data_25468
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25468
_Entry.PDB_ID 2MZ0
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 25468
_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 ASP N N 2 123.544 123.544 121.280 2.264 25468
2 1 1 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.628 0.070 25468
3 1 1 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.093 -1.185 25468
4 1 1 . 1 1 2 2 ASP H H 2 8.843 8.843 8.411 0.432 25468
5 1 1 . 1 1 3 3 ILE N N 3 121.633 121.633 122.380 -0.747 25468
6 1 1 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.034 0.124 25468
7 1 1 . 1 1 3 3 ILE CA C 3 61.110 61.110 60.485 0.625 25468
8 1 1 . 1 1 3 3 ILE CB C 3 39.038 39.038 36.910 2.128 25468
9 1 1 . 1 1 3 3 ILE H H 3 8.356 8.356 7.637 0.719 25468
10 1 1 . 1 1 4 4 ASP N N 4 124.028 124.028 128.552 -4.524 25468
11 1 1 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.491 0.136 25468
12 1 1 . 1 1 4 4 ASP CA C 4 53.776 53.776 54.836 -1.060 25468
13 1 1 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.679 -1.463 25468
14 1 1 . 1 1 4 4 ASP H H 4 8.460 8.460 8.725 -0.265 25468
15 1 1 . 1 1 5 5 GLY N N 5 110.531 110.531 108.817 1.714 25468
16 1 1 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.621 0.093 25468
17 1 1 . 1 1 5 5 GLY H H 5 8.405 8.405 8.572 -0.167 25468
18 1 1 . 1 1 6 6 ARG N N 6 119.193 119.193 120.035 -0.842 25468
19 1 1 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.438 -0.091 25468
20 1 1 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.996 1.251 25468
21 1 1 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.754 0.335 25468
22 1 1 . 1 1 6 6 ARG H H 6 8.128 8.128 8.095 0.033 25468
23 1 1 . 1 1 7 7 LYS N N 7 120.971 120.971 119.288 1.683 25468
24 1 1 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.583 0.186 25468
25 1 1 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.404 0.826 25468
26 1 1 . 1 1 7 7 LYS H H 7 7.984 7.984 7.720 0.264 25468
27 1 1 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.417 0.121 25468
28 1 1 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.343 0.860 25468
29 1 1 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.249 -0.394 25468
30 1 1 . 1 1 9 9 LEU N N 9 123.948 123.948 124.062 -0.114 25468
31 1 1 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.599 -0.112 25468
32 1 1 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.340 0.171 25468
33 1 1 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.175 2.584 25468
34 1 1 . 1 1 9 9 LEU H H 9 7.801 7.801 7.954 -0.153 25468
35 1 1 . 1 1 10 10 LEU N N 10 130.176 130.176 128.282 1.894 25468
36 1 1 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.996 -0.442 25468
37 1 1 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.630 0.841 25468
38 1 1 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.263 -1.160 25468
39 1 1 . 1 1 10 10 LEU H H 10 8.422 8.422 8.660 -0.238 25468
40 1 1 . 1 1 11 11 ILE N N 11 120.839 120.839 121.640 -0.801 25468
41 1 1 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.588 -0.202 25468
42 1 1 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.934 0.597 25468
43 1 1 . 1 1 11 11 ILE CB C 11 39.357 39.357 39.002 0.355 25468
44 1 1 . 1 1 11 11 ILE H H 11 8.289 8.289 8.659 -0.370 25468
45 1 1 . 1 1 12 12 GLY N N 12 106.385 106.385 107.787 -1.402 25468
46 1 1 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.556 -0.813 25468
47 1 1 . 1 1 12 12 GLY H H 12 7.125 7.125 7.458 -0.333 25468
48 1 1 . 1 1 13 13 THR N N 13 110.566 110.566 116.126 -5.560 25468
49 1 1 . 1 1 13 13 THR HA H 13 4.676 4.676 4.686 -0.010 25468
50 1 1 . 1 1 13 13 THR CA C 13 62.119 62.119 63.209 -1.090 25468
51 1 1 . 1 1 13 13 THR CB C 13 71.115 71.115 69.867 1.248 25468
52 1 1 . 1 1 13 13 THR H H 13 9.046 9.046 8.222 0.824 25468
53 1 1 . 1 1 14 14 CYS N N 14 117.216 117.216 126.577 -9.361 25468
54 1 1 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.513 0.387 25468
55 1 1 . 1 1 14 14 CYS CA C 14 58.201 58.201 61.210 -3.009 25468
56 1 1 . 1 1 14 14 CYS CB C 14 44.631 44.631 26.303 18.328 25468
57 1 1 . 1 1 14 14 CYS H H 14 8.436 8.436 8.499 -0.063 25468
58 1 1 . 1 1 15 15 ILE N N 15 118.247 118.247 119.491 -1.244 25468
59 1 1 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.703 0.183 25468
60 1 1 . 1 1 15 15 ILE CA C 15 63.301 63.301 64.587 -1.286 25468
61 1 1 . 1 1 15 15 ILE CB C 15 37.496 37.496 37.924 -0.428 25468
62 1 1 . 1 1 15 15 ILE H H 15 7.244 7.244 8.146 -0.902 25468
63 1 1 . 1 1 16 16 GLU N N 16 119.649 119.649 117.901 1.748 25468
64 1 1 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.047 -0.214 25468
65 1 1 . 1 1 16 16 GLU CA C 16 57.902 57.902 57.188 0.714 25468
66 1 1 . 1 1 16 16 GLU CB C 16 28.781 28.781 30.289 -1.508 25468
67 1 1 . 1 1 16 16 GLU H H 16 7.066 7.066 8.003 -0.937 25468
68 1 1 . 1 1 17 17 PHE N N 17 114.996 114.996 120.244 -5.248 25468
69 1 1 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.998 -0.434 25468
70 1 1 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.513 -0.985 25468
71 1 1 . 1 1 17 17 PHE CB C 17 39.890 39.890 38.894 0.996 25468
72 1 1 . 1 1 17 17 PHE H H 17 8.148 8.148 7.808 0.340 25468
73 1 1 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.635 0.218 25468
74 1 1 . 1 1 18 18 PRO CA C 18 62.917 62.917 62.944 -0.027 25468
75 1 1 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.554 -0.687 25468
76 1 1 . 1 1 19 19 THR N N 19 114.536 114.536 114.619 -0.083 25468
77 1 1 . 1 1 19 19 THR HA H 19 3.650 3.650 3.951 -0.301 25468
78 1 1 . 1 1 19 19 THR CA C 19 68.731 68.731 67.944 0.787 25468
79 1 1 . 1 1 19 19 THR CB C 19 69.792 69.792 68.541 1.251 25468
80 1 1 . 1 1 19 19 THR H H 19 8.370 8.370 8.576 -0.206 25468
81 1 1 . 1 1 20 20 GLU N N 20 120.374 120.374 121.139 -0.765 25468
82 1 1 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.178 0.015 25468
83 1 1 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.678 0.367 25468
84 1 1 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.767 -0.511 25468
85 1 1 . 1 1 20 20 GLU H H 20 9.038 9.038 8.799 0.239 25468
86 1 1 . 1 1 21 21 LYS N N 21 122.432 122.432 119.872 2.560 25468
87 1 1 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.137 0.028 25468
88 1 1 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.034 0.176 25468
89 1 1 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.269 0.858 25468
90 1 1 . 1 1 21 21 LYS H H 21 7.622 7.622 8.183 -0.561 25468
91 1 1 . 1 1 22 22 CYS N N 22 121.466 121.466 120.681 0.785 25468
92 1 1 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.065 0.020 25468
93 1 1 . 1 1 22 22 CYS CA C 22 58.769 58.769 61.890 -3.121 25468
94 1 1 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.005 10.589 25468
95 1 1 . 1 1 22 22 CYS H H 22 9.356 9.356 8.688 0.668 25468
96 1 1 . 1 1 23 23 ASN N N 23 115.604 115.604 118.926 -3.322 25468
97 1 1 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.454 -0.409 25468
98 1 1 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.610 1.257 25468
99 1 1 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.761 1.543 25468
100 1 1 . 1 1 23 23 ASN H H 23 7.925 7.925 8.125 -0.200 25468
101 1 1 . 1 1 24 24 LYS N N 24 116.665 116.665 121.243 -4.578 25468
102 1 1 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.984 -0.072 25468
103 1 1 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.754 0.155 25468
104 1 1 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.297 0.738 25468
105 1 1 . 1 1 24 24 LYS H H 24 7.955 7.955 7.853 0.102 25468
106 1 1 . 1 1 25 25 THR N N 25 116.759 116.759 115.088 1.671 25468
107 1 1 . 1 1 25 25 THR HA H 25 3.859 3.859 4.117 -0.258 25468
108 1 1 . 1 1 25 25 THR CA C 25 67.243 67.243 66.566 0.677 25468
109 1 1 . 1 1 25 25 THR CB C 25 68.752 68.752 68.218 0.534 25468
110 1 1 . 1 1 25 25 THR H H 25 8.518 8.518 8.572 -0.054 25468
111 1 1 . 1 1 26 26 CYS N N 26 121.616 121.616 119.477 2.139 25468
112 1 1 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.232 0.027 25468
113 1 1 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.698 -4.095 25468
114 1 1 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.794 8.396 25468
115 1 1 . 1 1 26 26 CYS H H 26 8.062 8.062 8.134 -0.072 25468
116 1 1 . 1 1 27 27 ILE N N 27 124.036 124.036 121.277 2.759 25468
117 1 1 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.148 0.006 25468
118 1 1 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.720 0.540 25468
119 1 1 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.431 0.604 25468
120 1 1 . 1 1 27 27 ILE H H 27 8.313 8.313 8.529 -0.216 25468
121 1 1 . 1 1 28 28 GLU N N 28 121.780 121.780 119.390 2.390 25468
122 1 1 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.152 0.042 25468
123 1 1 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.834 -0.337 25468
124 1 1 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.249 -1.292 25468
125 1 1 . 1 1 28 28 GLU H H 28 8.312 8.312 8.087 0.225 25468
126 1 1 . 1 1 29 29 SER N N 29 114.001 114.001 114.328 -0.327 25468
127 1 1 . 1 1 29 29 SER HA H 29 4.661 4.661 4.339 0.322 25468
128 1 1 . 1 1 29 29 SER CA C 29 58.377 58.377 58.727 -0.350 25468
129 1 1 . 1 1 29 29 SER CB C 29 63.484 63.484 63.420 0.064 25468
130 1 1 . 1 1 29 29 SER H H 29 7.459 7.459 7.663 -0.204 25468
131 1 1 . 1 1 30 30 ASN N N 30 112.213 112.213 114.001 -1.788 25468
132 1 1 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.462 -0.035 25468
133 1 1 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.868 0.173 25468
134 1 1 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.233 0.111 25468
135 1 1 . 1 1 30 30 ASN H H 30 8.067 8.067 7.999 0.068 25468
136 1 1 . 1 1 31 31 PHE N N 31 116.306 116.306 117.864 -1.558 25468
137 1 1 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.844 -0.270 25468
138 1 1 . 1 1 31 31 PHE CA C 31 57.969 57.969 56.400 1.569 25468
139 1 1 . 1 1 31 31 PHE CB C 31 38.699 38.699 41.033 -2.334 25468
140 1 1 . 1 1 31 31 PHE H H 31 7.861 7.861 8.202 -0.341 25468
141 1 1 . 1 1 32 32 ALA N N 32 121.103 121.103 125.593 -4.490 25468
142 1 1 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.294 -0.103 25468
143 1 1 . 1 1 32 32 ALA CA C 32 53.586 53.586 52.226 1.360 25468
144 1 1 . 1 1 32 32 ALA CB C 32 19.211 19.211 17.135 2.076 25468
145 1 1 . 1 1 32 32 ALA H H 32 8.403 8.403 8.824 -0.421 25468
146 1 1 . 1 1 33 33 GLY N N 33 100.820 100.820 107.263 -6.443 25468
147 1 1 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.518 0.352 25468
148 1 1 . 1 1 33 33 GLY H H 33 7.258 7.258 7.973 -0.715 25468
149 1 1 . 1 1 34 34 GLY N N 34 108.312 108.312 106.102 2.210 25468
150 1 1 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.660 1.777 25468
151 1 1 . 1 1 34 34 GLY H H 34 8.978 8.978 8.366 0.612 25468
152 1 1 . 1 1 35 35 LYS N N 35 119.929 119.929 116.112 3.817 25468
153 1 1 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.876 -0.282 25468
154 1 1 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.589 0.066 25468
155 1 1 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.630 1.654 25468
156 1 1 . 1 1 35 35 LYS H H 35 8.756 8.756 8.174 0.582 25468
157 1 1 . 1 1 36 36 CYS N N 36 119.831 119.831 120.588 -0.757 25468
158 1 1 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.674 -0.310 25468
159 1 1 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.597 -1.379 25468
160 1 1 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.154 17.997 25468
161 1 1 . 1 1 36 36 CYS H H 36 8.553 8.553 8.698 -0.145 25468
162 1 1 . 1 1 37 37 VAL N N 37 120.392 120.392 121.884 -1.492 25468
163 1 1 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.754 0.010 25468
164 1 1 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.245 1.002 25468
165 1 1 . 1 1 37 37 VAL H H 37 9.587 9.587 8.742 0.845 25468
166 1 1 . 1 1 38 38 HIS N N 38 118.311 118.311 118.456 -0.145 25468
167 1 1 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.266 -0.226 25468
168 1 1 . 1 1 38 38 HIS CA C 38 53.975 53.975 52.993 0.981 25468
169 1 1 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.081 -1.601 25468
170 1 1 . 1 1 38 38 HIS H H 38 8.698 8.698 7.810 0.888 25468
171 1 1 . 1 1 39 39 ILE N N 39 124.114 124.114 121.736 2.378 25468
172 1 1 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.192 0.110 25468
173 1 1 . 1 1 39 39 ILE CA C 39 59.840 59.840 59.533 0.307 25468
174 1 1 . 1 1 39 39 ILE CB C 39 38.709 38.709 37.346 1.363 25468
175 1 1 . 1 1 39 39 ILE H H 39 8.969 8.969 8.218 0.751 25468
176 1 1 . 1 1 40 40 GLY N N 40 115.080 115.080 117.336 -2.256 25468
177 1 1 . 1 1 40 40 GLY CA C 40 46.226 46.226 47.371 -1.145 25468
178 1 1 . 1 1 40 40 GLY H H 40 8.715 8.715 8.819 -0.104 25468
179 1 1 . 1 1 41 41 GLN N N 41 121.798 121.798 122.124 -0.326 25468
180 1 1 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.414 -0.110 25468
181 1 1 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.417 0.233 25468
182 1 1 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.420 -0.940 25468
183 1 1 . 1 1 41 41 GLN H H 41 8.672 8.672 8.263 0.409 25468
184 1 1 . 1 1 42 42 SER N N 42 114.462 114.462 116.617 -2.155 25468
185 1 1 . 1 1 42 42 SER HA H 42 4.347 4.347 4.301 0.046 25468
186 1 1 . 1 1 42 42 SER CA C 42 58.072 58.072 59.892 -1.820 25468
187 1 1 . 1 1 42 42 SER CB C 42 64.037 64.037 63.520 0.517 25468
188 1 1 . 1 1 42 42 SER H H 42 7.725 7.725 8.694 -0.969 25468
189 1 1 . 1 1 43 43 LEU N N 43 124.166 124.166 120.249 3.917 25468
190 1 1 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.793 0.157 25468
191 1 1 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.379 -0.084 25468
192 1 1 . 1 1 43 43 LEU CB C 43 41.400 41.400 41.201 0.199 25468
193 1 1 . 1 1 43 43 LEU H H 43 8.576 8.576 7.611 0.965 25468
194 1 1 . 1 1 44 44 ASP N N 44 118.797 118.797 118.684 0.113 25468
195 1 1 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.650 0.081 25468
196 1 1 . 1 1 44 44 ASP CB C 44 39.979 39.979 41.830 -1.851 25468
197 1 1 . 1 1 44 44 ASP H H 44 8.163 8.163 7.881 0.282 25468
198 1 1 . 1 1 45 45 PHE N N 45 123.595 123.595 123.888 -0.293 25468
199 1 1 . 1 1 45 45 PHE HA H 45 4.920 4.920 4.939 -0.019 25468
200 1 1 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.966 -0.359 25468
201 1 1 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.754 0.329 25468
202 1 1 . 1 1 45 45 PHE H H 45 9.042 9.042 8.757 0.285 25468
203 1 1 . 1 1 46 46 VAL N N 46 119.357 119.357 116.712 2.645 25468
204 1 1 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.728 -0.035 25468
205 1 1 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.699 0.216 25468
206 1 1 . 1 1 46 46 VAL CB C 46 34.666 34.666 35.827 -1.161 25468
207 1 1 . 1 1 46 46 VAL H H 46 9.555 9.555 8.733 0.822 25468
208 1 1 . 1 1 47 47 CYS N N 47 122.793 122.793 124.209 -1.416 25468
209 1 1 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.367 -0.537 25468
210 1 1 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.771 11.959 25468
211 1 1 . 1 1 47 47 CYS H H 47 9.044 9.044 8.798 0.246 25468
212 1 1 . 1 1 48 48 VAL N N 48 129.864 129.864 129.466 0.398 25468
213 1 1 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.114 -0.581 25468
214 1 1 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.659 0.158 25468
215 1 1 . 1 1 48 48 VAL CB C 48 34.398 34.398 35.887 -1.489 25468
216 1 1 . 1 1 48 48 VAL H H 48 8.616 8.616 8.167 0.449 25468
217 1 1 . 1 1 49 49 CYS N N 49 121.329 121.329 125.332 -4.003 25468
218 1 1 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.413 -0.265 25468
219 1 1 . 1 1 49 49 CYS CA C 49 50.429 50.429 57.604 -7.175 25468
220 1 1 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.998 4.875 25468
221 1 1 . 1 1 49 49 CYS H H 49 8.652 8.652 8.851 -0.199 25468
222 1 1 . 1 1 50 50 PHE N N 50 119.026 119.026 120.114 -1.088 25468
223 1 1 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.152 -0.203 25468
224 1 1 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.550 -0.898 25468
225 1 1 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.548 -0.955 25468
226 1 1 . 1 1 50 50 PHE H H 50 8.472 8.472 9.274 -0.802 25468
227 1 1 . 1 1 51 51 PRO HA H 51 4.732 4.732 3.867 0.865 25468
228 1 1 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.282 0.927 25468
229 1 1 . 1 1 52 52 LYS N N 52 119.951 119.951 122.263 -2.312 25468
230 1 1 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.348 -0.389 25468
231 1 1 . 1 1 52 52 LYS CA C 52 57.670 57.670 57.165 0.505 25468
232 1 1 . 1 1 52 52 LYS CB C 52 33.225 33.225 33.733 -0.508 25468
233 1 1 . 1 1 52 52 LYS H H 52 8.681 8.681 8.481 0.200 25468
234 1 1 . 1 1 53 53 TYR N N 53 118.889 118.889 118.688 0.201 25468
235 1 1 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.690 -0.219 25468
236 1 1 . 1 1 53 53 TYR CA C 53 58.049 58.049 57.012 1.037 25468
237 1 1 . 1 1 53 53 TYR CB C 53 38.268 38.268 38.799 -0.531 25468
238 1 1 . 1 1 53 53 TYR H H 53 8.215 8.215 8.222 -0.007 25468
239 1 1 . 1 1 54 54 TYR N N 54 121.087 121.087 123.923 -2.836 25468
240 1 1 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.582 -0.088 25468
241 1 1 . 1 1 54 54 TYR CA C 54 58.101 58.101 57.805 0.296 25468
242 1 1 . 1 1 54 54 TYR CB C 54 39.611 39.611 36.716 2.895 25468
243 1 1 . 1 1 54 54 TYR H H 54 7.919 7.919 7.764 0.155 25468
244 1 2 . 1 1 2 2 ASP N N 2 123.544 123.544 120.351 3.193 25468
245 1 2 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.546 0.152 25468
246 1 2 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.179 -1.272 25468
247 1 2 . 1 1 2 2 ASP H H 2 8.843 8.843 8.496 0.347 25468
248 1 2 . 1 1 3 3 ILE N N 3 121.633 121.633 120.462 1.171 25468
249 1 2 . 1 1 3 3 ILE HA H 3 4.158 4.158 3.930 0.228 25468
250 1 2 . 1 1 3 3 ILE CA C 3 61.110 61.110 61.816 -0.706 25468
251 1 2 . 1 1 3 3 ILE CB C 3 39.038 39.038 37.985 1.053 25468
252 1 2 . 1 1 3 3 ILE H H 3 8.356 8.356 7.458 0.898 25468
253 1 2 . 1 1 4 4 ASP N N 4 124.028 124.028 127.503 -3.475 25468
254 1 2 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.453 0.174 25468
255 1 2 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.560 -1.784 25468
256 1 2 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.172 -0.956 25468
257 1 2 . 1 1 4 4 ASP H H 4 8.460 8.460 8.524 -0.064 25468
258 1 2 . 1 1 5 5 GLY N N 5 110.531 110.531 107.385 3.146 25468
259 1 2 . 1 1 5 5 GLY CA C 5 45.714 45.714 44.995 0.720 25468
260 1 2 . 1 1 5 5 GLY H H 5 8.405 8.405 8.059 0.346 25468
261 1 2 . 1 1 6 6 ARG N N 6 119.193 119.193 117.875 1.318 25468
262 1 2 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.493 -0.146 25468
263 1 2 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.157 2.090 25468
264 1 2 . 1 1 6 6 ARG CB C 6 31.089 31.089 29.568 1.521 25468
265 1 2 . 1 1 6 6 ARG H H 6 8.128 8.128 7.780 0.348 25468
266 1 2 . 1 1 7 7 LYS N N 7 120.971 120.971 119.447 1.524 25468
267 1 2 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.635 0.134 25468
268 1 2 . 1 1 7 7 LYS CB C 7 33.230 33.230 33.578 -0.348 25468
269 1 2 . 1 1 7 7 LYS H H 7 7.984 7.984 7.716 0.268 25468
270 1 2 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.019 0.519 25468
271 1 2 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.445 0.758 25468
272 1 2 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.067 -0.212 25468
273 1 2 . 1 1 9 9 LEU N N 9 123.948 123.948 123.047 0.901 25468
274 1 2 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.369 0.118 25468
275 1 2 . 1 1 9 9 LEU CA C 9 53.511 53.511 52.954 0.557 25468
276 1 2 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.088 2.671 25468
277 1 2 . 1 1 9 9 LEU H H 9 7.801 7.801 7.866 -0.065 25468
278 1 2 . 1 1 10 10 LEU N N 10 130.176 130.176 128.258 1.918 25468
279 1 2 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.871 -0.317 25468
280 1 2 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.412 1.059 25468
281 1 2 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.031 -0.928 25468
282 1 2 . 1 1 10 10 LEU H H 10 8.422 8.422 8.537 -0.115 25468
283 1 2 . 1 1 11 11 ILE N N 11 120.839 120.839 122.110 -1.271 25468
284 1 2 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.531 -0.145 25468
285 1 2 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.985 0.546 25468
286 1 2 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.738 0.619 25468
287 1 2 . 1 1 11 11 ILE H H 11 8.289 8.289 8.701 -0.412 25468
288 1 2 . 1 1 12 12 GLY N N 12 106.385 106.385 107.015 -0.630 25468
289 1 2 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.845 -1.102 25468
290 1 2 . 1 1 12 12 GLY H H 12 7.125 7.125 7.515 -0.390 25468
291 1 2 . 1 1 13 13 THR N N 13 110.566 110.566 110.960 -0.394 25468
292 1 2 . 1 1 13 13 THR HA H 13 4.676 4.676 5.045 -0.369 25468
293 1 2 . 1 1 13 13 THR CA C 13 62.119 62.119 60.180 1.939 25468
294 1 2 . 1 1 13 13 THR CB C 13 71.115 71.115 71.572 -0.457 25468
295 1 2 . 1 1 13 13 THR H H 13 9.046 9.046 8.168 0.878 25468
296 1 2 . 1 1 14 14 CYS N N 14 117.216 117.216 121.922 -4.706 25468
297 1 2 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.588 0.312 25468
298 1 2 . 1 1 14 14 CYS CA C 14 58.201 58.201 61.240 -3.039 25468
299 1 2 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.769 18.862 25468
300 1 2 . 1 1 14 14 CYS H H 14 8.436 8.436 8.666 -0.230 25468
301 1 2 . 1 1 15 15 ILE N N 15 118.247 118.247 118.640 -0.393 25468
302 1 2 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.826 0.060 25468
303 1 2 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.801 -0.500 25468
304 1 2 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.039 -0.543 25468
305 1 2 . 1 1 15 15 ILE H H 15 7.244 7.244 8.093 -0.849 25468
306 1 2 . 1 1 16 16 GLU N N 16 119.649 119.649 118.636 1.013 25468
307 1 2 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.244 -0.411 25468
308 1 2 . 1 1 16 16 GLU CA C 16 57.902 57.902 56.477 1.425 25468
309 1 2 . 1 1 16 16 GLU CB C 16 28.781 28.781 31.722 -2.941 25468
310 1 2 . 1 1 16 16 GLU H H 16 7.066 7.066 8.170 -1.104 25468
311 1 2 . 1 1 17 17 PHE N N 17 114.996 114.996 121.180 -6.184 25468
312 1 2 . 1 1 17 17 PHE HA H 17 4.564 4.564 5.017 -0.453 25468
313 1 2 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.760 -1.232 25468
314 1 2 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.043 0.847 25468
315 1 2 . 1 1 17 17 PHE H H 17 8.148 8.148 8.319 -0.171 25468
316 1 2 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.471 0.382 25468
317 1 2 . 1 1 18 18 PRO CA C 18 62.917 62.917 63.255 -0.338 25468
318 1 2 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.429 -0.561 25468
319 1 2 . 1 1 19 19 THR N N 19 114.536 114.536 113.607 0.929 25468
320 1 2 . 1 1 19 19 THR HA H 19 3.650 3.650 3.910 -0.260 25468
321 1 2 . 1 1 19 19 THR CA C 19 68.731 68.731 67.072 1.659 25468
322 1 2 . 1 1 19 19 THR CB C 19 69.792 69.792 68.499 1.293 25468
323 1 2 . 1 1 19 19 THR H H 19 8.370 8.370 8.585 -0.215 25468
324 1 2 . 1 1 20 20 GLU N N 20 120.374 120.374 120.230 0.144 25468
325 1 2 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.034 0.159 25468
326 1 2 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.616 0.429 25468
327 1 2 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.673 -0.417 25468
328 1 2 . 1 1 20 20 GLU H H 20 9.038 9.038 8.961 0.077 25468
329 1 2 . 1 1 21 21 LYS N N 21 122.432 122.432 120.399 2.033 25468
330 1 2 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.117 0.048 25468
331 1 2 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.447 -0.237 25468
332 1 2 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.156 0.972 25468
333 1 2 . 1 1 21 21 LYS H H 21 7.622 7.622 7.952 -0.330 25468
334 1 2 . 1 1 22 22 CYS N N 22 121.466 121.466 121.163 0.303 25468
335 1 2 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.059 0.026 25468
336 1 2 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.045 -3.276 25468
337 1 2 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.024 10.570 25468
338 1 2 . 1 1 22 22 CYS H H 22 9.356 9.356 8.857 0.499 25468
339 1 2 . 1 1 23 23 ASN N N 23 115.604 115.604 118.991 -3.387 25468
340 1 2 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.455 -0.410 25468
341 1 2 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.433 1.434 25468
342 1 2 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.719 1.585 25468
343 1 2 . 1 1 23 23 ASN H H 23 7.925 7.925 8.469 -0.544 25468
344 1 2 . 1 1 24 24 LYS N N 24 116.665 116.665 121.464 -4.799 25468
345 1 2 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.941 -0.029 25468
346 1 2 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.990 -0.081 25468
347 1 2 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.249 0.786 25468
348 1 2 . 1 1 24 24 LYS H H 24 7.955 7.955 8.166 -0.211 25468
349 1 2 . 1 1 25 25 THR N N 25 116.759 116.759 116.087 0.672 25468
350 1 2 . 1 1 25 25 THR HA H 25 3.859 3.859 4.011 -0.152 25468
351 1 2 . 1 1 25 25 THR CA C 25 67.243 67.243 66.365 0.878 25468
352 1 2 . 1 1 25 25 THR CB C 25 68.752 68.752 68.609 0.143 25468
353 1 2 . 1 1 25 25 THR H H 25 8.518 8.518 8.608 -0.090 25468
354 1 2 . 1 1 26 26 CYS N N 26 121.616 121.616 120.654 0.962 25468
355 1 2 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.227 0.032 25468
356 1 2 . 1 1 26 26 CYS CA C 26 57.603 57.603 62.162 -4.559 25468
357 1 2 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.789 8.400 25468
358 1 2 . 1 1 26 26 CYS H H 26 8.062 8.062 7.726 0.336 25468
359 1 2 . 1 1 27 27 ILE N N 27 124.036 124.036 120.345 3.691 25468
360 1 2 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.135 0.019 25468
361 1 2 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.528 0.732 25468
362 1 2 . 1 1 27 27 ILE CB C 27 38.035 38.035 36.995 1.040 25468
363 1 2 . 1 1 27 27 ILE H H 27 8.313 8.313 8.437 -0.124 25468
364 1 2 . 1 1 28 28 GLU N N 28 121.780 121.780 120.663 1.117 25468
365 1 2 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.130 0.064 25468
366 1 2 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.824 -0.327 25468
367 1 2 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.241 -1.284 25468
368 1 2 . 1 1 28 28 GLU H H 28 8.312 8.312 7.857 0.455 25468
369 1 2 . 1 1 29 29 SER N N 29 114.001 114.001 113.818 0.183 25468
370 1 2 . 1 1 29 29 SER HA H 29 4.661 4.661 4.447 0.214 25468
371 1 2 . 1 1 29 29 SER CA C 29 58.377 58.377 59.486 -1.109 25468
372 1 2 . 1 1 29 29 SER CB C 29 63.484 63.484 63.287 0.197 25468
373 1 2 . 1 1 29 29 SER H H 29 7.459 7.459 7.714 -0.255 25468
374 1 2 . 1 1 30 30 ASN N N 30 112.213 112.213 116.860 -4.647 25468
375 1 2 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.322 0.105 25468
376 1 2 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.129 0.912 25468
377 1 2 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.993 -0.649 25468
378 1 2 . 1 1 30 30 ASN H H 30 8.067 8.067 7.639 0.428 25468
379 1 2 . 1 1 31 31 PHE N N 31 116.306 116.306 115.739 0.567 25468
380 1 2 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.627 -0.053 25468
381 1 2 . 1 1 31 31 PHE CA C 31 57.969 57.969 56.868 1.101 25468
382 1 2 . 1 1 31 31 PHE CB C 31 38.699 38.699 42.369 -3.670 25468
383 1 2 . 1 1 31 31 PHE H H 31 7.861 7.861 7.679 0.182 25468
384 1 2 . 1 1 32 32 ALA N N 32 121.103 121.103 123.405 -2.302 25468
385 1 2 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.340 -0.149 25468
386 1 2 . 1 1 32 32 ALA CA C 32 53.586 53.586 52.700 0.886 25468
387 1 2 . 1 1 32 32 ALA CB C 32 19.211 19.211 17.933 1.278 25468
388 1 2 . 1 1 32 32 ALA H H 32 8.403 8.403 9.144 -0.741 25468
389 1 2 . 1 1 33 33 GLY N N 33 100.820 100.820 105.771 -4.951 25468
390 1 2 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.401 0.469 25468
391 1 2 . 1 1 33 33 GLY H H 33 7.258 7.258 7.572 -0.314 25468
392 1 2 . 1 1 34 34 GLY N N 34 108.312 108.312 105.875 2.437 25468
393 1 2 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.410 2.027 25468
394 1 2 . 1 1 34 34 GLY H H 34 8.978 8.978 8.321 0.657 25468
395 1 2 . 1 1 35 35 LYS N N 35 119.929 119.929 115.806 4.123 25468
396 1 2 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.790 -0.196 25468
397 1 2 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.878 -0.223 25468
398 1 2 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.497 1.787 25468
399 1 2 . 1 1 35 35 LYS H H 35 8.756 8.756 8.338 0.418 25468
400 1 2 . 1 1 36 36 CYS N N 36 119.831 119.831 119.509 0.322 25468
401 1 2 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.603 -0.239 25468
402 1 2 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.512 -1.294 25468
403 1 2 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.658 17.492 25468
404 1 2 . 1 1 36 36 CYS H H 36 8.553 8.553 8.379 0.174 25468
405 1 2 . 1 1 37 37 VAL N N 37 120.392 120.392 122.476 -2.084 25468
406 1 2 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.967 -0.203 25468
407 1 2 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.412 0.835 25468
408 1 2 . 1 1 37 37 VAL H H 37 9.587 9.587 8.564 1.023 25468
409 1 2 . 1 1 38 38 HIS N N 38 118.311 118.311 119.114 -0.803 25468
410 1 2 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.406 -0.366 25468
411 1 2 . 1 1 38 38 HIS CA C 38 53.975 53.975 52.977 0.998 25468
412 1 2 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.392 -1.912 25468
413 1 2 . 1 1 38 38 HIS H H 38 8.698 8.698 7.677 1.021 25468
414 1 2 . 1 1 39 39 ILE N N 39 124.114 124.114 122.094 2.020 25468
415 1 2 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.185 0.117 25468
416 1 2 . 1 1 39 39 ILE CA C 39 59.840 59.840 59.553 0.287 25468
417 1 2 . 1 1 39 39 ILE CB C 39 38.709 38.709 37.643 1.066 25468
418 1 2 . 1 1 39 39 ILE H H 39 8.969 8.969 8.496 0.473 25468
419 1 2 . 1 1 40 40 GLY N N 40 115.080 115.080 117.953 -2.873 25468
420 1 2 . 1 1 40 40 GLY CA C 40 46.226 46.226 47.348 -1.122 25468
421 1 2 . 1 1 40 40 GLY H H 40 8.715 8.715 8.816 -0.101 25468
422 1 2 . 1 1 41 41 GLN N N 41 121.798 121.798 120.410 1.388 25468
423 1 2 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.556 -0.252 25468
424 1 2 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.290 0.360 25468
425 1 2 . 1 1 41 41 GLN CB C 41 28.480 28.480 28.924 -0.444 25468
426 1 2 . 1 1 41 41 GLN H H 41 8.672 8.672 8.199 0.473 25468
427 1 2 . 1 1 42 42 SER N N 42 114.462 114.462 117.366 -2.904 25468
428 1 2 . 1 1 42 42 SER HA H 42 4.347 4.347 4.485 -0.138 25468
429 1 2 . 1 1 42 42 SER CA C 42 58.072 58.072 58.647 -0.575 25468
430 1 2 . 1 1 42 42 SER CB C 42 64.037 64.037 63.404 0.633 25468
431 1 2 . 1 1 42 42 SER H H 42 7.725 7.725 8.761 -1.036 25468
432 1 2 . 1 1 43 43 LEU N N 43 124.166 124.166 113.769 10.397 25468
433 1 2 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.761 0.189 25468
434 1 2 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.469 -0.174 25468
435 1 2 . 1 1 43 43 LEU CB C 43 41.400 41.400 40.082 1.318 25468
436 1 2 . 1 1 43 43 LEU H H 43 8.576 8.576 7.702 0.874 25468
437 1 2 . 1 1 44 44 ASP N N 44 118.797 118.797 119.626 -0.829 25468
438 1 2 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.657 0.074 25468
439 1 2 . 1 1 44 44 ASP CB C 44 39.979 39.979 42.433 -2.454 25468
440 1 2 . 1 1 44 44 ASP H H 44 8.163 8.163 7.837 0.326 25468
441 1 2 . 1 1 45 45 PHE N N 45 123.595 123.595 124.325 -0.730 25468
442 1 2 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.066 -0.146 25468
443 1 2 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.236 0.371 25468
444 1 2 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.673 0.410 25468
445 1 2 . 1 1 45 45 PHE H H 45 9.042 9.042 8.722 0.320 25468
446 1 2 . 1 1 46 46 VAL N N 46 119.357 119.357 119.964 -0.607 25468
447 1 2 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.836 -0.143 25468
448 1 2 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.743 0.172 25468
449 1 2 . 1 1 46 46 VAL CB C 46 34.666 34.666 33.539 1.127 25468
450 1 2 . 1 1 46 46 VAL H H 46 9.555 9.555 8.759 0.796 25468
451 1 2 . 1 1 47 47 CYS N N 47 122.793 122.793 126.841 -4.048 25468
452 1 2 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.429 -0.599 25468
453 1 2 . 1 1 47 47 CYS CB C 47 38.730 38.730 27.064 11.666 25468
454 1 2 . 1 1 47 47 CYS H H 47 9.044 9.044 8.819 0.225 25468
455 1 2 . 1 1 48 48 VAL N N 48 129.864 129.864 128.655 1.209 25468
456 1 2 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.032 -0.499 25468
457 1 2 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.141 0.676 25468
458 1 2 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.404 -2.006 25468
459 1 2 . 1 1 48 48 VAL H H 48 8.616 8.616 8.175 0.441 25468
460 1 2 . 1 1 49 49 CYS N N 49 121.329 121.329 122.742 -1.413 25468
461 1 2 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.119 0.029 25468
462 1 2 . 1 1 49 49 CYS CA C 49 50.429 50.429 57.368 -6.939 25468
463 1 2 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.797 5.077 25468
464 1 2 . 1 1 49 49 CYS H H 49 8.652 8.652 7.933 0.719 25468
465 1 2 . 1 1 50 50 PHE N N 50 119.026 119.026 118.700 0.326 25468
466 1 2 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.010 -0.061 25468
467 1 2 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.447 -0.795 25468
468 1 2 . 1 1 50 50 PHE CB C 50 40.593 40.593 42.192 -1.599 25468
469 1 2 . 1 1 50 50 PHE H H 50 8.472 8.472 8.945 -0.473 25468
470 1 2 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.668 0.064 25468
471 1 2 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.971 0.238 25468
472 1 2 . 1 1 52 52 LYS N N 52 119.951 119.951 120.370 -0.419 25468
473 1 2 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.128 -0.169 25468
474 1 2 . 1 1 52 52 LYS CA C 52 57.670 57.670 58.463 -0.793 25468
475 1 2 . 1 1 52 52 LYS CB C 52 33.225 33.225 32.006 1.219 25468
476 1 2 . 1 1 52 52 LYS H H 52 8.681 8.681 8.583 0.098 25468
477 1 2 . 1 1 53 53 TYR N N 53 118.889 118.889 111.243 7.646 25468
478 1 2 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.733 -0.262 25468
479 1 2 . 1 1 53 53 TYR CA C 53 58.049 58.049 55.944 2.104 25468
480 1 2 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.840 0.428 25468
481 1 2 . 1 1 53 53 TYR H H 53 8.215 8.215 7.113 1.102 25468
482 1 2 . 1 1 54 54 TYR N N 54 121.087 121.087 125.199 -4.112 25468
483 1 2 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.556 -0.062 25468
484 1 2 . 1 1 54 54 TYR CA C 54 58.101 58.101 58.336 -0.235 25468
485 1 2 . 1 1 54 54 TYR CB C 54 39.611 39.611 37.331 2.280 25468
486 1 2 . 1 1 54 54 TYR H H 54 7.919 7.919 7.806 0.113 25468
487 1 3 . 1 1 2 2 ASP N N 2 123.544 123.544 121.966 1.578 25468
488 1 3 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.538 0.160 25468
489 1 3 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.193 -1.286 25468
490 1 3 . 1 1 2 2 ASP H H 2 8.843 8.843 8.400 0.443 25468
491 1 3 . 1 1 3 3 ILE N N 3 121.633 121.633 121.373 0.260 25468
492 1 3 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.031 0.127 25468
493 1 3 . 1 1 3 3 ILE CA C 3 61.110 61.110 61.020 0.090 25468
494 1 3 . 1 1 3 3 ILE CB C 3 39.038 39.038 38.118 0.920 25468
495 1 3 . 1 1 3 3 ILE H H 3 8.356 8.356 7.552 0.804 25468
496 1 3 . 1 1 4 4 ASP N N 4 124.028 124.028 127.229 -3.201 25468
497 1 3 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.378 0.249 25468
498 1 3 . 1 1 4 4 ASP CA C 4 53.776 53.776 54.381 -0.605 25468
499 1 3 . 1 1 4 4 ASP CB C 4 40.216 40.216 40.828 -0.612 25468
500 1 3 . 1 1 4 4 ASP H H 4 8.460 8.460 8.519 -0.059 25468
501 1 3 . 1 1 5 5 GLY N N 5 110.531 110.531 109.288 1.243 25468
502 1 3 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.570 0.144 25468
503 1 3 . 1 1 5 5 GLY H H 5 8.405 8.405 8.242 0.163 25468
504 1 3 . 1 1 6 6 ARG N N 6 119.193 119.193 117.831 1.362 25468
505 1 3 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.364 -0.017 25468
506 1 3 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.526 1.722 25468
507 1 3 . 1 1 6 6 ARG CB C 6 31.089 31.089 29.769 1.320 25468
508 1 3 . 1 1 6 6 ARG H H 6 8.128 8.128 8.168 -0.040 25468
509 1 3 . 1 1 7 7 LYS N N 7 120.971 120.971 119.256 1.715 25468
510 1 3 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.608 0.161 25468
511 1 3 . 1 1 7 7 LYS CB C 7 33.230 33.230 33.270 -0.040 25468
512 1 3 . 1 1 7 7 LYS H H 7 7.984 7.984 7.639 0.345 25468
513 1 3 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.083 0.455 25468
514 1 3 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.732 0.471 25468
515 1 3 . 1 1 8 8 PRO CB C 8 31.855 31.855 31.646 0.209 25468
516 1 3 . 1 1 9 9 LEU N N 9 123.948 123.948 124.374 -0.426 25468
517 1 3 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.394 0.093 25468
518 1 3 . 1 1 9 9 LEU CA C 9 53.511 53.511 52.861 0.651 25468
519 1 3 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.778 1.981 25468
520 1 3 . 1 1 9 9 LEU H H 9 7.801 7.801 7.401 0.400 25468
521 1 3 . 1 1 10 10 LEU N N 10 130.176 130.176 127.959 2.217 25468
522 1 3 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.782 -0.228 25468
523 1 3 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.491 0.980 25468
524 1 3 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.721 -1.619 25468
525 1 3 . 1 1 10 10 LEU H H 10 8.422 8.422 8.511 -0.089 25468
526 1 3 . 1 1 11 11 ILE N N 11 120.839 120.839 121.501 -0.662 25468
527 1 3 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.522 -0.136 25468
528 1 3 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.748 0.783 25468
529 1 3 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.619 0.738 25468
530 1 3 . 1 1 11 11 ILE H H 11 8.289 8.289 8.670 -0.381 25468
531 1 3 . 1 1 12 12 GLY N N 12 106.385 106.385 108.142 -1.757 25468
532 1 3 . 1 1 12 12 GLY CA C 12 44.743 44.743 46.282 -1.540 25468
533 1 3 . 1 1 12 12 GLY H H 12 7.125 7.125 7.579 -0.454 25468
534 1 3 . 1 1 13 13 THR N N 13 110.566 110.566 111.703 -1.137 25468
535 1 3 . 1 1 13 13 THR HA H 13 4.676 4.676 4.840 -0.164 25468
536 1 3 . 1 1 13 13 THR CA C 13 62.119 62.119 59.974 2.145 25468
537 1 3 . 1 1 13 13 THR CB C 13 71.115 71.115 71.837 -0.722 25468
538 1 3 . 1 1 13 13 THR H H 13 9.046 9.046 7.968 1.078 25468
539 1 3 . 1 1 14 14 CYS N N 14 117.216 117.216 122.977 -5.761 25468
540 1 3 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.699 0.201 25468
541 1 3 . 1 1 14 14 CYS CA C 14 58.201 58.201 60.274 -2.073 25468
542 1 3 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.933 18.698 25468
543 1 3 . 1 1 14 14 CYS H H 14 8.436 8.436 8.564 -0.128 25468
544 1 3 . 1 1 15 15 ILE N N 15 118.247 118.247 119.075 -0.828 25468
545 1 3 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.863 0.023 25468
546 1 3 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.756 -0.455 25468
547 1 3 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.271 -0.775 25468
548 1 3 . 1 1 15 15 ILE H H 15 7.244 7.244 8.062 -0.818 25468
549 1 3 . 1 1 16 16 GLU N N 16 119.649 119.649 119.228 0.421 25468
550 1 3 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.158 -0.325 25468
551 1 3 . 1 1 16 16 GLU CA C 16 57.902 57.902 56.918 0.984 25468
552 1 3 . 1 1 16 16 GLU CB C 16 28.781 28.781 30.681 -1.900 25468
553 1 3 . 1 1 16 16 GLU H H 16 7.066 7.066 7.778 -0.712 25468
554 1 3 . 1 1 17 17 PHE N N 17 114.996 114.996 120.451 -5.455 25468
555 1 3 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.987 -0.423 25468
556 1 3 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.486 -0.958 25468
557 1 3 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.192 0.698 25468
558 1 3 . 1 1 17 17 PHE H H 17 8.148 8.148 7.715 0.433 25468
559 1 3 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.560 0.293 25468
560 1 3 . 1 1 18 18 PRO CA C 18 62.917 62.917 63.047 -0.130 25468
561 1 3 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.427 -0.559 25468
562 1 3 . 1 1 19 19 THR N N 19 114.536 114.536 114.123 0.413 25468
563 1 3 . 1 1 19 19 THR HA H 19 3.650 3.650 3.880 -0.230 25468
564 1 3 . 1 1 19 19 THR CA C 19 68.731 68.731 67.024 1.707 25468
565 1 3 . 1 1 19 19 THR CB C 19 69.792 69.792 68.441 1.351 25468
566 1 3 . 1 1 19 19 THR H H 19 8.370 8.370 8.678 -0.308 25468
567 1 3 . 1 1 20 20 GLU N N 20 120.374 120.374 120.159 0.215 25468
568 1 3 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.042 0.151 25468
569 1 3 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.542 0.503 25468
570 1 3 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.731 -0.475 25468
571 1 3 . 1 1 20 20 GLU H H 20 9.038 9.038 8.936 0.102 25468
572 1 3 . 1 1 21 21 LYS N N 21 122.432 122.432 120.566 1.866 25468
573 1 3 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.112 0.053 25468
574 1 3 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.460 -0.250 25468
575 1 3 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.144 0.983 25468
576 1 3 . 1 1 21 21 LYS H H 21 7.622 7.622 7.929 -0.307 25468
577 1 3 . 1 1 22 22 CYS N N 22 121.466 121.466 120.189 1.277 25468
578 1 3 . 1 1 22 22 CYS HA H 22 4.085 4.085 3.987 0.098 25468
579 1 3 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.719 -3.950 25468
580 1 3 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.108 10.486 25468
581 1 3 . 1 1 22 22 CYS H H 22 9.356 9.356 8.888 0.468 25468
582 1 3 . 1 1 23 23 ASN N N 23 115.604 115.604 118.607 -3.003 25468
583 1 3 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.474 -0.429 25468
584 1 3 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.385 1.482 25468
585 1 3 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.713 1.591 25468
586 1 3 . 1 1 23 23 ASN H H 23 7.925 7.925 8.271 -0.346 25468
587 1 3 . 1 1 24 24 LYS N N 24 116.665 116.665 121.114 -4.449 25468
588 1 3 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.952 -0.040 25468
589 1 3 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.986 -0.077 25468
590 1 3 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.242 0.793 25468
591 1 3 . 1 1 24 24 LYS H H 24 7.955 7.955 8.191 -0.236 25468
592 1 3 . 1 1 25 25 THR N N 25 116.759 116.759 115.556 1.203 25468
593 1 3 . 1 1 25 25 THR HA H 25 3.859 3.859 4.093 -0.234 25468
594 1 3 . 1 1 25 25 THR CA C 25 67.243 67.243 66.275 0.968 25468
595 1 3 . 1 1 25 25 THR CB C 25 68.752 68.752 68.329 0.423 25468
596 1 3 . 1 1 25 25 THR H H 25 8.518 8.518 8.657 -0.139 25468
597 1 3 . 1 1 26 26 CYS N N 26 121.616 121.616 120.930 0.686 25468
598 1 3 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.238 0.021 25468
599 1 3 . 1 1 26 26 CYS CA C 26 57.603 57.603 62.041 -4.438 25468
600 1 3 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.873 8.316 25468
601 1 3 . 1 1 26 26 CYS H H 26 8.062 8.062 7.980 0.082 25468
602 1 3 . 1 1 27 27 ILE N N 27 124.036 124.036 120.331 3.705 25468
603 1 3 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.156 -0.002 25468
604 1 3 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.476 0.784 25468
605 1 3 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.000 1.035 25468
606 1 3 . 1 1 27 27 ILE H H 27 8.313 8.313 8.425 -0.112 25468
607 1 3 . 1 1 28 28 GLU N N 28 121.780 121.780 120.111 1.669 25468
608 1 3 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.075 0.119 25468
609 1 3 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.778 -0.281 25468
610 1 3 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.130 -1.173 25468
611 1 3 . 1 1 28 28 GLU H H 28 8.312 8.312 7.782 0.530 25468
612 1 3 . 1 1 29 29 SER N N 29 114.001 114.001 113.392 0.609 25468
613 1 3 . 1 1 29 29 SER HA H 29 4.661 4.661 4.425 0.236 25468
614 1 3 . 1 1 29 29 SER CA C 29 58.377 58.377 59.054 -0.677 25468
615 1 3 . 1 1 29 29 SER CB C 29 63.484 63.484 63.550 -0.066 25468
616 1 3 . 1 1 29 29 SER H H 29 7.459 7.459 7.678 -0.219 25468
617 1 3 . 1 1 30 30 ASN N N 30 112.213 112.213 116.915 -4.702 25468
618 1 3 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.397 0.030 25468
619 1 3 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.165 0.876 25468
620 1 3 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.899 -0.555 25468
621 1 3 . 1 1 30 30 ASN H H 30 8.067 8.067 7.670 0.397 25468
622 1 3 . 1 1 31 31 PHE N N 31 116.306 116.306 115.262 1.044 25468
623 1 3 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.657 -0.083 25468
624 1 3 . 1 1 31 31 PHE CA C 31 57.969 57.969 56.914 1.055 25468
625 1 3 . 1 1 31 31 PHE CB C 31 38.699 38.699 42.044 -3.345 25468
626 1 3 . 1 1 31 31 PHE H H 31 7.861 7.861 7.628 0.233 25468
627 1 3 . 1 1 32 32 ALA N N 32 121.103 121.103 125.219 -4.116 25468
628 1 3 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.340 -0.149 25468
629 1 3 . 1 1 32 32 ALA CA C 32 53.586 53.586 52.407 1.179 25468
630 1 3 . 1 1 32 32 ALA CB C 32 19.211 19.211 17.295 1.916 25468
631 1 3 . 1 1 32 32 ALA H H 32 8.403 8.403 9.175 -0.772 25468
632 1 3 . 1 1 33 33 GLY N N 33 100.820 100.820 106.815 -5.995 25468
633 1 3 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.437 0.433 25468
634 1 3 . 1 1 33 33 GLY H H 33 7.258 7.258 7.809 -0.551 25468
635 1 3 . 1 1 34 34 GLY N N 34 108.312 108.312 105.847 2.465 25468
636 1 3 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.494 1.943 25468
637 1 3 . 1 1 34 34 GLY H H 34 8.978 8.978 8.331 0.647 25468
638 1 3 . 1 1 35 35 LYS N N 35 119.929 119.929 117.620 2.309 25468
639 1 3 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.851 -0.257 25468
640 1 3 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.838 -0.183 25468
641 1 3 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.492 1.792 25468
642 1 3 . 1 1 35 35 LYS H H 35 8.756 8.756 8.591 0.165 25468
643 1 3 . 1 1 36 36 CYS N N 36 119.831 119.831 119.732 0.099 25468
644 1 3 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.568 -0.204 25468
645 1 3 . 1 1 36 36 CYS CA C 36 57.218 57.218 57.763 -0.545 25468
646 1 3 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.768 17.382 25468
647 1 3 . 1 1 36 36 CYS H H 36 8.553 8.553 8.637 -0.084 25468
648 1 3 . 1 1 37 37 VAL N N 37 120.392 120.392 119.714 0.678 25468
649 1 3 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.837 -0.073 25468
650 1 3 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.307 0.940 25468
651 1 3 . 1 1 37 37 VAL H H 37 9.587 9.587 8.851 0.736 25468
652 1 3 . 1 1 38 38 HIS N N 38 118.311 118.311 118.090 0.221 25468
653 1 3 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.530 -0.490 25468
654 1 3 . 1 1 38 38 HIS CA C 38 53.975 53.975 53.148 0.827 25468
655 1 3 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.642 -2.162 25468
656 1 3 . 1 1 38 38 HIS H H 38 8.698 8.698 7.462 1.236 25468
