data_18463
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18463
_Entry.PDB_ID 2LT8
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 18463
_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 PHE HA H 2 3.971 3.971 4.171 -0.200 18463
2 1 1 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.453 0.589 18463
3 1 1 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.354 0.966 18463
4 1 1 . 1 1 2 2 PHE H H 2 8.600 8.600 8.371 0.229 18463
5 1 1 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.190 -0.317 18463
6 1 1 . 1 1 3 3 GLY H H 3 8.004 8.004 8.407 -0.403 18463
7 1 1 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.203 -0.430 18463
8 1 1 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.752 9.035 18463
9 1 1 . 1 1 4 4 CYS H H 4 7.575 7.575 7.775 -0.200 18463
10 1 1 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.431 0.258 18463
11 1 1 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.788 -0.679 18463
12 1 1 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.446 2.937 18463
13 1 1 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.897 1.697 18463
14 1 1 . 1 1 6 6 GLY H H 6 8.907 8.907 8.427 0.480 18463
15 1 1 . 1 1 7 7 ASP HA H 7 5.007 5.007 5.010 -0.003 18463
16 1 1 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.675 -0.199 18463
17 1 1 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.478 -2.213 18463
18 1 1 . 1 1 7 7 ASP H H 7 8.466 8.466 8.292 0.174 18463
19 1 1 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.348 -0.351 18463
20 1 1 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.178 -0.279 18463
21 1 1 . 1 1 8 8 ALA H H 8 8.560 8.560 8.785 -0.225 18463
22 1 1 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.058 0.252 18463
23 1 1 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.730 -1.251 18463
24 1 1 . 1 1 9 9 TYR H H 9 8.432 8.432 8.863 -0.431 18463
25 1 1 . 1 1 10 10 GLN HA H 10 3.944 3.944 3.871 0.073 18463
26 1 1 . 1 1 10 10 GLN CA C 10 58.635 58.635 59.033 -0.399 18463
27 1 1 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.412 -0.053 18463
28 1 1 . 1 1 10 10 GLN H H 10 7.861 7.861 8.782 -0.921 18463
29 1 1 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.258 0.629 18463
30 1 1 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.648 -3.090 18463
31 1 1 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.399 10.475 18463
32 1 1 . 1 1 11 11 CYS H H 11 7.341 7.341 7.963 -0.622 18463
33 1 1 . 1 1 12 12 SER N N 12 117.382 117.382 116.569 0.813 18463
34 1 1 . 1 1 12 12 SER HA H 12 3.692 3.692 3.910 -0.218 18463
35 1 1 . 1 1 12 12 SER CB C 12 62.945 62.945 62.666 0.279 18463
36 1 1 . 1 1 12 12 SER H H 12 8.513 8.513 8.190 0.323 18463
37 1 1 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.732 0.098 18463
38 1 1 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.407 -0.307 18463
39 1 1 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.475 -0.175 18463
40 1 1 . 1 1 13 13 GLU H H 13 8.199 8.199 8.038 0.161 18463
41 1 1 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.116 0.151 18463
42 1 1 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.321 -0.686 18463
43 1 1 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.337 -2.262 18463
44 1 1 . 1 1 14 14 HIS H H 14 8.250 8.250 8.099 0.151 18463
45 1 1 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.705 0.039 18463
46 1 1 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.514 -2.607 18463
47 1 1 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.619 13.740 18463
48 1 1 . 1 1 15 15 CYS H H 15 8.419 8.419 7.821 0.598 18463
49 1 1 . 1 1 16 16 ARG HA H 16 3.595 3.595 4.033 -0.438 18463
50 1 1 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.873 1.316 18463
51 1 1 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.880 0.428 18463
52 1 1 . 1 1 16 16 ARG H H 16 8.081 8.081 8.234 -0.153 18463
53 1 1 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.092 -0.013 18463
54 1 1 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.372 -0.212 18463
55 1 1 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.212 -0.440 18463
56 1 1 . 1 1 17 17 ALA H H 17 7.763 7.763 7.850 -0.087 18463
57 1 1 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.005 0.002 18463
58 1 1 . 1 1 18 18 LEU CB C 18 42.373 42.373 41.979 0.394 18463
59 1 1 . 1 1 18 18 LEU H H 18 7.265 7.265 6.992 0.273 18463
60 1 1 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.323 0.751 18463
61 1 1 . 1 1 20 20 GLY H H 20 9.107 9.107 8.714 0.393 18463
62 1 1 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.816 -0.285 18463
63 1 1 . 1 1 21 21 GLY H H 21 8.671 8.671 8.094 0.577 18463
64 1 1 . 1 1 22 22 ARG N N 22 119.872 119.872 121.742 -1.870 18463
65 1 1 . 1 1 22 22 ARG HA H 22 3.993 3.993 3.881 0.112 18463
66 1 1 . 1 1 22 22 ARG CA C 22 56.615 56.615 56.009 0.606 18463
67 1 1 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.726 0.998 18463
68 1 1 . 1 1 22 22 ARG H H 22 6.965 6.965 7.539 -0.574 18463
69 1 1 . 1 1 23 23 THR HA H 23 4.277 4.277 4.337 -0.060 18463
70 1 1 . 1 1 23 23 THR CB C 23 70.344 70.344 69.682 0.662 18463
71 1 1 . 1 1 23 23 THR H H 23 8.837 8.837 8.128 0.709 18463
72 1 1 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.198 -0.041 18463
73 1 1 . 1 1 24 24 GLY H H 24 7.354 7.354 7.284 0.070 18463
74 1 1 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.116 1.685 18463
75 1 1 . 1 1 25 25 GLY H H 25 8.054 8.054 7.666 0.388 18463
76 1 1 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.947 -0.173 18463
77 1 1 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.390 -2.669 18463
78 1 1 . 1 1 26 26 TYR H H 26 8.932 8.932 8.929 0.003 18463
79 1 1 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.514 -0.326 18463
80 1 1 . 1 1 27 27 CYS CA C 27 52.852 52.852 58.127 -5.275 18463
81 1 1 . 1 1 27 27 CYS CB C 27 37.300 37.300 28.175 9.125 18463
82 1 1 . 1 1 27 27 CYS H H 27 8.753 8.753 8.795 -0.042 18463
83 1 1 . 1 1 28 28 ALA HA H 28 4.654 4.654 5.001 -0.347 18463
84 1 1 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.518 0.085 18463
85 1 1 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.161 -1.403 18463
86 1 1 . 1 1 28 28 ALA H H 28 9.122 9.122 9.061 0.061 18463
87 1 1 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.262 0.446 18463
88 1 1 . 1 1 29 29 GLY H H 29 8.548 8.548 8.284 0.264 18463
89 1 1 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.017 0.331 18463
90 1 1 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.033 -0.193 18463
91 1 1 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.447 0.353 18463
92 1 1 . 1 1 31 31 TRP CB C 31 27.706 27.706 28.965 -1.258 18463
93 1 1 . 1 1 31 31 TRP H H 31 9.002 9.002 8.000 1.002 18463
94 1 1 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.770 -0.888 18463
95 1 1 . 1 1 32 32 TYR CA C 32 58.010 58.010 55.303 2.707 18463
96 1 1 . 1 1 32 32 TYR CB C 32 35.410 35.410 40.036 -4.626 18463
97 1 1 . 1 1 32 32 TYR H H 32 6.367 6.367 6.722 -0.355 18463
98 1 1 . 1 1 33 33 LEU HA H 33 4.450 4.450 4.009 0.441 18463
99 1 1 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.149 -1.461 18463
100 1 1 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.018 0.760 18463
101 1 1 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.398 0.413 18463
102 1 1 . 1 1 34 34 GLY H H 34 7.632 7.632 8.328 -0.696 18463
103 1 1 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.983 -1.278 18463
104 1 1 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.735 -3.971 18463
105 1 1 . 1 1 35 35 HIS H H 35 7.334 7.334 8.448 -1.114 18463
106 1 1 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.594 -0.720 18463
107 1 1 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.486 0.586 18463
108 1 1 . 1 1 37 37 THR HA H 37 4.356 4.356 4.454 -0.098 18463
109 1 1 . 1 1 37 37 THR CB C 37 69.525 69.525 69.286 0.239 18463
110 1 1 . 1 1 37 37 THR H H 37 8.185 8.185 8.214 -0.029 18463
111 1 1 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.919 0.107 18463
112 1 1 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.792 -1.742 18463
113 1 1 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.245 6.676 18463
114 1 1 . 1 1 38 38 CYS H H 38 9.046 9.046 9.161 -0.115 18463
115 1 1 . 1 1 39 39 THR HA H 39 4.277 4.277 4.634 -0.357 18463
116 1 1 . 1 1 39 39 THR CB C 39 70.474 70.474 70.424 0.050 18463
117 1 1 . 1 1 39 39 THR H H 39 9.272 9.272 9.048 0.224 18463
118 1 1 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.464 1.003 18463
119 1 1 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.701 -5.636 18463
120 1 1 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.888 6.198 18463
121 1 1 . 1 1 40 40 CYS H H 40 8.658 8.658 8.804 -0.146 18463
122 1 1 . 1 1 41 41 SER HA H 41 4.771 4.771 4.975 -0.204 18463
123 1 1 . 1 1 41 41 SER CB C 41 66.158 66.158 64.498 1.660 18463
124 1 1 . 1 1 41 41 SER H H 41 8.680 8.680 8.503 0.177 18463
125 1 2 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.241 -0.270 18463
126 1 2 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.679 0.363 18463
127 1 2 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.705 0.615 18463
128 1 2 . 1 1 2 2 PHE H H 2 8.600 8.600 8.465 0.135 18463
129 1 2 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.158 -0.285 18463
130 1 2 . 1 1 3 3 GLY H H 3 8.004 8.004 8.365 -0.361 18463
131 1 2 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.196 -0.423 18463
132 1 2 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.460 9.327 18463
133 1 2 . 1 1 4 4 CYS H H 4 7.575 7.575 7.707 -0.132 18463
134 1 2 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.469 0.220 18463
135 1 2 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.633 -0.524 18463
136 1 2 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.551 2.832 18463
137 1 2 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.829 1.765 18463
138 1 2 . 1 1 6 6 GLY H H 6 8.907 8.907 8.462 0.445 18463
139 1 2 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.995 0.012 18463
140 1 2 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.601 -0.125 18463
141 1 2 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.565 -2.300 18463
142 1 2 . 1 1 7 7 ASP H H 7 8.466 8.466 8.296 0.170 18463
143 1 2 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.408 -0.411 18463
144 1 2 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.308 -0.409 18463
145 1 2 . 1 1 8 8 ALA H H 8 8.560 8.560 8.735 -0.175 18463
146 1 2 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.049 0.261 18463
147 1 2 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.828 -1.349 18463
148 1 2 . 1 1 9 9 TYR H H 9 8.432 8.432 8.772 -0.340 18463
149 1 2 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.258 -0.314 18463
150 1 2 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.946 -0.311 18463
151 1 2 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.499 -0.140 18463
152 1 2 . 1 1 10 10 GLN H H 10 7.861 7.861 9.069 -1.208 18463
153 1 2 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.309 0.578 18463
154 1 2 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.500 -2.942 18463
155 1 2 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.411 10.463 18463
156 1 2 . 1 1 11 11 CYS H H 11 7.341 7.341 8.256 -0.915 18463
157 1 2 . 1 1 12 12 SER N N 12 117.382 117.382 116.685 0.697 18463
158 1 2 . 1 1 12 12 SER HA H 12 3.692 3.692 3.931 -0.239 18463
159 1 2 . 1 1 12 12 SER CB C 12 62.945 62.945 62.670 0.274 18463
160 1 2 . 1 1 12 12 SER H H 12 8.513 8.513 8.286 0.227 18463
161 1 2 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.727 0.103 18463
162 1 2 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.383 -0.283 18463
163 1 2 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.476 -0.176 18463
