.955 57.547 -2.592 18980
922 1 4 . 1 1 37 37 TRP CB C 37 26.102 26.102 29.284 -3.182 18980
923 1 4 . 1 1 37 37 TRP H H 37 9.218 9.218 8.305 0.913 18980
924 1 4 . 1 1 38 38 LYS N N 38 121.676 121.676 119.144 2.532 18980
925 1 4 . 1 1 38 38 LYS HA H 38 4.200 4.200 4.012 0.188 18980
926 1 4 . 1 1 38 38 LYS CA C 38 55.916 55.916 58.960 -3.044 18980
927 1 4 . 1 1 38 38 LYS CB C 38 31.288 31.288 33.048 -1.760 18980
928 1 4 . 1 1 38 38 LYS H H 38 9.626 9.626 7.865 1.761 18980
929 1 4 . 1 1 39 39 CYS N N 39 117.746 117.746 112.318 5.428 18980
930 1 4 . 1 1 39 39 CYS HA H 39 4.929 4.929 4.862 0.067 18980
931 1 4 . 1 1 39 39 CYS CA C 39 56.058 56.058 57.297 -1.239 18980
932 1 4 . 1 1 39 39 CYS CB C 39 29.705 29.705 29.234 0.471 18980
933 1 4 . 1 1 39 39 CYS H H 39 8.612 8.612 7.806 0.806 18980
934 1 4 . 1 1 40 40 GLY N N 40 113.510 113.510 110.638 2.872 18980
935 1 4 . 1 1 40 40 GLY CA C 40 43.398 43.398 45.385 -1.987 18980
936 1 4 . 1 1 40 40 GLY H H 40 8.050 8.050 7.972 0.078 18980
937 1 4 . 1 1 41 41 LYS N N 41 121.911 121.911 121.338 0.573 18980
938 1 4 . 1 1 41 41 LYS HA H 41 4.296 4.296 4.503 -0.207 18980
939 1 4 . 1 1 41 41 LYS CA C 41 54.068 54.068 55.665 -1.597 18980
940 1 4 . 1 1 41 41 LYS CB C 41 30.765 30.765 33.460 -2.695 18980
941 1 4 . 1 1 41 41 LYS H H 41 8.340 8.340 7.536 0.804 18980
942 1 4 . 1 1 42 42 GLU N N 42 119.418 119.418 119.743 -0.325 18980
943 1 4 . 1 1 42 42 GLU HA H 42 4.116 4.116 4.198 -0.082 18980
944 1 4 . 1 1 42 42 GLU CA C 42 54.054 54.054 56.340 -2.285 18980
945 1 4 . 1 1 42 42 GLU CB C 42 27.786 27.786 30.322 -2.536 18980
946 1 4 . 1 1 42 42 GLU H H 42 8.501 8.501 8.520 -0.019 18980
947 1 4 . 1 1 43 43 GLY N N 43 107.782 107.782 108.604 -0.822 18980
948 1 4 . 1 1 43 43 GLY CA C 43 42.789 42.789 45.910 -3.121 18980
949 1 4 . 1 1 43 43 GLY H H 43 8.719 8.719 8.846 -0.127 18980
950 1 4 . 1 1 44 44 HIS N N 44 111.284 111.284 116.050 -4.766 18980
951 1 4 . 1 1 44 44 HIS HA H 44 4.587 4.587 4.715 -0.128 18980
952 1 4 . 1 1 44 44 HIS CA C 44 52.665 52.665 54.260 -1.595 18980
953 1 4 . 1 1 44 44 HIS CB C 44 27.416 27.416 30.459 -3.043 18980
954 1 4 . 1 1 44 44 HIS H H 44 6.810 6.810 7.712 -0.902 18980
955 1 4 . 1 1 45 45 GLN N N 45 117.297 117.297 118.988 -1.691 18980
956 1 4 . 1 1 45 45 GLN HA H 45 3.773 3.773 4.414 -0.641 18980
957 1 4 . 1 1 45 45 GLN CA C 45 51.454 51.454 54.224 -2.770 18980
958 1 4 . 1 1 45 45 GLN CB C 45 28.905 28.905 30.943 -2.038 18980
959 1 4 . 1 1 45 45 GLN H H 45 8.781 8.781 8.560 0.221 18980
960 1 4 . 1 1 46 46 MET N N 46 117.926 117.926 123.059 -5.133 18980
961 1 4 . 1 1 46 46 MET HA H 46 4.820 4.820 4.302 0.518 18980
962 1 4 . 1 1 46 46 MET CA C 46 57.542 57.542 58.285 -0.743 18980
963 1 4 . 1 1 46 46 MET CB C 46 29.549 29.549 32.154 -2.605 18980
964 1 4 . 1 1 46 46 MET H H 46 9.008 9.008 8.683 0.325 18980
965 1 4 . 1 1 47 47 LYS N N 47 117.631 117.631 116.980 0.651 18980
966 1 4 . 1 1 47 47 LYS HA H 47 3.448 3.448 4.151 -0.703 18980
967 1 4 . 1 1 47 47 LYS CA C 47 54.988 54.988 58.179 -3.191 18980
968 1 4 . 1 1 47 47 LYS CB C 47 28.285 28.285 31.633 -3.348 18980
969 1 4 . 1 1 47 47 LYS H H 47 6.430 6.430 8.024 -1.594 18980
970 1 4 . 1 1 48 48 ASP N N 48 117.363 117.363 119.308 -1.945 18980
971 1 4 . 1 1 48 48 ASP HA H 48 4.780 4.780 4.709 0.071 18980
972 1 4 . 1 1 48 48 ASP CA C 48 50.600 50.600 54.609 -4.010 18980
973 1 4 . 1 1 48 48 ASP CB C 48 40.029 40.029 41.629 -1.600 18980
974 1 4 . 1 1 48 48 ASP H H 48 7.560 7.560 7.931 -0.371 18980
975 1 4 . 1 1 49 49 CYS N N 49 122.910 122.910 118.686 4.224 18980
976 1 4 . 1 1 49 49 CYS HA H 49 3.682 3.682 4.666 -0.984 18980
977 1 4 . 1 1 49 49 CYS CA C 49 59.557 59.557 57.961 1.596 18980
978 1 4 . 1 1 49 49 CYS CB C 49 28.040 28.040 29.287 -1.247 18980
979 1 4 . 1 1 49 49 CYS H H 49 7.091 7.091 7.639 -0.548 18980
980 1 4 . 1 1 50 50 THR N N 50 119.675 119.675 120.684 -1.009 18980
981 1 4 . 1 1 50 50 THR HA H 50 4.293 4.293 4.223 0.070 18980
982 1 4 . 1 1 50 50 THR CA C 50 58.855 58.855 63.729 -4.874 18980
983 1 4 . 1 1 50 50 THR CB C 50 66.355 66.355 69.180 -2.825 18980
984 1 4 . 1 1 50 50 THR H H 50 8.139 8.139 8.537 -0.398 18980
985 1 4 . 1 1 51 51 GLU N N 51 124.935 124.935 120.767 4.168 18980
986 1 4 . 1 1 51 51 GLU HA H 51 4.164 4.164 4.463 -0.299 18980
987 1 4 . 1 1 51 51 GLU CA C 51 54.061 54.061 55.478 -1.417 18980
988 1 4 . 1 1 51 51 GLU CB C 51 27.130 27.130 31.485 -4.354 18980
989 1 4 . 1 1 51 51 GLU H H 51 8.551 8.551 7.936 0.615 18980
990 1 4 . 1 1 52 52 ARG N N 52 122.624 122.624 120.700 1.924 18980
991 1 4 . 1 1 52 52 ARG HA H 52 4.248 4.248 4.287 -0.039 18980
992 1 4 . 1 1 52 52 ARG CA C 52 53.402 53.402 56.352 -2.950 18980
993 1 4 . 1 1 52 52 ARG CB C 52 28.028 28.028 30.820 -2.792 18980
994 1 4 . 1 1 52 52 ARG H H 52 8.287 8.287 8.518 -0.231 18980
995 1 4 . 1 1 53 53 GLN N N 53 121.647 121.647 121.170 0.477 18980
996 1 4 . 1 1 53 53 GLN HA H 53 4.248 4.248 4.398 -0.150 18980
997 1 4 . 1 1 53 53 GLN CA C 53 52.946 52.946 55.650 -2.704 18980
998 1 4 . 1 1 53 53 GLN CB C 53 26.794 26.794 29.148 -2.354 18980
999 1 4 . 1 1 53 53 GLN H H 53 8.381 8.381 8.603 -0.222 18980
1000 1 4 . 1 1 54 54 ALA N N 54 125.878 125.878 123.700 2.178 18980
1001 1 4 . 1 1 54 54 ALA HA H 54 4.296 4.296 4.344 -0.048 18980
1002 1 4 . 1 1 54 54 ALA CA C 54 49.575 49.575 52.653 -3.078 18980
1003 1 4 . 1 1 54 54 ALA CB C 54 16.704 16.704 17.510 -0.806 18980
1004 1 4 . 1 1 54 54 ALA H H 54 8.338 8.338 8.580 -0.242 18980
1005 1 5 . 1 1 2 2 GLN N N 2 125.073 125.073 120.616 4.457 18980
1006 1 5 . 1 1 2 2 GLN HA H 2 4.309 4.309 4.433 -0.124 18980
1007 1 5 . 1 1 2 2 GLN CA C 2 52.755 52.755 55.825 -3.070 18980
1008 1 5 . 1 1 2 2 GLN CB C 2 26.728 26.728 29.388 -2.660 18980
1009 1 5 . 1 1 2 2 GLN H H 2 8.503 8.503 8.424 0.079 18980
1010 1 5 . 1 1 3 3 LYS N N 3 123.202 123.202 122.759 0.443 18980
1011 1 5 . 1 1 3 3 LYS HA H 3 4.271 4.271 4.155 0.116 18980
1012 1 5 . 1 1 3 3 LYS CA C 3 53.658 53.658 57.082 -3.424 18980
1013 1 5 . 1 1 3 3 LYS CB C 3 30.442 30.442 32.873 -2.431 18980
1014 1 5 . 1 1 3 3 LYS H H 3 8.414 8.414 8.822 -0.408 18980
1015 1 5 . 1 1 4 4 GLY N N 4 109.574 109.574 106.717 2.857 18980
1016 1 5 . 1 1 4 4 GLY CA C 4 42.455 42.455 44.135 -1.680 18980
1017 1 5 . 1 1 4 4 GLY H H 4 8.394 8.394 8.079 0.315 18980
1018 1 5 . 1 1 5 5 ASN N N 5 118.311 118.311 118.439 -0.128 18980
1019 1 5 . 1 1 5 5 ASN HA H 5 4.625 4.625 4.643 -0.018 18980
1020 1 5 . 1 1 5 5 ASN CA C 5 50.146 50.146 52.978 -2.832 18980
1021 1 5 . 1 1 5 5 ASN CB C 5 36.059 36.059 38.997 -2.938 18980
1022 1 5 . 1 1 5 5 ASN H H 5 8.240 8.240 8.128 0.112 18980
1023 1 5 . 1 1 6 6 PHE N N 6 120.460 120.460 120.407 0.053 18980
1024 1 5 . 1 1 6 6 PHE HA H 6 4.541 4.541 4.924 -0.383 18980
1025 1 5 . 1 1 6 6 PHE CA C 6 55.112 55.112 56.788 -1.676 18980
1026 1 5 . 1 1 6 6 PHE CB C 6 36.457 36.457 41.599 -5.142 18980
1027 1 5 . 1 1 6 6 PHE H H 6 8.164 8.164 8.229 -0.065 18980
1028 1 5 . 1 1 7 7 ARG N N 7 121.606 121.606 120.167 1.439 18980
1029 1 5 . 1 1 7 7 ARG HA H 7 4.193 4.193 4.327 -0.134 18980
1030 1 5 . 1 1 7 7 ARG CA C 7 53.586 53.586 57.045 -3.459 18980
1031 1 5 . 1 1 7 7 ARG CB C 7 27.788 27.788 29.533 -1.745 18980
1032 1 5 . 1 1 7 7 ARG H H 7 8.184 8.184 8.803 -0.619 18980
1033 1 5 . 1 1 8 8 ASN N N 8 118.773 118.773 116.605 2.168 18980
1034 1 5 . 1 1 8 8 ASN HA H 8 4.570 4.570 4.657 -0.087 18980
1035 1 5 . 1 1 8 8 ASN CA C 8 50.518 50.518 54.861 -4.343 18980
1036 1 5 . 1 1 8 8 ASN CB C 8 35.894 35.894 37.340 -1.446 18980
1037 1 5 . 1 1 8 8 ASN H H 8 8.294 8.294 9.089 -0.795 18980
1038 1 5 . 1 1 9 9 GLN N N 9 120.522 120.522 117.752 2.770 18980
1039 1 5 . 1 1 9 9 GLN HA H 9 4.245 4.245 4.480 -0.235 18980
1040 1 5 . 1 1 9 9 GLN CA C 9 53.202 53.202 55.576 -2.374 18980
1041 1 5 . 1 1 9 9 GLN CB C 9 26.688 26.688 31.346 -4.658 18980
1042 1 5 . 1 1 9 9 GLN H H 9 8.218 8.218 7.920 0.298 18980
1043 1 5 . 1 1 10 10 ARG N N 10 121.826 121.826 122.460 -0.634 18980
1044 1 5 . 1 1 10 10 ARG HA H 10 4.244 4.244 4.359 -0.115 18980
1045 1 5 . 1 1 10 10 ARG CA C 10 53.208 53.208 55.651 -2.443 18980
1046 1 5 . 1 1 10 10 ARG CB C 10 27.939 27.939 29.224 -1.285 18980
1047 1 5 . 1 1 10 10 ARG H H 10 8.273 8.273 8.068 0.205 18980
1048 1 5 . 1 1 11 11 LYS N N 11 122.737 122.737 119.959 2.778 18980
1049 1 5 . 1 1 11 11 LYS HA H 11 4.263 4.263 3.940 0.323 18980
1050 1 5 . 1 1 11 11 LYS CA C 11 53.578 53.578 58.618 -5.040 18980
1051 1 5 . 1 1 11 11 LYS CB C 11 30.323 30.323 31.237 -0.914 18980
1052 1 5 . 1 1 11 11 LYS H H 11 8.299 8.299 8.337 -0.038 18980
1053 1 5 . 1 1 12 12 THR N N 12 116.442 116.442 116.903 -0.461 18980
1054 1 5 . 1 1 12 12 THR HA H 12 4.254 4.254 4.284 -0.030 18980
1055 1 5 . 1 1 12 12 THR CA C 12 58.726 58.726 63.881 -5.155 18980
1056 1 5 . 1 1 12 12 THR CB C 12 66.915 66.915 69.623 -2.708 18980
1057 1 5 . 1 1 12 12 THR H H 12 8.088 8.088 7.930 0.158 18980
1058 1 5 . 1 1 13 13 VAL N N 13 122.626 122.626 120.088 2.538 18980
1059 1 5 . 1 1 13 13 VAL HA H 13 4.021 4.021 4.516 -0.495 18980
1060 1 5 . 1 1 13 13 VAL CA C 13 58.497 58.497 59.836 -1.339 18980
1061 1 5 . 1 1 13 13 VAL CB C 13 30.485 30.485 34.601 -4.116 18980
1062 1 5 . 1 1 13 13 VAL H H 13 8.209 8.209 8.052 0.157 18980
1063 1 5 . 1 1 14 14 LYS N N 14 123.504 123.504 126.255 -2.751 18980
1064 1 5 . 1 1 14 14 LYS HA H 14 4.412 4.412 4.503 -0.091 18980
1065 1 5 . 1 1 14 14 LYS CA C 14 51.599 51.599 54.633 -3.034 18980
1066 1 5 . 1 1 14 14 LYS CB C 14 31.540 31.540 35.234 -3.694 18980
1067 1 5 . 1 1 14 14 LYS H H 14 8.012 8.012 8.190 -0.178 18980
1068 1 5 . 1 1 15 15 CYS N N 15 129.731 129.731 125.444 4.287 18980
1069 1 5 . 1 1 15 15 CYS HA H 15 4.215 4.215 4.215 0.000 18980
1070 1 5 . 1 1 15 15 CYS CA C 15 56.967 56.967 59.016 -2.049 18980
1071 1 5 . 1 1 15 15 CYS CB C 15 27.829 27.829 28.648 -0.819 18980
1072 1 5 . 1 1 15 15 CYS H H 15 8.256 8.256 8.366 -0.110 18980
1073 1 5 . 1 1 16 16 PHE N N 16 128.836 128.836 123.449 5.387 18980
1074 1 5 . 1 1 16 16 PHE HA H 16 4.615 4.615 4.350 0.265 18980
1075 1 5 . 1 1 16 16 PHE CA C 16 56.137 56.137 58.326 -2.189 18980
1076 1 5 . 1 1 16 16 PHE CB C 16 37.103 37.103 38.791 -1.688 18980
1077 1 5 . 1 1 16 16 PHE H H 16 9.299 9.299 8.408 0.891 18980
1078 1 5 . 1 1 17 17 ASN N N 17 118.280 118.280 117.669 0.611 18980
1079 1 5 . 1 1 17 17 ASN HA H 17 3.816 3.816 4.302 -0.486 18980
1080 1 5 . 1 1 17 17 ASN CA C 17 53.075 53.075 55.188 -2.113 18980
1081 1 5 . 1 1 17 17 ASN CB C 17 36.212 36.212 38.903 -2.691 18980
1082 1 5 . 1 1 17 17 ASN H H 17 9.156 9.156 7.502 1.654 18980
1083 1 5 . 1 1 18 18 CYS N N 18 116.876 116.876 114.860 2.016 18980
1084 1 5 . 1 1 18 18 CYS HA H 18 4.696 4.696 4.763 -0.067 18980
1085 1 5 . 1 1 18 18 CYS CA C 18 56.126 56.126 58.834 -2.708 18980
1086 1 5 . 1 1 18 18 CYS CB C 18 29.066 29.066 27.558 1.508 18980
1087 1 5 . 1 1 18 18 CYS H H 18 8.489 8.489 7.546 0.943 18980
1088 1 5 . 1 1 19 19 GLY N N 19 112.394 112.394 110.217 2.177 18980
1089 1 5 . 1 1 19 19 GLY CA C 19 43.589 43.589 45.200 -1.611 18980
1090 1 5 . 1 1 19 19 GLY H H 19 7.703 7.703 8.256 -0.553 18980
1091 1 5 . 1 1 20 20 LYS N N 20 120.951 120.951 121.153 -0.202 18980
1092 1 5 . 1 1 20 20 LYS HA H 20 4.364 4.364 4.427 -0.063 18980
1093 1 5 . 1 1 20 20 LYS CA C 20 53.066 53.066 55.258 -2.192 18980
1094 1 5 . 1 1 20 20 LYS CB C 20 30.653 30.653 33.565 -2.912 18980
1095 1 5 . 1 1 20 20 LYS H H 20 8.162 8.162 7.296 0.866 18980
1096 1 5 . 1 1 21 21 GLU N N 21 119.095 119.095 119.891 -0.796 18980
1097 1 5 . 1 1 21 21 GLU HA H 21 4.602 4.602 4.280 0.322 18980
1098 1 5 . 1 1 21 21 GLU CA C 21 53.327 53.327 58.109 -4.782 18980
1099 1 5 . 1 1 21 21 GLU CB C 21 28.049 28.049 30.190 -2.141 18980
1100 1 5 . 1 1 21 21 GLU H H 21 8.454 8.454 8.652 -0.198 18980
1101 1 5 . 1 1 22 22 GLY N N 22 107.727 107.727 108.793 -1.066 18980
1102 1 5 . 1 1 22 22 GLY CA C 22 42.965 42.965 46.080 -3.115 18980
1103 1 5 . 1 1 22 22 GLY H H 22 8.639 8.639 8.473 0.166 18980
1104 1 5 . 1 1 23 23 HIS N N 23 113.019 113.019 115.584 -2.565 18980
1105 1 5 . 1 1 23 23 HIS HA H 23 4.613 4.613 4.751 -0.138 18980
1106 1 5 . 1 1 23 23 HIS CA C 23 52.409 52.409 54.584 -2.175 18980
1107 1 5 . 1 1 23 23 HIS CB C 23 27.389 27.389 31.447 -4.058 18980
1108 1 5 . 1 1 23 23 HIS H H 23 6.992 6.992 7.301 -0.309 18980
1109 1 5 . 1 1 24 24 ILE N N 24 105.931 105.931 112.988 -7.057 18980
1110 1 5 . 1 1 24 24 ILE HA H 24 4.313 4.313 4.324 -0.011 18980
1111 1 5 . 1 1 24 24 ILE CA C 24 56.515 56.515 58.282 -1.767 18980
1112 1 5 . 1 1 24 24 ILE CB C 24 38.320 38.320 41.421 -3.101 18980
1113 1 5 . 1 1 24 24 ILE H H 24 7.578 7.578 7.949 -0.371 18980
1114 1 5 . 1 1 25 25 ALA N N 25 122.665 122.665 125.252 -2.587 18980
1115 1 5 . 1 1 25 25 ALA HA H 25 4.521 4.521 3.806 0.715 18980
1116 1 5 . 1 1 25 25 ALA CA C 25 53.097 53.097 54.810 -1.713 18980
1117 1 5 . 1 1 25 25 ALA CB C 25 16.460 16.460 17.977 -1.517 18980
1118 1 5 . 1 1 25 25 ALA H H 25 8.944 8.944 8.412 0.532 18980
1119 1 5 . 1 1 26 26 LYS N N 26 117.327 117.327 116.100 1.227 18980
1120 1 5 . 1 1 26 26 LYS HA H 26 2.735 2.735 4.070 -1.335 18980
1121 1 5 . 1 1 26 26 LYS CA C 26 55.268 55.268 58.932 -3.664 18980
1122 1 5 . 1 1 26 26 LYS CB C 26 31.527 31.527 32.273 -0.746 18980
1123 1 5 . 1 1 26 26 LYS H H 26 6.448 6.448 8.296 -1.848 18980
1124 1 5 . 1 1 27 27 ASN N N 27 111.844 111.844 117.170 -5.326 18980
1125 1 5 . 1 1 27 27 ASN HA H 27 4.844 4.844 4.712 0.132 18980
1126 1 5 . 1 1 27 27 ASN CA C 27 48.766 48.766 53.048 -4.282 18980
1127 1 5 . 1 1 27 27 ASN CB C 27 37.372 37.372 39.627 -2.255 18980
1128 1 5 . 1 1 27 27 ASN H H 27 7.536 7.536 7.726 -0.190 18980
1129 1 5 . 1 1 28 28 CYS N N 28 122.908 122.908 119.534 3.374 18980
1130 1 5 . 1 1 28 28 CYS HA H 28 3.590 3.590 4.143 -0.553 18980
1131 1 5 . 1 1 28 28 CYS CA C 28 58.923 58.923 59.586 -0.663 18980
1132 1 5 . 1 1 28 28 CYS CB C 28 28.111 28.111 28.030 0.081 18980
1133 1 5 . 1 1 28 28 CYS H H 28 7.195 7.195 7.782 -0.587 18980
1134 1 5 . 1 1 29 29 ARG N N 29 129.416 129.416 125.346 4.070 18980
1135 1 5 . 1 1 29 29 ARG HA H 29 4.446 4.446 4.475 -0.029 18980
1136 1 5 . 1 1 29 29 ARG CA C 29 52.480 52.480 55.410 -2.930 18980
1137 1 5 . 1 1 29 29 ARG CB C 29 27.564 27.564 30.324 -2.760 18980
1138 1 5 . 1 1 29 29 ARG H H 29 8.885 8.885 8.405 0.480 18980
1139 1 5 . 1 1 30 30 ALA N N 30 127.959 127.959 126.255 1.704 18980
1140 1 5 . 1 1 30 30 ALA HA H 30 4.475 4.475 4.467 0.008 18980
1141 1 5 . 1 1 30 30 ALA CA C 30 48.220 48.220 50.752 -2.532 18980
1142 1 5 . 1 1 30 30 ALA CB C 30 15.112 15.112 18.306 -3.194 18980
1143 1 5 . 1 1 30 30 ALA H H 30 8.744 8.744 7.569 1.175 18980
1144 1 5 . 1 1 31 31 PRO HA H 31 4.238 4.238 4.448 -0.210 18980
1145 1 5 . 1 1 31 31 PRO CA C 31 60.017 60.017 62.965 -2.947 18980
1146 1 5 . 1 1 31 31 PRO CB C 31 28.726 28.726 32.564 -3.838 18980
1147 1 5 . 1 1 32 32 ARG N N 32 123.635 123.635 122.411 1.224 18980
1148 1 5 . 1 1 32 32 ARG HA H 32 4.391 4.391 4.698 -0.307 18980
1149 1 5 . 1 1 32 32 ARG CA C 32 53.336 53.336 55.337 -2.001 18980
1150 1 5 . 1 1 32 32 ARG CB C 32 27.689 27.689 31.434 -3.745 18980
1151 1 5 . 1 1 32 32 ARG H H 32 8.740 8.740 8.435 0.305 18980
1152 1 5 . 1 1 33 33 LYS N N 33 127.972 127.972 123.800 4.172 18980
1153 1 5 . 1 1 33 33 LYS HA H 33 4.339 4.339 4.380 -0.041 18980
1154 1 5 . 1 1 33 33 LYS CA C 33 53.372 53.372 56.604 -3.232 18980
1155 1 5 . 1 1 33 33 LYS CB C 33 30.439 30.439 33.153 -2.713 18980
1156 1 5 . 1 1 33 33 LYS H H 33 8.868 8.868 8.909 -0.041 18980
1157 1 5 . 1 1 34 34 LYS N N 34 120.697 120.697 120.582 0.115 18980
1158 1 5 . 1 1 34 34 LYS HA H 34 4.393 4.393 4.359 0.034 18980