657 1 3 . 1 1 39 39 ILE N N 39 124.114 124.114 122.543 1.571 25468
658 1 3 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.288 0.014 25468
659 1 3 . 1 1 39 39 ILE CA C 39 59.840 59.840 60.614 -0.774 25468
660 1 3 . 1 1 39 39 ILE CB C 39 38.709 38.709 39.883 -1.174 25468
661 1 3 . 1 1 39 39 ILE H H 39 8.969 8.969 8.432 0.537 25468
662 1 3 . 1 1 40 40 GLY N N 40 115.080 115.080 115.457 -0.377 25468
663 1 3 . 1 1 40 40 GLY CA C 40 46.226 46.226 46.638 -0.412 25468
664 1 3 . 1 1 40 40 GLY H H 40 8.715 8.715 8.772 -0.057 25468
665 1 3 . 1 1 41 41 GLN N N 41 121.798 121.798 119.990 1.808 25468
666 1 3 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.541 -0.237 25468
667 1 3 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.937 -0.287 25468
668 1 3 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.069 -0.589 25468
669 1 3 . 1 1 41 41 GLN H H 41 8.672 8.672 8.374 0.298 25468
670 1 3 . 1 1 42 42 SER N N 42 114.462 114.462 117.244 -2.782 25468
671 1 3 . 1 1 42 42 SER HA H 42 4.347 4.347 4.347 -0.000 25468
672 1 3 . 1 1 42 42 SER CA C 42 58.072 58.072 60.124 -2.052 25468
673 1 3 . 1 1 42 42 SER CB C 42 64.037 64.037 63.540 0.497 25468
674 1 3 . 1 1 42 42 SER H H 42 7.725 7.725 8.579 -0.854 25468
675 1 3 . 1 1 43 43 LEU N N 43 124.166 124.166 119.993 4.173 25468
676 1 3 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.829 0.121 25468
677 1 3 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.644 -0.349 25468
678 1 3 . 1 1 43 43 LEU CB C 43 41.400 41.400 40.700 0.700 25468
679 1 3 . 1 1 43 43 LEU H H 43 8.576 8.576 7.970 0.606 25468
680 1 3 . 1 1 44 44 ASP N N 44 118.797 118.797 118.782 0.015 25468
681 1 3 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.675 0.056 25468
682 1 3 . 1 1 44 44 ASP CB C 44 39.979 39.979 42.500 -2.521 25468
683 1 3 . 1 1 44 44 ASP H H 44 8.163 8.163 7.945 0.218 25468
684 1 3 . 1 1 45 45 PHE N N 45 123.595 123.595 123.789 -0.194 25468
685 1 3 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.199 -0.279 25468
686 1 3 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.155 0.452 25468
687 1 3 . 1 1 45 45 PHE CB C 45 40.083 40.083 40.047 0.036 25468
688 1 3 . 1 1 45 45 PHE H H 45 9.042 9.042 8.854 0.188 25468
689 1 3 . 1 1 46 46 VAL N N 46 119.357 119.357 118.798 0.559 25468
690 1 3 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.713 -0.020 25468
691 1 3 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.365 0.550 25468
692 1 3 . 1 1 46 46 VAL CB C 46 34.666 34.666 33.769 0.897 25468
693 1 3 . 1 1 46 46 VAL H H 46 9.555 9.555 8.822 0.733 25468
694 1 3 . 1 1 47 47 CYS N N 47 122.793 122.793 125.222 -2.429 25468
695 1 3 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.424 -0.594 25468
696 1 3 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.735 11.995 25468
697 1 3 . 1 1 47 47 CYS H H 47 9.044 9.044 8.395 0.649 25468
698 1 3 . 1 1 48 48 VAL N N 48 129.864 129.864 126.032 3.832 25468
699 1 3 . 1 1 48 48 VAL HA H 48 4.533 4.533 4.993 -0.460 25468
700 1 3 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.293 0.524 25468
701 1 3 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.042 -1.644 25468
702 1 3 . 1 1 48 48 VAL H H 48 8.616 8.616 8.329 0.287 25468
703 1 3 . 1 1 49 49 CYS N N 49 121.329 121.329 122.099 -0.770 25468
704 1 3 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.280 -0.132 25468
705 1 3 . 1 1 49 49 CYS CA C 49 50.429 50.429 57.390 -6.961 25468
706 1 3 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.606 5.267 25468
707 1 3 . 1 1 49 49 CYS H H 49 8.652 8.652 8.455 0.197 25468
708 1 3 . 1 1 50 50 PHE N N 50 119.026 119.026 118.720 0.306 25468
709 1 3 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.059 -0.110 25468
710 1 3 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.456 -0.804 25468
711 1 3 . 1 1 50 50 PHE CB C 50 40.593 40.593 42.165 -1.572 25468
712 1 3 . 1 1 50 50 PHE H H 50 8.472 8.472 8.994 -0.522 25468
713 1 3 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.722 0.010 25468
714 1 3 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.882 0.327 25468
715 1 3 . 1 1 52 52 LYS N N 52 119.951 119.951 121.008 -1.057 25468
716 1 3 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.181 -0.222 25468
717 1 3 . 1 1 52 52 LYS CA C 52 57.670 57.670 58.572 -0.902 25468
718 1 3 . 1 1 52 52 LYS CB C 52 33.225 33.225 32.730 0.495 25468
719 1 3 . 1 1 52 52 LYS H H 52 8.681 8.681 8.632 0.049 25468
720 1 3 . 1 1 53 53 TYR N N 53 118.889 118.889 112.236 6.653 25468
721 1 3 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.725 -0.254 25468
722 1 3 . 1 1 53 53 TYR CA C 53 58.049 58.049 56.113 1.936 25468
723 1 3 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.836 0.432 25468
724 1 3 . 1 1 53 53 TYR H H 53 8.215 8.215 7.716 0.499 25468
725 1 3 . 1 1 54 54 TYR N N 54 121.087 121.087 124.037 -2.950 25468
726 1 3 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.287 0.207 25468
727 1 3 . 1 1 54 54 TYR CA C 54 58.101 58.101 58.373 -0.272 25468
728 1 3 . 1 1 54 54 TYR CB C 54 39.611 39.611 38.346 1.265 25468
729 1 3 . 1 1 54 54 TYR H H 54 7.919 7.919 7.750 0.169 25468
730 1 4 . 1 1 2 2 ASP N N 2 123.544 123.544 122.506 1.038 25468
731 1 4 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.777 -0.079 25468
732 1 4 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.255 -1.348 25468
733 1 4 . 1 1 2 2 ASP H H 2 8.843 8.843 8.397 0.446 25468
734 1 4 . 1 1 3 3 ILE N N 3 121.633 121.633 121.974 -0.341 25468
735 1 4 . 1 1 3 3 ILE HA H 3 4.158 4.158 3.889 0.269 25468
736 1 4 . 1 1 3 3 ILE CA C 3 61.110 61.110 61.535 -0.425 25468
737 1 4 . 1 1 3 3 ILE CB C 3 39.038 39.038 39.339 -0.301 25468
738 1 4 . 1 1 3 3 ILE H H 3 8.356 8.356 7.560 0.796 25468
739 1 4 . 1 1 4 4 ASP N N 4 124.028 124.028 125.012 -0.984 25468
740 1 4 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.523 0.104 25468
741 1 4 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.890 -2.114 25468
742 1 4 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.003 -0.787 25468
743 1 4 . 1 1 4 4 ASP H H 4 8.460 8.460 8.564 -0.104 25468
744 1 4 . 1 1 5 5 GLY N N 5 110.531 110.531 107.117 3.414 25468
745 1 4 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.038 0.676 25468
746 1 4 . 1 1 5 5 GLY H H 5 8.405 8.405 8.335 0.070 25468
747 1 4 . 1 1 6 6 ARG N N 6 119.193 119.193 121.098 -1.905 25468
748 1 4 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.486 -0.139 25468
749 1 4 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.923 1.324 25468
750 1 4 . 1 1 6 6 ARG CB C 6 31.089 31.089 31.045 0.044 25468
751 1 4 . 1 1 6 6 ARG H H 6 8.128 8.128 7.973 0.155 25468
752 1 4 . 1 1 7 7 LYS N N 7 120.971 120.971 121.178 -0.207 25468
753 1 4 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.591 0.178 25468
754 1 4 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.542 0.688 25468
755 1 4 . 1 1 7 7 LYS H H 7 7.984 7.984 7.868 0.116 25468
756 1 4 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.272 0.266 25468
757 1 4 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.037 1.166 25468
758 1 4 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.318 -0.463 25468
759 1 4 . 1 1 9 9 LEU N N 9 123.948 123.948 122.181 1.767 25468
760 1 4 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.437 0.050 25468
761 1 4 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.312 0.199 25468
762 1 4 . 1 1 9 9 LEU CB C 9 46.759 46.759 43.990 2.769 25468
763 1 4 . 1 1 9 9 LEU H H 9 7.801 7.801 7.690 0.111 25468
764 1 4 . 1 1 10 10 LEU N N 10 130.176 130.176 128.214 1.962 25468
765 1 4 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.940 -0.386 25468
766 1 4 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.436 1.035 25468
767 1 4 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.159 -1.056 25468
768 1 4 . 1 1 10 10 LEU H H 10 8.422 8.422 8.550 -0.128 25468
769 1 4 . 1 1 11 11 ILE N N 11 120.839 120.839 121.974 -1.135 25468
770 1 4 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.551 -0.165 25468
771 1 4 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.984 0.546 25468
772 1 4 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.798 0.559 25468
773 1 4 . 1 1 11 11 ILE H H 11 8.289 8.289 8.534 -0.245 25468
774 1 4 . 1 1 12 12 GLY N N 12 106.385 106.385 106.770 -0.385 25468
775 1 4 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.312 -0.569 25468
776 1 4 . 1 1 12 12 GLY H H 12 7.125 7.125 7.645 -0.520 25468
777 1 4 . 1 1 13 13 THR N N 13 110.566 110.566 114.780 -4.214 25468
778 1 4 . 1 1 13 13 THR HA H 13 4.676 4.676 4.565 0.111 25468
779 1 4 . 1 1 13 13 THR CA C 13 62.119 62.119 62.922 -0.803 25468
780 1 4 . 1 1 13 13 THR CB C 13 71.115 71.115 70.588 0.527 25468
781 1 4 . 1 1 13 13 THR H H 13 9.046 9.046 8.150 0.896 25468
782 1 4 . 1 1 14 14 CYS N N 14 117.216 117.216 122.427 -5.211 25468
783 1 4 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.708 0.192 25468
784 1 4 . 1 1 14 14 CYS CA C 14 58.201 58.201 60.297 -2.096 25468
785 1 4 . 1 1 14 14 CYS CB C 14 44.631 44.631 26.001 18.630 25468
786 1 4 . 1 1 14 14 CYS H H 14 8.436 8.436 8.352 0.084 25468
787 1 4 . 1 1 15 15 ILE N N 15 118.247 118.247 119.915 -1.668 25468
788 1 4 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.910 -0.024 25468
789 1 4 . 1 1 15 15 ILE CA C 15 63.301 63.301 64.016 -0.715 25468
790 1 4 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.238 -0.742 25468
791 1 4 . 1 1 15 15 ILE H H 15 7.244 7.244 8.034 -0.790 25468
792 1 4 . 1 1 16 16 GLU N N 16 119.649 119.649 118.167 1.482 25468
793 1 4 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.036 -0.203 25468
794 1 4 . 1 1 16 16 GLU CA C 16 57.902 57.902 56.874 1.028 25468
795 1 4 . 1 1 16 16 GLU CB C 16 28.781 28.781 30.053 -1.272 25468
796 1 4 . 1 1 16 16 GLU H H 16 7.066 7.066 7.664 -0.598 25468
797 1 4 . 1 1 17 17 PHE N N 17 114.996 114.996 118.605 -3.609 25468
798 1 4 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.991 -0.427 25468
799 1 4 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.255 -0.727 25468
800 1 4 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.687 0.203 25468
801 1 4 . 1 1 17 17 PHE H H 17 8.148 8.148 7.631 0.517 25468
802 1 4 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.860 -0.007 25468
803 1 4 . 1 1 18 18 PRO CA C 18 62.917 62.917 62.518 0.399 25468
804 1 4 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.748 -0.880 25468
805 1 4 . 1 1 19 19 THR N N 19 114.536 114.536 113.277 1.259 25468
806 1 4 . 1 1 19 19 THR HA H 19 3.650 3.650 3.846 -0.196 25468
807 1 4 . 1 1 19 19 THR CA C 19 68.731 68.731 67.245 1.486 25468
808 1 4 . 1 1 19 19 THR CB C 19 69.792 69.792 67.819 1.973 25468
809 1 4 . 1 1 19 19 THR H H 19 8.370 8.370 8.706 -0.336 25468
810 1 4 . 1 1 20 20 GLU N N 20 120.374 120.374 120.782 -0.408 25468
811 1 4 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.066 0.127 25468
812 1 4 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.871 0.174 25468
813 1 4 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.374 -0.118 25468
814 1 4 . 1 1 20 20 GLU H H 20 9.038 9.038 9.042 -0.004 25468
815 1 4 . 1 1 21 21 LYS N N 21 122.432 122.432 120.921 1.511 25468
816 1 4 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.089 0.076 25468
817 1 4 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.573 -0.363 25468
818 1 4 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.120 1.008 25468
819 1 4 . 1 1 21 21 LYS H H 21 7.622 7.622 8.175 -0.553 25468
820 1 4 . 1 1 22 22 CYS N N 22 121.466 121.466 120.905 0.561 25468
821 1 4 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.079 0.006 25468
822 1 4 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.028 -3.259 25468
823 1 4 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.006 10.588 25468
824 1 4 . 1 1 22 22 CYS H H 22 9.356 9.356 8.906 0.450 25468
825 1 4 . 1 1 23 23 ASN N N 23 115.604 115.604 119.115 -3.511 25468
826 1 4 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.443 -0.398 25468
827 1 4 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.625 1.242 25468
828 1 4 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.770 1.534 25468
829 1 4 . 1 1 23 23 ASN H H 23 7.925 7.925 8.299 -0.374 25468
830 1 4 . 1 1 24 24 LYS N N 24 116.665 116.665 121.378 -4.713 25468
831 1 4 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.955 -0.043 25468
832 1 4 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.784 0.125 25468
833 1 4 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.378 0.657 25468
834 1 4 . 1 1 24 24 LYS H H 24 7.955 7.955 8.100 -0.145 25468
835 1 4 . 1 1 25 25 THR N N 25 116.759 116.759 115.863 0.896 25468
836 1 4 . 1 1 25 25 THR HA H 25 3.859 3.859 4.272 -0.413 25468
837 1 4 . 1 1 25 25 THR CA C 25 67.243 67.243 66.990 0.253 25468
838 1 4 . 1 1 25 25 THR CB C 25 68.752 68.752 68.372 0.380 25468
839 1 4 . 1 1 25 25 THR H H 25 8.518 8.518 8.572 -0.054 25468
840 1 4 . 1 1 26 26 CYS N N 26 121.616 121.616 120.764 0.852 25468
841 1 4 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.236 0.023 25468
842 1 4 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.958 -4.355 25468
843 1 4 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.808 8.381 25468
844 1 4 . 1 1 26 26 CYS H H 26 8.062 8.062 7.633 0.429 25468
845 1 4 . 1 1 27 27 ILE N N 27 124.036 124.036 120.833 3.203 25468
846 1 4 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.083 0.071 25468
847 1 4 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.758 0.502 25468
848 1 4 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.216 0.819 25468
849 1 4 . 1 1 27 27 ILE H H 27 8.313 8.313 8.464 -0.151 25468
850 1 4 . 1 1 28 28 GLU N N 28 121.780 121.780 119.139 2.641 25468
851 1 4 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.148 0.046 25468
852 1 4 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.484 0.013 25468
853 1 4 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.284 -1.327 25468
854 1 4 . 1 1 28 28 GLU H H 28 8.312 8.312 7.849 0.463 25468
855 1 4 . 1 1 29 29 SER N N 29 114.001 114.001 114.205 -0.204 25468
856 1 4 . 1 1 29 29 SER HA H 29 4.661 4.661 4.530 0.131 25468
857 1 4 . 1 1 29 29 SER CA C 29 58.377 58.377 59.327 -0.950 25468
858 1 4 . 1 1 29 29 SER CB C 29 63.484 63.484 63.720 -0.236 25468
859 1 4 . 1 1 29 29 SER H H 29 7.459 7.459 7.762 -0.303 25468
860 1 4 . 1 1 30 30 ASN N N 30 112.213 112.213 115.613 -3.400 25468
861 1 4 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.297 0.130 25468
862 1 4 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.499 0.542 25468
863 1 4 . 1 1 30 30 ASN CB C 30 36.344 36.344 35.887 0.457 25468
864 1 4 . 1 1 30 30 ASN H H 30 8.067 8.067 7.887 0.180 25468
865 1 4 . 1 1 31 31 PHE N N 31 116.306 116.306 116.158 0.148 25468
866 1 4 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.671 -0.097 25468
867 1 4 . 1 1 31 31 PHE CA C 31 57.969 57.969 57.098 0.871 25468
868 1 4 . 1 1 31 31 PHE CB C 31 38.699 38.699 42.306 -3.607 25468
869 1 4 . 1 1 31 31 PHE H H 31 7.861 7.861 7.707 0.154 25468
870 1 4 . 1 1 32 32 ALA N N 32 121.103 121.103 125.226 -4.123 25468
871 1 4 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.298 -0.107 25468
872 1 4 . 1 1 32 32 ALA CA C 32 53.586 53.586 52.333 1.253 25468
873 1 4 . 1 1 32 32 ALA CB C 32 19.211 19.211 17.168 2.043 25468
874 1 4 . 1 1 32 32 ALA H H 32 8.403 8.403 9.088 -0.685 25468
875 1 4 . 1 1 33 33 GLY N N 33 100.820 100.820 106.951 -6.131 25468
876 1 4 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.430 0.440 25468
877 1 4 . 1 1 33 33 GLY H H 33 7.258 7.258 7.838 -0.580 25468
878 1 4 . 1 1 34 34 GLY N N 34 108.312 108.312 105.974 2.338 25468
879 1 4 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.437 2.001 25468
880 1 4 . 1 1 34 34 GLY H H 34 8.978 8.978 8.353 0.625 25468
881 1 4 . 1 1 35 35 LYS N N 35 119.929 119.929 117.079 2.850 25468
882 1 4 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.853 -0.259 25468
883 1 4 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.906 -0.251 25468
884 1 4 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.413 1.871 25468
885 1 4 . 1 1 35 35 LYS H H 35 8.756 8.756 8.402 0.354 25468
886 1 4 . 1 1 36 36 CYS N N 36 119.831 119.831 120.513 -0.682 25468
887 1 4 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.729 -0.365 25468
888 1 4 . 1 1 36 36 CYS CA C 36 57.218 57.218 57.913 -0.695 25468
889 1 4 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.716 17.434 25468
890 1 4 . 1 1 36 36 CYS H H 36 8.553 8.553 8.598 -0.045 25468
891 1 4 . 1 1 37 37 VAL N N 37 120.392 120.392 121.283 -0.891 25468
892 1 4 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.874 -0.110 25468
893 1 4 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.252 0.995 25468
894 1 4 . 1 1 37 37 VAL H H 37 9.587 9.587 8.714 0.873 25468
895 1 4 . 1 1 38 38 HIS N N 38 118.311 118.311 117.732 0.579 25468
896 1 4 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.404 -0.364 25468
897 1 4 . 1 1 38 38 HIS CA C 38 53.975 53.975 53.580 0.395 25468
898 1 4 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.023 -1.543 25468
899 1 4 . 1 1 38 38 HIS H H 38 8.698 8.698 7.558 1.140 25468
900 1 4 . 1 1 39 39 ILE N N 39 124.114 124.114 121.545 2.569 25468
901 1 4 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.139 0.163 25468
902 1 4 . 1 1 39 39 ILE CA C 39 59.840 59.840 59.452 0.388 25468
903 1 4 . 1 1 39 39 ILE CB C 39 38.709 38.709 37.448 1.261 25468
904 1 4 . 1 1 39 39 ILE H H 39 8.969 8.969 8.264 0.705 25468
905 1 4 . 1 1 40 40 GLY N N 40 115.080 115.080 115.811 -0.731 25468
906 1 4 . 1 1 40 40 GLY CA C 40 46.226 46.226 46.136 0.090 25468
907 1 4 . 1 1 40 40 GLY H H 40 8.715 8.715 9.010 -0.295 25468
908 1 4 . 1 1 41 41 GLN N N 41 121.798 121.798 116.026 5.772 25468
909 1 4 . 1 1 41 41 GLN HA H 41 4.304 4.304 3.858 0.446 25468
910 1 4 . 1 1 41 41 GLN CA C 41 55.650 55.650 56.590 -0.940 25468
911 1 4 . 1 1 41 41 GLN CB C 41 28.480 28.480 27.493 0.987 25468
912 1 4 . 1 1 41 41 GLN H H 41 8.672 8.672 8.444 0.228 25468
913 1 4 . 1 1 42 42 SER N N 42 114.462 114.462 114.906 -0.444 25468
914 1 4 . 1 1 42 42 SER HA H 42 4.347 4.347 4.375 -0.028 25468
915 1 4 . 1 1 42 42 SER CA C 42 58.072 58.072 59.840 -1.768 25468
916 1 4 . 1 1 42 42 SER CB C 42 64.037 64.037 63.804 0.233 25468
917 1 4 . 1 1 42 42 SER H H 42 7.725 7.725 8.652 -0.927 25468
918 1 4 . 1 1 43 43 LEU N N 43 124.166 124.166 119.483 4.683 25468
919 1 4 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.828 0.122 25468
920 1 4 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.335 -0.040 25468
921 1 4 . 1 1 43 43 LEU CB C 43 41.400 41.400 40.719 0.681 25468
922 1 4 . 1 1 43 43 LEU H H 43 8.576 8.576 7.814 0.762 25468
923 1 4 . 1 1 44 44 ASP N N 44 118.797 118.797 119.158 -0.361 25468
924 1 4 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.680 0.051 25468
925 1 4 . 1 1 44 44 ASP CB C 44 39.979 39.979 42.218 -2.239 25468
926 1 4 . 1 1 44 44 ASP H H 44 8.163 8.163 7.852 0.311 25468
927 1 4 . 1 1 45 45 PHE N N 45 123.595 123.595 123.967 -0.372 25468
928 1 4 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.168 -0.248 25468
929 1 4 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.286 0.320 25468
930 1 4 . 1 1 45 45 PHE CB C 45 40.083 40.083 40.117 -0.034 25468
931 1 4 . 1 1 45 45 PHE H H 45 9.042 9.042 8.754 0.288 25468
932 1 4 . 1 1 46 46 VAL N N 46 119.357 119.357 118.826 0.531 25468
933 1 4 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.692 0.001 25468
934 1 4 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.958 -0.043 25468
935 1 4 . 1 1 46 46 VAL CB C 46 34.666 34.666 35.528 -0.862 25468
936 1 4 . 1 1 46 46 VAL H H 46 9.555 9.555 8.611 0.944 25468
937 1 4 . 1 1 47 47 CYS N N 47 122.793 122.793 123.587 -0.794 25468
938 1 4 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.442 -0.612 25468
939 1 4 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.651 12.079 25468
940 1 4 . 1 1 47 47 CYS H H 47 9.044 9.044 8.573 0.471 25468
941 1 4 . 1 1 48 48 VAL N N 48 129.864 129.864 128.391 1.473 25468
942 1 4 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.027 -0.494 25468
943 1 4 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.419 0.398 25468
944 1 4 . 1 1 48 48 VAL CB C 48 34.398 34.398 35.786 -1.388 25468
945 1 4 . 1 1 48 48 VAL H H 48 8.616 8.616 8.215 0.401 25468
946 1 4 . 1 1 49 49 CYS N N 49 121.329 121.329 124.053 -2.724 25468
947 1 4 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.251 -0.103 25468
948 1 4 . 1 1 49 49 CYS CA C 49 50.429 50.429 57.309 -6.880 25468
949 1 4 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.607 5.266 25468
950 1 4 . 1 1 49 49 CYS H H 49 8.652 8.652 8.413 0.239 25468
951 1 4 . 1 1 50 50 PHE N N 50 119.026 119.026 119.083 -0.057 25468
952 1 4 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.028 -0.079 25468
953 1 4 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.239 -0.587 25468
954 1 4 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.816 -1.222 25468
955 1 4 . 1 1 50 50 PHE H H 50 8.472 8.472 9.050 -0.578 25468
956 1 4 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.703 0.029 25468
957 1 4 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.502 0.707 25468
958 1 4 . 1 1 52 52 LYS N N 52 119.951 119.951 123.763 -3.812 25468
959 1 4 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.187 -0.228 25468
960 1 4 . 1 1 52 52 LYS CA C 52 57.670 57.670 58.360 -0.690 25468
961 1 4 . 1 1 52 52 LYS CB C 52 33.225 33.225 33.056 0.169 25468
962 1 4 . 1 1 52 52 LYS H H 52 8.681 8.681 8.851 -0.170 25468
963 1 4 . 1 1 53 53 TYR N N 53 118.889 118.889 116.029 2.860 25468
964 1 4 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.805 -0.334 25468
965 1 4 . 1 1 53 53 TYR CA C 53 58.049 58.049 56.825 1.224 25468
966 1 4 . 1 1 53 53 TYR CB C 53 38.268 38.268 38.499 -0.231 25468
967 1 4 . 1 1 53 53 TYR H H 53 8.215 8.215 8.090 0.125 25468
968 1 4 . 1 1 54 54 TYR N N 54 121.087 121.087 122.745 -1.658 25468
969 1 4 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.445 0.049 25468
970 1 4 . 1 1 54 54 TYR CA C 54 58.101 58.101 58.777 -0.676 25468
971 1 4 . 1 1 54 54 TYR CB C 54 39.611 39.611 38.526 1.085 25468
972 1 4 . 1 1 54 54 TYR H H 54 7.919 7.919 7.769 0.150 25468
973 1 5 . 1 1 2 2 ASP N N 2 123.544 123.544 122.002 1.542 25468
974 1 5 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.536 0.162 25468
975 1 5 . 1 1 2 2 ASP CB C 2 39.907 39.907 40.347 -0.440 25468
976 1 5 . 1 1 2 2 ASP H H 2 8.843 8.843 8.786 0.057 25468
977 1 5 . 1 1 3 3 ILE N N 3 121.633 121.633 113.689 7.944 25468
978 1 5 . 1 1 3 3 ILE HA H 3 4.158 4.158 3.935 0.223 25468
979 1 5 . 1 1 3 3 ILE CA C 3 61.110 61.110 62.422 -1.312 25468
980 1 5 . 1 1 3 3 ILE CB C 3 39.038 39.038 37.253 1.785 25468
981 1 5 . 1 1 3 3 ILE H H 3 8.356 8.356 7.698 0.658 25468
982 1 5 . 1 1 4 4 ASP N N 4 124.028 124.028 121.407 2.621 25468
983 1 5 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.410 0.217 25468
984 1 5 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.347 -1.571 25468
985 1 5 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.078 -0.862 25468
986 1 5 . 1 1 4 4 ASP H H 4 8.460 8.460 7.636 0.824 25468
987 1 5 . 1 1 5 5 GLY N N 5 110.531 110.531 108.858 1.673 25468
988 1 5 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.640 0.074 25468
989 1 5 . 1 1 5 5 GLY H H 5 8.405 8.405 7.881 0.524 25468
990 1 5 . 1 1 6 6 ARG N N 6 119.193 119.193 119.077 0.116 25468
991 1 5 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.412 -0.065 25468
992 1 5 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.113 2.134 25468
993 1 5 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.738 0.351 25468
994 1 5 . 1 1 6 6 ARG H H 6 8.128 8.128 8.122 0.006 25468
995 1 5 . 1 1 7 7 LYS N N 7 120.971 120.971 121.052 -0.081 25468
996 1 5 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.499 0.270 25468
997 1 5 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.496 0.734 25468
998 1 5 . 1 1 7 7 LYS H H 7 7.984 7.984 7.772 0.212 25468
999 1 5 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.384 0.154 25468
1000 1 5 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.054 1.149 25468
1001 1 5 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.323 -0.468 25468
1002 1 5 . 1 1 9 9 LEU N N 9 123.948 123.948 122.536 1.412 25468
1003 1 5 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.526 -0.039 25468
1004 1 5 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.593 -0.082 25468
1005 1 5 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.372 2.387 25468
1006 1 5 . 1 1 9 9 LEU H H 9 7.801 7.801 7.995 -0.194 25468
1007 1 5 . 1 1 10 10 LEU N N 10 130.176 130.176 128.307 1.869 25468
1008 1 5 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.886 -0.332 25468
1009 1 5 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.522 0.950 25468
1010 1 5 . 1 1 10 10 LEU CB C 10 42.103 42.103 42.884 -0.781 25468
1011 1 5 . 1 1 10 10 LEU H H 10 8.422 8.422 8.565 -0.143 25468
1012 1 5 . 1 1 11 11 ILE N N 11 120.839 120.839 122.038 -1.199 25468
1013 1 5 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.413 -0.027 25468
1014 1 5 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.843 0.688 25468
1015 1 5 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.632 0.725 25468
1016 1 5 . 1 1 11 11 ILE H H 11 8.289 8.289 8.672 -0.383 25468
1017 1 5 . 1 1 12 12 GLY N N 12 106.385 106.385 106.726 -0.341 25468
1018 1 5 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.557 -0.814 25468
1019 1 5 . 1 1 12 12 GLY H H 12 7.125 7.125 7.377 -0.252 25468
1020 1 5 . 1 1 13 13 THR N N 13 110.566 110.566 110.993 -0.427 25468
1021 1 5 . 1 1 13 13 THR HA H 13 4.676 4.676 4.956 -0.280 25468
1022 1 5 . 1 1 13 13 THR CA C 13 62.119 62.119 60.192 1.927 25468
1023 1 5 . 1 1 13 13 THR CB C 13 71.115 71.115 71.451 -0.337 25468
1024 1 5 . 1 1 13 13 THR H H 13 9.046 9.046 8.209 0.837 25468
1025 1 5 . 1 1 14 14 CYS N N 14 117.216 117.216 122.295 -5.079 25468
1026 1 5 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.565 0.335 25468
1027 1 5 . 1 1 14 14 CYS CA C 14 58.201 58.201 61.889 -3.688 25468
1028 1 5 . 1 1 14 14 CYS CB C 14 44.631 44.631 26.103 18.528 25468
1029 1 5 . 1 1 14 14 CYS H H 14 8.436 8.436 8.649 -0.213 25468
1030 1 5 . 1 1 15 15 ILE N N 15 118.247 118.247 118.945 -0.698 25468
1031 1 5 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.770 0.116 25468
1032 1 5 . 1 1 15 15 ILE CA C 15 63.301 63.301 64.399 -1.098 25468
1033 1 5 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.038 -0.542 25468
1034 1 5 . 1 1 15 15 ILE H H 15 7.244 7.244 8.218 -0.974 25468
1035 1 5 . 1 1 16 16 GLU N N 16 119.649 119.649 118.873 0.776 25468
1036 1 5 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.345 -0.512 25468
1037 1 5 . 1 1 16 16 GLU CA C 16 57.902 57.902 57.493 0.409 25468
1038 1 5 . 1 1 16 16 GLU CB C 16 28.781 28.781 31.184 -2.403 25468
1039 1 5 . 1 1 16 16 GLU H H 16 7.066 7.066 8.008 -0.942 25468
1040 1 5 . 1 1 17 17 PHE N N 17 114.996 114.996 121.366 -6.370 25468
1041 1 5 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.985 -0.421 25468
1042 1 5 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.748 -1.220 25468
1043 1 5 . 1 1 17 17 PHE CB C 17 39.890 39.890 38.994 0.896 25468
1044 1 5 . 1 1 17 17 PHE H H 17 8.148 8.148 8.477 -0.329 25468
1045 1 5 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.591 0.262 25468
1046 1 5 . 1 1 18 18 PRO CA C 18 62.917 62.917 63.132 -0.214 25468
1047 1 5 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.465 -0.597 25468
1048 1 5 . 1 1 19 19 THR N N 19 114.536 114.536 114.462 0.074 25468
1049 1 5 . 1 1 19 19 THR HA H 19 3.650 3.650 3.933 -0.283 25468
1050 1 5 . 1 1 19 19 THR CA C 19 68.731 68.731 68.150 0.582 25468
1051 1 5 . 1 1 19 19 THR CB C 19 69.792 69.792 68.809 0.983 25468
1052 1 5 . 1 1 19 19 THR H H 19 8.370 8.370 8.615 -0.245 25468
1053 1 5 . 1 1 20 20 GLU N N 20 120.374 120.374 120.936 -0.562 25468
1054 1 5 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.245 -0.052 25468
1055 1 5 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.528 0.517 25468
1056 1 5 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.859 -0.603 25468
1057 1 5 . 1 1 20 20 GLU H H 20 9.038 9.038 8.741 0.297 25468
1058 1 5 . 1 1 21 21 LYS N N 21 122.432 122.432 120.009 2.423 25468
1059 1 5 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.089 0.076 25468
1060 1 5 . 1 1 21 21 LYS CA C 21 59.210 59.210 58.810 0.400 25468
1061 1 5 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.243 0.884 25468
1062 1 5 . 1 1 21 21 LYS H H 21 7.622 7.622 8.048 -0.426 25468
1063 1 5 . 1 1 22 22 CYS N N 22 121.466 121.466 120.085 1.381 25468
1064 1 5 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.323 -0.238 25468
1065 1 5 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.245 -3.476 25468
1066 1 5 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.062 10.532 25468
1067 1 5 . 1 1 22 22 CYS H H 22 9.356 9.356 8.629 0.727 25468
1068 1 5 . 1 1 23 23 ASN N N 23 115.604 115.604 118.724 -3.120 25468
1069 1 5 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.518 -0.473 25468
1070 1 5 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.450 1.417 25468
1071 1 5 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.804 1.500 25468
1072 1 5 . 1 1 23 23 ASN H H 23 7.925 7.925 8.080 -0.155 25468
1073 1 5 . 1 1 24 24 LYS N N 24 116.665 116.665 121.473 -4.808 25468
1074 1 5 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.983 -0.071 25468
1075 1 5 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.826 0.083 25468
1076 1 5 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.321 0.714 25468
1077 1 5 . 1 1 24 24 LYS H H 24 7.955 7.955 8.255 -0.300 25468
1078 1 5 . 1 1 25 25 THR N N 25 116.759 116.759 115.789 0.970 25468
1079 1 5 . 1 1 25 25 THR HA H 25 3.859 3.859 4.129 -0.270 25468
1080 1 5 . 1 1 25 25 THR CA C 25 67.243 67.243 66.894 0.349 25468
1081 1 5 . 1 1 25 25 THR CB C 25 68.752 68.752 68.574 0.178 25468
1082 1 5 . 1 1 25 25 THR H H 25 8.518 8.518 8.715 -0.197 25468
1083 1 5 . 1 1 26 26 CYS N N 26 121.616 121.616 121.109 0.507 25468
1084 1 5 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.161 0.098 25468
1085 1 5 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.454 -3.851 25468
1086 1 5 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.893 8.296 25468
1087 1 5 . 1 1 26 26 CYS H H 26 8.062 8.062 7.639 0.423 25468
1088 1 5 . 1 1 27 27 ILE N N 27 124.036 124.036 120.589 3.447 25468
1089 1 5 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.135 0.019 25468
1090 1 5 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.804 0.456 25468
1091 1 5 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.077 0.958 25468
1092 1 5 . 1 1 27 27 ILE H H 27 8.313 8.313 8.548 -0.235 25468
1093 1 5 . 1 1 28 28 GLU N N 28 121.780 121.780 121.084 0.696 25468
1094 1 5 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.151 0.043 25468
1095 1 5 . 1 1 28 28 GLU CA C 28 58.497 58.497 59.011 -0.514 25468
1096 1 5 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.235 -1.278 25468
1097 1 5 . 1 1 28 28 GLU H H 28 8.312 8.312 8.386 -0.074 25468
1098 1 5 . 1 1 29 29 SER N N 29 114.001 114.001 112.990 1.011 25468
1099 1 5 . 1 1 29 29 SER HA H 29 4.661 4.661 4.428 0.233 25468
1100 1 5 . 1 1 29 29 SER CA C 29 58.377 58.377 59.238 -0.861 25468
1101 1 5 . 1 1 29 29 SER CB C 29 63.484 63.484 63.073 0.411 25468
1102 1 5 . 1 1 29 29 SER H H 29 7.459 7.459 7.705 -0.246 25468
1103 1 5 . 1 1 30 30 ASN N N 30 112.213 112.213 116.158 -3.945 25468
1104 1 5 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.522 -0.095 25468
1105 1 5 . 1 1 30 30 ASN CA C 30 55.041 55.041 55.089 -0.048 25468
1106 1 5 . 1 1 30 30 ASN CB C 30 36.344 36.344 37.149 -0.805 25468
1107 1 5 . 1 1 30 30 ASN H H 30 8.067 8.067 8.104 -0.037 25468
1108 1 5 . 1 1 31 31 PHE N N 31 116.306 116.306 117.437 -1.131 25468
1109 1 5 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.902 -0.328 25468
1110 1 5 . 1 1 31 31 PHE CA C 31 57.969 57.969 57.299 0.670 25468
1111 1 5 . 1 1 31 31 PHE CB C 31 38.699 38.699 40.056 -1.357 25468
1112 1 5 . 1 1 31 31 PHE H H 31 7.861 7.861 8.072 -0.211 25468
1113 1 5 . 1 1 32 32 ALA N N 32 121.103 121.103 122.890 -1.787 25468
1114 1 5 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.337 -0.146 25468
1115 1 5 . 1 1 32 32 ALA CA C 32 53.586 53.586 53.502 0.084 25468
1116 1 5 . 1 1 32 32 ALA CB C 32 19.211 19.211 19.636 -0.425 25468
1117 1 5 . 1 1 32 32 ALA H H 32 8.403 8.403 8.743 -0.340 25468
1118 1 5 . 1 1 33 33 GLY N N 33 100.820 100.820 104.903 -4.083 25468
1119 1 5 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.736 0.134 25468
1120 1 5 . 1 1 33 33 GLY H H 33 7.258 7.258 7.733 -0.475 25468
1121 1 5 . 1 1 34 34 GLY N N 34 108.312 108.312 105.547 2.765 25468
1122 1 5 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.257 2.180 25468
1123 1 5 . 1 1 34 34 GLY H H 34 8.978 8.978 8.430 0.548 25468
1124 1 5 . 1 1 35 35 LYS N N 35 119.929 119.929 115.621 4.308 25468
1125 1 5 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.774 -0.180 25468
1126 1 5 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.921 -0.266 25468
1127 1 5 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.109 2.175 25468
1128 1 5 . 1 1 35 35 LYS H H 35 8.756 8.756 8.128 0.628 25468
1129 1 5 . 1 1 36 36 CYS N N 36 119.831 119.831 119.938 -0.107 25468
1130 1 5 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.587 -0.223 25468
1131 1 5 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.382 -1.164 25468
1132 1 5 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.857 17.293 25468
1133 1 5 . 1 1 36 36 CYS H H 36 8.553 8.553 8.382 0.171 25468
1134 1 5 . 1 1 37 37 VAL N N 37 120.392 120.392 121.494 -1.102 25468
1135 1 5 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.862 -0.098 25468
1136 1 5 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.175 1.072 25468
1137 1 5 . 1 1 37 37 VAL H H 37 9.587 9.587 8.659 0.928 25468
1138 1 5 . 1 1 38 38 HIS N N 38 118.311 118.311 118.123 0.188 25468
1139 1 5 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.613 -0.573 25468
1140 1 5 . 1 1 38 38 HIS CA C 38 53.975 53.975 53.280 0.695 25468
1141 1 5 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.627 -2.147 25468
1142 1 5 . 1 1 38 38 HIS H H 38 8.698 8.698 7.467 1.231 25468
1143 1 5 . 1 1 39 39 ILE N N 39 124.114 124.114 122.281 1.833 25468
1144 1 5 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.288 0.014 25468
1145 1 5 . 1 1 39 39 ILE CA C 39 59.840 59.840 60.684 -0.844 25468
1146 1 5 . 1 1 39 39 ILE CB C 39 38.709 38.709 40.093 -1.384 25468
1147 1 5 . 1 1 39 39 ILE H H 39 8.969 8.969 8.639 0.330 25468
1148 1 5 . 1 1 40 40 GLY N N 40 115.080 115.080 117.616 -2.536 25468
1149 1 5 . 1 1 40 40 GLY CA C 40 46.226 46.226 47.011 -0.785 25468
1150 1 5 . 1 1 40 40 GLY H H 40 8.715 8.715 8.865 -0.150 25468
1151 1 5 . 1 1 41 41 GLN N N 41 121.798 121.798 121.435 0.363 25468
1152 1 5 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.537 -0.233 25468
1153 1 5 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.342 0.308 25468
1154 1 5 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.129 -0.649 25468
1155 1 5 . 1 1 41 41 GLN H H 41 8.672 8.672 8.357 0.315 25468
1156 1 5 . 1 1 42 42 SER N N 42 114.462 114.462 117.012 -2.550 25468
1157 1 5 . 1 1 42 42 SER HA H 42 4.347 4.347 4.370 -0.023 25468
1158 1 5 . 1 1 42 42 SER CA C 42 58.072 58.072 59.877 -1.804 25468
1159 1 5 . 1 1 42 42 SER CB C 42 64.037 64.037 63.640 0.397 25468
1160 1 5 . 1 1 42 42 SER H H 42 7.725 7.725 8.590 -0.865 25468
1161 1 5 . 1 1 43 43 LEU N N 43 124.166 124.166 119.224 4.942 25468
1162 1 5 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.789 0.161 25468
1163 1 5 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.769 -0.474 25468
1164 1 5 . 1 1 43 43 LEU CB C 43 41.400 41.400 40.760 0.640 25468
1165 1 5 . 1 1 43 43 LEU H H 43 8.576 8.576 8.119 0.457 25468
1166 1 5 . 1 1 44 44 ASP N N 44 118.797 118.797 118.766 0.031 25468
1167 1 5 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.727 0.004 25468
1168 1 5 . 1 1 44 44 ASP CB C 44 39.979 39.979 42.289 -2.311 25468
1169 1 5 . 1 1 44 44 ASP H H 44 8.163 8.163 7.928 0.235 25468
1170 1 5 . 1 1 45 45 PHE N N 45 123.595 123.595 122.323 1.272 25468
1171 1 5 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.116 -0.196 25468
1172 1 5 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.041 0.566 25468
1173 1 5 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.688 0.395 25468
1174 1 5 . 1 1 45 45 PHE H H 45 9.042 9.042 8.813 0.229 25468
1175 1 5 . 1 1 46 46 VAL N N 46 119.357 119.357 119.162 0.195 25468
1176 1 5 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.818 -0.125 25468
1177 1 5 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.446 0.470 25468
1178 1 5 . 1 1 46 46 VAL CB C 46 34.666 34.666 33.190 1.476 25468
1179 1 5 . 1 1 46 46 VAL H H 46 9.555 9.555 8.770 0.785 25468
1180 1 5 . 1 1 47 47 CYS N N 47 122.793 122.793 126.362 -3.569 25468
1181 1 5 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.387 -0.557 25468
1182 1 5 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.797 11.933 25468
1183 1 5 . 1 1 47 47 CYS H H 47 9.044 9.044 8.618 0.426 25468
1184 1 5 . 1 1 48 48 VAL N N 48 129.864 129.864 129.128 0.736 25468
1185 1 5 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.087 -0.554 25468
1186 1 5 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.996 -0.179 25468
1187 1 5 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.423 -2.025 25468
1188 1 5 . 1 1 48 48 VAL H H 48 8.616 8.616 8.166 0.450 25468
1189 1 5 . 1 1 49 49 CYS N N 49 121.329 121.329 124.648 -3.319 25468
1190 1 5 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.221 -0.073 25468
1191 1 5 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.583 -6.154 25468
1192 1 5 . 1 1 49 49 CYS CB C 49 33.873 33.873 29.047 4.826 25468
1193 1 5 . 1 1 49 49 CYS H H 49 8.652 8.652 8.201 0.451 25468
1194 1 5 . 1 1 50 50 PHE N N 50 119.026 119.026 120.806 -1.780 25468
1195 1 5 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.028 -0.079 25468
1196 1 5 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.173 -0.521 25468
1197 1 5 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.659 -1.066 25468
1198 1 5 . 1 1 50 50 PHE H H 50 8.472 8.472 8.780 -0.308 25468
1199 1 5 . 1 1 51 51 PRO HA H 51 4.732 4.732 3.944 0.788 25468
1200 1 5 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.111 1.098 25468
1201 1 5 . 1 1 52 52 LYS N N 52 119.951 119.951 123.689 -3.738 25468
1202 1 5 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.354 -0.395 25468
1203 1 5 . 1 1 52 52 LYS CA C 52 57.670 57.670 57.710 -0.040 25468
1204 1 5 . 1 1 52 52 LYS CB C 52 33.225 33.225 33.687 -0.462 25468
1205 1 5 . 1 1 52 52 LYS H H 52 8.681 8.681 8.261 0.420 25468
1206 1 5 . 1 1 53 53 TYR N N 53 118.889 118.889 115.457 3.432 25468
1207 1 5 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.702 -0.231 25468
1208 1 5 . 1 1 53 53 TYR CA C 53 58.049 58.049 54.528 3.521 25468
1209 1 5 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.829 0.439 25468
1210 1 5 . 1 1 53 53 TYR H H 53 8.215 8.215 7.589 0.626 25468
1211 1 5 . 1 1 54 54 TYR N N 54 121.087 121.087 125.091 -4.004 25468
1212 1 5 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.156 0.338 25468
1213 1 5 . 1 1 54 54 TYR CA C 54 58.101 58.101 57.325 0.776 25468
1214 1 5 . 1 1 54 54 TYR CB C 54 39.611 39.611 37.222 2.389 25468
1215 1 5 . 1 1 54 54 TYR H H 54 7.919 7.919 7.703 0.216 25468
1216 1 6 . 1 1 2 2 ASP N N 2 123.544 123.544 121.567 1.977 25468
1217 1 6 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.635 0.063 25468
1218 1 6 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.086 -1.179 25468
1219 1 6 . 1 1 2 2 ASP H H 2 8.843 8.843 8.447 0.396 25468
1220 1 6 . 1 1 3 3 ILE N N 3 121.633 121.633 122.201 -0.568 25468
1221 1 6 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.051 0.107 25468
1222 1 6 . 1 1 3 3 ILE CA C 3 61.110 61.110 60.786 0.324 25468
1223 1 6 . 1 1 3 3 ILE CB C 3 39.038 39.038 37.756 1.282 25468
1224 1 6 . 1 1 3 3 ILE H H 3 8.356 8.356 7.604 0.752 25468
1225 1 6 . 1 1 4 4 ASP N N 4 124.028 124.028 128.335 -4.307 25468
1226 1 6 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.434 0.193 25468
1227 1 6 . 1 1 4 4 ASP CA C 4 53.776 53.776 54.928 -1.152 25468
1228 1 6 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.386 -1.169 25468
1229 1 6 . 1 1 4 4 ASP H H 4 8.460 8.460 8.574 -0.114 25468
1230 1 6 . 1 1 5 5 GLY N N 5 110.531 110.531 108.418 2.113 25468
1231 1 6 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.740 -0.026 25468
1232 1 6 . 1 1 5 5 GLY H H 5 8.405 8.405 8.159 0.246 25468
1233 1 6 . 1 1 6 6 ARG N N 6 119.193 119.193 120.057 -0.864 25468
1234 1 6 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.445 -0.098 25468
1235 1 6 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.687 1.560 25468
1236 1 6 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.067 1.022 25468
1237 1 6 . 1 1 6 6 ARG H H 6 8.128 8.128 8.204 -0.076 25468
1238 1 6 . 1 1 7 7 LYS N N 7 120.971 120.971 120.496 0.475 25468
1239 1 6 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.738 0.031 25468
1240 1 6 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.597 0.633 25468
1241 1 6 . 1 1 7 7 LYS H H 7 7.984 7.984 7.719 0.265 25468
1242 1 6 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.356 0.182 25468
1243 1 6 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.579 0.624 25468
1244 1 6 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.218 -0.363 25468
1245 1 6 . 1 1 9 9 LEU N N 9 123.948 123.948 121.768 2.180 25468
1246 1 6 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.522 -0.035 25468
1247 1 6 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.541 -0.030 25468
1248 1 6 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.461 2.298 25468
1249 1 6 . 1 1 9 9 LEU H H 9 7.801 7.801 7.923 -0.122 25468
1250 1 6 . 1 1 10 10 LEU N N 10 130.176 130.176 127.824 2.352 25468
1251 1 6 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.857 -0.303 25468
1252 1 6 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.395 1.076 25468
1253 1 6 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.030 -0.927 25468
1254 1 6 . 1 1 10 10 LEU H H 10 8.422 8.422 8.549 -0.127 25468
1255 1 6 . 1 1 11 11 ILE N N 11 120.839 120.839 121.500 -0.661 25468
1256 1 6 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.479 -0.093 25468
1257 1 6 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.848 0.683 25468
1258 1 6 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.610 0.747 25468
1259 1 6 . 1 1 11 11 ILE H H 11 8.289 8.289 8.400 -0.111 25468
1260 1 6 . 1 1 12 12 GLY N N 12 106.385 106.385 107.035 -0.650 25468
1261 1 6 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.869 -1.126 25468
1262 1 6 . 1 1 12 12 GLY H H 12 7.125 7.125 7.555 -0.430 25468
1263 1 6 . 1 1 13 13 THR N N 13 110.566 110.566 112.497 -1.931 25468
1264 1 6 . 1 1 13 13 THR HA H 13 4.676 4.676 4.912 -0.236 25468
1265 1 6 . 1 1 13 13 THR CA C 13 62.119 62.119 60.058 2.061 25468
1266 1 6 . 1 1 13 13 THR CB C 13 71.115 71.115 71.332 -0.217 25468
1267 1 6 . 1 1 13 13 THR H H 13 9.046 9.046 8.268 0.778 25468
1268 1 6 . 1 1 14 14 CYS N N 14 117.216 117.216 121.637 -4.421 25468
1269 1 6 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.598 0.302 25468
1270 1 6 . 1 1 14 14 CYS CA C 14 58.201 58.201 59.325 -1.124 25468
1271 1 6 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.475 19.156 25468
1272 1 6 . 1 1 14 14 CYS H H 14 8.436 8.436 8.588 -0.152 25468
1273 1 6 . 1 1 15 15 ILE N N 15 118.247 118.247 120.388 -2.141 25468
1274 1 6 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.923 -0.037 25468
1275 1 6 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.690 -0.389 25468
1276 1 6 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.377 -0.881 25468
1277 1 6 . 1 1 15 15 ILE H H 15 7.244 7.244 7.787 -0.543 25468
1278 1 6 . 1 1 16 16 GLU N N 16 119.649 119.649 118.696 0.953 25468
1279 1 6 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.075 -0.242 25468
1280 1 6 . 1 1 16 16 GLU CA C 16 57.902 57.902 57.438 0.464 25468
1281 1 6 . 1 1 16 16 GLU CB C 16 28.781 28.781 30.161 -1.380 25468
1282 1 6 . 1 1 16 16 GLU H H 16 7.066 7.066 7.682 -0.616 25468
1283 1 6 . 1 1 17 17 PHE N N 17 114.996 114.996 120.465 -5.469 25468
1284 1 6 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.965 -0.401 25468
1285 1 6 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.219 -0.691 25468
1286 1 6 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.268 0.622 25468
1287 1 6 . 1 1 17 17 PHE H H 17 8.148 8.148 7.529 0.619 25468
1288 1 6 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.481 0.372 25468
1289 1 6 . 1 1 18 18 PRO CA C 18 62.917 62.917 63.185 -0.268 25468
1290 1 6 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.497 -0.629 25468
1291 1 6 . 1 1 19 19 THR N N 19 114.536 114.536 115.595 -1.059 25468
1292 1 6 . 1 1 19 19 THR HA H 19 3.650 3.650 3.872 -0.222 25468
1293 1 6 . 1 1 19 19 THR CA C 19 68.731 68.731 67.868 0.864 25468
1294 1 6 . 1 1 19 19 THR CB C 19 69.792 69.792 68.665 1.127 25468
1295 1 6 . 1 1 19 19 THR H H 19 8.370 8.370 8.693 -0.323 25468
1296 1 6 . 1 1 20 20 GLU N N 20 120.374 120.374 120.919 -0.545 25468
1297 1 6 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.271 -0.078 25468
1298 1 6 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.567 0.478 25468
1299 1 6 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.672 -0.416 25468
1300 1 6 . 1 1 20 20 GLU H H 20 9.038 9.038 8.846 0.192 25468
1301 1 6 . 1 1 21 21 LYS N N 21 122.432 122.432 120.613 1.819 25468
1302 1 6 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.125 0.040 25468
1303 1 6 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.066 0.143 25468
1304 1 6 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.377 0.750 25468
1305 1 6 . 1 1 21 21 LYS H H 21 7.622 7.622 8.130 -0.508 25468
1306 1 6 . 1 1 22 22 CYS N N 22 121.466 121.466 119.469 1.997 25468
1307 1 6 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.019 0.066 25468
1308 1 6 . 1 1 22 22 CYS CA C 22 58.769 58.769 63.017 -4.248 25468