164 1 2 . 1 1 13 13 GLU H H 13 8.199 8.199 8.048 0.151 18463
165 1 2 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.023 0.244 18463
166 1 2 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.161 -0.526 18463
167 1 2 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.174 -2.099 18463
168 1 2 . 1 1 14 14 HIS H H 14 8.250 8.250 8.007 0.243 18463
169 1 2 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.748 -0.004 18463
170 1 2 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.628 -2.720 18463
171 1 2 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.657 13.702 18463
172 1 2 . 1 1 15 15 CYS H H 15 8.419 8.419 7.869 0.550 18463
173 1 2 . 1 1 16 16 ARG HA H 16 3.595 3.595 4.043 -0.448 18463
174 1 2 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.862 1.327 18463
175 1 2 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.881 0.426 18463
176 1 2 . 1 1 16 16 ARG H H 16 8.081 8.081 8.321 -0.240 18463
177 1 2 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.099 -0.020 18463
178 1 2 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.392 -0.232 18463
179 1 2 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.223 -0.451 18463
180 1 2 . 1 1 17 17 ALA H H 17 7.763 7.763 7.781 -0.018 18463
181 1 2 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.007 0.000 18463
182 1 2 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.065 0.308 18463
183 1 2 . 1 1 18 18 LEU H H 18 7.265 7.265 7.094 0.171 18463
184 1 2 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.345 0.729 18463
185 1 2 . 1 1 20 20 GLY H H 20 9.107 9.107 8.692 0.415 18463
186 1 2 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.767 -0.236 18463
187 1 2 . 1 1 21 21 GLY H H 21 8.671 8.671 8.119 0.552 18463
188 1 2 . 1 1 22 22 ARG N N 22 119.872 119.872 121.790 -1.918 18463
189 1 2 . 1 1 22 22 ARG HA H 22 3.993 3.993 3.892 0.101 18463
190 1 2 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.795 0.820 18463
191 1 2 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.698 1.026 18463
192 1 2 . 1 1 22 22 ARG H H 22 6.965 6.965 7.460 -0.495 18463
193 1 2 . 1 1 23 23 THR HA H 23 4.277 4.277 4.292 -0.015 18463
194 1 2 . 1 1 23 23 THR CB C 23 70.344 70.344 69.673 0.671 18463
195 1 2 . 1 1 23 23 THR H H 23 8.837 8.837 8.243 0.594 18463
196 1 2 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.181 -0.024 18463
197 1 2 . 1 1 24 24 GLY H H 24 7.354 7.354 7.188 0.166 18463
198 1 2 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.096 1.704 18463
199 1 2 . 1 1 25 25 GLY H H 25 8.054 8.054 7.747 0.307 18463
200 1 2 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.952 -0.178 18463
201 1 2 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.143 -2.422 18463
202 1 2 . 1 1 26 26 TYR H H 26 8.932 8.932 8.973 -0.041 18463
203 1 2 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.645 -0.457 18463
204 1 2 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.837 -4.985 18463
205 1 2 . 1 1 27 27 CYS CB C 27 37.300 37.300 29.275 8.025 18463
206 1 2 . 1 1 27 27 CYS H H 27 8.753 8.753 8.663 0.090 18463
207 1 2 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.795 -0.141 18463
208 1 2 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.324 0.279 18463
209 1 2 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.117 -1.359 18463
210 1 2 . 1 1 28 28 ALA H H 28 9.122 9.122 9.149 -0.027 18463
211 1 2 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.431 0.277 18463
212 1 2 . 1 1 29 29 GLY H H 29 8.548 8.548 8.348 0.200 18463
213 1 2 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.140 0.208 18463
214 1 2 . 1 1 30 30 PRO CB C 30 31.840 31.840 31.978 -0.138 18463
215 1 2 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.360 0.440 18463
216 1 2 . 1 1 31 31 TRP CB C 31 27.706 27.706 28.763 -1.057 18463
217 1 2 . 1 1 31 31 TRP H H 31 9.002 9.002 8.124 0.878 18463
218 1 2 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.762 -0.880 18463
219 1 2 . 1 1 32 32 TYR CA C 32 58.010 58.010 55.276 2.734 18463
220 1 2 . 1 1 32 32 TYR CB C 32 35.410 35.410 40.019 -4.609 18463
221 1 2 . 1 1 32 32 TYR H H 32 6.367 6.367 6.773 -0.406 18463
222 1 2 . 1 1 33 33 LEU HA H 33 4.450 4.450 4.017 0.433 18463
223 1 2 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.140 -1.452 18463
224 1 2 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.087 0.692 18463
225 1 2 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.306 0.505 18463
226 1 2 . 1 1 34 34 GLY H H 34 7.632 7.632 8.335 -0.703 18463
227 1 2 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.978 -1.273 18463
228 1 2 . 1 1 35 35 HIS CB C 35 25.764 25.764 30.014 -4.250 18463
229 1 2 . 1 1 35 35 HIS H H 35 7.334 7.334 8.364 -1.030 18463
230 1 2 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.566 -0.692 18463
231 1 2 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.582 0.490 18463
232 1 2 . 1 1 37 37 THR HA H 37 4.356 4.356 4.447 -0.091 18463
233 1 2 . 1 1 37 37 THR CB C 37 69.525 69.525 69.290 0.235 18463
234 1 2 . 1 1 37 37 THR H H 37 8.185 8.185 8.255 -0.070 18463
235 1 2 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.877 0.149 18463
236 1 2 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.960 -1.910 18463
237 1 2 . 1 1 38 38 CYS CB C 38 34.921 34.921 27.610 7.311 18463
238 1 2 . 1 1 38 38 CYS H H 38 9.046 9.046 9.136 -0.090 18463
239 1 2 . 1 1 39 39 THR HA H 39 4.277 4.277 4.698 -0.421 18463
240 1 2 . 1 1 39 39 THR CB C 39 70.474 70.474 71.450 -0.976 18463
241 1 2 . 1 1 39 39 THR H H 39 9.272 9.272 9.224 0.048 18463
242 1 2 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.609 0.858 18463
243 1 2 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.902 -5.837 18463
244 1 2 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.725 6.361 18463
245 1 2 . 1 1 40 40 CYS H H 40 8.658 8.658 8.926 -0.268 18463
246 1 2 . 1 1 41 41 SER HA H 41 4.771 4.771 4.988 -0.217 18463
247 1 2 . 1 1 41 41 SER CB C 41 66.158 66.158 64.333 1.825 18463
248 1 2 . 1 1 41 41 SER H H 41 8.680 8.680 8.502 0.178 18463
249 1 3 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.013 -0.042 18463
250 1 3 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.044 0.998 18463
251 1 3 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.412 0.908 18463
252 1 3 . 1 1 2 2 PHE H H 2 8.600 8.600 8.093 0.507 18463
253 1 3 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.169 -0.296 18463
254 1 3 . 1 1 3 3 GLY H H 3 8.004 8.004 8.277 -0.273 18463
255 1 3 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.071 -0.298 18463
256 1 3 . 1 1 4 4 CYS CB C 4 37.787 37.787 27.898 9.889 18463
257 1 3 . 1 1 4 4 CYS H H 4 7.575 7.575 7.724 -0.149 18463
258 1 3 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.397 0.292 18463
259 1 3 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.950 -0.841 18463
260 1 3 . 1 1 5 5 PRO CB C 5 35.383 35.383 31.508 3.875 18463
261 1 3 . 1 1 6 6 GLY CA C 6 46.594 46.594 45.377 1.217 18463
262 1 3 . 1 1 6 6 GLY H H 6 8.907 8.907 8.260 0.647 18463
263 1 3 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.953 0.054 18463
264 1 3 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.561 -0.085 18463
265 1 3 . 1 1 7 7 ASP CB C 7 40.265 40.265 40.221 0.043 18463
266 1 3 . 1 1 7 7 ASP H H 7 8.466 8.466 8.071 0.395 18463
267 1 3 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.171 -0.174 18463
268 1 3 . 1 1 8 8 ALA CB C 8 18.899 18.899 18.981 -0.082 18463
269 1 3 . 1 1 8 8 ALA H H 8 8.560 8.560 8.151 0.409 18463
270 1 3 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.075 0.235 18463
271 1 3 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.556 -1.077 18463
272 1 3 . 1 1 9 9 TYR H H 9 8.432 8.432 8.157 0.275 18463
273 1 3 . 1 1 10 10 GLN HA H 10 3.944 3.944 3.869 0.075 18463
274 1 3 . 1 1 10 10 GLN CA C 10 58.635 58.635 59.051 -0.416 18463
275 1 3 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.514 -0.155 18463
276 1 3 . 1 1 10 10 GLN H H 10 7.861 7.861 8.741 -0.880 18463
277 1 3 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.263 0.624 18463
278 1 3 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.835 -3.277 18463
279 1 3 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.420 10.454 18463
280 1 3 . 1 1 11 11 CYS H H 11 7.341 7.341 7.845 -0.504 18463
281 1 3 . 1 1 12 12 SER N N 12 117.382 117.382 116.561 0.821 18463
282 1 3 . 1 1 12 12 SER HA H 12 3.692 3.692 3.929 -0.237 18463
283 1 3 . 1 1 12 12 SER CB C 12 62.945 62.945 62.664 0.281 18463
284 1 3 . 1 1 12 12 SER H H 12 8.513 8.513 8.075 0.438 18463
285 1 3 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.725 0.105 18463
286 1 3 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.308 -0.208 18463
287 1 3 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.439 -0.140 18463
288 1 3 . 1 1 13 13 GLU H H 13 8.199 8.199 8.008 0.191 18463
289 1 3 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.152 0.115 18463
290 1 3 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.396 -0.761 18463
291 1 3 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.477 -2.402 18463
292 1 3 . 1 1 14 14 HIS H H 14 8.250 8.250 8.251 -0.001 18463
293 1 3 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.670 0.074 18463
294 1 3 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.569 -2.661 18463
295 1 3 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.624 13.735 18463
296 1 3 . 1 1 15 15 CYS H H 15 8.419 8.419 7.919 0.500 18463
297 1 3 . 1 1 16 16 ARG HA H 16 3.595 3.595 3.865 -0.270 18463
298 1 3 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.905 1.284 18463
299 1 3 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.844 0.464 18463
300 1 3 . 1 1 16 16 ARG H H 16 8.081 8.081 8.229 -0.148 18463
301 1 3 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.101 -0.022 18463
302 1 3 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.310 -0.150 18463
303 1 3 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.243 -0.471 18463
304 1 3 . 1 1 17 17 ALA H H 17 7.763 7.763 7.872 -0.109 18463
305 1 3 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.022 -0.015 18463
306 1 3 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.020 0.353 18463
307 1 3 . 1 1 18 18 LEU H H 18 7.265 7.265 7.111 0.154 18463
308 1 3 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.310 0.764 18463
309 1 3 . 1 1 20 20 GLY H H 20 9.107 9.107 8.716 0.391 18463
310 1 3 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.773 -0.242 18463
311 1 3 . 1 1 21 21 GLY H H 21 8.671 8.671 8.072 0.599 18463
312 1 3 . 1 1 22 22 ARG N N 22 119.872 119.872 121.755 -1.883 18463
313 1 3 . 1 1 22 22 ARG HA H 22 3.993 3.993 3.782 0.211 18463
314 1 3 . 1 1 22 22 ARG CA C 22 56.615 56.615 56.081 0.534 18463
315 1 3 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.706 1.018 18463
316 1 3 . 1 1 22 22 ARG H H 22 6.965 6.965 7.551 -0.586 18463
317 1 3 . 1 1 23 23 THR HA H 23 4.277 4.277 4.277 -0.000 18463
318 1 3 . 1 1 23 23 THR CB C 23 70.344 70.344 69.594 0.750 18463
319 1 3 . 1 1 23 23 THR H H 23 8.837 8.837 8.149 0.688 18463
320 1 3 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.199 -0.042 18463
321 1 3 . 1 1 24 24 GLY H H 24 7.354 7.354 7.290 0.064 18463
322 1 3 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.099 1.702 18463
323 1 3 . 1 1 25 25 GLY H H 25 8.054 8.054 7.699 0.355 18463
324 1 3 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.965 -0.191 18463
325 1 3 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.515 -2.794 18463
326 1 3 . 1 1 26 26 TYR H H 26 8.932 8.932 8.967 -0.035 18463
327 1 3 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.608 -0.420 18463
328 1 3 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.958 -5.106 18463