1159 1 5 . 1 1 34 34 LYS CA C 34 54.385 54.385 55.965 -1.580 18980
1160 1 5 . 1 1 34 34 LYS CB C 34 30.651 30.651 32.483 -1.833 18980
1161 1 5 . 1 1 34 34 LYS H H 34 8.300 8.300 8.587 -0.287 18980
1162 1 5 . 1 1 35 35 GLY N N 35 109.787 109.787 105.726 4.061 18980
1163 1 5 . 1 1 35 35 GLY CA C 35 40.646 40.646 44.632 -3.986 18980
1164 1 5 . 1 1 35 35 GLY H H 35 8.518 8.518 7.338 1.180 18980
1165 1 5 . 1 1 36 36 CYS N N 36 122.657 122.657 119.688 2.969 18980
1166 1 5 . 1 1 36 36 CYS HA H 36 3.994 3.994 4.084 -0.090 18980
1167 1 5 . 1 1 36 36 CYS CA C 36 57.328 57.328 58.590 -1.262 18980
1168 1 5 . 1 1 36 36 CYS CB C 36 27.259 27.259 28.251 -0.992 18980
1169 1 5 . 1 1 36 36 CYS H H 36 8.249 8.249 8.035 0.214 18980
1170 1 5 . 1 1 37 37 TRP N N 37 132.646 132.646 125.789 6.857 18980
1171 1 5 . 1 1 37 37 TRP HA H 37 4.763 4.763 4.587 0.176 18980
1172 1 5 . 1 1 37 37 TRP CA C 37 54.955 54.955 57.547 -2.592 18980
1173 1 5 . 1 1 37 37 TRP CB C 37 26.102 26.102 29.284 -3.182 18980
1174 1 5 . 1 1 37 37 TRP H H 37 9.218 9.218 8.305 0.913 18980
1175 1 5 . 1 1 38 38 LYS N N 38 121.676 121.676 119.144 2.532 18980
1176 1 5 . 1 1 38 38 LYS HA H 38 4.200 4.200 4.012 0.188 18980
1177 1 5 . 1 1 38 38 LYS CA C 38 55.916 55.916 58.960 -3.044 18980
1178 1 5 . 1 1 38 38 LYS CB C 38 31.288 31.288 33.048 -1.760 18980
1179 1 5 . 1 1 38 38 LYS H H 38 9.626 9.626 7.865 1.761 18980
1180 1 5 . 1 1 39 39 CYS N N 39 117.746 117.746 112.318 5.428 18980
1181 1 5 . 1 1 39 39 CYS HA H 39 4.929 4.929 4.862 0.067 18980
1182 1 5 . 1 1 39 39 CYS CA C 39 56.058 56.058 57.297 -1.239 18980
1183 1 5 . 1 1 39 39 CYS CB C 39 29.705 29.705 29.234 0.471 18980
1184 1 5 . 1 1 39 39 CYS H H 39 8.612 8.612 7.806 0.806 18980
1185 1 5 . 1 1 40 40 GLY N N 40 113.510 113.510 110.638 2.872 18980
1186 1 5 . 1 1 40 40 GLY CA C 40 43.398 43.398 45.385 -1.987 18980
1187 1 5 . 1 1 40 40 GLY H H 40 8.050 8.050 7.972 0.078 18980
1188 1 5 . 1 1 41 41 LYS N N 41 121.911 121.911 121.338 0.573 18980
1189 1 5 . 1 1 41 41 LYS HA H 41 4.296 4.296 4.503 -0.207 18980
1190 1 5 . 1 1 41 41 LYS CA C 41 54.068 54.068 55.665 -1.597 18980
1191 1 5 . 1 1 41 41 LYS CB C 41 30.765 30.765 33.460 -2.695 18980
1192 1 5 . 1 1 41 41 LYS H H 41 8.340 8.340 7.536 0.804 18980
1193 1 5 . 1 1 42 42 GLU N N 42 119.418 119.418 119.743 -0.325 18980
1194 1 5 . 1 1 42 42 GLU HA H 42 4.116 4.116 4.198 -0.082 18980
1195 1 5 . 1 1 42 42 GLU CA C 42 54.054 54.054 56.340 -2.285 18980
1196 1 5 . 1 1 42 42 GLU CB C 42 27.786 27.786 30.322 -2.536 18980
1197 1 5 . 1 1 42 42 GLU H H 42 8.501 8.501 8.520 -0.019 18980
1198 1 5 . 1 1 43 43 GLY N N 43 107.782 107.782 108.604 -0.822 18980
1199 1 5 . 1 1 43 43 GLY CA C 43 42.789 42.789 45.910 -3.121 18980
1200 1 5 . 1 1 43 43 GLY H H 43 8.719 8.719 8.846 -0.127 18980
1201 1 5 . 1 1 44 44 HIS N N 44 111.284 111.284 116.050 -4.766 18980
1202 1 5 . 1 1 44 44 HIS HA H 44 4.587 4.587 4.715 -0.128 18980
1203 1 5 . 1 1 44 44 HIS CA C 44 52.665 52.665 54.260 -1.595 18980
1204 1 5 . 1 1 44 44 HIS CB C 44 27.416 27.416 30.459 -3.043 18980
1205 1 5 . 1 1 44 44 HIS H H 44 6.810 6.810 7.712 -0.902 18980
1206 1 5 . 1 1 45 45 GLN N N 45 117.297 117.297 118.988 -1.691 18980
1207 1 5 . 1 1 45 45 GLN HA H 45 3.773 3.773 4.414 -0.641 18980
1208 1 5 . 1 1 45 45 GLN CA C 45 51.454 51.454 54.224 -2.770 18980
1209 1 5 . 1 1 45 45 GLN CB C 45 28.905 28.905 30.943 -2.038 18980
1210 1 5 . 1 1 45 45 GLN H H 45 8.781 8.781 8.560 0.221 18980
1211 1 5 . 1 1 46 46 MET N N 46 117.926 117.926 123.059 -5.133 18980
1212 1 5 . 1 1 46 46 MET HA H 46 4.820 4.820 4.302 0.518 18980
1213 1 5 . 1 1 46 46 MET CA C 46 57.542 57.542 58.285 -0.743 18980
1214 1 5 . 1 1 46 46 MET CB C 46 29.549 29.549 32.154 -2.605 18980
1215 1 5 . 1 1 46 46 MET H H 46 9.008 9.008 8.683 0.325 18980
1216 1 5 . 1 1 47 47 LYS N N 47 117.631 117.631 116.980 0.651 18980
1217 1 5 . 1 1 47 47 LYS HA H 47 3.448 3.448 4.151 -0.703 18980
1218 1 5 . 1 1 47 47 LYS CA C 47 54.988 54.988 58.179 -3.191 18980
1219 1 5 . 1 1 47 47 LYS CB C 47 28.285 28.285 31.633 -3.348 18980
1220 1 5 . 1 1 47 47 LYS H H 47 6.430 6.430 8.024 -1.594 18980
1221 1 5 . 1 1 48 48 ASP N N 48 117.363 117.363 119.308 -1.945 18980
1222 1 5 . 1 1 48 48 ASP HA H 48 4.780 4.780 4.709 0.071 18980
1223 1 5 . 1 1 48 48 ASP CA C 48 50.600 50.600 54.609 -4.010 18980
1224 1 5 . 1 1 48 48 ASP CB C 48 40.029 40.029 41.629 -1.600 18980
1225 1 5 . 1 1 48 48 ASP H H 48 7.560 7.560 7.931 -0.371 18980
1226 1 5 . 1 1 49 49 CYS N N 49 122.910 122.910 118.686 4.224 18980
1227 1 5 . 1 1 49 49 CYS HA H 49 3.682 3.682 4.666 -0.984 18980
1228 1 5 . 1 1 49 49 CYS CA C 49 59.557 59.557 57.961 1.596 18980
1229 1 5 . 1 1 49 49 CYS CB C 49 28.040 28.040 29.287 -1.247 18980
1230 1 5 . 1 1 49 49 CYS H H 49 7.091 7.091 7.639 -0.548 18980
1231 1 5 . 1 1 50 50 THR N N 50 119.675 119.675 120.684 -1.009 18980
1232 1 5 . 1 1 50 50 THR HA H 50 4.293 4.293 4.223 0.070 18980
1233 1 5 . 1 1 50 50 THR CA C 50 58.855 58.855 63.729 -4.874 18980
1234 1 5 . 1 1 50 50 THR CB C 50 66.355 66.355 69.180 -2.825 18980
1235 1 5 . 1 1 50 50 THR H H 50 8.139 8.139 8.537 -0.398 18980
1236 1 5 . 1 1 51 51 GLU N N 51 124.935 124.935 120.767 4.168 18980
1237 1 5 . 1 1 51 51 GLU HA H 51 4.164 4.164 4.463 -0.299 18980
1238 1 5 . 1 1 51 51 GLU CA C 51 54.061 54.061 55.478 -1.417 18980
1239 1 5 . 1 1 51 51 GLU CB C 51 27.130 27.130 31.485 -4.354 18980
1240 1 5 . 1 1 51 51 GLU H H 51 8.551 8.551 7.936 0.615 18980
1241 1 5 . 1 1 52 52 ARG N N 52 122.624 122.624 120.700 1.924 18980
1242 1 5 . 1 1 52 52 ARG HA H 52 4.248 4.248 4.287 -0.039 18980
1243 1 5 . 1 1 52 52 ARG CA C 52 53.402 53.402 56.352 -2.950 18980
1244 1 5 . 1 1 52 52 ARG CB C 52 28.028 28.028 30.820 -2.792 18980
1245 1 5 . 1 1 52 52 ARG H H 52 8.287 8.287 8.518 -0.231 18980
1246 1 5 . 1 1 53 53 GLN N N 53 121.647 121.647 121.170 0.477 18980
1247 1 5 . 1 1 53 53 GLN HA H 53 4.248 4.248 4.398 -0.150 18980
1248 1 5 . 1 1 53 53 GLN CA C 53 52.946 52.946 55.650 -2.704 18980
1249 1 5 . 1 1 53 53 GLN CB C 53 26.794 26.794 29.148 -2.354 18980
1250 1 5 . 1 1 53 53 GLN H H 53 8.381 8.381 8.603 -0.222 18980
1251 1 5 . 1 1 54 54 ALA N N 54 125.878 125.878 123.700 2.178 18980
1252 1 5 . 1 1 54 54 ALA HA H 54 4.296 4.296 4.344 -0.048 18980
1253 1 5 . 1 1 54 54 ALA CA C 54 49.575 49.575 52.653 -3.078 18980
1254 1 5 . 1 1 54 54 ALA CB C 54 16.704 16.704 17.510 -0.806 18980
1255 1 5 . 1 1 54 54 ALA H H 54 8.338 8.338 8.580 -0.242 18980
1256 1 6 . 1 1 2 2 GLN N N 2 125.073 125.073 125.488 -0.415 18980
1257 1 6 . 1 1 2 2 GLN HA H 2 4.309 4.309 4.605 -0.296 18980
1258 1 6 . 1 1 2 2 GLN CA C 2 52.755 52.755 54.716 -1.961 18980
1259 1 6 . 1 1 2 2 GLN CB C 2 26.728 26.728 31.641 -4.913 18980
1260 1 6 . 1 1 2 2 GLN H H 2 8.503 8.503 8.203 0.300 18980
1261 1 6 . 1 1 3 3 LYS N N 3 123.202 123.202 119.496 3.706 18980
1262 1 6 . 1 1 3 3 LYS HA H 3 4.271 4.271 4.078 0.193 18980
1263 1 6 . 1 1 3 3 LYS CA C 3 53.658 53.658 57.695 -4.037 18980
1264 1 6 . 1 1 3 3 LYS CB C 3 30.442 30.442 32.556 -2.114 18980
1265 1 6 . 1 1 3 3 LYS H H 3 8.414 8.414 8.457 -0.043 18980
1266 1 6 . 1 1 4 4 GLY N N 4 109.574 109.574 109.101 0.473 18980
1267 1 6 . 1 1 4 4 GLY CA C 4 42.455 42.455 45.554 -3.099 18980
1268 1 6 . 1 1 4 4 GLY H H 4 8.394 8.394 8.963 -0.569 18980
1269 1 6 . 1 1 5 5 ASN N N 5 118.311 118.311 117.793 0.518 18980
1270 1 6 . 1 1 5 5 ASN HA H 5 4.625 4.625 4.467 0.158 18980
1271 1 6 . 1 1 5 5 ASN CA C 5 50.146 50.146 53.012 -2.866 18980
1272 1 6 . 1 1 5 5 ASN CB C 5 36.059 36.059 38.929 -2.870 18980
1273 1 6 . 1 1 5 5 ASN H H 5 8.240 8.240 7.445 0.795 18980
1274 1 6 . 1 1 6 6 PHE N N 6 120.460 120.460 121.609 -1.149 18980
1275 1 6 . 1 1 6 6 PHE HA H 6 4.541 4.541 4.555 -0.014 18980
1276 1 6 . 1 1 6 6 PHE CA C 6 55.112 55.112 57.427 -2.315 18980
1277 1 6 . 1 1 6 6 PHE CB C 6 36.457 36.457 38.808 -2.351 18980
1278 1 6 . 1 1 6 6 PHE H H 6 8.164 8.164 7.468 0.696 18980
1279 1 6 . 1 1 7 7 ARG N N 7 121.606 121.606 119.130 2.476 18980
1280 1 6 . 1 1 7 7 ARG HA H 7 4.193 4.193 4.278 -0.085 18980
1281 1 6 . 1 1 7 7 ARG CA C 7 53.586 53.586 56.646 -3.060 18980
1282 1 6 . 1 1 7 7 ARG CB C 7 27.788 27.788 28.726 -0.938 18980
1283 1 6 . 1 1 7 7 ARG H H 7 8.184 8.184 8.768 -0.584 18980
1284 1 6 . 1 1 8 8 ASN N N 8 118.773 118.773 115.540 3.233 18980
1285 1 6 . 1 1 8 8 ASN HA H 8 4.570 4.570 4.608 -0.038 18980
1286 1 6 . 1 1 8 8 ASN CA C 8 50.518 50.518 54.994 -4.476 18980
1287 1 6 . 1 1 8 8 ASN CB C 8 35.894 35.894 37.779 -1.885 18980
1288 1 6 . 1 1 8 8 ASN H H 8 8.294 8.294 8.729 -0.435 18980
1289 1 6 . 1 1 9 9 GLN N N 9 120.522 120.522 116.674 3.848 18980
1290 1 6 . 1 1 9 9 GLN HA H 9 4.245 4.245 4.563 -0.318 18980
1291 1 6 . 1 1 9 9 GLN CA C 9 53.202 53.202 56.552 -3.350 18980
1292 1 6 . 1 1 9 9 GLN CB C 9 26.688 26.688 30.193 -3.505 18980
1293 1 6 . 1 1 9 9 GLN H H 9 8.218 8.218 8.196 0.022 18980
1294 1 6 . 1 1 10 10 ARG N N 10 121.826 121.826 119.379 2.447 18980
1295 1 6 . 1 1 10 10 ARG HA H 10 4.244 4.244 4.532 -0.288 18980
1296 1 6 . 1 1 10 10 ARG CA C 10 53.208 53.208 56.916 -3.708 18980
1297 1 6 . 1 1 10 10 ARG CB C 10 27.939 27.939 31.969 -4.030 18980
1298 1 6 . 1 1 10 10 ARG H H 10 8.273 8.273 8.432 -0.159 18980
1299 1 6 . 1 1 11 11 LYS N N 11 122.737 122.737 119.252 3.485 18980
1300 1 6 . 1 1 11 11 LYS HA H 11 4.263 4.263 4.392 -0.129 18980
1301 1 6 . 1 1 11 11 LYS CA C 11 53.578 53.578 57.520 -3.942 18980
1302 1 6 . 1 1 11 11 LYS CB C 11 30.323 30.323 33.516 -3.193 18980
1303 1 6 . 1 1 11 11 LYS H H 11 8.299 8.299 8.220 0.079 18980
1304 1 6 . 1 1 12 12 THR N N 12 116.442 116.442 111.358 5.084 18980
1305 1 6 . 1 1 12 12 THR HA H 12 4.254 4.254 4.606 -0.352 18980
1306 1 6 . 1 1 12 12 THR CA C 12 58.726 58.726 60.361 -1.635 18980
1307 1 6 . 1 1 12 12 THR CB C 12 66.915 66.915 71.526 -4.611 18980
1308 1 6 . 1 1 12 12 THR H H 12 8.088 8.088 7.816 0.272 18980
1309 1 6 . 1 1 13 13 VAL N N 13 122.626 122.626 118.232 4.394 18980
1310 1 6 . 1 1 13 13 VAL HA H 13 4.021 4.021 4.560 -0.539 18980
1311 1 6 . 1 1 13 13 VAL CA C 13 58.497 58.497 61.093 -2.596 18980
1312 1 6 . 1 1 13 13 VAL CB C 13 30.485 30.485 35.595 -5.110 18980
1313 1 6 . 1 1 13 13 VAL H H 13 8.209 8.209 8.192 0.017 18980
1314 1 6 . 1 1 14 14 LYS N N 14 123.504 123.504 126.566 -3.062 18980
1315 1 6 . 1 1 14 14 LYS HA H 14 4.412 4.412 4.602 -0.190 18980
1316 1 6 . 1 1 14 14 LYS CA C 14 51.599 51.599 54.716 -3.117 18980
1317 1 6 . 1 1 14 14 LYS CB C 14 31.540 31.540 35.497 -3.957 18980
1318 1 6 . 1 1 14 14 LYS H H 14 8.012 8.012 8.241 -0.229 18980
1319 1 6 . 1 1 15 15 CYS N N 15 129.731 129.731 126.261 3.470 18980
1320 1 6 . 1 1 15 15 CYS HA H 15 4.215 4.215 4.146 0.069 18980
1321 1 6 . 1 1 15 15 CYS CA C 15 56.967 56.967 58.804 -1.837 18980
1322 1 6 . 1 1 15 15 CYS CB C 15 27.829 27.829 27.820 0.009 18980
1323 1 6 . 1 1 15 15 CYS H H 15 8.256 8.256 8.455 -0.199 18980
1324 1 6 . 1 1 16 16 PHE N N 16 128.836 128.836 124.724 4.112 18980
1325 1 6 . 1 1 16 16 PHE HA H 16 4.615 4.615 4.403 0.212 18980
1326 1 6 . 1 1 16 16 PHE CA C 16 56.137 56.137 57.912 -1.775 18980
1327 1 6 . 1 1 16 16 PHE CB C 16 37.103 37.103 38.555 -1.452 18980
1328 1 6 . 1 1 16 16 PHE H H 16 9.299 9.299 8.450 0.849 18980
1329 1 6 . 1 1 17 17 ASN N N 17 118.280 118.280 119.086 -0.806 18980
1330 1 6 . 1 1 17 17 ASN HA H 17 3.816 3.816 4.228 -0.412 18980
1331 1 6 . 1 1 17 17 ASN CA C 17 53.075 53.075 55.809 -2.734 18980
1332 1 6 . 1 1 17 17 ASN CB C 17 36.212 36.212 38.470 -2.258 18980
1333 1 6 . 1 1 17 17 ASN H H 17 9.156 9.156 7.589 1.567 18980
1334 1 6 . 1 1 18 18 CYS N N 18 116.876 116.876 113.360 3.516 18980
1335 1 6 . 1 1 18 18 CYS HA H 18 4.696 4.696 4.563 0.133 18980
1336 1 6 . 1 1 18 18 CYS CA C 18 56.126 56.126 58.248 -2.122 18980
1337 1 6 . 1 1 18 18 CYS CB C 18 29.066 29.066 27.694 1.372 18980
1338 1 6 . 1 1 18 18 CYS H H 18 8.489 8.489 7.467 1.022 18980
1339 1 6 . 1 1 19 19 GLY N N 19 112.394 112.394 108.414 3.980 18980
1340 1 6 . 1 1 19 19 GLY CA C 19 43.589 43.589 45.408 -1.819 18980
1341 1 6 . 1 1 19 19 GLY H H 19 7.703 7.703 8.318 -0.615 18980
1342 1 6 . 1 1 20 20 LYS N N 20 120.951 120.951 121.954 -1.003 18980
1343 1 6 . 1 1 20 20 LYS HA H 20 4.364 4.364 4.487 -0.123 18980
1344 1 6 . 1 1 20 20 LYS CA C 20 53.066 53.066 55.053 -1.987 18980
1345 1 6 . 1 1 20 20 LYS CB C 20 30.653 30.653 33.325 -2.672 18980
1346 1 6 . 1 1 20 20 LYS H H 20 8.162 8.162 7.430 0.732 18980
1347 1 6 . 1 1 21 21 GLU N N 21 119.095 119.095 120.640 -1.545 18980
1348 1 6 . 1 1 21 21 GLU HA H 21 4.602 4.602 4.260 0.342 18980
1349 1 6 . 1 1 21 21 GLU CA C 21 53.327 53.327 58.415 -5.088 18980
1350 1 6 . 1 1 21 21 GLU CB C 21 28.049 28.049 30.173 -2.124 18980
1351 1 6 . 1 1 21 21 GLU H H 21 8.454 8.454 8.720 -0.266 18980
1352 1 6 . 1 1 22 22 GLY N N 22 107.727 107.727 108.726 -0.999 18980
1353 1 6 . 1 1 22 22 GLY CA C 22 42.965 42.965 45.967 -3.002 18980
1354 1 6 . 1 1 22 22 GLY H H 22 8.639 8.639 8.467 0.172 18980
1355 1 6 . 1 1 23 23 HIS N N 23 113.019 113.019 115.722 -2.703 18980
1356 1 6 . 1 1 23 23 HIS HA H 23 4.613 4.613 4.743 -0.130 18980
1357 1 6 . 1 1 23 23 HIS CA C 23 52.409 52.409 54.640 -2.231 18980
1358 1 6 . 1 1 23 23 HIS CB C 23 27.389 27.389 31.367 -3.978 18980
1359 1 6 . 1 1 23 23 HIS H H 23 6.992 6.992 7.320 -0.328 18980
1360 1 6 . 1 1 24 24 ILE N N 24 105.931 105.931 112.612 -6.681 18980
1361 1 6 . 1 1 24 24 ILE HA H 24 4.313 4.313 4.346 -0.033 18980
1362 1 6 . 1 1 24 24 ILE CA C 24 56.515 56.515 58.265 -1.750 18980
1363 1 6 . 1 1 24 24 ILE CB C 24 38.320 38.320 41.492 -3.172 18980
1364 1 6 . 1 1 24 24 ILE H H 24 7.578 7.578 8.008 -0.430 18980
1365 1 6 . 1 1 25 25 ALA N N 25 122.665 122.665 125.454 -2.789 18980
1366 1 6 . 1 1 25 25 ALA HA H 25 4.521 4.521 3.816 0.705 18980
1367 1 6 . 1 1 25 25 ALA CA C 25 53.097 53.097 54.792 -1.695 18980
1368 1 6 . 1 1 25 25 ALA CB C 25 16.460 16.460 17.919 -1.459 18980
1369 1 6 . 1 1 25 25 ALA H H 25 8.944 8.944 8.413 0.531 18980
1370 1 6 . 1 1 26 26 LYS N N 26 117.327 117.327 116.309 1.018 18980
1371 1 6 . 1 1 26 26 LYS HA H 26 2.735 2.735 4.065 -1.330 18980
1372 1 6 . 1 1 26 26 LYS CA C 26 55.268 55.268 59.066 -3.798 18980
1373 1 6 . 1 1 26 26 LYS CB C 26 31.527 31.527 32.272 -0.745 18980
1374 1 6 . 1 1 26 26 LYS H H 26 6.448 6.448 8.300 -1.852 18980
1375 1 6 . 1 1 27 27 ASN N N 27 111.844 111.844 117.306 -5.462 18980
1376 1 6 . 1 1 27 27 ASN HA H 27 4.844 4.844 4.681 0.163 18980
1377 1 6 . 1 1 27 27 ASN CA C 27 48.766 48.766 53.349 -4.583 18980
1378 1 6 . 1 1 27 27 ASN CB C 27 37.372 37.372 39.409 -2.037 18980
1379 1 6 . 1 1 27 27 ASN H H 27 7.536 7.536 7.691 -0.155 18980
1380 1 6 . 1 1 28 28 CYS N N 28 122.908 122.908 120.184 2.724 18980
1381 1 6 . 1 1 28 28 CYS HA H 28 3.590 3.590 4.118 -0.528 18980
1382 1 6 . 1 1 28 28 CYS CA C 28 58.923 58.923 60.163 -1.240 18980
1383 1 6 . 1 1 28 28 CYS CB C 28 28.111 28.111 27.799 0.312 18980
1384 1 6 . 1 1 28 28 CYS H H 28 7.195 7.195 7.899 -0.704 18980
1385 1 6 . 1 1 29 29 ARG N N 29 129.416 129.416 125.067 4.349 18980
1386 1 6 . 1 1 29 29 ARG HA H 29 4.446 4.446 4.509 -0.063 18980
1387 1 6 . 1 1 29 29 ARG CA C 29 52.480 52.480 55.457 -2.977 18980
1388 1 6 . 1 1 29 29 ARG CB C 29 27.564 27.564 29.999 -2.435 18980
1389 1 6 . 1 1 29 29 ARG H H 29 8.885 8.885 8.531 0.354 18980
1390 1 6 . 1 1 30 30 ALA N N 30 127.959 127.959 125.687 2.272 18980
1391 1 6 . 1 1 30 30 ALA HA H 30 4.475 4.475 4.465 0.010 18980
1392 1 6 . 1 1 30 30 ALA CA C 30 48.220 48.220 50.734 -2.514 18980
1393 1 6 . 1 1 30 30 ALA CB C 30 15.112 15.112 18.522 -3.410 18980
1394 1 6 . 1 1 30 30 ALA H H 30 8.744 8.744 7.458 1.286 18980