1309 1 6 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.264 10.330 25468
1310 1 6 . 1 1 22 22 CYS H H 22 9.356 9.356 8.832 0.524 25468
1311 1 6 . 1 1 23 23 ASN N N 23 115.604 115.604 118.427 -2.823 25468
1312 1 6 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.449 -0.404 25468
1313 1 6 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.381 1.486 25468
1314 1 6 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.813 1.491 25468
1315 1 6 . 1 1 23 23 ASN H H 23 7.925 7.925 7.958 -0.033 25468
1316 1 6 . 1 1 24 24 LYS N N 24 116.665 116.665 121.153 -4.488 25468
1317 1 6 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.965 -0.053 25468
1318 1 6 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.748 0.161 25468
1319 1 6 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.242 0.793 25468
1320 1 6 . 1 1 24 24 LYS H H 24 7.955 7.955 8.621 -0.666 25468
1321 1 6 . 1 1 25 25 THR N N 25 116.759 116.759 115.650 1.109 25468
1322 1 6 . 1 1 25 25 THR HA H 25 3.859 3.859 4.037 -0.178 25468
1323 1 6 . 1 1 25 25 THR CA C 25 67.243 67.243 66.395 0.848 25468
1324 1 6 . 1 1 25 25 THR CB C 25 68.752 68.752 68.340 0.412 25468
1325 1 6 . 1 1 25 25 THR H H 25 8.518 8.518 8.546 -0.028 25468
1326 1 6 . 1 1 26 26 CYS N N 26 121.616 121.616 121.473 0.143 25468
1327 1 6 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.117 0.142 25468
1328 1 6 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.299 -3.696 25468
1329 1 6 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.816 8.373 25468
1330 1 6 . 1 1 26 26 CYS H H 26 8.062 8.062 7.679 0.383 25468
1331 1 6 . 1 1 27 27 ILE N N 27 124.036 124.036 120.471 3.565 25468
1332 1 6 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.080 0.074 25468
1333 1 6 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.731 0.529 25468
1334 1 6 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.027 1.008 25468
1335 1 6 . 1 1 27 27 ILE H H 27 8.313 8.313 8.447 -0.134 25468
1336 1 6 . 1 1 28 28 GLU N N 28 121.780 121.780 120.854 0.926 25468
1337 1 6 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.119 0.075 25468
1338 1 6 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.846 -0.349 25468
1339 1 6 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.299 -1.342 25468
1340 1 6 . 1 1 28 28 GLU H H 28 8.312 8.312 8.180 0.132 25468
1341 1 6 . 1 1 29 29 SER N N 29 114.001 114.001 113.629 0.372 25468
1342 1 6 . 1 1 29 29 SER HA H 29 4.661 4.661 4.342 0.319 25468
1343 1 6 . 1 1 29 29 SER CA C 29 58.377 58.377 59.751 -1.374 25468
1344 1 6 . 1 1 29 29 SER CB C 29 63.484 63.484 63.181 0.303 25468
1345 1 6 . 1 1 29 29 SER H H 29 7.459 7.459 7.643 -0.184 25468
1346 1 6 . 1 1 30 30 ASN N N 30 112.213 112.213 115.985 -3.772 25468
1347 1 6 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.564 -0.137 25468
1348 1 6 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.743 0.298 25468
1349 1 6 . 1 1 30 30 ASN CB C 30 36.344 36.344 37.873 -1.529 25468
1350 1 6 . 1 1 30 30 ASN H H 30 8.067 8.067 7.899 0.168 25468
1351 1 6 . 1 1 31 31 PHE N N 31 116.306 116.306 117.587 -1.281 25468
1352 1 6 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.595 -0.021 25468
1353 1 6 . 1 1 31 31 PHE CA C 31 57.969 57.969 57.254 0.715 25468
1354 1 6 . 1 1 31 31 PHE CB C 31 38.699 38.699 39.896 -1.197 25468
1355 1 6 . 1 1 31 31 PHE H H 31 7.861 7.861 7.950 -0.089 25468
1356 1 6 . 1 1 32 32 ALA N N 32 121.103 121.103 122.567 -1.464 25468
1357 1 6 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.241 -0.050 25468
1358 1 6 . 1 1 32 32 ALA CA C 32 53.586 53.586 53.829 -0.243 25468
1359 1 6 . 1 1 32 32 ALA CB C 32 19.211 19.211 19.478 -0.267 25468
1360 1 6 . 1 1 32 32 ALA H H 32 8.403 8.403 8.989 -0.586 25468
1361 1 6 . 1 1 33 33 GLY N N 33 100.820 100.820 103.570 -2.750 25468
1362 1 6 . 1 1 33 33 GLY CA C 33 44.870 44.870 45.179 -0.309 25468
1363 1 6 . 1 1 33 33 GLY H H 33 7.258 7.258 7.594 -0.336 25468
1364 1 6 . 1 1 34 34 GLY N N 34 108.312 108.312 105.315 2.997 25468
1365 1 6 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.096 2.341 25468
1366 1 6 . 1 1 34 34 GLY H H 34 8.978 8.978 8.333 0.645 25468
1367 1 6 . 1 1 35 35 LYS N N 35 119.929 119.929 117.872 2.057 25468
1368 1 6 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.826 -0.232 25468
1369 1 6 . 1 1 35 35 LYS CA C 35 54.655 54.655 55.086 -0.431 25468
1370 1 6 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.297 1.986 25468
1371 1 6 . 1 1 35 35 LYS H H 35 8.756 8.756 8.293 0.463 25468
1372 1 6 . 1 1 36 36 CYS N N 36 119.831 119.831 119.884 -0.053 25468
1373 1 6 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.700 -0.336 25468
1374 1 6 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.385 -1.167 25468
1375 1 6 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.333 17.817 25468
1376 1 6 . 1 1 36 36 CYS H H 36 8.553 8.553 8.664 -0.111 25468
1377 1 6 . 1 1 37 37 VAL N N 37 120.392 120.392 121.122 -0.730 25468
1378 1 6 . 1 1 37 37 VAL HA H 37 4.764 4.764 5.080 -0.316 25468
1379 1 6 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.277 0.970 25468
1380 1 6 . 1 1 37 37 VAL H H 37 9.587 9.587 9.028 0.559 25468
1381 1 6 . 1 1 38 38 HIS N N 38 118.311 118.311 117.015 1.296 25468
1382 1 6 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.516 -0.476 25468
1383 1 6 . 1 1 38 38 HIS CA C 38 53.975 53.975 53.112 0.863 25468
1384 1 6 . 1 1 38 38 HIS CB C 38 29.480 29.480 32.537 -3.057 25468
1385 1 6 . 1 1 38 38 HIS H H 38 8.698 8.698 7.753 0.945 25468
1386 1 6 . 1 1 39 39 ILE N N 39 124.114 124.114 121.213 2.901 25468
1387 1 6 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.202 0.100 25468
1388 1 6 . 1 1 39 39 ILE CA C 39 59.840 59.840 59.484 0.355 25468
1389 1 6 . 1 1 39 39 ILE CB C 39 38.709 38.709 38.275 0.434 25468
1390 1 6 . 1 1 39 39 ILE H H 39 8.969 8.969 8.726 0.243 25468
1391 1 6 . 1 1 40 40 GLY N N 40 115.080 115.080 114.564 0.516 25468
1392 1 6 . 1 1 40 40 GLY CA C 40 46.226 46.226 46.252 -0.026 25468
1393 1 6 . 1 1 40 40 GLY H H 40 8.715 8.715 8.729 -0.014 25468
1394 1 6 . 1 1 41 41 GLN N N 41 121.798 121.798 120.592 1.206 25468
1395 1 6 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.328 -0.024 25468
1396 1 6 . 1 1 41 41 GLN CA C 41 55.650 55.650 56.512 -0.862 25468
1397 1 6 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.598 -1.118 25468
1398 1 6 . 1 1 41 41 GLN H H 41 8.672 8.672 8.639 0.033 25468
1399 1 6 . 1 1 42 42 SER N N 42 114.462 114.462 115.909 -1.447 25468
1400 1 6 . 1 1 42 42 SER HA H 42 4.347 4.347 4.477 -0.130 25468
1401 1 6 . 1 1 42 42 SER CA C 42 58.072 58.072 59.063 -0.991 25468
1402 1 6 . 1 1 42 42 SER CB C 42 64.037 64.037 64.225 -0.188 25468
1403 1 6 . 1 1 42 42 SER H H 42 7.725 7.725 8.094 -0.369 25468
1404 1 6 . 1 1 43 43 LEU N N 43 124.166 124.166 119.757 4.409 25468
1405 1 6 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.867 0.083 25468
1406 1 6 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.772 -0.477 25468
1407 1 6 . 1 1 43 43 LEU CB C 43 41.400 41.400 40.281 1.119 25468
1408 1 6 . 1 1 43 43 LEU H H 43 8.576 8.576 7.603 0.973 25468
1409 1 6 . 1 1 44 44 ASP N N 44 118.797 118.797 118.406 0.391 25468
1410 1 6 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.598 0.133 25468
1411 1 6 . 1 1 44 44 ASP CB C 44 39.979 39.979 42.611 -2.632 25468
1412 1 6 . 1 1 44 44 ASP H H 44 8.163 8.163 7.874 0.289 25468
1413 1 6 . 1 1 45 45 PHE N N 45 123.595 123.595 121.653 1.942 25468
1414 1 6 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.109 -0.189 25468
1415 1 6 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.886 -0.279 25468
1416 1 6 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.949 0.134 25468
1417 1 6 . 1 1 45 45 PHE H H 45 9.042 9.042 8.732 0.310 25468
1418 1 6 . 1 1 46 46 VAL N N 46 119.357 119.357 119.055 0.302 25468
1419 1 6 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.852 -0.159 25468
1420 1 6 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.684 0.231 25468
1421 1 6 . 1 1 46 46 VAL CB C 46 34.666 34.666 34.978 -0.312 25468
1422 1 6 . 1 1 46 46 VAL H H 46 9.555 9.555 9.225 0.330 25468
1423 1 6 . 1 1 47 47 CYS N N 47 122.793 122.793 123.110 -0.317 25468
1424 1 6 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.570 -0.740 25468
1425 1 6 . 1 1 47 47 CYS CB C 47 38.730 38.730 27.541 11.190 25468
1426 1 6 . 1 1 47 47 CYS H H 47 9.044 9.044 8.412 0.632 25468
1427 1 6 . 1 1 48 48 VAL N N 48 129.864 129.864 125.756 4.108 25468
1428 1 6 . 1 1 48 48 VAL HA H 48 4.533 4.533 4.951 -0.418 25468
1429 1 6 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.316 0.501 25468
1430 1 6 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.365 -1.967 25468
1431 1 6 . 1 1 48 48 VAL H H 48 8.616 8.616 8.092 0.524 25468
1432 1 6 . 1 1 49 49 CYS N N 49 121.329 121.329 123.477 -2.148 25468
1433 1 6 . 1 1 49 49 CYS HA H 49 5.148 5.148 4.932 0.216 25468
1434 1 6 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.633 -6.205 25468
1435 1 6 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.825 5.048 25468
1436 1 6 . 1 1 49 49 CYS H H 49 8.652 8.652 7.919 0.733 25468
1437 1 6 . 1 1 50 50 PHE N N 50 119.026 119.026 120.864 -1.838 25468
1438 1 6 . 1 1 50 50 PHE HA H 50 4.949 4.949 4.976 -0.027 25468
1439 1 6 . 1 1 50 50 PHE CA C 50 54.652 54.652 54.873 -0.222 25468
1440 1 6 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.712 -1.119 25468
1441 1 6 . 1 1 50 50 PHE H H 50 8.472 8.472 8.870 -0.398 25468
1442 1 6 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.198 0.534 25468
1443 1 6 . 1 1 51 51 PRO CB C 51 33.209 33.209 33.141 0.068 25468
1444 1 6 . 1 1 52 52 LYS N N 52 119.951 119.951 119.103 0.848 25468
1445 1 6 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.030 -0.071 25468
1446 1 6 . 1 1 52 52 LYS CA C 52 57.670 57.670 57.825 -0.155 25468
1447 1 6 . 1 1 52 52 LYS CB C 52 33.225 33.225 31.623 1.602 25468
1448 1 6 . 1 1 52 52 LYS H H 52 8.681 8.681 8.431 0.250 25468
1449 1 6 . 1 1 53 53 TYR N N 53 118.889 118.889 116.994 1.895 25468
1450 1 6 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.604 -0.133 25468
1451 1 6 . 1 1 53 53 TYR CA C 53 58.049 58.049 56.875 1.174 25468
1452 1 6 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.680 0.588 25468
1453 1 6 . 1 1 53 53 TYR H H 53 8.215 8.215 7.540 0.675 25468
1454 1 6 . 1 1 54 54 TYR N N 54 121.087 121.087 121.500 -0.413 25468
1455 1 6 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.756 -0.262 25468
1456 1 6 . 1 1 54 54 TYR CA C 54 58.101 58.101 57.999 0.102 25468
1457 1 6 . 1 1 54 54 TYR CB C 54 39.611 39.611 40.015 -0.404 25468
1458 1 6 . 1 1 54 54 TYR H H 54 7.919 7.919 7.562 0.357 25468
1459 1 7 . 1 1 2 2 ASP N N 2 123.544 123.544 123.763 -0.219 25468
1460 1 7 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.525 0.173 25468
1461 1 7 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.472 -1.565 25468
1462 1 7 . 1 1 2 2 ASP H H 2 8.843 8.843 8.655 0.188 25468
1463 1 7 . 1 1 3 3 ILE N N 3 121.633 121.633 119.042 2.591 25468
1464 1 7 . 1 1 3 3 ILE HA H 3 4.158 4.158 2.986 1.172 25468
1465 1 7 . 1 1 3 3 ILE CA C 3 61.110 61.110 62.631 -1.521 25468
1466 1 7 . 1 1 3 3 ILE CB C 3 39.038 39.038 36.898 2.140 25468
1467 1 7 . 1 1 3 3 ILE H H 3 8.356 8.356 8.202 0.154 25468
1468 1 7 . 1 1 4 4 ASP N N 4 124.028 124.028 119.708 4.320 25468
1469 1 7 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.485 0.142 25468
1470 1 7 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.436 -1.660 25468
1471 1 7 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.356 -1.140 25468
1472 1 7 . 1 1 4 4 ASP H H 4 8.460 8.460 8.043 0.417 25468
1473 1 7 . 1 1 5 5 GLY N N 5 110.531 110.531 107.496 3.035 25468
1474 1 7 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.360 0.354 25468
1475 1 7 . 1 1 5 5 GLY H H 5 8.405 8.405 7.959 0.446 25468
1476 1 7 . 1 1 6 6 ARG N N 6 119.193 119.193 120.350 -1.157 25468
1477 1 7 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.507 -0.160 25468
1478 1 7 . 1 1 6 6 ARG CA C 6 56.247 56.247 55.004 1.243 25468
1479 1 7 . 1 1 6 6 ARG CB C 6 31.089 31.089 31.074 0.015 25468
1480 1 7 . 1 1 6 6 ARG H H 6 8.128 8.128 7.972 0.156 25468
1481 1 7 . 1 1 7 7 LYS N N 7 120.971 120.971 120.722 0.249 25468
1482 1 7 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.665 0.104 25468
1483 1 7 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.564 0.666 25468
1484 1 7 . 1 1 7 7 LYS H H 7 7.984 7.984 8.131 -0.147 25468
1485 1 7 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.141 0.397 25468
1486 1 7 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.064 1.139 25468
1487 1 7 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.214 -0.359 25468
1488 1 7 . 1 1 9 9 LEU N N 9 123.948 123.948 121.710 2.238 25468
1489 1 7 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.425 0.062 25468
1490 1 7 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.284 0.227 25468
1491 1 7 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.347 2.412 25468
1492 1 7 . 1 1 9 9 LEU H H 9 7.801 7.801 7.461 0.340 25468
1493 1 7 . 1 1 10 10 LEU N N 10 130.176 130.176 128.229 1.947 25468
1494 1 7 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.853 -0.299 25468
1495 1 7 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.445 1.026 25468
1496 1 7 . 1 1 10 10 LEU CB C 10 42.103 42.103 42.996 -0.893 25468
1497 1 7 . 1 1 10 10 LEU H H 10 8.422 8.422 8.521 -0.099 25468
1498 1 7 . 1 1 11 11 ILE N N 11 120.839 120.839 122.039 -1.200 25468
1499 1 7 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.444 -0.058 25468
1500 1 7 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.847 0.684 25468
1501 1 7 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.693 0.664 25468
1502 1 7 . 1 1 11 11 ILE H H 11 8.289 8.289 8.708 -0.419 25468
1503 1 7 . 1 1 12 12 GLY N N 12 106.385 106.385 106.955 -0.570 25468
1504 1 7 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.550 -0.807 25468
1505 1 7 . 1 1 12 12 GLY H H 12 7.125 7.125 7.317 -0.192 25468
1506 1 7 . 1 1 13 13 THR N N 13 110.566 110.566 110.382 0.184 25468
1507 1 7 . 1 1 13 13 THR HA H 13 4.676 4.676 4.923 -0.247 25468
1508 1 7 . 1 1 13 13 THR CA C 13 62.119 62.119 59.406 2.713 25468
1509 1 7 . 1 1 13 13 THR CB C 13 71.115 71.115 72.041 -0.926 25468
1510 1 7 . 1 1 13 13 THR H H 13 9.046 9.046 7.676 1.370 25468
1511 1 7 . 1 1 14 14 CYS N N 14 117.216 117.216 122.003 -4.787 25468
1512 1 7 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.586 0.314 25468
1513 1 7 . 1 1 14 14 CYS CA C 14 58.201 58.201 61.822 -3.621 25468
1514 1 7 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.975 18.656 25468
1515 1 7 . 1 1 14 14 CYS H H 14 8.436 8.436 8.814 -0.378 25468
1516 1 7 . 1 1 15 15 ILE N N 15 118.247 118.247 119.182 -0.935 25468
1517 1 7 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.755 0.131 25468
1518 1 7 . 1 1 15 15 ILE CA C 15 63.301 63.301 64.388 -1.087 25468
1519 1 7 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.115 -0.619 25468
1520 1 7 . 1 1 15 15 ILE H H 15 7.244 7.244 8.238 -0.994 25468
1521 1 7 . 1 1 16 16 GLU N N 16 119.649 119.649 118.276 1.373 25468
1522 1 7 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.355 -0.522 25468
1523 1 7 . 1 1 16 16 GLU CA C 16 57.902 57.902 57.306 0.596 25468
1524 1 7 . 1 1 16 16 GLU CB C 16 28.781 28.781 31.291 -2.510 25468
1525 1 7 . 1 1 16 16 GLU H H 16 7.066 7.066 7.957 -0.891 25468
1526 1 7 . 1 1 17 17 PHE N N 17 114.996 114.996 121.041 -6.045 25468
1527 1 7 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.985 -0.421 25468
1528 1 7 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.845 -1.317 25468
1529 1 7 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.029 0.861 25468
1530 1 7 . 1 1 17 17 PHE H H 17 8.148 8.148 8.485 -0.337 25468
1531 1 7 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.557 0.296 25468
1532 1 7 . 1 1 18 18 PRO CA C 18 62.917 62.917 63.389 -0.472 25468
1533 1 7 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.423 -0.555 25468
1534 1 7 . 1 1 19 19 THR N N 19 114.536 114.536 114.098 0.438 25468
1535 1 7 . 1 1 19 19 THR HA H 19 3.650 3.650 3.962 -0.312 25468
1536 1 7 . 1 1 19 19 THR CA C 19 68.731 68.731 67.831 0.900 25468
1537 1 7 . 1 1 19 19 THR CB C 19 69.792 69.792 68.519 1.273 25468
1538 1 7 . 1 1 19 19 THR H H 19 8.370 8.370 8.605 -0.235 25468
1539 1 7 . 1 1 20 20 GLU N N 20 120.374 120.374 121.081 -0.707 25468
1540 1 7 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.222 -0.029 25468
1541 1 7 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.766 0.279 25468
1542 1 7 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.669 -0.413 25468
1543 1 7 . 1 1 20 20 GLU H H 20 9.038 9.038 8.882 0.156 25468
1544 1 7 . 1 1 21 21 LYS N N 21 122.432 122.432 120.543 1.889 25468
1545 1 7 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.079 0.086 25468
1546 1 7 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.475 -0.265 25468
1547 1 7 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.165 0.962 25468
1548 1 7 . 1 1 21 21 LYS H H 21 7.622 7.622 8.106 -0.484 25468
1549 1 7 . 1 1 22 22 CYS N N 22 121.466 121.466 120.072 1.394 25468
1550 1 7 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.303 -0.218 25468
1551 1 7 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.219 -3.450 25468
1552 1 7 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.068 10.526 25468
1553 1 7 . 1 1 22 22 CYS H H 22 9.356 9.356 8.682 0.674 25468
1554 1 7 . 1 1 23 23 ASN N N 23 115.604 115.604 118.882 -3.278 25468
1555 1 7 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.491 -0.446 25468
1556 1 7 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.430 1.437 25468
1557 1 7 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.764 1.540 25468
1558 1 7 . 1 1 23 23 ASN H H 23 7.925 7.925 8.047 -0.122 25468
1559 1 7 . 1 1 24 24 LYS N N 24 116.665 116.665 121.293 -4.628 25468
1560 1 7 . 1 1 24 24 LYS HA H 24 3.912 3.912 4.001 -0.089 25468
1561 1 7 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.812 0.097 25468
1562 1 7 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.274 0.761 25468
1563 1 7 . 1 1 24 24 LYS H H 24 7.955 7.955 8.316 -0.361 25468
1564 1 7 . 1 1 25 25 THR N N 25 116.759 116.759 115.495 1.264 25468
1565 1 7 . 1 1 25 25 THR HA H 25 3.859 3.859 4.476 -0.617 25468
1566 1 7 . 1 1 25 25 THR CA C 25 67.243 67.243 66.784 0.459 25468
1567 1 7 . 1 1 25 25 THR CB C 25 68.752 68.752 68.732 0.020 25468
1568 1 7 . 1 1 25 25 THR H H 25 8.518 8.518 8.691 -0.173 25468
1569 1 7 . 1 1 26 26 CYS N N 26 121.616 121.616 120.765 0.851 25468
1570 1 7 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.337 -0.078 25468
1571 1 7 . 1 1 26 26 CYS CA C 26 57.603 57.603 62.161 -4.558 25468
1572 1 7 . 1 1 26 26 CYS CB C 26 34.189 34.189 26.130 8.059 25468
1573 1 7 . 1 1 26 26 CYS H H 26 8.062 8.062 8.075 -0.013 25468
1574 1 7 . 1 1 27 27 ILE N N 27 124.036 124.036 121.103 2.933 25468
1575 1 7 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.120 0.034 25468
1576 1 7 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.757 0.503 25468
1577 1 7 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.414 0.621 25468
1578 1 7 . 1 1 27 27 ILE H H 27 8.313 8.313 8.522 -0.209 25468
1579 1 7 . 1 1 28 28 GLU N N 28 121.780 121.780 120.106 1.674 25468
1580 1 7 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.168 0.026 25468
1581 1 7 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.804 -0.307 25468
1582 1 7 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.265 -1.308 25468
1583 1 7 . 1 1 28 28 GLU H H 28 8.312 8.312 8.029 0.283 25468
1584 1 7 . 1 1 29 29 SER N N 29 114.001 114.001 115.488 -1.487 25468
1585 1 7 . 1 1 29 29 SER HA H 29 4.661 4.661 4.473 0.188 25468
1586 1 7 . 1 1 29 29 SER CA C 29 58.377 58.377 58.978 -0.601 25468
1587 1 7 . 1 1 29 29 SER CB C 29 63.484 63.484 63.236 0.249 25468
1588 1 7 . 1 1 29 29 SER H H 29 7.459 7.459 7.786 -0.327 25468
1589 1 7 . 1 1 30 30 ASN N N 30 112.213 112.213 117.103 -4.890 25468
1590 1 7 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.234 0.193 25468
1591 1 7 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.204 0.837 25468
1592 1 7 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.683 -0.339 25468
1593 1 7 . 1 1 30 30 ASN H H 30 8.067 8.067 7.566 0.501 25468
1594 1 7 . 1 1 31 31 PHE N N 31 116.306 116.306 114.686 1.620 25468
1595 1 7 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.599 -0.025 25468
1596 1 7 . 1 1 31 31 PHE CA C 31 57.969 57.969 56.767 1.202 25468
1597 1 7 . 1 1 31 31 PHE CB C 31 38.699 38.699 42.405 -3.706 25468
1598 1 7 . 1 1 31 31 PHE H H 31 7.861 7.861 7.725 0.136 25468
1599 1 7 . 1 1 32 32 ALA N N 32 121.103 121.103 123.493 -2.390 25468
1600 1 7 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.251 -0.060 25468
1601 1 7 . 1 1 32 32 ALA CA C 32 53.586 53.586 52.617 0.969 25468
1602 1 7 . 1 1 32 32 ALA CB C 32 19.211 19.211 17.876 1.335 25468
1603 1 7 . 1 1 32 32 ALA H H 32 8.403 8.403 8.990 -0.587 25468
1604 1 7 . 1 1 33 33 GLY N N 33 100.820 100.820 105.803 -4.983 25468
1605 1 7 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.395 0.475 25468
1606 1 7 . 1 1 33 33 GLY H H 33 7.258 7.258 7.498 -0.240 25468
1607 1 7 . 1 1 34 34 GLY N N 34 108.312 108.312 106.018 2.294 25468
1608 1 7 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.495 1.942 25468
1609 1 7 . 1 1 34 34 GLY H H 34 8.978 8.978 8.384 0.594 25468
1610 1 7 . 1 1 35 35 LYS N N 35 119.929 119.929 115.451 4.478 25468
1611 1 7 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.813 -0.219 25468
1612 1 7 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.730 -0.075 25468
1613 1 7 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.200 2.084 25468
1614 1 7 . 1 1 35 35 LYS H H 35 8.756 8.756 8.293 0.463 25468
1615 1 7 . 1 1 36 36 CYS N N 36 119.831 119.831 120.517 -0.686 25468
1616 1 7 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.672 -0.308 25468
1617 1 7 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.188 -0.970 25468
1618 1 7 . 1 1 36 36 CYS CB C 36 44.150 44.150 27.077 17.073 25468
1619 1 7 . 1 1 36 36 CYS H H 36 8.553 8.553 8.566 -0.013 25468
1620 1 7 . 1 1 37 37 VAL N N 37 120.392 120.392 122.269 -1.877 25468
1621 1 7 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.895 -0.131 25468
1622 1 7 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.144 1.103 25468
1623 1 7 . 1 1 37 37 VAL H H 37 9.587 9.587 8.845 0.742 25468
1624 1 7 . 1 1 38 38 HIS N N 38 118.311 118.311 117.486 0.825 25468
1625 1 7 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.575 -0.535 25468
1626 1 7 . 1 1 38 38 HIS CA C 38 53.975 53.975 53.061 0.914 25468
1627 1 7 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.629 -2.149 25468
1628 1 7 . 1 1 38 38 HIS H H 38 8.698 8.698 7.483 1.215 25468
1629 1 7 . 1 1 39 39 ILE N N 39 124.114 124.114 121.545 2.569 25468
1630 1 7 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.219 0.083 25468
1631 1 7 . 1 1 39 39 ILE CA C 39 59.840 59.840 60.983 -1.143 25468
1632 1 7 . 1 1 39 39 ILE CB C 39 38.709 38.709 40.264 -1.554 25468
1633 1 7 . 1 1 39 39 ILE H H 39 8.969 8.969 8.639 0.330 25468
1634 1 7 . 1 1 40 40 GLY N N 40 115.080 115.080 114.191 0.889 25468
1635 1 7 . 1 1 40 40 GLY CA C 40 46.226 46.226 45.423 0.803 25468
1636 1 7 . 1 1 40 40 GLY H H 40 8.715 8.715 8.917 -0.202 25468
1637 1 7 . 1 1 41 41 GLN N N 41 121.798 121.798 115.272 6.526 25468
1638 1 7 . 1 1 41 41 GLN HA H 41 4.304 4.304 3.823 0.481 25468
1639 1 7 . 1 1 41 41 GLN CA C 41 55.650 55.650 56.570 -0.920 25468
1640 1 7 . 1 1 41 41 GLN CB C 41 28.480 28.480 26.861 1.619 25468
1641 1 7 . 1 1 41 41 GLN H H 41 8.672 8.672 8.591 0.081 25468
1642 1 7 . 1 1 42 42 SER N N 42 114.462 114.462 114.392 0.070 25468
1643 1 7 . 1 1 42 42 SER HA H 42 4.347 4.347 4.330 0.017 25468
1644 1 7 . 1 1 42 42 SER CA C 42 58.072 58.072 60.341 -2.269 25468
1645 1 7 . 1 1 42 42 SER CB C 42 64.037 64.037 63.971 0.066 25468
1646 1 7 . 1 1 42 42 SER H H 42 7.725 7.725 7.796 -0.071 25468
1647 1 7 . 1 1 43 43 LEU N N 43 124.166 124.166 119.119 5.047 25468
1648 1 7 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.803 0.147 25468
1649 1 7 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.107 0.188 25468
1650 1 7 . 1 1 43 43 LEU CB C 43 41.400 41.400 41.229 0.171 25468
1651 1 7 . 1 1 43 43 LEU H H 43 8.576 8.576 7.937 0.639 25468
1652 1 7 . 1 1 44 44 ASP N N 44 118.797 118.797 119.462 -0.665 25468
1653 1 7 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.785 -0.054 25468
1654 1 7 . 1 1 44 44 ASP CB C 44 39.979 39.979 41.853 -1.874 25468
1655 1 7 . 1 1 44 44 ASP H H 44 8.163 8.163 7.853 0.310 25468
1656 1 7 . 1 1 45 45 PHE N N 45 123.595 123.595 122.989 0.606 25468
1657 1 7 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.064 -0.144 25468
1658 1 7 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.209 0.397 25468
1659 1 7 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.510 0.573 25468
1660 1 7 . 1 1 45 45 PHE H H 45 9.042 9.042 8.906 0.136 25468
1661 1 7 . 1 1 46 46 VAL N N 46 119.357 119.357 118.058 1.299 25468
1662 1 7 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.857 -0.164 25468
1663 1 7 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.579 0.336 25468
1664 1 7 . 1 1 46 46 VAL CB C 46 34.666 34.666 34.221 0.445 25468
1665 1 7 . 1 1 46 46 VAL H H 46 9.555 9.555 8.811 0.744 25468
1666 1 7 . 1 1 47 47 CYS N N 47 122.793 122.793 126.031 -3.238 25468
1667 1 7 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.375 -0.545 25468
1668 1 7 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.526 12.204 25468
1669 1 7 . 1 1 47 47 CYS H H 47 9.044 9.044 8.629 0.415 25468
1670 1 7 . 1 1 48 48 VAL N N 48 129.864 129.864 129.449 0.415 25468
1671 1 7 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.042 -0.509 25468
1672 1 7 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.948 -0.131 25468
1673 1 7 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.483 -2.085 25468
1674 1 7 . 1 1 48 48 VAL H H 48 8.616 8.616 8.324 0.292 25468
1675 1 7 . 1 1 49 49 CYS N N 49 121.329 121.329 123.689 -2.360 25468
1676 1 7 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.272 -0.124 25468
1677 1 7 . 1 1 49 49 CYS CA C 49 50.429 50.429 57.438 -7.008 25468
1678 1 7 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.570 5.303 25468
1679 1 7 . 1 1 49 49 CYS H H 49 8.652 8.652 8.269 0.383 25468
1680 1 7 . 1 1 50 50 PHE N N 50 119.026 119.026 118.547 0.479 25468
1681 1 7 . 1 1 50 50 PHE HA H 50 4.949 4.949 4.885 0.064 25468
1682 1 7 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.409 -0.757 25468
1683 1 7 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.929 -1.336 25468
1684 1 7 . 1 1 50 50 PHE H H 50 8.472 8.472 8.891 -0.419 25468
1685 1 7 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.529 0.203 25468
1686 1 7 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.166 1.044 25468
1687 1 7 . 1 1 52 52 LYS N N 52 119.951 119.951 123.948 -3.997 25468
1688 1 7 . 1 1 52 52 LYS HA H 52 3.959 3.959 3.794 0.165 25468
1689 1 7 . 1 1 52 52 LYS CA C 52 57.670 57.670 58.603 -0.933 25468
1690 1 7 . 1 1 52 52 LYS CB C 52 33.225 33.225 31.723 1.502 25468
1691 1 7 . 1 1 52 52 LYS H H 52 8.681 8.681 8.496 0.185 25468
1692 1 7 . 1 1 53 53 TYR N N 53 118.889 118.889 112.590 6.299 25468
1693 1 7 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.652 -0.181 25468
1694 1 7 . 1 1 53 53 TYR CA C 53 58.049 58.049 57.153 0.896 25468
1695 1 7 . 1 1 53 53 TYR CB C 53 38.268 38.268 38.968 -0.700 25468
1696 1 7 . 1 1 53 53 TYR H H 53 8.215 8.215 7.788 0.427 25468
1697 1 7 . 1 1 54 54 TYR N N 54 121.087 121.087 122.960 -1.873 25468
1698 1 7 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.651 -0.157 25468
1699 1 7 . 1 1 54 54 TYR CA C 54 58.101 58.101 57.546 0.555 25468
1700 1 7 . 1 1 54 54 TYR CB C 54 39.611 39.611 36.712 2.899 25468
1701 1 7 . 1 1 54 54 TYR H H 54 7.919 7.919 7.949 -0.030 25468
1702 1 8 . 1 1 2 2 ASP N N 2 123.544 123.544 121.354 2.190 25468
1703 1 8 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.575 0.123 25468
1704 1 8 . 1 1 2 2 ASP CB C 2 39.907 39.907 40.529 -0.622 25468
1705 1 8 . 1 1 2 2 ASP H H 2 8.843 8.843 8.196 0.647 25468
1706 1 8 . 1 1 3 3 ILE N N 3 121.633 121.633 114.099 7.534 25468
1707 1 8 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.269 -0.111 25468
1708 1 8 . 1 1 3 3 ILE CA C 3 61.110 61.110 59.618 1.492 25468
1709 1 8 . 1 1 3 3 ILE CB C 3 39.038 39.038 39.554 -0.517 25468
1710 1 8 . 1 1 3 3 ILE H H 3 8.356 8.356 7.490 0.866 25468
1711 1 8 . 1 1 4 4 ASP N N 4 124.028 124.028 123.752 0.276 25468
1712 1 8 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.177 0.450 25468
1713 1 8 . 1 1 4 4 ASP CA C 4 53.776 53.776 54.500 -0.724 25468
1714 1 8 . 1 1 4 4 ASP CB C 4 40.216 40.216 40.760 -0.543 25468
1715 1 8 . 1 1 4 4 ASP H H 4 8.460 8.460 8.445 0.015 25468
1716 1 8 . 1 1 5 5 GLY N N 5 110.531 110.531 108.371 2.160 25468
1717 1 8 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.042 0.672 25468
1718 1 8 . 1 1 5 5 GLY H H 5 8.405 8.405 7.950 0.455 25468
1719 1 8 . 1 1 6 6 ARG N N 6 119.193 119.193 120.323 -1.130 25468
1720 1 8 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.607 -0.260 25468
1721 1 8 . 1 1 6 6 ARG CA C 6 56.247 56.247 55.372 0.875 25468
1722 1 8 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.967 0.122 25468
1723 1 8 . 1 1 6 6 ARG H H 6 8.128 8.128 8.270 -0.142 25468
1724 1 8 . 1 1 7 7 LYS N N 7 120.971 120.971 120.260 0.711 25468
1725 1 8 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.721 0.048 25468
1726 1 8 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.593 0.637 25468
1727 1 8 . 1 1 7 7 LYS H H 7 7.984 7.984 7.846 0.138 25468
1728 1 8 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.132 0.406 25468
1729 1 8 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.358 0.845 25468
1730 1 8 . 1 1 8 8 PRO CB C 8 31.855 31.855 31.897 -0.042 25468
1731 1 8 . 1 1 9 9 LEU N N 9 123.948 123.948 123.998 -0.050 25468
1732 1 8 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.422 0.065 25468
1733 1 8 . 1 1 9 9 LEU CA C 9 53.511 53.511 52.740 0.770 25468
1734 1 8 . 1 1 9 9 LEU CB C 9 46.759 46.759 43.904 2.855 25468
1735 1 8 . 1 1 9 9 LEU H H 9 7.801 7.801 7.624 0.177 25468
1736 1 8 . 1 1 10 10 LEU N N 10 130.176 130.176 128.497 1.679 25468
1737 1 8 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.769 -0.215 25468
1738 1 8 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.367 1.104 25468
1739 1 8 . 1 1 10 10 LEU CB C 10 42.103 42.103 42.352 -0.249 25468
1740 1 8 . 1 1 10 10 LEU H H 10 8.422 8.422 8.567 -0.145 25468
1741 1 8 . 1 1 11 11 ILE N N 11 120.839 120.839 123.144 -2.305 25468
1742 1 8 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.569 -0.183 25468
1743 1 8 . 1 1 11 11 ILE CA C 11 61.531 61.531 61.185 0.346 25468
1744 1 8 . 1 1 11 11 ILE CB C 11 39.357 39.357 39.107 0.250 25468
1745 1 8 . 1 1 11 11 ILE H H 11 8.289 8.289 8.872 -0.583 25468
1746 1 8 . 1 1 12 12 GLY N N 12 106.385 106.385 107.208 -0.823 25468
1747 1 8 . 1 1 12 12 GLY CA C 12 44.743 44.743 46.096 -1.353 25468
1748 1 8 . 1 1 12 12 GLY H H 12 7.125 7.125 7.632 -0.507 25468
1749 1 8 . 1 1 13 13 THR N N 13 110.566 110.566 110.658 -0.092 25468
1750 1 8 . 1 1 13 13 THR HA H 13 4.676 4.676 4.949 -0.273 25468
1751 1 8 . 1 1 13 13 THR CA C 13 62.119 62.119 59.797 2.322 25468
1752 1 8 . 1 1 13 13 THR CB C 13 71.115 71.115 71.612 -0.497 25468
1753 1 8 . 1 1 13 13 THR H H 13 9.046 9.046 7.621 1.425 25468
1754 1 8 . 1 1 14 14 CYS N N 14 117.216 117.216 121.370 -4.154 25468
1755 1 8 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.609 0.291 25468
1756 1 8 . 1 1 14 14 CYS CA C 14 58.201 58.201 61.150 -2.949 25468
1757 1 8 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.859 18.772 25468
1758 1 8 . 1 1 14 14 CYS H H 14 8.436 8.436 8.634 -0.198 25468
1759 1 8 . 1 1 15 15 ILE N N 15 118.247 118.247 119.500 -1.253 25468
1760 1 8 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.943 -0.057 25468
1761 1 8 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.046 0.255 25468
1762 1 8 . 1 1 15 15 ILE CB C 15 37.496 37.496 36.982 0.514 25468
1763 1 8 . 1 1 15 15 ILE H H 15 7.244 7.244 7.962 -0.718 25468
1764 1 8 . 1 1 16 16 GLU N N 16 119.649 119.649 117.109 2.540 25468
1765 1 8 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.298 -0.466 25468
1766 1 8 . 1 1 16 16 GLU CA C 16 57.902 57.902 56.427 1.475 25468
1767 1 8 . 1 1 16 16 GLU CB C 16 28.781 28.781 31.717 -2.936 25468
1768 1 8 . 1 1 16 16 GLU H H 16 7.066 7.066 8.047 -0.981 25468
1769 1 8 . 1 1 17 17 PHE N N 17 114.996 114.996 120.821 -5.825 25468
1770 1 8 . 1 1 17 17 PHE HA H 17 4.564 4.564 5.062 -0.498 25468
1771 1 8 . 1 1 17 17 PHE CA C 17 54.528 54.528 54.149 0.379 25468
1772 1 8 . 1 1 17 17 PHE CB C 17 39.890 39.890 38.728 1.162 25468
1773 1 8 . 1 1 17 17 PHE H H 17 8.148 8.148 8.202 -0.054 25468
1774 1 8 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.853 -0.000 25468
1775 1 8 . 1 1 18 18 PRO CA C 18 62.917 62.917 62.140 0.777 25468
1776 1 8 . 1 1 18 18 PRO CB C 18 31.868 31.868 33.173 -1.305 25468
1777 1 8 . 1 1 19 19 THR N N 19 114.536 114.536 112.413 2.123 25468
1778 1 8 . 1 1 19 19 THR HA H 19 3.650 3.650 3.856 -0.206 25468
1779 1 8 . 1 1 19 19 THR CA C 19 68.731 68.731 66.894 1.837 25468
1780 1 8 . 1 1 19 19 THR CB C 19 69.792 69.792 67.903 1.889 25468
1781 1 8 . 1 1 19 19 THR H H 19 8.370 8.370 8.716 -0.346 25468
1782 1 8 . 1 1 20 20 GLU N N 20 120.374 120.374 120.925 -0.551 25468
1783 1 8 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.046 0.147 25468
1784 1 8 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.666 0.379 25468
1785 1 8 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.290 -0.034 25468
1786 1 8 . 1 1 20 20 GLU H H 20 9.038 9.038 9.028 0.010 25468
1787 1 8 . 1 1 21 21 LYS N N 21 122.432 122.432 120.887 1.545 25468
1788 1 8 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.157 0.008 25468
1789 1 8 . 1 1 21 21 LYS CA C 21 59.210 59.210 58.830 0.380 25468
1790 1 8 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.437 0.690 25468
1791 1 8 . 1 1 21 21 LYS H H 21 7.622 7.622 7.950 -0.328 25468
1792 1 8 . 1 1 22 22 CYS N N 22 121.466 121.466 119.093 2.373 25468
1793 1 8 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.110 -0.025 25468
1794 1 8 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.559 -3.790 25468
1795 1 8 . 1 1 22 22 CYS CB C 22 36.594 36.594 25.959 10.635 25468
1796 1 8 . 1 1 22 22 CYS H H 22 9.356 9.356 8.727 0.629 25468
1797 1 8 . 1 1 23 23 ASN N N 23 115.604 115.604 118.674 -3.070 25468
1798 1 8 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.482 -0.437 25468
1799 1 8 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.290 1.577 25468
1800 1 8 . 1 1 23 23 ASN CB C 23 39.304 39.304 38.226 1.078 25468
1801 1 8 . 1 1 23 23 ASN H H 23 7.925 7.925 8.122 -0.197 25468
1802 1 8 . 1 1 24 24 LYS N N 24 116.665 116.665 120.779 -4.114 25468
1803 1 8 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.880 0.032 25468
1804 1 8 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.904 0.005 25468
1805 1 8 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.368 0.667 25468
1806 1 8 . 1 1 24 24 LYS H H 24 7.955 7.955 7.948 0.007 25468
1807 1 8 . 1 1 25 25 THR N N 25 116.759 116.759 115.869 0.890 25468
1808 1 8 . 1 1 25 25 THR HA H 25 3.859 3.859 4.045 -0.186 25468
1809 1 8 . 1 1 25 25 THR CA C 25 67.243 67.243 66.597 0.646 25468
1810 1 8 . 1 1 25 25 THR CB C 25 68.752 68.752 68.362 0.390 25468
1811 1 8 . 1 1 25 25 THR H H 25 8.518 8.518 8.651 -0.133 25468
1812 1 8 . 1 1 26 26 CYS N N 26 121.616 121.616 120.993 0.623 25468
1813 1 8 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.275 -0.016 25468
1814 1 8 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.959 -4.356 25468
1815 1 8 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.924 8.265 25468
1816 1 8 . 1 1 26 26 CYS H H 26 8.062 8.062 7.993 0.069 25468
1817 1 8 . 1 1 27 27 ILE N N 27 124.036 124.036 121.216 2.820 25468
1818 1 8 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.153 0.001 25468
1819 1 8 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.668 0.592 25468
1820 1 8 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.461 0.574 25468
1821 1 8 . 1 1 27 27 ILE H H 27 8.313 8.313 8.588 -0.275 25468
1822 1 8 . 1 1 28 28 GLU N N 28 121.780 121.780 120.592 1.188 25468
1823 1 8 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.199 -0.005 25468
1824 1 8 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.694 -0.197 25468
1825 1 8 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.015 -1.058 25468
1826 1 8 . 1 1 28 28 GLU H H 28 8.312 8.312 8.221 0.091 25468
1827 1 8 . 1 1 29 29 SER N N 29 114.001 114.001 115.738 -1.737 25468
1828 1 8 . 1 1 29 29 SER HA H 29 4.661 4.661 4.453 0.208 25468
1829 1 8 . 1 1 29 29 SER CA C 29 58.377 58.377 58.922 -0.545 25468
1830 1 8 . 1 1 29 29 SER CB C 29 63.484 63.484 63.103 0.381 25468
1831 1 8 . 1 1 29 29 SER H H 29 7.459 7.459 7.767 -0.308 25468
1832 1 8 . 1 1 30 30 ASN N N 30 112.213 112.213 117.371 -5.158 25468
1833 1 8 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.285 0.142 25468
1834 1 8 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.353 0.688 25468
1835 1 8 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.779 -0.435 25468
1836 1 8 . 1 1 30 30 ASN H H 30 8.067 8.067 7.673 0.394 25468
1837 1 8 . 1 1 31 31 PHE N N 31 116.306 116.306 115.103 1.203 25468
1838 1 8 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.716 -0.142 25468
1839 1 8 . 1 1 31 31 PHE CA C 31 57.969 57.969 56.773 1.196 25468
1840 1 8 . 1 1 31 31 PHE CB C 31 38.699 38.699 42.208 -3.509 25468
1841 1 8 . 1 1 31 31 PHE H H 31 7.861 7.861 7.903 -0.042 25468
1842 1 8 . 1 1 32 32 ALA N N 32 121.103 121.103 124.838 -3.735 25468
1843 1 8 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.317 -0.126 25468
1844 1 8 . 1 1 32 32 ALA CA C 32 53.586 53.586 52.445 1.141 25468
1845 1 8 . 1 1 32 32 ALA CB C 32 19.211 19.211 17.281 1.930 25468
1846 1 8 . 1 1 32 32 ALA H H 32 8.403 8.403 9.015 -0.612 25468
1847 1 8 . 1 1 33 33 GLY N N 33 100.820 100.820 106.981 -6.161 25468
1848 1 8 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.422 0.448 25468
1849 1 8 . 1 1 33 33 GLY H H 33 7.258 7.258 7.893 -0.635 25468
1850 1 8 . 1 1 34 34 GLY N N 34 108.312 108.312 106.018 2.294 25468
1851 1 8 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.580 1.857 25468
1852 1 8 . 1 1 34 34 GLY H H 34 8.978 8.978 8.380 0.598 25468
1853 1 8 . 1 1 35 35 LYS N N 35 119.929 119.929 115.972 3.957 25468
1854 1 8 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.796 -0.202 25468
1855 1 8 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.684 -0.029 25468
1856 1 8 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.294 1.990 25468
1857 1 8 . 1 1 35 35 LYS H H 35 8.756 8.756 8.313 0.443 25468
1858 1 8 . 1 1 36 36 CYS N N 36 119.831 119.831 119.904 -0.073 25468
1859 1 8 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.578 -0.214 25468
1860 1 8 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.437 -1.219 25468
1861 1 8 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.783 17.367 25468
1862 1 8 . 1 1 36 36 CYS H H 36 8.553 8.553 8.386 0.167 25468
1863 1 8 . 1 1 37 37 VAL N N 37 120.392 120.392 121.697 -1.305 25468
1864 1 8 . 1 1 37 37 VAL HA H 37 4.764 4.764 5.005 -0.241 25468
1865 1 8 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.282 0.965 25468
1866 1 8 . 1 1 37 37 VAL H H 37 9.587 9.587 8.626 0.961 25468
1867 1 8 . 1 1 38 38 HIS N N 38 118.311 118.311 118.507 -0.196 25468
1868 1 8 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.406 -0.366 25468
1869 1 8 . 1 1 38 38 HIS CA C 38 53.975 53.975 53.135 0.840 25468
1870 1 8 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.553 -2.073 25468
1871 1 8 . 1 1 38 38 HIS H H 38 8.698 8.698 7.754 0.944 25468
1872 1 8 . 1 1 39 39 ILE N N 39 124.114 124.114 122.170 1.944 25468
1873 1 8 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.163 0.139 25468
1874 1 8 . 1 1 39 39 ILE CA C 39 59.840 59.840 59.545 0.295 25468
1875 1 8 . 1 1 39 39 ILE CB C 39 38.709 38.709 37.225 1.484 25468
1876 1 8 . 1 1 39 39 ILE H H 39 8.969 8.969 8.582 0.387 25468
1877 1 8 . 1 1 40 40 GLY N N 40 115.080 115.080 117.716 -2.636 25468
1878 1 8 . 1 1 40 40 GLY CA C 40 46.226 46.226 47.459 -1.233 25468
1879 1 8 . 1 1 40 40 GLY H H 40 8.715 8.715 8.933 -0.218 25468
1880 1 8 . 1 1 41 41 GLN N N 41 121.798 121.798 120.035 1.763 25468
1881 1 8 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.463 -0.159 25468
1882 1 8 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.387 0.263 25468
1883 1 8 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.058 -0.578 25468
1884 1 8 . 1 1 41 41 GLN H H 41 8.672 8.672 8.190 0.482 25468
1885 1 8 . 1 1 42 42 SER N N 42 114.462 114.462 117.443 -2.981 25468
1886 1 8 . 1 1 42 42 SER HA H 42 4.347 4.347 4.365 -0.018 25468
1887 1 8 . 1 1 42 42 SER CA C 42 58.072 58.072 59.538 -1.466 25468
1888 1 8 . 1 1 42 42 SER CB C 42 64.037 64.037 63.522 0.515 25468
1889 1 8 . 1 1 42 42 SER H H 42 7.725 7.725 8.688 -0.963 25468
1890 1 8 . 1 1 43 43 LEU N N 43 124.166 124.166 119.165 5.001 25468
1891 1 8 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.756 0.194 25468
1892 1 8 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.595 -0.300 25468
1893 1 8 . 1 1 43 43 LEU CB C 43 41.400 41.400 40.826 0.574 25468
1894 1 8 . 1 1 43 43 LEU H H 43 8.576 8.576 7.966 0.610 25468
1895 1 8 . 1 1 44 44 ASP N N 44 118.797 118.797 118.735 0.062 25468
1896 1 8 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.603 0.128 25468
1897 1 8 . 1 1 44 44 ASP CB C 44 39.979 39.979 41.880 -1.901 25468
1898 1 8 . 1 1 44 44 ASP H H 44 8.163 8.163 7.877 0.286 25468
1899 1 8 . 1 1 45 45 PHE N N 45 123.595 123.595 124.470 -0.875 25468
1900 1 8 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.045 -0.125 25468
1901 1 8 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.207 0.400 25468
1902 1 8 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.525 0.558 25468
1903 1 8 . 1 1 45 45 PHE H H 45 9.042 9.042 8.767 0.275 25468
1904 1 8 . 1 1 46 46 VAL N N 46 119.357 119.357 117.743 1.614 25468
1905 1 8 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.843 -0.150 25468
1906 1 8 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.612 0.303 25468
1907 1 8 . 1 1 46 46 VAL CB C 46 34.666 34.666 34.199 0.467 25468
1908 1 8 . 1 1 46 46 VAL H H 46 9.555 9.555 8.789 0.766 25468
1909 1 8 . 1 1 47 47 CYS N N 47 122.793 122.793 126.301 -3.508 25468
1910 1 8 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.376 -0.546 25468
1911 1 8 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.383 12.347 25468
1912 1 8 . 1 1 47 47 CYS H H 47 9.044 9.044 8.791 0.253 25468
1913 1 8 . 1 1 48 48 VAL N N 48 129.864 129.864 129.479 0.385 25468
1914 1 8 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.169 -0.636 25468
1915 1 8 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.860 -0.043 25468
1916 1 8 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.510 -2.112 25468
1917 1 8 . 1 1 48 48 VAL H H 48 8.616 8.616 8.223 0.393 25468
1918 1 8 . 1 1 49 49 CYS N N 49 121.329 121.329 123.492 -2.163 25468
1919 1 8 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.230 -0.082 25468
1920 1 8 . 1 1 49 49 CYS CA C 49 50.429 50.429 57.653 -7.223 25468
1921 1 8 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.238 5.636 25468
1922 1 8 . 1 1 49 49 CYS H H 49 8.652 8.652 8.349 0.303 25468
1923 1 8 . 1 1 50 50 PHE N N 50 119.026 119.026 119.609 -0.583 25468
1924 1 8 . 1 1 50 50 PHE HA H 50 4.949 4.949 4.974 -0.025 25468
1925 1 8 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.317 -0.665 25468
1926 1 8 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.646 -1.053 25468
1927 1 8 . 1 1 50 50 PHE H H 50 8.472 8.472 9.284 -0.812 25468
1928 1 8 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.786 -0.054 25468
1929 1 8 . 1 1 51 51 PRO CB C 51 33.209 33.209 33.039 0.170 25468
1930 1 8 . 1 1 52 52 LYS N N 52 119.951 119.951 120.809 -0.858 25468
1931 1 8 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.248 -0.289 25468
1932 1 8 . 1 1 52 52 LYS CA C 52 57.670 57.670 57.870 -0.200 25468
1933 1 8 . 1 1 52 52 LYS CB C 52 33.225 33.225 31.321 1.904 25468
1934 1 8 . 1 1 52 52 LYS H H 52 8.681 8.681 8.858 -0.177 25468
1935 1 8 . 1 1 53 53 TYR N N 53 118.889 118.889 116.839 2.050 25468
1936 1 8 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.582 -0.111 25468
1937 1 8 . 1 1 53 53 TYR CA C 53 58.049 58.049 57.164 0.885 25468
1938 1 8 . 1 1 53 53 TYR CB C 53 38.268 38.268 38.260 0.008 25468
1939 1 8 . 1 1 53 53 TYR H H 53 8.215 8.215 7.986 0.229 25468
1940 1 8 . 1 1 54 54 TYR N N 54 121.087 121.087 123.261 -2.174 25468
1941 1 8 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.536 -0.042 25468
1942 1 8 . 1 1 54 54 TYR CA C 54 58.101 58.101 59.029 -0.928 25468
1943 1 8 . 1 1 54 54 TYR CB C 54 39.611 39.611 39.039 0.572 25468
1944 1 8 . 1 1 54 54 TYR H H 54 7.919 7.919 7.831 0.088 25468
1945 1 9 . 1 1 2 2 ASP N N 2 123.544 123.544 121.485 2.059 25468
1946 1 9 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.543 0.155 25468
1947 1 9 . 1 1 2 2 ASP CB C 2 39.907 39.907 40.932 -1.025 25468
1948 1 9 . 1 1 2 2 ASP H H 2 8.843 8.843 8.357 0.486 25468
1949 1 9 . 1 1 3 3 ILE N N 3 121.633 121.633 121.816 -0.183 25468
1950 1 9 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.061 0.097 25468
1951 1 9 . 1 1 3 3 ILE CA C 3 61.110 61.110 60.656 0.454 25468
1952 1 9 . 1 1 3 3 ILE CB C 3 39.038 39.038 38.156 0.882 25468
1953 1 9 . 1 1 3 3 ILE H H 3 8.356 8.356 7.621 0.735 25468
1954 1 9 . 1 1 4 4 ASP N N 4 124.028 124.028 126.298 -2.270 25468
1955 1 9 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.481 0.146 25468
1956 1 9 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.986 -2.211 25468
1957 1 9 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.502 -1.286 25468
1958 1 9 . 1 1 4 4 ASP H H 4 8.460 8.460 8.622 -0.162 25468
1959 1 9 . 1 1 5 5 GLY N N 5 110.531 110.531 107.077 3.454 25468
1960 1 9 . 1 1 5 5 GLY CA C 5 45.714 45.714 44.945 0.769 25468