329 1 3 . 1 1 27 27 CYS CB C 27 37.300 37.300 28.664 8.636 18463
330 1 3 . 1 1 27 27 CYS H H 27 8.753 8.753 8.723 0.030 18463
331 1 3 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.915 -0.261 18463
332 1 3 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.465 0.139 18463
333 1 3 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.050 -1.292 18463
334 1 3 . 1 1 28 28 ALA H H 28 9.122 9.122 9.133 -0.011 18463
335 1 3 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.430 0.278 18463
336 1 3 . 1 1 29 29 GLY H H 29 8.548 8.548 8.308 0.240 18463
337 1 3 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.061 0.287 18463
338 1 3 . 1 1 30 30 PRO CB C 30 31.840 31.840 31.791 0.049 18463
339 1 3 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.439 0.361 18463
340 1 3 . 1 1 31 31 TRP CB C 31 27.706 27.706 28.887 -1.181 18463
341 1 3 . 1 1 31 31 TRP H H 31 9.002 9.002 7.704 1.298 18463
342 1 3 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.707 -0.825 18463
343 1 3 . 1 1 32 32 TYR CA C 32 58.010 58.010 56.170 1.840 18463
344 1 3 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.374 -3.964 18463
345 1 3 . 1 1 32 32 TYR H H 32 6.367 6.367 7.040 -0.673 18463
346 1 3 . 1 1 33 33 LEU HA H 33 4.450 4.450 3.997 0.453 18463
347 1 3 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.072 -1.384 18463
348 1 3 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.135 0.643 18463
349 1 3 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.418 0.392 18463
350 1 3 . 1 1 34 34 GLY H H 34 7.632 7.632 8.355 -0.723 18463
351 1 3 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.957 -1.252 18463
352 1 3 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.821 -4.057 18463
353 1 3 . 1 1 35 35 HIS H H 35 7.334 7.334 8.267 -0.933 18463
354 1 3 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.356 -0.482 18463
355 1 3 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.712 0.360 18463
356 1 3 . 1 1 37 37 THR HA H 37 4.356 4.356 4.511 -0.155 18463
357 1 3 . 1 1 37 37 THR CB C 37 69.525 69.525 69.410 0.115 18463
358 1 3 . 1 1 37 37 THR H H 37 8.185 8.185 8.307 -0.122 18463
359 1 3 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.948 0.078 18463
360 1 3 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.852 -1.802 18463
361 1 3 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.236 6.685 18463
362 1 3 . 1 1 38 38 CYS H H 38 9.046 9.046 9.185 -0.139 18463
363 1 3 . 1 1 39 39 THR HA H 39 4.277 4.277 4.636 -0.359 18463
364 1 3 . 1 1 39 39 THR CB C 39 70.474 70.474 70.522 -0.049 18463
365 1 3 . 1 1 39 39 THR H H 39 9.272 9.272 9.077 0.195 18463
366 1 3 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.561 0.906 18463
367 1 3 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.735 -5.670 18463
368 1 3 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.705 6.381 18463
369 1 3 . 1 1 40 40 CYS H H 40 8.658 8.658 8.777 -0.119 18463
370 1 3 . 1 1 41 41 SER HA H 41 4.771 4.771 4.968 -0.197 18463
371 1 3 . 1 1 41 41 SER CB C 41 66.158 66.158 64.354 1.804 18463
372 1 3 . 1 1 41 41 SER H H 41 8.680 8.680 8.438 0.242 18463
373 1 4 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.205 -0.234 18463
374 1 4 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.424 0.618 18463
375 1 4 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.272 1.048 18463
376 1 4 . 1 1 2 2 PHE H H 2 8.600 8.600 8.389 0.211 18463
377 1 4 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.191 -0.317 18463
378 1 4 . 1 1 3 3 GLY H H 3 8.004 8.004 8.388 -0.384 18463
379 1 4 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.196 -0.423 18463
380 1 4 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.586 9.201 18463
381 1 4 . 1 1 4 4 CYS H H 4 7.575 7.575 7.750 -0.175 18463
382 1 4 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.456 0.233 18463
383 1 4 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.705 -0.596 18463
384 1 4 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.519 2.864 18463
385 1 4 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.846 1.748 18463
386 1 4 . 1 1 6 6 GLY H H 6 8.907 8.907 8.457 0.450 18463
387 1 4 . 1 1 7 7 ASP HA H 7 5.007 5.007 5.006 0.001 18463
388 1 4 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.589 -0.112 18463
389 1 4 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.394 -2.129 18463
390 1 4 . 1 1 7 7 ASP H H 7 8.466 8.466 8.278 0.188 18463
391 1 4 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.387 -0.390 18463
392 1 4 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.221 -0.322 18463
393 1 4 . 1 1 8 8 ALA H H 8 8.560 8.560 8.785 -0.225 18463
394 1 4 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.030 0.280 18463
395 1 4 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.830 -1.351 18463
396 1 4 . 1 1 9 9 TYR H H 9 8.432 8.432 8.875 -0.443 18463
397 1 4 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.190 -0.246 18463
398 1 4 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.989 -0.354 18463
399 1 4 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.474 -0.115 18463
400 1 4 . 1 1 10 10 GLN H H 10 7.861 7.861 8.979 -1.118 18463
401 1 4 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.300 0.587 18463
402 1 4 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.691 -3.133 18463
403 1 4 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.395 10.479 18463
404 1 4 . 1 1 11 11 CYS H H 11 7.341 7.341 8.134 -0.793 18463
405 1 4 . 1 1 12 12 SER N N 12 117.382 117.382 116.602 0.780 18463
406 1 4 . 1 1 12 12 SER HA H 12 3.692 3.692 3.914 -0.222 18463
407 1 4 . 1 1 12 12 SER CB C 12 62.945 62.945 62.659 0.286 18463
408 1 4 . 1 1 12 12 SER H H 12 8.513 8.513 8.252 0.261 18463
409 1 4 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.739 0.091 18463
410 1 4 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.369 -0.269 18463
411 1 4 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.508 -0.208 18463
412 1 4 . 1 1 13 13 GLU H H 13 8.199 8.199 8.067 0.132 18463
413 1 4 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.131 0.136 18463
414 1 4 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.315 -0.680 18463
415 1 4 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.305 -2.230 18463
416 1 4 . 1 1 14 14 HIS H H 14 8.250 8.250 8.180 0.070 18463
417 1 4 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.582 0.162 18463
418 1 4 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.481 -2.573 18463
419 1 4 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.567 13.792 18463
420 1 4 . 1 1 15 15 CYS H H 15 8.419 8.419 7.863 0.556 18463
421 1 4 . 1 1 16 16 ARG HA H 16 3.595 3.595 4.039 -0.444 18463
422 1 4 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.825 1.364 18463
423 1 4 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.884 0.424 18463
424 1 4 . 1 1 16 16 ARG H H 16 8.081 8.081 8.305 -0.224 18463
425 1 4 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.096 -0.017 18463
426 1 4 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.364 -0.204 18463
427 1 4 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.219 -0.447 18463
428 1 4 . 1 1 17 17 ALA H H 17 7.763 7.763 7.876 -0.113 18463
429 1 4 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.027 -0.020 18463
430 1 4 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.044 0.329 18463
431 1 4 . 1 1 18 18 LEU H H 18 7.265 7.265 7.045 0.220 18463
432 1 4 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.377 0.697 18463
433 1 4 . 1 1 20 20 GLY H H 20 9.107 9.107 8.702 0.405 18463
434 1 4 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.798 -0.267 18463
435 1 4 . 1 1 21 21 GLY H H 21 8.671 8.671 8.104 0.567 18463
436 1 4 . 1 1 22 22 ARG N N 22 119.872 119.872 121.551 -1.679 18463
437 1 4 . 1 1 22 22 ARG HA H 22 3.993 3.993 3.875 0.118 18463
438 1 4 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.975 0.640 18463
439 1 4 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.804 0.920 18463
440 1 4 . 1 1 22 22 ARG H H 22 6.965 6.965 7.541 -0.576 18463
441 1 4 . 1 1 23 23 THR HA H 23 4.277 4.277 4.395 -0.118 18463
442 1 4 . 1 1 23 23 THR CB C 23 70.344 70.344 69.859 0.485 18463
443 1 4 . 1 1 23 23 THR H H 23 8.837 8.837 8.263 0.574 18463
444 1 4 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.170 -0.013 18463
445 1 4 . 1 1 24 24 GLY H H 24 7.354 7.354 7.236 0.118 18463
446 1 4 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.112 1.689 18463
447 1 4 . 1 1 25 25 GLY H H 25 8.054 8.054 7.678 0.376 18463
448 1 4 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.945 -0.171 18463
449 1 4 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.399 -2.678 18463
450 1 4 . 1 1 26 26 TYR H H 26 8.932 8.932 8.956 -0.024 18463
451 1 4 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.593 -0.405 18463
452 1 4 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.958 -5.106 18463
453 1 4 . 1 1 27 27 CYS CB C 27 37.300 37.300 28.779 8.521 18463
454 1 4 . 1 1 27 27 CYS H H 27 8.753 8.753 8.757 -0.004 18463
455 1 4 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.905 -0.251 18463
456 1 4 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.518 0.085 18463
457 1 4 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.089 -1.331 18463
458 1 4 . 1 1 28 28 ALA H H 28 9.122 9.122 9.156 -0.034 18463
459 1 4 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.401 0.307 18463
460 1 4 . 1 1 29 29 GLY H H 29 8.548 8.548 8.317 0.231 18463
461 1 4 . 1 1 30 30 PRO HA H 30 4.348 4.348 3.963 0.385 18463
462 1 4 . 1 1 30 30 PRO CB C 30 31.840 31.840 31.995 -0.155 18463
463 1 4 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.522 0.278 18463
464 1 4 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.081 -1.375 18463
465 1 4 . 1 1 31 31 TRP H H 31 9.002 9.002 7.563 1.439 18463
466 1 4 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.691 -0.809 18463
467 1 4 . 1 1 32 32 TYR CA C 32 58.010 58.010 56.166 1.845 18463
468 1 4 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.330 -3.920 18463
469 1 4 . 1 1 32 32 TYR H H 32 6.367 6.367 7.019 -0.652 18463
470 1 4 . 1 1 33 33 LEU HA H 33 4.450 4.450 3.996 0.454 18463
471 1 4 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.122 -1.434 18463
472 1 4 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.057 0.721 18463
473 1 4 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.407 0.403 18463
474 1 4 . 1 1 34 34 GLY H H 34 7.632 7.632 8.331 -0.699 18463
475 1 4 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.964 -1.259 18463
476 1 4 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.889 -4.125 18463
477 1 4 . 1 1 35 35 HIS H H 35 7.334 7.334 8.338 -1.004 18463
478 1 4 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.530 -0.656 18463
479 1 4 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.593 0.478 18463
480 1 4 . 1 1 37 37 THR HA H 37 4.356 4.356 4.485 -0.129 18463
481 1 4 . 1 1 37 37 THR CB C 37 69.525 69.525 69.280 0.245 18463
482 1 4 . 1 1 37 37 THR H H 37 8.185 8.185 8.256 -0.071 18463
483 1 4 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.895 0.131 18463
484 1 4 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.837 -1.787 18463
485 1 4 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.332 6.589 18463
486 1 4 . 1 1 38 38 CYS H H 38 9.046 9.046 9.163 -0.117 18463
487 1 4 . 1 1 39 39 THR HA H 39 4.277 4.277 4.645 -0.368 18463
488 1 4 . 1 1 39 39 THR CB C 39 70.474 70.474 70.431 0.043 18463
489 1 4 . 1 1 39 39 THR H H 39 9.272 9.272 9.089 0.183 18463
490 1 4 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.554 0.913 18463
491 1 4 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.673 -5.608 18463