1395 1 6 . 1 1 31 31 PRO HA H 31 4.238 4.238 4.437 -0.199 18980
1396 1 6 . 1 1 31 31 PRO CA C 31 60.017 60.017 63.028 -3.011 18980
1397 1 6 . 1 1 31 31 PRO CB C 31 28.726 28.726 32.531 -3.805 18980
1398 1 6 . 1 1 32 32 ARG N N 32 123.635 123.635 122.213 1.422 18980
1399 1 6 . 1 1 32 32 ARG HA H 32 4.391 4.391 4.690 -0.299 18980
1400 1 6 . 1 1 32 32 ARG CA C 32 53.336 53.336 55.370 -2.034 18980
1401 1 6 . 1 1 32 32 ARG CB C 32 27.689 27.689 31.880 -4.191 18980
1402 1 6 . 1 1 32 32 ARG H H 32 8.740 8.740 8.433 0.307 18980
1403 1 6 . 1 1 33 33 LYS N N 33 127.972 127.972 123.850 4.122 18980
1404 1 6 . 1 1 33 33 LYS HA H 33 4.339 4.339 4.368 -0.029 18980
1405 1 6 . 1 1 33 33 LYS CA C 33 53.372 53.372 56.621 -3.249 18980
1406 1 6 . 1 1 33 33 LYS CB C 33 30.439 30.439 33.174 -2.735 18980
1407 1 6 . 1 1 33 33 LYS H H 33 8.868 8.868 8.910 -0.042 18980
1408 1 6 . 1 1 34 34 LYS N N 34 120.697 120.697 121.289 -0.592 18980
1409 1 6 . 1 1 34 34 LYS HA H 34 4.393 4.393 4.310 0.083 18980
1410 1 6 . 1 1 34 34 LYS CA C 34 54.385 54.385 56.042 -1.657 18980
1411 1 6 . 1 1 34 34 LYS CB C 34 30.651 30.651 32.344 -1.693 18980
1412 1 6 . 1 1 34 34 LYS H H 34 8.300 8.300 8.599 -0.299 18980
1413 1 6 . 1 1 35 35 GLY N N 35 109.787 109.787 105.257 4.530 18980
1414 1 6 . 1 1 35 35 GLY CA C 35 40.646 40.646 44.540 -3.894 18980
1415 1 6 . 1 1 35 35 GLY H H 35 8.518 8.518 7.322 1.196 18980
1416 1 6 . 1 1 36 36 CYS N N 36 122.657 122.657 119.967 2.690 18980
1417 1 6 . 1 1 36 36 CYS HA H 36 3.994 3.994 4.090 -0.096 18980
1418 1 6 . 1 1 36 36 CYS CA C 36 57.328 57.328 58.531 -1.203 18980
1419 1 6 . 1 1 36 36 CYS CB C 36 27.259 27.259 28.142 -0.883 18980
1420 1 6 . 1 1 36 36 CYS H H 36 8.249 8.249 8.015 0.234 18980
1421 1 6 . 1 1 37 37 TRP N N 37 132.646 132.646 126.589 6.057 18980
1422 1 6 . 1 1 37 37 TRP HA H 37 4.763 4.763 4.512 0.251 18980
1423 1 6 . 1 1 37 37 TRP CA C 37 54.955 54.955 57.889 -2.934 18980
1424 1 6 . 1 1 37 37 TRP CB C 37 26.102 26.102 29.069 -2.967 18980
1425 1 6 . 1 1 37 37 TRP H H 37 9.218 9.218 8.408 0.810 18980
1426 1 6 . 1 1 38 38 LYS N N 38 121.676 121.676 119.608 2.068 18980
1427 1 6 . 1 1 38 38 LYS HA H 38 4.200 4.200 4.031 0.169 18980
1428 1 6 . 1 1 38 38 LYS CA C 38 55.916 55.916 58.997 -3.081 18980
1429 1 6 . 1 1 38 38 LYS CB C 38 31.288 31.288 32.933 -1.645 18980
1430 1 6 . 1 1 38 38 LYS H H 38 9.626 9.626 7.848 1.778 18980
1431 1 6 . 1 1 39 39 CYS N N 39 117.746 117.746 111.840 5.906 18980
1432 1 6 . 1 1 39 39 CYS HA H 39 4.929 4.929 4.802 0.127 18980
1433 1 6 . 1 1 39 39 CYS CA C 39 56.058 56.058 57.531 -1.473 18980
1434 1 6 . 1 1 39 39 CYS CB C 39 29.705 29.705 29.421 0.284 18980
1435 1 6 . 1 1 39 39 CYS H H 39 8.612 8.612 7.693 0.919 18980
1436 1 6 . 1 1 40 40 GLY N N 40 113.510 113.510 111.246 2.264 18980
1437 1 6 . 1 1 40 40 GLY CA C 40 43.398 43.398 45.477 -2.079 18980
1438 1 6 . 1 1 40 40 GLY H H 40 8.050 8.050 7.977 0.073 18980
1439 1 6 . 1 1 41 41 LYS N N 41 121.911 121.911 121.451 0.460 18980
1440 1 6 . 1 1 41 41 LYS HA H 41 4.296 4.296 4.431 -0.135 18980
1441 1 6 . 1 1 41 41 LYS CA C 41 54.068 54.068 55.804 -1.736 18980
1442 1 6 . 1 1 41 41 LYS CB C 41 30.765 30.765 33.208 -2.443 18980
1443 1 6 . 1 1 41 41 LYS H H 41 8.340 8.340 7.493 0.847 18980
1444 1 6 . 1 1 42 42 GLU N N 42 119.418 119.418 120.102 -0.684 18980
1445 1 6 . 1 1 42 42 GLU HA H 42 4.116 4.116 4.292 -0.176 18980
1446 1 6 . 1 1 42 42 GLU CA C 42 54.054 54.054 56.385 -2.330 18980
1447 1 6 . 1 1 42 42 GLU CB C 42 27.786 27.786 30.467 -2.681 18980
1448 1 6 . 1 1 42 42 GLU H H 42 8.501 8.501 8.477 0.024 18980
1449 1 6 . 1 1 43 43 GLY N N 43 107.782 107.782 108.225 -0.443 18980
1450 1 6 . 1 1 43 43 GLY CA C 43 42.789 42.789 45.931 -3.142 18980
1451 1 6 . 1 1 43 43 GLY H H 43 8.719 8.719 8.856 -0.137 18980
1452 1 6 . 1 1 44 44 HIS N N 44 111.284 111.284 116.110 -4.826 18980
1453 1 6 . 1 1 44 44 HIS HA H 44 4.587 4.587 4.712 -0.125 18980
1454 1 6 . 1 1 44 44 HIS CA C 44 52.665 52.665 54.175 -1.510 18980
1455 1 6 . 1 1 44 44 HIS CB C 44 27.416 27.416 30.600 -3.184 18980
1456 1 6 . 1 1 44 44 HIS H H 44 6.810 6.810 7.714 -0.904 18980
1457 1 6 . 1 1 45 45 GLN N N 45 117.297 117.297 119.153 -1.856 18980
1458 1 6 . 1 1 45 45 GLN HA H 45 3.773 3.773 4.399 -0.626 18980
1459 1 6 . 1 1 45 45 GLN CA C 45 51.454 51.454 54.147 -2.693 18980
1460 1 6 . 1 1 45 45 GLN CB C 45 28.905 28.905 30.733 -1.828 18980
1461 1 6 . 1 1 45 45 GLN H H 45 8.781 8.781 8.632 0.149 18980
1462 1 6 . 1 1 46 46 MET N N 46 117.926 117.926 122.887 -4.961 18980
1463 1 6 . 1 1 46 46 MET HA H 46 4.820 4.820 4.336 0.484 18980
1464 1 6 . 1 1 46 46 MET CA C 46 57.542 57.542 58.010 -0.468 18980
1465 1 6 . 1 1 46 46 MET CB C 46 29.549 29.549 32.256 -2.707 18980
1466 1 6 . 1 1 46 46 MET H H 46 9.008 9.008 8.640 0.368 18980
1467 1 6 . 1 1 47 47 LYS N N 47 117.631 117.631 116.626 1.005 18980
1468 1 6 . 1 1 47 47 LYS HA H 47 3.448 3.448 4.183 -0.735 18980
1469 1 6 . 1 1 47 47 LYS CA C 47 54.988 54.988 58.054 -3.066 18980
1470 1 6 . 1 1 47 47 LYS CB C 47 28.285 28.285 31.911 -3.626 18980
1471 1 6 . 1 1 47 47 LYS H H 47 6.430 6.430 7.891 -1.461 18980
1472 1 6 . 1 1 48 48 ASP N N 48 117.363 117.363 119.639 -2.276 18980
1473 1 6 . 1 1 48 48 ASP HA H 48 4.780 4.780 4.657 0.123 18980
1474 1 6 . 1 1 48 48 ASP CA C 48 50.600 50.600 54.842 -4.242 18980
1475 1 6 . 1 1 48 48 ASP CB C 48 40.029 40.029 41.637 -1.608 18980
1476 1 6 . 1 1 48 48 ASP H H 48 7.560 7.560 7.946 -0.386 18980
1477 1 6 . 1 1 49 49 CYS N N 49 122.910 122.910 118.471 4.439 18980
1478 1 6 . 1 1 49 49 CYS HA H 49 3.682 3.682 4.581 -0.899 18980
1479 1 6 . 1 1 49 49 CYS CA C 49 59.557 59.557 58.258 1.298 18980
1480 1 6 . 1 1 49 49 CYS CB C 49 28.040 28.040 29.143 -1.103 18980
1481 1 6 . 1 1 49 49 CYS H H 49 7.091 7.091 7.434 -0.343 18980
1482 1 6 . 1 1 50 50 THR N N 50 119.675 119.675 120.675 -1.000 18980
1483 1 6 . 1 1 50 50 THR HA H 50 4.293 4.293 4.259 0.034 18980
1484 1 6 . 1 1 50 50 THR CA C 50 58.855 58.855 63.405 -4.550 18980
1485 1 6 . 1 1 50 50 THR CB C 50 66.355 66.355 69.003 -2.648 18980
1486 1 6 . 1 1 50 50 THR H H 50 8.139 8.139 8.586 -0.447 18980
1487 1 6 . 1 1 51 51 GLU N N 51 124.935 124.935 122.078 2.857 18980
1488 1 6 . 1 1 51 51 GLU HA H 51 4.164 4.164 4.327 -0.163 18980
1489 1 6 . 1 1 51 51 GLU CA C 51 54.061 54.061 56.115 -2.054 18980
1490 1 6 . 1 1 51 51 GLU CB C 51 27.130 27.130 30.375 -3.245 18980
1491 1 6 . 1 1 51 51 GLU H H 51 8.551 8.551 8.435 0.116 18980
1492 1 6 . 1 1 52 52 ARG N N 52 122.624 122.624 121.320 1.304 18980
1493 1 6 . 1 1 52 52 ARG HA H 52 4.248 4.248 4.586 -0.338 18980
1494 1 6 . 1 1 52 52 ARG CA C 52 53.402 53.402 54.747 -1.345 18980
1495 1 6 . 1 1 52 52 ARG CB C 52 28.028 28.028 31.520 -3.491 18980
1496 1 6 . 1 1 52 52 ARG H H 52 8.287 8.287 8.482 -0.195 18980
1497 1 6 . 1 1 53 53 GLN N N 53 121.647 121.647 119.407 2.240 18980
1498 1 6 . 1 1 53 53 GLN HA H 53 4.248 4.248 4.109 0.139 18980
1499 1 6 . 1 1 53 53 GLN CA C 53 52.946 52.946 57.352 -4.406 18980
1500 1 6 . 1 1 53 53 GLN CB C 53 26.794 26.794 29.495 -2.701 18980
1501 1 6 . 1 1 53 53 GLN H H 53 8.381 8.381 8.457 -0.076 18980
1502 1 6 . 1 1 54 54 ALA N N 54 125.878 125.878 117.807 8.071 18980
1503 1 6 . 1 1 54 54 ALA HA H 54 4.296 4.296 4.432 -0.136 18980
1504 1 6 . 1 1 54 54 ALA CA C 54 49.575 49.575 51.382 -1.807 18980
1505 1 6 . 1 1 54 54 ALA CB C 54 16.704 16.704 21.053 -4.349 18980
1506 1 6 . 1 1 54 54 ALA H H 54 8.338 8.338 7.708 0.630 18980
1507 1 7 . 1 1 2 2 GLN N N 2 125.073 125.073 124.457 0.616 18980
1508 1 7 . 1 1 2 2 GLN HA H 2 4.309 4.309 4.897 -0.588 18980
1509 1 7 . 1 1 2 2 GLN CA C 2 52.755 52.755 54.541 -1.786 18980
1510 1 7 . 1 1 2 2 GLN CB C 2 26.728 26.728 31.082 -4.354 18980
1511 1 7 . 1 1 2 2 GLN H H 2 8.503 8.503 8.415 0.088 18980
1512 1 7 . 1 1 3 3 LYS N N 3 123.202 123.202 123.828 -0.626 18980
1513 1 7 . 1 1 3 3 LYS HA H 3 4.271 4.271 4.317 -0.046 18980
1514 1 7 . 1 1 3 3 LYS CA C 3 53.658 53.658 55.861 -2.203 18980
1515 1 7 . 1 1 3 3 LYS CB C 3 30.442 30.442 31.211 -0.769 18980
1516 1 7 . 1 1 3 3 LYS H H 3 8.414 8.414 8.993 -0.579 18980
1517 1 7 . 1 1 4 4 GLY N N 4 109.574 109.574 111.528 -1.954 18980
1518 1 7 . 1 1 4 4 GLY CA C 4 42.455 42.455 46.458 -4.003 18980
1519 1 7 . 1 1 4 4 GLY H H 4 8.394 8.394 8.317 0.077 18980
1520 1 7 . 1 1 5 5 ASN N N 5 118.311 118.311 122.073 -3.762 18980
1521 1 7 . 1 1 5 5 ASN HA H 5 4.625 4.625 4.468 0.157 18980
1522 1 7 . 1 1 5 5 ASN CA C 5 50.146 50.146 53.856 -3.710 18980
1523 1 7 . 1 1 5 5 ASN CB C 5 36.059 36.059 38.531 -2.472 18980
1524 1 7 . 1 1 5 5 ASN H H 5 8.240 8.240 8.360 -0.120 18980
1525 1 7 . 1 1 6 6 PHE N N 6 120.460 120.460 118.120 2.340 18980
1526 1 7 . 1 1 6 6 PHE HA H 6 4.541 4.541 4.712 -0.171 18980
1527 1 7 . 1 1 6 6 PHE CA C 6 55.112 55.112 56.610 -1.498 18980
1528 1 7 . 1 1 6 6 PHE CB C 6 36.457 36.457 40.243 -3.786 18980
1529 1 7 . 1 1 6 6 PHE H H 6 8.164 8.164 7.399 0.765 18980
1530 1 7 . 1 1 7 7 ARG N N 7 121.606 121.606 121.131 0.475 18980
1531 1 7 . 1 1 7 7 ARG HA H 7 4.193 4.193 4.438 -0.245 18980
1532 1 7 . 1 1 7 7 ARG CA C 7 53.586 53.586 55.202 -1.616 18980
1533 1 7 . 1 1 7 7 ARG CB C 7 27.788 27.788 31.277 -3.489 18980
1534 1 7 . 1 1 7 7 ARG H H 7 8.184 8.184 8.788 -0.604 18980
1535 1 7 . 1 1 8 8 ASN N N 8 118.773 118.773 123.185 -4.412 18980
1536 1 7 . 1 1 8 8 ASN HA H 8 4.570 4.570 4.643 -0.073 18980
1537 1 7 . 1 1 8 8 ASN CA C 8 50.518 50.518 52.968 -2.450 18980
1538 1 7 . 1 1 8 8 ASN CB C 8 35.894 35.894 36.713 -0.819 18980
1539 1 7 . 1 1 8 8 ASN H H 8 8.294 8.294 9.079 -0.785 18980
1540 1 7 . 1 1 9 9 GLN N N 9 120.522 120.522 112.715 7.807 18980
1541 1 7 . 1 1 9 9 GLN HA H 9 4.245 4.245 3.978 0.267 18980
1542 1 7 . 1 1 9 9 GLN CA C 9 53.202 53.202 57.416 -4.214 18980
1543 1 7 . 1 1 9 9 GLN CB C 9 26.688 26.688 26.636 0.052 18980
1544 1 7 . 1 1 9 9 GLN H H 9 8.218 8.218 8.101 0.117 18980
1545 1 7 . 1 1 10 10 ARG N N 10 121.826 121.826 121.134 0.692 18980
1546 1 7 . 1 1 10 10 ARG HA H 10 4.244 4.244 4.247 -0.003 18980
1547 1 7 . 1 1 10 10 ARG CA C 10 53.208 53.208 56.628 -3.420 18980
1548 1 7 . 1 1 10 10 ARG CB C 10 27.939 27.939 30.118 -2.179 18980
1549 1 7 . 1 1 10 10 ARG H H 10 8.273 8.273 7.999 0.274 18980
1550 1 7 . 1 1 11 11 LYS N N 11 122.737 122.737 124.042 -1.305 18980
1551 1 7 . 1 1 11 11 LYS HA H 11 4.263 4.263 4.045 0.218 18980
1552 1 7 . 1 1 11 11 LYS CA C 11 53.578 53.578 58.468 -4.890 18980
1553 1 7 . 1 1 11 11 LYS CB C 11 30.323 30.323 31.838 -1.515 18980
1554 1 7 . 1 1 11 11 LYS H H 11 8.299 8.299 8.811 -0.512 18980
1555 1 7 . 1 1 12 12 THR N N 12 116.442 116.442 113.726 2.716 18980
1556 1 7 . 1 1 12 12 THR HA H 12 4.254 4.254 4.620 -0.366 18980
1557 1 7 . 1 1 12 12 THR CA C 12 58.726 58.726 61.178 -2.452 18980
1558 1 7 . 1 1 12 12 THR CB C 12 66.915 66.915 72.466 -5.551 18980
1559 1 7 . 1 1 12 12 THR H H 12 8.088 8.088 7.742 0.346 18980
1560 1 7 . 1 1 13 13 VAL N N 13 122.626 122.626 120.569 2.057 18980
1561 1 7 . 1 1 13 13 VAL HA H 13 4.021 4.021 4.593 -0.572 18980
1562 1 7 . 1 1 13 13 VAL CA C 13 58.497 58.497 60.145 -1.648 18980
1563 1 7 . 1 1 13 13 VAL CB C 13 30.485 30.485 35.837 -5.352 18980
1564 1 7 . 1 1 13 13 VAL H H 13 8.209 8.209 8.382 -0.173 18980
1565 1 7 . 1 1 14 14 LYS N N 14 123.504 123.504 126.459 -2.955 18980
1566 1 7 . 1 1 14 14 LYS HA H 14 4.412 4.412 4.713 -0.300 18980
1567 1 7 . 1 1 14 14 LYS CA C 14 51.599 51.599 54.293 -2.694 18980
1568 1 7 . 1 1 14 14 LYS CB C 14 31.540 31.540 35.611 -4.071 18980
1569 1 7 . 1 1 14 14 LYS H H 14 8.012 8.012 7.948 0.064 18980
1570 1 7 . 1 1 15 15 CYS N N 15 129.731 129.731 126.323 3.408 18980
1571 1 7 . 1 1 15 15 CYS HA H 15 4.215 4.215 4.160 0.055 18980
1572 1 7 . 1 1 15 15 CYS CA C 15 56.967 56.967 58.883 -1.916 18980
1573 1 7 . 1 1 15 15 CYS CB C 15 27.829 27.829 28.464 -0.635 18980
1574 1 7 . 1 1 15 15 CYS H H 15 8.256 8.256 8.530 -0.274 18980
1575 1 7 . 1 1 16 16 PHE N N 16 128.836 128.836 123.335 5.501 18980
1576 1 7 . 1 1 16 16 PHE HA H 16 4.615 4.615 3.502 1.113 18980
1577 1 7 . 1 1 16 16 PHE CA C 16 56.137 56.137 57.667 -1.530 18980
1578 1 7 . 1 1 16 16 PHE CB C 16 37.103 37.103 38.306 -1.202 18980
1579 1 7 . 1 1 16 16 PHE H H 16 9.299 9.299 8.179 1.120 18980
1580 1 7 . 1 1 17 17 ASN N N 17 118.280 118.280 118.122 0.158 18980
1581 1 7 . 1 1 17 17 ASN HA H 17 3.816 3.816 3.887 -0.071 18980
1582 1 7 . 1 1 17 17 ASN CA C 17 53.075 53.075 55.553 -2.478 18980
1583 1 7 . 1 1 17 17 ASN CB C 17 36.212 36.212 38.505 -2.293 18980
1584 1 7 . 1 1 17 17 ASN H H 17 9.156 9.156 7.306 1.850 18980
1585 1 7 . 1 1 18 18 CYS N N 18 116.876 116.876 114.494 2.382 18980
1586 1 7 . 1 1 18 18 CYS HA H 18 4.696 4.696 4.658 0.038 18980
1587 1 7 . 1 1 18 18 CYS CA C 18 56.126 56.126 58.435 -2.309 18980
1588 1 7 . 1 1 18 18 CYS CB C 18 29.066 29.066 27.927 1.139 18980
1589 1 7 . 1 1 18 18 CYS H H 18 8.489 8.489 7.452 1.037 18980
1590 1 7 . 1 1 19 19 GLY N N 19 112.394 112.394 109.962 2.432 18980
1591 1 7 . 1 1 19 19 GLY CA C 19 43.589 43.589 45.476 -1.887 18980
1592 1 7 . 1 1 19 19 GLY H H 19 7.703 7.703 8.098 -0.395 18980
1593 1 7 . 1 1 20 20 LYS N N 20 120.951 120.951 122.054 -1.103 18980
1594 1 7 . 1 1 20 20 LYS HA H 20 4.364 4.364 4.492 -0.128 18980
1595 1 7 . 1 1 20 20 LYS CA C 20 53.066 53.066 55.464 -2.398 18980
1596 1 7 . 1 1 20 20 LYS CB C 20 30.653 30.653 33.285 -2.632 18980
1597 1 7 . 1 1 20 20 LYS H H 20 8.162 8.162 7.493 0.669 18980
1598 1 7 . 1 1 21 21 GLU N N 21 119.095 119.095 120.145 -1.050 18980
1599 1 7 . 1 1 21 21 GLU HA H 21 4.602 4.602 4.460 0.142 18980
1600 1 7 . 1 1 21 21 GLU CA C 21 53.327 53.327 58.222 -4.895 18980
1601 1 7 . 1 1 21 21 GLU CB C 21 28.049 28.049 30.338 -2.289 18980
1602 1 7 . 1 1 21 21 GLU H H 21 8.454 8.454 8.702 -0.248 18980
1603 1 7 . 1 1 22 22 GLY N N 22 107.727 107.727 108.659 -0.932 18980
1604 1 7 . 1 1 22 22 GLY CA C 22 42.965 42.965 46.144 -3.179 18980
1605 1 7 . 1 1 22 22 GLY H H 22 8.639 8.639 8.473 0.166 18980
1606 1 7 . 1 1 23 23 HIS N N 23 113.019 113.019 115.932 -2.913 18980
1607 1 7 . 1 1 23 23 HIS HA H 23 4.613 4.613 4.778 -0.165 18980
1608 1 7 . 1 1 23 23 HIS CA C 23 52.409 52.409 54.528 -2.119 18980
1609 1 7 . 1 1 23 23 HIS CB C 23 27.389 27.389 31.542 -4.153 18980
1610 1 7 . 1 1 23 23 HIS H H 23 6.992 6.992 7.352 -0.360 18980
1611 1 7 . 1 1 24 24 ILE N N 24 105.931 105.931 112.605 -6.674 18980
1612 1 7 . 1 1 24 24 ILE HA H 24 4.313 4.313 4.312 0.001 18980
1613 1 7 . 1 1 24 24 ILE CA C 24 56.515 56.515 58.234 -1.719 18980
1614 1 7 . 1 1 24 24 ILE CB C 24 38.320 38.320 41.459 -3.139 18980
1615 1 7 . 1 1 24 24 ILE H H 24 7.578 7.578 7.983 -0.405 18980
1616 1 7 . 1 1 25 25 ALA N N 25 122.665 122.665 125.206 -2.541 18980
1617 1 7 . 1 1 25 25 ALA HA H 25 4.521 4.521 3.805 0.716 18980
1618 1 7 . 1 1 25 25 ALA CA C 25 53.097 53.097 54.837 -1.740 18980
1619 1 7 . 1 1 25 25 ALA CB C 25 16.460 16.460 17.949 -1.489 18980
1620 1 7 . 1 1 25 25 ALA H H 25 8.944 8.944 8.362 0.582 18980
1621 1 7 . 1 1 26 26 LYS N N 26 117.327 117.327 115.246 2.081 18980
1622 1 7 . 1 1 26 26 LYS HA H 26 2.735 2.735 4.076 -1.341 18980
1623 1 7 . 1 1 26 26 LYS CA C 26 55.268 55.268 58.451 -3.183 18980
1624 1 7 . 1 1 26 26 LYS CB C 26 31.527 31.527 32.305 -0.778 18980
1625 1 7 . 1 1 26 26 LYS H H 26 6.448 6.448 8.190 -1.742 18980
1626 1 7 . 1 1 27 27 ASN N N 27 111.844 111.844 116.240 -4.396 18980
1627 1 7 . 1 1 27 27 ASN HA H 27 4.844 4.844 4.720 0.124 18980
1628 1 7 . 1 1 27 27 ASN CA C 27 48.766 48.766 53.192 -4.426 18980
1629 1 7 . 1 1 27 27 ASN CB C 27 37.372 37.372 39.871 -2.499 18980
1630 1 7 . 1 1 27 27 ASN H H 27 7.536 7.536 7.701 -0.165 18980