1961 1 9 . 1 1 5 5 GLY H H 5 8.405 8.405 8.274 0.131 25468
1962 1 9 . 1 1 6 6 ARG N N 6 119.193 119.193 120.549 -1.356 25468
1963 1 9 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.511 -0.164 25468
1964 1 9 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.292 1.955 25468
1965 1 9 . 1 1 6 6 ARG CB C 6 31.089 31.089 29.715 1.374 25468
1966 1 9 . 1 1 6 6 ARG H H 6 8.128 8.128 7.648 0.480 25468
1967 1 9 . 1 1 7 7 LYS N N 7 120.971 120.971 119.582 1.389 25468
1968 1 9 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.611 0.158 25468
1969 1 9 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.402 0.828 25468
1970 1 9 . 1 1 7 7 LYS H H 7 7.984 7.984 7.725 0.259 25468
1971 1 9 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.315 0.223 25468
1972 1 9 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.352 0.851 25468
1973 1 9 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.226 -0.371 25468
1974 1 9 . 1 1 9 9 LEU N N 9 123.948 123.948 123.556 0.392 25468
1975 1 9 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.425 0.062 25468
1976 1 9 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.311 0.200 25468
1977 1 9 . 1 1 9 9 LEU CB C 9 46.759 46.759 43.632 3.127 25468
1978 1 9 . 1 1 9 9 LEU H H 9 7.801 7.801 7.993 -0.192 25468
1979 1 9 . 1 1 10 10 LEU N N 10 130.176 130.176 128.455 1.721 25468
1980 1 9 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.738 -0.184 25468
1981 1 9 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.383 1.088 25468
1982 1 9 . 1 1 10 10 LEU CB C 10 42.103 42.103 42.280 -0.177 25468
1983 1 9 . 1 1 10 10 LEU H H 10 8.422 8.422 8.506 -0.084 25468
1984 1 9 . 1 1 11 11 ILE N N 11 120.839 120.839 122.630 -1.791 25468
1985 1 9 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.480 -0.094 25468
1986 1 9 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.978 0.553 25468
1987 1 9 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.850 0.507 25468
1988 1 9 . 1 1 11 11 ILE H H 11 8.289 8.289 8.502 -0.213 25468
1989 1 9 . 1 1 12 12 GLY N N 12 106.385 106.385 106.897 -0.512 25468
1990 1 9 . 1 1 12 12 GLY CA C 12 44.743 44.743 46.093 -1.350 25468
1991 1 9 . 1 1 12 12 GLY H H 12 7.125 7.125 7.583 -0.458 25468
1992 1 9 . 1 1 13 13 THR N N 13 110.566 110.566 111.000 -0.434 25468
1993 1 9 . 1 1 13 13 THR HA H 13 4.676 4.676 4.994 -0.318 25468
1994 1 9 . 1 1 13 13 THR CA C 13 62.119 62.119 59.821 2.298 25468
1995 1 9 . 1 1 13 13 THR CB C 13 71.115 71.115 71.786 -0.671 25468
1996 1 9 . 1 1 13 13 THR H H 13 9.046 9.046 8.032 1.014 25468
1997 1 9 . 1 1 14 14 CYS N N 14 117.216 117.216 121.019 -3.803 25468
1998 1 9 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.720 0.180 25468
1999 1 9 . 1 1 14 14 CYS CA C 14 58.201 58.201 60.839 -2.638 25468
2000 1 9 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.713 18.918 25468
2001 1 9 . 1 1 14 14 CYS H H 14 8.436 8.436 8.714 -0.278 25468
2002 1 9 . 1 1 15 15 ILE N N 15 118.247 118.247 119.334 -1.087 25468
2003 1 9 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.985 -0.099 25468
2004 1 9 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.052 0.249 25468
2005 1 9 . 1 1 15 15 ILE CB C 15 37.496 37.496 37.191 0.305 25468
2006 1 9 . 1 1 15 15 ILE H H 15 7.244 7.244 7.634 -0.390 25468
2007 1 9 . 1 1 16 16 GLU N N 16 119.649 119.649 118.080 1.569 25468
2008 1 9 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.219 -0.386 25468
2009 1 9 . 1 1 16 16 GLU CA C 16 57.902 57.902 56.344 1.558 25468
2010 1 9 . 1 1 16 16 GLU CB C 16 28.781 28.781 31.632 -2.851 25468
2011 1 9 . 1 1 16 16 GLU H H 16 7.066 7.066 8.059 -0.993 25468
2012 1 9 . 1 1 17 17 PHE N N 17 114.996 114.996 121.093 -6.097 25468
2013 1 9 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.993 -0.429 25468
2014 1 9 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.385 -0.857 25468
2015 1 9 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.627 0.263 25468
2016 1 9 . 1 1 17 17 PHE H H 17 8.148 8.148 8.129 0.019 25468
2017 1 9 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.691 0.162 25468
2018 1 9 . 1 1 18 18 PRO CA C 18 62.917 62.917 62.441 0.477 25468
2019 1 9 . 1 1 18 18 PRO CB C 18 31.868 31.868 33.029 -1.161 25468
2020 1 9 . 1 1 19 19 THR N N 19 114.536 114.536 114.959 -0.423 25468
2021 1 9 . 1 1 19 19 THR HA H 19 3.650 3.650 3.873 -0.223 25468
2022 1 9 . 1 1 19 19 THR CA C 19 68.731 68.731 68.372 0.359 25468
2023 1 9 . 1 1 19 19 THR CB C 19 69.792 69.792 68.616 1.176 25468
2024 1 9 . 1 1 19 19 THR H H 19 8.370 8.370 8.595 -0.225 25468
2025 1 9 . 1 1 20 20 GLU N N 20 120.374 120.374 120.720 -0.346 25468
2026 1 9 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.109 0.084 25468
2027 1 9 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.889 0.156 25468
2028 1 9 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.408 -0.152 25468
2029 1 9 . 1 1 20 20 GLU H H 20 9.038 9.038 8.806 0.232 25468
2030 1 9 . 1 1 21 21 LYS N N 21 122.432 122.432 120.648 1.784 25468
2031 1 9 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.063 0.102 25468
2032 1 9 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.684 -0.474 25468
2033 1 9 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.298 0.829 25468
2034 1 9 . 1 1 21 21 LYS H H 21 7.622 7.622 8.182 -0.560 25468
2035 1 9 . 1 1 22 22 CYS N N 22 121.466 121.466 120.322 1.144 25468
2036 1 9 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.045 0.040 25468
2037 1 9 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.137 -3.368 25468
2038 1 9 . 1 1 22 22 CYS CB C 22 36.594 36.594 25.917 10.677 25468
2039 1 9 . 1 1 22 22 CYS H H 22 9.356 9.356 8.713 0.643 25468
2040 1 9 . 1 1 23 23 ASN N N 23 115.604 115.604 118.818 -3.214 25468
2041 1 9 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.488 -0.443 25468
2042 1 9 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.344 1.522 25468
2043 1 9 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.840 1.464 25468
2044 1 9 . 1 1 23 23 ASN H H 23 7.925 7.925 8.451 -0.526 25468
2045 1 9 . 1 1 24 24 LYS N N 24 116.665 116.665 121.101 -4.436 25468
2046 1 9 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.960 -0.048 25468
2047 1 9 . 1 1 24 24 LYS CA C 24 59.909 59.909 60.025 -0.116 25468
2048 1 9 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.286 0.749 25468
2049 1 9 . 1 1 24 24 LYS H H 24 7.955 7.955 8.622 -0.667 25468
2050 1 9 . 1 1 25 25 THR N N 25 116.759 116.759 115.615 1.144 25468
2051 1 9 . 1 1 25 25 THR HA H 25 3.859 3.859 4.058 -0.199 25468
2052 1 9 . 1 1 25 25 THR CA C 25 67.243 67.243 66.311 0.932 25468
2053 1 9 . 1 1 25 25 THR CB C 25 68.752 68.752 68.378 0.374 25468
2054 1 9 . 1 1 25 25 THR H H 25 8.518 8.518 8.700 -0.182 25468
2055 1 9 . 1 1 26 26 CYS N N 26 121.616 121.616 120.392 1.224 25468
2056 1 9 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.162 0.097 25468
2057 1 9 . 1 1 26 26 CYS CA C 26 57.603 57.603 62.048 -4.445 25468
2058 1 9 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.903 8.286 25468
2059 1 9 . 1 1 26 26 CYS H H 26 8.062 8.062 7.410 0.652 25468
2060 1 9 . 1 1 27 27 ILE N N 27 124.036 124.036 120.446 3.590 25468
2061 1 9 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.181 -0.027 25468
2062 1 9 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.519 0.741 25468
2063 1 9 . 1 1 27 27 ILE CB C 27 38.035 38.035 36.979 1.056 25468
2064 1 9 . 1 1 27 27 ILE H H 27 8.313 8.313 8.428 -0.115 25468
2065 1 9 . 1 1 28 28 GLU N N 28 121.780 121.780 120.750 1.030 25468
2066 1 9 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.149 0.045 25468
2067 1 9 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.959 -0.462 25468
2068 1 9 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.162 -1.205 25468
2069 1 9 . 1 1 28 28 GLU H H 28 8.312 8.312 7.816 0.496 25468
2070 1 9 . 1 1 29 29 SER N N 29 114.001 114.001 112.607 1.394 25468
2071 1 9 . 1 1 29 29 SER HA H 29 4.661 4.661 4.449 0.212 25468
2072 1 9 . 1 1 29 29 SER CA C 29 58.377 58.377 59.478 -1.101 25468
2073 1 9 . 1 1 29 29 SER CB C 29 63.484 63.484 63.278 0.206 25468
2074 1 9 . 1 1 29 29 SER H H 29 7.459 7.459 7.573 -0.114 25468
2075 1 9 . 1 1 30 30 ASN N N 30 112.213 112.213 115.041 -2.828 25468
2076 1 9 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.578 -0.151 25468
2077 1 9 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.351 0.690 25468
2078 1 9 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.843 -0.499 25468
2079 1 9 . 1 1 30 30 ASN H H 30 8.067 8.067 7.955 0.112 25468
2080 1 9 . 1 1 31 31 PHE N N 31 116.306 116.306 117.794 -1.488 25468
2081 1 9 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.677 -0.103 25468
2082 1 9 . 1 1 31 31 PHE CA C 31 57.969 57.969 56.615 1.354 25468
2083 1 9 . 1 1 31 31 PHE CB C 31 38.699 38.699 41.214 -2.515 25468
2084 1 9 . 1 1 31 31 PHE H H 31 7.861 7.861 8.098 -0.236 25468
2085 1 9 . 1 1 32 32 ALA N N 32 121.103 121.103 123.289 -2.186 25468
2086 1 9 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.343 -0.152 25468
2087 1 9 . 1 1 32 32 ALA CA C 32 53.586 53.586 52.662 0.924 25468
2088 1 9 . 1 1 32 32 ALA CB C 32 19.211 19.211 18.006 1.206 25468
2089 1 9 . 1 1 32 32 ALA H H 32 8.403 8.403 9.071 -0.668 25468
2090 1 9 . 1 1 33 33 GLY N N 33 100.820 100.820 105.720 -4.900 25468
2091 1 9 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.411 0.459 25468
2092 1 9 . 1 1 33 33 GLY H H 33 7.258 7.258 7.587 -0.329 25468
2093 1 9 . 1 1 34 34 GLY N N 34 108.312 108.312 105.763 2.549 25468
2094 1 9 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.375 2.062 25468
2095 1 9 . 1 1 34 34 GLY H H 34 8.978 8.978 8.330 0.648 25468
2096 1 9 . 1 1 35 35 LYS N N 35 119.929 119.929 116.841 3.088 25468
2097 1 9 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.834 -0.240 25468
2098 1 9 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.594 0.061 25468
2099 1 9 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.519 1.765 25468
2100 1 9 . 1 1 35 35 LYS H H 35 8.756 8.756 8.281 0.475 25468
2101 1 9 . 1 1 36 36 CYS N N 36 119.831 119.831 120.013 -0.182 25468
2102 1 9 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.606 -0.242 25468
2103 1 9 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.833 -1.615 25468
2104 1 9 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.490 17.660 25468
2105 1 9 . 1 1 36 36 CYS H H 36 8.553 8.553 8.645 -0.092 25468
2106 1 9 . 1 1 37 37 VAL N N 37 120.392 120.392 122.517 -2.125 25468
2107 1 9 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.875 -0.111 25468
2108 1 9 . 1 1 37 37 VAL CB C 37 36.247 36.247 34.679 1.568 25468
2109 1 9 . 1 1 37 37 VAL H H 37 9.587 9.587 8.625 0.962 25468
2110 1 9 . 1 1 38 38 HIS N N 38 118.311 118.311 118.072 0.239 25468
2111 1 9 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.502 -0.462 25468
2112 1 9 . 1 1 38 38 HIS CA C 38 53.975 53.975 53.074 0.901 25468
2113 1 9 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.697 -2.217 25468
2114 1 9 . 1 1 38 38 HIS H H 38 8.698 8.698 7.565 1.133 25468
2115 1 9 . 1 1 39 39 ILE N N 39 124.114 124.114 121.884 2.230 25468
2116 1 9 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.268 0.034 25468
2117 1 9 . 1 1 39 39 ILE CA C 39 59.840 59.840 60.670 -0.830 25468
2118 1 9 . 1 1 39 39 ILE CB C 39 38.709 38.709 40.216 -1.507 25468
2119 1 9 . 1 1 39 39 ILE H H 39 8.969 8.969 8.641 0.328 25468
2120 1 9 . 1 1 40 40 GLY N N 40 115.080 115.080 117.601 -2.521 25468
2121 1 9 . 1 1 40 40 GLY CA C 40 46.226 46.226 47.124 -0.898 25468
2122 1 9 . 1 1 40 40 GLY H H 40 8.715 8.715 8.924 -0.209 25468
2123 1 9 . 1 1 41 41 GLN N N 41 121.798 121.798 122.282 -0.484 25468
2124 1 9 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.450 -0.146 25468
2125 1 9 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.628 0.022 25468
2126 1 9 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.489 -1.010 25468
2127 1 9 . 1 1 41 41 GLN H H 41 8.672 8.672 8.317 0.355 25468
2128 1 9 . 1 1 42 42 SER N N 42 114.462 114.462 116.444 -1.982 25468
2129 1 9 . 1 1 42 42 SER HA H 42 4.347 4.347 4.430 -0.083 25468
2130 1 9 . 1 1 42 42 SER CA C 42 58.072 58.072 58.757 -0.685 25468
2131 1 9 . 1 1 42 42 SER CB C 42 64.037 64.037 63.480 0.557 25468
2132 1 9 . 1 1 42 42 SER H H 42 7.725 7.725 8.550 -0.825 25468
2133 1 9 . 1 1 43 43 LEU N N 43 124.166 124.166 120.178 3.988 25468
2134 1 9 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.733 0.217 25468
2135 1 9 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.483 -0.188 25468
2136 1 9 . 1 1 43 43 LEU CB C 43 41.400 41.400 41.374 0.026 25468
2137 1 9 . 1 1 43 43 LEU H H 43 8.576 8.576 7.997 0.579 25468
2138 1 9 . 1 1 44 44 ASP N N 44 118.797 118.797 118.735 0.062 25468
2139 1 9 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.591 0.140 25468
2140 1 9 . 1 1 44 44 ASP CB C 44 39.979 39.979 41.899 -1.920 25468
2141 1 9 . 1 1 44 44 ASP H H 44 8.163 8.163 7.867 0.296 25468
2142 1 9 . 1 1 45 45 PHE N N 45 123.595 123.595 123.748 -0.153 25468
2143 1 9 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.093 -0.173 25468
2144 1 9 . 1 1 45 45 PHE CA C 45 57.607 57.607 56.845 0.762 25468
2145 1 9 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.716 0.367 25468
2146 1 9 . 1 1 45 45 PHE H H 45 9.042 9.042 8.710 0.332 25468
2147 1 9 . 1 1 46 46 VAL N N 46 119.357 119.357 119.778 -0.421 25468
2148 1 9 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.820 -0.127 25468
2149 1 9 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.710 0.205 25468
2150 1 9 . 1 1 46 46 VAL CB C 46 34.666 34.666 33.650 1.016 25468
2151 1 9 . 1 1 46 46 VAL H H 46 9.555 9.555 8.667 0.888 25468
2152 1 9 . 1 1 47 47 CYS N N 47 122.793 122.793 127.168 -4.375 25468
2153 1 9 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.360 -0.530 25468
2154 1 9 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.512 12.218 25468
2155 1 9 . 1 1 47 47 CYS H H 47 9.044 9.044 8.579 0.465 25468
2156 1 9 . 1 1 48 48 VAL N N 48 129.864 129.864 128.639 1.225 25468
2157 1 9 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.173 -0.640 25468
2158 1 9 . 1 1 48 48 VAL CA C 48 59.817 59.817 58.978 0.839 25468
2159 1 9 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.461 -2.063 25468
2160 1 9 . 1 1 48 48 VAL H H 48 8.616 8.616 8.006 0.610 25468
2161 1 9 . 1 1 49 49 CYS N N 49 121.329 121.329 122.229 -0.900 25468
2162 1 9 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.083 0.065 25468
2163 1 9 . 1 1 49 49 CYS CA C 49 50.429 50.429 57.401 -6.972 25468
2164 1 9 . 1 1 49 49 CYS CB C 49 33.873 33.873 29.175 4.698 25468
2165 1 9 . 1 1 49 49 CYS H H 49 8.652 8.652 7.790 0.862 25468
2166 1 9 . 1 1 50 50 PHE N N 50 119.026 119.026 118.772 0.254 25468
2167 1 9 . 1 1 50 50 PHE HA H 50 4.949 4.949 4.997 -0.048 25468
2168 1 9 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.244 -0.592 25468
2169 1 9 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.553 -0.961 25468
2170 1 9 . 1 1 50 50 PHE H H 50 8.472 8.472 8.930 -0.458 25468
2171 1 9 . 1 1 51 51 PRO HA H 51 4.732 4.732 3.642 1.090 25468
2172 1 9 . 1 1 51 51 PRO CB C 51 33.209 33.209 31.765 1.444 25468
2173 1 9 . 1 1 52 52 LYS N N 52 119.951 119.951 123.992 -4.041 25468
2174 1 9 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.305 -0.346 25468
2175 1 9 . 1 1 52 52 LYS CA C 52 57.670 57.670 57.370 0.300 25468
2176 1 9 . 1 1 52 52 LYS CB C 52 33.225 33.225 34.107 -0.882 25468
2177 1 9 . 1 1 52 52 LYS H H 52 8.681 8.681 8.431 0.250 25468
2178 1 9 . 1 1 53 53 TYR N N 53 118.889 118.889 114.573 4.316 25468
2179 1 9 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.762 -0.291 25468
2180 1 9 . 1 1 53 53 TYR CA C 53 58.049 58.049 55.248 2.801 25468
2181 1 9 . 1 1 53 53 TYR CB C 53 38.268 38.268 38.216 0.052 25468
2182 1 9 . 1 1 53 53 TYR H H 53 8.215 8.215 7.838 0.377 25468
2183 1 9 . 1 1 54 54 TYR N N 54 121.087 121.087 124.601 -3.514 25468
2184 1 9 . 1 1 54 54 TYR HA H 54 4.494 4.494 3.985 0.509 25468
2185 1 9 . 1 1 54 54 TYR CA C 54 58.101 58.101 59.156 -1.055 25468
2186 1 9 . 1 1 54 54 TYR CB C 54 39.611 39.611 36.712 2.899 25468
2187 1 9 . 1 1 54 54 TYR H H 54 7.919 7.919 7.737 0.182 25468
2188 1 10 . 1 1 2 2 ASP N N 2 123.544 123.544 120.399 3.145 25468
2189 1 10 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.546 0.152 25468
2190 1 10 . 1 1 2 2 ASP CB C 2 39.907 39.907 40.809 -0.902 25468
2191 1 10 . 1 1 2 2 ASP H H 2 8.843 8.843 8.534 0.309 25468
2192 1 10 . 1 1 3 3 ILE N N 3 121.633 121.633 115.593 6.040 25468
2193 1 10 . 1 1 3 3 ILE HA H 3 4.158 4.158 3.964 0.194 25468
2194 1 10 . 1 1 3 3 ILE CA C 3 61.110 61.110 60.827 0.283 25468
2195 1 10 . 1 1 3 3 ILE CB C 3 39.038 39.038 38.651 0.387 25468
2196 1 10 . 1 1 3 3 ILE H H 3 8.356 8.356 7.310 1.046 25468
2197 1 10 . 1 1 4 4 ASP N N 4 124.028 124.028 121.571 2.457 25468
2198 1 10 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.351 0.276 25468
2199 1 10 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.273 -1.497 25468
2200 1 10 . 1 1 4 4 ASP CB C 4 40.216 40.216 40.837 -0.621 25468
2201 1 10 . 1 1 4 4 ASP H H 4 8.460 8.460 8.452 0.008 25468
2202 1 10 . 1 1 5 5 GLY N N 5 110.531 110.531 108.277 2.254 25468
2203 1 10 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.270 0.444 25468
2204 1 10 . 1 1 5 5 GLY H H 5 8.405 8.405 8.186 0.219 25468
2205 1 10 . 1 1 6 6 ARG N N 6 119.193 119.193 118.076 1.117 25468
2206 1 10 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.537 -0.190 25468
2207 1 10 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.794 1.452 25468
2208 1 10 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.032 1.057 25468
2209 1 10 . 1 1 6 6 ARG H H 6 8.128 8.128 8.351 -0.223 25468
2210 1 10 . 1 1 7 7 LYS N N 7 120.971 120.971 119.917 1.054 25468
2211 1 10 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.777 -0.008 25468
2212 1 10 . 1 1 7 7 LYS CB C 7 33.230 33.230 33.539 -0.309 25468
2213 1 10 . 1 1 7 7 LYS H H 7 7.984 7.984 7.680 0.304 25468
2214 1 10 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.450 0.088 25468
2215 1 10 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.423 0.780 25468
2216 1 10 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.504 -0.649 25468
2217 1 10 . 1 1 9 9 LEU N N 9 123.948 123.948 121.600 2.348 25468
2218 1 10 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.576 -0.089 25468
2219 1 10 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.516 -0.005 25468
2220 1 10 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.542 2.217 25468
2221 1 10 . 1 1 9 9 LEU H H 9 7.801 7.801 7.793 0.008 25468
2222 1 10 . 1 1 10 10 LEU N N 10 130.176 130.176 128.131 2.045 25468
2223 1 10 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.726 -0.172 25468
2224 1 10 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.798 0.673 25468
2225 1 10 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.252 -1.149 25468
2226 1 10 . 1 1 10 10 LEU H H 10 8.422 8.422 8.592 -0.170 25468
2227 1 10 . 1 1 11 11 ILE N N 11 120.839 120.839 121.272 -0.433 25468
2228 1 10 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.601 -0.215 25468
2229 1 10 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.687 0.844 25468
2230 1 10 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.956 0.401 25468
2231 1 10 . 1 1 11 11 ILE H H 11 8.289 8.289 8.462 -0.173 25468
2232 1 10 . 1 1 12 12 GLY N N 12 106.385 106.385 107.493 -1.108 25468
2233 1 10 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.923 -1.180 25468
2234 1 10 . 1 1 12 12 GLY H H 12 7.125 7.125 7.486 -0.361 25468
2235 1 10 . 1 1 13 13 THR N N 13 110.566 110.566 112.428 -1.862 25468
2236 1 10 . 1 1 13 13 THR HA H 13 4.676 4.676 4.829 -0.153 25468
2237 1 10 . 1 1 13 13 THR CA C 13 62.119 62.119 60.433 1.686 25468
2238 1 10 . 1 1 13 13 THR CB C 13 71.115 71.115 70.936 0.179 25468
2239 1 10 . 1 1 13 13 THR H H 13 9.046 9.046 8.258 0.788 25468
2240 1 10 . 1 1 14 14 CYS N N 14 117.216 117.216 121.381 -4.165 25468
2241 1 10 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.570 0.330 25468
2242 1 10 . 1 1 14 14 CYS CA C 14 58.201 58.201 59.378 -1.177 25468
2243 1 10 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.310 19.321 25468
2244 1 10 . 1 1 14 14 CYS H H 14 8.436 8.436 8.564 -0.128 25468
2245 1 10 . 1 1 15 15 ILE N N 15 118.247 118.247 120.384 -2.137 25468
2246 1 10 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.896 -0.010 25468
2247 1 10 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.791 -0.490 25468
2248 1 10 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.335 -0.839 25468
2249 1 10 . 1 1 15 15 ILE H H 15 7.244 7.244 7.817 -0.573 25468
2250 1 10 . 1 1 16 16 GLU N N 16 119.649 119.649 118.670 0.979 25468
2251 1 10 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.063 -0.230 25468
2252 1 10 . 1 1 16 16 GLU CA C 16 57.902 57.902 57.464 0.438 25468
2253 1 10 . 1 1 16 16 GLU CB C 16 28.781 28.781 30.158 -1.377 25468
2254 1 10 . 1 1 16 16 GLU H H 16 7.066 7.066 7.689 -0.623 25468
2255 1 10 . 1 1 17 17 PHE N N 17 114.996 114.996 120.297 -5.301 25468
2256 1 10 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.957 -0.393 25468
2257 1 10 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.155 -0.627 25468
2258 1 10 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.385 0.505 25468
2259 1 10 . 1 1 17 17 PHE H H 17 8.148 8.148 7.514 0.634 25468
2260 1 10 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.481 0.372 25468
2261 1 10 . 1 1 18 18 PRO CA C 18 62.917 62.917 63.311 -0.394 25468
2262 1 10 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.285 -0.417 25468
2263 1 10 . 1 1 19 19 THR N N 19 114.536 114.536 113.352 1.184 25468
2264 1 10 . 1 1 19 19 THR HA H 19 3.650 3.650 3.883 -0.233 25468
2265 1 10 . 1 1 19 19 THR CA C 19 68.731 68.731 66.620 2.111 25468
2266 1 10 . 1 1 19 19 THR CB C 19 69.792 69.792 68.339 1.453 25468
2267 1 10 . 1 1 19 19 THR H H 19 8.370 8.370 8.642 -0.272 25468
2268 1 10 . 1 1 20 20 GLU N N 20 120.374 120.374 120.443 -0.069 25468
2269 1 10 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.144 0.049 25468
2270 1 10 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.811 0.234 25468
2271 1 10 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.591 -0.335 25468
2272 1 10 . 1 1 20 20 GLU H H 20 9.038 9.038 8.973 0.065 25468
2273 1 10 . 1 1 21 21 LYS N N 21 122.432 122.432 121.142 1.290 25468
2274 1 10 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.087 0.078 25468
2275 1 10 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.811 -0.601 25468
2276 1 10 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.257 0.870 25468
2277 1 10 . 1 1 21 21 LYS H H 21 7.622 7.622 8.110 -0.488 25468
2278 1 10 . 1 1 22 22 CYS N N 22 121.466 121.466 119.534 1.932 25468
2279 1 10 . 1 1 22 22 CYS HA H 22 4.085 4.085 3.941 0.144 25468
2280 1 10 . 1 1 22 22 CYS CA C 22 58.769 58.769 63.323 -4.554 25468
2281 1 10 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.337 10.257 25468
2282 1 10 . 1 1 22 22 CYS H H 22 9.356 9.356 8.840 0.516 25468
2283 1 10 . 1 1 23 23 ASN N N 23 115.604 115.604 118.378 -2.774 25468
2284 1 10 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.453 -0.408 25468
2285 1 10 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.406 1.461 25468
2286 1 10 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.812 1.492 25468
2287 1 10 . 1 1 23 23 ASN H H 23 7.925 7.925 8.061 -0.136 25468
2288 1 10 . 1 1 24 24 LYS N N 24 116.665 116.665 121.195 -4.530 25468
2289 1 10 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.971 -0.059 25468
2290 1 10 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.815 0.094 25468
2291 1 10 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.210 0.825 25468
2292 1 10 . 1 1 24 24 LYS H H 24 7.955 7.955 8.607 -0.652 25468
2293 1 10 . 1 1 25 25 THR N N 25 116.759 116.759 116.035 0.724 25468
2294 1 10 . 1 1 25 25 THR HA H 25 3.859 3.859 4.213 -0.354 25468
2295 1 10 . 1 1 25 25 THR CA C 25 67.243 67.243 66.756 0.487 25468
2296 1 10 . 1 1 25 25 THR CB C 25 68.752 68.752 68.406 0.346 25468
2297 1 10 . 1 1 25 25 THR H H 25 8.518 8.518 8.424 0.094 25468
2298 1 10 . 1 1 26 26 CYS N N 26 121.616 121.616 120.820 0.796 25468
2299 1 10 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.261 -0.002 25468
2300 1 10 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.164 -3.561 25468
2301 1 10 . 1 1 26 26 CYS CB C 26 34.189 34.189 26.013 8.176 25468
2302 1 10 . 1 1 26 26 CYS H H 26 8.062 8.062 7.478 0.584 25468
2303 1 10 . 1 1 27 27 ILE N N 27 124.036 124.036 121.020 3.016 25468
2304 1 10 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.014 0.140 25468
2305 1 10 . 1 1 27 27 ILE CA C 27 65.260 65.260 65.050 0.210 25468
2306 1 10 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.502 0.533 25468
2307 1 10 . 1 1 27 27 ILE H H 27 8.313 8.313 8.501 -0.188 25468
2308 1 10 . 1 1 28 28 GLU N N 28 121.780 121.780 119.681 2.099 25468
2309 1 10 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.095 0.099 25468
2310 1 10 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.737 -0.240 25468
2311 1 10 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.028 -1.071 25468
2312 1 10 . 1 1 28 28 GLU H H 28 8.312 8.312 8.491 -0.179 25468
2313 1 10 . 1 1 29 29 SER N N 29 114.001 114.001 114.002 -0.001 25468
2314 1 10 . 1 1 29 29 SER HA H 29 4.661 4.661 4.425 0.236 25468
2315 1 10 . 1 1 29 29 SER CA C 29 58.377 58.377 59.861 -1.484 25468
2316 1 10 . 1 1 29 29 SER CB C 29 63.484 63.484 63.341 0.143 25468
2317 1 10 . 1 1 29 29 SER H H 29 7.459 7.459 7.783 -0.324 25468
2318 1 10 . 1 1 30 30 ASN N N 30 112.213 112.213 116.195 -3.982 25468
2319 1 10 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.479 -0.052 25468
2320 1 10 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.909 0.132 25468
2321 1 10 . 1 1 30 30 ASN CB C 30 36.344 36.344 37.268 -0.924 25468
2322 1 10 . 1 1 30 30 ASN H H 30 8.067 8.067 7.750 0.317 25468
2323 1 10 . 1 1 31 31 PHE N N 31 116.306 116.306 117.886 -1.580 25468
2324 1 10 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.572 0.002 25468
2325 1 10 . 1 1 31 31 PHE CA C 31 57.969 57.969 57.291 0.678 25468
2326 1 10 . 1 1 31 31 PHE CB C 31 38.699 38.699 39.967 -1.268 25468
2327 1 10 . 1 1 31 31 PHE H H 31 7.861 7.861 8.175 -0.314 25468
2328 1 10 . 1 1 32 32 ALA N N 32 121.103 121.103 122.868 -1.765 25468
2329 1 10 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.270 -0.079 25468
2330 1 10 . 1 1 32 32 ALA CA C 32 53.586 53.586 53.508 0.078 25468
2331 1 10 . 1 1 32 32 ALA CB C 32 19.211 19.211 19.495 -0.284 25468
2332 1 10 . 1 1 32 32 ALA H H 32 8.403 8.403 8.864 -0.461 25468
2333 1 10 . 1 1 33 33 GLY N N 33 100.820 100.820 104.957 -4.137 25468
2334 1 10 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.671 0.199 25468
2335 1 10 . 1 1 33 33 GLY H H 33 7.258 7.258 7.671 -0.413 25468
2336 1 10 . 1 1 34 34 GLY N N 34 108.312 108.312 105.635 2.677 25468
2337 1 10 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.042 2.395 25468
2338 1 10 . 1 1 34 34 GLY H H 34 8.978 8.978 8.381 0.597 25468
2339 1 10 . 1 1 35 35 LYS N N 35 119.929 119.929 118.709 1.220 25468
2340 1 10 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.852 -0.258 25468
2341 1 10 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.734 -0.079 25468
2342 1 10 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.586 1.698 25468
2343 1 10 . 1 1 35 35 LYS H H 35 8.756 8.756 8.167 0.589 25468
2344 1 10 . 1 1 36 36 CYS N N 36 119.831 119.831 120.636 -0.805 25468
2345 1 10 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.571 -0.207 25468
2346 1 10 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.010 -0.792 25468
2347 1 10 . 1 1 36 36 CYS CB C 36 44.150 44.150 25.983 18.167 25468
2348 1 10 . 1 1 36 36 CYS H H 36 8.553 8.553 8.673 -0.120 25468
2349 1 10 . 1 1 37 37 VAL N N 37 120.392 120.392 120.789 -0.397 25468
2350 1 10 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.772 -0.008 25468
2351 1 10 . 1 1 37 37 VAL CB C 37 36.247 36.247 34.824 1.423 25468
2352 1 10 . 1 1 37 37 VAL H H 37 9.587 9.587 8.779 0.808 25468
2353 1 10 . 1 1 38 38 HIS N N 38 118.311 118.311 118.479 -0.168 25468
2354 1 10 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.462 -0.422 25468
2355 1 10 . 1 1 38 38 HIS CA C 38 53.975 53.975 54.708 -0.733 25468
2356 1 10 . 1 1 38 38 HIS CB C 38 29.480 29.480 32.381 -2.901 25468
2357 1 10 . 1 1 38 38 HIS H H 38 8.698 8.698 8.217 0.481 25468
2358 1 10 . 1 1 39 39 ILE N N 39 124.114 124.114 121.348 2.766 25468
2359 1 10 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.232 0.070 25468
2360 1 10 . 1 1 39 39 ILE CA C 39 59.840 59.840 61.027 -1.187 25468
2361 1 10 . 1 1 39 39 ILE CB C 39 38.709 38.709 39.905 -1.196 25468
2362 1 10 . 1 1 39 39 ILE H H 39 8.969 8.969 8.760 0.209 25468
2363 1 10 . 1 1 40 40 GLY N N 40 115.080 115.080 114.905 0.175 25468
2364 1 10 . 1 1 40 40 GLY CA C 40 46.226 46.226 45.357 0.869 25468
2365 1 10 . 1 1 40 40 GLY H H 40 8.715 8.715 8.711 0.004 25468
2366 1 10 . 1 1 41 41 GLN N N 41 121.798 121.798 115.411 6.387 25468
2367 1 10 . 1 1 41 41 GLN HA H 41 4.304 4.304 3.936 0.368 25468
2368 1 10 . 1 1 41 41 GLN CA C 41 55.650 55.650 56.491 -0.841 25468
2369 1 10 . 1 1 41 41 GLN CB C 41 28.480 28.480 26.916 1.564 25468
2370 1 10 . 1 1 41 41 GLN H H 41 8.672 8.672 8.544 0.128 25468
2371 1 10 . 1 1 42 42 SER N N 42 114.462 114.462 114.530 -0.068 25468
2372 1 10 . 1 1 42 42 SER HA H 42 4.347 4.347 4.259 0.088 25468
2373 1 10 . 1 1 42 42 SER CA C 42 58.072 58.072 59.495 -1.423 25468
2374 1 10 . 1 1 42 42 SER CB C 42 64.037 64.037 63.764 0.273 25468
2375 1 10 . 1 1 42 42 SER H H 42 7.725 7.725 7.878 -0.153 25468
2376 1 10 . 1 1 43 43 LEU N N 43 124.166 124.166 120.496 3.670 25468
2377 1 10 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.377 0.573 25468
2378 1 10 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.304 -0.009 25468
2379 1 10 . 1 1 43 43 LEU CB C 43 41.400 41.400 41.291 0.109 25468
2380 1 10 . 1 1 43 43 LEU H H 43 8.576 8.576 7.810 0.766 25468
2381 1 10 . 1 1 44 44 ASP N N 44 118.797 118.797 117.987 0.810 25468
2382 1 10 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.825 -0.094 25468
2383 1 10 . 1 1 44 44 ASP CB C 44 39.979 39.979 43.361 -3.382 25468
2384 1 10 . 1 1 44 44 ASP H H 44 8.163 8.163 7.779 0.384 25468
2385 1 10 . 1 1 45 45 PHE N N 45 123.595 123.595 121.406 2.189 25468
2386 1 10 . 1 1 45 45 PHE HA H 45 4.920 4.920 4.622 0.298 25468
2387 1 10 . 1 1 45 45 PHE CA C 45 57.607 57.607 56.944 0.663 25468
2388 1 10 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.580 0.503 25468
2389 1 10 . 1 1 45 45 PHE H H 45 9.042 9.042 8.717 0.325 25468
2390 1 10 . 1 1 46 46 VAL N N 46 119.357 119.357 117.538 1.819 25468
2391 1 10 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.743 -0.050 25468
2392 1 10 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.813 0.102 25468
2393 1 10 . 1 1 46 46 VAL CB C 46 34.666 34.666 34.981 -0.315 25468
2394 1 10 . 1 1 46 46 VAL H H 46 9.555 9.555 8.674 0.881 25468
2395 1 10 . 1 1 47 47 CYS N N 47 122.793 122.793 125.157 -2.364 25468
2396 1 10 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.417 -0.587 25468
2397 1 10 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.949 11.781 25468
2398 1 10 . 1 1 47 47 CYS H H 47 9.044 9.044 8.687 0.357 25468
2399 1 10 . 1 1 48 48 VAL N N 48 129.864 129.864 126.360 3.504 25468
2400 1 10 . 1 1 48 48 VAL HA H 48 4.533 4.533 4.869 -0.336 25468
2401 1 10 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.481 0.336 25468
2402 1 10 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.282 -1.884 25468
2403 1 10 . 1 1 48 48 VAL H H 48 8.616 8.616 8.122 0.494 25468
2404 1 10 . 1 1 49 49 CYS N N 49 121.329 121.329 123.670 -2.341 25468
2405 1 10 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.097 0.051 25468
2406 1 10 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.587 -6.158 25468
2407 1 10 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.686 5.187 25468
2408 1 10 . 1 1 49 49 CYS H H 49 8.652 8.652 8.347 0.305 25468
2409 1 10 . 1 1 50 50 PHE N N 50 119.026 119.026 121.203 -2.177 25468
2410 1 10 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.082 -0.133 25468
2411 1 10 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.216 -0.564 25468
2412 1 10 . 1 1 50 50 PHE CB C 50 40.593 40.593 42.018 -1.425 25468
2413 1 10 . 1 1 50 50 PHE H H 50 8.472 8.472 8.613 -0.141 25468
2414 1 10 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.254 0.478 25468
2415 1 10 . 1 1 51 51 PRO CB C 51 33.209 33.209 33.049 0.160 25468
2416 1 10 . 1 1 52 52 LYS N N 52 119.951 119.951 119.984 -0.033 25468
2417 1 10 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.132 -0.173 25468
2418 1 10 . 1 1 52 52 LYS CA C 52 57.670 57.670 57.934 -0.264 25468
2419 1 10 . 1 1 52 52 LYS CB C 52 33.225 33.225 31.884 1.341 25468
2420 1 10 . 1 1 52 52 LYS H H 52 8.681 8.681 8.549 0.132 25468
2421 1 10 . 1 1 53 53 TYR N N 53 118.889 118.889 117.216 1.673 25468
2422 1 10 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.597 -0.126 25468
2423 1 10 . 1 1 53 53 TYR CA C 53 58.049 58.049 56.520 1.530 25468
2424 1 10 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.459 0.809 25468
2425 1 10 . 1 1 53 53 TYR H H 53 8.215 8.215 7.864 0.351 25468
2426 1 10 . 1 1 54 54 TYR N N 54 121.087 121.087 122.307 -1.220 25468
2427 1 10 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.546 -0.052 25468
2428 1 10 . 1 1 54 54 TYR CA C 54 58.101 58.101 59.190 -1.089 25468
2429 1 10 . 1 1 54 54 TYR CB C 54 39.611 39.611 38.834 0.777 25468
2430 1 10 . 1 1 54 54 TYR H H 54 7.919 7.919 7.649 0.270 25468
2431 1 11 . 1 1 2 2 ASP N N 2 123.544 123.544 121.968 1.576 25468
2432 1 11 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.547 0.151 25468
2433 1 11 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.223 -1.316 25468
2434 1 11 . 1 1 2 2 ASP H H 2 8.843 8.843 8.459 0.384 25468
2435 1 11 . 1 1 3 3 ILE N N 3 121.633 121.633 121.066 0.567 25468
2436 1 11 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.061 0.097 25468
2437 1 11 . 1 1 3 3 ILE CA C 3 61.110 61.110 61.188 -0.078 25468
2438 1 11 . 1 1 3 3 ILE CB C 3 39.038 39.038 38.187 0.851 25468
2439 1 11 . 1 1 3 3 ILE H H 3 8.356 8.356 7.562 0.794 25468
2440 1 11 . 1 1 4 4 ASP N N 4 124.028 124.028 128.434 -4.406 25468
2441 1 11 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.463 0.164 25468
2442 1 11 . 1 1 4 4 ASP CA C 4 53.776 53.776 54.980 -1.204 25468
2443 1 11 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.378 -1.162 25468
2444 1 11 . 1 1 4 4 ASP H H 4 8.460 8.460 8.578 -0.118 25468
2445 1 11 . 1 1 5 5 GLY N N 5 110.531 110.531 108.516 2.015 25468
2446 1 11 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.818 -0.104 25468
2447 1 11 . 1 1 5 5 GLY H H 5 8.405 8.405 8.154 0.251 25468
2448 1 11 . 1 1 6 6 ARG N N 6 119.193 119.193 119.395 -0.202 25468
2449 1 11 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.464 -0.117 25468
2450 1 11 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.287 1.960 25468
2451 1 11 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.111 0.978 25468
2452 1 11 . 1 1 6 6 ARG H H 6 8.128 8.128 8.343 -0.215 25468
2453 1 11 . 1 1 7 7 LYS N N 7 120.971 120.971 119.864 1.107 25468
2454 1 11 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.805 -0.036 25468
2455 1 11 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.188 1.042 25468
2456 1 11 . 1 1 7 7 LYS H H 7 7.984 7.984 7.683 0.301 25468
2457 1 11 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.380 0.158 25468
2458 1 11 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.602 0.601 25468
2459 1 11 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.189 -0.334 25468
2460 1 11 . 1 1 9 9 LEU N N 9 123.948 123.948 123.419 0.529 25468
2461 1 11 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.560 -0.073 25468
2462 1 11 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.494 0.017 25468
2463 1 11 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.553 2.206 25468
2464 1 11 . 1 1 9 9 LEU H H 9 7.801 7.801 8.014 -0.213 25468
2465 1 11 . 1 1 10 10 LEU N N 10 130.176 130.176 128.234 1.942 25468
2466 1 11 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.881 -0.327 25468
2467 1 11 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.622 0.849 25468
2468 1 11 . 1 1 10 10 LEU CB C 10 42.103 42.103 42.916 -0.812 25468
2469 1 11 . 1 1 10 10 LEU H H 10 8.422 8.422 8.589 -0.167 25468
2470 1 11 . 1 1 11 11 ILE N N 11 120.839 120.839 122.010 -1.171 25468
2471 1 11 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.465 -0.079 25468
2472 1 11 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.871 0.660 25468
2473 1 11 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.800 0.557 25468
2474 1 11 . 1 1 11 11 ILE H H 11 8.289 8.289 8.718 -0.429 25468
2475 1 11 . 1 1 12 12 GLY N N 12 106.385 106.385 106.788 -0.403 25468
2476 1 11 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.203 -0.460 25468
2477 1 11 . 1 1 12 12 GLY H H 12 7.125 7.125 7.349 -0.224 25468
2478 1 11 . 1 1 13 13 THR N N 13 110.566 110.566 110.298 0.268 25468
2479 1 11 . 1 1 13 13 THR HA H 13 4.676 4.676 4.894 -0.218 25468
2480 1 11 . 1 1 13 13 THR CA C 13 62.119 62.119 59.560 2.559 25468
2481 1 11 . 1 1 13 13 THR CB C 13 71.115 71.115 71.692 -0.577 25468
2482 1 11 . 1 1 13 13 THR H H 13 9.046 9.046 7.905 1.141 25468
2483 1 11 . 1 1 14 14 CYS N N 14 117.216 117.216 121.874 -4.658 25468
2484 1 11 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.749 0.151 25468
2485 1 11 . 1 1 14 14 CYS CA C 14 58.201 58.201 60.901 -2.700 25468
2486 1 11 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.544 19.087 25468
2487 1 11 . 1 1 14 14 CYS H H 14 8.436 8.436 8.861 -0.424 25468
2488 1 11 . 1 1 15 15 ILE N N 15 118.247 118.247 119.627 -1.380 25468
2489 1 11 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.945 -0.059 25468
2490 1 11 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.576 -0.275 25468
2491 1 11 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.221 -0.725 25468
2492 1 11 . 1 1 15 15 ILE H H 15 7.244 7.244 7.614 -0.370 25468
2493 1 11 . 1 1 16 16 GLU N N 16 119.649 119.649 117.737 1.912 25468
2494 1 11 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.438 -0.605 25468
2495 1 11 . 1 1 16 16 GLU CA C 16 57.902 57.902 56.777 1.125 25468
2496 1 11 . 1 1 16 16 GLU CB C 16 28.781 28.781 31.624 -2.843 25468
2497 1 11 . 1 1 16 16 GLU H H 16 7.066 7.066 8.235 -1.169 25468
2498 1 11 . 1 1 17 17 PHE N N 17 114.996 114.996 122.668 -7.672 25468
2499 1 11 . 1 1 17 17 PHE HA H 17 4.564 4.564 5.013 -0.449 25468
2500 1 11 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.526 -0.998 25468
2501 1 11 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.180 0.710 25468
2502 1 11 . 1 1 17 17 PHE H H 17 8.148 8.148 8.630 -0.482 25468
2503 1 11 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.589 0.264 25468
2504 1 11 . 1 1 18 18 PRO CA C 18 62.917 62.917 62.841 0.076 25468
2505 1 11 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.732 -0.864 25468
2506 1 11 . 1 1 19 19 THR N N 19 114.536 114.536 113.790 0.746 25468
2507 1 11 . 1 1 19 19 THR HA H 19 3.650 3.650 3.932 -0.282 25468
2508 1 11 . 1 1 19 19 THR CA C 19 68.731 68.731 67.999 0.732 25468
2509 1 11 . 1 1 19 19 THR CB C 19 69.792 69.792 68.523 1.269 25468
2510 1 11 . 1 1 19 19 THR H H 19 8.370 8.370 8.576 -0.206 25468
2511 1 11 . 1 1 20 20 GLU N N 20 120.374 120.374 120.522 -0.148 25468
2512 1 11 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.033 0.160 25468
2513 1 11 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.638 0.407 25468
2514 1 11 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.947 -0.691 25468
2515 1 11 . 1 1 20 20 GLU H H 20 9.038 9.038 8.689 0.349 25468
2516 1 11 . 1 1 21 21 LYS N N 21 122.432 122.432 119.923 2.509 25468
2517 1 11 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.043 0.122 25468
2518 1 11 . 1 1 21 21 LYS CA C 21 59.210 59.210 58.720 0.490 25468
2519 1 11 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.182 0.945 25468
2520 1 11 . 1 1 21 21 LYS H H 21 7.622 7.622 7.998 -0.376 25468
2521 1 11 . 1 1 22 22 CYS N N 22 121.466 121.466 119.139 2.327 25468
2522 1 11 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.323 -0.238 25468
2523 1 11 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.486 -3.716 25468
2524 1 11 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.056 10.538 25468
2525 1 11 . 1 1 22 22 CYS H H 22 9.356 9.356 8.570 0.786 25468
2526 1 11 . 1 1 23 23 ASN N N 23 115.604 115.604 118.818 -3.214 25468
2527 1 11 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.504 -0.459 25468
2528 1 11 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.308 1.559 25468
2529 1 11 . 1 1 23 23 ASN CB C 23 39.304 39.304 38.256 1.048 25468
2530 1 11 . 1 1 23 23 ASN H H 23 7.925 7.925 8.045 -0.120 25468
2531 1 11 . 1 1 24 24 LYS N N 24 116.665 116.665 120.706 -4.041 25468
2532 1 11 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.919 -0.007 25468
2533 1 11 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.986 -0.077 25468
2534 1 11 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.251 0.784 25468
2535 1 11 . 1 1 24 24 LYS H H 24 7.955 7.955 8.047 -0.092 25468
2536 1 11 . 1 1 25 25 THR N N 25 116.759 116.759 115.695 1.064 25468
2537 1 11 . 1 1 25 25 THR HA H 25 3.859 3.859 4.113 -0.254 25468
2538 1 11 . 1 1 25 25 THR CA C 25 67.243 67.243 66.759 0.484 25468
2539 1 11 . 1 1 25 25 THR CB C 25 68.752 68.752 68.537 0.215 25468
2540 1 11 . 1 1 25 25 THR H H 25 8.518 8.518 8.690 -0.172 25468
2541 1 11 . 1 1 26 26 CYS N N 26 121.616 121.616 120.973 0.643 25468
2542 1 11 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.264 -0.005 25468
2543 1 11 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.452 -3.849 25468
2544 1 11 . 1 1 26 26 CYS CB C 26 34.189 34.189 26.014 8.175 25468
2545 1 11 . 1 1 26 26 CYS H H 26 8.062 8.062 7.843 0.219 25468
2546 1 11 . 1 1 27 27 ILE N N 27 124.036 124.036 120.639 3.397 25468
2547 1 11 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.083 0.071 25468
2548 1 11 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.876 0.384 25468
2549 1 11 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.123 0.912 25468
2550 1 11 . 1 1 27 27 ILE H H 27 8.313 8.313 8.520 -0.207 25468
2551 1 11 . 1 1 28 28 GLU N N 28 121.780 121.780 120.294 1.486 25468
2552 1 11 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.133 0.061 25468
2553 1 11 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.981 -0.484 25468
2554 1 11 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.131 -1.174 25468
2555 1 11 . 1 1 28 28 GLU H H 28 8.312 8.312 8.298 0.014 25468
2556 1 11 . 1 1 29 29 SER N N 29 114.001 114.001 113.482 0.519 25468
2557 1 11 . 1 1 29 29 SER HA H 29 4.661 4.661 4.362 0.299 25468
2558 1 11 . 1 1 29 29 SER CA C 29 58.377 58.377 59.881 -1.504 25468
2559 1 11 . 1 1 29 29 SER CB C 29 63.484 63.484 63.193 0.291 25468
2560 1 11 . 1 1 29 29 SER H H 29 7.459 7.459 7.792 -0.333 25468
2561 1 11 . 1 1 30 30 ASN N N 30 112.213 112.213 116.146 -3.933 25468
2562 1 11 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.469 -0.042 25468
2563 1 11 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.725 0.316 25468
2564 1 11 . 1 1 30 30 ASN CB C 30 36.344 36.344 37.025 -0.681 25468
2565 1 11 . 1 1 30 30 ASN H H 30 8.067 8.067 7.838 0.229 25468
2566 1 11 . 1 1 31 31 PHE N N 31 116.306 116.306 117.260 -0.954 25468
2567 1 11 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.573 0.001 25468
2568 1 11 . 1 1 31 31 PHE CA C 31 57.969 57.969 57.392 0.577 25468
2569 1 11 . 1 1 31 31 PHE CB C 31 38.699 38.699 39.847 -1.148 25468
2570 1 11 . 1 1 31 31 PHE H H 31 7.861 7.861 7.953 -0.092 25468
2571 1 11 . 1 1 32 32 ALA N N 32 121.103 121.103 122.524 -1.421 25468
2572 1 11 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.250 -0.059 25468
2573 1 11 . 1 1 32 32 ALA CA C 32 53.586 53.586 53.806 -0.220 25468
2574 1 11 . 1 1 32 32 ALA CB C 32 19.211 19.211 19.475 -0.264 25468
2575 1 11 . 1 1 32 32 ALA H H 32 8.403 8.403 9.062 -0.659 25468
2576 1 11 . 1 1 33 33 GLY N N 33 100.820 100.820 103.544 -2.724 25468
2577 1 11 . 1 1 33 33 GLY CA C 33 44.870 44.870 45.213 -0.343 25468
2578 1 11 . 1 1 33 33 GLY H H 33 7.258 7.258 7.631 -0.373 25468
2579 1 11 . 1 1 34 34 GLY N N 34 108.312 108.312 105.517 2.795 25468
2580 1 11 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.325 2.112 25468
2581 1 11 . 1 1 34 34 GLY H H 34 8.978 8.978 8.398 0.580 25468
2582 1 11 . 1 1 35 35 LYS N N 35 119.929 119.929 116.787 3.142 25468
2583 1 11 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.872 -0.278 25468
2584 1 11 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.723 -0.068 25468
2585 1 11 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.431 1.853 25468
2586 1 11 . 1 1 35 35 LYS H H 35 8.756 8.756 8.018 0.738 25468
2587 1 11 . 1 1 36 36 CYS N N 36 119.831 119.831 120.327 -0.496 25468
2588 1 11 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.612 -0.248 25468
2589 1 11 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.918 -1.700 25468
2590 1 11 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.419 17.731 25468
2591 1 11 . 1 1 36 36 CYS H H 36 8.553 8.553 8.683 -0.130 25468
2592 1 11 . 1 1 37 37 VAL N N 37 120.392 120.392 122.560 -2.168 25468
2593 1 11 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.970 -0.206 25468
2594 1 11 . 1 1 37 37 VAL CB C 37 36.247 36.247 34.708 1.539 25468
2595 1 11 . 1 1 37 37 VAL H H 37 9.587 9.587 8.686 0.901 25468
2596 1 11 . 1 1 38 38 HIS N N 38 118.311 118.311 118.000 0.311 25468
2597 1 11 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.438 -0.398 25468
2598 1 11 . 1 1 38 38 HIS CA C 38 53.975 53.975 52.843 1.132 25468
2599 1 11 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.900 -2.420 25468
2600 1 11 . 1 1 38 38 HIS H H 38 8.698 8.698 7.723 0.975 25468
2601 1 11 . 1 1 39 39 ILE N N 39 124.114 124.114 122.220 1.894 25468
2602 1 11 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.162 0.140 25468
2603 1 11 . 1 1 39 39 ILE CA C 39 59.840 59.840 59.537 0.303 25468
2604 1 11 . 1 1 39 39 ILE CB C 39 38.709 38.709 37.155 1.554 25468
2605 1 11 . 1 1 39 39 ILE H H 39 8.969 8.969 8.656 0.313 25468