492 1 4 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.854 6.232 18463
493 1 4 . 1 1 40 40 CYS H H 40 8.658 8.658 8.811 -0.153 18463
494 1 4 . 1 1 41 41 SER HA H 41 4.771 4.771 4.990 -0.219 18463
495 1 4 . 1 1 41 41 SER CB C 41 66.158 66.158 64.432 1.726 18463
496 1 4 . 1 1 41 41 SER H H 41 8.680 8.680 8.523 0.157 18463
497 1 5 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.084 -0.113 18463
498 1 5 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.026 1.016 18463
499 1 5 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.232 1.088 18463
500 1 5 . 1 1 2 2 PHE H H 2 8.600 8.600 8.120 0.480 18463
501 1 5 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.313 -0.440 18463
502 1 5 . 1 1 3 3 GLY H H 3 8.004 8.004 8.312 -0.308 18463
503 1 5 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.217 -0.444 18463
504 1 5 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.803 8.984 18463
505 1 5 . 1 1 4 4 CYS H H 4 7.575 7.575 7.804 -0.229 18463
506 1 5 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.458 0.231 18463
507 1 5 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.723 -0.614 18463
508 1 5 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.536 2.847 18463
509 1 5 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.928 1.666 18463
510 1 5 . 1 1 6 6 GLY H H 6 8.907 8.907 8.441 0.466 18463
511 1 5 . 1 1 7 7 ASP HA H 7 5.007 5.007 5.027 -0.020 18463
512 1 5 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.634 -0.158 18463
513 1 5 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.437 -2.171 18463
514 1 5 . 1 1 7 7 ASP H H 7 8.466 8.466 8.329 0.137 18463
515 1 5 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.281 -0.284 18463
516 1 5 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.077 -0.178 18463
517 1 5 . 1 1 8 8 ALA H H 8 8.560 8.560 8.832 -0.272 18463
518 1 5 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.065 0.245 18463
519 1 5 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.686 -1.207 18463
520 1 5 . 1 1 9 9 TYR H H 9 8.432 8.432 8.786 -0.354 18463
521 1 5 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.011 -0.067 18463
522 1 5 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.984 -0.350 18463
523 1 5 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.449 -0.090 18463
524 1 5 . 1 1 10 10 GLN H H 10 7.861 7.861 8.817 -0.956 18463
525 1 5 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.337 0.550 18463
526 1 5 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.660 -3.102 18463
527 1 5 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.439 10.435 18463
528 1 5 . 1 1 11 11 CYS H H 11 7.341 7.341 7.917 -0.576 18463
529 1 5 . 1 1 12 12 SER N N 12 117.382 117.382 116.692 0.690 18463
530 1 5 . 1 1 12 12 SER HA H 12 3.692 3.692 3.929 -0.237 18463
531 1 5 . 1 1 12 12 SER CB C 12 62.945 62.945 62.697 0.248 18463
532 1 5 . 1 1 12 12 SER H H 12 8.513 8.513 8.257 0.256 18463
533 1 5 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.732 0.098 18463
534 1 5 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.461 -0.361 18463
535 1 5 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.480 -0.180 18463
536 1 5 . 1 1 13 13 GLU H H 13 8.199 8.199 8.007 0.192 18463
537 1 5 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.135 0.132 18463
538 1 5 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.290 -0.655 18463
539 1 5 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.385 -2.310 18463
540 1 5 . 1 1 14 14 HIS H H 14 8.250 8.250 8.102 0.148 18463
541 1 5 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.611 0.134 18463
542 1 5 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.522 -2.614 18463
543 1 5 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.598 13.761 18463
544 1 5 . 1 1 15 15 CYS H H 15 8.419 8.419 7.933 0.486 18463
545 1 5 . 1 1 16 16 ARG HA H 16 3.595 3.595 3.896 -0.301 18463
546 1 5 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.865 1.324 18463
547 1 5 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.882 0.426 18463
548 1 5 . 1 1 16 16 ARG H H 16 8.081 8.081 8.212 -0.131 18463
549 1 5 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.101 -0.022 18463
550 1 5 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.330 -0.170 18463
551 1 5 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.233 -0.461 18463
552 1 5 . 1 1 17 17 ALA H H 17 7.763 7.763 7.841 -0.078 18463
553 1 5 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.032 -0.025 18463
554 1 5 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.057 0.316 18463
555 1 5 . 1 1 18 18 LEU H H 18 7.265 7.265 7.095 0.170 18463
556 1 5 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.256 0.818 18463
557 1 5 . 1 1 20 20 GLY H H 20 9.107 9.107 8.701 0.406 18463
558 1 5 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.813 -0.282 18463
559 1 5 . 1 1 21 21 GLY H H 21 8.671 8.671 8.099 0.572 18463
560 1 5 . 1 1 22 22 ARG N N 22 119.872 119.872 121.592 -1.720 18463
561 1 5 . 1 1 22 22 ARG HA H 22 3.993 3.993 3.947 0.046 18463
562 1 5 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.915 0.700 18463
563 1 5 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.816 0.908 18463
564 1 5 . 1 1 22 22 ARG H H 22 6.965 6.965 7.513 -0.548 18463
565 1 5 . 1 1 23 23 THR HA H 23 4.277 4.277 4.328 -0.051 18463
566 1 5 . 1 1 23 23 THR CB C 23 70.344 70.344 69.689 0.655 18463
567 1 5 . 1 1 23 23 THR H H 23 8.837 8.837 8.187 0.650 18463
568 1 5 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.185 -0.028 18463
569 1 5 . 1 1 24 24 GLY H H 24 7.354 7.354 7.250 0.103 18463
570 1 5 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.076 1.725 18463
571 1 5 . 1 1 25 25 GLY H H 25 8.054 8.054 7.752 0.302 18463
572 1 5 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.961 -0.187 18463
573 1 5 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.242 -2.522 18463
574 1 5 . 1 1 26 26 TYR H H 26 8.932 8.932 8.921 0.011 18463
575 1 5 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.637 -0.449 18463
576 1 5 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.822 -4.970 18463
577 1 5 . 1 1 27 27 CYS CB C 27 37.300 37.300 29.272 8.028 18463
578 1 5 . 1 1 27 27 CYS H H 27 8.753 8.753 8.664 0.089 18463
579 1 5 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.923 -0.269 18463
580 1 5 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.354 0.249 18463
581 1 5 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.140 -1.382 18463
582 1 5 . 1 1 28 28 ALA H H 28 9.122 9.122 9.177 -0.055 18463
583 1 5 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.380 0.327 18463
584 1 5 . 1 1 29 29 GLY H H 29 8.548 8.548 8.311 0.237 18463
585 1 5 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.120 0.228 18463
586 1 5 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.102 -0.262 18463
587 1 5 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.539 0.261 18463
588 1 5 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.265 -1.559 18463
589 1 5 . 1 1 31 31 TRP H H 31 9.002 9.002 7.927 1.075 18463
590 1 5 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.677 -0.795 18463
591 1 5 . 1 1 32 32 TYR CA C 32 58.010 58.010 56.158 1.852 18463
592 1 5 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.300 -3.890 18463
593 1 5 . 1 1 32 32 TYR H H 32 6.367 6.367 7.073 -0.706 18463
594 1 5 . 1 1 33 33 LEU HA H 33 4.450 4.450 4.002 0.448 18463
595 1 5 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.148 -1.460 18463
596 1 5 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.108 0.670 18463
597 1 5 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.373 0.437 18463
598 1 5 . 1 1 34 34 GLY H H 34 7.632 7.632 8.330 -0.698 18463
599 1 5 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.968 -1.263 18463
600 1 5 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.898 -4.133 18463
601 1 5 . 1 1 35 35 HIS H H 35 7.334 7.334 8.350 -1.016 18463
602 1 5 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.582 -0.708 18463
603 1 5 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.514 0.558 18463
604 1 5 . 1 1 37 37 THR HA H 37 4.356 4.356 4.486 -0.130 18463
605 1 5 . 1 1 37 37 THR CB C 37 69.525 69.525 69.313 0.212 18463
606 1 5 . 1 1 37 37 THR H H 37 8.185 8.185 8.285 -0.100 18463
607 1 5 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.967 0.059 18463
608 1 5 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.757 -1.707 18463
609 1 5 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.172 6.749 18463
610 1 5 . 1 1 38 38 CYS H H 38 9.046 9.046 9.184 -0.138 18463
611 1 5 . 1 1 39 39 THR HA H 39 4.277 4.277 4.632 -0.355 18463
612 1 5 . 1 1 39 39 THR CB C 39 70.474 70.474 70.317 0.157 18463
613 1 5 . 1 1 39 39 THR H H 39 9.272 9.272 9.084 0.188 18463
614 1 5 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.536 0.931 18463
615 1 5 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.640 -5.575 18463
616 1 5 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.740 6.346 18463
617 1 5 . 1 1 40 40 CYS H H 40 8.658 8.658 8.778 -0.120 18463
618 1 5 . 1 1 41 41 SER HA H 41 4.771 4.771 4.925 -0.154 18463
619 1 5 . 1 1 41 41 SER CB C 41 66.158 66.158 64.202 1.956 18463
620 1 5 . 1 1 41 41 SER H H 41 8.680 8.680 8.347 0.333 18463
621 1 6 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.005 -0.034 18463
622 1 6 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.132 0.910 18463
623 1 6 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.516 0.804 18463
624 1 6 . 1 1 2 2 PHE H H 2 8.600 8.600 8.122 0.478 18463
625 1 6 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.236 -0.363 18463
626 1 6 . 1 1 3 3 GLY H H 3 8.004 8.004 8.279 -0.275 18463
627 1 6 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.177 -0.404 18463
628 1 6 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.469 9.318 18463
629 1 6 . 1 1 4 4 CYS H H 4 7.575 7.575 7.780 -0.205 18463
630 1 6 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.433 0.256 18463
631 1 6 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.690 -0.581 18463
632 1 6 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.245 3.138 18463
633 1 6 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.992 1.602 18463
634 1 6 . 1 1 6 6 GLY H H 6 8.907 8.907 8.137 0.770 18463
635 1 6 . 1 1 7 7 ASP HA H 7 5.007 5.007 5.001 0.006 18463
636 1 6 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.398 0.078 18463
637 1 6 . 1 1 7 7 ASP CB C 7 40.265 40.265 40.463 -0.198 18463
638 1 6 . 1 1 7 7 ASP H H 7 8.466 8.466 8.216 0.250 18463
639 1 6 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.184 -0.187 18463
640 1 6 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.041 -0.142 18463
641 1 6 . 1 1 8 8 ALA H H 8 8.560 8.560 8.357 0.203 18463
642 1 6 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.059 0.251 18463
643 1 6 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.510 -1.031 18463
644 1 6 . 1 1 9 9 TYR H H 9 8.432 8.432 8.199 0.233 18463
645 1 6 . 1 1 10 10 GLN HA H 10 3.944 3.944 3.820 0.124 18463
646 1 6 . 1 1 10 10 GLN CA C 10 58.635 58.635 59.009 -0.374 18463
647 1 6 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.459 -0.100 18463
648 1 6 . 1 1 10 10 GLN H H 10 7.861 7.861 8.690 -0.829 18463
649 1 6 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.315 0.572 18463
650 1 6 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.771 -3.213 18463
651 1 6 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.423 10.451 18463
652 1 6 . 1 1 11 11 CYS H H 11 7.341 7.341 7.761 -0.420 18463
653 1 6 . 1 1 12 12 SER N N 12 117.382 117.382 116.502 0.880 18463
654 1 6 . 1 1 12 12 SER HA H 12 3.692 3.692 3.928 -0.236 18463
655 1 6 . 1 1 12 12 SER CB C 12 62.945 62.945 62.636 0.309 18463