1631 1 7 . 1 1 28 28 CYS N N 28 122.908 122.908 119.388 3.520 18980
1632 1 7 . 1 1 28 28 CYS HA H 28 3.590 3.590 4.122 -0.532 18980
1633 1 7 . 1 1 28 28 CYS CA C 28 58.923 58.923 60.000 -1.077 18980
1634 1 7 . 1 1 28 28 CYS CB C 28 28.111 28.111 27.694 0.417 18980
1635 1 7 . 1 1 28 28 CYS H H 28 7.195 7.195 7.757 -0.562 18980
1636 1 7 . 1 1 29 29 ARG N N 29 129.416 129.416 125.354 4.062 18980
1637 1 7 . 1 1 29 29 ARG HA H 29 4.446 4.446 4.450 -0.004 18980
1638 1 7 . 1 1 29 29 ARG CA C 29 52.480 52.480 55.535 -3.055 18980
1639 1 7 . 1 1 29 29 ARG CB C 29 27.564 27.564 30.661 -3.097 18980
1640 1 7 . 1 1 29 29 ARG H H 29 8.885 8.885 8.509 0.376 18980
1641 1 7 . 1 1 30 30 ALA N N 30 127.959 127.959 125.084 2.875 18980
1642 1 7 . 1 1 30 30 ALA HA H 30 4.475 4.475 4.540 -0.065 18980
1643 1 7 . 1 1 30 30 ALA CA C 30 48.220 48.220 50.678 -2.458 18980
1644 1 7 . 1 1 30 30 ALA CB C 30 15.112 15.112 18.660 -3.548 18980
1645 1 7 . 1 1 30 30 ALA H H 30 8.744 8.744 7.455 1.289 18980
1646 1 7 . 1 1 31 31 PRO HA H 31 4.238 4.238 4.487 -0.249 18980
1647 1 7 . 1 1 31 31 PRO CA C 31 60.017 60.017 62.952 -2.934 18980
1648 1 7 . 1 1 31 31 PRO CB C 31 28.726 28.726 32.818 -4.092 18980
1649 1 7 . 1 1 32 32 ARG N N 32 123.635 123.635 121.760 1.875 18980
1650 1 7 . 1 1 32 32 ARG HA H 32 4.391 4.391 4.837 -0.446 18980
1651 1 7 . 1 1 32 32 ARG CA C 32 53.336 53.336 55.318 -1.982 18980
1652 1 7 . 1 1 32 32 ARG CB C 32 27.689 27.689 32.133 -4.444 18980
1653 1 7 . 1 1 32 32 ARG H H 32 8.740 8.740 8.369 0.371 18980
1654 1 7 . 1 1 33 33 LYS N N 33 127.972 127.972 124.368 3.604 18980
1655 1 7 . 1 1 33 33 LYS HA H 33 4.339 4.339 4.288 0.051 18980
1656 1 7 . 1 1 33 33 LYS CA C 33 53.372 53.372 57.024 -3.652 18980
1657 1 7 . 1 1 33 33 LYS CB C 33 30.439 30.439 33.173 -2.735 18980
1658 1 7 . 1 1 33 33 LYS H H 33 8.868 8.868 8.780 0.088 18980
1659 1 7 . 1 1 34 34 LYS N N 34 120.697 120.697 120.158 0.539 18980
1660 1 7 . 1 1 34 34 LYS HA H 34 4.393 4.393 4.310 0.083 18980
1661 1 7 . 1 1 34 34 LYS CA C 34 54.385 54.385 56.601 -2.216 18980
1662 1 7 . 1 1 34 34 LYS CB C 34 30.651 30.651 32.334 -1.683 18980
1663 1 7 . 1 1 34 34 LYS H H 34 8.300 8.300 8.509 -0.209 18980
1664 1 7 . 1 1 35 35 GLY N N 35 109.787 109.787 105.864 3.923 18980
1665 1 7 . 1 1 35 35 GLY CA C 35 40.646 40.646 44.389 -3.743 18980
1666 1 7 . 1 1 35 35 GLY H H 35 8.518 8.518 7.334 1.184 18980
1667 1 7 . 1 1 36 36 CYS N N 36 122.657 122.657 120.036 2.621 18980
1668 1 7 . 1 1 36 36 CYS HA H 36 3.994 3.994 4.066 -0.072 18980
1669 1 7 . 1 1 36 36 CYS CA C 36 57.328 57.328 58.639 -1.311 18980
1670 1 7 . 1 1 36 36 CYS CB C 36 27.259 27.259 28.243 -0.984 18980
1671 1 7 . 1 1 36 36 CYS H H 36 8.249 8.249 8.037 0.212 18980
1672 1 7 . 1 1 37 37 TRP N N 37 132.646 132.646 125.533 7.113 18980
1673 1 7 . 1 1 37 37 TRP HA H 37 4.763 4.763 4.642 0.121 18980
1674 1 7 . 1 1 37 37 TRP CA C 37 54.955 54.955 57.066 -2.111 18980
1675 1 7 . 1 1 37 37 TRP CB C 37 26.102 26.102 29.156 -3.054 18980
1676 1 7 . 1 1 37 37 TRP H H 37 9.218 9.218 8.303 0.915 18980
1677 1 7 . 1 1 38 38 LYS N N 38 121.676 121.676 117.361 4.315 18980
1678 1 7 . 1 1 38 38 LYS HA H 38 4.200 4.200 4.191 0.009 18980
1679 1 7 . 1 1 38 38 LYS CA C 38 55.916 55.916 57.698 -1.782 18980
1680 1 7 . 1 1 38 38 LYS CB C 38 31.288 31.288 33.716 -2.428 18980
1681 1 7 . 1 1 38 38 LYS H H 38 9.626 9.626 7.809 1.817 18980
1682 1 7 . 1 1 39 39 CYS N N 39 117.746 117.746 114.339 3.407 18980
1683 1 7 . 1 1 39 39 CYS HA H 39 4.929 4.929 4.798 0.131 18980
1684 1 7 . 1 1 39 39 CYS CA C 39 56.058 56.058 57.961 -1.903 18980
1685 1 7 . 1 1 39 39 CYS CB C 39 29.705 29.705 29.531 0.174 18980
1686 1 7 . 1 1 39 39 CYS H H 39 8.612 8.612 7.829 0.783 18980
1687 1 7 . 1 1 40 40 GLY N N 40 113.510 113.510 110.104 3.406 18980
1688 1 7 . 1 1 40 40 GLY CA C 40 43.398 43.398 45.070 -1.672 18980
1689 1 7 . 1 1 40 40 GLY H H 40 8.050 8.050 8.405 -0.355 18980
1690 1 7 . 1 1 41 41 LYS N N 41 121.911 121.911 121.702 0.209 18980
1691 1 7 . 1 1 41 41 LYS HA H 41 4.296 4.296 4.421 -0.125 18980
1692 1 7 . 1 1 41 41 LYS CA C 41 54.068 54.068 56.030 -1.962 18980
1693 1 7 . 1 1 41 41 LYS CB C 41 30.765 30.765 33.368 -2.603 18980
1694 1 7 . 1 1 41 41 LYS H H 41 8.340 8.340 7.603 0.737 18980
1695 1 7 . 1 1 42 42 GLU N N 42 119.418 119.418 120.590 -1.172 18980
1696 1 7 . 1 1 42 42 GLU HA H 42 4.116 4.116 4.208 -0.092 18980
1697 1 7 . 1 1 42 42 GLU CA C 42 54.054 54.054 56.672 -2.618 18980
1698 1 7 . 1 1 42 42 GLU CB C 42 27.786 27.786 30.280 -2.494 18980
1699 1 7 . 1 1 42 42 GLU H H 42 8.501 8.501 8.505 -0.004 18980
1700 1 7 . 1 1 43 43 GLY N N 43 107.782 107.782 108.895 -1.113 18980
1701 1 7 . 1 1 43 43 GLY CA C 43 42.789 42.789 45.667 -2.878 18980
1702 1 7 . 1 1 43 43 GLY H H 43 8.719 8.719 8.788 -0.069 18980
1703 1 7 . 1 1 44 44 HIS N N 44 111.284 111.284 116.537 -5.253 18980
1704 1 7 . 1 1 44 44 HIS HA H 44 4.587 4.587 4.755 -0.168 18980
1705 1 7 . 1 1 44 44 HIS CA C 44 52.665 52.665 54.168 -1.503 18980
1706 1 7 . 1 1 44 44 HIS CB C 44 27.416 27.416 30.366 -2.950 18980
1707 1 7 . 1 1 44 44 HIS H H 44 6.810 6.810 7.652 -0.842 18980
1708 1 7 . 1 1 45 45 GLN N N 45 117.297 117.297 119.199 -1.902 18980
1709 1 7 . 1 1 45 45 GLN HA H 45 3.773 3.773 4.416 -0.643 18980
1710 1 7 . 1 1 45 45 GLN CA C 45 51.454 51.454 54.113 -2.659 18980
1711 1 7 . 1 1 45 45 GLN CB C 45 28.905 28.905 30.780 -1.875 18980
1712 1 7 . 1 1 45 45 GLN H H 45 8.781 8.781 8.620 0.161 18980
1713 1 7 . 1 1 46 46 MET N N 46 117.926 117.926 122.987 -5.061 18980
1714 1 7 . 1 1 46 46 MET HA H 46 4.820 4.820 4.306 0.513 18980
1715 1 7 . 1 1 46 46 MET CA C 46 57.542 57.542 58.178 -0.636 18980
1716 1 7 . 1 1 46 46 MET CB C 46 29.549 29.549 32.180 -2.631 18980
1717 1 7 . 1 1 46 46 MET H H 46 9.008 9.008 8.642 0.366 18980
1718 1 7 . 1 1 47 47 LYS N N 47 117.631 117.631 118.548 -0.917 18980
1719 1 7 . 1 1 47 47 LYS HA H 47 3.448 3.448 4.155 -0.707 18980
1720 1 7 . 1 1 47 47 LYS CA C 47 54.988 54.988 58.136 -3.148 18980
1721 1 7 . 1 1 47 47 LYS CB C 47 28.285 28.285 31.656 -3.371 18980
1722 1 7 . 1 1 47 47 LYS H H 47 6.430 6.430 8.160 -1.730 18980
1723 1 7 . 1 1 48 48 ASP N N 48 117.363 117.363 118.692 -1.329 18980
1724 1 7 . 1 1 48 48 ASP HA H 48 4.780 4.780 4.664 0.116 18980
1725 1 7 . 1 1 48 48 ASP CA C 48 50.600 50.600 54.215 -3.615 18980
1726 1 7 . 1 1 48 48 ASP CB C 48 40.029 40.029 41.617 -1.588 18980
1727 1 7 . 1 1 48 48 ASP H H 48 7.560 7.560 7.991 -0.431 18980
1728 1 7 . 1 1 49 49 CYS N N 49 122.910 122.910 116.998 5.912 18980
1729 1 7 . 1 1 49 49 CYS HA H 49 3.682 3.682 4.701 -1.019 18980
1730 1 7 . 1 1 49 49 CYS CA C 49 59.557 59.557 57.941 1.616 18980
1731 1 7 . 1 1 49 49 CYS CB C 49 28.040 28.040 29.582 -1.542 18980
1732 1 7 . 1 1 49 49 CYS H H 49 7.091 7.091 7.570 -0.479 18980
1733 1 7 . 1 1 50 50 THR N N 50 119.675 119.675 115.839 3.836 18980
1734 1 7 . 1 1 50 50 THR HA H 50 4.293 4.293 4.438 -0.145 18980
1735 1 7 . 1 1 50 50 THR CA C 50 58.855 58.855 62.262 -3.407 18980
1736 1 7 . 1 1 50 50 THR CB C 50 66.355 66.355 70.501 -4.146 18980
1737 1 7 . 1 1 50 50 THR H H 50 8.139 8.139 8.366 -0.227 18980
1738 1 7 . 1 1 51 51 GLU N N 51 124.935 124.935 120.761 4.174 18980
1739 1 7 . 1 1 51 51 GLU HA H 51 4.164 4.164 4.467 -0.303 18980
1740 1 7 . 1 1 51 51 GLU CA C 51 54.061 54.061 54.782 -0.721 18980
1741 1 7 . 1 1 51 51 GLU CB C 51 27.130 27.130 31.989 -4.859 18980
1742 1 7 . 1 1 51 51 GLU H H 51 8.551 8.551 7.832 0.719 18980
1743 1 7 . 1 1 52 52 ARG N N 52 122.624 122.624 120.557 2.067 18980
1744 1 7 . 1 1 52 52 ARG HA H 52 4.248 4.248 4.057 0.191 18980
1745 1 7 . 1 1 52 52 ARG CA C 52 53.402 53.402 58.684 -5.282 18980
1746 1 7 . 1 1 52 52 ARG CB C 52 28.028 28.028 29.999 -1.971 18980
1747 1 7 . 1 1 52 52 ARG H H 52 8.287 8.287 8.759 -0.472 18980
1748 1 7 . 1 1 53 53 GLN N N 53 121.647 121.647 118.016 3.631 18980
1749 1 7 . 1 1 53 53 GLN HA H 53 4.248 4.248 4.269 -0.021 18980
1750 1 7 . 1 1 53 53 GLN CA C 53 52.946 52.946 57.153 -4.207 18980
1751 1 7 . 1 1 53 53 GLN CB C 53 26.794 26.794 28.252 -1.458 18980
1752 1 7 . 1 1 53 53 GLN H H 53 8.381 8.381 8.007 0.374 18980
1753 1 7 . 1 1 54 54 ALA N N 54 125.878 125.878 121.811 4.067 18980
1754 1 7 . 1 1 54 54 ALA HA H 54 4.296 4.296 4.167 0.129 18980
1755 1 7 . 1 1 54 54 ALA CA C 54 49.575 49.575 52.712 -3.137 18980
1756 1 7 . 1 1 54 54 ALA CB C 54 16.704 16.704 19.227 -2.523 18980
1757 1 7 . 1 1 54 54 ALA H H 54 8.338 8.338 8.107 0.231 18980
1758 1 8 . 1 1 2 2 GLN N N 2 125.073 125.073 127.390 -2.317 18980
1759 1 8 . 1 1 2 2 GLN HA H 2 4.309 4.309 4.265 0.044 18980
1760 1 8 . 1 1 2 2 GLN CA C 2 52.755 52.755 57.610 -4.855 18980
1761 1 8 . 1 1 2 2 GLN CB C 2 26.728 26.728 28.939 -2.211 18980
1762 1 8 . 1 1 2 2 GLN H H 2 8.503 8.503 8.556 -0.053 18980
1763 1 8 . 1 1 3 3 LYS N N 3 123.202 123.202 118.348 4.854 18980
1764 1 8 . 1 1 3 3 LYS HA H 3 4.271 4.271 4.114 0.157 18980
1765 1 8 . 1 1 3 3 LYS CA C 3 53.658 53.658 56.086 -2.428 18980
1766 1 8 . 1 1 3 3 LYS CB C 3 30.442 30.442 32.662 -2.220 18980
1767 1 8 . 1 1 3 3 LYS H H 3 8.414 8.414 8.112 0.302 18980
1768 1 8 . 1 1 4 4 GLY N N 4 109.574 109.574 108.004 1.570 18980
1769 1 8 . 1 1 4 4 GLY CA C 4 42.455 42.455 44.065 -1.610 18980
1770 1 8 . 1 1 4 4 GLY H H 4 8.394 8.394 7.400 0.994 18980
1771 1 8 . 1 1 5 5 ASN N N 5 118.311 118.311 118.221 0.090 18980
1772 1 8 . 1 1 5 5 ASN HA H 5 4.625 4.625 4.392 0.233 18980
1773 1 8 . 1 1 5 5 ASN CA C 5 50.146 50.146 53.388 -3.242 18980
1774 1 8 . 1 1 5 5 ASN CB C 5 36.059 36.059 38.931 -2.872 18980
1775 1 8 . 1 1 5 5 ASN H H 5 8.240 8.240 8.242 -0.002 18980
1776 1 8 . 1 1 6 6 PHE N N 6 120.460 120.460 118.994 1.466 18980
1777 1 8 . 1 1 6 6 PHE HA H 6 4.541 4.541 4.509 0.032 18980
1778 1 8 . 1 1 6 6 PHE CA C 6 55.112 55.112 57.411 -2.299 18980
1779 1 8 . 1 1 6 6 PHE CB C 6 36.457 36.457 39.700 -3.243 18980
1780 1 8 . 1 1 6 6 PHE H H 6 8.164 8.164 8.257 -0.093 18980
1781 1 8 . 1 1 7 7 ARG N N 7 121.606 121.606 120.895 0.711 18980
1782 1 8 . 1 1 7 7 ARG HA H 7 4.193 4.193 4.238 -0.045 18980
1783 1 8 . 1 1 7 7 ARG CA C 7 53.586 53.586 56.401 -2.814 18980
1784 1 8 . 1 1 7 7 ARG CB C 7 27.788 27.788 28.227 -0.439 18980
1785 1 8 . 1 1 7 7 ARG H H 7 8.184 8.184 8.945 -0.761 18980
1786 1 8 . 1 1 8 8 ASN N N 8 118.773 118.773 118.023 0.750 18980
1787 1 8 . 1 1 8 8 ASN HA H 8 4.570 4.570 4.551 0.019 18980
1788 1 8 . 1 1 8 8 ASN CA C 8 50.518 50.518 54.453 -3.935 18980
1789 1 8 . 1 1 8 8 ASN CB C 8 35.894 35.894 38.122 -2.228 18980
1790 1 8 . 1 1 8 8 ASN H H 8 8.294 8.294 8.328 -0.034 18980
1791 1 8 . 1 1 9 9 GLN N N 9 120.522 120.522 117.564 2.958 18980
1792 1 8 . 1 1 9 9 GLN HA H 9 4.245 4.245 4.381 -0.136 18980
1793 1 8 . 1 1 9 9 GLN CA C 9 53.202 53.202 55.929 -2.727 18980
1794 1 8 . 1 1 9 9 GLN CB C 9 26.688 26.688 30.018 -3.330 18980
1795 1 8 . 1 1 9 9 GLN H H 9 8.218 8.218 8.106 0.112 18980
1796 1 8 . 1 1 10 10 ARG N N 10 121.826 121.826 122.387 -0.561 18980
1797 1 8 . 1 1 10 10 ARG HA H 10 4.244 4.244 4.417 -0.173 18980
1798 1 8 . 1 1 10 10 ARG CA C 10 53.208 53.208 55.601 -2.393 18980
1799 1 8 . 1 1 10 10 ARG CB C 10 27.939 27.939 29.465 -1.526 18980
1800 1 8 . 1 1 10 10 ARG H H 10 8.273 8.273 7.942 0.331 18980
1801 1 8 . 1 1 11 11 LYS N N 11 122.737 122.737 122.443 0.294 18980
1802 1 8 . 1 1 11 11 LYS HA H 11 4.263 4.263 3.924 0.339 18980
1803 1 8 . 1 1 11 11 LYS CA C 11 53.578 53.578 58.743 -5.165 18980
1804 1 8 . 1 1 11 11 LYS CB C 11 30.323 30.323 31.258 -0.935 18980
1805 1 8 . 1 1 11 11 LYS H H 11 8.299 8.299 8.451 -0.152 18980
1806 1 8 . 1 1 12 12 THR N N 12 116.442 116.442 115.082 1.360 18980
1807 1 8 . 1 1 12 12 THR HA H 12 4.254 4.254 4.455 -0.201 18980
1808 1 8 . 1 1 12 12 THR CA C 12 58.726 58.726 62.518 -3.792 18980
1809 1 8 . 1 1 12 12 THR CB C 12 66.915 66.915 70.576 -3.661 18980
1810 1 8 . 1 1 12 12 THR H H 12 8.088 8.088 8.021 0.067 18980
1811 1 8 . 1 1 13 13 VAL N N 13 122.626 122.626 117.473 5.153 18980
1812 1 8 . 1 1 13 13 VAL HA H 13 4.021 4.021 4.419 -0.398 18980
1813 1 8 . 1 1 13 13 VAL CA C 13 58.497 58.497 61.321 -2.824 18980
1814 1 8 . 1 1 13 13 VAL CB C 13 30.485 30.485 34.723 -4.238 18980
1815 1 8 . 1 1 13 13 VAL H H 13 8.209 8.209 8.054 0.155 18980
1816 1 8 . 1 1 14 14 LYS N N 14 123.504 123.504 127.392 -3.888 18980
1817 1 8 . 1 1 14 14 LYS HA H 14 4.412 4.412 4.558 -0.146 18980
1818 1 8 . 1 1 14 14 LYS CA C 14 51.599 51.599 54.146 -2.547 18980
1819 1 8 . 1 1 14 14 LYS CB C 14 31.540 31.540 34.566 -3.026 18980
1820 1 8 . 1 1 14 14 LYS H H 14 8.012 8.012 8.105 -0.093 18980
1821 1 8 . 1 1 15 15 CYS N N 15 129.731 129.731 125.897 3.834 18980
1822 1 8 . 1 1 15 15 CYS HA H 15 4.215 4.215 4.191 0.024 18980
1823 1 8 . 1 1 15 15 CYS CA C 15 56.967 56.967 59.474 -2.507 18980
1824 1 8 . 1 1 15 15 CYS CB C 15 27.829 27.829 28.385 -0.556 18980
1825 1 8 . 1 1 15 15 CYS H H 15 8.256 8.256 8.270 -0.014 18980
1826 1 8 . 1 1 16 16 PHE N N 16 128.836 128.836 123.804 5.032 18980
1827 1 8 . 1 1 16 16 PHE HA H 16 4.615 4.615 4.342 0.273 18980
1828 1 8 . 1 1 16 16 PHE CA C 16 56.137 56.137 58.600 -2.463 18980
1829 1 8 . 1 1 16 16 PHE CB C 16 37.103 37.103 38.822 -1.718 18980
1830 1 8 . 1 1 16 16 PHE H H 16 9.299 9.299 8.446 0.853 18980
1831 1 8 . 1 1 17 17 ASN N N 17 118.280 118.280 117.532 0.748 18980
1832 1 8 . 1 1 17 17 ASN HA H 17 3.816 3.816 4.321 -0.505 18980
1833 1 8 . 1 1 17 17 ASN CA C 17 53.075 53.075 55.049 -1.974 18980
1834 1 8 . 1 1 17 17 ASN CB C 17 36.212 36.212 39.035 -2.823 18980
1835 1 8 . 1 1 17 17 ASN H H 17 9.156 9.156 7.544 1.612 18980
1836 1 8 . 1 1 18 18 CYS N N 18 116.876 116.876 112.636 4.240 18980
1837 1 8 . 1 1 18 18 CYS HA H 18 4.696 4.696 4.963 -0.267 18980
1838 1 8 . 1 1 18 18 CYS CA C 18 56.126 56.126 57.339 -1.212 18980
1839 1 8 . 1 1 18 18 CYS CB C 18 29.066 29.066 27.955 1.111 18980
1840 1 8 . 1 1 18 18 CYS H H 18 8.489 8.489 7.591 0.898 18980
1841 1 8 . 1 1 19 19 GLY N N 19 112.394 112.394 110.922 1.472 18980
1842 1 8 . 1 1 19 19 GLY CA C 19 43.589 43.589 45.678 -2.089 18980
1843 1 8 . 1 1 19 19 GLY H H 19 7.703 7.703 8.101 -0.398 18980
1844 1 8 . 1 1 20 20 LYS N N 20 120.951 120.951 120.374 0.577 18980
1845 1 8 . 1 1 20 20 LYS HA H 20 4.364 4.364 4.482 -0.118 18980
1846 1 8 . 1 1 20 20 LYS CA C 20 53.066 53.066 54.469 -1.403 18980
1847 1 8 . 1 1 20 20 LYS CB C 20 30.653 30.653 34.189 -3.536 18980
1848 1 8 . 1 1 20 20 LYS H H 20 8.162 8.162 7.440 0.722 18980
1849 1 8 . 1 1 21 21 GLU N N 21 119.095 119.095 120.765 -1.670 18980
1850 1 8 . 1 1 21 21 GLU HA H 21 4.602 4.602 4.313 0.289 18980
1851 1 8 . 1 1 21 21 GLU CA C 21 53.327 53.327 58.211 -4.884 18980
1852 1 8 . 1 1 21 21 GLU CB C 21 28.049 28.049 30.005 -1.956 18980
1853 1 8 . 1 1 21 21 GLU H H 21 8.454 8.454 8.763 -0.309 18980
1854 1 8 . 1 1 22 22 GLY N N 22 107.727 107.727 109.211 -1.484 18980
1855 1 8 . 1 1 22 22 GLY CA C 22 42.965 42.965 45.862 -2.897 18980
1856 1 8 . 1 1 22 22 GLY H H 22 8.639 8.639 8.430 0.209 18980
1857 1 8 . 1 1 23 23 HIS N N 23 113.019 113.019 116.048 -3.029 18980
1858 1 8 . 1 1 23 23 HIS HA H 23 4.613 4.613 4.772 -0.159 18980
1859 1 8 . 1 1 23 23 HIS CA C 23 52.409 52.409 54.612 -2.203 18980
1860 1 8 . 1 1 23 23 HIS CB C 23 27.389 27.389 31.607 -4.218 18980
1861 1 8 . 1 1 23 23 HIS H H 23 6.992 6.992 7.314 -0.322 18980
1862 1 8 . 1 1 24 24 ILE N N 24 105.931 105.931 112.629 -6.698 18980
1863 1 8 . 1 1 24 24 ILE HA H 24 4.313 4.313 4.392 -0.079 18980
1864 1 8 . 1 1 24 24 ILE CA C 24 56.515 56.515 58.282 -1.767 18980
1865 1 8 . 1 1 24 24 ILE CB C 24 38.320 38.320 41.477 -3.158 18980
1866 1 8 . 1 1 24 24 ILE H H 24 7.578 7.578 8.016 -0.438 18980