2606 1 11 . 1 1 40 40 GLY N N 40 115.080 115.080 117.887 -2.807 25468
2607 1 11 . 1 1 40 40 GLY CA C 40 46.226 46.226 47.432 -1.206 25468
2608 1 11 . 1 1 40 40 GLY H H 40 8.715 8.715 8.946 -0.231 25468
2609 1 11 . 1 1 41 41 GLN N N 41 121.798 121.798 121.101 0.697 25468
2610 1 11 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.523 -0.219 25468
2611 1 11 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.494 0.156 25468
2612 1 11 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.283 -0.803 25468
2613 1 11 . 1 1 41 41 GLN H H 41 8.672 8.672 8.089 0.583 25468
2614 1 11 . 1 1 42 42 SER N N 42 114.462 114.462 116.951 -2.489 25468
2615 1 11 . 1 1 42 42 SER HA H 42 4.347 4.347 4.424 -0.077 25468
2616 1 11 . 1 1 42 42 SER CA C 42 58.072 58.072 59.285 -1.213 25468
2617 1 11 . 1 1 42 42 SER CB C 42 64.037 64.037 63.507 0.531 25468
2618 1 11 . 1 1 42 42 SER H H 42 7.725 7.725 8.854 -1.129 25468
2619 1 11 . 1 1 43 43 LEU N N 43 124.166 124.166 114.435 9.731 25468
2620 1 11 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.731 0.219 25468
2621 1 11 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.638 -0.343 25468
2622 1 11 . 1 1 43 43 LEU CB C 43 41.400 41.400 39.800 1.600 25468
2623 1 11 . 1 1 43 43 LEU H H 43 8.576 8.576 7.811 0.765 25468
2624 1 11 . 1 1 44 44 ASP N N 44 118.797 118.797 119.547 -0.750 25468
2625 1 11 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.717 0.014 25468
2626 1 11 . 1 1 44 44 ASP CB C 44 39.979 39.979 42.637 -2.658 25468
2627 1 11 . 1 1 44 44 ASP H H 44 8.163 8.163 7.770 0.393 25468
2628 1 11 . 1 1 45 45 PHE N N 45 123.595 123.595 124.059 -0.464 25468
2629 1 11 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.078 -0.158 25468
2630 1 11 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.401 0.206 25468
2631 1 11 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.708 0.375 25468
2632 1 11 . 1 1 45 45 PHE H H 45 9.042 9.042 8.840 0.202 25468
2633 1 11 . 1 1 46 46 VAL N N 46 119.357 119.357 119.686 -0.329 25468
2634 1 11 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.773 -0.080 25468
2635 1 11 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.664 0.251 25468
2636 1 11 . 1 1 46 46 VAL CB C 46 34.666 34.666 34.142 0.524 25468
2637 1 11 . 1 1 46 46 VAL H H 46 9.555 9.555 8.770 0.785 25468
2638 1 11 . 1 1 47 47 CYS N N 47 122.793 122.793 125.268 -2.475 25468
2639 1 11 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.486 -0.656 25468
2640 1 11 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.813 11.917 25468
2641 1 11 . 1 1 47 47 CYS H H 47 9.044 9.044 8.556 0.488 25468
2642 1 11 . 1 1 48 48 VAL N N 48 129.864 129.864 129.001 0.863 25468
2643 1 11 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.061 -0.528 25468
2644 1 11 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.973 -0.156 25468
2645 1 11 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.398 -2.000 25468
2646 1 11 . 1 1 48 48 VAL H H 48 8.616 8.616 8.039 0.577 25468
2647 1 11 . 1 1 49 49 CYS N N 49 121.329 121.329 124.269 -2.940 25468
2648 1 11 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.167 -0.019 25468
2649 1 11 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.648 -6.218 25468
2650 1 11 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.950 4.923 25468
2651 1 11 . 1 1 49 49 CYS H H 49 8.652 8.652 8.224 0.428 25468
2652 1 11 . 1 1 50 50 PHE N N 50 119.026 119.026 121.188 -2.162 25468
2653 1 11 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.174 -0.225 25468
2654 1 11 . 1 1 50 50 PHE CA C 50 54.652 54.652 54.957 -0.305 25468
2655 1 11 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.802 -1.209 25468
2656 1 11 . 1 1 50 50 PHE H H 50 8.472 8.472 8.873 -0.401 25468
2657 1 11 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.269 0.463 25468
2658 1 11 . 1 1 51 51 PRO CB C 51 33.209 33.209 33.093 0.116 25468
2659 1 11 . 1 1 52 52 LYS N N 52 119.951 119.951 120.300 -0.349 25468
2660 1 11 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.028 -0.069 25468
2661 1 11 . 1 1 52 52 LYS CA C 52 57.670 57.670 59.104 -1.434 25468
2662 1 11 . 1 1 52 52 LYS CB C 52 33.225 33.225 32.082 1.143 25468
2663 1 11 . 1 1 52 52 LYS H H 52 8.681 8.681 8.560 0.121 25468
2664 1 11 . 1 1 53 53 TYR N N 53 118.889 118.889 115.498 3.391 25468
2665 1 11 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.534 -0.063 25468
2666 1 11 . 1 1 53 53 TYR CA C 53 58.049 58.049 56.048 2.001 25468
2667 1 11 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.287 0.981 25468
2668 1 11 . 1 1 53 53 TYR H H 53 8.215 8.215 7.690 0.525 25468
2669 1 11 . 1 1 54 54 TYR N N 54 121.087 121.087 118.403 2.684 25468
2670 1 11 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.606 -0.112 25468
2671 1 11 . 1 1 54 54 TYR CA C 54 58.101 58.101 57.732 0.369 25468
2672 1 11 . 1 1 54 54 TYR CB C 54 39.611 39.611 38.585 1.026 25468
2673 1 11 . 1 1 54 54 TYR H H 54 7.919 7.919 7.677 0.242 25468
2674 1 12 . 1 1 2 2 ASP N N 2 123.544 123.544 120.799 2.745 25468
2675 1 12 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.456 0.242 25468
2676 1 12 . 1 1 2 2 ASP CB C 2 39.907 39.907 40.344 -0.437 25468
2677 1 12 . 1 1 2 2 ASP H H 2 8.843 8.843 8.213 0.630 25468
2678 1 12 . 1 1 3 3 ILE N N 3 121.633 121.633 119.568 2.065 25468
2679 1 12 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.137 0.021 25468
2680 1 12 . 1 1 3 3 ILE CA C 3 61.110 61.110 60.310 0.800 25468
2681 1 12 . 1 1 3 3 ILE CB C 3 39.038 39.038 37.775 1.263 25468
2682 1 12 . 1 1 3 3 ILE H H 3 8.356 8.356 7.791 0.565 25468
2683 1 12 . 1 1 4 4 ASP N N 4 124.028 124.028 128.642 -4.614 25468
2684 1 12 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.423 0.204 25468
2685 1 12 . 1 1 4 4 ASP CA C 4 53.776 53.776 54.770 -0.994 25468
2686 1 12 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.390 -1.174 25468
2687 1 12 . 1 1 4 4 ASP H H 4 8.460 8.460 8.610 -0.150 25468
2688 1 12 . 1 1 5 5 GLY N N 5 110.531 110.531 108.599 1.932 25468
2689 1 12 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.475 0.239 25468
2690 1 12 . 1 1 5 5 GLY H H 5 8.405 8.405 8.037 0.368 25468
2691 1 12 . 1 1 6 6 ARG N N 6 119.193 119.193 120.502 -1.309 25468
2692 1 12 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.560 -0.213 25468
2693 1 12 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.601 1.646 25468
2694 1 12 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.127 0.962 25468
2695 1 12 . 1 1 6 6 ARG H H 6 8.128 8.128 8.265 -0.137 25468
2696 1 12 . 1 1 7 7 LYS N N 7 120.971 120.971 121.069 -0.098 25468
2697 1 12 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.836 -0.067 25468
2698 1 12 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.395 0.835 25468
2699 1 12 . 1 1 7 7 LYS H H 7 7.984 7.984 7.758 0.226 25468
2700 1 12 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.429 0.109 25468
2701 1 12 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.389 0.814 25468
2702 1 12 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.705 -0.850 25468
2703 1 12 . 1 1 9 9 LEU N N 9 123.948 123.948 121.180 2.768 25468
2704 1 12 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.550 -0.063 25468
2705 1 12 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.708 -0.197 25468
2706 1 12 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.604 2.155 25468
2707 1 12 . 1 1 9 9 LEU H H 9 7.801 7.801 7.757 0.044 25468
2708 1 12 . 1 1 10 10 LEU N N 10 130.176 130.176 128.206 1.970 25468
2709 1 12 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.822 -0.268 25468
2710 1 12 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.795 0.676 25468
2711 1 12 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.237 -1.134 25468
2712 1 12 . 1 1 10 10 LEU H H 10 8.422 8.422 8.566 -0.144 25468
2713 1 12 . 1 1 11 11 ILE N N 11 120.839 120.839 121.431 -0.592 25468
2714 1 12 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.454 -0.068 25468
2715 1 12 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.637 0.894 25468
2716 1 12 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.748 0.609 25468
2717 1 12 . 1 1 11 11 ILE H H 11 8.289 8.289 8.430 -0.141 25468
2718 1 12 . 1 1 12 12 GLY N N 12 106.385 106.385 107.044 -0.659 25468
2719 1 12 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.588 -0.845 25468
2720 1 12 . 1 1 12 12 GLY H H 12 7.125 7.125 7.274 -0.149 25468
2721 1 12 . 1 1 13 13 THR N N 13 110.566 110.566 111.149 -0.583 25468
2722 1 12 . 1 1 13 13 THR HA H 13 4.676 4.676 5.074 -0.398 25468
2723 1 12 . 1 1 13 13 THR CA C 13 62.119 62.119 59.418 2.701 25468
2724 1 12 . 1 1 13 13 THR CB C 13 71.115 71.115 71.072 0.043 25468
2725 1 12 . 1 1 13 13 THR H H 13 9.046 9.046 8.094 0.952 25468
2726 1 12 . 1 1 14 14 CYS N N 14 117.216 117.216 121.447 -4.231 25468
2727 1 12 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.635 0.265 25468
2728 1 12 . 1 1 14 14 CYS CA C 14 58.201 58.201 61.684 -3.483 25468
2729 1 12 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.636 18.995 25468
2730 1 12 . 1 1 14 14 CYS H H 14 8.436 8.436 8.697 -0.261 25468
2731 1 12 . 1 1 15 15 ILE N N 15 118.247 118.247 120.074 -1.827 25468
2732 1 12 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.781 0.105 25468
2733 1 12 . 1 1 15 15 ILE CA C 15 63.301 63.301 64.400 -1.099 25468
2734 1 12 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.080 -0.584 25468
2735 1 12 . 1 1 15 15 ILE H H 15 7.244 7.244 7.657 -0.413 25468
2736 1 12 . 1 1 16 16 GLU N N 16 119.649 119.649 118.506 1.143 25468
2737 1 12 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.301 -0.468 25468
2738 1 12 . 1 1 16 16 GLU CA C 16 57.902 57.902 57.664 0.238 25468
2739 1 12 . 1 1 16 16 GLU CB C 16 28.781 28.781 30.911 -2.130 25468
2740 1 12 . 1 1 16 16 GLU H H 16 7.066 7.066 7.877 -0.811 25468
2741 1 12 . 1 1 17 17 PHE N N 17 114.996 114.996 120.950 -5.954 25468
2742 1 12 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.990 -0.426 25468
2743 1 12 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.607 -1.079 25468
2744 1 12 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.341 0.549 25468
2745 1 12 . 1 1 17 17 PHE H H 17 8.148 8.148 8.505 -0.357 25468
2746 1 12 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.563 0.290 25468
2747 1 12 . 1 1 18 18 PRO CA C 18 62.917 62.917 63.437 -0.520 25468
2748 1 12 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.236 -0.368 25468
2749 1 12 . 1 1 19 19 THR N N 19 114.536 114.536 112.231 2.305 25468
2750 1 12 . 1 1 19 19 THR HA H 19 3.650 3.650 3.920 -0.270 25468
2751 1 12 . 1 1 19 19 THR CA C 19 68.731 68.731 66.746 1.986 25468
2752 1 12 . 1 1 19 19 THR CB C 19 69.792 69.792 68.459 1.333 25468
2753 1 12 . 1 1 19 19 THR H H 19 8.370 8.370 8.495 -0.125 25468
2754 1 12 . 1 1 20 20 GLU N N 20 120.374 120.374 120.438 -0.064 25468
2755 1 12 . 1 1 20 20 GLU HA H 20 4.193 4.193 3.928 0.265 25468
2756 1 12 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.519 0.526 25468
2757 1 12 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.700 -0.444 25468
2758 1 12 . 1 1 20 20 GLU H H 20 9.038 9.038 8.908 0.130 25468
2759 1 12 . 1 1 21 21 LYS N N 21 122.432 122.432 120.268 2.164 25468
2760 1 12 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.079 0.086 25468
2761 1 12 . 1 1 21 21 LYS CA C 21 59.210 59.210 58.841 0.369 25468
2762 1 12 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.247 0.880 25468
2763 1 12 . 1 1 21 21 LYS H H 21 7.622 7.622 7.778 -0.156 25468
2764 1 12 . 1 1 22 22 CYS N N 22 121.466 121.466 119.441 2.025 25468
2765 1 12 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.251 -0.166 25468
2766 1 12 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.459 -3.690 25468
2767 1 12 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.062 10.532 25468
2768 1 12 . 1 1 22 22 CYS H H 22 9.356 9.356 8.626 0.730 25468
2769 1 12 . 1 1 23 23 ASN N N 23 115.604 115.604 118.752 -3.148 25468
2770 1 12 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.388 -0.343 25468
2771 1 12 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.455 1.412 25468
2772 1 12 . 1 1 23 23 ASN CB C 23 39.304 39.304 38.206 1.098 25468
2773 1 12 . 1 1 23 23 ASN H H 23 7.925 7.925 8.219 -0.294 25468
2774 1 12 . 1 1 24 24 LYS N N 24 116.665 116.665 120.640 -3.975 25468
2775 1 12 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.877 0.035 25468
2776 1 12 . 1 1 24 24 LYS CA C 24 59.909 59.909 60.129 -0.220 25468
2777 1 12 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.192 0.843 25468
2778 1 12 . 1 1 24 24 LYS H H 24 7.955 7.955 8.221 -0.266 25468
2779 1 12 . 1 1 25 25 THR N N 25 116.759 116.759 115.669 1.090 25468
2780 1 12 . 1 1 25 25 THR HA H 25 3.859 3.859 4.127 -0.268 25468
2781 1 12 . 1 1 25 25 THR CA C 25 67.243 67.243 66.566 0.677 25468
2782 1 12 . 1 1 25 25 THR CB C 25 68.752 68.752 68.637 0.115 25468
2783 1 12 . 1 1 25 25 THR H H 25 8.518 8.518 8.552 -0.034 25468
2784 1 12 . 1 1 26 26 CYS N N 26 121.616 121.616 121.591 0.025 25468
2785 1 12 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.132 0.127 25468
2786 1 12 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.169 -3.566 25468
2787 1 12 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.700 8.489 25468
2788 1 12 . 1 1 26 26 CYS H H 26 8.062 8.062 7.704 0.358 25468
2789 1 12 . 1 1 27 27 ILE N N 27 124.036 124.036 120.630 3.406 25468
2790 1 12 . 1 1 27 27 ILE HA H 27 4.154 4.154 3.982 0.172 25468
2791 1 12 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.911 0.349 25468
2792 1 12 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.497 0.538 25468
2793 1 12 . 1 1 27 27 ILE H H 27 8.313 8.313 8.571 -0.258 25468
2794 1 12 . 1 1 28 28 GLU N N 28 121.780 121.780 120.588 1.192 25468
2795 1 12 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.178 0.016 25468
2796 1 12 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.818 -0.321 25468
2797 1 12 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.015 -1.058 25468
2798 1 12 . 1 1 28 28 GLU H H 28 8.312 8.312 8.536 -0.224 25468
2799 1 12 . 1 1 29 29 SER N N 29 114.001 114.001 115.603 -1.602 25468
2800 1 12 . 1 1 29 29 SER HA H 29 4.661 4.661 4.398 0.263 25468
2801 1 12 . 1 1 29 29 SER CA C 29 58.377 58.377 59.339 -0.962 25468
2802 1 12 . 1 1 29 29 SER CB C 29 63.484 63.484 63.485 -0.001 25468
2803 1 12 . 1 1 29 29 SER H H 29 7.459 7.459 7.762 -0.303 25468
2804 1 12 . 1 1 30 30 ASN N N 30 112.213 112.213 115.998 -3.785 25468
2805 1 12 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.378 0.049 25468
2806 1 12 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.793 0.248 25468
2807 1 12 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.702 -0.358 25468
2808 1 12 . 1 1 30 30 ASN H H 30 8.067 8.067 7.774 0.293 25468
2809 1 12 . 1 1 31 31 PHE N N 31 116.306 116.306 116.783 -0.477 25468
2810 1 12 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.464 0.110 25468
2811 1 12 . 1 1 31 31 PHE CA C 31 57.969 57.969 58.024 -0.055 25468
2812 1 12 . 1 1 31 31 PHE CB C 31 38.699 38.699 39.579 -0.880 25468
2813 1 12 . 1 1 31 31 PHE H H 31 7.861 7.861 7.896 -0.035 25468
2814 1 12 . 1 1 32 32 ALA N N 32 121.103 121.103 122.575 -1.472 25468
2815 1 12 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.309 -0.118 25468
2816 1 12 . 1 1 32 32 ALA CA C 32 53.586 53.586 53.575 0.011 25468
2817 1 12 . 1 1 32 32 ALA CB C 32 19.211 19.211 19.461 -0.250 25468
2818 1 12 . 1 1 32 32 ALA H H 32 8.403 8.403 8.734 -0.331 25468
2819 1 12 . 1 1 33 33 GLY N N 33 100.820 100.820 103.913 -3.093 25468
2820 1 12 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.580 0.290 25468
2821 1 12 . 1 1 33 33 GLY H H 33 7.258 7.258 7.062 0.196 25468
2822 1 12 . 1 1 34 34 GLY N N 34 108.312 108.312 105.209 3.103 25468
2823 1 12 . 1 1 34 34 GLY CA C 34 46.437 46.437 43.670 2.767 25468
2824 1 12 . 1 1 34 34 GLY H H 34 8.978 8.978 8.252 0.726 25468
2825 1 12 . 1 1 35 35 LYS N N 35 119.929 119.929 116.742 3.187 25468
2826 1 12 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.778 -0.184 25468
2827 1 12 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.694 -0.040 25468
2828 1 12 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.631 1.653 25468
2829 1 12 . 1 1 35 35 LYS H H 35 8.756 8.756 7.968 0.788 25468
2830 1 12 . 1 1 36 36 CYS N N 36 119.831 119.831 120.002 -0.171 25468
2831 1 12 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.481 -0.117 25468
2832 1 12 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.500 -1.282 25468
2833 1 12 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.248 17.901 25468
2834 1 12 . 1 1 36 36 CYS H H 36 8.553 8.553 8.385 0.168 25468
2835 1 12 . 1 1 37 37 VAL N N 37 120.392 120.392 122.828 -2.436 25468
2836 1 12 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.793 -0.029 25468
2837 1 12 . 1 1 37 37 VAL CB C 37 36.247 36.247 34.972 1.275 25468
2838 1 12 . 1 1 37 37 VAL H H 37 9.587 9.587 8.395 1.192 25468
2839 1 12 . 1 1 38 38 HIS N N 38 118.311 118.311 119.322 -1.011 25468
2840 1 12 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.454 -0.414 25468
2841 1 12 . 1 1 38 38 HIS CA C 38 53.975 53.975 54.474 -0.499 25468
2842 1 12 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.395 -1.915 25468
2843 1 12 . 1 1 38 38 HIS H H 38 8.698 8.698 8.410 0.288 25468
2844 1 12 . 1 1 39 39 ILE N N 39 124.114 124.114 121.843 2.271 25468
2845 1 12 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.266 0.036 25468
2846 1 12 . 1 1 39 39 ILE CA C 39 59.840 59.840 59.673 0.167 25468
2847 1 12 . 1 1 39 39 ILE CB C 39 38.709 38.709 38.335 0.374 25468
2848 1 12 . 1 1 39 39 ILE H H 39 8.969 8.969 8.668 0.301 25468
2849 1 12 . 1 1 40 40 GLY N N 40 115.080 115.080 117.344 -2.264 25468
2850 1 12 . 1 1 40 40 GLY CA C 40 46.226 46.226 47.383 -1.157 25468
2851 1 12 . 1 1 40 40 GLY H H 40 8.715 8.715 8.918 -0.203 25468
2852 1 12 . 1 1 41 41 GLN N N 41 121.798 121.798 121.276 0.522 25468
2853 1 12 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.490 -0.186 25468
2854 1 12 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.123 0.527 25468
2855 1 12 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.827 -1.347 25468
2856 1 12 . 1 1 41 41 GLN H H 41 8.672 8.672 8.175 0.497 25468
2857 1 12 . 1 1 42 42 SER N N 42 114.462 114.462 116.748 -2.286 25468
2858 1 12 . 1 1 42 42 SER HA H 42 4.347 4.347 4.332 0.015 25468
2859 1 12 . 1 1 42 42 SER CA C 42 58.072 58.072 60.642 -2.570 25468
2860 1 12 . 1 1 42 42 SER CB C 42 64.037 64.037 63.628 0.409 25468
2861 1 12 . 1 1 42 42 SER H H 42 7.725 7.725 8.790 -1.065 25468
2862 1 12 . 1 1 43 43 LEU N N 43 124.166 124.166 120.666 3.500 25468
2863 1 12 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.975 -0.025 25468
2864 1 12 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.577 -0.282 25468
2865 1 12 . 1 1 43 43 LEU CB C 43 41.400 41.400 41.115 0.285 25468
2866 1 12 . 1 1 43 43 LEU H H 43 8.576 8.576 7.888 0.688 25468
2867 1 12 . 1 1 44 44 ASP N N 44 118.797 118.797 118.179 0.618 25468
2868 1 12 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.544 0.187 25468
2869 1 12 . 1 1 44 44 ASP CB C 44 39.979 39.979 43.174 -3.195 25468
2870 1 12 . 1 1 44 44 ASP H H 44 8.163 8.163 7.783 0.380 25468
2871 1 12 . 1 1 45 45 PHE N N 45 123.595 123.595 121.551 2.044 25468
2872 1 12 . 1 1 45 45 PHE HA H 45 4.920 4.920 4.726 0.194 25468
2873 1 12 . 1 1 45 45 PHE CA C 45 57.607 57.607 56.877 0.730 25468
2874 1 12 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.210 0.873 25468
2875 1 12 . 1 1 45 45 PHE H H 45 9.042 9.042 8.600 0.442 25468
2876 1 12 . 1 1 46 46 VAL N N 46 119.357 119.357 117.902 1.455 25468
2877 1 12 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.725 -0.032 25468
2878 1 12 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.875 0.040 25468
2879 1 12 . 1 1 46 46 VAL CB C 46 34.666 34.666 34.078 0.588 25468
2880 1 12 . 1 1 46 46 VAL H H 46 9.555 9.555 8.633 0.922 25468
2881 1 12 . 1 1 47 47 CYS N N 47 122.793 122.793 127.196 -4.403 25468
2882 1 12 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.372 -0.542 25468
2883 1 12 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.836 11.894 25468
2884 1 12 . 1 1 47 47 CYS H H 47 9.044 9.044 9.153 -0.109 25468
2885 1 12 . 1 1 48 48 VAL N N 48 129.864 129.864 129.148 0.716 25468
2886 1 12 . 1 1 48 48 VAL HA H 48 4.533 4.533 4.746 -0.213 25468
2887 1 12 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.936 -0.119 25468
2888 1 12 . 1 1 48 48 VAL CB C 48 34.398 34.398 35.829 -1.431 25468
2889 1 12 . 1 1 48 48 VAL H H 48 8.616 8.616 8.107 0.509 25468
2890 1 12 . 1 1 49 49 CYS N N 49 121.329 121.329 126.176 -4.847 25468
2891 1 12 . 1 1 49 49 CYS HA H 49 5.148 5.148 4.716 0.432 25468
2892 1 12 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.065 -5.636 25468
2893 1 12 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.325 5.548 25468
2894 1 12 . 1 1 49 49 CYS H H 49 8.652 8.652 8.310 0.342 25468
2895 1 12 . 1 1 50 50 PHE N N 50 119.026 119.026 119.341 -0.315 25468
2896 1 12 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.110 -0.161 25468
2897 1 12 . 1 1 50 50 PHE CA C 50 54.652 54.652 54.605 0.047 25468
2898 1 12 . 1 1 50 50 PHE CB C 50 40.593 40.593 39.248 1.345 25468
2899 1 12 . 1 1 50 50 PHE H H 50 8.472 8.472 7.517 0.955 25468
2900 1 12 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.787 -0.055 25468
2901 1 12 . 1 1 51 51 PRO CB C 51 33.209 33.209 33.428 -0.219 25468
2902 1 12 . 1 1 52 52 LYS N N 52 119.951 119.951 120.483 -0.532 25468
2903 1 12 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.181 -0.222 25468
2904 1 12 . 1 1 52 52 LYS CA C 52 57.670 57.670 58.730 -1.060 25468
2905 1 12 . 1 1 52 52 LYS CB C 52 33.225 33.225 32.036 1.189 25468
2906 1 12 . 1 1 52 52 LYS H H 52 8.681 8.681 8.772 -0.091 25468
2907 1 12 . 1 1 53 53 TYR N N 53 118.889 118.889 116.867 2.022 25468
2908 1 12 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.708 -0.237 25468
2909 1 12 . 1 1 53 53 TYR CA C 53 58.049 58.049 55.538 2.511 25468
2910 1 12 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.348 0.920 25468
2911 1 12 . 1 1 53 53 TYR H H 53 8.215 8.215 7.782 0.433 25468
2912 1 12 . 1 1 54 54 TYR N N 54 121.087 121.087 124.009 -2.922 25468
2913 1 12 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.563 -0.069 25468
2914 1 12 . 1 1 54 54 TYR CA C 54 58.101 58.101 58.819 -0.718 25468
2915 1 12 . 1 1 54 54 TYR CB C 54 39.611 39.611 37.730 1.881 25468
2916 1 12 . 1 1 54 54 TYR H H 54 7.919 7.919 7.868 0.051 25468
2917 1 13 . 1 1 2 2 ASP N N 2 123.544 123.544 122.479 1.065 25468
2918 1 13 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.744 -0.046 25468
2919 1 13 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.494 -1.587 25468
2920 1 13 . 1 1 2 2 ASP H H 2 8.843 8.843 8.380 0.463 25468
2921 1 13 . 1 1 3 3 ILE N N 3 121.633 121.633 122.349 -0.716 25468
2922 1 13 . 1 1 3 3 ILE HA H 3 4.158 4.158 3.951 0.207 25468
2923 1 13 . 1 1 3 3 ILE CA C 3 61.110 61.110 61.425 -0.315 25468
2924 1 13 . 1 1 3 3 ILE CB C 3 39.038 39.038 38.894 0.144 25468
2925 1 13 . 1 1 3 3 ILE H H 3 8.356 8.356 7.464 0.892 25468
2926 1 13 . 1 1 4 4 ASP N N 4 124.028 124.028 127.093 -3.065 25468
2927 1 13 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.449 0.178 25468
2928 1 13 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.437 -1.661 25468
2929 1 13 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.033 -0.817 25468
2930 1 13 . 1 1 4 4 ASP H H 4 8.460 8.460 8.587 -0.127 25468
2931 1 13 . 1 1 5 5 GLY N N 5 110.531 110.531 109.029 1.502 25468
2932 1 13 . 1 1 5 5 GLY CA C 5 45.714 45.714 46.129 -0.415 25468
2933 1 13 . 1 1 5 5 GLY H H 5 8.405 8.405 8.155 0.250 25468
2934 1 13 . 1 1 6 6 ARG N N 6 119.193 119.193 122.571 -3.378 25468
2935 1 13 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.638 -0.291 25468
2936 1 13 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.016 2.231 25468
2937 1 13 . 1 1 6 6 ARG CB C 6 31.089 31.089 29.715 1.374 25468
2938 1 13 . 1 1 6 6 ARG H H 6 8.128 8.128 7.908 0.220 25468
2939 1 13 . 1 1 7 7 LYS N N 7 120.971 120.971 122.074 -1.103 25468
2940 1 13 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.775 -0.006 25468
2941 1 13 . 1 1 7 7 LYS CB C 7 33.230 33.230 34.359 -1.129 25468
2942 1 13 . 1 1 7 7 LYS H H 7 7.984 7.984 7.796 0.188 25468
2943 1 13 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.594 -0.056 25468
2944 1 13 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.247 0.956 25468
2945 1 13 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.655 -0.800 25468
2946 1 13 . 1 1 9 9 LEU N N 9 123.948 123.948 120.571 3.377 25468
2947 1 13 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.584 -0.097 25468
2948 1 13 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.604 -0.093 25468
2949 1 13 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.580 2.179 25468
2950 1 13 . 1 1 9 9 LEU H H 9 7.801 7.801 7.794 0.007 25468
2951 1 13 . 1 1 10 10 LEU N N 10 130.176 130.176 128.358 1.818 25468
2952 1 13 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.811 -0.257 25468
2953 1 13 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.770 0.701 25468
2954 1 13 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.254 -1.151 25468
2955 1 13 . 1 1 10 10 LEU H H 10 8.422 8.422 8.577 -0.155 25468
2956 1 13 . 1 1 11 11 ILE N N 11 120.839 120.839 121.924 -1.085 25468
2957 1 13 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.620 -0.234 25468
2958 1 13 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.919 0.612 25468
2959 1 13 . 1 1 11 11 ILE CB C 11 39.357 39.357 39.033 0.324 25468
2960 1 13 . 1 1 11 11 ILE H H 11 8.289 8.289 8.850 -0.561 25468
2961 1 13 . 1 1 12 12 GLY N N 12 106.385 106.385 107.462 -1.077 25468
2962 1 13 . 1 1 12 12 GLY CA C 12 44.743 44.743 46.074 -1.331 25468
2963 1 13 . 1 1 12 12 GLY H H 12 7.125 7.125 7.502 -0.377 25468
2964 1 13 . 1 1 13 13 THR N N 13 110.566 110.566 110.830 -0.264 25468
2965 1 13 . 1 1 13 13 THR HA H 13 4.676 4.676 5.058 -0.382 25468
2966 1 13 . 1 1 13 13 THR CA C 13 62.119 62.119 59.254 2.865 25468
2967 1 13 . 1 1 13 13 THR CB C 13 71.115 71.115 71.853 -0.738 25468
2968 1 13 . 1 1 13 13 THR H H 13 9.046 9.046 7.924 1.122 25468
2969 1 13 . 1 1 14 14 CYS N N 14 117.216 117.216 121.402 -4.186 25468
2970 1 13 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.671 0.229 25468
2971 1 13 . 1 1 14 14 CYS CA C 14 58.201 58.201 61.353 -3.152 25468
2972 1 13 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.623 19.008 25468
2973 1 13 . 1 1 14 14 CYS H H 14 8.436 8.436 8.859 -0.423 25468
2974 1 13 . 1 1 15 15 ILE N N 15 118.247 118.247 120.137 -1.890 25468
2975 1 13 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.868 0.018 25468
2976 1 13 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.774 -0.473 25468
2977 1 13 . 1 1 15 15 ILE CB C 15 37.496 37.496 37.063 0.433 25468
2978 1 13 . 1 1 15 15 ILE H H 15 7.244 7.244 7.563 -0.319 25468
2979 1 13 . 1 1 16 16 GLU N N 16 119.649 119.649 118.576 1.073 25468
2980 1 13 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.151 -0.318 25468
2981 1 13 . 1 1 16 16 GLU CA C 16 57.902 57.902 56.781 1.121 25468
2982 1 13 . 1 1 16 16 GLU CB C 16 28.781 28.781 31.247 -2.466 25468
2983 1 13 . 1 1 16 16 GLU H H 16 7.066 7.066 7.794 -0.728 25468
2984 1 13 . 1 1 17 17 PHE N N 17 114.996 114.996 121.261 -6.265 25468
2985 1 13 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.974 -0.410 25468
2986 1 13 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.346 -0.818 25468
2987 1 13 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.060 0.830 25468
2988 1 13 . 1 1 17 17 PHE H H 17 8.148 8.148 8.247 -0.099 25468
2989 1 13 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.547 0.306 25468
2990 1 13 . 1 1 18 18 PRO CA C 18 62.917 62.917 63.208 -0.291 25468
2991 1 13 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.484 -0.616 25468
2992 1 13 . 1 1 19 19 THR N N 19 114.536 114.536 114.387 0.149 25468
2993 1 13 . 1 1 19 19 THR HA H 19 3.650 3.650 3.904 -0.254 25468
2994 1 13 . 1 1 19 19 THR CA C 19 68.731 68.731 68.050 0.681 25468
2995 1 13 . 1 1 19 19 THR CB C 19 69.792 69.792 68.793 0.999 25468
2996 1 13 . 1 1 19 19 THR H H 19 8.370 8.370 8.594 -0.224 25468
2997 1 13 . 1 1 20 20 GLU N N 20 120.374 120.374 121.156 -0.782 25468
2998 1 13 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.196 -0.003 25468
2999 1 13 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.645 0.400 25468
3000 1 13 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.720 -0.464 25468
3001 1 13 . 1 1 20 20 GLU H H 20 9.038 9.038 8.784 0.254 25468
3002 1 13 . 1 1 21 21 LYS N N 21 122.432 122.432 120.491 1.941 25468
3003 1 13 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.080 0.085 25468
3004 1 13 . 1 1 21 21 LYS CA C 21 59.210 59.210 60.036 -0.826 25468
3005 1 13 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.222 0.904 25468
3006 1 13 . 1 1 21 21 LYS H H 21 7.622 7.622 8.177 -0.555 25468
3007 1 13 . 1 1 22 22 CYS N N 22 121.466 121.466 120.270 1.196 25468
3008 1 13 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.102 -0.017 25468
3009 1 13 . 1 1 22 22 CYS CA C 22 58.769 58.769 61.806 -3.038 25468
3010 1 13 . 1 1 22 22 CYS CB C 22 36.594 36.594 25.944 10.650 25468
3011 1 13 . 1 1 22 22 CYS H H 22 9.356 9.356 8.691 0.665 25468
3012 1 13 . 1 1 23 23 ASN N N 23 115.604 115.604 118.660 -3.056 25468
3013 1 13 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.585 -0.540 25468
3014 1 13 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.137 1.730 25468
3015 1 13 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.904 1.400 25468
3016 1 13 . 1 1 23 23 ASN H H 23 7.925 7.925 8.029 -0.104 25468
3017 1 13 . 1 1 24 24 LYS N N 24 116.665 116.665 121.005 -4.340 25468
3018 1 13 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.967 -0.055 25468
3019 1 13 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.811 0.098 25468
3020 1 13 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.267 0.768 25468
3021 1 13 . 1 1 24 24 LYS H H 24 7.955 7.955 8.533 -0.578 25468
3022 1 13 . 1 1 25 25 THR N N 25 116.759 116.759 114.395 2.364 25468
3023 1 13 . 1 1 25 25 THR HA H 25 3.859 3.859 4.099 -0.240 25468
3024 1 13 . 1 1 25 25 THR CA C 25 67.243 67.243 65.296 1.947 25468
3025 1 13 . 1 1 25 25 THR CB C 25 68.752 68.752 68.482 0.270 25468
3026 1 13 . 1 1 25 25 THR H H 25 8.518 8.518 8.417 0.101 25468
3027 1 13 . 1 1 26 26 CYS N N 26 121.616 121.616 120.349 1.267 25468
3028 1 13 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.127 0.132 25468
3029 1 13 . 1 1 26 26 CYS CA C 26 57.603 57.603 62.276 -4.673 25468
3030 1 13 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.896 8.293 25468
3031 1 13 . 1 1 26 26 CYS H H 26 8.062 8.062 7.562 0.500 25468
3032 1 13 . 1 1 27 27 ILE N N 27 124.036 124.036 119.819 4.217 25468
3033 1 13 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.121 0.033 25468
3034 1 13 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.894 0.367 25468
3035 1 13 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.238 0.797 25468
3036 1 13 . 1 1 27 27 ILE H H 27 8.313 8.313 8.343 -0.030 25468
3037 1 13 . 1 1 28 28 GLU N N 28 121.780 121.780 120.143 1.637 25468
3038 1 13 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.126 0.068 25468
3039 1 13 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.947 -0.450 25468
3040 1 13 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.384 -1.427 25468
3041 1 13 . 1 1 28 28 GLU H H 28 8.312 8.312 7.762 0.550 25468
3042 1 13 . 1 1 29 29 SER N N 29 114.001 114.001 113.162 0.839 25468
3043 1 13 . 1 1 29 29 SER HA H 29 4.661 4.661 4.424 0.237 25468
3044 1 13 . 1 1 29 29 SER CA C 29 58.377 58.377 59.412 -1.035 25468
3045 1 13 . 1 1 29 29 SER CB C 29 63.484 63.484 63.125 0.359 25468
3046 1 13 . 1 1 29 29 SER H H 29 7.459 7.459 7.628 -0.169 25468
3047 1 13 . 1 1 30 30 ASN N N 30 112.213 112.213 113.961 -1.748 25468
3048 1 13 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.540 -0.113 25468
3049 1 13 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.427 0.614 25468
3050 1 13 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.492 -0.147 25468
3051 1 13 . 1 1 30 30 ASN H H 30 8.067 8.067 7.877 0.190 25468
3052 1 13 . 1 1 31 31 PHE N N 31 116.306 116.306 117.900 -1.594 25468
3053 1 13 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.695 -0.121 25468
3054 1 13 . 1 1 31 31 PHE CA C 31 57.969 57.969 56.710 1.259 25468
3055 1 13 . 1 1 31 31 PHE CB C 31 38.699 38.699 40.671 -1.972 25468
3056 1 13 . 1 1 31 31 PHE H H 31 7.861 7.861 7.983 -0.122 25468
3057 1 13 . 1 1 32 32 ALA N N 32 121.103 121.103 124.915 -3.812 25468
3058 1 13 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.293 -0.102 25468
3059 1 13 . 1 1 32 32 ALA CA C 32 53.586 53.586 52.377 1.209 25468
3060 1 13 . 1 1 32 32 ALA CB C 32 19.211 19.211 17.396 1.815 25468
3061 1 13 . 1 1 32 32 ALA H H 32 8.403 8.403 8.851 -0.448 25468
3062 1 13 . 1 1 33 33 GLY N N 33 100.820 100.820 106.675 -5.855 25468
3063 1 13 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.382 0.488 25468
3064 1 13 . 1 1 33 33 GLY H H 33 7.258 7.258 7.569 -0.311 25468
3065 1 13 . 1 1 34 34 GLY N N 34 108.312 108.312 105.984 2.328 25468
3066 1 13 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.539 1.897 25468
3067 1 13 . 1 1 34 34 GLY H H 34 8.978 8.978 8.229 0.749 25468
3068 1 13 . 1 1 35 35 LYS N N 35 119.929 119.929 116.689 3.240 25468
3069 1 13 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.777 -0.183 25468
3070 1 13 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.859 -0.204 25468
3071 1 13 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.672 1.612 25468
3072 1 13 . 1 1 35 35 LYS H H 35 8.756 8.756 8.406 0.350 25468
3073 1 13 . 1 1 36 36 CYS N N 36 119.831 119.831 119.874 -0.043 25468
3074 1 13 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.628 -0.264 25468
3075 1 13 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.532 -1.314 25468
3076 1 13 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.335 17.815 25468
3077 1 13 . 1 1 36 36 CYS H H 36 8.553 8.553 8.580 -0.027 25468
3078 1 13 . 1 1 37 37 VAL N N 37 120.392 120.392 122.345 -1.953 25468
3079 1 13 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.687 0.077 25468
3080 1 13 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.087 1.160 25468
3081 1 13 . 1 1 37 37 VAL H H 37 9.587 9.587 8.454 1.133 25468
3082 1 13 . 1 1 38 38 HIS N N 38 118.311 118.311 118.666 -0.355 25468
3083 1 13 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.558 -0.518 25468
3084 1 13 . 1 1 38 38 HIS CA C 38 53.975 53.975 54.590 -0.615 25468
3085 1 13 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.696 -2.216 25468
3086 1 13 . 1 1 38 38 HIS H H 38 8.698 8.698 8.206 0.492 25468
3087 1 13 . 1 1 39 39 ILE N N 39 124.114 124.114 122.147 1.967 25468
3088 1 13 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.261 0.041 25468
3089 1 13 . 1 1 39 39 ILE CA C 39 59.840 59.840 61.119 -1.279 25468
3090 1 13 . 1 1 39 39 ILE CB C 39 38.709 38.709 40.166 -1.457 25468
3091 1 13 . 1 1 39 39 ILE H H 39 8.969 8.969 8.859 0.110 25468
3092 1 13 . 1 1 40 40 GLY N N 40 115.080 115.080 115.819 -0.739 25468
3093 1 13 . 1 1 40 40 GLY CA C 40 46.226 46.226 45.432 0.794 25468
3094 1 13 . 1 1 40 40 GLY H H 40 8.715 8.715 8.805 -0.090 25468
3095 1 13 . 1 1 41 41 GLN N N 41 121.798 121.798 114.948 6.850 25468
3096 1 13 . 1 1 41 41 GLN HA H 41 4.304 4.304 3.905 0.399 25468
3097 1 13 . 1 1 41 41 GLN CA C 41 55.650 55.650 56.575 -0.925 25468
3098 1 13 . 1 1 41 41 GLN CB C 41 28.480 28.480 26.282 2.198 25468
3099 1 13 . 1 1 41 41 GLN H H 41 8.672 8.672 8.481 0.191 25468
3100 1 13 . 1 1 42 42 SER N N 42 114.462 114.462 114.366 0.096 25468
3101 1 13 . 1 1 42 42 SER HA H 42 4.347 4.347 4.354 -0.007 25468
3102 1 13 . 1 1 42 42 SER CA C 42 58.072 58.072 59.718 -1.646 25468
3103 1 13 . 1 1 42 42 SER CB C 42 64.037 64.037 63.912 0.125 25468
3104 1 13 . 1 1 42 42 SER H H 42 7.725 7.725 7.812 -0.087 25468
3105 1 13 . 1 1 43 43 LEU N N 43 124.166 124.166 118.741 5.425 25468
3106 1 13 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.528 0.422 25468
3107 1 13 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.128 0.167 25468
3108 1 13 . 1 1 43 43 LEU CB C 43 41.400 41.400 41.159 0.241 25468
3109 1 13 . 1 1 43 43 LEU H H 43 8.576 8.576 7.901 0.675 25468
3110 1 13 . 1 1 44 44 ASP N N 44 118.797 118.797 118.818 -0.021 25468
3111 1 13 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.798 -0.067 25468
3112 1 13 . 1 1 44 44 ASP CB C 44 39.979 39.979 42.669 -2.690 25468
3113 1 13 . 1 1 44 44 ASP H H 44 8.163 8.163 7.861 0.302 25468
3114 1 13 . 1 1 45 45 PHE N N 45 123.595 123.595 121.461 2.134 25468
3115 1 13 . 1 1 45 45 PHE HA H 45 4.920 4.920 4.834 0.086 25468
3116 1 13 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.050 0.557 25468
3117 1 13 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.584 0.499 25468
3118 1 13 . 1 1 45 45 PHE H H 45 9.042 9.042 8.814 0.228 25468
3119 1 13 . 1 1 46 46 VAL N N 46 119.357 119.357 120.038 -0.681 25468
3120 1 13 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.811 -0.118 25468
3121 1 13 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.935 -0.020 25468
3122 1 13 . 1 1 46 46 VAL CB C 46 34.666 34.666 33.896 0.770 25468
3123 1 13 . 1 1 46 46 VAL H H 46 9.555 9.555 8.713 0.842 25468
3124 1 13 . 1 1 47 47 CYS N N 47 122.793 122.793 127.098 -4.305 25468
3125 1 13 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.388 -0.558 25468
3126 1 13 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.576 12.154 25468
3127 1 13 . 1 1 47 47 CYS H H 47 9.044 9.044 8.806 0.238 25468
3128 1 13 . 1 1 48 48 VAL N N 48 129.864 129.864 129.442 0.422 25468
3129 1 13 . 1 1 48 48 VAL HA H 48 4.533 4.533 4.990 -0.457 25468
3130 1 13 . 1 1 48 48 VAL CA C 48 59.817 59.817 60.159 -0.342 25468
3131 1 13 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.626 -2.228 25468
3132 1 13 . 1 1 48 48 VAL H H 48 8.616 8.616 8.238 0.378 25468
3133 1 13 . 1 1 49 49 CYS N N 49 121.329 121.329 123.166 -1.837 25468
3134 1 13 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.325 -0.177 25468
3135 1 13 . 1 1 49 49 CYS CA C 49 50.429 50.429 57.557 -7.128 25468
3136 1 13 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.273 5.600 25468
3137 1 13 . 1 1 49 49 CYS H H 49 8.652 8.652 8.639 0.013 25468
3138 1 13 . 1 1 50 50 PHE N N 50 119.026 119.026 120.374 -1.348 25468
3139 1 13 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.156 -0.207 25468
3140 1 13 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.603 -0.951 25468
3141 1 13 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.491 -0.898 25468
3142 1 13 . 1 1 50 50 PHE H H 50 8.472 8.472 9.452 -0.980 25468
3143 1 13 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.201 0.531 25468
3144 1 13 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.659 0.550 25468
3145 1 13 . 1 1 52 52 LYS N N 52 119.951 119.951 119.635 0.316 25468
3146 1 13 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.073 -0.114 25468
3147 1 13 . 1 1 52 52 LYS CA C 52 57.670 57.670 58.807 -1.137 25468
3148 1 13 . 1 1 52 52 LYS CB C 52 33.225 33.225 32.239 0.986 25468
3149 1 13 . 1 1 52 52 LYS H H 52 8.681 8.681 8.537 0.144 25468
3150 1 13 . 1 1 53 53 TYR N N 53 118.889 118.889 116.013 2.876 25468
3151 1 13 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.482 -0.011 25468
3152 1 13 . 1 1 53 53 TYR CA C 53 58.049 58.049 56.755 1.294 25468
3153 1 13 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.679 0.589 25468
3154 1 13 . 1 1 53 53 TYR H H 53 8.215 8.215 7.552 0.663 25468
3155 1 13 . 1 1 54 54 TYR N N 54 121.087 121.087 118.541 2.546 25468
3156 1 13 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.530 -0.036 25468
3157 1 13 . 1 1 54 54 TYR CA C 54 58.101 58.101 57.932 0.169 25468
3158 1 13 . 1 1 54 54 TYR CB C 54 39.611 39.611 38.585 1.026 25468
3159 1 13 . 1 1 54 54 TYR H H 54 7.919 7.919 7.731 0.188 25468
3160 1 14 . 1 1 2 2 ASP N N 2 123.544 123.544 121.183 2.361 25468
3161 1 14 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.525 0.173 25468
3162 1 14 . 1 1 2 2 ASP CB C 2 39.907 39.907 40.587 -0.680 25468
3163 1 14 . 1 1 2 2 ASP H H 2 8.843 8.843 8.171 0.672 25468
3164 1 14 . 1 1 3 3 ILE N N 3 121.633 121.633 114.347 7.286 25468
3165 1 14 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.270 -0.112 25468
3166 1 14 . 1 1 3 3 ILE CA C 3 61.110 61.110 60.431 0.679 25468
3167 1 14 . 1 1 3 3 ILE CB C 3 39.038 39.038 40.243 -1.205 25468
3168 1 14 . 1 1 3 3 ILE H H 3 8.356 8.356 7.726 0.630 25468
3169 1 14 . 1 1 4 4 ASP N N 4 124.028 124.028 122.445 1.583 25468
3170 1 14 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.507 0.120 25468
3171 1 14 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.078 -1.302 25468
3172 1 14 . 1 1 4 4 ASP CB C 4 40.216 40.216 40.415 -0.199 25468
3173 1 14 . 1 1 4 4 ASP H H 4 8.460 8.460 8.342 0.118 25468
3174 1 14 . 1 1 5 5 GLY N N 5 110.531 110.531 108.489 2.042 25468
3175 1 14 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.163 0.552 25468
3176 1 14 . 1 1 5 5 GLY H H 5 8.405 8.405 8.075 0.330 25468
3177 1 14 . 1 1 6 6 ARG N N 6 119.193 119.193 119.209 -0.016 25468
3178 1 14 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.584 -0.237 25468
3179 1 14 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.561 1.686 25468
3180 1 14 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.002 1.087 25468
3181 1 14 . 1 1 6 6 ARG H H 6 8.128 8.128 7.918 0.210 25468
3182 1 14 . 1 1 7 7 LYS N N 7 120.971 120.971 119.671 1.300 25468
3183 1 14 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.937 -0.168 25468
3184 1 14 . 1 1 7 7 LYS CB C 7 33.230 33.230 33.319 -0.089 25468
3185 1 14 . 1 1 7 7 LYS H H 7 7.984 7.984 8.062 -0.078 25468
3186 1 14 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.377 0.161 25468
3187 1 14 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.521 0.682 25468
3188 1 14 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.673 -0.818 25468
3189 1 14 . 1 1 9 9 LEU N N 9 123.948 123.948 120.817 3.131 25468
3190 1 14 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.488 -0.001 25468
3191 1 14 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.651 -0.140 25468
3192 1 14 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.270 2.489 25468
3193 1 14 . 1 1 9 9 LEU H H 9 7.801 7.801 7.742 0.059 25468
3194 1 14 . 1 1 10 10 LEU N N 10 130.176 130.176 127.866 2.310 25468
3195 1 14 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.820 -0.266 25468
3196 1 14 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.428 1.043 25468
3197 1 14 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.369 -1.266 25468
3198 1 14 . 1 1 10 10 LEU H H 10 8.422 8.422 8.513 -0.091 25468
3199 1 14 . 1 1 11 11 ILE N N 11 120.839 120.839 121.530 -0.691 25468
3200 1 14 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.465 -0.079 25468
3201 1 14 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.765 0.766 25468
3202 1 14 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.745 0.612 25468
3203 1 14 . 1 1 11 11 ILE H H 11 8.289 8.289 8.396 -0.107 25468
3204 1 14 . 1 1 12 12 GLY N N 12 106.385 106.385 107.519 -1.134 25468
3205 1 14 . 1 1 12 12 GLY CA C 12 44.743 44.743 46.111 -1.368 25468
3206 1 14 . 1 1 12 12 GLY H H 12 7.125 7.125 7.520 -0.395 25468
3207 1 14 . 1 1 13 13 THR N N 13 110.566 110.566 112.416 -1.850 25468
3208 1 14 . 1 1 13 13 THR HA H 13 4.676 4.676 4.808 -0.132 25468
3209 1 14 . 1 1 13 13 THR CA C 13 62.119 62.119 60.010 2.109 25468
3210 1 14 . 1 1 13 13 THR CB C 13 71.115 71.115 71.651 -0.536 25468
3211 1 14 . 1 1 13 13 THR H H 13 9.046 9.046 8.214 0.832 25468
3212 1 14 . 1 1 14 14 CYS N N 14 117.216 117.216 122.795 -5.579 25468
3213 1 14 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.658 0.242 25468
3214 1 14 . 1 1 14 14 CYS CA C 14 58.201 58.201 60.015 -1.814 25468
3215 1 14 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.619 19.012 25468
3216 1 14 . 1 1 14 14 CYS H H 14 8.436 8.436 8.668 -0.232 25468
3217 1 14 . 1 1 15 15 ILE N N 15 118.247 118.247 119.764 -1.517 25468
3218 1 14 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.907 -0.021 25468
3219 1 14 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.678 -0.377 25468
3220 1 14 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.274 -0.778 25468
3221 1 14 . 1 1 15 15 ILE H H 15 7.244 7.244 7.374 -0.130 25468
3222 1 14 . 1 1 16 16 GLU N N 16 119.649 119.649 118.211 1.438 25468
3223 1 14 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.169 -0.336 25468
3224 1 14 . 1 1 16 16 GLU CA C 16 57.902 57.902 56.731 1.171 25468
3225 1 14 . 1 1 16 16 GLU CB C 16 28.781 28.781 30.412 -1.631 25468
3226 1 14 . 1 1 16 16 GLU H H 16 7.066 7.066 7.722 -0.656 25468
3227 1 14 . 1 1 17 17 PHE N N 17 114.996 114.996 120.517 -5.521 25468
3228 1 14 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.975 -0.411 25468
3229 1 14 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.270 -0.742 25468
3230 1 14 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.366 0.524 25468
3231 1 14 . 1 1 17 17 PHE H H 17 8.148 8.148 7.633 0.515 25468
3232 1 14 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.465 0.388 25468
3233 1 14 . 1 1 18 18 PRO CA C 18 62.917 62.917 63.257 -0.340 25468
3234 1 14 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.453 -0.585 25468
3235 1 14 . 1 1 19 19 THR N N 19 114.536 114.536 115.449 -0.913 25468
3236 1 14 . 1 1 19 19 THR HA H 19 3.650 3.650 3.921 -0.271 25468
3237 1 14 . 1 1 19 19 THR CA C 19 68.731 68.731 67.399 1.332 25468
3238 1 14 . 1 1 19 19 THR CB C 19 69.792 69.792 68.517 1.275 25468
3239 1 14 . 1 1 19 19 THR H H 19 8.370 8.370 8.687 -0.317 25468
3240 1 14 . 1 1 20 20 GLU N N 20 120.374 120.374 120.984 -0.610 25468
3241 1 14 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.283 -0.090 25468
3242 1 14 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.732 0.313 25468
3243 1 14 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.569 -0.313 25468
3244 1 14 . 1 1 20 20 GLU H H 20 9.038 9.038 8.839 0.199 25468
3245 1 14 . 1 1 21 21 LYS N N 21 122.432 122.432 120.864 1.568 25468