656 1 6 . 1 1 12 12 SER H H 12 8.513 8.513 7.984 0.529 18463
657 1 6 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.733 0.097 18463
658 1 6 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.389 -0.289 18463
659 1 6 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.466 -0.166 18463
660 1 6 . 1 1 13 13 GLU H H 13 8.199 8.199 7.991 0.208 18463
661 1 6 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.130 0.137 18463
662 1 6 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.333 -0.698 18463
663 1 6 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.377 -2.302 18463
664 1 6 . 1 1 14 14 HIS H H 14 8.250 8.250 8.183 0.067 18463
665 1 6 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.632 0.112 18463
666 1 6 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.206 -2.298 18463
667 1 6 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.408 13.951 18463
668 1 6 . 1 1 15 15 CYS H H 15 8.419 8.419 7.872 0.547 18463
669 1 6 . 1 1 16 16 ARG HA H 16 3.595 3.595 3.913 -0.318 18463
670 1 6 . 1 1 16 16 ARG CA C 16 60.189 60.189 59.006 1.183 18463
671 1 6 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.826 0.482 18463
672 1 6 . 1 1 16 16 ARG H H 16 8.081 8.081 8.322 -0.241 18463
673 1 6 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.101 -0.022 18463
674 1 6 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.349 -0.189 18463
675 1 6 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.236 -0.464 18463
676 1 6 . 1 1 17 17 ALA H H 17 7.763 7.763 7.978 -0.215 18463
677 1 6 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.044 -0.037 18463
678 1 6 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.104 0.269 18463
679 1 6 . 1 1 18 18 LEU H H 18 7.265 7.265 7.132 0.133 18463
680 1 6 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.156 0.918 18463
681 1 6 . 1 1 20 20 GLY H H 20 9.107 9.107 8.692 0.415 18463
682 1 6 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.832 -0.301 18463
683 1 6 . 1 1 21 21 GLY H H 21 8.671 8.671 8.120 0.551 18463
684 1 6 . 1 1 22 22 ARG N N 22 119.872 119.872 121.776 -1.904 18463
685 1 6 . 1 1 22 22 ARG HA H 22 3.993 3.993 4.062 -0.069 18463
686 1 6 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.719 0.896 18463
687 1 6 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.817 0.907 18463
688 1 6 . 1 1 22 22 ARG H H 22 6.965 6.965 7.519 -0.554 18463
689 1 6 . 1 1 23 23 THR HA H 23 4.277 4.277 4.182 0.095 18463
690 1 6 . 1 1 23 23 THR CB C 23 70.344 70.344 69.500 0.844 18463
691 1 6 . 1 1 23 23 THR H H 23 8.837 8.837 8.165 0.672 18463
692 1 6 . 1 1 24 24 GLY CA C 24 45.157 45.157 44.972 0.185 18463
693 1 6 . 1 1 24 24 GLY H H 24 7.354 7.354 7.202 0.151 18463
694 1 6 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.002 1.799 18463
695 1 6 . 1 1 25 25 GLY H H 25 8.054 8.054 7.267 0.787 18463
696 1 6 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.935 -0.161 18463
697 1 6 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.856 -3.135 18463
698 1 6 . 1 1 26 26 TYR H H 26 8.932 8.932 8.994 -0.062 18463
699 1 6 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.490 -0.302 18463
700 1 6 . 1 1 27 27 CYS CA C 27 52.852 52.852 58.101 -5.249 18463
701 1 6 . 1 1 27 27 CYS CB C 27 37.300 37.300 27.780 9.520 18463
702 1 6 . 1 1 27 27 CYS H H 27 8.753 8.753 8.800 -0.047 18463
703 1 6 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.746 -0.092 18463
704 1 6 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.180 0.423 18463
705 1 6 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.198 -1.440 18463
706 1 6 . 1 1 28 28 ALA H H 28 9.122 9.122 9.103 0.019 18463
707 1 6 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.419 0.289 18463
708 1 6 . 1 1 29 29 GLY H H 29 8.548 8.548 8.289 0.259 18463
709 1 6 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.041 0.307 18463
710 1 6 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.007 -0.167 18463
711 1 6 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.481 0.319 18463
712 1 6 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.091 -1.385 18463
713 1 6 . 1 1 31 31 TRP H H 31 9.002 9.002 8.071 0.931 18463
714 1 6 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.806 -0.924 18463
715 1 6 . 1 1 32 32 TYR CA C 32 58.010 58.010 55.355 2.655 18463
716 1 6 . 1 1 32 32 TYR CB C 32 35.410 35.410 40.131 -4.721 18463
717 1 6 . 1 1 32 32 TYR H H 32 6.367 6.367 6.772 -0.405 18463
718 1 6 . 1 1 33 33 LEU HA H 33 4.450 4.450 3.996 0.454 18463
719 1 6 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.178 -1.490 18463
720 1 6 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.000 0.778 18463
721 1 6 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.234 0.576 18463
722 1 6 . 1 1 34 34 GLY H H 34 7.632 7.632 8.298 -0.666 18463
723 1 6 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.967 -1.262 18463
724 1 6 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.910 -4.146 18463
725 1 6 . 1 1 35 35 HIS H H 35 7.334 7.334 8.327 -0.993 18463
726 1 6 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.548 -0.674 18463
727 1 6 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.567 0.505 18463
728 1 6 . 1 1 37 37 THR HA H 37 4.356 4.356 4.431 -0.075 18463
729 1 6 . 1 1 37 37 THR CB C 37 69.525 69.525 69.142 0.383 18463
730 1 6 . 1 1 37 37 THR H H 37 8.185 8.185 8.143 0.042 18463
731 1 6 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.845 0.181 18463
732 1 6 . 1 1 38 38 CYS CA C 38 57.050 57.050 59.030 -1.980 18463
733 1 6 . 1 1 38 38 CYS CB C 38 34.921 34.921 27.396 7.524 18463
734 1 6 . 1 1 38 38 CYS H H 38 9.046 9.046 9.165 -0.119 18463
735 1 6 . 1 1 39 39 THR HA H 39 4.277 4.277 4.699 -0.422 18463
736 1 6 . 1 1 39 39 THR CB C 39 70.474 70.474 71.408 -0.934 18463
737 1 6 . 1 1 39 39 THR H H 39 9.272 9.272 9.195 0.077 18463
738 1 6 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.590 0.877 18463
739 1 6 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.970 -5.905 18463
740 1 6 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.324 6.762 18463
741 1 6 . 1 1 40 40 CYS H H 40 8.658 8.658 8.927 -0.269 18463
742 1 6 . 1 1 41 41 SER HA H 41 4.771 4.771 4.960 -0.189 18463
743 1 6 . 1 1 41 41 SER CB C 41 66.158 66.158 64.414 1.744 18463
744 1 6 . 1 1 41 41 SER H H 41 8.680 8.680 8.514 0.166 18463
745 1 7 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.113 -0.142 18463
746 1 7 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.131 0.911 18463
747 1 7 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.360 0.960 18463
748 1 7 . 1 1 2 2 PHE H H 2 8.600 8.600 8.113 0.487 18463
749 1 7 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.194 -0.321 18463
750 1 7 . 1 1 3 3 GLY H H 3 8.004 8.004 8.311 -0.307 18463
751 1 7 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.196 -0.423 18463
752 1 7 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.712 9.075 18463
753 1 7 . 1 1 4 4 CYS H H 4 7.575 7.575 7.757 -0.182 18463
754 1 7 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.446 0.243 18463
755 1 7 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.669 -0.560 18463
756 1 7 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.615 2.768 18463
757 1 7 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.873 1.721 18463
758 1 7 . 1 1 6 6 GLY H H 6 8.907 8.907 8.486 0.421 18463
759 1 7 . 1 1 7 7 ASP HA H 7 5.007 5.007 5.010 -0.003 18463
760 1 7 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.725 -0.249 18463
761 1 7 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.457 -2.192 18463
762 1 7 . 1 1 7 7 ASP H H 7 8.466 8.466 8.335 0.131 18463
763 1 7 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.319 -0.322 18463
764 1 7 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.114 -0.215 18463
765 1 7 . 1 1 8 8 ALA H H 8 8.560 8.560 8.782 -0.222 18463
766 1 7 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.063 0.247 18463
767 1 7 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.664 -1.185 18463
768 1 7 . 1 1 9 9 TYR H H 9 8.432 8.432 8.822 -0.390 18463
769 1 7 . 1 1 10 10 GLN HA H 10 3.944 3.944 3.816 0.128 18463
770 1 7 . 1 1 10 10 GLN CA C 10 58.635 58.635 59.025 -0.390 18463
771 1 7 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.370 -0.011 18463
772 1 7 . 1 1 10 10 GLN H H 10 7.861 7.861 8.804 -0.943 18463
773 1 7 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.260 0.627 18463
774 1 7 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.659 -3.101 18463
775 1 7 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.390 10.484 18463
776 1 7 . 1 1 11 11 CYS H H 11 7.341 7.341 7.935 -0.594 18463
777 1 7 . 1 1 12 12 SER N N 12 117.382 117.382 116.635 0.747 18463
778 1 7 . 1 1 12 12 SER HA H 12 3.692 3.692 3.912 -0.220 18463
779 1 7 . 1 1 12 12 SER CB C 12 62.945 62.945 62.674 0.271 18463
780 1 7 . 1 1 12 12 SER H H 12 8.513 8.513 8.123 0.390 18463
781 1 7 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.725 0.105 18463
782 1 7 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.419 -0.319 18463
783 1 7 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.453 -0.153 18463
784 1 7 . 1 1 13 13 GLU H H 13 8.199 8.199 8.044 0.155 18463
785 1 7 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.114 0.153 18463
786 1 7 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.333 -0.698 18463
787 1 7 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.351 -2.276 18463
788 1 7 . 1 1 14 14 HIS H H 14 8.250 8.250 8.198 0.052 18463
789 1 7 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.632 0.112 18463
790 1 7 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.527 -2.619 18463
791 1 7 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.598 13.761 18463
792 1 7 . 1 1 15 15 CYS H H 15 8.419 8.419 7.849 0.570 18463
793 1 7 . 1 1 16 16 ARG HA H 16 3.595 3.595 4.025 -0.430 18463
794 1 7 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.865 1.324 18463
795 1 7 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.892 0.416 18463
796 1 7 . 1 1 16 16 ARG H H 16 8.081 8.081 8.205 -0.124 18463
797 1 7 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.102 -0.023 18463
798 1 7 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.329 -0.169 18463
799 1 7 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.230 -0.458 18463
800 1 7 . 1 1 17 17 ALA H H 17 7.763 7.763 7.905 -0.142 18463
801 1 7 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.019 -0.012 18463
802 1 7 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.030 0.343 18463
803 1 7 . 1 1 18 18 LEU H H 18 7.265 7.265 7.100 0.165 18463
804 1 7 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.363 0.711 18463
805 1 7 . 1 1 20 20 GLY H H 20 9.107 9.107 8.715 0.392 18463
806 1 7 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.816 -0.285 18463
807 1 7 . 1 1 21 21 GLY H H 21 8.671 8.671 8.108 0.563 18463
808 1 7 . 1 1 22 22 ARG N N 22 119.872 119.872 121.640 -1.768 18463
809 1 7 . 1 1 22 22 ARG HA H 22 3.993 3.993 4.051 -0.058 18463
810 1 7 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.959 0.657 18463
811 1 7 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.865 0.859 18463
812 1 7 . 1 1 22 22 ARG H H 22 6.965 6.965 7.599 -0.634 18463
813 1 7 . 1 1 23 23 THR HA H 23 4.277 4.277 4.388 -0.111 18463
814 1 7 . 1 1 23 23 THR CB C 23 70.344 70.344 69.759 0.585 18463
815 1 7 . 1 1 23 23 THR H H 23 8.837 8.837 8.180 0.657 18463
816 1 7 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.285 -0.128 18463
817 1 7 . 1 1 24 24 GLY H H 24 7.354 7.354 7.330 0.024 18463
818 1 7 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.140 1.661 18463
819 1 7 . 1 1 25 25 GLY H H 25 8.054 8.054 7.224 0.830 18463