1867 1 8 . 1 1 25 25 ALA N N 25 122.665 122.665 125.244 -2.579 18980
1868 1 8 . 1 1 25 25 ALA HA H 25 4.521 4.521 3.836 0.685 18980
1869 1 8 . 1 1 25 25 ALA CA C 25 53.097 53.097 54.834 -1.737 18980
1870 1 8 . 1 1 25 25 ALA CB C 25 16.460 16.460 18.033 -1.573 18980
1871 1 8 . 1 1 25 25 ALA H H 25 8.944 8.944 8.452 0.492 18980
1872 1 8 . 1 1 26 26 LYS N N 26 117.327 117.327 115.918 1.409 18980
1873 1 8 . 1 1 26 26 LYS HA H 26 2.735 2.735 4.086 -1.351 18980
1874 1 8 . 1 1 26 26 LYS CA C 26 55.268 55.268 58.542 -3.274 18980
1875 1 8 . 1 1 26 26 LYS CB C 26 31.527 31.527 32.326 -0.799 18980
1876 1 8 . 1 1 26 26 LYS H H 26 6.448 6.448 8.236 -1.788 18980
1877 1 8 . 1 1 27 27 ASN N N 27 111.844 111.844 116.561 -4.717 18980
1878 1 8 . 1 1 27 27 ASN HA H 27 4.844 4.844 4.679 0.165 18980
1879 1 8 . 1 1 27 27 ASN CA C 27 48.766 48.766 53.472 -4.706 18980
1880 1 8 . 1 1 27 27 ASN CB C 27 37.372 37.372 39.803 -2.431 18980
1881 1 8 . 1 1 27 27 ASN H H 27 7.536 7.536 7.710 -0.174 18980
1882 1 8 . 1 1 28 28 CYS N N 28 122.908 122.908 119.399 3.509 18980
1883 1 8 . 1 1 28 28 CYS HA H 28 3.590 3.590 4.035 -0.445 18980
1884 1 8 . 1 1 28 28 CYS CA C 28 58.923 58.923 60.446 -1.523 18980
1885 1 8 . 1 1 28 28 CYS CB C 28 28.111 28.111 27.593 0.518 18980
1886 1 8 . 1 1 28 28 CYS H H 28 7.195 7.195 7.913 -0.718 18980
1887 1 8 . 1 1 29 29 ARG N N 29 129.416 129.416 124.875 4.541 18980
1888 1 8 . 1 1 29 29 ARG HA H 29 4.446 4.446 4.410 0.036 18980
1889 1 8 . 1 1 29 29 ARG CA C 29 52.480 52.480 55.285 -2.804 18980
1890 1 8 . 1 1 29 29 ARG CB C 29 27.564 27.564 30.254 -2.690 18980
1891 1 8 . 1 1 29 29 ARG H H 29 8.885 8.885 8.514 0.371 18980
1892 1 8 . 1 1 30 30 ALA N N 30 127.959 127.959 125.068 2.891 18980
1893 1 8 . 1 1 30 30 ALA HA H 30 4.475 4.475 4.476 -0.001 18980
1894 1 8 . 1 1 30 30 ALA CA C 30 48.220 48.220 50.795 -2.575 18980
1895 1 8 . 1 1 30 30 ALA CB C 30 15.112 15.112 18.566 -3.454 18980
1896 1 8 . 1 1 30 30 ALA H H 30 8.744 8.744 7.436 1.308 18980
1897 1 8 . 1 1 31 31 PRO HA H 31 4.238 4.238 4.483 -0.245 18980
1898 1 8 . 1 1 31 31 PRO CA C 31 60.017 60.017 62.952 -2.935 18980
1899 1 8 . 1 1 31 31 PRO CB C 31 28.726 28.726 32.805 -4.079 18980
1900 1 8 . 1 1 32 32 ARG N N 32 123.635 123.635 123.030 0.605 18980
1901 1 8 . 1 1 32 32 ARG HA H 32 4.391 4.391 4.675 -0.284 18980
1902 1 8 . 1 1 32 32 ARG CA C 32 53.336 53.336 55.405 -2.069 18980
1903 1 8 . 1 1 32 32 ARG CB C 32 27.689 27.689 31.476 -3.787 18980
1904 1 8 . 1 1 32 32 ARG H H 32 8.740 8.740 8.422 0.318 18980
1905 1 8 . 1 1 33 33 LYS N N 33 127.972 127.972 123.392 4.580 18980
1906 1 8 . 1 1 33 33 LYS HA H 33 4.339 4.339 4.373 -0.034 18980
1907 1 8 . 1 1 33 33 LYS CA C 33 53.372 53.372 56.480 -3.108 18980
1908 1 8 . 1 1 33 33 LYS CB C 33 30.439 30.439 33.105 -2.667 18980
1909 1 8 . 1 1 33 33 LYS H H 33 8.868 8.868 8.743 0.125 18980
1910 1 8 . 1 1 34 34 LYS N N 34 120.697 120.697 120.634 0.063 18980
1911 1 8 . 1 1 34 34 LYS HA H 34 4.393 4.393 4.345 0.048 18980
1912 1 8 . 1 1 34 34 LYS CA C 34 54.385 54.385 56.005 -1.620 18980
1913 1 8 . 1 1 34 34 LYS CB C 34 30.651 30.651 32.514 -1.863 18980
1914 1 8 . 1 1 34 34 LYS H H 34 8.300 8.300 8.596 -0.296 18980
1915 1 8 . 1 1 35 35 GLY N N 35 109.787 109.787 105.299 4.488 18980
1916 1 8 . 1 1 35 35 GLY CA C 35 40.646 40.646 44.491 -3.845 18980
1917 1 8 . 1 1 35 35 GLY H H 35 8.518 8.518 7.351 1.167 18980
1918 1 8 . 1 1 36 36 CYS N N 36 122.657 122.657 119.774 2.883 18980
1919 1 8 . 1 1 36 36 CYS HA H 36 3.994 3.994 4.068 -0.074 18980
1920 1 8 . 1 1 36 36 CYS CA C 36 57.328 57.328 58.335 -1.007 18980
1921 1 8 . 1 1 36 36 CYS CB C 36 27.259 27.259 28.018 -0.759 18980
1922 1 8 . 1 1 36 36 CYS H H 36 8.249 8.249 8.028 0.221 18980
1923 1 8 . 1 1 37 37 TRP N N 37 132.646 132.646 125.587 7.059 18980
1924 1 8 . 1 1 37 37 TRP HA H 37 4.763 4.763 4.625 0.138 18980
1925 1 8 . 1 1 37 37 TRP CA C 37 54.955 54.955 57.077 -2.122 18980
1926 1 8 . 1 1 37 37 TRP CB C 37 26.102 26.102 29.132 -3.030 18980
1927 1 8 . 1 1 37 37 TRP H H 37 9.218 9.218 8.260 0.958 18980
1928 1 8 . 1 1 38 38 LYS N N 38 121.676 121.676 117.486 4.190 18980
1929 1 8 . 1 1 38 38 LYS HA H 38 4.200 4.200 4.058 0.142 18980
1930 1 8 . 1 1 38 38 LYS CA C 38 55.916 55.916 57.857 -1.941 18980
1931 1 8 . 1 1 38 38 LYS CB C 38 31.288 31.288 33.512 -2.224 18980
1932 1 8 . 1 1 38 38 LYS H H 38 9.626 9.626 7.722 1.904 18980
1933 1 8 . 1 1 39 39 CYS N N 39 117.746 117.746 113.897 3.849 18980
1934 1 8 . 1 1 39 39 CYS HA H 39 4.929 4.929 4.841 0.088 18980
1935 1 8 . 1 1 39 39 CYS CA C 39 56.058 56.058 58.619 -2.561 18980
1936 1 8 . 1 1 39 39 CYS CB C 39 29.705 29.705 29.179 0.526 18980
1937 1 8 . 1 1 39 39 CYS H H 39 8.612 8.612 7.961 0.651 18980
1938 1 8 . 1 1 40 40 GLY N N 40 113.510 113.510 111.022 2.488 18980
1939 1 8 . 1 1 40 40 GLY CA C 40 43.398 43.398 45.031 -1.633 18980
1940 1 8 . 1 1 40 40 GLY H H 40 8.050 8.050 8.156 -0.106 18980
1941 1 8 . 1 1 41 41 LYS N N 41 121.911 121.911 121.753 0.158 18980
1942 1 8 . 1 1 41 41 LYS HA H 41 4.296 4.296 4.461 -0.165 18980
1943 1 8 . 1 1 41 41 LYS CA C 41 54.068 54.068 55.793 -1.725 18980
1944 1 8 . 1 1 41 41 LYS CB C 41 30.765 30.765 33.582 -2.817 18980
1945 1 8 . 1 1 41 41 LYS H H 41 8.340 8.340 7.552 0.788 18980
1946 1 8 . 1 1 42 42 GLU N N 42 119.418 119.418 119.223 0.195 18980
1947 1 8 . 1 1 42 42 GLU HA H 42 4.116 4.116 4.242 -0.126 18980
1948 1 8 . 1 1 42 42 GLU CA C 42 54.054 54.054 56.533 -2.479 18980
1949 1 8 . 1 1 42 42 GLU CB C 42 27.786 27.786 30.283 -2.497 18980
1950 1 8 . 1 1 42 42 GLU H H 42 8.501 8.501 8.526 -0.025 18980
1951 1 8 . 1 1 43 43 GLY N N 43 107.782 107.782 108.982 -1.200 18980
1952 1 8 . 1 1 43 43 GLY CA C 43 42.789 42.789 46.032 -3.243 18980
1953 1 8 . 1 1 43 43 GLY H H 43 8.719 8.719 8.644 0.075 18980
1954 1 8 . 1 1 44 44 HIS N N 44 111.284 111.284 115.177 -3.893 18980
1955 1 8 . 1 1 44 44 HIS HA H 44 4.587 4.587 4.727 -0.140 18980
1956 1 8 . 1 1 44 44 HIS CA C 44 52.665 52.665 54.084 -1.419 18980
1957 1 8 . 1 1 44 44 HIS CB C 44 27.416 27.416 30.483 -3.067 18980
1958 1 8 . 1 1 44 44 HIS H H 44 6.810 6.810 7.760 -0.950 18980
1959 1 8 . 1 1 45 45 GLN N N 45 117.297 117.297 119.005 -1.708 18980
1960 1 8 . 1 1 45 45 GLN HA H 45 3.773 3.773 4.405 -0.632 18980
1961 1 8 . 1 1 45 45 GLN CA C 45 51.454 51.454 54.087 -2.633 18980
1962 1 8 . 1 1 45 45 GLN CB C 45 28.905 28.905 30.734 -1.829 18980
1963 1 8 . 1 1 45 45 GLN H H 45 8.781 8.781 8.653 0.128 18980
1964 1 8 . 1 1 46 46 MET N N 46 117.926 117.926 120.314 -2.388 18980
1965 1 8 . 1 1 46 46 MET HA H 46 4.820 4.820 4.307 0.513 18980
1966 1 8 . 1 1 46 46 MET CA C 46 57.542 57.542 58.007 -0.465 18980
1967 1 8 . 1 1 46 46 MET CB C 46 29.549 29.549 32.436 -2.887 18980
1968 1 8 . 1 1 46 46 MET H H 46 9.008 9.008 8.508 0.500 18980
1969 1 8 . 1 1 47 47 LYS N N 47 117.631 117.631 115.867 1.764 18980
1970 1 8 . 1 1 47 47 LYS HA H 47 3.448 3.448 4.153 -0.705 18980
1971 1 8 . 1 1 47 47 LYS CA C 47 54.988 54.988 57.564 -2.576 18980
1972 1 8 . 1 1 47 47 LYS CB C 47 28.285 28.285 31.852 -3.567 18980
1973 1 8 . 1 1 47 47 LYS H H 47 6.430 6.430 7.782 -1.352 18980
1974 1 8 . 1 1 48 48 ASP N N 48 117.363 117.363 119.732 -2.369 18980
1975 1 8 . 1 1 48 48 ASP HA H 48 4.780 4.780 4.630 0.150 18980
1976 1 8 . 1 1 48 48 ASP CA C 48 50.600 50.600 55.177 -4.577 18980
1977 1 8 . 1 1 48 48 ASP CB C 48 40.029 40.029 41.840 -1.811 18980
1978 1 8 . 1 1 48 48 ASP H H 48 7.560 7.560 7.897 -0.337 18980
1979 1 8 . 1 1 49 49 CYS N N 49 122.910 122.910 119.630 3.280 18980
1980 1 8 . 1 1 49 49 CYS HA H 49 3.682 3.682 4.522 -0.840 18980
1981 1 8 . 1 1 49 49 CYS CA C 49 59.557 59.557 59.276 0.281 18980
1982 1 8 . 1 1 49 49 CYS CB C 49 28.040 28.040 26.583 1.457 18980
1983 1 8 . 1 1 49 49 CYS H H 49 7.091 7.091 7.659 -0.568 18980
1984 1 8 . 1 1 50 50 THR N N 50 119.675 119.675 121.019 -1.344 18980
1985 1 8 . 1 1 50 50 THR HA H 50 4.293 4.293 4.193 0.100 18980
1986 1 8 . 1 1 50 50 THR CA C 50 58.855 58.855 64.117 -5.261 18980
1987 1 8 . 1 1 50 50 THR CB C 50 66.355 66.355 69.262 -2.907 18980
1988 1 8 . 1 1 50 50 THR H H 50 8.139 8.139 8.700 -0.561 18980
1989 1 8 . 1 1 51 51 GLU N N 51 124.935 124.935 119.852 5.083 18980
1990 1 8 . 1 1 51 51 GLU HA H 51 4.164 4.164 4.451 -0.287 18980
1991 1 8 . 1 1 51 51 GLU CA C 51 54.061 54.061 54.945 -0.884 18980
1992 1 8 . 1 1 51 51 GLU CB C 51 27.130 27.130 31.885 -4.755 18980
1993 1 8 . 1 1 51 51 GLU H H 51 8.551 8.551 7.858 0.693 18980
1994 1 8 . 1 1 52 52 ARG N N 52 122.624 122.624 122.849 -0.225 18980
1995 1 8 . 1 1 52 52 ARG HA H 52 4.248 4.248 4.221 0.027 18980
1996 1 8 . 1 1 52 52 ARG CA C 52 53.402 53.402 56.362 -2.960 18980
1997 1 8 . 1 1 52 52 ARG CB C 52 28.028 28.028 29.126 -1.098 18980
1998 1 8 . 1 1 52 52 ARG H H 52 8.287 8.287 8.589 -0.302 18980
1999 1 8 . 1 1 53 53 GLN N N 53 121.647 121.647 124.846 -3.199 18980
2000 1 8 . 1 1 53 53 GLN HA H 53 4.248 4.248 4.410 -0.162 18980
2001 1 8 . 1 1 53 53 GLN CA C 53 52.946 52.946 55.027 -2.081 18980
2002 1 8 . 1 1 53 53 GLN CB C 53 26.794 26.794 30.388 -3.594 18980
2003 1 8 . 1 1 53 53 GLN H H 53 8.381 8.381 8.425 -0.044 18980
2004 1 8 . 1 1 54 54 ALA N N 54 125.878 125.878 122.959 2.919 18980
2005 1 8 . 1 1 54 54 ALA HA H 54 4.296 4.296 4.176 0.120 18980
2006 1 8 . 1 1 54 54 ALA CA C 54 49.575 49.575 53.096 -3.521 18980
2007 1 8 . 1 1 54 54 ALA CB C 54 16.704 16.704 18.733 -2.029 18980
2008 1 8 . 1 1 54 54 ALA H H 54 8.338 8.338 8.526 -0.188 18980
2009 1 9 . 1 1 2 2 GLN N N 2 125.073 125.073 123.349 1.724 18980
2010 1 9 . 1 1 2 2 GLN HA H 2 4.309 4.309 4.956 -0.647 18980
2011 1 9 . 1 1 2 2 GLN CA C 2 52.755 52.755 54.998 -2.244 18980
2012 1 9 . 1 1 2 2 GLN CB C 2 26.728 26.728 32.100 -5.372 18980
2013 1 9 . 1 1 2 2 GLN H H 2 8.503 8.503 8.363 0.140 18980
2014 1 9 . 1 1 3 3 LYS N N 3 123.202 123.202 120.276 2.926 18980
2015 1 9 . 1 1 3 3 LYS HA H 3 4.271 4.271 4.219 0.052 18980
2016 1 9 . 1 1 3 3 LYS CA C 3 53.658 53.658 57.437 -3.779 18980
2017 1 9 . 1 1 3 3 LYS CB C 3 30.442 30.442 32.843 -2.401 18980
2018 1 9 . 1 1 3 3 LYS H H 3 8.414 8.414 8.601 -0.187 18980
2019 1 9 . 1 1 4 4 GLY N N 4 109.574 109.574 105.235 4.339 18980
2020 1 9 . 1 1 4 4 GLY CA C 4 42.455 42.455 43.554 -1.099 18980
2021 1 9 . 1 1 4 4 GLY H H 4 8.394 8.394 7.550 0.845 18980
2022 1 9 . 1 1 5 5 ASN N N 5 118.311 118.311 118.148 0.163 18980
2023 1 9 . 1 1 5 5 ASN HA H 5 4.625 4.625 4.446 0.179 18980
2024 1 9 . 1 1 5 5 ASN CA C 5 50.146 50.146 54.199 -4.053 18980
2025 1 9 . 1 1 5 5 ASN CB C 5 36.059 36.059 38.276 -2.217 18980
2026 1 9 . 1 1 5 5 ASN H H 5 8.240 8.240 8.370 -0.130 18980
2027 1 9 . 1 1 6 6 PHE N N 6 120.460 120.460 117.430 3.030 18980
2028 1 9 . 1 1 6 6 PHE HA H 6 4.541 4.541 4.626 -0.085 18980
2029 1 9 . 1 1 6 6 PHE CA C 6 55.112 55.112 56.195 -1.083 18980
2030 1 9 . 1 1 6 6 PHE CB C 6 36.457 36.457 39.866 -3.409 18980
2031 1 9 . 1 1 6 6 PHE H H 6 8.164 8.164 7.621 0.543 18980
2032 1 9 . 1 1 7 7 ARG N N 7 121.606 121.606 120.292 1.314 18980
2033 1 9 . 1 1 7 7 ARG HA H 7 4.193 4.193 4.231 -0.038 18980
2034 1 9 . 1 1 7 7 ARG CA C 7 53.586 53.586 57.525 -3.939 18980
2035 1 9 . 1 1 7 7 ARG CB C 7 27.788 27.788 29.901 -2.113 18980
2036 1 9 . 1 1 7 7 ARG H H 7 8.184 8.184 8.694 -0.510 18980
2037 1 9 . 1 1 8 8 ASN N N 8 118.773 118.773 119.766 -0.993 18980
2038 1 9 . 1 1 8 8 ASN HA H 8 4.570 4.570 4.849 -0.279 18980
2039 1 9 . 1 1 8 8 ASN CA C 8 50.518 50.518 54.071 -3.553 18980
2040 1 9 . 1 1 8 8 ASN CB C 8 35.894 35.894 41.549 -5.655 18980
2041 1 9 . 1 1 8 8 ASN H H 8 8.294 8.294 9.202 -0.908 18980
2042 1 9 . 1 1 9 9 GLN N N 9 120.522 120.522 117.834 2.688 18980
2043 1 9 . 1 1 9 9 GLN HA H 9 4.245 4.245 4.483 -0.238 18980
2044 1 9 . 1 1 9 9 GLN CA C 9 53.202 53.202 56.139 -2.937 18980
2045 1 9 . 1 1 9 9 GLN CB C 9 26.688 26.688 31.653 -4.965 18980
2046 1 9 . 1 1 9 9 GLN H H 9 8.218 8.218 8.905 -0.687 18980
2047 1 9 . 1 1 10 10 ARG N N 10 121.826 121.826 122.351 -0.525 18980
2048 1 9 . 1 1 10 10 ARG HA H 10 4.244 4.244 4.302 -0.058 18980
2049 1 9 . 1 1 10 10 ARG CA C 10 53.208 53.208 56.853 -3.645 18980
2050 1 9 . 1 1 10 10 ARG CB C 10 27.939 27.939 30.544 -2.605 18980
2051 1 9 . 1 1 10 10 ARG H H 10 8.273 8.273 8.585 -0.312 18980
2052 1 9 . 1 1 11 11 LYS N N 11 122.737 122.737 123.420 -0.683 18980
2053 1 9 . 1 1 11 11 LYS HA H 11 4.263 4.263 4.093 0.170 18980
2054 1 9 . 1 1 11 11 LYS CA C 11 53.578 53.578 58.493 -4.915 18980
2055 1 9 . 1 1 11 11 LYS CB C 11 30.323 30.323 31.117 -0.794 18980
2056 1 9 . 1 1 11 11 LYS H H 11 8.299 8.299 9.007 -0.708 18980
2057 1 9 . 1 1 12 12 THR N N 12 116.442 116.442 114.696 1.746 18980
2058 1 9 . 1 1 12 12 THR HA H 12 4.254 4.254 4.493 -0.239 18980
2059 1 9 . 1 1 12 12 THR CA C 12 58.726 58.726 61.221 -2.495 18980
2060 1 9 . 1 1 12 12 THR CB C 12 66.915 66.915 72.035 -5.120 18980
2061 1 9 . 1 1 12 12 THR H H 12 8.088 8.088 7.792 0.296 18980
2062 1 9 . 1 1 13 13 VAL N N 13 122.626 122.626 123.366 -0.740 18980
2063 1 9 . 1 1 13 13 VAL HA H 13 4.021 4.021 4.255 -0.234 18980
2064 1 9 . 1 1 13 13 VAL CA C 13 58.497 58.497 59.567 -1.070 18980
2065 1 9 . 1 1 13 13 VAL CB C 13 30.485 30.485 34.318 -3.833 18980
2066 1 9 . 1 1 13 13 VAL H H 13 8.209 8.209 8.325 -0.116 18980
2067 1 9 . 1 1 14 14 LYS N N 14 123.504 123.504 127.048 -3.544 18980
2068 1 9 . 1 1 14 14 LYS HA H 14 4.412 4.412 4.495 -0.083 18980
2069 1 9 . 1 1 14 14 LYS CA C 14 51.599 51.599 54.355 -2.756 18980
2070 1 9 . 1 1 14 14 LYS CB C 14 31.540 31.540 34.977 -3.437 18980
2071 1 9 . 1 1 14 14 LYS H H 14 8.012 8.012 7.966 0.046 18980
2072 1 9 . 1 1 15 15 CYS N N 15 129.731 129.731 126.241 3.490 18980
2073 1 9 . 1 1 15 15 CYS HA H 15 4.215 4.215 4.159 0.056 18980
2074 1 9 . 1 1 15 15 CYS CA C 15 56.967 56.967 58.935 -1.968 18980
2075 1 9 . 1 1 15 15 CYS CB C 15 27.829 27.829 27.608 0.221 18980
2076 1 9 . 1 1 15 15 CYS H H 15 8.256 8.256 8.462 -0.206 18980
2077 1 9 . 1 1 16 16 PHE N N 16 128.836 128.836 124.009 4.827 18980
2078 1 9 . 1 1 16 16 PHE HA H 16 4.615 4.615 4.266 0.349 18980
2079 1 9 . 1 1 16 16 PHE CA C 16 56.137 56.137 57.909 -1.772 18980
2080 1 9 . 1 1 16 16 PHE CB C 16 37.103 37.103 38.715 -1.612 18980
2081 1 9 . 1 1 16 16 PHE H H 16 9.299 9.299 8.344 0.955 18980
2082 1 9 . 1 1 17 17 ASN N N 17 118.280 118.280 117.775 0.505 18980
2083 1 9 . 1 1 17 17 ASN HA H 17 3.816 3.816 3.982 -0.166 18980
2084 1 9 . 1 1 17 17 ASN CA C 17 53.075 53.075 55.329 -2.254 18980
2085 1 9 . 1 1 17 17 ASN CB C 17 36.212 36.212 38.604 -2.392 18980
2086 1 9 . 1 1 17 17 ASN H H 17 9.156 9.156 7.440 1.716 18980
2087 1 9 . 1 1 18 18 CYS N N 18 116.876 116.876 113.732 3.144 18980
2088 1 9 . 1 1 18 18 CYS HA H 18 4.696 4.696 4.728 -0.032 18980
2089 1 9 . 1 1 18 18 CYS CA C 18 56.126 56.126 56.839 -0.713 18980
2090 1 9 . 1 1 18 18 CYS CB C 18 29.066 29.066 27.822 1.244 18980
2091 1 9 . 1 1 18 18 CYS H H 18 8.489 8.489 7.516 0.973 18980
2092 1 9 . 1 1 19 19 GLY N N 19 112.394 112.394 109.662 2.732 18980
2093 1 9 . 1 1 19 19 GLY CA C 19 43.589 43.589 45.528 -1.939 18980
2094 1 9 . 1 1 19 19 GLY H H 19 7.703 7.703 8.535 -0.832 18980
2095 1 9 . 1 1 20 20 LYS N N 20 120.951 120.951 120.747 0.204 18980
2096 1 9 . 1 1 20 20 LYS HA H 20 4.364 4.364 4.484 -0.120 18980
2097 1 9 . 1 1 20 20 LYS CA C 20 53.066 53.066 54.737 -1.671 18980
2098 1 9 . 1 1 20 20 LYS CB C 20 30.653 30.653 34.041 -3.388 18980
2099 1 9 . 1 1 20 20 LYS H H 20 8.162 8.162 7.524 0.638 18980
2100 1 9 . 1 1 21 21 GLU N N 21 119.095 119.095 121.078 -1.983 18980
2101 1 9 . 1 1 21 21 GLU HA H 21 4.602 4.602 4.309 0.293 18980
2102 1 9 . 1 1 21 21 GLU CA C 21 53.327 53.327 58.234 -4.907 18980