3246 1 14 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.105 0.060 25468
3247 1 14 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.631 -0.421 25468
3248 1 14 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.286 0.841 25468
3249 1 14 . 1 1 21 21 LYS H H 21 7.622 7.622 8.155 -0.533 25468
3250 1 14 . 1 1 22 22 CYS N N 22 121.466 121.466 119.311 2.155 25468
3251 1 14 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.008 0.077 25468
3252 1 14 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.987 -4.218 25468
3253 1 14 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.153 10.441 25468
3254 1 14 . 1 1 22 22 CYS H H 22 9.356 9.356 8.865 0.491 25468
3255 1 14 . 1 1 23 23 ASN N N 23 115.604 115.604 118.631 -3.027 25468
3256 1 14 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.418 -0.373 25468
3257 1 14 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.419 1.448 25468
3258 1 14 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.700 1.604 25468
3259 1 14 . 1 1 23 23 ASN H H 23 7.925 7.925 7.939 -0.014 25468
3260 1 14 . 1 1 24 24 LYS N N 24 116.665 116.665 121.114 -4.449 25468
3261 1 14 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.964 -0.052 25468
3262 1 14 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.749 0.160 25468
3263 1 14 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.205 0.830 25468
3264 1 14 . 1 1 24 24 LYS H H 24 7.955 7.955 8.580 -0.625 25468
3265 1 14 . 1 1 25 25 THR N N 25 116.759 116.759 115.711 1.048 25468
3266 1 14 . 1 1 25 25 THR HA H 25 3.859 3.859 4.112 -0.253 25468
3267 1 14 . 1 1 25 25 THR CA C 25 67.243 67.243 66.580 0.663 25468
3268 1 14 . 1 1 25 25 THR CB C 25 68.752 68.752 68.555 0.198 25468
3269 1 14 . 1 1 25 25 THR H H 25 8.518 8.518 8.573 -0.055 25468
3270 1 14 . 1 1 26 26 CYS N N 26 121.616 121.616 120.887 0.729 25468
3271 1 14 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.127 0.132 25468
3272 1 14 . 1 1 26 26 CYS CA C 26 57.603 57.603 62.091 -4.488 25468
3273 1 14 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.854 8.335 25468
3274 1 14 . 1 1 26 26 CYS H H 26 8.062 8.062 7.945 0.117 25468
3275 1 14 . 1 1 27 27 ILE N N 27 124.036 124.036 120.919 3.117 25468
3276 1 14 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.147 0.007 25468
3277 1 14 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.725 0.535 25468
3278 1 14 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.171 0.864 25468
3279 1 14 . 1 1 27 27 ILE H H 27 8.313 8.313 8.482 -0.169 25468
3280 1 14 . 1 1 28 28 GLU N N 28 121.780 121.780 120.185 1.595 25468
3281 1 14 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.102 0.092 25468
3282 1 14 . 1 1 28 28 GLU CA C 28 58.497 58.497 59.036 -0.539 25468
3283 1 14 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.223 -1.266 25468
3284 1 14 . 1 1 28 28 GLU H H 28 8.312 8.312 8.009 0.303 25468
3285 1 14 . 1 1 29 29 SER N N 29 114.001 114.001 113.889 0.112 25468
3286 1 14 . 1 1 29 29 SER HA H 29 4.661 4.661 4.295 0.366 25468
3287 1 14 . 1 1 29 29 SER CA C 29 58.377 58.377 58.785 -0.408 25468
3288 1 14 . 1 1 29 29 SER CB C 29 63.484 63.484 63.502 -0.018 25468
3289 1 14 . 1 1 29 29 SER H H 29 7.459 7.459 7.679 -0.220 25468
3290 1 14 . 1 1 30 30 ASN N N 30 112.213 112.213 118.031 -5.818 25468
3291 1 14 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.503 -0.076 25468
3292 1 14 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.350 0.691 25468
3293 1 14 . 1 1 30 30 ASN CB C 30 36.344 36.344 37.507 -1.163 25468
3294 1 14 . 1 1 30 30 ASN H H 30 8.067 8.067 7.946 0.121 25468
3295 1 14 . 1 1 31 31 PHE N N 31 116.306 116.306 116.888 -0.582 25468
3296 1 14 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.712 -0.138 25468
3297 1 14 . 1 1 31 31 PHE CA C 31 57.969 57.969 56.727 1.242 25468
3298 1 14 . 1 1 31 31 PHE CB C 31 38.699 38.699 41.362 -2.663 25468
3299 1 14 . 1 1 31 31 PHE H H 31 7.861 7.861 8.037 -0.176 25468
3300 1 14 . 1 1 32 32 ALA N N 32 121.103 121.103 125.454 -4.351 25468
3301 1 14 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.326 -0.135 25468
3302 1 14 . 1 1 32 32 ALA CA C 32 53.586 53.586 52.389 1.197 25468
3303 1 14 . 1 1 32 32 ALA CB C 32 19.211 19.211 17.256 1.955 25468
3304 1 14 . 1 1 32 32 ALA H H 32 8.403 8.403 9.150 -0.747 25468
3305 1 14 . 1 1 33 33 GLY N N 33 100.820 100.820 106.747 -5.927 25468
3306 1 14 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.462 0.408 25468
3307 1 14 . 1 1 33 33 GLY H H 33 7.258 7.258 7.818 -0.560 25468
3308 1 14 . 1 1 34 34 GLY N N 34 108.312 108.312 105.806 2.506 25468
3309 1 14 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.579 1.858 25468
3310 1 14 . 1 1 34 34 GLY H H 34 8.978 8.978 8.280 0.698 25468
3311 1 14 . 1 1 35 35 LYS N N 35 119.929 119.929 117.585 2.344 25468
3312 1 14 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.842 -0.248 25468
3313 1 14 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.863 -0.208 25468
3314 1 14 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.511 1.773 25468
3315 1 14 . 1 1 35 35 LYS H H 35 8.756 8.756 8.608 0.148 25468
3316 1 14 . 1 1 36 36 CYS N N 36 119.831 119.831 120.243 -0.412 25468
3317 1 14 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.656 -0.292 25468
3318 1 14 . 1 1 36 36 CYS CA C 36 57.218 57.218 57.845 -0.627 25468
3319 1 14 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.936 17.214 25468
3320 1 14 . 1 1 36 36 CYS H H 36 8.553 8.553 8.635 -0.082 25468
3321 1 14 . 1 1 37 37 VAL N N 37 120.392 120.392 121.053 -0.661 25468
3322 1 14 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.801 -0.037 25468
3323 1 14 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.140 1.107 25468
3324 1 14 . 1 1 37 37 VAL H H 37 9.587 9.587 8.894 0.693 25468
3325 1 14 . 1 1 38 38 HIS N N 38 118.311 118.311 117.950 0.361 25468
3326 1 14 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.448 -0.408 25468
3327 1 14 . 1 1 38 38 HIS CA C 38 53.975 53.975 52.836 1.139 25468
3328 1 14 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.742 -2.263 25468
3329 1 14 . 1 1 38 38 HIS H H 38 8.698 8.698 7.377 1.321 25468
3330 1 14 . 1 1 39 39 ILE N N 39 124.114 124.114 122.658 1.456 25468
3331 1 14 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.192 0.110 25468
3332 1 14 . 1 1 39 39 ILE CA C 39 59.840 59.840 59.505 0.335 25468
3333 1 14 . 1 1 39 39 ILE CB C 39 38.709 38.709 36.764 1.945 25468
3334 1 14 . 1 1 39 39 ILE H H 39 8.969 8.969 8.274 0.695 25468
3335 1 14 . 1 1 40 40 GLY N N 40 115.080 115.080 117.815 -2.735 25468
3336 1 14 . 1 1 40 40 GLY CA C 40 46.226 46.226 47.401 -1.175 25468
3337 1 14 . 1 1 40 40 GLY H H 40 8.715 8.715 8.932 -0.217 25468
3338 1 14 . 1 1 41 41 GLN N N 41 121.798 121.798 120.841 0.957 25468
3339 1 14 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.438 -0.134 25468
3340 1 14 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.235 0.415 25468
3341 1 14 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.529 -1.049 25468
3342 1 14 . 1 1 41 41 GLN H H 41 8.672 8.672 8.163 0.509 25468
3343 1 14 . 1 1 42 42 SER N N 42 114.462 114.462 117.147 -2.685 25468
3344 1 14 . 1 1 42 42 SER HA H 42 4.347 4.347 4.373 -0.026 25468
3345 1 14 . 1 1 42 42 SER CA C 42 58.072 58.072 60.070 -1.998 25468
3346 1 14 . 1 1 42 42 SER CB C 42 64.037 64.037 63.525 0.512 25468
3347 1 14 . 1 1 42 42 SER H H 42 7.725 7.725 8.800 -1.075 25468
3348 1 14 . 1 1 43 43 LEU N N 43 124.166 124.166 119.300 4.866 25468
3349 1 14 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.829 0.121 25468
3350 1 14 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.668 -0.373 25468
3351 1 14 . 1 1 43 43 LEU CB C 43 41.400 41.400 40.867 0.533 25468
3352 1 14 . 1 1 43 43 LEU H H 43 8.576 8.576 8.087 0.489 25468
3353 1 14 . 1 1 44 44 ASP N N 44 118.797 118.797 118.901 -0.104 25468
3354 1 14 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.725 0.006 25468
3355 1 14 . 1 1 44 44 ASP CB C 44 39.979 39.979 42.078 -2.099 25468
3356 1 14 . 1 1 44 44 ASP H H 44 8.163 8.163 7.950 0.213 25468
3357 1 14 . 1 1 45 45 PHE N N 45 123.595 123.595 123.566 0.029 25468
3358 1 14 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.216 -0.296 25468
3359 1 14 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.445 0.162 25468
3360 1 14 . 1 1 45 45 PHE CB C 45 40.083 40.083 40.082 0.001 25468
3361 1 14 . 1 1 45 45 PHE H H 45 9.042 9.042 8.886 0.156 25468
3362 1 14 . 1 1 46 46 VAL N N 46 119.357 119.357 116.835 2.522 25468
3363 1 14 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.738 -0.045 25468
3364 1 14 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.784 0.131 25468
3365 1 14 . 1 1 46 46 VAL CB C 46 34.666 34.666 35.224 -0.558 25468
3366 1 14 . 1 1 46 46 VAL H H 46 9.555 9.555 8.985 0.570 25468
3367 1 14 . 1 1 47 47 CYS N N 47 122.793 122.793 124.061 -1.268 25468
3368 1 14 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.332 -0.502 25468
3369 1 14 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.488 12.242 25468
3370 1 14 . 1 1 47 47 CYS H H 47 9.044 9.044 8.418 0.626 25468
3371 1 14 . 1 1 48 48 VAL N N 48 129.864 129.864 126.128 3.736 25468
3372 1 14 . 1 1 48 48 VAL HA H 48 4.533 4.533 4.950 -0.417 25468
3373 1 14 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.382 0.435 25468
3374 1 14 . 1 1 48 48 VAL CB C 48 34.398 34.398 35.901 -1.503 25468
3375 1 14 . 1 1 48 48 VAL H H 48 8.616 8.616 8.296 0.320 25468
3376 1 14 . 1 1 49 49 CYS N N 49 121.329 121.329 122.942 -1.613 25468
3377 1 14 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.180 -0.032 25468
3378 1 14 . 1 1 49 49 CYS CA C 49 50.429 50.429 57.252 -6.822 25468
3379 1 14 . 1 1 49 49 CYS CB C 49 33.873 33.873 29.046 4.827 25468
3380 1 14 . 1 1 49 49 CYS H H 49 8.652 8.652 8.384 0.268 25468
3381 1 14 . 1 1 50 50 PHE N N 50 119.026 119.026 119.441 -0.415 25468
3382 1 14 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.053 -0.104 25468
3383 1 14 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.296 -0.644 25468
3384 1 14 . 1 1 50 50 PHE CB C 50 40.593 40.593 42.056 -1.463 25468
3385 1 14 . 1 1 50 50 PHE H H 50 8.472 8.472 8.969 -0.497 25468
3386 1 14 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.173 0.559 25468
3387 1 14 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.929 0.280 25468
3388 1 14 . 1 1 52 52 LYS N N 52 119.951 119.951 120.449 -0.498 25468
3389 1 14 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.541 -0.582 25468
3390 1 14 . 1 1 52 52 LYS CA C 52 57.670 57.670 57.677 -0.007 25468
3391 1 14 . 1 1 52 52 LYS CB C 52 33.225 33.225 33.791 -0.566 25468
3392 1 14 . 1 1 52 52 LYS H H 52 8.681 8.681 8.671 0.010 25468
3393 1 14 . 1 1 53 53 TYR N N 53 118.889 118.889 115.866 3.023 25468
3394 1 14 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.784 -0.313 25468
3395 1 14 . 1 1 53 53 TYR CA C 53 58.049 58.049 55.553 2.496 25468
3396 1 14 . 1 1 53 53 TYR CB C 53 38.268 38.268 38.204 0.064 25468
3397 1 14 . 1 1 53 53 TYR H H 53 8.215 8.215 7.924 0.291 25468
3398 1 14 . 1 1 54 54 TYR N N 54 121.087 121.087 123.005 -1.918 25468
3399 1 14 . 1 1 54 54 TYR HA H 54 4.494 4.494 3.823 0.671 25468
3400 1 14 . 1 1 54 54 TYR CA C 54 58.101 58.101 59.253 -1.152 25468
3401 1 14 . 1 1 54 54 TYR CB C 54 39.611 39.611 38.839 0.772 25468
3402 1 14 . 1 1 54 54 TYR H H 54 7.919 7.919 7.758 0.161 25468
3403 1 15 . 1 1 2 2 ASP N N 2 123.544 123.544 119.667 3.877 25468
3404 1 15 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.420 0.278 25468
3405 1 15 . 1 1 2 2 ASP CB C 2 39.907 39.907 40.172 -0.265 25468
3406 1 15 . 1 1 2 2 ASP H H 2 8.843 8.843 8.437 0.406 25468
3407 1 15 . 1 1 3 3 ILE N N 3 121.633 121.633 119.882 1.751 25468
3408 1 15 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.203 -0.045 25468
3409 1 15 . 1 1 3 3 ILE CA C 3 61.110 61.110 60.338 0.772 25468
3410 1 15 . 1 1 3 3 ILE CB C 3 39.038 39.038 38.908 0.130 25468
3411 1 15 . 1 1 3 3 ILE H H 3 8.356 8.356 7.732 0.624 25468
3412 1 15 . 1 1 4 4 ASP N N 4 124.028 124.028 127.129 -3.101 25468
3413 1 15 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.497 0.130 25468
3414 1 15 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.343 -1.567 25468
3415 1 15 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.341 -1.125 25468
3416 1 15 . 1 1 4 4 ASP H H 4 8.460 8.460 8.701 -0.241 25468
3417 1 15 . 1 1 5 5 GLY N N 5 110.531 110.531 107.953 2.578 25468
3418 1 15 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.329 0.385 25468
3419 1 15 . 1 1 5 5 GLY H H 5 8.405 8.405 8.178 0.227 25468
3420 1 15 . 1 1 6 6 ARG N N 6 119.193 119.193 117.608 1.585 25468
3421 1 15 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.549 -0.202 25468
3422 1 15 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.822 1.425 25468
3423 1 15 . 1 1 6 6 ARG CB C 6 31.089 31.089 29.956 1.133 25468
3424 1 15 . 1 1 6 6 ARG H H 6 8.128 8.128 8.380 -0.252 25468
3425 1 15 . 1 1 7 7 LYS N N 7 120.971 120.971 119.456 1.515 25468
3426 1 15 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.834 -0.065 25468
3427 1 15 . 1 1 7 7 LYS CB C 7 33.230 33.230 34.119 -0.889 25468
3428 1 15 . 1 1 7 7 LYS H H 7 7.984 7.984 7.776 0.208 25468
3429 1 15 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.401 0.137 25468
3430 1 15 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.462 0.741 25468
3431 1 15 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.231 -0.376 25468
3432 1 15 . 1 1 9 9 LEU N N 9 123.948 123.948 122.711 1.237 25468
3433 1 15 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.508 -0.021 25468
3434 1 15 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.154 0.357 25468
3435 1 15 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.232 2.527 25468
3436 1 15 . 1 1 9 9 LEU H H 9 7.801 7.801 7.760 0.041 25468
3437 1 15 . 1 1 10 10 LEU N N 10 130.176 130.176 127.893 2.283 25468
3438 1 15 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.719 -0.165 25468
3439 1 15 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.890 0.581 25468
3440 1 15 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.434 -1.331 25468
3441 1 15 . 1 1 10 10 LEU H H 10 8.422 8.422 8.567 -0.145 25468
3442 1 15 . 1 1 11 11 ILE N N 11 120.839 120.839 120.147 0.692 25468
3443 1 15 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.457 -0.071 25468
3444 1 15 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.811 0.720 25468
3445 1 15 . 1 1 11 11 ILE CB C 11 39.357 39.357 39.157 0.200 25468
3446 1 15 . 1 1 11 11 ILE H H 11 8.289 8.289 8.620 -0.331 25468
3447 1 15 . 1 1 12 12 GLY N N 12 106.385 106.385 106.899 -0.514 25468
3448 1 15 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.587 -0.843 25468
3449 1 15 . 1 1 12 12 GLY H H 12 7.125 7.125 7.464 -0.339 25468
3450 1 15 . 1 1 13 13 THR N N 13 110.566 110.566 111.087 -0.521 25468
3451 1 15 . 1 1 13 13 THR HA H 13 4.676 4.676 4.902 -0.226 25468
3452 1 15 . 1 1 13 13 THR CA C 13 62.119 62.119 60.168 1.951 25468
3453 1 15 . 1 1 13 13 THR CB C 13 71.115 71.115 71.590 -0.475 25468
3454 1 15 . 1 1 13 13 THR H H 13 9.046 9.046 8.219 0.827 25468
3455 1 15 . 1 1 14 14 CYS N N 14 117.216 117.216 122.324 -5.108 25468
3456 1 15 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.668 0.232 25468
3457 1 15 . 1 1 14 14 CYS CA C 14 58.201 58.201 61.957 -3.756 25468
3458 1 15 . 1 1 14 14 CYS CB C 14 44.631 44.631 26.010 18.621 25468
3459 1 15 . 1 1 14 14 CYS H H 14 8.436 8.436 8.832 -0.396 25468
3460 1 15 . 1 1 15 15 ILE N N 15 118.247 118.247 119.714 -1.467 25468
3461 1 15 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.912 -0.026 25468
3462 1 15 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.861 -0.560 25468
3463 1 15 . 1 1 15 15 ILE CB C 15 37.496 37.496 37.073 0.423 25468
3464 1 15 . 1 1 15 15 ILE H H 15 7.244 7.244 7.711 -0.467 25468
3465 1 15 . 1 1 16 16 GLU N N 16 119.649 119.649 118.098 1.551 25468
3466 1 15 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.315 -0.482 25468
3467 1 15 . 1 1 16 16 GLU CA C 16 57.902 57.902 57.443 0.459 25468
3468 1 15 . 1 1 16 16 GLU CB C 16 28.781 28.781 31.150 -2.369 25468
3469 1 15 . 1 1 16 16 GLU H H 16 7.066 7.066 8.086 -1.020 25468
3470 1 15 . 1 1 17 17 PHE N N 17 114.996 114.996 121.072 -6.076 25468
3471 1 15 . 1 1 17 17 PHE HA H 17 4.564 4.564 5.010 -0.446 25468
3472 1 15 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.702 -1.174 25468
3473 1 15 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.491 0.399 25468
3474 1 15 . 1 1 17 17 PHE H H 17 8.148 8.148 8.611 -0.463 25468
3475 1 15 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.639 0.214 25468
3476 1 15 . 1 1 18 18 PRO CA C 18 62.917 62.917 63.286 -0.369 25468
3477 1 15 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.398 -0.530 25468
3478 1 15 . 1 1 19 19 THR N N 19 114.536 114.536 111.642 2.894 25468
3479 1 15 . 1 1 19 19 THR HA H 19 3.650 3.650 3.937 -0.287 25468
3480 1 15 . 1 1 19 19 THR CA C 19 68.731 68.731 66.912 1.819 25468
3481 1 15 . 1 1 19 19 THR CB C 19 69.792 69.792 68.727 1.065 25468
3482 1 15 . 1 1 19 19 THR H H 19 8.370 8.370 8.577 -0.207 25468
3483 1 15 . 1 1 20 20 GLU N N 20 120.374 120.374 120.403 -0.029 25468
3484 1 15 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.192 0.001 25468
3485 1 15 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.738 0.307 25468
3486 1 15 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.687 -0.431 25468
3487 1 15 . 1 1 20 20 GLU H H 20 9.038 9.038 8.963 0.075 25468
3488 1 15 . 1 1 21 21 LYS N N 21 122.432 122.432 120.845 1.587 25468
3489 1 15 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.119 0.046 25468
3490 1 15 . 1 1 21 21 LYS CA C 21 59.210 59.210 58.957 0.253 25468
3491 1 15 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.261 0.866 25468
3492 1 15 . 1 1 21 21 LYS H H 21 7.622 7.622 7.969 -0.347 25468
3493 1 15 . 1 1 22 22 CYS N N 22 121.466 121.466 120.091 1.375 25468
3494 1 15 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.290 -0.205 25468
3495 1 15 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.142 -3.373 25468
3496 1 15 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.048 10.546 25468
3497 1 15 . 1 1 22 22 CYS H H 22 9.356 9.356 8.761 0.595 25468
3498 1 15 . 1 1 23 23 ASN N N 23 115.604 115.604 118.956 -3.352 25468
3499 1 15 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.497 -0.452 25468
3500 1 15 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.393 1.474 25468
3501 1 15 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.761 1.543 25468
3502 1 15 . 1 1 23 23 ASN H H 23 7.925 7.925 8.118 -0.193 25468
3503 1 15 . 1 1 24 24 LYS N N 24 116.665 116.665 121.246 -4.581 25468
3504 1 15 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.984 -0.072 25468
3505 1 15 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.949 -0.040 25468
3506 1 15 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.296 0.739 25468
3507 1 15 . 1 1 24 24 LYS H H 24 7.955 7.955 8.441 -0.486 25468
3508 1 15 . 1 1 25 25 THR N N 25 116.759 116.759 115.678 1.081 25468
3509 1 15 . 1 1 25 25 THR HA H 25 3.859 3.859 4.130 -0.271 25468
3510 1 15 . 1 1 25 25 THR CA C 25 67.243 67.243 66.763 0.480 25468
3511 1 15 . 1 1 25 25 THR CB C 25 68.752 68.752 68.572 0.180 25468
3512 1 15 . 1 1 25 25 THR H H 25 8.518 8.518 8.645 -0.127 25468
3513 1 15 . 1 1 26 26 CYS N N 26 121.616 121.616 120.938 0.678 25468
3514 1 15 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.134 0.125 25468
3515 1 15 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.332 -3.729 25468
3516 1 15 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.832 8.357 25468
3517 1 15 . 1 1 26 26 CYS H H 26 8.062 8.062 7.642 0.420 25468
3518 1 15 . 1 1 27 27 ILE N N 27 124.036 124.036 120.001 4.035 25468
3519 1 15 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.164 -0.010 25468
3520 1 15 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.546 0.714 25468
3521 1 15 . 1 1 27 27 ILE CB C 27 38.035 38.035 36.954 1.081 25468
3522 1 15 . 1 1 27 27 ILE H H 27 8.313 8.313 8.476 -0.163 25468
3523 1 15 . 1 1 28 28 GLU N N 28 121.780 121.780 120.805 0.975 25468
3524 1 15 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.194 0.000 25468
3525 1 15 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.814 -0.317 25468
3526 1 15 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.282 -1.325 25468
3527 1 15 . 1 1 28 28 GLU H H 28 8.312 8.312 8.058 0.254 25468
3528 1 15 . 1 1 29 29 SER N N 29 114.001 114.001 113.301 0.700 25468
3529 1 15 . 1 1 29 29 SER HA H 29 4.661 4.661 4.408 0.253 25468
3530 1 15 . 1 1 29 29 SER CA C 29 58.377 58.377 59.304 -0.927 25468
3531 1 15 . 1 1 29 29 SER CB C 29 63.484 63.484 63.069 0.415 25468
3532 1 15 . 1 1 29 29 SER H H 29 7.459 7.459 7.678 -0.219 25468
3533 1 15 . 1 1 30 30 ASN N N 30 112.213 112.213 113.349 -1.136 25468
3534 1 15 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.550 -0.123 25468
3535 1 15 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.573 0.468 25468
3536 1 15 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.659 -0.315 25468
3537 1 15 . 1 1 30 30 ASN H H 30 8.067 8.067 7.913 0.154 25468
3538 1 15 . 1 1 31 31 PHE N N 31 116.306 116.306 118.737 -2.431 25468
3539 1 15 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.658 -0.084 25468
3540 1 15 . 1 1 31 31 PHE CA C 31 57.969 57.969 57.268 0.701 25468
3541 1 15 . 1 1 31 31 PHE CB C 31 38.699 38.699 40.128 -1.429 25468
3542 1 15 . 1 1 31 31 PHE H H 31 7.861 7.861 7.975 -0.114 25468
3543 1 15 . 1 1 32 32 ALA N N 32 121.103 121.103 122.383 -1.280 25468
3544 1 15 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.457 -0.266 25468
3545 1 15 . 1 1 32 32 ALA CA C 32 53.586 53.586 53.527 0.059 25468
3546 1 15 . 1 1 32 32 ALA CB C 32 19.211 19.211 19.698 -0.487 25468
3547 1 15 . 1 1 32 32 ALA H H 32 8.403 8.403 8.840 -0.437 25468
3548 1 15 . 1 1 33 33 GLY N N 33 100.820 100.820 103.531 -2.711 25468
3549 1 15 . 1 1 33 33 GLY CA C 33 44.870 44.870 45.205 -0.335 25468
3550 1 15 . 1 1 33 33 GLY H H 33 7.258 7.258 7.617 -0.359 25468
3551 1 15 . 1 1 34 34 GLY N N 34 108.312 108.312 105.303 3.009 25468
3552 1 15 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.275 2.162 25468
3553 1 15 . 1 1 34 34 GLY H H 34 8.978 8.978 8.321 0.657 25468
3554 1 15 . 1 1 35 35 LYS N N 35 119.929 119.929 117.054 2.875 25468
3555 1 15 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.801 -0.207 25468
3556 1 15 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.863 -0.208 25468
3557 1 15 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.212 2.072 25468
3558 1 15 . 1 1 35 35 LYS H H 35 8.756 8.756 8.127 0.629 25468
3559 1 15 . 1 1 36 36 CYS N N 36 119.831 119.831 119.724 0.107 25468
3560 1 15 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.536 -0.172 25468
3561 1 15 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.291 -1.073 25468
3562 1 15 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.682 17.468 25468
3563 1 15 . 1 1 36 36 CYS H H 36 8.553 8.553 8.491 0.062 25468
3564 1 15 . 1 1 37 37 VAL N N 37 120.392 120.392 121.527 -1.135 25468
3565 1 15 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.398 0.366 25468
3566 1 15 . 1 1 37 37 VAL CB C 37 36.247 36.247 34.569 1.677 25468
3567 1 15 . 1 1 37 37 VAL H H 37 9.587 9.587 8.310 1.277 25468
3568 1 15 . 1 1 38 38 HIS N N 38 118.311 118.311 117.570 0.741 25468
3569 1 15 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.716 -0.676 25468
3570 1 15 . 1 1 38 38 HIS CA C 38 53.975 53.975 53.111 0.864 25468
3571 1 15 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.846 -2.366 25468
3572 1 15 . 1 1 38 38 HIS H H 38 8.698 8.698 7.698 1.000 25468
3573 1 15 . 1 1 39 39 ILE N N 39 124.114 124.114 121.075 3.039 25468
3574 1 15 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.198 0.104 25468
3575 1 15 . 1 1 39 39 ILE CA C 39 59.840 59.840 61.103 -1.263 25468
3576 1 15 . 1 1 39 39 ILE CB C 39 38.709 38.709 40.402 -1.693 25468
3577 1 15 . 1 1 39 39 ILE H H 39 8.969 8.969 8.703 0.266 25468
3578 1 15 . 1 1 40 40 GLY N N 40 115.080 115.080 114.924 0.156 25468
3579 1 15 . 1 1 40 40 GLY CA C 40 46.226 46.226 45.528 0.699 25468
3580 1 15 . 1 1 40 40 GLY H H 40 8.715 8.715 8.956 -0.241 25468
3581 1 15 . 1 1 41 41 GLN N N 41 121.798 121.798 115.657 6.141 25468
3582 1 15 . 1 1 41 41 GLN HA H 41 4.304 4.304 3.952 0.352 25468
3583 1 15 . 1 1 41 41 GLN CA C 41 55.650 55.650 56.827 -1.177 25468
3584 1 15 . 1 1 41 41 GLN CB C 41 28.480 28.480 26.768 1.712 25468
3585 1 15 . 1 1 41 41 GLN H H 41 8.672 8.672 8.622 0.050 25468
3586 1 15 . 1 1 42 42 SER N N 42 114.462 114.462 113.843 0.619 25468
3587 1 15 . 1 1 42 42 SER HA H 42 4.347 4.347 4.380 -0.033 25468
3588 1 15 . 1 1 42 42 SER CA C 42 58.072 58.072 59.618 -1.546 25468
3589 1 15 . 1 1 42 42 SER CB C 42 64.037 64.037 63.671 0.366 25468
3590 1 15 . 1 1 42 42 SER H H 42 7.725 7.725 8.072 -0.347 25468
3591 1 15 . 1 1 43 43 LEU N N 43 124.166 124.166 119.338 4.828 25468
3592 1 15 . 1 1 43 43 LEU HA H 43 3.950 3.950 4.245 -0.295 25468
3593 1 15 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.665 -0.370 25468
3594 1 15 . 1 1 43 43 LEU CB C 43 41.400 41.400 40.902 0.498 25468
3595 1 15 . 1 1 43 43 LEU H H 43 8.576 8.576 8.101 0.475 25468
3596 1 15 . 1 1 44 44 ASP N N 44 118.797 118.797 119.863 -1.066 25468
3597 1 15 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.867 -0.136 25468
3598 1 15 . 1 1 44 44 ASP CB C 44 39.979 39.979 41.855 -1.876 25468
3599 1 15 . 1 1 44 44 ASP H H 44 8.163 8.163 8.171 -0.008 25468
3600 1 15 . 1 1 45 45 PHE N N 45 123.595 123.595 125.101 -1.506 25468
3601 1 15 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.128 -0.208 25468
3602 1 15 . 1 1 45 45 PHE CA C 45 57.607 57.607 55.446 2.161 25468
3603 1 15 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.417 0.666 25468
3604 1 15 . 1 1 45 45 PHE H H 45 9.042 9.042 8.981 0.061 25468
3605 1 15 . 1 1 46 46 VAL N N 46 119.357 119.357 119.274 0.083 25468
3606 1 15 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.786 -0.093 25468
3607 1 15 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.275 0.640 25468
3608 1 15 . 1 1 46 46 VAL CB C 46 34.666 34.666 33.746 0.920 25468
3609 1 15 . 1 1 46 46 VAL H H 46 9.555 9.555 8.530 1.025 25468
3610 1 15 . 1 1 47 47 CYS N N 47 122.793 122.793 125.908 -3.115 25468
3611 1 15 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.330 -0.500 25468
3612 1 15 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.724 12.006 25468
3613 1 15 . 1 1 47 47 CYS H H 47 9.044 9.044 8.756 0.288 25468
3614 1 15 . 1 1 48 48 VAL N N 48 129.864 129.864 127.837 2.027 25468
3615 1 15 . 1 1 48 48 VAL HA H 48 4.533 4.533 4.779 -0.246 25468
3616 1 15 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.279 0.538 25468
3617 1 15 . 1 1 48 48 VAL CB C 48 34.398 34.398 35.644 -1.246 25468
3618 1 15 . 1 1 48 48 VAL H H 48 8.616 8.616 8.071 0.545 25468
3619 1 15 . 1 1 49 49 CYS N N 49 121.329 121.329 123.956 -2.627 25468
3620 1 15 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.036 0.112 25468
3621 1 15 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.677 -6.248 25468
3622 1 15 . 1 1 49 49 CYS CB C 49 33.873 33.873 29.034 4.839 25468
3623 1 15 . 1 1 49 49 CYS H H 49 8.652 8.652 8.258 0.394 25468
3624 1 15 . 1 1 50 50 PHE N N 50 119.026 119.026 120.681 -1.655 25468
3625 1 15 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.035 -0.086 25468
3626 1 15 . 1 1 50 50 PHE CA C 50 54.652 54.652 54.838 -0.186 25468
3627 1 15 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.721 -1.128 25468
3628 1 15 . 1 1 50 50 PHE H H 50 8.472 8.472 8.950 -0.478 25468
3629 1 15 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.453 0.279 25468
3630 1 15 . 1 1 51 51 PRO CB C 51 33.209 33.209 33.029 0.180 25468
3631 1 15 . 1 1 52 52 LYS N N 52 119.951 119.951 121.260 -1.309 25468
3632 1 15 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.001 -0.042 25468
3633 1 15 . 1 1 52 52 LYS CA C 52 57.670 57.670 58.757 -1.087 25468
3634 1 15 . 1 1 52 52 LYS CB C 52 33.225 33.225 32.073 1.152 25468
3635 1 15 . 1 1 52 52 LYS H H 52 8.681 8.681 8.558 0.123 25468
3636 1 15 . 1 1 53 53 TYR N N 53 118.889 118.889 116.543 2.346 25468
3637 1 15 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.641 -0.170 25468
3638 1 15 . 1 1 53 53 TYR CA C 53 58.049 58.049 56.351 1.698 25468
3639 1 15 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.257 1.011 25468
3640 1 15 . 1 1 53 53 TYR H H 53 8.215 8.215 7.779 0.436 25468
3641 1 15 . 1 1 54 54 TYR N N 54 121.087 121.087 121.906 -0.819 25468
3642 1 15 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.491 0.003 25468
3643 1 15 . 1 1 54 54 TYR CA C 54 58.101 58.101 59.248 -1.147 25468
3644 1 15 . 1 1 54 54 TYR CB C 54 39.611 39.611 38.894 0.717 25468
3645 1 15 . 1 1 54 54 TYR H H 54 7.919 7.919 7.646 0.273 25468
3646 1 16 . 1 1 2 2 ASP N N 2 123.544 123.544 122.179 1.365 25468
3647 1 16 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.556 0.142 25468
3648 1 16 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.204 -1.297 25468
3649 1 16 . 1 1 2 2 ASP H H 2 8.843 8.843 8.440 0.403 25468
3650 1 16 . 1 1 3 3 ILE N N 3 121.633 121.633 121.521 0.112 25468
3651 1 16 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.010 0.148 25468
3652 1 16 . 1 1 3 3 ILE CA C 3 61.110 61.110 60.483 0.627 25468
3653 1 16 . 1 1 3 3 ILE CB C 3 39.038 39.038 36.322 2.716 25468
3654 1 16 . 1 1 3 3 ILE H H 3 8.356 8.356 7.635 0.721 25468
3655 1 16 . 1 1 4 4 ASP N N 4 124.028 124.028 128.558 -4.530 25468
3656 1 16 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.420 0.207 25468
3657 1 16 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.052 -1.276 25468
3658 1 16 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.441 -1.225 25468
3659 1 16 . 1 1 4 4 ASP H H 4 8.460 8.460 8.028 0.432 25468
3660 1 16 . 1 1 5 5 GLY N N 5 110.531 110.531 107.602 2.929 25468
3661 1 16 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.595 0.119 25468
3662 1 16 . 1 1 5 5 GLY H H 5 8.405 8.405 8.380 0.025 25468
3663 1 16 . 1 1 6 6 ARG N N 6 119.193 119.193 118.901 0.292 25468
3664 1 16 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.293 0.054 25468
3665 1 16 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.628 1.619 25468
3666 1 16 . 1 1 6 6 ARG CB C 6 31.089 31.089 29.629 1.460 25468
3667 1 16 . 1 1 6 6 ARG H H 6 8.128 8.128 8.028 0.100 25468
3668 1 16 . 1 1 7 7 LYS N N 7 120.971 120.971 120.134 0.837 25468
3669 1 16 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.650 0.119 25468
3670 1 16 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.212 1.018 25468
3671 1 16 . 1 1 7 7 LYS H H 7 7.984 7.984 7.594 0.390 25468
3672 1 16 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.327 0.211 25468
3673 1 16 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.689 0.514 25468
3674 1 16 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.025 -0.170 25468
3675 1 16 . 1 1 9 9 LEU N N 9 123.948 123.948 123.674 0.274 25468
3676 1 16 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.503 -0.016 25468
3677 1 16 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.364 0.148 25468
3678 1 16 . 1 1 9 9 LEU CB C 9 46.759 46.759 43.990 2.769 25468
3679 1 16 . 1 1 9 9 LEU H H 9 7.801 7.801 7.926 -0.125 25468
3680 1 16 . 1 1 10 10 LEU N N 10 130.176 130.176 128.124 2.052 25468
3681 1 16 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.995 -0.441 25468
3682 1 16 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.257 1.214 25468
3683 1 16 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.209 -1.106 25468
3684 1 16 . 1 1 10 10 LEU H H 10 8.422 8.422 8.553 -0.131 25468
3685 1 16 . 1 1 11 11 ILE N N 11 120.839 120.839 122.125 -1.286 25468
3686 1 16 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.508 -0.122 25468
3687 1 16 . 1 1 11 11 ILE CA C 11 61.531 61.531 61.031 0.500 25468
3688 1 16 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.623 0.734 25468
3689 1 16 . 1 1 11 11 ILE H H 11 8.289 8.289 8.452 -0.163 25468
3690 1 16 . 1 1 12 12 GLY N N 12 106.385 106.385 106.908 -0.523 25468
3691 1 16 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.739 -0.996 25468
3692 1 16 . 1 1 12 12 GLY H H 12 7.125 7.125 7.846 -0.721 25468
3693 1 16 . 1 1 13 13 THR N N 13 110.566 110.566 111.337 -0.771 25468
3694 1 16 . 1 1 13 13 THR HA H 13 4.676 4.676 4.919 -0.243 25468
3695 1 16 . 1 1 13 13 THR CA C 13 62.119 62.119 60.182 1.937 25468
3696 1 16 . 1 1 13 13 THR CB C 13 71.115 71.115 71.744 -0.629 25468
3697 1 16 . 1 1 13 13 THR H H 13 9.046 9.046 8.136 0.910 25468
3698 1 16 . 1 1 14 14 CYS N N 14 117.216 117.216 121.071 -3.855 25468
3699 1 16 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.719 0.181 25468
3700 1 16 . 1 1 14 14 CYS CA C 14 58.201 58.201 61.050 -2.849 25468
3701 1 16 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.927 18.704 25468
3702 1 16 . 1 1 14 14 CYS H H 14 8.436 8.436 8.541 -0.105 25468
3703 1 16 . 1 1 15 15 ILE N N 15 118.247 118.247 115.824 2.423 25468
3704 1 16 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.988 -0.102 25468
3705 1 16 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.452 -0.151 25468
3706 1 16 . 1 1 15 15 ILE CB C 15 37.496 37.496 37.791 -0.295 25468
3707 1 16 . 1 1 15 15 ILE H H 15 7.244 7.244 8.001 -0.757 25468
3708 1 16 . 1 1 16 16 GLU N N 16 119.649 119.649 118.171 1.478 25468
3709 1 16 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.215 -0.382 25468
3710 1 16 . 1 1 16 16 GLU CA C 16 57.902 57.902 56.214 1.688 25468
3711 1 16 . 1 1 16 16 GLU CB C 16 28.781 28.781 31.167 -2.386 25468
3712 1 16 . 1 1 16 16 GLU H H 16 7.066 7.066 7.782 -0.716 25468
3713 1 16 . 1 1 17 17 PHE N N 17 114.996 114.996 122.324 -7.328 25468
3714 1 16 . 1 1 17 17 PHE HA H 17 4.564 4.564 5.015 -0.451 25468
3715 1 16 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.056 -0.528 25468
3716 1 16 . 1 1 17 17 PHE CB C 17 39.890 39.890 38.912 0.978 25468
3717 1 16 . 1 1 17 17 PHE H H 17 8.148 8.148 8.474 -0.326 25468
3718 1 16 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.556 0.297 25468
3719 1 16 . 1 1 18 18 PRO CA C 18 62.917 62.917 62.755 0.162 25468
3720 1 16 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.668 -0.800 25468
3721 1 16 . 1 1 19 19 THR N N 19 114.536 114.536 114.141 0.395 25468
3722 1 16 . 1 1 19 19 THR HA H 19 3.650 3.650 3.948 -0.298 25468
3723 1 16 . 1 1 19 19 THR CA C 19 68.731 68.731 68.191 0.540 25468
3724 1 16 . 1 1 19 19 THR CB C 19 69.792 69.792 68.724 1.068 25468
3725 1 16 . 1 1 19 19 THR H H 19 8.370 8.370 8.626 -0.256 25468
3726 1 16 . 1 1 20 20 GLU N N 20 120.374 120.374 121.177 -0.803 25468
3727 1 16 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.192 0.001 25468
3728 1 16 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.656 0.389 25468
3729 1 16 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.774 -0.518 25468
3730 1 16 . 1 1 20 20 GLU H H 20 9.038 9.038 8.809 0.229 25468
3731 1 16 . 1 1 21 21 LYS N N 21 122.432 122.432 119.883 2.549 25468
3732 1 16 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.154 0.011 25468
3733 1 16 . 1 1 21 21 LYS CA C 21 59.210 59.210 58.979 0.231 25468
3734 1 16 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.300 0.827 25468
3735 1 16 . 1 1 21 21 LYS H H 21 7.622 7.622 8.173 -0.551 25468
3736 1 16 . 1 1 22 22 CYS N N 22 121.466 121.466 120.348 1.118 25468
3737 1 16 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.085 0.000 25468
3738 1 16 . 1 1 22 22 CYS CA C 22 58.769 58.769 61.825 -3.057 25468
3739 1 16 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.023 10.571 25468
3740 1 16 . 1 1 22 22 CYS H H 22 9.356 9.356 8.689 0.667 25468
3741 1 16 . 1 1 23 23 ASN N N 23 115.604 115.604 118.398 -2.794 25468
3742 1 16 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.482 -0.437 25468
3743 1 16 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.327 1.540 25468
3744 1 16 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.856 1.448 25468
3745 1 16 . 1 1 23 23 ASN H H 23 7.925 7.925 8.102 -0.177 25468
3746 1 16 . 1 1 24 24 LYS N N 24 116.665 116.665 121.396 -4.731 25468
3747 1 16 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.949 -0.037 25468
3748 1 16 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.772 0.137 25468
3749 1 16 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.334 0.701 25468
3750 1 16 . 1 1 24 24 LYS H H 24 7.955 7.955 7.759 0.196 25468
3751 1 16 . 1 1 25 25 THR N N 25 116.759 116.759 112.560 4.199 25468
3752 1 16 . 1 1 25 25 THR HA H 25 3.859 3.859 3.968 -0.109 25468
3753 1 16 . 1 1 25 25 THR CA C 25 67.243 67.243 66.013 1.230 25468
3754 1 16 . 1 1 25 25 THR CB C 25 68.752 68.752 68.335 0.417 25468
3755 1 16 . 1 1 25 25 THR H H 25 8.518 8.518 8.338 0.180 25468
3756 1 16 . 1 1 26 26 CYS N N 26 121.616 121.616 120.745 0.871 25468
3757 1 16 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.198 0.061 25468
3758 1 16 . 1 1 26 26 CYS CA C 26 57.603 57.603 60.615 -3.012 25468
3759 1 16 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.766 8.423 25468
3760 1 16 . 1 1 26 26 CYS H H 26 8.062 8.062 7.386 0.676 25468
3761 1 16 . 1 1 27 27 ILE N N 27 124.036 124.036 120.569 3.467 25468
3762 1 16 . 1 1 27 27 ILE HA H 27 4.154 4.154 3.905 0.249 25468
3763 1 16 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.840 0.420 25468
3764 1 16 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.105 0.930 25468
3765 1 16 . 1 1 27 27 ILE H H 27 8.313 8.313 8.514 -0.201 25468
3766 1 16 . 1 1 28 28 GLU N N 28 121.780 121.780 120.966 0.814 25468
3767 1 16 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.105 0.089 25468
3768 1 16 . 1 1 28 28 GLU CA C 28 58.497 58.497 59.052 -0.555 25468
3769 1 16 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.289 -1.332 25468
3770 1 16 . 1 1 28 28 GLU H H 28 8.312 8.312 8.497 -0.185 25468
3771 1 16 . 1 1 29 29 SER N N 29 114.001 114.001 113.376 0.625 25468
3772 1 16 . 1 1 29 29 SER HA H 29 4.661 4.661 4.272 0.389 25468
3773 1 16 . 1 1 29 29 SER CA C 29 58.377 58.377 58.737 -0.360 25468
3774 1 16 . 1 1 29 29 SER CB C 29 63.484 63.484 63.049 0.435 25468
3775 1 16 . 1 1 29 29 SER H H 29 7.459 7.459 7.687 -0.228 25468
3776 1 16 . 1 1 30 30 ASN N N 30 112.213 112.213 116.721 -4.508 25468
3777 1 16 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.549 -0.122 25468
3778 1 16 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.779 0.262 25468
3779 1 16 . 1 1 30 30 ASN CB C 30 36.344 36.344 37.513 -1.169 25468
3780 1 16 . 1 1 30 30 ASN H H 30 8.067 8.067 7.947 0.120 25468
3781 1 16 . 1 1 31 31 PHE N N 31 116.306 116.306 117.104 -0.798 25468
3782 1 16 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.549 0.025 25468
3783 1 16 . 1 1 31 31 PHE CA C 31 57.969 57.969 57.339 0.630 25468
3784 1 16 . 1 1 31 31 PHE CB C 31 38.699 38.699 39.915 -1.216 25468
3785 1 16 . 1 1 31 31 PHE H H 31 7.861 7.861 7.962 -0.101 25468
3786 1 16 . 1 1 32 32 ALA N N 32 121.103 121.103 122.586 -1.483 25468
3787 1 16 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.184 0.007 25468
3788 1 16 . 1 1 32 32 ALA CA C 32 53.586 53.586 53.837 -0.251 25468
3789 1 16 . 1 1 32 32 ALA CB C 32 19.211 19.211 19.346 -0.135 25468
3790 1 16 . 1 1 32 32 ALA H H 32 8.403 8.403 8.840 -0.437 25468
3791 1 16 . 1 1 33 33 GLY N N 33 100.820 100.820 103.489 -2.669 25468
3792 1 16 . 1 1 33 33 GLY CA C 33 44.870 44.870 45.211 -0.341 25468
3793 1 16 . 1 1 33 33 GLY H H 33 7.258 7.258 7.600 -0.342 25468
3794 1 16 . 1 1 34 34 GLY N N 34 108.312 108.312 105.454 2.858 25468
3795 1 16 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.131 2.306 25468
3796 1 16 . 1 1 34 34 GLY H H 34 8.978 8.978 8.403 0.575 25468
3797 1 16 . 1 1 35 35 LYS N N 35 119.929 119.929 116.549 3.380 25468
3798 1 16 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.863 -0.269 25468
3799 1 16 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.780 -0.125 25468
3800 1 16 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.439 1.845 25468
3801 1 16 . 1 1 35 35 LYS H H 35 8.756 8.756 8.085 0.671 25468
3802 1 16 . 1 1 36 36 CYS N N 36 119.831 119.831 120.389 -0.558 25468
3803 1 16 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.638 -0.274 25468
3804 1 16 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.924 -1.706 25468
3805 1 16 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.434 17.716 25468
3806 1 16 . 1 1 36 36 CYS H H 36 8.553 8.553 8.700 -0.147 25468
3807 1 16 . 1 1 37 37 VAL N N 37 120.392 120.392 123.419 -3.027 25468
3808 1 16 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.955 -0.191 25468
3809 1 16 . 1 1 37 37 VAL CB C 37 36.247 36.247 34.698 1.549 25468
3810 1 16 . 1 1 37 37 VAL H H 37 9.587 9.587 8.759 0.828 25468
3811 1 16 . 1 1 38 38 HIS N N 38 118.311 118.311 117.970 0.341 25468
3812 1 16 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.469 -0.429 25468
3813 1 16 . 1 1 38 38 HIS CA C 38 53.975 53.975 52.873 1.102 25468
3814 1 16 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.839 -2.359 25468
3815 1 16 . 1 1 38 38 HIS H H 38 8.698 8.698 7.739 0.959 25468
3816 1 16 . 1 1 39 39 ILE N N 39 124.114 124.114 122.306 1.808 25468
3817 1 16 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.155 0.147 25468
3818 1 16 . 1 1 39 39 ILE CA C 39 59.840 59.840 59.537 0.303 25468
3819 1 16 . 1 1 39 39 ILE CB C 39 38.709 38.709 36.981 1.728 25468
3820 1 16 . 1 1 39 39 ILE H H 39 8.969 8.969 8.556 0.413 25468
3821 1 16 . 1 1 40 40 GLY N N 40 115.080 115.080 118.109 -3.029 25468
3822 1 16 . 1 1 40 40 GLY CA C 40 46.226 46.226 47.310 -1.084 25468
3823 1 16 . 1 1 40 40 GLY H H 40 8.715 8.715 8.943 -0.228 25468
3824 1 16 . 1 1 41 41 GLN N N 41 121.798 121.798 121.886 -0.088 25468
3825 1 16 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.467 -0.163 25468
3826 1 16 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.545 0.105 25468
3827 1 16 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.687 -1.207 25468
3828 1 16 . 1 1 41 41 GLN H H 41 8.672 8.672 8.183 0.489 25468
3829 1 16 . 1 1 42 42 SER N N 42 114.462 114.462 116.781 -2.319 25468
3830 1 16 . 1 1 42 42 SER HA H 42 4.347 4.347 4.454 -0.107 25468
3831 1 16 . 1 1 42 42 SER CA C 42 58.072 58.072 59.052 -0.980 25468
3832 1 16 . 1 1 42 42 SER CB C 42 64.037 64.037 63.601 0.436 25468
3833 1 16 . 1 1 42 42 SER H H 42 7.725 7.725 8.779 -1.054 25468
3834 1 16 . 1 1 43 43 LEU N N 43 124.166 124.166 119.572 4.594 25468
3835 1 16 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.794 0.156 25468
3836 1 16 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.633 -0.339 25468
3837 1 16 . 1 1 43 43 LEU CB C 43 41.400 41.400 40.958 0.442 25468
3838 1 16 . 1 1 43 43 LEU H H 43 8.576 8.576 8.034 0.542 25468
3839 1 16 . 1 1 44 44 ASP N N 44 118.797 118.797 118.864 -0.067 25468
3840 1 16 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.667 0.064 25468
3841 1 16 . 1 1 44 44 ASP CB C 44 39.979 39.979 41.953 -1.974 25468
3842 1 16 . 1 1 44 44 ASP H H 44 8.163 8.163 7.893 0.270 25468
3843 1 16 . 1 1 45 45 PHE N N 45 123.595 123.595 124.261 -0.666 25468
3844 1 16 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.098 -0.178 25468
3845 1 16 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.409 0.198 25468
3846 1 16 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.579 0.504 25468
3847 1 16 . 1 1 45 45 PHE H H 45 9.042 9.042 8.874 0.168 25468
3848 1 16 . 1 1 46 46 VAL N N 46 119.357 119.357 117.503 1.854 25468
3849 1 16 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.884 -0.191 25468
3850 1 16 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.487 0.428 25468
3851 1 16 . 1 1 46 46 VAL CB C 46 34.666 34.666 34.706 -0.040 25468
3852 1 16 . 1 1 46 46 VAL H H 46 9.555 9.555 8.877 0.678 25468
3853 1 16 . 1 1 47 47 CYS N N 47 122.793 122.793 124.800 -2.007 25468
3854 1 16 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.485 -0.655 25468
3855 1 16 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.749 11.981 25468
3856 1 16 . 1 1 47 47 CYS H H 47 9.044 9.044 8.464 0.580 25468
3857 1 16 . 1 1 48 48 VAL N N 48 129.864 129.864 128.941 0.923 25468
3858 1 16 . 1 1 48 48 VAL HA H 48 4.533 4.533 4.981 -0.448 25468
3859 1 16 . 1 1 48 48 VAL CA C 48 59.817 59.817 60.002 -0.185 25468
3860 1 16 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.483 -2.085 25468
3861 1 16 . 1 1 48 48 VAL H H 48 8.616 8.616 8.058 0.558 25468
3862 1 16 . 1 1 49 49 CYS N N 49 121.329 121.329 123.843 -2.514 25468
3863 1 16 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.193 -0.045 25468
3864 1 16 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.532 -6.103 25468
3865 1 16 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.832 5.041 25468
3866 1 16 . 1 1 49 49 CYS H H 49 8.652 8.652 8.062 0.590 25468
3867 1 16 . 1 1 50 50 PHE N N 50 119.026 119.026 120.634 -1.608 25468
3868 1 16 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.137 -0.188 25468
3869 1 16 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.180 -0.528 25468
3870 1 16 . 1 1 50 50 PHE CB C 50 40.593 40.593 42.051 -1.458 25468
3871 1 16 . 1 1 50 50 PHE H H 50 8.472 8.472 8.791 -0.319 25468
3872 1 16 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.195 0.537 25468
3873 1 16 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.905 0.304 25468
3874 1 16 . 1 1 52 52 LYS N N 52 119.951 119.951 120.950 -0.999 25468
3875 1 16 . 1 1 52 52 LYS HA H 52 3.959 3.959 3.713 0.246 25468
3876 1 16 . 1 1 52 52 LYS CA C 52 57.670 57.670 58.321 -0.651 25468
3877 1 16 . 1 1 52 52 LYS CB C 52 33.225 33.225 32.289 0.936 25468
3878 1 16 . 1 1 52 52 LYS H H 52 8.681 8.681 8.211 0.470 25468
3879 1 16 . 1 1 53 53 TYR N N 53 118.889 118.889 114.422 4.467 25468
3880 1 16 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.596 -0.125 25468
3881 1 16 . 1 1 53 53 TYR CA C 53 58.049 58.049 57.354 0.695 25468
3882 1 16 . 1 1 53 53 TYR CB C 53 38.268 38.268 38.721 -0.453 25468
3883 1 16 . 1 1 53 53 TYR H H 53 8.215 8.215 7.841 0.374 25468
3884 1 16 . 1 1 54 54 TYR N N 54 121.087 121.087 122.219 -1.132 25468
3885 1 16 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.771 -0.277 25468
3886 1 16 . 1 1 54 54 TYR CA C 54 58.101 58.101 57.588 0.513 25468
3887 1 16 . 1 1 54 54 TYR CB C 54 39.611 39.611 39.166 0.445 25468