820 1 7 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.962 -0.188 18463
821 1 7 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.600 -2.879 18463
822 1 7 . 1 1 26 26 TYR H H 26 8.932 8.932 8.980 -0.048 18463
823 1 7 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.617 -0.429 18463
824 1 7 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.959 -5.107 18463
825 1 7 . 1 1 27 27 CYS CB C 27 37.300 37.300 28.965 8.335 18463
826 1 7 . 1 1 27 27 CYS H H 27 8.753 8.753 8.736 0.017 18463
827 1 7 . 1 1 28 28 ALA HA H 28 4.654 4.654 5.052 -0.398 18463
828 1 7 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.572 0.032 18463
829 1 7 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.110 -1.352 18463
830 1 7 . 1 1 28 28 ALA H H 28 9.122 9.122 9.082 0.040 18463
831 1 7 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.439 0.269 18463
832 1 7 . 1 1 29 29 GLY H H 29 8.548 8.548 8.272 0.276 18463
833 1 7 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.010 0.338 18463
834 1 7 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.002 -0.162 18463
835 1 7 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.497 0.303 18463
836 1 7 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.070 -1.363 18463
837 1 7 . 1 1 31 31 TRP H H 31 9.002 9.002 7.631 1.371 18463
838 1 7 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.683 -0.801 18463
839 1 7 . 1 1 32 32 TYR CA C 32 58.010 58.010 56.123 1.887 18463
840 1 7 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.261 -3.852 18463
841 1 7 . 1 1 32 32 TYR H H 32 6.367 6.367 6.996 -0.629 18463
842 1 7 . 1 1 33 33 LEU HA H 33 4.450 4.450 4.011 0.439 18463
843 1 7 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.134 -1.446 18463
844 1 7 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.057 0.721 18463
845 1 7 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.541 0.269 18463
846 1 7 . 1 1 34 34 GLY H H 34 7.632 7.632 8.350 -0.718 18463
847 1 7 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.979 -1.274 18463
848 1 7 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.722 -3.958 18463
849 1 7 . 1 1 35 35 HIS H H 35 7.334 7.334 8.436 -1.102 18463
850 1 7 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.527 -0.652 18463
851 1 7 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.608 0.464 18463
852 1 7 . 1 1 37 37 THR HA H 37 4.356 4.356 4.480 -0.124 18463
853 1 7 . 1 1 37 37 THR CB C 37 69.525 69.525 69.260 0.266 18463
854 1 7 . 1 1 37 37 THR H H 37 8.185 8.185 8.304 -0.119 18463
855 1 7 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.890 0.136 18463
856 1 7 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.889 -1.839 18463
857 1 7 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.432 6.489 18463
858 1 7 . 1 1 38 38 CYS H H 38 9.046 9.046 9.150 -0.104 18463
859 1 7 . 1 1 39 39 THR HA H 39 4.277 4.277 4.639 -0.362 18463
860 1 7 . 1 1 39 39 THR CB C 39 70.474 70.474 70.570 -0.096 18463
861 1 7 . 1 1 39 39 THR H H 39 9.272 9.272 9.045 0.227 18463
862 1 7 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.467 1.000 18463
863 1 7 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.688 -5.623 18463
864 1 7 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.892 6.194 18463
865 1 7 . 1 1 40 40 CYS H H 40 8.658 8.658 8.807 -0.149 18463
866 1 7 . 1 1 41 41 SER HA H 41 4.771 4.771 4.967 -0.196 18463
867 1 7 . 1 1 41 41 SER CB C 41 66.158 66.158 64.460 1.698 18463
868 1 7 . 1 1 41 41 SER H H 41 8.680 8.680 8.466 0.214 18463
869 1 8 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.106 -0.135 18463
870 1 8 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.206 0.836 18463
871 1 8 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.523 0.797 18463
872 1 8 . 1 1 2 2 PHE H H 2 8.600 8.600 8.090 0.510 18463
873 1 8 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.141 -0.268 18463
874 1 8 . 1 1 3 3 GLY H H 3 8.004 8.004 8.300 -0.296 18463
875 1 8 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.128 -0.355 18463
876 1 8 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.096 9.691 18463
877 1 8 . 1 1 4 4 CYS H H 4 7.575 7.575 7.724 -0.149 18463
878 1 8 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.402 0.287 18463
879 1 8 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.988 -0.879 18463
880 1 8 . 1 1 5 5 PRO CB C 5 35.383 35.383 31.569 3.814 18463
881 1 8 . 1 1 6 6 GLY CA C 6 46.594 46.594 45.370 1.224 18463
882 1 8 . 1 1 6 6 GLY H H 6 8.907 8.907 8.391 0.516 18463
883 1 8 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.999 0.008 18463
884 1 8 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.410 0.067 18463
885 1 8 . 1 1 7 7 ASP CB C 7 40.265 40.265 40.794 -0.529 18463
886 1 8 . 1 1 7 7 ASP H H 7 8.466 8.466 8.215 0.251 18463
887 1 8 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.172 -0.175 18463
888 1 8 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.032 -0.133 18463
889 1 8 . 1 1 8 8 ALA H H 8 8.560 8.560 8.619 -0.059 18463
890 1 8 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.075 0.235 18463
891 1 8 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.624 -1.145 18463
892 1 8 . 1 1 9 9 TYR H H 9 8.432 8.432 8.622 -0.190 18463
893 1 8 . 1 1 10 10 GLN HA H 10 3.944 3.944 3.966 -0.022 18463
894 1 8 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.835 -0.200 18463
895 1 8 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.429 -0.070 18463
896 1 8 . 1 1 10 10 GLN H H 10 7.861 7.861 8.365 -0.504 18463
897 1 8 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.268 0.619 18463
898 1 8 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.684 -3.126 18463
899 1 8 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.470 10.405 18463
900 1 8 . 1 1 11 11 CYS H H 11 7.341 7.341 7.718 -0.377 18463
901 1 8 . 1 1 12 12 SER N N 12 117.382 117.382 116.668 0.714 18463
902 1 8 . 1 1 12 12 SER HA H 12 3.692 3.692 3.898 -0.206 18463
903 1 8 . 1 1 12 12 SER CB C 12 62.945 62.945 62.612 0.333 18463
904 1 8 . 1 1 12 12 SER H H 12 8.513 8.513 8.051 0.462 18463
905 1 8 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.735 0.095 18463
906 1 8 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.401 -0.302 18463
907 1 8 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.441 -0.141 18463
908 1 8 . 1 1 13 13 GLU H H 13 8.199 8.199 7.922 0.277 18463
909 1 8 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.085 0.182 18463
910 1 8 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.275 -0.640 18463
911 1 8 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.328 -2.253 18463
912 1 8 . 1 1 14 14 HIS H H 14 8.250 8.250 8.052 0.198 18463
913 1 8 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.739 0.005 18463
914 1 8 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.699 -2.791 18463
915 1 8 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.638 13.721 18463
916 1 8 . 1 1 15 15 CYS H H 15 8.419 8.419 8.048 0.371 18463
917 1 8 . 1 1 16 16 ARG HA H 16 3.595 3.595 4.041 -0.446 18463
918 1 8 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.881 1.308 18463
919 1 8 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.893 0.415 18463
920 1 8 . 1 1 16 16 ARG H H 16 8.081 8.081 8.273 -0.192 18463
921 1 8 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.100 -0.021 18463
922 1 8 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.373 -0.213 18463
923 1 8 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.222 -0.450 18463
924 1 8 . 1 1 17 17 ALA H H 17 7.763 7.763 7.806 -0.043 18463
925 1 8 . 1 1 18 18 LEU HA H 18 4.007 4.007 3.976 0.031 18463
926 1 8 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.010 0.363 18463
927 1 8 . 1 1 18 18 LEU H H 18 7.265 7.265 7.144 0.121 18463
928 1 8 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.316 0.759 18463
929 1 8 . 1 1 20 20 GLY H H 20 9.107 9.107 8.711 0.396 18463
930 1 8 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.817 -0.286 18463
931 1 8 . 1 1 21 21 GLY H H 21 8.671 8.671 8.106 0.565 18463
932 1 8 . 1 1 22 22 ARG N N 22 119.872 119.872 121.618 -1.746 18463
933 1 8 . 1 1 22 22 ARG HA H 22 3.993 3.993 4.016 -0.023 18463
934 1 8 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.837 0.778 18463
935 1 8 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.855 0.870 18463
936 1 8 . 1 1 22 22 ARG H H 22 6.965 6.965 7.547 -0.582 18463
937 1 8 . 1 1 23 23 THR HA H 23 4.277 4.277 4.384 -0.107 18463
938 1 8 . 1 1 23 23 THR CB C 23 70.344 70.344 69.721 0.623 18463
939 1 8 . 1 1 23 23 THR H H 23 8.837 8.837 8.277 0.560 18463
940 1 8 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.341 -0.184 18463
941 1 8 . 1 1 24 24 GLY H H 24 7.354 7.354 7.480 -0.126 18463
942 1 8 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.257 1.544 18463
943 1 8 . 1 1 25 25 GLY H H 25 8.054 8.054 7.163 0.891 18463
944 1 8 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.972 -0.198 18463
945 1 8 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.521 -2.800 18463
946 1 8 . 1 1 26 26 TYR H H 26 8.932 8.932 9.005 -0.073 18463
947 1 8 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.715 -0.527 18463
948 1 8 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.789 -4.937 18463
949 1 8 . 1 1 27 27 CYS CB C 27 37.300 37.300 29.966 7.334 18463
950 1 8 . 1 1 27 27 CYS H H 27 8.753 8.753 8.677 0.076 18463
951 1 8 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.803 -0.149 18463
952 1 8 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.785 -0.181 18463
953 1 8 . 1 1 28 28 ALA CB C 28 20.758 20.758 21.800 -1.042 18463
954 1 8 . 1 1 28 28 ALA H H 28 9.122 9.122 9.092 0.030 18463
955 1 8 . 1 1 29 29 GLY CA C 29 44.708 44.708 43.986 0.722 18463
956 1 8 . 1 1 29 29 GLY H H 29 8.548 8.548 8.317 0.231 18463
957 1 8 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.207 0.141 18463
958 1 8 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.004 -0.164 18463
959 1 8 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.450 0.350 18463
960 1 8 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.120 -1.415 18463
961 1 8 . 1 1 31 31 TRP H H 31 9.002 9.002 8.008 0.994 18463
962 1 8 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.684 -0.802 18463
963 1 8 . 1 1 32 32 TYR CA C 32 58.010 58.010 56.164 1.846 18463
964 1 8 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.358 -3.948 18463
965 1 8 . 1 1 32 32 TYR H H 32 6.367 6.367 7.072 -0.705 18463
966 1 8 . 1 1 33 33 LEU HA H 33 4.450 4.450 4.002 0.448 18463
967 1 8 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.095 -1.407 18463
968 1 8 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.100 0.678 18463
969 1 8 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.396 0.414 18463
970 1 8 . 1 1 34 34 GLY H H 34 7.632 7.632 8.358 -0.726 18463
971 1 8 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.976 -1.271 18463
972 1 8 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.824 -4.060 18463
973 1 8 . 1 1 35 35 HIS H H 35 7.334 7.334 8.356 -1.022 18463
974 1 8 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.552 -0.678 18463
975 1 8 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.497 0.575 18463
976 1 8 . 1 1 37 37 THR HA H 37 4.356 4.356 4.407 -0.051 18463
977 1 8 . 1 1 37 37 THR CB C 37 69.525 69.525 69.312 0.213 18463
978 1 8 . 1 1 37 37 THR H H 37 8.185 8.185 8.096 0.089 18463
979 1 8 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.817 0.209 18463
980 1 8 . 1 1 38 38 CYS CA C 38 57.050 57.050 59.083 -2.033 18463
981 1 8 . 1 1 38 38 CYS CB C 38 34.921 34.921 27.594 7.327 18463
982 1 8 . 1 1 38 38 CYS H H 38 9.046 9.046 9.158 -0.112 18463
983 1 8 . 1 1 39 39 THR HA H 39 4.277 4.277 4.695 -0.418 18463