2103 1 9 . 1 1 21 21 GLU CB C 21 28.049 28.049 30.000 -1.951 18980
2104 1 9 . 1 1 21 21 GLU H H 21 8.454 8.454 8.842 -0.388 18980
2105 1 9 . 1 1 22 22 GLY N N 22 107.727 107.727 109.559 -1.832 18980
2106 1 9 . 1 1 22 22 GLY CA C 22 42.965 42.965 45.734 -2.769 18980
2107 1 9 . 1 1 22 22 GLY H H 22 8.639 8.639 8.532 0.107 18980
2108 1 9 . 1 1 23 23 HIS N N 23 113.019 113.019 115.105 -2.086 18980
2109 1 9 . 1 1 23 23 HIS HA H 23 4.613 4.613 5.077 -0.464 18980
2110 1 9 . 1 1 23 23 HIS CA C 23 52.409 52.409 54.797 -2.388 18980
2111 1 9 . 1 1 23 23 HIS CB C 23 27.389 27.389 31.718 -4.329 18980
2112 1 9 . 1 1 23 23 HIS H H 23 6.992 6.992 7.187 -0.195 18980
2113 1 9 . 1 1 24 24 ILE N N 24 105.931 105.931 113.758 -7.827 18980
2114 1 9 . 1 1 24 24 ILE HA H 24 4.313 4.313 4.411 -0.098 18980
2115 1 9 . 1 1 24 24 ILE CA C 24 56.515 56.515 58.413 -1.898 18980
2116 1 9 . 1 1 24 24 ILE CB C 24 38.320 38.320 41.500 -3.180 18980
2117 1 9 . 1 1 24 24 ILE H H 24 7.578 7.578 8.804 -1.226 18980
2118 1 9 . 1 1 25 25 ALA N N 25 122.665 122.665 124.889 -2.224 18980
2119 1 9 . 1 1 25 25 ALA HA H 25 4.521 4.521 3.849 0.672 18980
2120 1 9 . 1 1 25 25 ALA CA C 25 53.097 53.097 54.836 -1.739 18980
2121 1 9 . 1 1 25 25 ALA CB C 25 16.460 16.460 17.916 -1.456 18980
2122 1 9 . 1 1 25 25 ALA H H 25 8.944 8.944 8.411 0.533 18980
2123 1 9 . 1 1 26 26 LYS N N 26 117.327 117.327 117.543 -0.216 18980
2124 1 9 . 1 1 26 26 LYS HA H 26 2.735 2.735 4.115 -1.380 18980
2125 1 9 . 1 1 26 26 LYS CA C 26 55.268 55.268 58.852 -3.584 18980
2126 1 9 . 1 1 26 26 LYS CB C 26 31.527 31.527 32.466 -0.939 18980
2127 1 9 . 1 1 26 26 LYS H H 26 6.448 6.448 8.422 -1.974 18980
2128 1 9 . 1 1 27 27 ASN N N 27 111.844 111.844 113.652 -1.808 18980
2129 1 9 . 1 1 27 27 ASN HA H 27 4.844 4.844 4.745 0.099 18980
2130 1 9 . 1 1 27 27 ASN CA C 27 48.766 48.766 52.206 -3.440 18980
2131 1 9 . 1 1 27 27 ASN CB C 27 37.372 37.372 38.587 -1.215 18980
2132 1 9 . 1 1 27 27 ASN H H 27 7.536 7.536 7.782 -0.246 18980
2133 1 9 . 1 1 28 28 CYS N N 28 122.908 122.908 120.529 2.379 18980
2134 1 9 . 1 1 28 28 CYS HA H 28 3.590 3.590 4.032 -0.442 18980
2135 1 9 . 1 1 28 28 CYS CA C 28 58.923 58.923 60.146 -1.223 18980
2136 1 9 . 1 1 28 28 CYS CB C 28 28.111 28.111 28.180 -0.069 18980
2137 1 9 . 1 1 28 28 CYS H H 28 7.195 7.195 7.870 -0.675 18980
2138 1 9 . 1 1 29 29 ARG N N 29 129.416 129.416 126.746 2.670 18980
2139 1 9 . 1 1 29 29 ARG HA H 29 4.446 4.446 4.402 0.044 18980
2140 1 9 . 1 1 29 29 ARG CA C 29 52.480 52.480 56.021 -3.541 18980
2141 1 9 . 1 1 29 29 ARG CB C 29 27.564 27.564 30.703 -3.139 18980
2142 1 9 . 1 1 29 29 ARG H H 29 8.885 8.885 8.471 0.414 18980
2143 1 9 . 1 1 30 30 ALA N N 30 127.959 127.959 124.423 3.536 18980
2144 1 9 . 1 1 30 30 ALA HA H 30 4.475 4.475 4.580 -0.105 18980
2145 1 9 . 1 1 30 30 ALA CA C 30 48.220 48.220 50.645 -2.425 18980
2146 1 9 . 1 1 30 30 ALA CB C 30 15.112 15.112 18.503 -3.391 18980
2147 1 9 . 1 1 30 30 ALA H H 30 8.744 8.744 7.469 1.275 18980
2148 1 9 . 1 1 31 31 PRO HA H 31 4.238 4.238 4.513 -0.275 18980
2149 1 9 . 1 1 31 31 PRO CA C 31 60.017 60.017 62.875 -2.858 18980
2150 1 9 . 1 1 31 31 PRO CB C 31 28.726 28.726 32.875 -4.149 18980
2151 1 9 . 1 1 32 32 ARG N N 32 123.635 123.635 121.219 2.416 18980
2152 1 9 . 1 1 32 32 ARG HA H 32 4.391 4.391 4.851 -0.460 18980
2153 1 9 . 1 1 32 32 ARG CA C 32 53.336 53.336 55.343 -2.007 18980
2154 1 9 . 1 1 32 32 ARG CB C 32 27.689 27.689 32.139 -4.450 18980
2155 1 9 . 1 1 32 32 ARG H H 32 8.740 8.740 8.371 0.369 18980
2156 1 9 . 1 1 33 33 LYS N N 33 127.972 127.972 123.992 3.980 18980
2157 1 9 . 1 1 33 33 LYS HA H 33 4.339 4.339 4.299 0.040 18980
2158 1 9 . 1 1 33 33 LYS CA C 33 53.372 53.372 56.938 -3.566 18980
2159 1 9 . 1 1 33 33 LYS CB C 33 30.439 30.439 33.155 -2.716 18980
2160 1 9 . 1 1 33 33 LYS H H 33 8.868 8.868 8.810 0.058 18980
2161 1 9 . 1 1 34 34 LYS N N 34 120.697 120.697 120.221 0.476 18980
2162 1 9 . 1 1 34 34 LYS HA H 34 4.393 4.393 4.314 0.079 18980
2163 1 9 . 1 1 34 34 LYS CA C 34 54.385 54.385 56.559 -2.175 18980
2164 1 9 . 1 1 34 34 LYS CB C 34 30.651 30.651 32.428 -1.777 18980
2165 1 9 . 1 1 34 34 LYS H H 34 8.300 8.300 8.517 -0.217 18980
2166 1 9 . 1 1 35 35 GLY N N 35 109.787 109.787 106.596 3.191 18980
2167 1 9 . 1 1 35 35 GLY CA C 35 40.646 40.646 44.522 -3.876 18980
2168 1 9 . 1 1 35 35 GLY H H 35 8.518 8.518 7.400 1.118 18980
2169 1 9 . 1 1 36 36 CYS N N 36 122.657 122.657 120.805 1.852 18980
2170 1 9 . 1 1 36 36 CYS HA H 36 3.994 3.994 3.997 -0.003 18980
2171 1 9 . 1 1 36 36 CYS CA C 36 57.328 57.328 58.520 -1.192 18980
2172 1 9 . 1 1 36 36 CYS CB C 36 27.259 27.259 27.641 -0.382 18980
2173 1 9 . 1 1 36 36 CYS H H 36 8.249 8.249 8.192 0.057 18980
2174 1 9 . 1 1 37 37 TRP N N 37 132.646 132.646 125.661 6.985 18980
2175 1 9 . 1 1 37 37 TRP HA H 37 4.763 4.763 4.581 0.182 18980
2176 1 9 . 1 1 37 37 TRP CA C 37 54.955 54.955 57.212 -2.257 18980
2177 1 9 . 1 1 37 37 TRP CB C 37 26.102 26.102 29.134 -3.032 18980
2178 1 9 . 1 1 37 37 TRP H H 37 9.218 9.218 8.300 0.918 18980
2179 1 9 . 1 1 38 38 LYS N N 38 121.676 121.676 116.949 4.727 18980
2180 1 9 . 1 1 38 38 LYS HA H 38 4.200 4.200 4.132 0.068 18980
2181 1 9 . 1 1 38 38 LYS CA C 38 55.916 55.916 57.493 -1.577 18980
2182 1 9 . 1 1 38 38 LYS CB C 38 31.288 31.288 33.667 -2.379 18980
2183 1 9 . 1 1 38 38 LYS H H 38 9.626 9.626 7.749 1.877 18980
2184 1 9 . 1 1 39 39 CYS N N 39 117.746 117.746 113.572 4.174 18980
2185 1 9 . 1 1 39 39 CYS HA H 39 4.929 4.929 4.833 0.096 18980
2186 1 9 . 1 1 39 39 CYS CA C 39 56.058 56.058 58.718 -2.660 18980
2187 1 9 . 1 1 39 39 CYS CB C 39 29.705 29.705 29.445 0.261 18980
2188 1 9 . 1 1 39 39 CYS H H 39 8.612 8.612 7.911 0.701 18980
2189 1 9 . 1 1 40 40 GLY N N 40 113.510 113.510 111.276 2.234 18980
2190 1 9 . 1 1 40 40 GLY CA C 40 43.398 43.398 45.030 -1.632 18980
2191 1 9 . 1 1 40 40 GLY H H 40 8.050 8.050 8.075 -0.025 18980
2192 1 9 . 1 1 41 41 LYS N N 41 121.911 121.911 121.539 0.372 18980
2193 1 9 . 1 1 41 41 LYS HA H 41 4.296 4.296 4.436 -0.140 18980
2194 1 9 . 1 1 41 41 LYS CA C 41 54.068 54.068 55.900 -1.831 18980
2195 1 9 . 1 1 41 41 LYS CB C 41 30.765 30.765 33.445 -2.680 18980
2196 1 9 . 1 1 41 41 LYS H H 41 8.340 8.340 7.566 0.774 18980
2197 1 9 . 1 1 42 42 GLU N N 42 119.418 119.418 119.268 0.150 18980
2198 1 9 . 1 1 42 42 GLU HA H 42 4.116 4.116 4.412 -0.296 18980
2199 1 9 . 1 1 42 42 GLU CA C 42 54.054 54.054 56.356 -2.303 18980
2200 1 9 . 1 1 42 42 GLU CB C 42 27.786 27.786 30.345 -2.559 18980
2201 1 9 . 1 1 42 42 GLU H H 42 8.501 8.501 8.518 -0.017 18980
2202 1 9 . 1 1 43 43 GLY N N 43 107.782 107.782 108.769 -0.987 18980
2203 1 9 . 1 1 43 43 GLY CA C 43 42.789 42.789 46.008 -3.219 18980
2204 1 9 . 1 1 43 43 GLY H H 43 8.719 8.719 8.900 -0.181 18980
2205 1 9 . 1 1 44 44 HIS N N 44 111.284 111.284 115.491 -4.207 18980
2206 1 9 . 1 1 44 44 HIS HA H 44 4.587 4.587 4.701 -0.114 18980
2207 1 9 . 1 1 44 44 HIS CA C 44 52.665 52.665 54.259 -1.594 18980
2208 1 9 . 1 1 44 44 HIS CB C 44 27.416 27.416 30.385 -2.969 18980
2209 1 9 . 1 1 44 44 HIS H H 44 6.810 6.810 7.768 -0.958 18980
2210 1 9 . 1 1 45 45 GLN N N 45 117.297 117.297 118.924 -1.627 18980
2211 1 9 . 1 1 45 45 GLN HA H 45 3.773 3.773 4.370 -0.597 18980
2212 1 9 . 1 1 45 45 GLN CA C 45 51.454 51.454 54.049 -2.595 18980
2213 1 9 . 1 1 45 45 GLN CB C 45 28.905 28.905 30.885 -1.980 18980
2214 1 9 . 1 1 45 45 GLN H H 45 8.781 8.781 8.531 0.250 18980
2215 1 9 . 1 1 46 46 MET N N 46 117.926 117.926 119.836 -1.910 18980
2216 1 9 . 1 1 46 46 MET HA H 46 4.820 4.820 4.288 0.532 18980
2217 1 9 . 1 1 46 46 MET CA C 46 57.542 57.542 58.136 -0.594 18980
2218 1 9 . 1 1 46 46 MET CB C 46 29.549 29.549 32.236 -2.688 18980
2219 1 9 . 1 1 46 46 MET H H 46 9.008 9.008 8.512 0.496 18980
2220 1 9 . 1 1 47 47 LYS N N 47 117.631 117.631 115.915 1.716 18980
2221 1 9 . 1 1 47 47 LYS HA H 47 3.448 3.448 4.172 -0.724 18980
2222 1 9 . 1 1 47 47 LYS CA C 47 54.988 54.988 57.643 -2.655 18980
2223 1 9 . 1 1 47 47 LYS CB C 47 28.285 28.285 31.850 -3.565 18980
2224 1 9 . 1 1 47 47 LYS H H 47 6.430 6.430 7.709 -1.279 18980
2225 1 9 . 1 1 48 48 ASP N N 48 117.363 117.363 119.861 -2.498 18980
2226 1 9 . 1 1 48 48 ASP HA H 48 4.780 4.780 4.620 0.160 18980
2227 1 9 . 1 1 48 48 ASP CA C 48 50.600 50.600 55.383 -4.783 18980
2228 1 9 . 1 1 48 48 ASP CB C 48 40.029 40.029 41.826 -1.797 18980
2229 1 9 . 1 1 48 48 ASP H H 48 7.560 7.560 7.818 -0.258 18980
2230 1 9 . 1 1 49 49 CYS N N 49 122.910 122.910 120.943 1.967 18980
2231 1 9 . 1 1 49 49 CYS HA H 49 3.682 3.682 4.430 -0.748 18980
2232 1 9 . 1 1 49 49 CYS CA C 49 59.557 59.557 58.361 1.196 18980
2233 1 9 . 1 1 49 49 CYS CB C 49 28.040 28.040 24.684 3.356 18980
2234 1 9 . 1 1 49 49 CYS H H 49 7.091 7.091 7.741 -0.650 18980
2235 1 9 . 1 1 50 50 THR N N 50 119.675 119.675 119.266 0.409 18980
2236 1 9 . 1 1 50 50 THR HA H 50 4.293 4.293 4.153 0.140 18980
2237 1 9 . 1 1 50 50 THR CA C 50 58.855 58.855 64.511 -5.656 18980
2238 1 9 . 1 1 50 50 THR CB C 50 66.355 66.355 68.956 -2.601 18980
2239 1 9 . 1 1 50 50 THR H H 50 8.139 8.139 8.166 -0.027 18980
2240 1 9 . 1 1 51 51 GLU N N 51 124.935 124.935 121.077 3.858 18980
2241 1 9 . 1 1 51 51 GLU HA H 51 4.164 4.164 4.715 -0.551 18980
2242 1 9 . 1 1 51 51 GLU CA C 51 54.061 54.061 55.355 -1.294 18980
2243 1 9 . 1 1 51 51 GLU CB C 51 27.130 27.130 31.281 -4.151 18980
2244 1 9 . 1 1 51 51 GLU H H 51 8.551 8.551 8.403 0.148 18980
2245 1 9 . 1 1 52 52 ARG N N 52 122.624 122.624 120.709 1.915 18980
2246 1 9 . 1 1 52 52 ARG HA H 52 4.248 4.248 4.532 -0.284 18980
2247 1 9 . 1 1 52 52 ARG CA C 52 53.402 53.402 55.747 -2.345 18980
2248 1 9 . 1 1 52 52 ARG CB C 52 28.028 28.028 31.454 -3.426 18980
2249 1 9 . 1 1 52 52 ARG H H 52 8.287 8.287 8.466 -0.179 18980
2250 1 9 . 1 1 53 53 GLN N N 53 121.647 121.647 120.496 1.151 18980
2251 1 9 . 1 1 53 53 GLN HA H 53 4.248 4.248 4.864 -0.616 18980
2252 1 9 . 1 1 53 53 GLN CA C 53 52.946 52.946 54.742 -1.796 18980
2253 1 9 . 1 1 53 53 GLN CB C 53 26.794 26.794 31.669 -4.875 18980
2254 1 9 . 1 1 53 53 GLN H H 53 8.381 8.381 8.710 -0.329 18980
2255 1 9 . 1 1 54 54 ALA N N 54 125.878 125.878 124.331 1.547 18980
2256 1 9 . 1 1 54 54 ALA HA H 54 4.296 4.296 4.614 -0.318 18980
2257 1 9 . 1 1 54 54 ALA CA C 54 49.575 49.575 52.014 -2.439 18980
2258 1 9 . 1 1 54 54 ALA CB C 54 16.704 16.704 19.443 -2.739 18980
2259 1 9 . 1 1 54 54 ALA H H 54 8.338 8.338 8.887 -0.549 18980
2260 1 10 . 1 1 2 2 GLN N N 2 125.073 125.073 123.970 1.103 18980
2261 1 10 . 1 1 2 2 GLN HA H 2 4.309 4.309 4.539 -0.230 18980
2262 1 10 . 1 1 2 2 GLN CA C 2 52.755 52.755 54.719 -1.964 18980
2263 1 10 . 1 1 2 2 GLN CB C 2 26.728 26.728 30.507 -3.779 18980
2264 1 10 . 1 1 2 2 GLN H H 2 8.503 8.503 8.134 0.369 18980
2265 1 10 . 1 1 3 3 LYS N N 3 123.202 123.202 123.099 0.103 18980
2266 1 10 . 1 1 3 3 LYS HA H 3 4.271 4.271 4.136 0.135 18980
2267 1 10 . 1 1 3 3 LYS CA C 3 53.658 53.658 58.147 -4.489 18980
2268 1 10 . 1 1 3 3 LYS CB C 3 30.442 30.442 32.314 -1.872 18980
2269 1 10 . 1 1 3 3 LYS H H 3 8.414 8.414 8.940 -0.526 18980
2270 1 10 . 1 1 4 4 GLY N N 4 109.574 109.574 104.933 4.641 18980
2271 1 10 . 1 1 4 4 GLY CA C 4 42.455 42.455 45.247 -2.792 18980
2272 1 10 . 1 1 4 4 GLY H H 4 8.394 8.394 8.638 -0.244 18980
2273 1 10 . 1 1 5 5 ASN N N 5 118.311 118.311 118.346 -0.035 18980
2274 1 10 . 1 1 5 5 ASN HA H 5 4.625 4.625 4.343 0.282 18980
2275 1 10 . 1 1 5 5 ASN CA C 5 50.146 50.146 54.917 -4.771 18980
2276 1 10 . 1 1 5 5 ASN CB C 5 36.059 36.059 38.556 -2.497 18980
2277 1 10 . 1 1 5 5 ASN H H 5 8.240 8.240 7.710 0.530 18980
2278 1 10 . 1 1 6 6 PHE N N 6 120.460 120.460 118.932 1.528 18980
2279 1 10 . 1 1 6 6 PHE HA H 6 4.541 4.541 4.586 -0.045 18980
2280 1 10 . 1 1 6 6 PHE CA C 6 55.112 55.112 56.907 -1.795 18980
2281 1 10 . 1 1 6 6 PHE CB C 6 36.457 36.457 40.025 -3.568 18980
2282 1 10 . 1 1 6 6 PHE H H 6 8.164 8.164 7.397 0.767 18980
2283 1 10 . 1 1 7 7 ARG N N 7 121.606 121.606 123.812 -2.206 18980
2284 1 10 . 1 1 7 7 ARG HA H 7 4.193 4.193 4.349 -0.156 18980
2285 1 10 . 1 1 7 7 ARG CA C 7 53.586 53.586 56.404 -2.818 18980
2286 1 10 . 1 1 7 7 ARG CB C 7 27.788 27.788 29.895 -2.107 18980
2287 1 10 . 1 1 7 7 ARG H H 7 8.184 8.184 8.742 -0.558 18980
2288 1 10 . 1 1 8 8 ASN N N 8 118.773 118.773 119.134 -0.361 18980
2289 1 10 . 1 1 8 8 ASN HA H 8 4.570 4.570 4.909 -0.339 18980
2290 1 10 . 1 1 8 8 ASN CA C 8 50.518 50.518 53.097 -2.579 18980
2291 1 10 . 1 1 8 8 ASN CB C 8 35.894 35.894 39.972 -4.078 18980
2292 1 10 . 1 1 8 8 ASN H H 8 8.294 8.294 8.605 -0.311 18980
2293 1 10 . 1 1 9 9 GLN N N 9 120.522 120.522 118.602 1.920 18980
2294 1 10 . 1 1 9 9 GLN HA H 9 4.245 4.245 4.340 -0.095 18980
2295 1 10 . 1 1 9 9 GLN CA C 9 53.202 53.202 56.570 -3.368 18980
2296 1 10 . 1 1 9 9 GLN CB C 9 26.688 26.688 30.016 -3.328 18980
2297 1 10 . 1 1 9 9 GLN H H 9 8.218 8.218 7.774 0.444 18980
2298 1 10 . 1 1 10 10 ARG N N 10 121.826 121.826 122.075 -0.249 18980
2299 1 10 . 1 1 10 10 ARG HA H 10 4.244 4.244 4.303 -0.059 18980
2300 1 10 . 1 1 10 10 ARG CA C 10 53.208 53.208 56.567 -3.359 18980
2301 1 10 . 1 1 10 10 ARG CB C 10 27.939 27.939 30.493 -2.554 18980
2302 1 10 . 1 1 10 10 ARG H H 10 8.273 8.273 8.482 -0.209 18980
2303 1 10 . 1 1 11 11 LYS N N 11 122.737 122.737 123.530 -0.793 18980
2304 1 10 . 1 1 11 11 LYS HA H 11 4.263 4.263 3.965 0.298 18980
2305 1 10 . 1 1 11 11 LYS CA C 11 53.578 53.578 58.253 -4.675 18980
2306 1 10 . 1 1 11 11 LYS CB C 11 30.323 30.323 32.085 -1.762 18980
2307 1 10 . 1 1 11 11 LYS H H 11 8.299 8.299 9.042 -0.743 18980
2308 1 10 . 1 1 12 12 THR N N 12 116.442 116.442 114.983 1.459 18980
2309 1 10 . 1 1 12 12 THR HA H 12 4.254 4.254 4.451 -0.197 18980
2310 1 10 . 1 1 12 12 THR CA C 12 58.726 58.726 61.512 -2.786 18980
2311 1 10 . 1 1 12 12 THR CB C 12 66.915 66.915 71.925 -5.010 18980
2312 1 10 . 1 1 12 12 THR H H 12 8.088 8.088 8.101 -0.013 18980
2313 1 10 . 1 1 13 13 VAL N N 13 122.626 122.626 121.579 1.047 18980
2314 1 10 . 1 1 13 13 VAL HA H 13 4.021 4.021 4.343 -0.322 18980
2315 1 10 . 1 1 13 13 VAL CA C 13 58.497 58.497 59.080 -0.583 18980
2316 1 10 . 1 1 13 13 VAL CB C 13 30.485 30.485 33.962 -3.477 18980
2317 1 10 . 1 1 13 13 VAL H H 13 8.209 8.209 8.364 -0.155 18980
2318 1 10 . 1 1 14 14 LYS N N 14 123.504 123.504 127.398 -3.894 18980
2319 1 10 . 1 1 14 14 LYS HA H 14 4.412 4.412 4.455 -0.043 18980
2320 1 10 . 1 1 14 14 LYS CA C 14 51.599 51.599 54.265 -2.666 18980
2321 1 10 . 1 1 14 14 LYS CB C 14 31.540 31.540 34.410 -2.869 18980
2322 1 10 . 1 1 14 14 LYS H H 14 8.012 8.012 8.051 -0.039 18980
2323 1 10 . 1 1 15 15 CYS N N 15 129.731 129.731 126.434 3.297 18980
2324 1 10 . 1 1 15 15 CYS HA H 15 4.215 4.215 4.079 0.136 18980
2325 1 10 . 1 1 15 15 CYS CA C 15 56.967 56.967 58.843 -1.876 18980
2326 1 10 . 1 1 15 15 CYS CB C 15 27.829 27.829 27.590 0.239 18980
2327 1 10 . 1 1 15 15 CYS H H 15 8.256 8.256 8.507 -0.251 18980
2328 1 10 . 1 1 16 16 PHE N N 16 128.836 128.836 123.600 5.236 18980
2329 1 10 . 1 1 16 16 PHE HA H 16 4.615 4.615 4.261 0.354 18980
2330 1 10 . 1 1 16 16 PHE CA C 16 56.137 56.137 57.491 -1.354 18980
2331 1 10 . 1 1 16 16 PHE CB C 16 37.103 37.103 38.602 -1.499 18980
2332 1 10 . 1 1 16 16 PHE H H 16 9.299 9.299 8.280 1.019 18980
2333 1 10 . 1 1 17 17 ASN N N 17 118.280 118.280 117.913 0.367 18980
2334 1 10 . 1 1 17 17 ASN HA H 17 3.816 3.816 4.085 -0.269 18980
2335 1 10 . 1 1 17 17 ASN CA C 17 53.075 53.075 55.430 -2.355 18980
2336 1 10 . 1 1 17 17 ASN CB C 17 36.212 36.212 38.690 -2.478 18980