3888 1 16 . 1 1 54 54 TYR H H 54 7.919 7.919 7.921 -0.002 25468
3889 1 17 . 1 1 2 2 ASP N N 2 123.544 123.544 121.605 1.939 25468
3890 1 17 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.495 0.203 25468
3891 1 17 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.193 -1.286 25468
3892 1 17 . 1 1 2 2 ASP H H 2 8.843 8.843 8.536 0.307 25468
3893 1 17 . 1 1 3 3 ILE N N 3 121.633 121.633 122.586 -0.953 25468
3894 1 17 . 1 1 3 3 ILE HA H 3 4.158 4.158 3.854 0.304 25468
3895 1 17 . 1 1 3 3 ILE CA C 3 61.110 61.110 61.184 -0.074 25468
3896 1 17 . 1 1 3 3 ILE CB C 3 39.038 39.038 35.983 3.055 25468
3897 1 17 . 1 1 3 3 ILE H H 3 8.356 8.356 7.821 0.535 25468
3898 1 17 . 1 1 4 4 ASP N N 4 124.028 124.028 128.485 -4.457 25468
3899 1 17 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.370 0.257 25468
3900 1 17 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.169 -1.393 25468
3901 1 17 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.331 -1.115 25468
3902 1 17 . 1 1 4 4 ASP H H 4 8.460 8.460 8.315 0.145 25468
3903 1 17 . 1 1 5 5 GLY N N 5 110.531 110.531 108.168 2.363 25468
3904 1 17 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.545 0.169 25468
3905 1 17 . 1 1 5 5 GLY H H 5 8.405 8.405 8.127 0.278 25468
3906 1 17 . 1 1 6 6 ARG N N 6 119.193 119.193 118.084 1.109 25468
3907 1 17 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.488 -0.141 25468
3908 1 17 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.872 1.375 25468
3909 1 17 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.373 0.716 25468
3910 1 17 . 1 1 6 6 ARG H H 6 8.128 8.128 8.224 -0.096 25468
3911 1 17 . 1 1 7 7 LYS N N 7 120.971 120.971 120.178 0.793 25468
3912 1 17 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.791 -0.022 25468
3913 1 17 . 1 1 7 7 LYS CB C 7 33.230 33.230 33.079 0.151 25468
3914 1 17 . 1 1 7 7 LYS H H 7 7.984 7.984 7.722 0.262 25468
3915 1 17 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.450 0.088 25468
3916 1 17 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.507 0.696 25468
3917 1 17 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.366 -0.511 25468
3918 1 17 . 1 1 9 9 LEU N N 9 123.948 123.948 120.822 3.126 25468
3919 1 17 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.534 -0.047 25468
3920 1 17 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.800 -0.289 25468
3921 1 17 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.411 2.348 25468
3922 1 17 . 1 1 9 9 LEU H H 9 7.801 7.801 7.985 -0.184 25468
3923 1 17 . 1 1 10 10 LEU N N 10 130.176 130.176 127.908 2.268 25468
3924 1 17 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.953 -0.399 25468
3925 1 17 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.397 1.074 25468
3926 1 17 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.205 -1.102 25468
3927 1 17 . 1 1 10 10 LEU H H 10 8.422 8.422 8.517 -0.095 25468
3928 1 17 . 1 1 11 11 ILE N N 11 120.839 120.839 121.602 -0.763 25468
3929 1 17 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.559 -0.173 25468
3930 1 17 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.903 0.628 25468
3931 1 17 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.787 0.570 25468
3932 1 17 . 1 1 11 11 ILE H H 11 8.289 8.289 8.533 -0.244 25468
3933 1 17 . 1 1 12 12 GLY N N 12 106.385 106.385 107.209 -0.824 25468
3934 1 17 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.366 -0.623 25468
3935 1 17 . 1 1 12 12 GLY H H 12 7.125 7.125 7.584 -0.459 25468
3936 1 17 . 1 1 13 13 THR N N 13 110.566 110.566 111.833 -1.267 25468
3937 1 17 . 1 1 13 13 THR HA H 13 4.676 4.676 4.602 0.074 25468
3938 1 17 . 1 1 13 13 THR CA C 13 62.119 62.119 60.591 1.528 25468
3939 1 17 . 1 1 13 13 THR CB C 13 71.115 71.115 70.754 0.361 25468
3940 1 17 . 1 1 13 13 THR H H 13 9.046 9.046 8.431 0.615 25468
3941 1 17 . 1 1 14 14 CYS N N 14 117.216 117.216 122.024 -4.808 25468
3942 1 17 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.823 0.077 25468
3943 1 17 . 1 1 14 14 CYS CA C 14 58.201 58.201 59.537 -1.336 25468
3944 1 17 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.620 19.011 25468
3945 1 17 . 1 1 14 14 CYS H H 14 8.436 8.436 8.602 -0.166 25468
3946 1 17 . 1 1 15 15 ILE N N 15 118.247 118.247 120.485 -2.238 25468
3947 1 17 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.894 -0.008 25468
3948 1 17 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.982 -0.681 25468
3949 1 17 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.208 -0.712 25468
3950 1 17 . 1 1 15 15 ILE H H 15 7.244 7.244 7.784 -0.540 25468
3951 1 17 . 1 1 16 16 GLU N N 16 119.649 119.649 120.151 -0.502 25468
3952 1 17 . 1 1 16 16 GLU HA H 16 3.833 3.833 3.906 -0.073 25468
3953 1 17 . 1 1 16 16 GLU CA C 16 57.902 57.902 58.343 -0.441 25468
3954 1 17 . 1 1 16 16 GLU CB C 16 28.781 28.781 29.957 -1.176 25468
3955 1 17 . 1 1 16 16 GLU H H 16 7.066 7.066 7.638 -0.572 25468
3956 1 17 . 1 1 17 17 PHE N N 17 114.996 114.996 120.021 -5.025 25468
3957 1 17 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.934 -0.370 25468
3958 1 17 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.231 -0.703 25468
3959 1 17 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.474 0.416 25468
3960 1 17 . 1 1 17 17 PHE H H 17 8.148 8.148 7.600 0.548 25468
3961 1 17 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.814 0.039 25468
3962 1 17 . 1 1 18 18 PRO CA C 18 62.917 62.917 62.510 0.407 25468
3963 1 17 . 1 1 18 18 PRO CB C 18 31.868 31.868 33.040 -1.172 25468
3964 1 17 . 1 1 19 19 THR N N 19 114.536 114.536 114.155 0.381 25468
3965 1 17 . 1 1 19 19 THR HA H 19 3.650 3.650 3.957 -0.307 25468
3966 1 17 . 1 1 19 19 THR CA C 19 68.731 68.731 67.969 0.762 25468
3967 1 17 . 1 1 19 19 THR CB C 19 69.792 69.792 68.509 1.283 25468
3968 1 17 . 1 1 19 19 THR H H 19 8.370 8.370 8.654 -0.284 25468
3969 1 17 . 1 1 20 20 GLU N N 20 120.374 120.374 120.562 -0.188 25468
3970 1 17 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.033 0.160 25468
3971 1 17 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.677 0.368 25468
3972 1 17 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.962 -0.706 25468
3973 1 17 . 1 1 20 20 GLU H H 20 9.038 9.038 8.760 0.278 25468
3974 1 17 . 1 1 21 21 LYS N N 21 122.432 122.432 119.963 2.469 25468
3975 1 17 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.149 0.016 25468
3976 1 17 . 1 1 21 21 LYS CA C 21 59.210 59.210 58.830 0.380 25468
3977 1 17 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.494 0.633 25468
3978 1 17 . 1 1 21 21 LYS H H 21 7.622 7.622 8.036 -0.414 25468
3979 1 17 . 1 1 22 22 CYS N N 22 121.466 121.466 119.218 2.248 25468
3980 1 17 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.014 0.071 25468
3981 1 17 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.465 -3.696 25468
3982 1 17 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.030 10.564 25468
3983 1 17 . 1 1 22 22 CYS H H 22 9.356 9.356 8.493 0.863 25468
3984 1 17 . 1 1 23 23 ASN N N 23 115.604 115.604 118.444 -2.840 25468
3985 1 17 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.429 -0.384 25468
3986 1 17 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.240 1.627 25468
3987 1 17 . 1 1 23 23 ASN CB C 23 39.304 39.304 38.179 1.125 25468
3988 1 17 . 1 1 23 23 ASN H H 23 7.925 7.925 8.115 -0.190 25468
3989 1 17 . 1 1 24 24 LYS N N 24 116.665 116.665 120.656 -3.991 25468
3990 1 17 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.894 0.018 25468
3991 1 17 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.870 0.040 25468
3992 1 17 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.197 0.838 25468
3993 1 17 . 1 1 24 24 LYS H H 24 7.955 7.955 7.958 -0.003 25468
3994 1 17 . 1 1 25 25 THR N N 25 116.759 116.759 116.031 0.728 25468
3995 1 17 . 1 1 25 25 THR HA H 25 3.859 3.859 4.008 -0.149 25468
3996 1 17 . 1 1 25 25 THR CA C 25 67.243 67.243 66.812 0.431 25468
3997 1 17 . 1 1 25 25 THR CB C 25 68.752 68.752 68.360 0.392 25468
3998 1 17 . 1 1 25 25 THR H H 25 8.518 8.518 8.664 -0.146 25468
3999 1 17 . 1 1 26 26 CYS N N 26 121.616 121.616 122.060 -0.444 25468
4000 1 17 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.098 0.161 25468
4001 1 17 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.565 -3.962 25468
4002 1 17 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.756 8.434 25468
4003 1 17 . 1 1 26 26 CYS H H 26 8.062 8.062 7.968 0.094 25468
4004 1 17 . 1 1 27 27 ILE N N 27 124.036 124.036 120.959 3.077 25468
4005 1 17 . 1 1 27 27 ILE HA H 27 4.154 4.154 3.894 0.260 25468
4006 1 17 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.826 0.434 25468
4007 1 17 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.463 0.572 25468
4008 1 17 . 1 1 27 27 ILE H H 27 8.313 8.313 8.539 -0.226 25468
4009 1 17 . 1 1 28 28 GLU N N 28 121.780 121.780 121.326 0.454 25468
4010 1 17 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.148 0.046 25468
4011 1 17 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.890 -0.393 25468
4012 1 17 . 1 1 28 28 GLU CB C 28 27.957 27.957 28.805 -0.848 25468
4013 1 17 . 1 1 28 28 GLU H H 28 8.312 8.312 8.556 -0.244 25468
4014 1 17 . 1 1 29 29 SER N N 29 114.001 114.001 114.849 -0.848 25468
4015 1 17 . 1 1 29 29 SER HA H 29 4.661 4.661 4.320 0.341 25468
4016 1 17 . 1 1 29 29 SER CA C 29 58.377 58.377 59.599 -1.222 25468
4017 1 17 . 1 1 29 29 SER CB C 29 63.484 63.484 63.224 0.260 25468
4018 1 17 . 1 1 29 29 SER H H 29 7.459 7.459 7.655 -0.196 25468
4019 1 17 . 1 1 30 30 ASN N N 30 112.213 112.213 115.930 -3.717 25468
4020 1 17 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.511 -0.083 25468
4021 1 17 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.958 0.083 25468
4022 1 17 . 1 1 30 30 ASN CB C 30 36.344 36.344 37.423 -1.079 25468
4023 1 17 . 1 1 30 30 ASN H H 30 8.067 8.067 7.834 0.233 25468
4024 1 17 . 1 1 31 31 PHE N N 31 116.306 116.306 117.357 -1.051 25468
4025 1 17 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.599 -0.025 25468
4026 1 17 . 1 1 31 31 PHE CA C 31 57.969 57.969 57.254 0.715 25468
4027 1 17 . 1 1 31 31 PHE CB C 31 38.699 38.699 40.032 -1.333 25468
4028 1 17 . 1 1 31 31 PHE H H 31 7.861 7.861 8.169 -0.308 25468
4029 1 17 . 1 1 32 32 ALA N N 32 121.103 121.103 123.219 -2.116 25468
4030 1 17 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.304 -0.113 25468
4031 1 17 . 1 1 32 32 ALA CA C 32 53.586 53.586 53.700 -0.114 25468
4032 1 17 . 1 1 32 32 ALA CB C 32 19.211 19.211 19.399 -0.188 25468
4033 1 17 . 1 1 32 32 ALA H H 32 8.403 8.403 8.998 -0.595 25468
4034 1 17 . 1 1 33 33 GLY N N 33 100.820 100.820 104.488 -3.668 25468
4035 1 17 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.905 -0.035 25468
4036 1 17 . 1 1 33 33 GLY H H 33 7.258 7.258 7.594 -0.336 25468
4037 1 17 . 1 1 34 34 GLY N N 34 108.312 108.312 105.386 2.926 25468
4038 1 17 . 1 1 34 34 GLY CA C 34 46.437 46.437 43.781 2.656 25468
4039 1 17 . 1 1 34 34 GLY H H 34 8.978 8.978 8.341 0.637 25468
4040 1 17 . 1 1 35 35 LYS N N 35 119.929 119.929 118.227 1.702 25468
4041 1 17 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.812 -0.218 25468
4042 1 17 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.940 -0.285 25468
4043 1 17 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.258 2.026 25468
4044 1 17 . 1 1 35 35 LYS H H 35 8.756 8.756 8.079 0.677 25468
4045 1 17 . 1 1 36 36 CYS N N 36 119.831 119.831 120.280 -0.449 25468
4046 1 17 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.520 -0.156 25468
4047 1 17 . 1 1 36 36 CYS CA C 36 57.218 57.218 57.461 -0.243 25468
4048 1 17 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.328 17.822 25468
4049 1 17 . 1 1 36 36 CYS H H 36 8.553 8.553 8.526 0.027 25468
4050 1 17 . 1 1 37 37 VAL N N 37 120.392 120.392 119.843 0.549 25468
4051 1 17 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.086 0.678 25468
4052 1 17 . 1 1 37 37 VAL CB C 37 36.247 36.247 34.877 1.370 25468
4053 1 17 . 1 1 37 37 VAL H H 37 9.587 9.587 8.487 1.100 25468
4054 1 17 . 1 1 38 38 HIS N N 38 118.311 118.311 116.885 1.426 25468
4055 1 17 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.639 -0.599 25468
4056 1 17 . 1 1 38 38 HIS CA C 38 53.975 53.975 52.808 1.167 25468
4057 1 17 . 1 1 38 38 HIS CB C 38 29.480 29.480 32.275 -2.795 25468
4058 1 17 . 1 1 38 38 HIS H H 38 8.698 8.698 7.860 0.838 25468
4059 1 17 . 1 1 39 39 ILE N N 39 124.114 124.114 121.346 2.768 25468
4060 1 17 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.294 0.008 25468
4061 1 17 . 1 1 39 39 ILE CA C 39 59.840 59.840 60.717 -0.877 25468
4062 1 17 . 1 1 39 39 ILE CB C 39 38.709 38.709 39.937 -1.228 25468
4063 1 17 . 1 1 39 39 ILE H H 39 8.969 8.969 8.778 0.191 25468
4064 1 17 . 1 1 40 40 GLY N N 40 115.080 115.080 116.358 -1.278 25468
4065 1 17 . 1 1 40 40 GLY CA C 40 46.226 46.226 46.416 -0.190 25468
4066 1 17 . 1 1 40 40 GLY H H 40 8.715 8.715 8.709 0.006 25468
4067 1 17 . 1 1 41 41 GLN N N 41 121.798 121.798 121.184 0.614 25468
4068 1 17 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.589 -0.285 25468
4069 1 17 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.604 0.046 25468
4070 1 17 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.265 -0.785 25468
4071 1 17 . 1 1 41 41 GLN H H 41 8.672 8.672 8.561 0.111 25468
4072 1 17 . 1 1 42 42 SER N N 42 114.462 114.462 116.566 -2.104 25468
4073 1 17 . 1 1 42 42 SER HA H 42 4.347 4.347 4.450 -0.103 25468
4074 1 17 . 1 1 42 42 SER CA C 42 58.072 58.072 59.233 -1.161 25468
4075 1 17 . 1 1 42 42 SER CB C 42 64.037 64.037 63.531 0.506 25468
4076 1 17 . 1 1 42 42 SER H H 42 7.725 7.725 8.428 -0.703 25468
4077 1 17 . 1 1 43 43 LEU N N 43 124.166 124.166 120.584 3.582 25468
4078 1 17 . 1 1 43 43 LEU HA H 43 3.950 3.950 4.199 -0.249 25468
4079 1 17 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.891 -0.596 25468
4080 1 17 . 1 1 43 43 LEU CB C 43 41.400 41.400 40.710 0.690 25468
4081 1 17 . 1 1 43 43 LEU H H 43 8.576 8.576 7.984 0.592 25468
4082 1 17 . 1 1 44 44 ASP N N 44 118.797 118.797 119.119 -0.322 25468
4083 1 17 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.789 -0.058 25468
4084 1 17 . 1 1 44 44 ASP CB C 44 39.979 39.979 42.251 -2.272 25468
4085 1 17 . 1 1 44 44 ASP H H 44 8.163 8.163 8.128 0.035 25468
4086 1 17 . 1 1 45 45 PHE N N 45 123.595 123.595 123.939 -0.344 25468
4087 1 17 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.050 -0.130 25468
4088 1 17 . 1 1 45 45 PHE CA C 45 57.607 57.607 56.118 1.489 25468
4089 1 17 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.626 0.457 25468
4090 1 17 . 1 1 45 45 PHE H H 45 9.042 9.042 8.976 0.066 25468
4091 1 17 . 1 1 46 46 VAL N N 46 119.357 119.357 119.993 -0.636 25468
4092 1 17 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.610 0.083 25468
4093 1 17 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.746 0.169 25468
4094 1 17 . 1 1 46 46 VAL CB C 46 34.666 34.666 35.343 -0.677 25468
4095 1 17 . 1 1 46 46 VAL H H 46 9.555 9.555 8.429 1.126 25468
4096 1 17 . 1 1 47 47 CYS N N 47 122.793 122.793 124.117 -1.324 25468
4097 1 17 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.326 -0.496 25468
4098 1 17 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.759 11.971 25468
4099 1 17 . 1 1 47 47 CYS H H 47 9.044 9.044 8.737 0.307 25468
4100 1 17 . 1 1 48 48 VAL N N 48 129.864 129.864 128.530 1.334 25468
4101 1 17 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.006 -0.473 25468
4102 1 17 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.261 0.556 25468
4103 1 17 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.283 -1.885 25468
4104 1 17 . 1 1 48 48 VAL H H 48 8.616 8.616 7.964 0.652 25468
4105 1 17 . 1 1 49 49 CYS N N 49 121.329 121.329 123.619 -2.290 25468
4106 1 17 . 1 1 49 49 CYS HA H 49 5.148 5.148 4.718 0.430 25468
4107 1 17 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.522 -6.093 25468
4108 1 17 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.715 5.157 25468
4109 1 17 . 1 1 49 49 CYS H H 49 8.652 8.652 7.928 0.724 25468
4110 1 17 . 1 1 50 50 PHE N N 50 119.026 119.026 121.287 -2.261 25468
4111 1 17 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.011 -0.062 25468
4112 1 17 . 1 1 50 50 PHE CA C 50 54.652 54.652 54.840 -0.188 25468
4113 1 17 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.457 -0.864 25468
4114 1 17 . 1 1 50 50 PHE H H 50 8.472 8.472 8.603 -0.131 25468
4115 1 17 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.411 0.321 25468
4116 1 17 . 1 1 51 51 PRO CB C 51 33.209 33.209 33.092 0.117 25468
4117 1 17 . 1 1 52 52 LYS N N 52 119.951 119.951 119.788 0.163 25468
4118 1 17 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.092 -0.133 25468
4119 1 17 . 1 1 52 52 LYS CA C 52 57.670 57.670 58.409 -0.739 25468
4120 1 17 . 1 1 52 52 LYS CB C 52 33.225 33.225 32.177 1.048 25468
4121 1 17 . 1 1 52 52 LYS H H 52 8.681 8.681 8.563 0.118 25468
4122 1 17 . 1 1 53 53 TYR N N 53 118.889 118.889 116.896 1.993 25468
4123 1 17 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.613 -0.142 25468
4124 1 17 . 1 1 53 53 TYR CA C 53 58.049 58.049 56.069 1.980 25468
4125 1 17 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.616 0.652 25468
4126 1 17 . 1 1 53 53 TYR H H 53 8.215 8.215 7.841 0.374 25468
4127 1 17 . 1 1 54 54 TYR N N 54 121.087 121.087 122.427 -1.340 25468
4128 1 17 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.599 -0.105 25468
4129 1 17 . 1 1 54 54 TYR CA C 54 58.101 58.101 58.215 -0.114 25468
4130 1 17 . 1 1 54 54 TYR CB C 54 39.611 39.611 37.946 1.665 25468
4131 1 17 . 1 1 54 54 TYR H H 54 7.919 7.919 7.620 0.299 25468
4132 1 18 . 1 1 2 2 ASP N N 2 123.544 123.544 121.883 1.661 25468
4133 1 18 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.694 0.004 25468
4134 1 18 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.236 -1.329 25468
4135 1 18 . 1 1 2 2 ASP H H 2 8.843 8.843 8.461 0.382 25468
4136 1 18 . 1 1 3 3 ILE N N 3 121.633 121.633 121.931 -0.298 25468
4137 1 18 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.087 0.071 25468
4138 1 18 . 1 1 3 3 ILE CA C 3 61.110 61.110 60.160 0.950 25468
4139 1 18 . 1 1 3 3 ILE CB C 3 39.038 39.038 37.090 1.948 25468
4140 1 18 . 1 1 3 3 ILE H H 3 8.356 8.356 7.632 0.724 25468
4141 1 18 . 1 1 4 4 ASP N N 4 124.028 124.028 128.988 -4.960 25468
4142 1 18 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.514 0.113 25468
4143 1 18 . 1 1 4 4 ASP CA C 4 53.776 53.776 54.869 -1.093 25468
4144 1 18 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.694 -1.478 25468
4145 1 18 . 1 1 4 4 ASP H H 4 8.460 8.460 8.817 -0.357 25468
4146 1 18 . 1 1 5 5 GLY N N 5 110.531 110.531 108.447 2.084 25468
4147 1 18 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.676 0.038 25468
4148 1 18 . 1 1 5 5 GLY H H 5 8.405 8.405 8.705 -0.300 25468
4149 1 18 . 1 1 6 6 ARG N N 6 119.193 119.193 118.666 0.527 25468
4150 1 18 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.373 -0.026 25468
4151 1 18 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.220 2.027 25468
4152 1 18 . 1 1 6 6 ARG CB C 6 31.089 31.089 31.003 0.086 25468
4153 1 18 . 1 1 6 6 ARG H H 6 8.128 8.128 7.646 0.482 25468
4154 1 18 . 1 1 7 7 LYS N N 7 120.971 120.971 120.768 0.203 25468
4155 1 18 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.416 0.353 25468
4156 1 18 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.030 1.200 25468
4157 1 18 . 1 1 7 7 LYS H H 7 7.984 7.984 7.790 0.194 25468
4158 1 18 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.087 0.451 25468
4159 1 18 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.082 1.121 25468
4160 1 18 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.267 -0.411 25468
4161 1 18 . 1 1 9 9 LEU N N 9 123.948 123.948 121.409 2.539 25468
4162 1 18 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.540 -0.053 25468
4163 1 18 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.694 -0.183 25468
4164 1 18 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.543 2.216 25468
4165 1 18 . 1 1 9 9 LEU H H 9 7.801 7.801 7.800 0.001 25468
4166 1 18 . 1 1 10 10 LEU N N 10 130.176 130.176 128.214 1.962 25468
4167 1 18 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.928 -0.374 25468
4168 1 18 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.442 1.029 25468
4169 1 18 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.158 -1.055 25468
4170 1 18 . 1 1 10 10 LEU H H 10 8.422 8.422 8.571 -0.149 25468
4171 1 18 . 1 1 11 11 ILE N N 11 120.839 120.839 121.986 -1.147 25468
4172 1 18 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.580 -0.194 25468
4173 1 18 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.974 0.557 25468
4174 1 18 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.801 0.556 25468
4175 1 18 . 1 1 11 11 ILE H H 11 8.289 8.289 8.689 -0.400 25468
4176 1 18 . 1 1 12 12 GLY N N 12 106.385 106.385 107.098 -0.713 25468
4177 1 18 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.928 -1.185 25468
4178 1 18 . 1 1 12 12 GLY H H 12 7.125 7.125 7.598 -0.473 25468
4179 1 18 . 1 1 13 13 THR N N 13 110.566 110.566 111.223 -0.657 25468
4180 1 18 . 1 1 13 13 THR HA H 13 4.676 4.676 4.975 -0.299 25468
4181 1 18 . 1 1 13 13 THR CA C 13 62.119 62.119 60.157 1.962 25468
4182 1 18 . 1 1 13 13 THR CB C 13 71.115 71.115 71.580 -0.465 25468
4183 1 18 . 1 1 13 13 THR H H 13 9.046 9.046 8.182 0.864 25468
4184 1 18 . 1 1 14 14 CYS N N 14 117.216 117.216 121.347 -4.131 25468
4185 1 18 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.632 0.268 25468
4186 1 18 . 1 1 14 14 CYS CA C 14 58.201 58.201 61.018 -2.817 25468
4187 1 18 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.860 18.771 25468
4188 1 18 . 1 1 14 14 CYS H H 14 8.436 8.436 8.617 -0.181 25468
4189 1 18 . 1 1 15 15 ILE N N 15 118.247 118.247 118.426 -0.179 25468
4190 1 18 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.878 0.008 25468
4191 1 18 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.631 -0.330 25468
4192 1 18 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.086 -0.590 25468
4193 1 18 . 1 1 15 15 ILE H H 15 7.244 7.244 8.048 -0.804 25468
4194 1 18 . 1 1 16 16 GLU N N 16 119.649 119.649 118.039 1.610 25468
4195 1 18 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.240 -0.407 25468
4196 1 18 . 1 1 16 16 GLU CA C 16 57.902 57.902 56.371 1.531 25468
4197 1 18 . 1 1 16 16 GLU CB C 16 28.781 28.781 31.600 -2.819 25468
4198 1 18 . 1 1 16 16 GLU H H 16 7.066 7.066 8.117 -1.051 25468
4199 1 18 . 1 1 17 17 PHE N N 17 114.996 114.996 121.311 -6.315 25468
4200 1 18 . 1 1 17 17 PHE HA H 17 4.564 4.564 5.005 -0.441 25468
4201 1 18 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.645 -1.117 25468
4202 1 18 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.349 0.541 25468
4203 1 18 . 1 1 17 17 PHE H H 17 8.148 8.148 8.271 -0.123 25468
4204 1 18 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.675 0.178 25468
4205 1 18 . 1 1 18 18 PRO CA C 18 62.917 62.917 62.515 0.402 25468
4206 1 18 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.932 -1.064 25468
4207 1 18 . 1 1 19 19 THR N N 19 114.536 114.536 114.629 -0.093 25468
4208 1 18 . 1 1 19 19 THR HA H 19 3.650 3.650 3.865 -0.215 25468
4209 1 18 . 1 1 19 19 THR CA C 19 68.731 68.731 67.668 1.063 25468
4210 1 18 . 1 1 19 19 THR CB C 19 69.792 69.792 68.328 1.464 25468
4211 1 18 . 1 1 19 19 THR H H 19 8.370 8.370 8.579 -0.209 25468
4212 1 18 . 1 1 20 20 GLU N N 20 120.374 120.374 121.065 -0.691 25468
4213 1 18 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.122 0.071 25468
4214 1 18 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.846 0.199 25468
4215 1 18 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.440 -0.184 25468
4216 1 18 . 1 1 20 20 GLU H H 20 9.038 9.038 8.824 0.214 25468
4217 1 18 . 1 1 21 21 LYS N N 21 122.432 122.432 120.356 2.076 25468
4218 1 18 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.107 0.058 25468
4219 1 18 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.068 0.142 25468
4220 1 18 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.400 0.727 25468
4221 1 18 . 1 1 21 21 LYS H H 21 7.622 7.622 8.162 -0.540 25468
4222 1 18 . 1 1 22 22 CYS N N 22 121.466 121.466 120.176 1.290 25468
4223 1 18 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.079 0.006 25468
4224 1 18 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.240 -3.471 25468
4225 1 18 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.052 10.542 25468
4226 1 18 . 1 1 22 22 CYS H H 22 9.356 9.356 8.740 0.616 25468
4227 1 18 . 1 1 23 23 ASN N N 23 115.604 115.604 118.852 -3.248 25468
4228 1 18 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.450 -0.405 25468
4229 1 18 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.433 1.434 25468
4230 1 18 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.836 1.468 25468
4231 1 18 . 1 1 23 23 ASN H H 23 7.925 7.925 8.504 -0.579 25468
4232 1 18 . 1 1 24 24 LYS N N 24 116.665 116.665 121.300 -4.635 25468
4233 1 18 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.967 -0.055 25468
4234 1 18 . 1 1 24 24 LYS CA C 24 59.909 59.909 60.109 -0.200 25468
4235 1 18 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.221 0.814 25468
4236 1 18 . 1 1 24 24 LYS H H 24 7.955 7.955 8.624 -0.669 25468
4237 1 18 . 1 1 25 25 THR N N 25 116.759 116.759 115.923 0.836 25468
4238 1 18 . 1 1 25 25 THR HA H 25 3.859 3.859 4.063 -0.204 25468
4239 1 18 . 1 1 25 25 THR CA C 25 67.243 67.243 66.708 0.535 25468
4240 1 18 . 1 1 25 25 THR CB C 25 68.752 68.752 68.350 0.402 25468
4241 1 18 . 1 1 25 25 THR H H 25 8.518 8.518 8.510 0.008 25468
4242 1 18 . 1 1 26 26 CYS N N 26 121.616 121.616 121.160 0.456 25468
4243 1 18 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.302 -0.043 25468
4244 1 18 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.421 -3.818 25468
4245 1 18 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.819 8.370 25468
4246 1 18 . 1 1 26 26 CYS H H 26 8.062 8.062 7.605 0.457 25468
4247 1 18 . 1 1 27 27 ILE N N 27 124.036 124.036 120.956 3.080 25468
4248 1 18 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.103 0.051 25468
4249 1 18 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.897 0.363 25468
4250 1 18 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.543 0.492 25468
4251 1 18 . 1 1 27 27 ILE H H 27 8.313 8.313 8.603 -0.290 25468
4252 1 18 . 1 1 28 28 GLU N N 28 121.780 121.780 120.727 1.053 25468
4253 1 18 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.161 0.033 25468
4254 1 18 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.862 -0.365 25468
4255 1 18 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.009 -1.052 25468
4256 1 18 . 1 1 28 28 GLU H H 28 8.312 8.312 8.633 -0.321 25468
4257 1 18 . 1 1 29 29 SER N N 29 114.001 114.001 115.548 -1.547 25468
4258 1 18 . 1 1 29 29 SER HA H 29 4.661 4.661 4.330 0.331 25468
4259 1 18 . 1 1 29 29 SER CA C 29 58.377 58.377 59.177 -0.800 25468
4260 1 18 . 1 1 29 29 SER CB C 29 63.484 63.484 63.391 0.093 25468
4261 1 18 . 1 1 29 29 SER H H 29 7.459 7.459 7.768 -0.309 25468
4262 1 18 . 1 1 30 30 ASN N N 30 112.213 112.213 115.826 -3.613 25468
4263 1 18 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.328 0.099 25468
4264 1 18 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.647 0.394 25468
4265 1 18 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.554 -0.210 25468
4266 1 18 . 1 1 30 30 ASN H H 30 8.067 8.067 7.753 0.314 25468
4267 1 18 . 1 1 31 31 PHE N N 31 116.306 116.306 116.848 -0.542 25468
4268 1 18 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.886 -0.312 25468
4269 1 18 . 1 1 31 31 PHE CA C 31 57.969 57.969 57.352 0.617 25468
4270 1 18 . 1 1 31 31 PHE CB C 31 38.699 38.699 40.345 -1.646 25468
4271 1 18 . 1 1 31 31 PHE H H 31 7.861 7.861 7.878 -0.017 25468
4272 1 18 . 1 1 32 32 ALA N N 32 121.103 121.103 123.207 -2.104 25468
4273 1 18 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.296 -0.105 25468
4274 1 18 . 1 1 32 32 ALA CA C 32 53.586 53.586 54.029 -0.443 25468
4275 1 18 . 1 1 32 32 ALA CB C 32 19.211 19.211 19.250 -0.039 25468
4276 1 18 . 1 1 32 32 ALA H H 32 8.403 8.403 8.566 -0.163 25468
4277 1 18 . 1 1 33 33 GLY N N 33 100.820 100.820 104.113 -3.293 25468
4278 1 18 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.848 0.022 25468
4279 1 18 . 1 1 33 33 GLY H H 33 7.258 7.258 7.580 -0.322 25468
4280 1 18 . 1 1 34 34 GLY N N 34 108.312 108.312 105.333 2.979 25468
4281 1 18 . 1 1 34 34 GLY CA C 34 46.437 46.437 43.926 2.511 25468
4282 1 18 . 1 1 34 34 GLY H H 34 8.978 8.978 8.370 0.608 25468
4283 1 18 . 1 1 35 35 LYS N N 35 119.929 119.929 116.004 3.925 25468
4284 1 18 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.691 -0.097 25468
4285 1 18 . 1 1 35 35 LYS CA C 35 54.655 54.655 55.080 -0.425 25468
4286 1 18 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.320 1.964 25468
4287 1 18 . 1 1 35 35 LYS H H 35 8.756 8.756 8.089 0.667 25468
4288 1 18 . 1 1 36 36 CYS N N 36 119.831 119.831 120.338 -0.507 25468
4289 1 18 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.611 -0.247 25468
4290 1 18 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.079 -0.861 25468
4291 1 18 . 1 1 36 36 CYS CB C 36 44.150 44.150 27.079 17.071 25468
4292 1 18 . 1 1 36 36 CYS H H 36 8.553 8.553 8.462 0.091 25468
4293 1 18 . 1 1 37 37 VAL N N 37 120.392 120.392 122.059 -1.667 25468
4294 1 18 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.725 0.039 25468
4295 1 18 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.442 0.805 25468
4296 1 18 . 1 1 37 37 VAL H H 37 9.587 9.587 8.736 0.851 25468
4297 1 18 . 1 1 38 38 HIS N N 38 118.311 118.311 118.717 -0.406 25468
4298 1 18 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.410 -0.370 25468
4299 1 18 . 1 1 38 38 HIS CA C 38 53.975 53.975 52.528 1.447 25468
4300 1 18 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.707 -2.227 25468
4301 1 18 . 1 1 38 38 HIS H H 38 8.698 8.698 7.980 0.718 25468
4302 1 18 . 1 1 39 39 ILE N N 39 124.114 124.114 121.675 2.439 25468
4303 1 18 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.224 0.078 25468
4304 1 18 . 1 1 39 39 ILE CA C 39 59.840 59.840 59.640 0.200 25468
4305 1 18 . 1 1 39 39 ILE CB C 39 38.709 38.709 37.419 1.290 25468
4306 1 18 . 1 1 39 39 ILE H H 39 8.969 8.969 8.611 0.358 25468
4307 1 18 . 1 1 40 40 GLY N N 40 115.080 115.080 117.270 -2.190 25468
4308 1 18 . 1 1 40 40 GLY CA C 40 46.226 46.226 47.308 -1.082 25468
4309 1 18 . 1 1 40 40 GLY H H 40 8.715 8.715 8.896 -0.181 25468
4310 1 18 . 1 1 41 41 GLN N N 41 121.798 121.798 121.835 -0.037 25468
4311 1 18 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.429 -0.125 25468
4312 1 18 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.255 0.395 25468
4313 1 18 . 1 1 41 41 GLN CB C 41 28.480 28.480 29.654 -1.174 25468
4314 1 18 . 1 1 41 41 GLN H H 41 8.672 8.672 8.242 0.430 25468
4315 1 18 . 1 1 42 42 SER N N 42 114.462 114.462 116.840 -2.378 25468
4316 1 18 . 1 1 42 42 SER HA H 42 4.347 4.347 4.330 0.017 25468
4317 1 18 . 1 1 42 42 SER CA C 42 58.072 58.072 60.167 -2.095 25468
4318 1 18 . 1 1 42 42 SER CB C 42 64.037 64.037 63.455 0.582 25468
4319 1 18 . 1 1 42 42 SER H H 42 7.725 7.725 8.795 -1.070 25468
4320 1 18 . 1 1 43 43 LEU N N 43 124.166 124.166 120.330 3.836 25468
4321 1 18 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.763 0.187 25468
4322 1 18 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.285 0.009 25468
4323 1 18 . 1 1 43 43 LEU CB C 43 41.400 41.400 41.045 0.355 25468
4324 1 18 . 1 1 43 43 LEU H H 43 8.576 8.576 7.700 0.876 25468
4325 1 18 . 1 1 44 44 ASP N N 44 118.797 118.797 118.851 -0.054 25468
4326 1 18 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.558 0.173 25468
4327 1 18 . 1 1 44 44 ASP CB C 44 39.979 39.979 41.492 -1.513 25468
4328 1 18 . 1 1 44 44 ASP H H 44 8.163 8.163 7.851 0.312 25468
4329 1 18 . 1 1 45 45 PHE N N 45 123.595 123.595 124.393 -0.798 25468
4330 1 18 . 1 1 45 45 PHE HA H 45 4.920 4.920 4.935 -0.015 25468
4331 1 18 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.145 0.462 25468
4332 1 18 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.414 0.668 25468
4333 1 18 . 1 1 45 45 PHE H H 45 9.042 9.042 8.647 0.395 25468
4334 1 18 . 1 1 46 46 VAL N N 46 119.357 119.357 119.806 -0.449 25468
4335 1 18 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.814 -0.121 25468
4336 1 18 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.883 0.032 25468
4337 1 18 . 1 1 46 46 VAL CB C 46 34.666 34.666 33.885 0.781 25468
4338 1 18 . 1 1 46 46 VAL H H 46 9.555 9.555 8.693 0.862 25468
4339 1 18 . 1 1 47 47 CYS N N 47 122.793 122.793 126.774 -3.981 25468
4340 1 18 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.408 -0.578 25468
4341 1 18 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.537 12.193 25468
4342 1 18 . 1 1 47 47 CYS H H 47 9.044 9.044 8.684 0.360 25468
4343 1 18 . 1 1 48 48 VAL N N 48 129.864 129.864 128.307 1.557 25468
4344 1 18 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.060 -0.527 25468
4345 1 18 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.310 0.507 25468
4346 1 18 . 1 1 48 48 VAL CB C 48 34.398 34.398 35.884 -1.486 25468
4347 1 18 . 1 1 48 48 VAL H H 48 8.616 8.616 8.138 0.478 25468
4348 1 18 . 1 1 49 49 CYS N N 49 121.329 121.329 124.390 -3.061 25468
4349 1 18 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.065 0.083 25468
4350 1 18 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.713 -6.284 25468
4351 1 18 . 1 1 49 49 CYS CB C 49 33.873 33.873 29.051 4.822 25468
4352 1 18 . 1 1 49 49 CYS H H 49 8.652 8.652 8.263 0.389 25468
4353 1 18 . 1 1 50 50 PHE N N 50 119.026 119.026 120.899 -1.873 25468
4354 1 18 . 1 1 50 50 PHE HA H 50 4.949 4.949 4.863 0.086 25468
4355 1 18 . 1 1 50 50 PHE CA C 50 54.652 54.652 54.906 -0.254 25468
4356 1 18 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.469 -0.876 25468
4357 1 18 . 1 1 50 50 PHE H H 50 8.472 8.472 8.411 0.061 25468
4358 1 18 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.465 0.267 25468
4359 1 18 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.998 0.211 25468
4360 1 18 . 1 1 52 52 LYS N N 52 119.951 119.951 120.907 -0.956 25468
4361 1 18 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.397 -0.438 25468
4362 1 18 . 1 1 52 52 LYS CA C 52 57.670 57.670 57.459 0.211 25468
4363 1 18 . 1 1 52 52 LYS CB C 52 33.225 33.225 33.438 -0.213 25468
4364 1 18 . 1 1 52 52 LYS H H 52 8.681 8.681 8.887 -0.206 25468
4365 1 18 . 1 1 53 53 TYR N N 53 118.889 118.889 118.284 0.605 25468
4366 1 18 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.798 -0.327 25468
4367 1 18 . 1 1 53 53 TYR CA C 53 58.049 58.049 57.102 0.947 25468
4368 1 18 . 1 1 53 53 TYR CB C 53 38.268 38.268 38.539 -0.271 25468
4369 1 18 . 1 1 53 53 TYR H H 53 8.215 8.215 8.055 0.160 25468
4370 1 18 . 1 1 54 54 TYR N N 54 121.087 121.087 123.649 -2.562 25468
4371 1 18 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.608 -0.114 25468
4372 1 18 . 1 1 54 54 TYR CA C 54 58.101 58.101 58.329 -0.228 25468
4373 1 18 . 1 1 54 54 TYR CB C 54 39.611 39.611 38.602 1.008 25468
4374 1 18 . 1 1 54 54 TYR H H 54 7.919 7.919 7.768 0.151 25468
4375 1 19 . 1 1 2 2 ASP N N 2 123.544 123.544 119.597 3.947 25468
4376 1 19 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.515 0.183 25468
4377 1 19 . 1 1 2 2 ASP CB C 2 39.907 39.907 40.345 -0.438 25468
4378 1 19 . 1 1 2 2 ASP H H 2 8.843 8.843 8.408 0.435 25468
4379 1 19 . 1 1 3 3 ILE N N 3 121.633 121.633 114.784 6.849 25468
4380 1 19 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.268 -0.110 25468
4381 1 19 . 1 1 3 3 ILE CA C 3 61.110 61.110 60.429 0.681 25468
4382 1 19 . 1 1 3 3 ILE CB C 3 39.038 39.038 39.138 -0.100 25468
4383 1 19 . 1 1 3 3 ILE H H 3 8.356 8.356 7.259 1.097 25468
4384 1 19 . 1 1 4 4 ASP N N 4 124.028 124.028 123.764 0.264 25468
4385 1 19 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.427 0.200 25468
4386 1 19 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.954 -2.178 25468
4387 1 19 . 1 1 4 4 ASP CB C 4 40.216 40.216 40.934 -0.718 25468
4388 1 19 . 1 1 4 4 ASP H H 4 8.460 8.460 8.718 -0.258 25468
4389 1 19 . 1 1 5 5 GLY N N 5 110.531 110.531 106.684 3.847 25468
4390 1 19 . 1 1 5 5 GLY CA C 5 45.714 45.714 44.957 0.757 25468
4391 1 19 . 1 1 5 5 GLY H H 5 8.405 8.405 8.262 0.143 25468
4392 1 19 . 1 1 6 6 ARG N N 6 119.193 119.193 120.147 -0.954 25468
4393 1 19 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.462 -0.115 25468
4394 1 19 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.524 1.723 25468
4395 1 19 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.037 1.052 25468
4396 1 19 . 1 1 6 6 ARG H H 6 8.128 8.128 7.936 0.192 25468
4397 1 19 . 1 1 7 7 LYS N N 7 120.971 120.971 121.517 -0.546 25468
4398 1 19 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.497 0.272 25468
4399 1 19 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.340 0.890 25468
4400 1 19 . 1 1 7 7 LYS H H 7 7.984 7.984 7.878 0.106 25468
4401 1 19 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.368 0.170 25468
4402 1 19 . 1 1 8 8 PRO CA C 8 63.203 63.203 61.956 1.246 25468
4403 1 19 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.509 -0.654 25468
4404 1 19 . 1 1 9 9 LEU N N 9 123.948 123.948 121.282 2.666 25468
4405 1 19 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.532 -0.045 25468
4406 1 19 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.648 -0.137 25468
4407 1 19 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.696 2.063 25468
4408 1 19 . 1 1 9 9 LEU H H 9 7.801 7.801 7.773 0.028 25468
4409 1 19 . 1 1 10 10 LEU N N 10 130.176 130.176 128.069 2.107 25468
4410 1 19 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.712 -0.158 25468
4411 1 19 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.888 0.583 25468
4412 1 19 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.224 -1.121 25468
4413 1 19 . 1 1 10 10 LEU H H 10 8.422 8.422 8.566 -0.144 25468
4414 1 19 . 1 1 11 11 ILE N N 11 120.839 120.839 121.285 -0.446 25468
4415 1 19 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.584 -0.198 25468
4416 1 19 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.691 0.840 25468
4417 1 19 . 1 1 11 11 ILE CB C 11 39.357 39.357 39.002 0.355 25468
4418 1 19 . 1 1 11 11 ILE H H 11 8.289 8.289 8.489 -0.200 25468
4419 1 19 . 1 1 12 12 GLY N N 12 106.385 106.385 107.891 -1.506 25468
4420 1 19 . 1 1 12 12 GLY CA C 12 44.743 44.743 46.028 -1.285 25468
4421 1 19 . 1 1 12 12 GLY H H 12 7.125 7.125 7.462 -0.337 25468
4422 1 19 . 1 1 13 13 THR N N 13 110.566 110.566 111.919 -1.353 25468
4423 1 19 . 1 1 13 13 THR HA H 13 4.676 4.676 4.805 -0.129 25468
4424 1 19 . 1 1 13 13 THR CA C 13 62.119 62.119 59.814 2.305 25468
4425 1 19 . 1 1 13 13 THR CB C 13 71.115 71.115 71.169 -0.054 25468
4426 1 19 . 1 1 13 13 THR H H 13 9.046 9.046 8.254 0.792 25468
4427 1 19 . 1 1 14 14 CYS N N 14 117.216 117.216 122.012 -4.796 25468
4428 1 19 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.862 0.038 25468
4429 1 19 . 1 1 14 14 CYS CA C 14 58.201 58.201 59.446 -1.245 25468
4430 1 19 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.480 19.151 25468
4431 1 19 . 1 1 14 14 CYS H H 14 8.436 8.436 8.516 -0.080 25468
4432 1 19 . 1 1 15 15 ILE N N 15 118.247 118.247 120.276 -2.029 25468
4433 1 19 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.964 -0.078 25468
4434 1 19 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.630 -0.329 25468
4435 1 19 . 1 1 15 15 ILE CB C 15 37.496 37.496 38.417 -0.921 25468
4436 1 19 . 1 1 15 15 ILE H H 15 7.244 7.244 7.343 -0.099 25468
4437 1 19 . 1 1 16 16 GLU N N 16 119.649 119.649 118.230 1.419 25468
4438 1 19 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.056 -0.223 25468
4439 1 19 . 1 1 16 16 GLU CA C 16 57.902 57.902 56.985 0.917 25468
4440 1 19 . 1 1 16 16 GLU CB C 16 28.781 28.781 30.170 -1.389 25468
4441 1 19 . 1 1 16 16 GLU H H 16 7.066 7.066 7.537 -0.471 25468
4442 1 19 . 1 1 17 17 PHE N N 17 114.996 114.996 120.058 -5.062 25468
4443 1 19 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.977 -0.413 25468
4444 1 19 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.199 -0.671 25468
4445 1 19 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.817 0.073 25468
4446 1 19 . 1 1 17 17 PHE H H 17 8.148 8.148 7.552 0.596 25468
4447 1 19 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.791 0.062 25468
4448 1 19 . 1 1 18 18 PRO CA C 18 62.917 62.917 62.626 0.291 25468
4449 1 19 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.992 -1.124 25468
4450 1 19 . 1 1 19 19 THR N N 19 114.536 114.536 114.522 0.014 25468
4451 1 19 . 1 1 19 19 THR HA H 19 3.650 3.650 3.930 -0.280 25468
4452 1 19 . 1 1 19 19 THR CA C 19 68.731 68.731 68.165 0.566 25468
4453 1 19 . 1 1 19 19 THR CB C 19 69.792 69.792 68.603 1.189 25468
4454 1 19 . 1 1 19 19 THR H H 19 8.370 8.370 8.743 -0.373 25468
4455 1 19 . 1 1 20 20 GLU N N 20 120.374 120.374 120.820 -0.446 25468
4456 1 19 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.149 0.044 25468
4457 1 19 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.824 0.221 25468
4458 1 19 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.629 -0.373 25468
4459 1 19 . 1 1 20 20 GLU H H 20 9.038 9.038 8.863 0.175 25468
4460 1 19 . 1 1 21 21 LYS N N 21 122.432 122.432 120.535 1.897 25468
4461 1 19 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.133 0.032 25468
4462 1 19 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.022 0.188 25468
4463 1 19 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.422 0.705 25468
4464 1 19 . 1 1 21 21 LYS H H 21 7.622 7.622 8.171 -0.549 25468
4465 1 19 . 1 1 22 22 CYS N N 22 121.466 121.466 119.432 2.034 25468
4466 1 19 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.039 0.046 25468
4467 1 19 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.804 -4.035 25468
4468 1 19 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.202 10.392 25468
4469 1 19 . 1 1 22 22 CYS H H 22 9.356 9.356 8.812 0.544 25468
4470 1 19 . 1 1 23 23 ASN N N 23 115.604 115.604 118.553 -2.949 25468
4471 1 19 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.467 -0.422 25468
4472 1 19 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.372 1.495 25468
4473 1 19 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.944 1.361 25468
4474 1 19 . 1 1 23 23 ASN H H 23 7.925 7.925 8.146 -0.221 25468
4475 1 19 . 1 1 24 24 LYS N N 24 116.665 116.665 121.137 -4.472 25468
4476 1 19 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.994 -0.082 25468
4477 1 19 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.759 0.150 25468
4478 1 19 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.236 0.799 25468
4479 1 19 . 1 1 24 24 LYS H H 24 7.955 7.955 8.536 -0.581 25468
4480 1 19 . 1 1 25 25 THR N N 25 116.759 116.759 115.983 0.776 25468
4481 1 19 . 1 1 25 25 THR HA H 25 3.859 3.859 4.030 -0.171 25468
4482 1 19 . 1 1 25 25 THR CA C 25 67.243 67.243 66.684 0.559 25468
4483 1 19 . 1 1 25 25 THR CB C 25 68.752 68.752 68.484 0.268 25468
4484 1 19 . 1 1 25 25 THR H H 25 8.518 8.518 8.580 -0.062 25468
4485 1 19 . 1 1 26 26 CYS N N 26 121.616 121.616 121.373 0.243 25468
4486 1 19 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.250 0.009 25468
4487 1 19 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.353 -3.751 25468
4488 1 19 . 1 1 26 26 CYS CB C 26 34.189 34.189 26.226 7.963 25468
4489 1 19 . 1 1 26 26 CYS H H 26 8.062 8.062 7.414 0.648 25468
4490 1 19 . 1 1 27 27 ILE N N 27 124.036 124.036 120.381 3.655 25468
4491 1 19 . 1 1 27 27 ILE HA H 27 4.154 4.154 3.946 0.208 25468
4492 1 19 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.882 0.378 25468
4493 1 19 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.037 0.998 25468
4494 1 19 . 1 1 27 27 ILE H H 27 8.313 8.313 8.564 -0.251 25468
4495 1 19 . 1 1 28 28 GLU N N 28 121.780 121.780 121.019 0.761 25468
4496 1 19 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.132 0.062 25468
4497 1 19 . 1 1 28 28 GLU CA C 28 58.497 58.497 59.102 -0.605 25468
4498 1 19 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.263 -1.306 25468
4499 1 19 . 1 1 28 28 GLU H H 28 8.312 8.312 8.282 0.030 25468
4500 1 19 . 1 1 29 29 SER N N 29 114.001 114.001 113.147 0.854 25468
4501 1 19 . 1 1 29 29 SER HA H 29 4.661 4.661 4.361 0.300 25468
4502 1 19 . 1 1 29 29 SER CA C 29 58.377 58.377 59.320 -0.943 25468
4503 1 19 . 1 1 29 29 SER CB C 29 63.484 63.484 63.283 0.201 25468
4504 1 19 . 1 1 29 29 SER H H 29 7.459 7.459 7.630 -0.171 25468
4505 1 19 . 1 1 30 30 ASN N N 30 112.213 112.213 116.717 -4.504 25468
4506 1 19 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.553 -0.126 25468
4507 1 19 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.706 0.335 25468
4508 1 19 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.813 -0.469 25468
4509 1 19 . 1 1 30 30 ASN H H 30 8.067 8.067 7.991 0.076 25468
4510 1 19 . 1 1 31 31 PHE N N 31 116.306 116.306 117.144 -0.838 25468
4511 1 19 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.866 -0.292 25468
4512 1 19 . 1 1 31 31 PHE CA C 31 57.969 57.969 57.216 0.753 25468
4513 1 19 . 1 1 31 31 PHE CB C 31 38.699 38.699 40.145 -1.446 25468
4514 1 19 . 1 1 31 31 PHE H H 31 7.861 7.861 8.136 -0.275 25468
4515 1 19 . 1 1 32 32 ALA N N 32 121.103 121.103 123.000 -1.897 25468
4516 1 19 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.296 -0.105 25468
4517 1 19 . 1 1 32 32 ALA CA C 32 53.586 53.586 53.639 -0.053 25468
4518 1 19 . 1 1 32 32 ALA CB C 32 19.211 19.211 19.532 -0.321 25468
4519 1 19 . 1 1 32 32 ALA H H 32 8.403 8.403 8.640 -0.237 25468
4520 1 19 . 1 1 33 33 GLY N N 33 100.820 100.820 104.808 -3.988 25468
4521 1 19 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.685 0.185 25468
4522 1 19 . 1 1 33 33 GLY H H 33 7.258 7.258 7.698 -0.440 25468
4523 1 19 . 1 1 34 34 GLY N N 34 108.312 108.312 105.781 2.531 25468
4524 1 19 . 1 1 34 34 GLY CA C 34 46.437 46.437 43.984 2.453 25468
4525 1 19 . 1 1 34 34 GLY H H 34 8.978 8.978 8.437 0.541 25468
4526 1 19 . 1 1 35 35 LYS N N 35 119.929 119.929 119.235 0.694 25468
4527 1 19 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.857 -0.263 25468