984 1 8 . 1 1 39 39 THR CB C 39 70.474 70.474 71.108 -0.634 18463
985 1 8 . 1 1 39 39 THR H H 39 9.272 9.272 9.270 0.002 18463
986 1 8 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.603 0.864 18463
987 1 8 . 1 1 40 40 CYS CA C 40 52.065 52.065 58.120 -6.055 18463
988 1 8 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.589 6.497 18463
989 1 8 . 1 1 40 40 CYS H H 40 8.658 8.658 8.865 -0.207 18463
990 1 8 . 1 1 41 41 SER HA H 41 4.771 4.771 4.924 -0.153 18463
991 1 8 . 1 1 41 41 SER CB C 41 66.158 66.158 64.838 1.320 18463
992 1 8 . 1 1 41 41 SER H H 41 8.680 8.680 8.616 0.064 18463
993 1 9 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.011 -0.040 18463
994 1 9 . 1 1 2 2 PHE CA C 2 59.042 59.042 57.980 1.062 18463
995 1 9 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.491 0.829 18463
996 1 9 . 1 1 2 2 PHE H H 2 8.600 8.600 8.107 0.493 18463
997 1 9 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.206 -0.333 18463
998 1 9 . 1 1 3 3 GLY H H 3 8.004 8.004 8.256 -0.252 18463
999 1 9 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.113 -0.340 18463
1000 1 9 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.093 9.694 18463
1001 1 9 . 1 1 4 4 CYS H H 4 7.575 7.575 7.729 -0.154 18463
1002 1 9 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.375 0.314 18463
1003 1 9 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.986 -0.877 18463
1004 1 9 . 1 1 5 5 PRO CB C 5 35.383 35.383 31.555 3.828 18463
1005 1 9 . 1 1 6 6 GLY CA C 6 46.594 46.594 45.324 1.270 18463
1006 1 9 . 1 1 6 6 GLY H H 6 8.907 8.907 8.457 0.450 18463
1007 1 9 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.990 0.017 18463
1008 1 9 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.435 0.041 18463
1009 1 9 . 1 1 7 7 ASP CB C 7 40.265 40.265 40.395 -0.130 18463
1010 1 9 . 1 1 7 7 ASP H H 7 8.466 8.466 8.171 0.295 18463
1011 1 9 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.188 -0.191 18463
1012 1 9 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.018 -0.119 18463
1013 1 9 . 1 1 8 8 ALA H H 8 8.560 8.560 8.306 0.254 18463
1014 1 9 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.031 0.279 18463
1015 1 9 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.617 -1.139 18463
1016 1 9 . 1 1 9 9 TYR H H 9 8.432 8.432 8.185 0.247 18463
1017 1 9 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.154 -0.210 18463
1018 1 9 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.995 -0.360 18463
1019 1 9 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.547 -0.188 18463
1020 1 9 . 1 1 10 10 GLN H H 10 7.861 7.861 8.740 -0.879 18463
1021 1 9 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.326 0.561 18463
1022 1 9 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.759 -3.201 18463
1023 1 9 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.438 10.437 18463
1024 1 9 . 1 1 11 11 CYS H H 11 7.341 7.341 7.812 -0.471 18463
1025 1 9 . 1 1 12 12 SER N N 12 117.382 117.382 116.654 0.728 18463
1026 1 9 . 1 1 12 12 SER HA H 12 3.692 3.692 3.920 -0.228 18463
1027 1 9 . 1 1 12 12 SER CB C 12 62.945 62.945 62.609 0.336 18463
1028 1 9 . 1 1 12 12 SER H H 12 8.513 8.513 8.149 0.364 18463
1029 1 9 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.763 0.067 18463
1030 1 9 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.361 -0.261 18463
1031 1 9 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.523 -0.223 18463
1032 1 9 . 1 1 13 13 GLU H H 13 8.199 8.199 8.104 0.095 18463
1033 1 9 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.184 0.083 18463
1034 1 9 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.452 -0.817 18463
1035 1 9 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.560 -2.485 18463
1036 1 9 . 1 1 14 14 HIS H H 14 8.250 8.250 8.279 -0.029 18463
1037 1 9 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.765 -0.021 18463
1038 1 9 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.750 -2.842 18463
1039 1 9 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.645 13.714 18463
1040 1 9 . 1 1 15 15 CYS H H 15 8.419 8.419 8.066 0.353 18463
1041 1 9 . 1 1 16 16 ARG HA H 16 3.595 3.595 3.902 -0.307 18463
1042 1 9 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.916 1.273 18463
1043 1 9 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.871 0.437 18463
1044 1 9 . 1 1 16 16 ARG H H 16 8.081 8.081 8.228 -0.147 18463
1045 1 9 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.105 -0.026 18463
1046 1 9 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.395 -0.235 18463
1047 1 9 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.216 -0.444 18463
1048 1 9 . 1 1 17 17 ALA H H 17 7.763 7.763 7.811 -0.048 18463
1049 1 9 . 1 1 18 18 LEU HA H 18 4.007 4.007 3.986 0.021 18463
1050 1 9 . 1 1 18 18 LEU CB C 18 42.373 42.373 41.995 0.378 18463
1051 1 9 . 1 1 18 18 LEU H H 18 7.265 7.265 7.124 0.141 18463
1052 1 9 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.218 0.856 18463
1053 1 9 . 1 1 20 20 GLY H H 20 9.107 9.107 8.717 0.390 18463
1054 1 9 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.820 -0.289 18463
1055 1 9 . 1 1 21 21 GLY H H 21 8.671 8.671 8.089 0.582 18463
1056 1 9 . 1 1 22 22 ARG N N 22 119.872 119.872 121.778 -1.906 18463
1057 1 9 . 1 1 22 22 ARG HA H 22 3.993 3.993 4.059 -0.066 18463
1058 1 9 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.970 0.645 18463
1059 1 9 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.866 0.858 18463
1060 1 9 . 1 1 22 22 ARG H H 22 6.965 6.965 7.598 -0.633 18463
1061 1 9 . 1 1 23 23 THR HA H 23 4.277 4.277 4.239 0.038 18463
1062 1 9 . 1 1 23 23 THR CB C 23 70.344 70.344 69.561 0.783 18463
1063 1 9 . 1 1 23 23 THR H H 23 8.837 8.837 8.241 0.596 18463
1064 1 9 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.115 0.042 18463
1065 1 9 . 1 1 24 24 GLY H H 24 7.354 7.354 7.295 0.059 18463
1066 1 9 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.126 1.675 18463
1067 1 9 . 1 1 25 25 GLY H H 25 8.054 8.054 7.188 0.866 18463
1068 1 9 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.890 -0.116 18463
1069 1 9 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.732 -3.011 18463
1070 1 9 . 1 1 26 26 TYR H H 26 8.932 8.932 9.022 -0.090 18463
1071 1 9 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.638 -0.450 18463
1072 1 9 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.795 -4.943 18463
1073 1 9 . 1 1 27 27 CYS CB C 27 37.300 37.300 29.319 7.981 18463
1074 1 9 . 1 1 27 27 CYS H H 27 8.753 8.753 8.706 0.047 18463
1075 1 9 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.552 0.102 18463
1076 1 9 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.737 -0.134 18463
1077 1 9 . 1 1 28 28 ALA CB C 28 20.758 20.758 21.538 -0.780 18463
1078 1 9 . 1 1 28 28 ALA H H 28 9.122 9.122 9.198 -0.076 18463
1079 1 9 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.697 0.011 18463
1080 1 9 . 1 1 29 29 GLY H H 29 8.548 8.548 8.060 0.488 18463
1081 1 9 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.280 0.068 18463
1082 1 9 . 1 1 30 30 PRO CB C 30 31.840 31.840 31.965 -0.125 18463
1083 1 9 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.469 0.331 18463
1084 1 9 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.142 -1.436 18463
1085 1 9 . 1 1 31 31 TRP H H 31 9.002 9.002 8.111 0.891 18463
1086 1 9 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.718 -0.836 18463
1087 1 9 . 1 1 32 32 TYR CA C 32 58.010 58.010 56.209 1.801 18463
1088 1 9 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.449 -4.038 18463
1089 1 9 . 1 1 32 32 TYR H H 32 6.367 6.367 7.107 -0.740 18463
1090 1 9 . 1 1 33 33 LEU HA H 33 4.450 4.450 4.018 0.432 18463
1091 1 9 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.016 -1.328 18463
1092 1 9 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.173 0.605 18463
1093 1 9 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.341 0.469 18463
1094 1 9 . 1 1 34 34 GLY H H 34 7.632 7.632 8.361 -0.729 18463
1095 1 9 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.936 -1.231 18463
1096 1 9 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.936 -4.172 18463
1097 1 9 . 1 1 35 35 HIS H H 35 7.334 7.334 8.271 -0.937 18463
1098 1 9 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.344 -0.470 18463
1099 1 9 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.732 0.340 18463
1100 1 9 . 1 1 37 37 THR HA H 37 4.356 4.356 4.488 -0.132 18463
1101 1 9 . 1 1 37 37 THR CB C 37 69.525 69.525 69.136 0.389 18463
1102 1 9 . 1 1 37 37 THR H H 37 8.185 8.185 8.221 -0.036 18463
1103 1 9 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.896 0.130 18463
1104 1 9 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.852 -1.802 18463
1105 1 9 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.265 6.656 18463
1106 1 9 . 1 1 38 38 CYS H H 38 9.046 9.046 9.170 -0.124 18463
1107 1 9 . 1 1 39 39 THR HA H 39 4.277 4.277 4.638 -0.361 18463
1108 1 9 . 1 1 39 39 THR CB C 39 70.474 70.474 70.456 0.018 18463
1109 1 9 . 1 1 39 39 THR H H 39 9.272 9.272 9.097 0.175 18463
1110 1 9 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.570 0.897 18463
1111 1 9 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.650 -5.585 18463
1112 1 9 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.915 6.171 18463
1113 1 9 . 1 1 40 40 CYS H H 40 8.658 8.658 8.805 -0.147 18463
1114 1 9 . 1 1 41 41 SER HA H 41 4.771 4.771 4.952 -0.181 18463
1115 1 9 . 1 1 41 41 SER CB C 41 66.158 66.158 64.513 1.645 18463
1116 1 9 . 1 1 41 41 SER H H 41 8.680 8.680 8.533 0.147 18463
1117 1 10 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.184 -0.213 18463
1118 1 10 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.374 0.668 18463
1119 1 10 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.505 0.815 18463
1120 1 10 . 1 1 2 2 PHE H H 2 8.600 8.600 8.409 0.191 18463
1121 1 10 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.098 -0.225 18463
1122 1 10 . 1 1 3 3 GLY H H 3 8.004 8.004 8.414 -0.410 18463
1123 1 10 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.108 -0.335 18463
1124 1 10 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.045 9.742 18463
1125 1 10 . 1 1 4 4 CYS H H 4 7.575 7.575 7.709 -0.134 18463
1126 1 10 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.457 0.232 18463
1127 1 10 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.635 -0.526 18463
1128 1 10 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.318 3.065 18463
1129 1 10 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.929 1.665 18463
1130 1 10 . 1 1 6 6 GLY H H 6 8.907 8.907 8.343 0.564 18463
1131 1 10 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.982 0.025 18463
1132 1 10 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.415 0.061 18463
1133 1 10 . 1 1 7 7 ASP CB C 7 40.265 40.265 40.344 -0.079 18463
1134 1 10 . 1 1 7 7 ASP H H 7 8.466 8.466 8.141 0.325 18463
1135 1 10 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.223 -0.226 18463
1136 1 10 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.062 -0.163 18463
1137 1 10 . 1 1 8 8 ALA H H 8 8.560 8.560 8.309 0.251 18463
1138 1 10 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.084 0.226 18463
1139 1 10 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.654 -1.175 18463
1140 1 10 . 1 1 9 9 TYR H H 9 8.432 8.432 8.316 0.116 18463
1141 1 10 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.086 -0.142 18463
1142 1 10 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.975 -0.340 18463
1143 1 10 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.474 -0.115 18463
1144 1 10 . 1 1 10 10 GLN H H 10 7.861 7.861 8.697 -0.836 18463
1145 1 10 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.278 0.609 18463