2337 1 10 . 1 1 17 17 ASN H H 17 9.156 9.156 7.404 1.752 18980
2338 1 10 . 1 1 18 18 CYS N N 18 116.876 116.876 113.923 2.953 18980
2339 1 10 . 1 1 18 18 CYS HA H 18 4.696 4.696 4.624 0.072 18980
2340 1 10 . 1 1 18 18 CYS CA C 18 56.126 56.126 57.474 -1.348 18980
2341 1 10 . 1 1 18 18 CYS CB C 18 29.066 29.066 28.470 0.596 18980
2342 1 10 . 1 1 18 18 CYS H H 18 8.489 8.489 7.397 1.092 18980
2343 1 10 . 1 1 19 19 GLY N N 19 112.394 112.394 110.294 2.100 18980
2344 1 10 . 1 1 19 19 GLY CA C 19 43.589 43.589 45.312 -1.723 18980
2345 1 10 . 1 1 19 19 GLY H H 19 7.703 7.703 8.145 -0.442 18980
2346 1 10 . 1 1 20 20 LYS N N 20 120.951 120.951 120.593 0.358 18980
2347 1 10 . 1 1 20 20 LYS HA H 20 4.364 4.364 4.491 -0.127 18980
2348 1 10 . 1 1 20 20 LYS CA C 20 53.066 53.066 54.712 -1.646 18980
2349 1 10 . 1 1 20 20 LYS CB C 20 30.653 30.653 33.999 -3.346 18980
2350 1 10 . 1 1 20 20 LYS H H 20 8.162 8.162 7.277 0.885 18980
2351 1 10 . 1 1 21 21 GLU N N 21 119.095 119.095 120.331 -1.236 18980
2352 1 10 . 1 1 21 21 GLU HA H 21 4.602 4.602 4.408 0.194 18980
2353 1 10 . 1 1 21 21 GLU CA C 21 53.327 53.327 58.118 -4.791 18980
2354 1 10 . 1 1 21 21 GLU CB C 21 28.049 28.049 30.149 -2.100 18980
2355 1 10 . 1 1 21 21 GLU H H 21 8.454 8.454 8.767 -0.313 18980
2356 1 10 . 1 1 22 22 GLY N N 22 107.727 107.727 108.857 -1.130 18980
2357 1 10 . 1 1 22 22 GLY CA C 22 42.965 42.965 45.938 -2.973 18980
2358 1 10 . 1 1 22 22 GLY H H 22 8.639 8.639 8.477 0.162 18980
2359 1 10 . 1 1 23 23 HIS N N 23 113.019 113.019 115.296 -2.277 18980
2360 1 10 . 1 1 23 23 HIS HA H 23 4.613 4.613 5.082 -0.469 18980
2361 1 10 . 1 1 23 23 HIS CA C 23 52.409 52.409 54.800 -2.391 18980
2362 1 10 . 1 1 23 23 HIS CB C 23 27.389 27.389 31.683 -4.294 18980
2363 1 10 . 1 1 23 23 HIS H H 23 6.992 6.992 7.184 -0.192 18980
2364 1 10 . 1 1 24 24 ILE N N 24 105.931 105.931 113.342 -7.411 18980
2365 1 10 . 1 1 24 24 ILE HA H 24 4.313 4.313 4.344 -0.031 18980
2366 1 10 . 1 1 24 24 ILE CA C 24 56.515 56.515 58.368 -1.853 18980
2367 1 10 . 1 1 24 24 ILE CB C 24 38.320 38.320 41.639 -3.320 18980
2368 1 10 . 1 1 24 24 ILE H H 24 7.578 7.578 8.772 -1.194 18980
2369 1 10 . 1 1 25 25 ALA N N 25 122.665 122.665 124.582 -1.917 18980
2370 1 10 . 1 1 25 25 ALA HA H 25 4.521 4.521 3.787 0.734 18980
2371 1 10 . 1 1 25 25 ALA CA C 25 53.097 53.097 54.773 -1.676 18980
2372 1 10 . 1 1 25 25 ALA CB C 25 16.460 16.460 17.765 -1.305 18980
2373 1 10 . 1 1 25 25 ALA H H 25 8.944 8.944 8.359 0.585 18980
2374 1 10 . 1 1 26 26 LYS N N 26 117.327 117.327 117.664 -0.337 18980
2375 1 10 . 1 1 26 26 LYS HA H 26 2.735 2.735 4.109 -1.374 18980
2376 1 10 . 1 1 26 26 LYS CA C 26 55.268 55.268 59.263 -3.995 18980
2377 1 10 . 1 1 26 26 LYS CB C 26 31.527 31.527 32.383 -0.856 18980
2378 1 10 . 1 1 26 26 LYS H H 26 6.448 6.448 8.406 -1.958 18980
2379 1 10 . 1 1 27 27 ASN N N 27 111.844 111.844 114.178 -2.334 18980
2380 1 10 . 1 1 27 27 ASN HA H 27 4.844 4.844 4.738 0.106 18980
2381 1 10 . 1 1 27 27 ASN CA C 27 48.766 48.766 52.118 -3.352 18980
2382 1 10 . 1 1 27 27 ASN CB C 27 37.372 37.372 38.407 -1.035 18980
2383 1 10 . 1 1 27 27 ASN H H 27 7.536 7.536 7.782 -0.246 18980
2384 1 10 . 1 1 28 28 CYS N N 28 122.908 122.908 119.580 3.328 18980
2385 1 10 . 1 1 28 28 CYS HA H 28 3.590 3.590 4.032 -0.442 18980
2386 1 10 . 1 1 28 28 CYS CA C 28 58.923 58.923 60.230 -1.307 18980
2387 1 10 . 1 1 28 28 CYS CB C 28 28.111 28.111 27.966 0.145 18980
2388 1 10 . 1 1 28 28 CYS H H 28 7.195 7.195 7.989 -0.794 18980
2389 1 10 . 1 1 29 29 ARG N N 29 129.416 129.416 126.691 2.725 18980
2390 1 10 . 1 1 29 29 ARG HA H 29 4.446 4.446 4.521 -0.075 18980
2391 1 10 . 1 1 29 29 ARG CA C 29 52.480 52.480 55.636 -3.156 18980
2392 1 10 . 1 1 29 29 ARG CB C 29 27.564 27.564 29.950 -2.386 18980
2393 1 10 . 1 1 29 29 ARG H H 29 8.885 8.885 8.544 0.341 18980
2394 1 10 . 1 1 30 30 ALA N N 30 127.959 127.959 125.590 2.369 18980
2395 1 10 . 1 1 30 30 ALA HA H 30 4.475 4.475 4.548 -0.073 18980
2396 1 10 . 1 1 30 30 ALA CA C 30 48.220 48.220 50.248 -2.028 18980
2397 1 10 . 1 1 30 30 ALA CB C 30 15.112 15.112 18.161 -3.049 18980
2398 1 10 . 1 1 30 30 ALA H H 30 8.744 8.744 7.444 1.300 18980
2399 1 10 . 1 1 31 31 PRO HA H 31 4.238 4.238 4.434 -0.196 18980
2400 1 10 . 1 1 31 31 PRO CA C 31 60.017 60.017 62.942 -2.925 18980
2401 1 10 . 1 1 31 31 PRO CB C 31 28.726 28.726 32.430 -3.704 18980
2402 1 10 . 1 1 32 32 ARG N N 32 123.635 123.635 122.351 1.284 18980
2403 1 10 . 1 1 32 32 ARG HA H 32 4.391 4.391 4.805 -0.414 18980
2404 1 10 . 1 1 32 32 ARG CA C 32 53.336 53.336 55.557 -2.221 18980
2405 1 10 . 1 1 32 32 ARG CB C 32 27.689 27.689 31.961 -4.272 18980
2406 1 10 . 1 1 32 32 ARG H H 32 8.740 8.740 8.346 0.394 18980
2407 1 10 . 1 1 33 33 LYS N N 33 127.972 127.972 123.516 4.456 18980
2408 1 10 . 1 1 33 33 LYS HA H 33 4.339 4.339 4.268 0.071 18980
2409 1 10 . 1 1 33 33 LYS CA C 33 53.372 53.372 56.859 -3.487 18980
2410 1 10 . 1 1 33 33 LYS CB C 33 30.439 30.439 33.115 -2.676 18980
2411 1 10 . 1 1 33 33 LYS H H 33 8.868 8.868 8.666 0.202 18980
2412 1 10 . 1 1 34 34 LYS N N 34 120.697 120.697 120.238 0.459 18980
2413 1 10 . 1 1 34 34 LYS HA H 34 4.393 4.393 4.374 0.019 18980
2414 1 10 . 1 1 34 34 LYS CA C 34 54.385 54.385 55.926 -1.541 18980
2415 1 10 . 1 1 34 34 LYS CB C 34 30.651 30.651 32.323 -1.672 18980
2416 1 10 . 1 1 34 34 LYS H H 34 8.300 8.300 8.542 -0.242 18980
2417 1 10 . 1 1 35 35 GLY N N 35 109.787 109.787 106.290 3.497 18980
2418 1 10 . 1 1 35 35 GLY CA C 35 40.646 40.646 44.465 -3.819 18980
2419 1 10 . 1 1 35 35 GLY H H 35 8.518 8.518 7.347 1.171 18980
2420 1 10 . 1 1 36 36 CYS N N 36 122.657 122.657 120.070 2.587 18980
2421 1 10 . 1 1 36 36 CYS HA H 36 3.994 3.994 4.183 -0.189 18980
2422 1 10 . 1 1 36 36 CYS CA C 36 57.328 57.328 58.261 -0.933 18980
2423 1 10 . 1 1 36 36 CYS CB C 36 27.259 27.259 27.948 -0.689 18980
2424 1 10 . 1 1 36 36 CYS H H 36 8.249 8.249 8.084 0.165 18980
2425 1 10 . 1 1 37 37 TRP N N 37 132.646 132.646 125.888 6.758 18980
2426 1 10 . 1 1 37 37 TRP HA H 37 4.763 4.763 4.630 0.133 18980
2427 1 10 . 1 1 37 37 TRP CA C 37 54.955 54.955 57.278 -2.323 18980
2428 1 10 . 1 1 37 37 TRP CB C 37 26.102 26.102 29.262 -3.160 18980
2429 1 10 . 1 1 37 37 TRP H H 37 9.218 9.218 8.357 0.861 18980
2430 1 10 . 1 1 38 38 LYS N N 38 121.676 121.676 117.597 4.079 18980
2431 1 10 . 1 1 38 38 LYS HA H 38 4.200 4.200 4.117 0.083 18980
2432 1 10 . 1 1 38 38 LYS CA C 38 55.916 55.916 58.324 -2.408 18980
2433 1 10 . 1 1 38 38 LYS CB C 38 31.288 31.288 33.847 -2.559 18980
2434 1 10 . 1 1 38 38 LYS H H 38 9.626 9.626 7.833 1.793 18980
2435 1 10 . 1 1 39 39 CYS N N 39 117.746 117.746 113.242 4.504 18980
2436 1 10 . 1 1 39 39 CYS HA H 39 4.929 4.929 4.787 0.142 18980
2437 1 10 . 1 1 39 39 CYS CA C 39 56.058 56.058 57.657 -1.599 18980
2438 1 10 . 1 1 39 39 CYS CB C 39 29.705 29.705 28.917 0.788 18980
2439 1 10 . 1 1 39 39 CYS H H 39 8.612 8.612 7.696 0.916 18980
2440 1 10 . 1 1 40 40 GLY N N 40 113.510 113.510 110.337 3.173 18980
2441 1 10 . 1 1 40 40 GLY CA C 40 43.398 43.398 45.289 -1.891 18980
2442 1 10 . 1 1 40 40 GLY H H 40 8.050 8.050 8.369 -0.319 18980
2443 1 10 . 1 1 41 41 LYS N N 41 121.911 121.911 121.667 0.244 18980
2444 1 10 . 1 1 41 41 LYS HA H 41 4.296 4.296 4.327 -0.031 18980
2445 1 10 . 1 1 41 41 LYS CA C 41 54.068 54.068 56.007 -1.939 18980
2446 1 10 . 1 1 41 41 LYS CB C 41 30.765 30.765 33.238 -2.473 18980
2447 1 10 . 1 1 41 41 LYS H H 41 8.340 8.340 7.460 0.880 18980
2448 1 10 . 1 1 42 42 GLU N N 42 119.418 119.418 119.704 -0.286 18980
2449 1 10 . 1 1 42 42 GLU HA H 42 4.116 4.116 4.033 0.083 18980
2450 1 10 . 1 1 42 42 GLU CA C 42 54.054 54.054 56.651 -2.597 18980
2451 1 10 . 1 1 42 42 GLU CB C 42 27.786 27.786 30.224 -2.438 18980
2452 1 10 . 1 1 42 42 GLU H H 42 8.501 8.501 8.398 0.103 18980
2453 1 10 . 1 1 43 43 GLY N N 43 107.782 107.782 111.651 -3.869 18980
2454 1 10 . 1 1 43 43 GLY CA C 43 42.789 42.789 45.657 -2.868 18980
2455 1 10 . 1 1 43 43 GLY H H 43 8.719 8.719 8.624 0.095 18980
2456 1 10 . 1 1 44 44 HIS N N 44 111.284 111.284 121.334 -10.050 18980
2457 1 10 . 1 1 44 44 HIS HA H 44 4.587 4.587 4.626 -0.039 18980
2458 1 10 . 1 1 44 44 HIS CA C 44 52.665 52.665 55.042 -2.377 18980
2459 1 10 . 1 1 44 44 HIS CB C 44 27.416 27.416 30.529 -3.113 18980
2460 1 10 . 1 1 44 44 HIS H H 44 6.810 6.810 7.918 -1.108 18980
2461 1 10 . 1 1 45 45 GLN N N 45 117.297 117.297 119.342 -2.045 18980
2462 1 10 . 1 1 45 45 GLN HA H 45 3.773 3.773 4.289 -0.516 18980
2463 1 10 . 1 1 45 45 GLN CA C 45 51.454 51.454 54.570 -3.116 18980
2464 1 10 . 1 1 45 45 GLN CB C 45 28.905 28.905 30.266 -1.361 18980
2465 1 10 . 1 1 45 45 GLN H H 45 8.781 8.781 8.712 0.069 18980
2466 1 10 . 1 1 46 46 MET N N 46 117.926 117.926 122.442 -4.516 18980
2467 1 10 . 1 1 46 46 MET HA H 46 4.820 4.820 4.340 0.480 18980
2468 1 10 . 1 1 46 46 MET CA C 46 57.542 57.542 58.144 -0.602 18980
2469 1 10 . 1 1 46 46 MET CB C 46 29.549 29.549 32.248 -2.699 18980
2470 1 10 . 1 1 46 46 MET H H 46 9.008 9.008 8.634 0.374 18980
2471 1 10 . 1 1 47 47 LYS N N 47 117.631 117.631 116.066 1.565 18980
2472 1 10 . 1 1 47 47 LYS HA H 47 3.448 3.448 4.154 -0.706 18980
2473 1 10 . 1 1 47 47 LYS CA C 47 54.988 54.988 58.047 -3.059 18980
2474 1 10 . 1 1 47 47 LYS CB C 47 28.285 28.285 31.821 -3.536 18980
2475 1 10 . 1 1 47 47 LYS H H 47 6.430 6.430 7.859 -1.429 18980
2476 1 10 . 1 1 48 48 ASP N N 48 117.363 117.363 119.913 -2.550 18980
2477 1 10 . 1 1 48 48 ASP HA H 48 4.780 4.780 4.599 0.181 18980
2478 1 10 . 1 1 48 48 ASP CA C 48 50.600 50.600 55.093 -4.493 18980
2479 1 10 . 1 1 48 48 ASP CB C 48 40.029 40.029 41.707 -1.678 18980
2480 1 10 . 1 1 48 48 ASP H H 48 7.560 7.560 7.794 -0.234 18980
2481 1 10 . 1 1 49 49 CYS N N 49 122.910 122.910 119.546 3.364 18980
2482 1 10 . 1 1 49 49 CYS HA H 49 3.682 3.682 4.207 -0.525 18980
2483 1 10 . 1 1 49 49 CYS CA C 49 59.557 59.557 59.590 -0.033 18980
2484 1 10 . 1 1 49 49 CYS CB C 49 28.040 28.040 27.320 0.720 18980
2485 1 10 . 1 1 49 49 CYS H H 49 7.091 7.091 7.677 -0.586 18980
2486 1 10 . 1 1 50 50 THR N N 50 119.675 119.675 122.619 -2.944 18980
2487 1 10 . 1 1 50 50 THR HA H 50 4.293 4.293 4.240 0.053 18980
2488 1 10 . 1 1 50 50 THR CA C 50 58.855 58.855 63.595 -4.740 18980
2489 1 10 . 1 1 50 50 THR CB C 50 66.355 66.355 68.968 -2.613 18980
2490 1 10 . 1 1 50 50 THR H H 50 8.139 8.139 8.553 -0.414 18980
2491 1 10 . 1 1 51 51 GLU N N 51 124.935 124.935 123.003 1.932 18980
2492 1 10 . 1 1 51 51 GLU HA H 51 4.164 4.164 4.510 -0.346 18980
2493 1 10 . 1 1 51 51 GLU CA C 51 54.061 54.061 55.399 -1.338 18980
2494 1 10 . 1 1 51 51 GLU CB C 51 27.130 27.130 30.774 -3.644 18980
2495 1 10 . 1 1 51 51 GLU H H 51 8.551 8.551 8.411 0.141 18980
2496 1 10 . 1 1 52 52 ARG N N 52 122.624 122.624 121.669 0.955 18980
2497 1 10 . 1 1 52 52 ARG HA H 52 4.248 4.248 4.371 -0.123 18980
2498 1 10 . 1 1 52 52 ARG CA C 52 53.402 53.402 55.513 -2.111 18980
2499 1 10 . 1 1 52 52 ARG CB C 52 28.028 28.028 31.065 -3.037 18980
2500 1 10 . 1 1 52 52 ARG H H 52 8.287 8.287 8.507 -0.220 18980
2501 1 10 . 1 1 53 53 GLN N N 53 121.647 121.647 119.492 2.155 18980
2502 1 10 . 1 1 53 53 GLN HA H 53 4.248 4.248 4.250 -0.002 18980
2503 1 10 . 1 1 53 53 GLN CA C 53 52.946 52.946 55.788 -2.842 18980
2504 1 10 . 1 1 53 53 GLN CB C 53 26.794 26.794 29.146 -2.352 18980
2505 1 10 . 1 1 53 53 GLN H H 53 8.381 8.381 8.368 0.013 18980
2506 1 10 . 1 1 54 54 ALA N N 54 125.878 125.878 123.370 2.508 18980
2507 1 10 . 1 1 54 54 ALA HA H 54 4.296 4.296 4.541 -0.245 18980
2508 1 10 . 1 1 54 54 ALA CA C 54 49.575 49.575 51.848 -2.273 18980
2509 1 10 . 1 1 54 54 ALA CB C 54 16.704 16.704 21.257 -4.553 18980
2510 1 10 . 1 1 54 54 ALA H H 54 8.338 8.338 8.256 0.082 18980
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 52 2.950 -0.960 2.816 18980
2 1 1 "Average Difference" HA 59 0.374 0.083 0.368 18980
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18980
4 1 1 "Average Difference" CA 53 2.694 2.463 1.103 18980
5 1 1 "Average Difference" CB 47 2.849 2.387 1.572 18980
6 1 1 "Average Difference" HN 52 0.684 -0.092 0.685 18980
7 1 2 "Average Difference" N 52 3.179 -0.557 3.160 18980
8 1 2 "Average Difference" HA 59 0.367 0.038 0.368 18980
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18980
10 1 2 "Average Difference" CA 53 2.643 2.483 0.915 18980
11 1 2 "Average Difference" CB 47 2.699 2.330 1.377 18980
12 1 2 "Average Difference" HN 52 0.749 -0.099 0.750 18980
13 1 3 "Average Difference" N 52 3.018 -1.016 2.870 18980
14 1 3 "Average Difference" HA 59 0.373 0.053 0.372 18980
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18980
16 1 3 "Average Difference" CA 53 2.774 2.479 1.257 18980
17 1 3 "Average Difference" CB 47 2.969 2.451 1.694 18980
18 1 3 "Average Difference" HN 52 0.696 -0.096 0.696 18980
19 1 4 "Average Difference" N 52 3.053 -0.952 2.929 18980
20 1 4 "Average Difference" HA 59 0.377 0.046 0.377 18980
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18980
22 1 4 "Average Difference" CA 53 2.855 2.584 1.224 18980
23 1 4 "Average Difference" CB 47 2.679 2.338 1.323 18980
24 1 4 "Average Difference" HN 52 0.686 -0.077 0.689 18980
25 1 5 "Average Difference" N 52 3.053 -0.952 2.929 18980
26 1 5 "Average Difference" HA 59 0.377 0.046 0.377 18980
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18980
28 1 5 "Average Difference" CA 53 2.855 2.584 1.224 18980
29 1 5 "Average Difference" CB 47 2.679 2.338 1.323 18980
30 1 5 "Average Difference" HN 52 0.686 -0.077 0.689 18980
31 1 6 "Average Difference" N 52 3.372 -1.179 3.190 18980
32 1 6 "Average Difference" HA 59 0.366 0.058 0.365 18980
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18980
34 1 6 "Average Difference" CA 53 2.850 2.603 1.170 18980
35 1 6 "Average Difference" CB 47 2.848 2.485 1.408 18980
36 1 6 "Average Difference" HN 52 0.692 -0.102 0.691 18980
37 1 7 "Average Difference" N 52 3.394 -0.893 3.306 18980
38 1 7 "Average Difference" HA 59 0.404 0.036 0.406 18980
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18980
40 1 7 "Average Difference" CA 53 2.809 2.536 1.218 18980
41 1 7 "Average Difference" CB 47 2.842 2.420 1.505 18980
42 1 7 "Average Difference" HN 52 0.722 -0.097 0.722 18980
43 1 8 "Average Difference" N 52 3.129 -0.919 3.020 18980
44 1 8 "Average Difference" HA 59 0.372 0.020 0.375 18980
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18980
46 1 8 "Average Difference" CA 53 2.834 2.586 1.173 18980
47 1 8 "Average Difference" CB 47 2.661 2.266 1.410 18980
48 1 8 "Average Difference" HN 52 0.687 -0.113 0.684 18980
49 1 9 "Average Difference" N 52 2.827 -0.939 2.693 18980
50 1 9 "Average Difference" HA 59 0.392 0.091 0.384 18980
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18980
52 1 9 "Average Difference" CA 53 2.771 2.481 1.245 18980
53 1 9 "Average Difference" CB 47 3.069 2.528 1.760 18980
54 1 9 "Average Difference" HN 52 0.737 -0.025 0.744 18980
55 1 10 "Average Difference" N 52 3.160 -0.531 3.146 18980
56 1 10 "Average Difference" HA 59 0.359 0.035 0.360 18980
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18980
58 1 10 "Average Difference" CA 53 2.761 2.528 1.119 18980
59 1 10 "Average Difference" CB 47 2.761 2.390 1.397 18980
60 1 10 "Average Difference" HN 52 0.741 -0.072 0.745 18980
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 18980
_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 GLN N N 2 125.073 125.073 123.602 1.471 18980
2 1 . 1 1 2 2 GLN HA H 2 4.309 4.309 4.606 -0.297 18980
3 1 . 1 1 2 2 GLN CA C 2 52.755 52.755 55.319 -2.564 18980