4528 1 19 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.786 -0.131 25468
4529 1 19 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.572 1.712 25468
4530 1 19 . 1 1 35 35 LYS H H 35 8.756 8.756 8.191 0.565 25468
4531 1 19 . 1 1 36 36 CYS N N 36 119.831 119.831 120.121 -0.290 25468
4532 1 19 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.454 -0.090 25468
4533 1 19 . 1 1 36 36 CYS CA C 36 57.218 57.218 57.647 -0.429 25468
4534 1 19 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.405 17.745 25468
4535 1 19 . 1 1 36 36 CYS H H 36 8.553 8.553 8.636 -0.083 25468
4536 1 19 . 1 1 37 37 VAL N N 37 120.392 120.392 120.358 0.034 25468
4537 1 19 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.137 0.627 25468
4538 1 19 . 1 1 37 37 VAL CB C 37 36.247 36.247 34.936 1.311 25468
4539 1 19 . 1 1 37 37 VAL H H 37 9.587 9.587 7.977 1.610 25468
4540 1 19 . 1 1 38 38 HIS N N 38 118.311 118.311 117.480 0.831 25468
4541 1 19 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.486 -0.446 25468
4542 1 19 . 1 1 38 38 HIS CA C 38 53.975 53.975 53.797 0.178 25468
4543 1 19 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.328 -1.848 25468
4544 1 19 . 1 1 38 38 HIS H H 38 8.698 8.698 7.368 1.330 25468
4545 1 19 . 1 1 39 39 ILE N N 39 124.114 124.114 121.796 2.318 25468
4546 1 19 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.157 0.145 25468
4547 1 19 . 1 1 39 39 ILE CA C 39 59.840 59.840 59.573 0.267 25468
4548 1 19 . 1 1 39 39 ILE CB C 39 38.709 38.709 37.514 1.195 25468
4549 1 19 . 1 1 39 39 ILE H H 39 8.969 8.969 8.368 0.601 25468
4550 1 19 . 1 1 40 40 GLY N N 40 115.080 115.080 116.751 -1.671 25468
4551 1 19 . 1 1 40 40 GLY CA C 40 46.226 46.226 45.984 0.242 25468
4552 1 19 . 1 1 40 40 GLY H H 40 8.715 8.715 8.965 -0.250 25468
4553 1 19 . 1 1 41 41 GLN N N 41 121.798 121.798 114.877 6.921 25468
4554 1 19 . 1 1 41 41 GLN HA H 41 4.304 4.304 3.942 0.362 25468
4555 1 19 . 1 1 41 41 GLN CA C 41 55.650 55.650 56.810 -1.160 25468
4556 1 19 . 1 1 41 41 GLN CB C 41 28.480 28.480 25.857 2.623 25468
4557 1 19 . 1 1 41 41 GLN H H 41 8.672 8.672 8.676 -0.004 25468
4558 1 19 . 1 1 42 42 SER N N 42 114.462 114.462 114.264 0.198 25468
4559 1 19 . 1 1 42 42 SER HA H 42 4.347 4.347 4.417 -0.070 25468
4560 1 19 . 1 1 42 42 SER CA C 42 58.072 58.072 59.874 -1.802 25468
4561 1 19 . 1 1 42 42 SER CB C 42 64.037 64.037 63.922 0.115 25468
4562 1 19 . 1 1 42 42 SER H H 42 7.725 7.725 8.476 -0.751 25468
4563 1 19 . 1 1 43 43 LEU N N 43 124.166 124.166 118.749 5.417 25468
4564 1 19 . 1 1 43 43 LEU HA H 43 3.950 3.950 4.174 -0.224 25468
4565 1 19 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.670 -0.375 25468
4566 1 19 . 1 1 43 43 LEU CB C 43 41.400 41.400 41.344 0.056 25468
4567 1 19 . 1 1 43 43 LEU H H 43 8.576 8.576 8.034 0.542 25468
4568 1 19 . 1 1 44 44 ASP N N 44 118.797 118.797 119.701 -0.904 25468
4569 1 19 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.912 -0.181 25468
4570 1 19 . 1 1 44 44 ASP CB C 44 39.979 39.979 41.902 -1.923 25468
4571 1 19 . 1 1 44 44 ASP H H 44 8.163 8.163 8.113 0.050 25468
4572 1 19 . 1 1 45 45 PHE N N 45 123.595 123.595 124.628 -1.033 25468
4573 1 19 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.107 -0.187 25468
4574 1 19 . 1 1 45 45 PHE CA C 45 57.607 57.607 55.961 1.646 25468
4575 1 19 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.684 0.399 25468
4576 1 19 . 1 1 45 45 PHE H H 45 9.042 9.042 9.043 -0.001 25468
4577 1 19 . 1 1 46 46 VAL N N 46 119.357 119.357 117.920 1.437 25468
4578 1 19 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.724 -0.031 25468
4579 1 19 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.892 0.022 25468
4580 1 19 . 1 1 46 46 VAL CB C 46 34.666 34.666 35.035 -0.369 25468
4581 1 19 . 1 1 46 46 VAL H H 46 9.555 9.555 8.447 1.108 25468
4582 1 19 . 1 1 47 47 CYS N N 47 122.793 122.793 124.226 -1.433 25468
4583 1 19 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.423 -0.593 25468
4584 1 19 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.856 11.874 25468
4585 1 19 . 1 1 47 47 CYS H H 47 9.044 9.044 8.475 0.569 25468
4586 1 19 . 1 1 48 48 VAL N N 48 129.864 129.864 126.916 2.948 25468
4587 1 19 . 1 1 48 48 VAL HA H 48 4.533 4.533 4.826 -0.293 25468
4588 1 19 . 1 1 48 48 VAL CA C 48 59.817 59.817 60.094 -0.277 25468
4589 1 19 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.356 -1.958 25468
4590 1 19 . 1 1 48 48 VAL H H 48 8.616 8.616 8.143 0.473 25468
4591 1 19 . 1 1 49 49 CYS N N 49 121.329 121.329 123.848 -2.519 25468
4592 1 19 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.327 -0.179 25468
4593 1 19 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.641 -6.212 25468
4594 1 19 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.541 5.332 25468
4595 1 19 . 1 1 49 49 CYS H H 49 8.652 8.652 8.462 0.190 25468
4596 1 19 . 1 1 50 50 PHE N N 50 119.026 119.026 121.465 -2.439 25468
4597 1 19 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.076 -0.127 25468
4598 1 19 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.219 -0.567 25468
4599 1 19 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.924 -1.331 25468
4600 1 19 . 1 1 50 50 PHE H H 50 8.472 8.472 8.673 -0.201 25468
4601 1 19 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.004 0.728 25468
4602 1 19 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.529 0.680 25468
4603 1 19 . 1 1 52 52 LYS N N 52 119.951 119.951 121.762 -1.811 25468
4604 1 19 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.386 -0.427 25468
4605 1 19 . 1 1 52 52 LYS CA C 52 57.670 57.670 56.785 0.885 25468
4606 1 19 . 1 1 52 52 LYS CB C 52 33.225 33.225 34.104 -0.879 25468
4607 1 19 . 1 1 52 52 LYS H H 52 8.681 8.681 8.013 0.668 25468
4608 1 19 . 1 1 53 53 TYR N N 53 118.889 118.889 115.591 3.298 25468
4609 1 19 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.709 -0.238 25468
4610 1 19 . 1 1 53 53 TYR CA C 53 58.049 58.049 55.725 2.324 25468
4611 1 19 . 1 1 53 53 TYR CB C 53 38.268 38.268 38.099 0.169 25468
4612 1 19 . 1 1 53 53 TYR H H 53 8.215 8.215 7.588 0.627 25468
4613 1 19 . 1 1 54 54 TYR N N 54 121.087 121.087 123.478 -2.391 25468
4614 1 19 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.284 0.210 25468
4615 1 19 . 1 1 54 54 TYR CA C 54 58.101 58.101 58.373 -0.272 25468
4616 1 19 . 1 1 54 54 TYR CB C 54 39.611 39.611 38.333 1.278 25468
4617 1 19 . 1 1 54 54 TYR H H 54 7.919 7.919 7.346 0.573 25468
4618 1 20 . 1 1 2 2 ASP N N 2 123.544 123.544 121.637 1.907 25468
4619 1 20 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.630 0.068 25468
4620 1 20 . 1 1 2 2 ASP CB C 2 39.907 39.907 41.192 -1.285 25468
4621 1 20 . 1 1 2 2 ASP H H 2 8.843 8.843 8.407 0.436 25468
4622 1 20 . 1 1 3 3 ILE N N 3 121.633 121.633 122.258 -0.625 25468
4623 1 20 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.026 0.132 25468
4624 1 20 . 1 1 3 3 ILE CA C 3 61.110 61.110 61.073 0.037 25468
4625 1 20 . 1 1 3 3 ILE CB C 3 39.038 39.038 38.179 0.859 25468
4626 1 20 . 1 1 3 3 ILE H H 3 8.356 8.356 7.547 0.809 25468
4627 1 20 . 1 1 4 4 ASP N N 4 124.028 124.028 126.732 -2.704 25468
4628 1 20 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.465 0.162 25468
4629 1 20 . 1 1 4 4 ASP CA C 4 53.776 53.776 54.233 -0.457 25468
4630 1 20 . 1 1 4 4 ASP CB C 4 40.216 40.216 40.807 -0.591 25468
4631 1 20 . 1 1 4 4 ASP H H 4 8.460 8.460 8.438 0.022 25468
4632 1 20 . 1 1 5 5 GLY N N 5 110.531 110.531 109.489 1.042 25468
4633 1 20 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.528 0.187 25468
4634 1 20 . 1 1 5 5 GLY H H 5 8.405 8.405 8.063 0.342 25468
4635 1 20 . 1 1 6 6 ARG N N 6 119.193 119.193 121.916 -2.723 25468
4636 1 20 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.566 -0.219 25468
4637 1 20 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.708 1.539 25468
4638 1 20 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.076 1.013 25468
4639 1 20 . 1 1 6 6 ARG H H 6 8.128 8.128 8.065 0.063 25468
4640 1 20 . 1 1 7 7 LYS N N 7 120.971 120.971 119.995 0.976 25468
4641 1 20 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.524 0.245 25468
4642 1 20 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.220 1.010 25468
4643 1 20 . 1 1 7 7 LYS H H 7 7.984 7.984 7.418 0.566 25468
4644 1 20 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.052 0.486 25468
4645 1 20 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.438 0.765 25468
4646 1 20 . 1 1 8 8 PRO CB C 8 31.855 31.855 31.880 -0.025 25468
4647 1 20 . 1 1 9 9 LEU N N 9 123.948 123.948 123.231 0.717 25468
4648 1 20 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.506 -0.019 25468
4649 1 20 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.424 0.087 25468
4650 1 20 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.245 2.514 25468
4651 1 20 . 1 1 9 9 LEU H H 9 7.801 7.801 7.960 -0.159 25468
4652 1 20 . 1 1 10 10 LEU N N 10 130.176 130.176 128.615 1.561 25468
4653 1 20 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.754 -0.200 25468
4654 1 20 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.707 0.764 25468
4655 1 20 . 1 1 10 10 LEU CB C 10 42.103 42.103 42.189 -0.086 25468
4656 1 20 . 1 1 10 10 LEU H H 10 8.422 8.422 8.598 -0.176 25468
4657 1 20 . 1 1 11 11 ILE N N 11 120.839 120.839 122.527 -1.688 25468
4658 1 20 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.584 -0.198 25468
4659 1 20 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.945 0.586 25468
4660 1 20 . 1 1 11 11 ILE CB C 11 39.357 39.357 39.054 0.303 25468
4661 1 20 . 1 1 11 11 ILE H H 11 8.289 8.289 8.566 -0.277 25468
4662 1 20 . 1 1 12 12 GLY N N 12 106.385 106.385 107.858 -1.473 25468
4663 1 20 . 1 1 12 12 GLY CA C 12 44.743 44.743 46.018 -1.275 25468
4664 1 20 . 1 1 12 12 GLY H H 12 7.125 7.125 7.507 -0.382 25468
4665 1 20 . 1 1 13 13 THR N N 13 110.566 110.566 110.874 -0.308 25468
4666 1 20 . 1 1 13 13 THR HA H 13 4.676 4.676 5.053 -0.377 25468
4667 1 20 . 1 1 13 13 THR CA C 13 62.119 62.119 60.048 2.071 25468
4668 1 20 . 1 1 13 13 THR CB C 13 71.115 71.115 71.819 -0.704 25468
4669 1 20 . 1 1 13 13 THR H H 13 9.046 9.046 8.164 0.882 25468
4670 1 20 . 1 1 14 14 CYS N N 14 117.216 117.216 121.631 -4.415 25468
4671 1 20 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.779 0.121 25468
4672 1 20 . 1 1 14 14 CYS CA C 14 58.201 58.201 61.628 -3.427 25468
4673 1 20 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.833 18.798 25468
4674 1 20 . 1 1 14 14 CYS H H 14 8.436 8.436 8.780 -0.344 25468
4675 1 20 . 1 1 15 15 ILE N N 15 118.247 118.247 119.387 -1.140 25468
4676 1 20 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.852 0.034 25468
4677 1 20 . 1 1 15 15 ILE CA C 15 63.301 63.301 64.112 -0.811 25468
4678 1 20 . 1 1 15 15 ILE CB C 15 37.496 37.496 37.288 0.208 25468
4679 1 20 . 1 1 15 15 ILE H H 15 7.244 7.244 7.601 -0.357 25468
4680 1 20 . 1 1 16 16 GLU N N 16 119.649 119.649 118.921 0.728 25468
4681 1 20 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.150 -0.317 25468
4682 1 20 . 1 1 16 16 GLU CA C 16 57.902 57.902 57.103 0.799 25468
4683 1 20 . 1 1 16 16 GLU CB C 16 28.781 28.781 30.884 -2.103 25468
4684 1 20 . 1 1 16 16 GLU H H 16 7.066 7.066 7.882 -0.816 25468
4685 1 20 . 1 1 17 17 PHE N N 17 114.996 114.996 120.932 -5.936 25468
4686 1 20 . 1 1 17 17 PHE HA H 17 4.564 4.564 5.002 -0.438 25468
4687 1 20 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.645 -1.117 25468
4688 1 20 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.049 0.841 25468
4689 1 20 . 1 1 17 17 PHE H H 17 8.148 8.148 8.134 0.014 25468
4690 1 20 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.580 0.273 25468
4691 1 20 . 1 1 18 18 PRO CA C 18 62.917 62.917 63.121 -0.204 25468
4692 1 20 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.387 -0.519 25468
4693 1 20 . 1 1 19 19 THR N N 19 114.536 114.536 113.763 0.773 25468
4694 1 20 . 1 1 19 19 THR HA H 19 3.650 3.650 3.810 -0.160 25468
4695 1 20 . 1 1 19 19 THR CA C 19 68.731 68.731 67.216 1.515 25468
4696 1 20 . 1 1 19 19 THR CB C 19 69.792 69.792 68.593 1.199 25468
4697 1 20 . 1 1 19 19 THR H H 19 8.370 8.370 8.597 -0.227 25468
4698 1 20 . 1 1 20 20 GLU N N 20 120.374 120.374 120.163 0.211 25468
4699 1 20 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.012 0.181 25468
4700 1 20 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.457 0.588 25468
4701 1 20 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.873 -0.617 25468
4702 1 20 . 1 1 20 20 GLU H H 20 9.038 9.038 8.920 0.118 25468
4703 1 20 . 1 1 21 21 LYS N N 21 122.432 122.432 120.421 2.011 25468
4704 1 20 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.145 0.020 25468
4705 1 20 . 1 1 21 21 LYS CA C 21 59.210 59.210 58.892 0.318 25468
4706 1 20 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.306 0.821 25468
4707 1 20 . 1 1 21 21 LYS H H 21 7.622 7.622 7.862 -0.240 25468
4708 1 20 . 1 1 22 22 CYS N N 22 121.466 121.466 120.570 0.896 25468
4709 1 20 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.032 0.053 25468
4710 1 20 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.797 -4.029 25468
4711 1 20 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.206 10.388 25468
4712 1 20 . 1 1 22 22 CYS H H 22 9.356 9.356 8.890 0.466 25468
4713 1 20 . 1 1 23 23 ASN N N 23 115.604 115.604 118.343 -2.739 25468
4714 1 20 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.467 -0.422 25468
4715 1 20 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.439 1.428 25468
4716 1 20 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.704 1.600 25468
4717 1 20 . 1 1 23 23 ASN H H 23 7.925 7.925 8.316 -0.391 25468
4718 1 20 . 1 1 24 24 LYS N N 24 116.665 116.665 121.401 -4.736 25468
4719 1 20 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.972 -0.060 25468
4720 1 20 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.779 0.130 25468
4721 1 20 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.270 0.765 25468
4722 1 20 . 1 1 24 24 LYS H H 24 7.955 7.955 8.153 -0.198 25468
4723 1 20 . 1 1 25 25 THR N N 25 116.759 116.759 115.166 1.593 25468
4724 1 20 . 1 1 25 25 THR HA H 25 3.859 3.859 4.063 -0.204 25468
4725 1 20 . 1 1 25 25 THR CA C 25 67.243 67.243 66.867 0.376 25468
4726 1 20 . 1 1 25 25 THR CB C 25 68.752 68.752 68.445 0.307 25468
4727 1 20 . 1 1 25 25 THR H H 25 8.518 8.518 8.475 0.043 25468
4728 1 20 . 1 1 26 26 CYS N N 26 121.616 121.616 120.003 1.613 25468
4729 1 20 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.326 -0.067 25468
4730 1 20 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.013 -3.410 25468
4731 1 20 . 1 1 26 26 CYS CB C 26 34.189 34.189 26.364 7.825 25468
4732 1 20 . 1 1 26 26 CYS H H 26 8.062 8.062 7.756 0.306 25468
4733 1 20 . 1 1 27 27 ILE N N 27 124.036 124.036 121.069 2.967 25468
4734 1 20 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.059 0.095 25468
4735 1 20 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.800 0.460 25468
4736 1 20 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.472 0.563 25468
4737 1 20 . 1 1 27 27 ILE H H 27 8.313 8.313 8.596 -0.283 25468
4738 1 20 . 1 1 28 28 GLU N N 28 121.780 121.780 119.725 2.055 25468
4739 1 20 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.100 0.094 25468
4740 1 20 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.422 0.075 25468
4741 1 20 . 1 1 28 28 GLU CB C 28 27.957 27.957 28.634 -0.677 25468
4742 1 20 . 1 1 28 28 GLU H H 28 8.312 8.312 8.561 -0.249 25468
4743 1 20 . 1 1 29 29 SER N N 29 114.001 114.001 115.278 -1.277 25468
4744 1 20 . 1 1 29 29 SER HA H 29 4.661 4.661 4.365 0.296 25468
4745 1 20 . 1 1 29 29 SER CA C 29 58.377 58.377 58.927 -0.550 25468
4746 1 20 . 1 1 29 29 SER CB C 29 63.484 63.484 63.313 0.171 25468
4747 1 20 . 1 1 29 29 SER H H 29 7.459 7.459 7.639 -0.180 25468
4748 1 20 . 1 1 30 30 ASN N N 30 112.213 112.213 113.890 -1.677 25468
4749 1 20 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.262 0.165 25468
4750 1 20 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.418 0.623 25468
4751 1 20 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.480 -0.136 25468
4752 1 20 . 1 1 30 30 ASN H H 30 8.067 8.067 7.679 0.388 25468
4753 1 20 . 1 1 31 31 PHE N N 31 116.306 116.306 117.334 -1.028 25468
4754 1 20 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.938 -0.364 25468
4755 1 20 . 1 1 31 31 PHE CA C 31 57.969 57.969 56.692 1.277 25468
4756 1 20 . 1 1 31 31 PHE CB C 31 38.699 38.699 40.626 -1.927 25468
4757 1 20 . 1 1 31 31 PHE H H 31 7.861 7.861 7.850 0.011 25468
4758 1 20 . 1 1 32 32 ALA N N 32 121.103 121.103 123.602 -2.499 25468
4759 1 20 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.310 -0.119 25468
4760 1 20 . 1 1 32 32 ALA CA C 32 53.586 53.586 53.812 -0.226 25468
4761 1 20 . 1 1 32 32 ALA CB C 32 19.211 19.211 19.298 -0.087 25468
4762 1 20 . 1 1 32 32 ALA H H 32 8.403 8.403 8.604 -0.201 25468
4763 1 20 . 1 1 33 33 GLY N N 33 100.820 100.820 104.642 -3.822 25468
4764 1 20 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.795 0.075 25468
4765 1 20 . 1 1 33 33 GLY H H 33 7.258 7.258 7.561 -0.303 25468
4766 1 20 . 1 1 34 34 GLY N N 34 108.312 108.312 105.829 2.483 25468
4767 1 20 . 1 1 34 34 GLY CA C 34 46.437 46.437 43.760 2.677 25468
4768 1 20 . 1 1 34 34 GLY H H 34 8.978 8.978 8.402 0.576 25468
4769 1 20 . 1 1 35 35 LYS N N 35 119.929 119.929 117.098 2.831 25468
4770 1 20 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.727 -0.133 25468
4771 1 20 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.918 -0.263 25468
4772 1 20 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.375 1.909 25468
4773 1 20 . 1 1 35 35 LYS H H 35 8.756 8.756 8.248 0.508 25468
4774 1 20 . 1 1 36 36 CYS N N 36 119.831 119.831 120.917 -1.086 25468
4775 1 20 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.717 -0.353 25468
4776 1 20 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.094 -0.876 25468
4777 1 20 . 1 1 36 36 CYS CB C 36 44.150 44.150 27.007 17.143 25468
4778 1 20 . 1 1 36 36 CYS H H 36 8.553 8.553 8.614 -0.061 25468
4779 1 20 . 1 1 37 37 VAL N N 37 120.392 120.392 121.508 -1.116 25468
4780 1 20 . 1 1 37 37 VAL HA H 37 4.764 4.764 5.039 -0.275 25468
4781 1 20 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.506 0.741 25468
4782 1 20 . 1 1 37 37 VAL H H 37 9.587 9.587 8.785 0.802 25468
4783 1 20 . 1 1 38 38 HIS N N 38 118.311 118.311 118.724 -0.413 25468
4784 1 20 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.340 -0.300 25468
4785 1 20 . 1 1 38 38 HIS CA C 38 53.975 53.975 53.691 0.284 25468
4786 1 20 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.207 -1.727 25468
4787 1 20 . 1 1 38 38 HIS H H 38 8.698 8.698 8.288 0.410 25468
4788 1 20 . 1 1 39 39 ILE N N 39 124.114 124.114 121.114 3.000 25468
4789 1 20 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.090 0.212 25468
4790 1 20 . 1 1 39 39 ILE CA C 39 59.840 59.840 60.415 -0.575 25468
4791 1 20 . 1 1 39 39 ILE CB C 39 38.709 38.709 39.148 -0.439 25468
4792 1 20 . 1 1 39 39 ILE H H 39 8.969 8.969 8.496 0.473 25468
4793 1 20 . 1 1 40 40 GLY N N 40 115.080 115.080 115.322 -0.242 25468
4794 1 20 . 1 1 40 40 GLY CA C 40 46.226 46.226 46.073 0.153 25468
4795 1 20 . 1 1 40 40 GLY H H 40 8.715 8.715 8.932 -0.217 25468
4796 1 20 . 1 1 41 41 GLN N N 41 121.798 121.798 116.246 5.552 25468
4797 1 20 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.016 0.288 25468
4798 1 20 . 1 1 41 41 GLN CA C 41 55.650 55.650 56.676 -1.026 25468
4799 1 20 . 1 1 41 41 GLN CB C 41 28.480 28.480 27.552 0.927 25468
4800 1 20 . 1 1 41 41 GLN H H 41 8.672 8.672 8.388 0.284 25468
4801 1 20 . 1 1 42 42 SER N N 42 114.462 114.462 114.098 0.364 25468
4802 1 20 . 1 1 42 42 SER HA H 42 4.347 4.347 4.371 -0.024 25468
4803 1 20 . 1 1 42 42 SER CA C 42 58.072 58.072 59.385 -1.313 25468
4804 1 20 . 1 1 42 42 SER CB C 42 64.037 64.037 63.633 0.404 25468
4805 1 20 . 1 1 42 42 SER H H 42 7.725 7.725 8.674 -0.949 25468
4806 1 20 . 1 1 43 43 LEU N N 43 124.166 124.166 119.989 4.177 25468
4807 1 20 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.850 0.100 25468
4808 1 20 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.481 -0.186 25468
4809 1 20 . 1 1 43 43 LEU CB C 43 41.400 41.400 41.584 -0.184 25468
4810 1 20 . 1 1 43 43 LEU H H 43 8.576 8.576 7.682 0.894 25468
4811 1 20 . 1 1 44 44 ASP N N 44 118.797 118.797 119.205 -0.408 25468
4812 1 20 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.666 0.065 25468
4813 1 20 . 1 1 44 44 ASP CB C 44 39.979 39.979 41.754 -1.775 25468
4814 1 20 . 1 1 44 44 ASP H H 44 8.163 8.163 7.892 0.271 25468
4815 1 20 . 1 1 45 45 PHE N N 45 123.595 123.595 124.820 -1.225 25468
4816 1 20 . 1 1 45 45 PHE HA H 45 4.920 4.920 4.809 0.111 25468
4817 1 20 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.441 0.166 25468
4818 1 20 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.309 0.774 25468
4819 1 20 . 1 1 45 45 PHE H H 45 9.042 9.042 8.801 0.241 25468
4820 1 20 . 1 1 46 46 VAL N N 46 119.357 119.357 118.821 0.536 25468
4821 1 20 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.871 -0.178 25468
4822 1 20 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.579 0.336 25468
4823 1 20 . 1 1 46 46 VAL CB C 46 34.666 34.666 33.037 1.629 25468
4824 1 20 . 1 1 46 46 VAL H H 46 9.555 9.555 8.682 0.873 25468
4825 1 20 . 1 1 47 47 CYS N N 47 122.793 122.793 126.387 -3.594 25468
4826 1 20 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.216 -0.386 25468
4827 1 20 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.461 12.269 25468
4828 1 20 . 1 1 47 47 CYS H H 47 9.044 9.044 8.532 0.512 25468
4829 1 20 . 1 1 48 48 VAL N N 48 129.864 129.864 126.401 3.463 25468
4830 1 20 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.188 -0.655 25468
4831 1 20 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.296 0.521 25468
4832 1 20 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.471 -2.073 25468
4833 1 20 . 1 1 48 48 VAL H H 48 8.616 8.616 8.168 0.449 25468
4834 1 20 . 1 1 49 49 CYS N N 49 121.329 121.329 123.854 -2.525 25468
4835 1 20 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.078 0.070 25468
4836 1 20 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.587 -6.158 25468
4837 1 20 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.963 4.910 25468
4838 1 20 . 1 1 49 49 CYS H H 49 8.652 8.652 8.079 0.573 25468
4839 1 20 . 1 1 50 50 PHE N N 50 119.026 119.026 120.697 -1.671 25468
4840 1 20 . 1 1 50 50 PHE HA H 50 4.949 4.949 4.726 0.223 25468
4841 1 20 . 1 1 50 50 PHE CA C 50 54.652 54.652 54.729 -0.077 25468
4842 1 20 . 1 1 50 50 PHE CB C 50 40.593 40.593 40.834 -0.241 25468
4843 1 20 . 1 1 50 50 PHE H H 50 8.472 8.472 8.422 0.050 25468
4844 1 20 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.287 0.445 25468
4845 1 20 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.213 0.996 25468
4846 1 20 . 1 1 52 52 LYS N N 52 119.951 119.951 124.002 -4.051 25468
4847 1 20 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.156 -0.197 25468
4848 1 20 . 1 1 52 52 LYS CA C 52 57.670 57.670 58.360 -0.690 25468
4849 1 20 . 1 1 52 52 LYS CB C 52 33.225 33.225 32.434 0.791 25468
4850 1 20 . 1 1 52 52 LYS H H 52 8.681 8.681 9.168 -0.487 25468
4851 1 20 . 1 1 53 53 TYR N N 53 118.889 118.889 116.891 1.998 25468
4852 1 20 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.695 -0.224 25468
4853 1 20 . 1 1 53 53 TYR CA C 53 58.049 58.049 56.178 1.871 25468
4854 1 20 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.612 0.656 25468
4855 1 20 . 1 1 53 53 TYR H H 53 8.215 8.215 7.896 0.319 25468
4856 1 20 . 1 1 54 54 TYR N N 54 121.087 121.087 121.321 -0.234 25468
4857 1 20 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.762 -0.268 25468
4858 1 20 . 1 1 54 54 TYR CA C 54 58.101 58.101 57.957 0.144 25468
4859 1 20 . 1 1 54 54 TYR CB C 54 39.611 39.611 40.390 -0.779 25468
4860 1 20 . 1 1 54 54 TYR H H 54 7.919 7.919 7.565 0.354 25468
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 50 2.865 0.700 2.806 25468
2 1 1 "Average Difference" HA 53 0.317 0.067 0.312 25468
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25468
4 1 1 "Average Difference" CA 47 1.585 0.232 1.585 25468
5 1 1 "Average Difference" CB 48 4.736 -1.610 4.501 25468
6 1 1 "Average Difference" HN 50 0.495 -0.055 0.497 25468
7 1 2 "Average Difference" N 50 3.064 0.066 3.094 25468
8 1 2 "Average Difference" HA 53 0.289 0.065 0.284 25468
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25468
10 1 2 "Average Difference" CA 47 1.691 0.125 1.705 25468
11 1 2 "Average Difference" CB 48 4.758 -1.557 4.544 25468
12 1 2 "Average Difference" HN 50 0.538 -0.130 0.528 25468
13 1 3 "Average Difference" N 50 2.610 0.118 2.634 25468
14 1 3 "Average Difference" HA 53 0.284 0.062 0.280 25468
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25468
16 1 3 "Average Difference" CA 47 1.661 0.123 1.675 25468
17 1 3 "Average Difference" CB 48 4.720 -1.473 4.532 25468
18 1 3 "Average Difference" HN 50 0.487 -0.110 0.479 25468
19 1 4 "Average Difference" N 50 2.556 0.206 2.574 25468
20 1 4 "Average Difference" HA 53 0.287 0.077 0.279 25468
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25468
22 1 4 "Average Difference" CA 47 1.558 0.231 1.557 25468
23 1 4 "Average Difference" CB 48 4.724 -1.549 4.510 25468
24 1 4 "Average Difference" HN 50 0.491 -0.098 0.486 25468
25 1 5 "Average Difference" N 50 2.762 0.156 2.785 25468
26 1 5 "Average Difference" HA 53 0.329 0.080 0.322 25468
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25468
28 1 5 "Average Difference" CA 47 1.645 0.222 1.647 25468
29 1 5 "Average Difference" CB 48 4.679 -1.522 4.471 25468
30 1 5 "Average Difference" HN 50 0.498 -0.106 0.491 25468
31 1 6 "Average Difference" N 50 2.263 0.026 2.285 25468
32 1 6 "Average Difference" HA 53 0.281 0.075 0.274 25468
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25468
34 1 6 "Average Difference" CA 47 1.477 0.169 1.483 25468
35 1 6 "Average Difference" CB 48 4.726 -1.438 4.550 25468
36 1 6 "Average Difference" HN 50 0.445 -0.127 0.431 25468
37 1 7 "Average Difference" N 50 2.842 -0.156 2.866 25468
38 1 7 "Average Difference" HA 53 0.350 0.049 0.350 25468
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25468
40 1 7 "Average Difference" CA 47 1.724 0.270 1.721 25468
41 1 7 "Average Difference" CB 48 4.739 -1.517 4.537 25468
42 1 7 "Average Difference" HN 50 0.473 -0.097 0.468 25468
43 1 8 "Average Difference" N 50 2.719 0.172 2.741 25468
44 1 8 "Average Difference" HA 53 0.294 0.085 0.284 25468
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25468
46 1 8 "Average Difference" CA 47 1.686 0.046 1.704 25468
47 1 8 "Average Difference" CB 48 4.768 -1.581 4.545 25468
48 1 8 "Average Difference" HN 50 0.517 -0.075 0.516 25468
49 1 9 "Average Difference" N 50 2.452 0.364 2.450 25468
50 1 9 "Average Difference" HA 53 0.321 0.060 0.319 25468
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25468
52 1 9 "Average Difference" CA 47 1.715 0.092 1.731 25468
53 1 9 "Average Difference" CB 48 4.789 -1.542 4.582 25468
54 1 9 "Average Difference" HN 50 0.519 -0.121 0.510 25468
55 1 10 "Average Difference" N 50 2.554 -0.319 2.560 25468
56 1 10 "Average Difference" HA 53 0.291 0.032 0.292 25468
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25468
58 1 10 "Average Difference" CA 47 1.535 0.229 1.534 25468
59 1 10 "Average Difference" CB 48 4.790 -1.473 4.606 25468
60 1 10 "Average Difference" HN 50 0.435 -0.118 0.423 25468
61 1 11 "Average Difference" N 50 2.739 0.113 2.764 25468
62 1 11 "Average Difference" HA 53 0.294 0.090 0.283 25468
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25468
64 1 11 "Average Difference" CA 47 1.568 0.198 1.572 25468
65 1 11 "Average Difference" CB 48 4.760 -1.536 4.553 25468
66 1 11 "Average Difference" HN 50 0.518 -0.095 0.514 25468
67 1 12 "Average Difference" N 50 2.490 0.288 2.498 25468
68 1 12 "Average Difference" HA 53 0.250 0.043 0.248 25468
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25468
70 1 12 "Average Difference" CA 47 1.610 0.207 1.614 25468
71 1 12 "Average Difference" CB 48 4.770 -1.617 4.535 25468
72 1 12 "Average Difference" HN 50 0.482 -0.142 0.465 25468
73 1 13 "Average Difference" N 50 2.705 0.097 2.730 25468
74 1 13 "Average Difference" HA 53 0.299 0.064 0.295 25468
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25468
76 1 13 "Average Difference" CA 47 1.744 0.255 1.744 25468
77 1 13 "Average Difference" CB 48 4.805 -1.522 4.605 25468
78 1 13 "Average Difference" HN 50 0.472 -0.112 0.463 25468
79 1 14 "Average Difference" N 50 2.773 0.014 2.801 25468
80 1 14 "Average Difference" HA 53 0.300 0.072 0.294 25468
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25468
82 1 14 "Average Difference" CA 47 1.675 0.117 1.689 25468
83 1 14 "Average Difference" CB 48 4.723 -1.430 4.550 25468
84 1 14 "Average Difference" HN 50 0.470 -0.096 0.465 25468
85 1 15 "Average Difference" N 50 2.528 -0.217 2.545 25468
86 1 15 "Average Difference" HA 53 0.273 0.078 0.264 25468
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25468
88 1 15 "Average Difference" CA 47 1.620 0.189 1.626 25468
89 1 15 "Average Difference" CB 48 4.696 -1.539 4.484 25468
90 1 15 "Average Difference" HN 50 0.466 -0.080 0.464 25468
91 1 16 "Average Difference" N 50 2.544 0.161 2.565 25468
92 1 16 "Average Difference" HA 53 0.305 0.069 0.300 25468
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25468
94 1 16 "Average Difference" CA 47 1.441 0.117 1.451 25468
95 1 16 "Average Difference" CB 48 4.754 -1.547 4.543 25468
96 1 16 "Average Difference" HN 50 0.486 -0.119 0.476 25468
97 1 17 "Average Difference" N 50 2.209 0.281 2.213 25468
98 1 17 "Average Difference" HA 53 0.286 0.052 0.284 25468
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25468
100 1 17 "Average Difference" CA 47 1.477 0.142 1.486 25468
101 1 17 "Average Difference" CB 48 4.777 -1.510 4.580 25468
102 1 17 "Average Difference" HN 50 0.455 -0.118 0.444 25468
103 1 18 "Average Difference" N 50 2.382 0.487 2.355 25468
104 1 18 "Average Difference" HA 53 0.298 0.070 0.292 25468
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25468
106 1 18 "Average Difference" CA 47 1.556 0.126 1.568 25468
107 1 18 "Average Difference" CB 48 4.683 -1.486 4.488 25468
108 1 18 "Average Difference" HN 50 0.496 -0.066 0.496 25468
109 1 19 "Average Difference" N 50 2.763 -0.154 2.786 25468
110 1 19 "Average Difference" HA 53 0.314 0.073 0.309 25468
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25468
112 1 19 "Average Difference" CA 47 1.570 0.091 1.585 25468
113 1 19 "Average Difference" CB 48 4.730 -1.525 4.525 25468
114 1 19 "Average Difference" HN 50 0.533 -0.165 0.512 25468
115 1 20 "Average Difference" N 50 2.433 0.238 2.446 25468
116 1 20 "Average Difference" HA 53 0.304 0.052 0.302 25468
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25468
118 1 20 "Average Difference" CA 47 1.553 0.145 1.563 25468
119 1 20 "Average Difference" CB 48 4.655 -1.591 4.421 25468
120 1 20 "Average Difference" HN 50 0.446 -0.111 0.436 25468
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 25468
_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 ASP N N 2 123.544 123.544 121.484 2.061 25468
2 1 . 1 1 2 2 ASP HA H 2 4.698 4.698 4.572 0.126 25468
3 1 . 1 1 2 2 ASP CB C 2 39.907 39.907 40.944 -1.037 25468
4 1 . 1 1 2 2 ASP H H 2 8.843 8.843 8.430 0.413 25468
5 1 . 1 1 3 3 ILE N N 3 121.633 121.633 119.646 1.987 25468
6 1 . 1 1 3 3 ILE HA H 3 4.158 4.158 4.001 0.157 25468
7 1 . 1 1 3 3 ILE CA C 3 61.110 61.110 60.941 0.169 25468
8 1 . 1 1 3 3 ILE CB C 3 39.038 39.038 38.067 0.971 25468
9 1 . 1 1 3 3 ILE H H 3 8.356 8.356 7.615 0.741 25468
10 1 . 1 1 4 4 ASP N N 4 124.028 124.028 125.982 -1.954 25468
11 1 . 1 1 4 4 ASP HA H 4 4.627 4.627 4.436 0.191 25468
12 1 . 1 1 4 4 ASP CA C 4 53.776 53.776 55.151 -1.375 25468
13 1 . 1 1 4 4 ASP CB C 4 40.216 40.216 41.168 -0.952 25468
14 1 . 1 1 4 4 ASP H H 4 8.460 8.460 8.462 -0.002 25468
15 1 . 1 1 5 5 GLY N N 5 110.531 110.531 108.204 2.327 25468
16 1 . 1 1 5 5 GLY CA C 5 45.714 45.714 45.422 0.292 25468
17 1 . 1 1 5 5 GLY H H 5 8.405 8.405 8.188 0.217 25468
18 1 . 1 1 6 6 ARG N N 6 119.193 119.193 119.614 -0.420 25468
19 1 . 1 1 6 6 ARG HA H 6 4.347 4.347 4.489 -0.142 25468
20 1 . 1 1 6 6 ARG CA C 6 56.247 56.247 54.605 1.642 25468
21 1 . 1 1 6 6 ARG CB C 6 31.089 31.089 30.238 0.851 25468
22 1 . 1 1 6 6 ARG H H 6 8.128 8.128 8.065 0.063 25468
23 1 . 1 1 7 7 LYS N N 7 120.971 120.971 120.296 0.675 25468
24 1 . 1 1 7 7 LYS HA H 7 4.769 4.769 4.675 0.094 25468
25 1 . 1 1 7 7 LYS CB C 7 33.230 33.230 32.812 0.418 25468
26 1 . 1 1 7 7 LYS H H 7 7.984 7.984 7.765 0.219 25468
27 1 . 1 1 8 8 PRO HA H 8 4.538 4.538 4.302 0.236 25468
28 1 . 1 1 8 8 PRO CA C 8 63.203 63.203 62.364 0.839 25468
29 1 . 1 1 8 8 PRO CB C 8 31.855 31.855 32.258 -0.403 25468
30 1 . 1 1 9 9 LEU N N 9 123.948 123.948 122.397 1.551 25468
31 1 . 1 1 9 9 LEU HA H 9 4.487 4.487 4.500 -0.013 25468
32 1 . 1 1 9 9 LEU CA C 9 53.511 53.511 53.400 0.111 25468
33 1 . 1 1 9 9 LEU CB C 9 46.759 46.759 44.321 2.438 25468
34 1 . 1 1 9 9 LEU H H 9 7.801 7.801 7.811 -0.010 25468
35 1 . 1 1 10 10 LEU N N 10 130.176 130.176 128.182 1.994 25468
36 1 . 1 1 10 10 LEU HA H 10 4.554 4.554 4.841 -0.287 25468
37 1 . 1 1 10 10 LEU CA C 10 55.471 55.471 54.554 0.917 25468
38 1 . 1 1 10 10 LEU CB C 10 42.103 42.103 43.058 -0.955 25468
39 1 . 1 1 10 10 LEU H H 10 8.422 8.422 8.559 -0.137 25468
40 1 . 1 1 11 11 ILE N N 11 120.839 120.839 121.821 -0.982 25468
41 1 . 1 1 11 11 ILE HA H 11 4.386 4.386 4.523 -0.137 25468
42 1 . 1 1 11 11 ILE CA C 11 61.531 61.531 60.879 0.652 25468
43 1 . 1 1 11 11 ILE CB C 11 39.357 39.357 38.838 0.519 25468
44 1 . 1 1 11 11 ILE H H 11 8.289 8.289 8.596 -0.307 25468
45 1 . 1 1 12 12 GLY N N 12 106.385 106.385 107.235 -0.850 25468
46 1 . 1 1 12 12 GLY CA C 12 44.743 44.743 45.786 -1.043 25468
47 1 . 1 1 12 12 GLY H H 12 7.125 7.125 7.513 -0.388 25468
48 1 . 1 1 13 13 THR N N 13 110.566 110.566 111.725 -1.159 25468
49 1 . 1 1 13 13 THR HA H 13 4.676 4.676 4.889 -0.213 25468
50 1 . 1 1 13 13 THR CA C 13 62.119 62.119 60.260 1.859 25468
51 1 . 1 1 13 13 THR CB C 13 71.115 71.115 71.397 -0.282 25468
52 1 . 1 1 13 13 THR H H 13 9.046 9.046 8.105 0.941 25468
53 1 . 1 1 14 14 CYS N N 14 117.216 117.216 122.077 -4.861 25468
54 1 . 1 1 14 14 CYS HA H 14 4.900 4.900 4.668 0.232 25468
55 1 . 1 1 14 14 CYS CA C 14 58.201 58.201 60.801 -2.600 25468
56 1 . 1 1 14 14 CYS CB C 14 44.631 44.631 25.780 18.851 25468
57 1 . 1 1 14 14 CYS H H 14 8.436 8.436 8.651 -0.215 25468
58 1 . 1 1 15 15 ILE N N 15 118.247 118.247 119.428 -1.181 25468
59 1 . 1 1 15 15 ILE HA H 15 3.886 3.886 3.878 0.008 25468
60 1 . 1 1 15 15 ILE CA C 15 63.301 63.301 63.831 -0.530 25468
61 1 . 1 1 15 15 ILE CB C 15 37.496 37.496 37.901 -0.405 25468
62 1 . 1 1 15 15 ILE H H 15 7.244 7.244 7.834 -0.590 25468
63 1 . 1 1 16 16 GLU N N 16 119.649 119.649 118.414 1.235 25468
64 1 . 1 1 16 16 GLU HA H 16 3.833 3.833 4.189 -0.356 25468
65 1 . 1 1 16 16 GLU CA C 16 57.902 57.902 57.017 0.885 25468
66 1 . 1 1 16 16 GLU CB C 16 28.781 28.781 30.901 -2.120 25468
67 1 . 1 1 16 16 GLU H H 16 7.066 7.066 7.886 -0.820 25468
68 1 . 1 1 17 17 PHE N N 17 114.996 114.996 120.834 -5.838 25468
69 1 . 1 1 17 17 PHE HA H 17 4.564 4.564 4.992 -0.428 25468
70 1 . 1 1 17 17 PHE CA C 17 54.528 54.528 55.387 -0.859 25468
71 1 . 1 1 17 17 PHE CB C 17 39.890 39.890 39.244 0.646 25468
72 1 . 1 1 17 17 PHE H H 17 8.148 8.148 8.073 0.075 25468
73 1 . 1 1 18 18 PRO HA H 18 4.853 4.853 4.620 0.233 25468
74 1 . 1 1 18 18 PRO CA C 18 62.917 62.917 62.946 -0.029 25468
75 1 . 1 1 18 18 PRO CB C 18 31.868 31.868 32.618 -0.750 25468
76 1 . 1 1 19 19 THR N N 19 114.536 114.536 113.961 0.575 25468
77 1 . 1 1 19 19 THR HA H 19 3.650 3.650 3.905 -0.255 25468
78 1 . 1 1 19 19 THR CA C 19 68.731 68.731 67.567 1.164 25468
79 1 . 1 1 19 19 THR CB C 19 69.792 69.792 68.496 1.296 25468
80 1 . 1 1 19 19 THR H H 19 8.370 8.370 8.627 -0.257 25468
81 1 . 1 1 20 20 GLU N N 20 120.374 120.374 120.731 -0.357 25468
82 1 . 1 1 20 20 GLU HA H 20 4.193 4.193 4.125 0.068 25468
83 1 . 1 1 20 20 GLU CA C 20 60.045 60.045 59.683 0.362 25468
84 1 . 1 1 20 20 GLU CB C 20 28.256 28.256 28.667 -0.411 25468
85 1 . 1 1 20 20 GLU H H 20 9.038 9.038 8.869 0.169 25468
86 1 . 1 1 21 21 LYS N N 21 122.432 122.432 120.457 1.975 25468
87 1 . 1 1 21 21 LYS HA H 21 4.165 4.165 4.108 0.057 25468
88 1 . 1 1 21 21 LYS CA C 21 59.210 59.210 59.208 0.002 25468
89 1 . 1 1 21 21 LYS CB C 21 33.127 33.127 32.279 0.848 25468
90 1 . 1 1 21 21 LYS H H 21 7.622 7.622 8.062 -0.440 25468
91 1 . 1 1 22 22 CYS N N 22 121.466 121.466 119.975 1.491 25468
92 1 . 1 1 22 22 CYS HA H 22 4.085 4.085 4.108 -0.023 25468
93 1 . 1 1 22 22 CYS CA C 22 58.769 58.769 62.410 -3.641 25468
94 1 . 1 1 22 22 CYS CB C 22 36.594 36.594 26.076 10.518 25468
95 1 . 1 1 22 22 CYS H H 22 9.356 9.356 8.745 0.611 25468
96 1 . 1 1 23 23 ASN N N 23 115.604 115.604 118.697 -3.093 25468
97 1 . 1 1 23 23 ASN HA H 23 4.045 4.045 4.470 -0.425 25468
98 1 . 1 1 23 23 ASN CA C 23 57.867 57.867 56.394 1.473 25468
99 1 . 1 1 23 23 ASN CB C 23 39.304 39.304 37.878 1.426 25468
100 1 . 1 1 23 23 ASN H H 23 7.925 7.925 8.171 -0.246 25468
101 1 . 1 1 24 24 LYS N N 24 116.665 116.665 121.140 -4.475 25468
102 1 . 1 1 24 24 LYS HA H 24 3.912 3.912 3.954 -0.042 25468
103 1 . 1 1 24 24 LYS CA C 24 59.909 59.909 59.878 0.031 25468
104 1 . 1 1 24 24 LYS CB C 24 33.035 33.035 32.267 0.768 25468
105 1 . 1 1 24 24 LYS H H 24 7.955 7.955 8.277 -0.322 25468
106 1 . 1 1 25 25 THR N N 25 116.759 116.759 115.493 1.266 25468
107 1 . 1 1 25 25 THR HA H 25 3.859 3.859 4.108 -0.249 25468
108 1 . 1 1 25 25 THR CA C 25 67.243 67.243 66.549 0.694 25468
109 1 . 1 1 25 25 THR CB C 25 68.752 68.752 68.454 0.298 25468
110 1 . 1 1 25 25 THR H H 25 8.518 8.518 8.579 -0.061 25468
111 1 . 1 1 26 26 CYS N N 26 121.616 121.616 120.873 0.743 25468
112 1 . 1 1 26 26 CYS HA H 26 4.259 4.259 4.210 0.049 25468
113 1 . 1 1 26 26 CYS CA C 26 57.603 57.603 61.612 -4.009 25468
114 1 . 1 1 26 26 CYS CB C 26 34.189 34.189 25.908 8.281 25468
115 1 . 1 1 26 26 CYS H H 26 8.062 8.062 7.729 0.333 25468
116 1 . 1 1 27 27 ILE N N 27 124.036 124.036 120.679 3.357 25468
117 1 . 1 1 27 27 ILE HA H 27 4.154 4.154 4.080 0.074 25468
118 1 . 1 1 27 27 ILE CA C 27 65.260 65.260 64.760 0.500 25468
119 1 . 1 1 27 27 ILE CB C 27 38.035 38.035 37.235 0.800 25468
120 1 . 1 1 27 27 ILE H H 27 8.313 8.313 8.505 -0.192 25468
121 1 . 1 1 28 28 GLU N N 28 121.780 121.780 120.407 1.373 25468
122 1 . 1 1 28 28 GLU HA H 28 4.194 4.194 4.138 0.056 25468
123 1 . 1 1 28 28 GLU CA C 28 58.497 58.497 58.845 -0.348 25468
124 1 . 1 1 28 28 GLU CB C 28 27.957 27.957 29.147 -1.190 25468
125 1 . 1 1 28 28 GLU H H 28 8.312 8.312 8.195 0.117 25468
126 1 . 1 1 29 29 SER N N 29 114.001 114.001 114.092 -0.091 25468
127 1 . 1 1 29 29 SER HA H 29 4.661 4.661 4.392 0.269 25468
128 1 . 1 1 29 29 SER CA C 29 58.377 58.377 59.265 -0.888 25468
129 1 . 1 1 29 29 SER CB C 29 63.484 63.484 63.291 0.193 25468
130 1 . 1 1 29 29 SER H H 29 7.459 7.459 7.700 -0.241 25468
131 1 . 1 1 30 30 ASN N N 30 112.213 112.213 115.891 -3.678 25468
132 1 . 1 1 30 30 ASN HA H 30 4.427 4.427 4.439 -0.012 25468
133 1 . 1 1 30 30 ASN CA C 30 55.041 55.041 54.584 0.457 25468
134 1 . 1 1 30 30 ASN CB C 30 36.344 36.344 36.889 -0.545 25468
135 1 . 1 1 30 30 ASN H H 30 8.067 8.067 7.835 0.232 25468
136 1 . 1 1 31 31 PHE N N 31 116.306 116.306 116.944 -0.638 25468
137 1 . 1 1 31 31 PHE HA H 31 4.574 4.574 4.690 -0.116 25468
138 1 . 1 1 31 31 PHE CA C 31 57.969 57.969 57.063 0.906 25468
139 1 . 1 1 31 31 PHE CB C 31 38.699 38.699 40.807 -2.108 25468
140 1 . 1 1 31 31 PHE H H 31 7.861 7.861 7.949 -0.088 25468
141 1 . 1 1 32 32 ALA N N 32 121.103 121.103 123.643 -2.540 25468
142 1 . 1 1 32 32 ALA HA H 32 4.191 4.191 4.303 -0.112 25468
143 1 . 1 1 32 32 ALA CA C 32 53.586 53.586 53.146 0.440 25468
144 1 . 1 1 32 32 ALA CB C 32 19.211 19.211 18.571 0.640 25468
145 1 . 1 1 32 32 ALA H H 32 8.403 8.403 8.909 -0.506 25468
146 1 . 1 1 33 33 GLY N N 33 100.820 100.820 105.234 -4.414 25468
147 1 . 1 1 33 33 GLY CA C 33 44.870 44.870 44.694 0.176 25468
148 1 . 1 1 33 33 GLY H H 33 7.258 7.258 7.645 -0.387 25468
149 1 . 1 1 34 34 GLY N N 34 108.312 108.312 105.685 2.627 25468
150 1 . 1 1 34 34 GLY CA C 34 46.437 46.437 44.241 2.196 25468
151 1 . 1 1 34 34 GLY H H 34 8.978 8.978 8.352 0.626 25468
152 1 . 1 1 35 35 LYS N N 35 119.929 119.929 116.953 2.976 25468
153 1 . 1 1 35 35 LYS HA H 35 4.594 4.594 4.814 -0.220 25468
154 1 . 1 1 35 35 LYS CA C 35 54.655 54.655 54.823 -0.168 25468
155 1 . 1 1 35 35 LYS CB C 35 37.284 37.284 35.423 1.861 25468
156 1 . 1 1 35 35 LYS H H 35 8.756 8.756 8.240 0.516 25468
157 1 . 1 1 36 36 CYS N N 36 119.831 119.831 120.172 -0.341 25468
158 1 . 1 1 36 36 CYS HA H 36 5.364 5.364 5.607 -0.243 25468
159 1 . 1 1 36 36 CYS CA C 36 57.218 57.218 58.266 -1.048 25468
160 1 . 1 1 36 36 CYS CB C 36 44.150 44.150 26.585 17.565 25468
161 1 . 1 1 36 36 CYS H H 36 8.553 8.553 8.567 -0.014 25468
162 1 . 1 1 37 37 VAL N N 37 120.392 120.392 121.637 -1.245 25468
163 1 . 1 1 37 37 VAL HA H 37 4.764 4.764 4.776 -0.012 25468
164 1 . 1 1 37 37 VAL CB C 37 36.247 36.247 35.077 1.170 25468
165 1 . 1 1 37 37 VAL H H 37 9.587 9.587 8.646 0.941 25468
166 1 . 1 1 38 38 HIS N N 38 118.311 118.311 118.118 0.193 25468
167 1 . 1 1 38 38 HIS HA H 38 5.040 5.040 5.482 -0.442 25468
168 1 . 1 1 38 38 HIS CA C 38 53.975 53.975 53.331 0.644 25468
169 1 . 1 1 38 38 HIS CB C 38 29.480 29.480 31.675 -2.195 25468
170 1 . 1 1 38 38 HIS H H 38 8.698 8.698 7.770 0.928 25468
171 1 . 1 1 39 39 ILE N N 39 124.114 124.114 121.827 2.287 25468
172 1 . 1 1 39 39 ILE HA H 39 4.302 4.302 4.209 0.093 25468
173 1 . 1 1 39 39 ILE CA C 39 59.840 59.840 60.118 -0.278 25468
174 1 . 1 1 39 39 ILE CB C 39 38.709 38.709 38.606 0.103 25468
175 1 . 1 1 39 39 ILE H H 39 8.969 8.969 8.568 0.401 25468
176 1 . 1 1 40 40 GLY N N 40 115.080 115.080 116.537 -1.457 25468
177 1 . 1 1 40 40 GLY CA C 40 46.226 46.226 46.619 -0.393 25468
178 1 . 1 1 40 40 GLY H H 40 8.715 8.715 8.875 -0.160 25468
179 1 . 1 1 41 41 GLN N N 41 121.798 121.798 119.171 2.627 25468
180 1 . 1 1 41 41 GLN HA H 41 4.304 4.304 4.283 0.021 25468
181 1 . 1 1 41 41 GLN CA C 41 55.650 55.650 55.915 -0.265 25468
182 1 . 1 1 41 41 GLN CB C 41 28.480 28.480 28.483 -0.003 25468
183 1 . 1 1 41 41 GLN H H 41 8.672 8.672 8.375 0.297 25468
184 1 . 1 1 42 42 SER N N 42 114.462 114.462 115.973 -1.511 25468
185 1 . 1 1 42 42 SER HA H 42 4.347 4.347 4.381 -0.034 25468
186 1 . 1 1 42 42 SER CA C 42 58.072 58.072 59.631 -1.559 25468
187 1 . 1 1 42 42 SER CB C 42 64.037 64.037 63.663 0.374 25468
188 1 . 1 1 42 42 SER H H 42 7.725 7.725 8.488 -0.763 25468
189 1 . 1 1 43 43 LEU N N 43 124.166 124.166 119.157 5.009 25468
190 1 . 1 1 43 43 LEU HA H 43 3.950 3.950 3.831 0.119 25468
191 1 . 1 1 43 43 LEU CA C 43 55.295 55.295 55.525 -0.230 25468
192 1 . 1 1 43 43 LEU CB C 43 41.400 41.400 40.897 0.503 25468
193 1 . 1 1 43 43 LEU H H 43 8.576 8.576 7.888 0.688 25468
194 1 . 1 1 44 44 ASP N N 44 118.797 118.797 118.969 -0.172 25468
195 1 . 1 1 44 44 ASP HA H 44 4.731 4.731 4.702 0.029 25468
196 1 . 1 1 44 44 ASP CB C 44 39.979 39.979 42.232 -2.253 25468
197 1 . 1 1 44 44 ASP H H 44 8.163 8.163 7.905 0.258 25468
198 1 . 1 1 45 45 PHE N N 45 123.595 123.595 123.517 0.078 25468
199 1 . 1 1 45 45 PHE HA H 45 4.920 4.920 5.020 -0.100 25468
200 1 . 1 1 45 45 PHE CA C 45 57.607 57.607 57.053 0.553 25468
201 1 . 1 1 45 45 PHE CB C 45 40.083 40.083 39.659 0.424 25468
202 1 . 1 1 45 45 PHE H H 45 9.042 9.042 8.810 0.232 25468
203 1 . 1 1 46 46 VAL N N 46 119.357 119.357 118.671 0.686 25468
204 1 . 1 1 46 46 VAL HA H 46 4.693 4.693 4.782 -0.089 25468
205 1 . 1 1 46 46 VAL CA C 46 59.915 59.915 59.686 0.229 25468
206 1 . 1 1 46 46 VAL CB C 46 34.666 34.666 34.349 0.317 25468
207 1 . 1 1 46 46 VAL H H 46 9.555 9.555 8.731 0.824 25468
208 1 . 1 1 47 47 CYS N N 47 122.793 122.793 125.491 -2.698 25468
209 1 . 1 1 47 47 CYS HA H 47 4.830 4.830 5.396 -0.566 25468
210 1 . 1 1 47 47 CYS CB C 47 38.730 38.730 26.736 11.994 25468
211 1 . 1 1 47 47 CYS H H 47 9.044 9.044 8.644 0.400 25468
212 1 . 1 1 48 48 VAL N N 48 129.864 129.864 128.100 1.764 25468
213 1 . 1 1 48 48 VAL HA H 48 4.533 4.533 5.002 -0.469 25468
214 1 . 1 1 48 48 VAL CA C 48 59.817 59.817 59.589 0.228 25468
215 1 . 1 1 48 48 VAL CB C 48 34.398 34.398 36.226 -1.828 25468
216 1 . 1 1 48 48 VAL H H 48 8.616 8.616 8.152 0.464 25468
217 1 . 1 1 49 49 CYS N N 49 121.329 121.329 123.775 -2.446 25468
218 1 . 1 1 49 49 CYS HA H 49 5.148 5.148 5.135 0.013 25468
219 1 . 1 1 49 49 CYS CA C 49 50.429 50.429 56.958 -6.529 25468
220 1 . 1 1 49 49 CYS CB C 49 33.873 33.873 28.764 5.109 25468
221 1 . 1 1 49 49 CYS H H 49 8.652 8.652 8.257 0.395 25468
222 1 . 1 1 50 50 PHE N N 50 119.026 119.026 120.121 -1.095 25468
223 1 . 1 1 50 50 PHE HA H 50 4.949 4.949 5.027 -0.078 25468
224 1 . 1 1 50 50 PHE CA C 50 54.652 54.652 55.155 -0.503 25468
225 1 . 1 1 50 50 PHE CB C 50 40.593 40.593 41.615 -1.022 25468
226 1 . 1 1 50 50 PHE H H 50 8.472 8.472 8.815 -0.343 25468
227 1 . 1 1 51 51 PRO HA H 51 4.732 4.732 4.328 0.404 25468
228 1 . 1 1 51 51 PRO CB C 51 33.209 33.209 32.739 0.470 25468
229 1 . 1 1 52 52 LYS N N 52 119.951 119.951 121.423 -1.472 25468
230 1 . 1 1 52 52 LYS HA H 52 3.959 3.959 4.164 -0.205 25468
231 1 . 1 1 52 52 LYS CA C 52 57.670 57.670 58.114 -0.444 25468
232 1 . 1 1 52 52 LYS CB C 52 33.225 33.225 32.627 0.598 25468
233 1 . 1 1 52 52 LYS H H 52 8.681 8.681 8.576 0.105 25468
234 1 . 1 1 53 53 TYR N N 53 118.889 118.889 115.737 3.152 25468
235 1 . 1 1 53 53 TYR HA H 53 4.471 4.471 4.671 -0.200 25468
236 1 . 1 1 53 53 TYR CA C 53 58.049 58.049 56.303 1.746 25468
237 1 . 1 1 53 53 TYR CB C 53 38.268 38.268 37.987 0.281 25468
238 1 . 1 1 53 53 TYR H H 53 8.215 8.215 7.785 0.430 25468
239 1 . 1 1 54 54 TYR N N 54 121.087 121.087 122.729 -1.642 25468
240 1 . 1 1 54 54 TYR HA H 54 4.494 4.494 4.477 0.017 25468
241 1 . 1 1 54 54 TYR CA C 54 58.101 58.101 58.349 -0.248 25468
242 1 . 1 1 54 54 TYR CB C 54 39.611 39.611 38.326 1.285 25468
243 1 . 1 1 54 54 TYR H H 54 7.919 7.919 7.721 0.198 25468
stop_
save_