4 1 . 1 1 2 2 GLN CB C 2 26.728 26.728 30.776 -4.048 18980
5 1 . 1 1 2 2 GLN H H 2 8.503 8.503 8.344 0.159 18980
6 1 . 1 1 3 3 LYS N N 3 123.202 123.202 121.434 1.768 18980
7 1 . 1 1 3 3 LYS HA H 3 4.271 4.271 4.189 0.082 18980
8 1 . 1 1 3 3 LYS CA C 3 53.658 53.658 56.988 -3.330 18980
9 1 . 1 1 3 3 LYS CB C 3 30.442 30.442 32.539 -2.097 18980
10 1 . 1 1 3 3 LYS H H 3 8.414 8.414 8.701 -0.287 18980
11 1 . 1 1 4 4 GLY N N 4 109.574 109.574 107.453 2.121 18980
12 1 . 1 1 4 4 GLY CA C 4 42.455 42.455 44.549 -2.094 18980
13 1 . 1 1 4 4 GLY H H 4 8.394 8.394 8.036 0.358 18980
14 1 . 1 1 5 5 ASN N N 5 118.311 118.311 118.673 -0.362 18980
15 1 . 1 1 5 5 ASN HA H 5 4.625 4.625 4.497 0.128 18980
16 1 . 1 1 5 5 ASN CA C 5 50.146 50.146 53.606 -3.460 18980
17 1 . 1 1 5 5 ASN CB C 5 36.059 36.059 38.720 -2.661 18980
18 1 . 1 1 5 5 ASN H H 5 8.240 8.240 8.040 0.200 18980
19 1 . 1 1 6 6 PHE N N 6 120.460 120.460 119.729 0.731 18980
20 1 . 1 1 6 6 PHE HA H 6 4.541 4.541 4.684 -0.144 18980
21 1 . 1 1 6 6 PHE CA C 6 55.112 55.112 56.816 -1.704 18980
22 1 . 1 1 6 6 PHE CB C 6 36.457 36.457 40.359 -3.902 18980
23 1 . 1 1 6 6 PHE H H 6 8.164 8.164 7.825 0.339 18980
24 1 . 1 1 7 7 ARG N N 7 121.606 121.606 121.143 0.463 18980
25 1 . 1 1 7 7 ARG HA H 7 4.193 4.193 4.307 -0.114 18980
26 1 . 1 1 7 7 ARG CA C 7 53.586 53.586 56.504 -2.918 18980
27 1 . 1 1 7 7 ARG CB C 7 27.788 27.788 29.099 -1.311 18980
28 1 . 1 1 7 7 ARG H H 7 8.184 8.184 8.844 -0.659 18980
29 1 . 1 1 8 8 ASN N N 8 118.773 118.773 118.581 0.192 18980
30 1 . 1 1 8 8 ASN HA H 8 4.570 4.570 4.695 -0.125 18980
31 1 . 1 1 8 8 ASN CA C 8 50.518 50.518 54.304 -3.786 18980
32 1 . 1 1 8 8 ASN CB C 8 35.894 35.894 38.762 -2.868 18980
33 1 . 1 1 8 8 ASN H H 8 8.294 8.294 8.758 -0.465 18980
34 1 . 1 1 9 9 GLN N N 9 120.522 120.522 117.227 3.295 18980
35 1 . 1 1 9 9 GLN HA H 9 4.245 4.245 4.385 -0.140 18980
36 1 . 1 1 9 9 GLN CA C 9 53.202 53.202 56.265 -3.063 18980
37 1 . 1 1 9 9 GLN CB C 9 26.688 26.688 30.091 -3.403 18980
38 1 . 1 1 9 9 GLN H H 9 8.218 8.218 8.115 0.103 18980
39 1 . 1 1 10 10 ARG N N 10 121.826 121.826 121.909 -0.083 18980
40 1 . 1 1 10 10 ARG HA H 10 4.244 4.244 4.317 -0.073 18980
41 1 . 1 1 10 10 ARG CA C 10 53.208 53.208 56.465 -3.257 18980
42 1 . 1 1 10 10 ARG CB C 10 27.939 27.939 30.178 -2.239 18980
43 1 . 1 1 10 10 ARG H H 10 8.273 8.273 8.238 0.035 18980
44 1 . 1 1 11 11 LYS N N 11 122.737 122.737 122.249 0.488 18980
45 1 . 1 1 11 11 LYS HA H 11 4.263 4.263 4.026 0.237 18980
46 1 . 1 1 11 11 LYS CA C 11 53.578 53.578 58.407 -4.829 18980
47 1 . 1 1 11 11 LYS CB C 11 30.323 30.323 31.690 -1.367 18980
48 1 . 1 1 11 11 LYS H H 11 8.299 8.299 8.678 -0.379 18980
49 1 . 1 1 12 12 THR N N 12 116.442 116.442 114.137 2.305 18980
50 1 . 1 1 12 12 THR HA H 12 4.254 4.254 4.460 -0.206 18980
51 1 . 1 1 12 12 THR CA C 12 58.726 58.726 61.808 -3.082 18980
52 1 . 1 1 12 12 THR CB C 12 66.915 66.915 70.953 -4.038 18980
53 1 . 1 1 12 12 THR H H 12 8.088 8.088 7.897 0.191 18980
54 1 . 1 1 13 13 VAL N N 13 122.626 122.626 119.864 2.762 18980
55 1 . 1 1 13 13 VAL HA H 13 4.021 4.021 4.445 -0.424 18980
56 1 . 1 1 13 13 VAL CA C 13 58.497 58.497 60.082 -1.585 18980
57 1 . 1 1 13 13 VAL CB C 13 30.485 30.485 34.897 -4.412 18980
58 1 . 1 1 13 13 VAL H H 13 8.209 8.209 8.195 0.014 18980
59 1 . 1 1 14 14 LYS N N 14 123.504 123.504 127.160 -3.656 18980
60 1 . 1 1 14 14 LYS HA H 14 4.412 4.412 4.528 -0.116 18980
61 1 . 1 1 14 14 LYS CA C 14 51.599 51.599 54.408 -2.809 18980
62 1 . 1 1 14 14 LYS CB C 14 31.540 31.540 34.871 -3.331 18980
63 1 . 1 1 14 14 LYS H H 14 8.012 8.012 8.098 -0.085 18980
64 1 . 1 1 15 15 CYS N N 15 129.731 129.731 126.087 3.644 18980
65 1 . 1 1 15 15 CYS HA H 15 4.215 4.215 4.149 0.066 18980
66 1 . 1 1 15 15 CYS CA C 15 56.967 56.967 58.999 -2.032 18980
67 1 . 1 1 15 15 CYS CB C 15 27.829 27.829 28.062 -0.233 18980
68 1 . 1 1 15 15 CYS H H 15 8.256 8.256 8.404 -0.148 18980
69 1 . 1 1 16 16 PHE N N 16 128.836 128.836 123.729 5.107 18980
70 1 . 1 1 16 16 PHE HA H 16 4.615 4.615 4.247 0.368 18980
71 1 . 1 1 16 16 PHE CA C 16 56.137 56.137 58.021 -1.884 18980
72 1 . 1 1 16 16 PHE CB C 16 37.103 37.103 38.700 -1.597 18980
73 1 . 1 1 16 16 PHE H H 16 9.299 9.299 8.363 0.936 18980
74 1 . 1 1 17 17 ASN N N 17 118.280 118.280 117.780 0.500 18980
75 1 . 1 1 17 17 ASN HA H 17 3.816 3.816 4.175 -0.358 18980
76 1 . 1 1 17 17 ASN CA C 17 53.075 53.075 55.315 -2.240 18980
77 1 . 1 1 17 17 ASN CB C 17 36.212 36.212 38.759 -2.547 18980
78 1 . 1 1 17 17 ASN H H 17 9.156 9.156 7.489 1.667 18980
79 1 . 1 1 18 18 CYS N N 18 116.876 116.876 113.905 2.971 18980
80 1 . 1 1 18 18 CYS HA H 18 4.696 4.696 4.756 -0.060 18980
81 1 . 1 1 18 18 CYS CA C 18 56.126 56.126 58.031 -1.905 18980
82 1 . 1 1 18 18 CYS CB C 18 29.066 29.066 27.941 1.125 18980
83 1 . 1 1 18 18 CYS H H 18 8.489 8.489 7.496 0.994 18980
84 1 . 1 1 19 19 GLY N N 19 112.394 112.394 110.134 2.260 18980
85 1 . 1 1 19 19 GLY CA C 19 43.589 43.589 45.339 -1.750 18980
86 1 . 1 1 19 19 GLY H H 19 7.703 7.703 8.251 -0.548 18980
87 1 . 1 1 20 20 LYS N N 20 120.951 120.951 121.203 -0.251 18980
88 1 . 1 1 20 20 LYS HA H 20 4.364 4.364 4.455 -0.091 18980
89 1 . 1 1 20 20 LYS CA C 20 53.066 53.066 55.065 -1.999 18980
90 1 . 1 1 20 20 LYS CB C 20 30.653 30.653 33.758 -3.105 18980
91 1 . 1 1 20 20 LYS H H 20 8.162 8.162 7.375 0.787 18980
92 1 . 1 1 21 21 GLU N N 21 119.095 119.095 120.569 -1.474 18980
93 1 . 1 1 21 21 GLU HA H 21 4.602 4.602 4.355 0.247 18980
94 1 . 1 1 21 21 GLU CA C 21 53.327 53.327 58.185 -4.858 18980
95 1 . 1 1 21 21 GLU CB C 21 28.049 28.049 30.161 -2.112 18980
96 1 . 1 1 21 21 GLU H H 21 8.454 8.454 8.729 -0.275 18980
97 1 . 1 1 22 22 GLY N N 22 107.727 107.727 108.870 -1.143 18980
98 1 . 1 1 22 22 GLY CA C 22 42.965 42.965 45.953 -2.988 18980
99 1 . 1 1 22 22 GLY H H 22 8.639 8.639 8.472 0.167 18980
100 1 . 1 1 23 23 HIS N N 23 113.019 113.019 115.651 -2.632 18980
101 1 . 1 1 23 23 HIS HA H 23 4.613 4.613 4.855 -0.242 18980
102 1 . 1 1 23 23 HIS CA C 23 52.409 52.409 54.674 -2.265 18980
103 1 . 1 1 23 23 HIS CB C 23 27.389 27.389 31.521 -4.132 18980
104 1 . 1 1 23 23 HIS H H 23 6.992 6.992 7.289 -0.297 18980
105 1 . 1 1 24 24 ILE N N 24 105.931 105.931 112.979 -7.048 18980
106 1 . 1 1 24 24 ILE HA H 24 4.313 4.313 4.345 -0.032 18980
107 1 . 1 1 24 24 ILE CA C 24 56.515 56.515 58.291 -1.776 18980
108 1 . 1 1 24 24 ILE CB C 24 38.320 38.320 41.494 -3.174 18980
109 1 . 1 1 24 24 ILE H H 24 7.578 7.578 8.220 -0.642 18980
110 1 . 1 1 25 25 ALA N N 25 122.665 122.665 125.062 -2.397 18980
111 1 . 1 1 25 25 ALA HA H 25 4.521 4.521 3.810 0.710 18980
112 1 . 1 1 25 25 ALA CA C 25 53.097 53.097 54.823 -1.726 18980
113 1 . 1 1 25 25 ALA CB C 25 16.460 16.460 17.939 -1.479 18980
114 1 . 1 1 25 25 ALA H H 25 8.944 8.944 8.401 0.543 18980
115 1 . 1 1 26 26 LYS N N 26 117.327 117.327 116.358 0.970 18980
116 1 . 1 1 26 26 LYS HA H 26 2.735 2.735 4.087 -1.352 18980
117 1 . 1 1 26 26 LYS CA C 26 55.268 55.268 58.829 -3.561 18980
118 1 . 1 1 26 26 LYS CB C 26 31.527 31.527 32.333 -0.806 18980
119 1 . 1 1 26 26 LYS H H 26 6.448 6.448 8.300 -1.852 18980
120 1 . 1 1 27 27 ASN N N 27 111.844 111.844 115.912 -4.068 18980
121 1 . 1 1 27 27 ASN HA H 27 4.844 4.844 4.708 0.136 18980
122 1 . 1 1 27 27 ASN CA C 27 48.766 48.766 52.876 -4.110 18980
123 1 . 1 1 27 27 ASN CB C 27 37.372 37.372 39.289 -1.917 18980
124 1 . 1 1 27 27 ASN H H 27 7.536 7.536 7.724 -0.188 18980
125 1 . 1 1 28 28 CYS N N 28 122.908 122.908 119.755 3.153 18980
126 1 . 1 1 28 28 CYS HA H 28 3.590 3.590 4.098 -0.508 18980
127 1 . 1 1 28 28 CYS CA C 28 58.923 58.923 60.085 -1.162 18980
128 1 . 1 1 28 28 CYS CB C 28 28.111 28.111 27.964 0.147 18980
129 1 . 1 1 28 28 CYS H H 28 7.195 7.195 7.861 -0.666 18980
130 1 . 1 1 29 29 ARG N N 29 129.416 129.416 125.736 3.680 18980
131 1 . 1 1 29 29 ARG HA H 29 4.446 4.446 4.458 -0.012 18980
132 1 . 1 1 29 29 ARG CA C 29 52.480 52.480 55.571 -3.091 18980
133 1 . 1 1 29 29 ARG CB C 29 27.564 27.564 30.310 -2.747 18980
134 1 . 1 1 29 29 ARG H H 29 8.885 8.885 8.500 0.385 18980
135 1 . 1 1 30 30 ALA N N 30 127.959 127.959 125.411 2.548 18980
136 1 . 1 1 30 30 ALA HA H 30 4.475 4.475 4.501 -0.026 18980
137 1 . 1 1 30 30 ALA CA C 30 48.220 48.220 50.630 -2.410 18980
138 1 . 1 1 30 30 ALA CB C 30 15.112 15.112 18.405 -3.293 18980
139 1 . 1 1 30 30 ALA H H 30 8.744 8.744 7.465 1.279 18980
140 1 . 1 1 31 31 PRO HA H 31 4.238 4.238 4.455 -0.217 18980
141 1 . 1 1 31 31 PRO CA C 31 60.017 60.017 62.973 -2.956 18980
142 1 . 1 1 31 31 PRO CB C 31 28.726 28.726 32.624 -3.898 18980
143 1 . 1 1 32 32 ARG N N 32 123.635 123.635 122.305 1.330 18980
144 1 . 1 1 32 32 ARG HA H 32 4.391 4.391 4.746 -0.355 18980
145 1 . 1 1 32 32 ARG CA C 32 53.336 53.336 55.404 -2.068 18980
146 1 . 1 1 32 32 ARG CB C 32 27.689 27.689 31.752 -4.063 18980
147 1 . 1 1 32 32 ARG H H 32 8.740 8.740 8.405 0.335 18980
148 1 . 1 1 33 33 LYS N N 33 127.972 127.972 123.905 4.067 18980
149 1 . 1 1 33 33 LYS HA H 33 4.339 4.339 4.332 0.007 18980
150 1 . 1 1 33 33 LYS CA C 33 53.372 53.372 56.750 -3.378 18980
151 1 . 1 1 33 33 LYS CB C 33 30.439 30.439 33.138 -2.699 18980
152 1 . 1 1 33 33 LYS H H 33 8.868 8.868 8.788 0.080 18980
153 1 . 1 1 34 34 LYS N N 34 120.697 120.697 120.411 0.286 18980
154 1 . 1 1 34 34 LYS HA H 34 4.393 4.393 4.344 0.049 18980
155 1 . 1 1 34 34 LYS CA C 34 54.385 54.385 56.134 -1.749 18980
156 1 . 1 1 34 34 LYS CB C 34 30.651 30.651 32.438 -1.788 18980
157 1 . 1 1 34 34 LYS H H 34 8.300 8.300 8.566 -0.266 18980
158 1 . 1 1 35 35 GLY N N 35 109.787 109.787 105.858 3.929 18980
159 1 . 1 1 35 35 GLY CA C 35 40.646 40.646 44.525 -3.879 18980
160 1 . 1 1 35 35 GLY H H 35 8.518 8.518 7.350 1.168 18980
161 1 . 1 1 36 36 CYS N N 36 122.657 122.657 120.073 2.584 18980
162 1 . 1 1 36 36 CYS HA H 36 3.994 3.994 4.093 -0.099 18980
163 1 . 1 1 36 36 CYS CA C 36 57.328 57.328 58.509 -1.181 18980
164 1 . 1 1 36 36 CYS CB C 36 27.259 27.259 28.020 -0.762 18980
165 1 . 1 1 36 36 CYS H H 36 8.249 8.249 8.078 0.172 18980
166 1 . 1 1 37 37 TRP N N 37 132.646 132.646 125.827 6.819 18980
167 1 . 1 1 37 37 TRP HA H 37 4.763 4.763 4.597 0.166 18980
168 1 . 1 1 37 37 TRP CA C 37 54.955 54.955 57.379 -2.424 18980
169 1 . 1 1 37 37 TRP CB C 37 26.102 26.102 29.187 -3.085 18980
170 1 . 1 1 37 37 TRP H H 37 9.218 9.218 8.324 0.894 18980
171 1 . 1 1 38 38 LYS N N 38 121.676 121.676 117.921 3.755 18980
172 1 . 1 1 38 38 LYS HA H 38 4.200 4.200 4.090 0.110 18980
173 1 . 1 1 38 38 LYS CA C 38 55.916 55.916 58.085 -2.169 18980
174 1 . 1 1 38 38 LYS CB C 38 31.288 31.288 33.411 -2.123 18980
175 1 . 1 1 38 38 LYS H H 38 9.626 9.626 7.803 1.823 18980
176 1 . 1 1 39 39 CYS N N 39 117.746 117.746 113.356 4.390 18980
177 1 . 1 1 39 39 CYS HA H 39 4.929 4.929 4.844 0.085 18980
178 1 . 1 1 39 39 CYS CA C 39 56.058 56.058 57.708 -1.650 18980
179 1 . 1 1 39 39 CYS CB C 39 29.705 29.705 29.355 0.350 18980
180 1 . 1 1 39 39 CYS H H 39 8.612 8.612 7.809 0.803 18980
181 1 . 1 1 40 40 GLY N N 40 113.510 113.510 110.743 2.767 18980
182 1 . 1 1 40 40 GLY CA C 40 43.398 43.398 45.259 -1.862 18980
183 1 . 1 1 40 40 GLY H H 40 8.050 8.050 8.124 -0.074 18980
184 1 . 1 1 41 41 LYS N N 41 121.911 121.911 121.580 0.331 18980
185 1 . 1 1 41 41 LYS HA H 41 4.296 4.296 4.426 -0.130 18980
186 1 . 1 1 41 41 LYS CA C 41 54.068 54.068 55.844 -1.776 18980
187 1 . 1 1 41 41 LYS CB C 41 30.765 30.765 33.410 -2.645 18980
188 1 . 1 1 41 41 LYS H H 41 8.340 8.340 7.527 0.814 18980
189 1 . 1 1 42 42 GLU N N 42 119.418 119.418 119.708 -0.290 18980
190 1 . 1 1 42 42 GLU HA H 42 4.116 4.116 4.200 -0.084 18980
191 1 . 1 1 42 42 GLU CA C 42 54.054 54.054 56.470 -2.416 18980
192 1 . 1 1 42 42 GLU CB C 42 27.786 27.786 30.295 -2.509 18980
193 1 . 1 1 42 42 GLU H H 42 8.501 8.501 8.481 0.020 18980
194 1 . 1 1 43 43 GLY N N 43 107.782 107.782 109.247 -1.465 18980
195 1 . 1 1 43 43 GLY CA C 43 42.789 42.789 45.825 -3.036 18980
196 1 . 1 1 43 43 GLY H H 43 8.719 8.719 8.760 -0.041 18980
197 1 . 1 1 44 44 HIS N N 44 111.284 111.284 116.906 -5.622 18980
198 1 . 1 1 44 44 HIS HA H 44 4.587 4.587 4.702 -0.115 18980
199 1 . 1 1 44 44 HIS CA C 44 52.665 52.665 54.355 -1.690 18980
200 1 . 1 1 44 44 HIS CB C 44 27.416 27.416 30.467 -3.051 18980
201 1 . 1 1 44 44 HIS H H 44 6.810 6.810 7.758 -0.948 18980
202 1 . 1 1 45 45 GLN N N 45 117.297 117.297 118.987 -1.690 18980
203 1 . 1 1 45 45 GLN HA H 45 3.773 3.773 4.394 -0.621 18980
204 1 . 1 1 45 45 GLN CA C 45 51.454 51.454 54.202 -2.748 18980
205 1 . 1 1 45 45 GLN CB C 45 28.905 28.905 30.725 -1.820 18980
206 1 . 1 1 45 45 GLN H H 45 8.781 8.781 8.631 0.150 18980
207 1 . 1 1 46 46 MET N N 46 117.926 117.926 121.770 -3.844 18980
208 1 . 1 1 46 46 MET HA H 46 4.820 4.820 4.314 0.506 18980
209 1 . 1 1 46 46 MET CA C 46 57.542 57.542 58.166 -0.624 18980
210 1 . 1 1 46 46 MET CB C 46 29.549 29.549 32.276 -2.727 18980
211 1 . 1 1 46 46 MET H H 46 9.008 9.008 8.609 0.399 18980
212 1 . 1 1 47 47 LYS N N 47 117.631 117.631 116.523 1.108 18980
213 1 . 1 1 47 47 LYS HA H 47 3.448 3.448 4.168 -0.720 18980
214 1 . 1 1 47 47 LYS CA C 47 54.988 54.988 57.875 -2.887 18980
215 1 . 1 1 47 47 LYS CB C 47 28.285 28.285 31.829 -3.544 18980
216 1 . 1 1 47 47 LYS H H 47 6.430 6.430 7.877 -1.447 18980
217 1 . 1 1 48 48 ASP N N 48 117.363 117.363 119.634 -2.271 18980
218 1 . 1 1 48 48 ASP HA H 48 4.780 4.780 4.641 0.139 18980
219 1 . 1 1 48 48 ASP CA C 48 50.600 50.600 54.910 -4.311 18980
220 1 . 1 1 48 48 ASP CB C 48 40.029 40.029 41.719 -1.690 18980
221 1 . 1 1 48 48 ASP H H 48 7.560 7.560 7.909 -0.349 18980
222 1 . 1 1 49 49 CYS N N 49 122.910 122.910 119.259 3.651 18980
223 1 . 1 1 49 49 CYS HA H 49 3.682 3.682 4.484 -0.802 18980
224 1 . 1 1 49 49 CYS CA C 49 59.557 59.557 58.643 0.914 18980
225 1 . 1 1 49 49 CYS CB C 49 28.040 28.040 27.345 0.695 18980
226 1 . 1 1 49 49 CYS H H 49 7.091 7.091 7.709 -0.618 18980
227 1 . 1 1 50 50 THR N N 50 119.675 119.675 119.212 0.463 18980
228 1 . 1 1 50 50 THR HA H 50 4.293 4.293 4.279 0.014 18980
229 1 . 1 1 50 50 THR CA C 50 58.855 58.855 63.355 -4.500 18980
230 1 . 1 1 50 50 THR CB C 50 66.355 66.355 69.311 -2.956 18980
231 1 . 1 1 50 50 THR H H 50 8.139 8.139 8.393 -0.255 18980
232 1 . 1 1 51 51 GLU N N 51 124.935 124.935 121.564 3.370 18980
233 1 . 1 1 51 51 GLU HA H 51 4.164 4.164 4.462 -0.299 18980
234 1 . 1 1 51 51 GLU CA C 51 54.061 54.061 55.502 -1.441 18980
235 1 . 1 1 51 51 GLU CB C 51 27.130 27.130 31.135 -4.004 18980
236 1 . 1 1 51 51 GLU H H 51 8.551 8.551 8.067 0.484 18980
237 1 . 1 1 52 52 ARG N N 52 122.624 122.624 121.200 1.424 18980
238 1 . 1 1 52 52 ARG HA H 52 4.248 4.248 4.380 -0.132 18980
239 1 . 1 1 52 52 ARG CA C 52 53.402 53.402 56.045 -2.643 18980
240 1 . 1 1 52 52 ARG CB C 52 28.028 28.028 30.693 -2.665 18980
241 1 . 1 1 52 52 ARG H H 52 8.287 8.287 8.558 -0.271 18980
242 1 . 1 1 53 53 GLN N N 53 121.647 121.647 120.589 1.058 18980
243 1 . 1 1 53 53 GLN HA H 53 4.248 4.248 4.399 -0.151 18980
244 1 . 1 1 53 53 GLN CA C 53 52.946 52.946 55.789 -2.843 18980
245 1 . 1 1 53 53 GLN CB C 53 26.794 26.794 29.779 -2.985 18980
246 1 . 1 1 53 53 GLN H H 53 8.381 8.381 8.393 -0.013 18980
247 1 . 1 1 54 54 ALA N N 54 125.878 125.878 123.072 2.806 18980
248 1 . 1 1 54 54 ALA HA H 54 4.296 4.296 4.450 -0.154 18980
249 1 . 1 1 54 54 ALA CA C 54 49.575 49.575 52.260 -2.685 18980
250 1 . 1 1 54 54 ALA CB C 54 16.704 16.704 19.666 -2.962 18980
251 1 . 1 1 54 54 ALA H H 54 8.338 8.338 8.446 -0.108 18980
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