1146 1 10 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.744 -3.186 18463
1147 1 10 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.448 10.426 18463
1148 1 10 . 1 1 11 11 CYS H H 11 7.341 7.341 7.762 -0.421 18463
1149 1 10 . 1 1 12 12 SER N N 12 117.382 117.382 116.579 0.803 18463
1150 1 10 . 1 1 12 12 SER HA H 12 3.692 3.692 3.931 -0.239 18463
1151 1 10 . 1 1 12 12 SER CB C 12 62.945 62.945 62.664 0.281 18463
1152 1 10 . 1 1 12 12 SER H H 12 8.513 8.513 8.032 0.481 18463
1153 1 10 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.732 0.098 18463
1154 1 10 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.436 -0.336 18463
1155 1 10 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.494 -0.194 18463
1156 1 10 . 1 1 13 13 GLU H H 13 8.199 8.199 8.046 0.153 18463
1157 1 10 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.082 0.185 18463
1158 1 10 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.272 -0.637 18463
1159 1 10 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.225 -2.150 18463
1160 1 10 . 1 1 14 14 HIS H H 14 8.250 8.250 8.131 0.119 18463
1161 1 10 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.646 0.098 18463
1162 1 10 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.186 -2.278 18463
1163 1 10 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.419 13.940 18463
1164 1 10 . 1 1 15 15 CYS H H 15 8.419 8.419 7.817 0.602 18463
1165 1 10 . 1 1 16 16 ARG HA H 16 3.595 3.595 3.910 -0.315 18463
1166 1 10 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.984 1.205 18463
1167 1 10 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.816 0.492 18463
1168 1 10 . 1 1 16 16 ARG H H 16 8.081 8.081 8.323 -0.242 18463
1169 1 10 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.097 -0.018 18463
1170 1 10 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.359 -0.200 18463
1171 1 10 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.242 -0.470 18463
1172 1 10 . 1 1 17 17 ALA H H 17 7.763 7.763 7.961 -0.198 18463
1173 1 10 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.046 -0.039 18463
1174 1 10 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.066 0.307 18463
1175 1 10 . 1 1 18 18 LEU H H 18 7.265 7.265 7.131 0.134 18463
1176 1 10 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.164 0.910 18463
1177 1 10 . 1 1 20 20 GLY H H 20 9.107 9.107 8.690 0.417 18463
1178 1 10 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.802 -0.271 18463
1179 1 10 . 1 1 21 21 GLY H H 21 8.671 8.671 8.123 0.548 18463
1180 1 10 . 1 1 22 22 ARG N N 22 119.872 119.872 121.832 -1.960 18463
1181 1 10 . 1 1 22 22 ARG HA H 22 3.993 3.993 4.069 -0.076 18463
1182 1 10 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.751 0.864 18463
1183 1 10 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.796 0.928 18463
1184 1 10 . 1 1 22 22 ARG H H 22 6.965 6.965 7.497 -0.532 18463
1185 1 10 . 1 1 23 23 THR HA H 23 4.277 4.277 4.201 0.076 18463
1186 1 10 . 1 1 23 23 THR CB C 23 70.344 70.344 69.511 0.833 18463
1187 1 10 . 1 1 23 23 THR H H 23 8.837 8.837 8.100 0.737 18463
1188 1 10 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.071 0.086 18463
1189 1 10 . 1 1 24 24 GLY H H 24 7.354 7.354 7.150 0.204 18463
1190 1 10 . 1 1 25 25 GLY CA C 25 46.801 46.801 44.975 1.825 18463
1191 1 10 . 1 1 25 25 GLY H H 25 8.054 8.054 7.772 0.281 18463
1192 1 10 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.966 -0.192 18463
1193 1 10 . 1 1 26 26 TYR CB C 26 39.721 39.721 41.997 -2.276 18463
1194 1 10 . 1 1 26 26 TYR H H 26 8.932 8.932 8.886 0.046 18463
1195 1 10 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.701 -0.513 18463
1196 1 10 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.744 -4.892 18463
1197 1 10 . 1 1 27 27 CYS CB C 27 37.300 37.300 29.952 7.348 18463
1198 1 10 . 1 1 27 27 CYS H H 27 8.753 8.753 8.619 0.134 18463
1199 1 10 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.630 0.024 18463
1200 1 10 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.614 -0.011 18463
1201 1 10 . 1 1 28 28 ALA CB C 28 20.758 20.758 21.704 -0.947 18463
1202 1 10 . 1 1 28 28 ALA H H 28 9.122 9.122 9.236 -0.114 18463
1203 1 10 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.602 0.106 18463
1204 1 10 . 1 1 29 29 GLY H H 29 8.548 8.548 8.090 0.458 18463
1205 1 10 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.179 0.169 18463
1206 1 10 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.104 -0.264 18463
1207 1 10 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.543 0.257 18463
1208 1 10 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.258 -1.552 18463
1209 1 10 . 1 1 31 31 TRP H H 31 9.002 9.002 8.006 0.996 18463
1210 1 10 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.678 -0.796 18463
1211 1 10 . 1 1 32 32 TYR CA C 32 58.010 58.010 56.106 1.904 18463
1212 1 10 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.245 -3.835 18463
1213 1 10 . 1 1 32 32 TYR H H 32 6.367 6.367 7.075 -0.708 18463
1214 1 10 . 1 1 33 33 LEU HA H 33 4.450 4.450 4.002 0.448 18463
1215 1 10 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.180 -1.492 18463
1216 1 10 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.055 0.723 18463
1217 1 10 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.321 0.489 18463
1218 1 10 . 1 1 34 34 GLY H H 34 7.632 7.632 8.330 -0.698 18463
1219 1 10 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.964 -1.259 18463
1220 1 10 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.960 -4.196 18463
1221 1 10 . 1 1 35 35 HIS H H 35 7.334 7.334 8.296 -0.962 18463
1222 1 10 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.559 -0.685 18463
1223 1 10 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.606 0.466 18463
1224 1 10 . 1 1 37 37 THR HA H 37 4.356 4.356 4.466 -0.110 18463
1225 1 10 . 1 1 37 37 THR CB C 37 69.525 69.525 69.305 0.220 18463
1226 1 10 . 1 1 37 37 THR H H 37 8.185 8.185 8.264 -0.079 18463
1227 1 10 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.980 0.046 18463
1228 1 10 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.757 -1.707 18463
1229 1 10 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.579 6.342 18463
1230 1 10 . 1 1 38 38 CYS H H 38 9.046 9.046 9.136 -0.090 18463
1231 1 10 . 1 1 39 39 THR HA H 39 4.277 4.277 4.630 -0.353 18463
1232 1 10 . 1 1 39 39 THR CB C 39 70.474 70.474 70.578 -0.104 18463
1233 1 10 . 1 1 39 39 THR H H 39 9.272 9.272 9.043 0.229 18463
1234 1 10 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.499 0.968 18463
1235 1 10 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.664 -5.599 18463
1236 1 10 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.614 6.472 18463
1237 1 10 . 1 1 40 40 CYS H H 40 8.658 8.658 8.810 -0.152 18463
1238 1 10 . 1 1 41 41 SER HA H 41 4.771 4.771 4.889 -0.118 18463
1239 1 10 . 1 1 41 41 SER CB C 41 66.158 66.158 64.135 2.023 18463
1240 1 10 . 1 1 41 41 SER H H 41 8.680 8.680 8.400 0.280 18463
1241 1 11 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.221 -0.250 18463
1242 1 11 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.311 0.731 18463
1243 1 11 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.587 0.733 18463
1244 1 11 . 1 1 2 2 PHE H H 2 8.600 8.600 8.099 0.501 18463
1245 1 11 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.103 -0.230 18463
1246 1 11 . 1 1 3 3 GLY H H 3 8.004 8.004 8.417 -0.413 18463
1247 1 11 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.197 -0.424 18463
1248 1 11 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.555 9.232 18463
1249 1 11 . 1 1 4 4 CYS H H 4 7.575 7.575 7.691 -0.116 18463
1250 1 11 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.437 0.252 18463
1251 1 11 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.721 -0.612 18463
1252 1 11 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.314 3.069 18463
1253 1 11 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.858 1.736 18463
1254 1 11 . 1 1 6 6 GLY H H 6 8.907 8.907 8.359 0.548 18463
1255 1 11 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.987 0.020 18463
1256 1 11 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.584 -0.108 18463
1257 1 11 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.621 -2.357 18463
1258 1 11 . 1 1 7 7 ASP H H 7 8.466 8.466 8.301 0.165 18463
1259 1 11 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.451 -0.454 18463
1260 1 11 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.337 -0.438 18463
1261 1 11 . 1 1 8 8 ALA H H 8 8.560 8.560 8.733 -0.173 18463
1262 1 11 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.039 0.271 18463
1263 1 11 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.893 -1.414 18463
1264 1 11 . 1 1 9 9 TYR H H 9 8.432 8.432 8.890 -0.458 18463
1265 1 11 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.282 -0.338 18463
1266 1 11 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.896 -0.261 18463
1267 1 11 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.498 -0.139 18463
1268 1 11 . 1 1 10 10 GLN H H 10 7.861 7.861 9.116 -1.255 18463
1269 1 11 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.309 0.578 18463
1270 1 11 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.559 -3.001 18463
1271 1 11 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.386 10.488 18463
1272 1 11 . 1 1 11 11 CYS H H 11 7.341 7.341 8.332 -0.991 18463
1273 1 11 . 1 1 12 12 SER N N 12 117.382 117.382 116.645 0.737 18463
1274 1 11 . 1 1 12 12 SER HA H 12 3.692 3.692 3.933 -0.241 18463
1275 1 11 . 1 1 12 12 SER CB C 12 62.945 62.945 62.651 0.294 18463
1276 1 11 . 1 1 12 12 SER H H 12 8.513 8.513 8.252 0.261 18463
1277 1 11 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.747 0.083 18463
1278 1 11 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.398 -0.298 18463
1279 1 11 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.520 -0.220 18463
1280 1 11 . 1 1 13 13 GLU H H 13 8.199 8.199 7.950 0.249 18463
1281 1 11 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.098 0.169 18463
1282 1 11 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.316 -0.681 18463
1283 1 11 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.344 -2.269 18463
1284 1 11 . 1 1 14 14 HIS H H 14 8.250 8.250 8.183 0.067 18463
1285 1 11 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.795 -0.051 18463
1286 1 11 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.715 -2.807 18463
1287 1 11 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.660 13.699 18463
1288 1 11 . 1 1 15 15 CYS H H 15 8.419 8.419 7.916 0.503 18463
1289 1 11 . 1 1 16 16 ARG HA H 16 3.595 3.595 4.023 -0.428 18463
1290 1 11 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.902 1.287 18463
1291 1 11 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.888 0.420 18463
1292 1 11 . 1 1 16 16 ARG H H 16 8.081 8.081 8.306 -0.225 18463
1293 1 11 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.092 -0.013 18463
1294 1 11 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.389 -0.229 18463
1295 1 11 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.203 -0.431 18463
1296 1 11 . 1 1 17 17 ALA H H 17 7.763 7.763 7.730 0.033 18463
1297 1 11 . 1 1 18 18 LEU HA H 18 4.007 4.007 3.990 0.017 18463
1298 1 11 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.019 0.354 18463
1299 1 11 . 1 1 18 18 LEU H H 18 7.265 7.265 7.083 0.182 18463
1300 1 11 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.316 0.758 18463
1301 1 11 . 1 1 20 20 GLY H H 20 9.107 9.107 8.699 0.408 18463
1302 1 11 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.807 -0.276 18463
1303 1 11 . 1 1 21 21 GLY H H 21 8.671 8.671 8.112 0.559 18463
1304 1 11 . 1 1 22 22 ARG N N 22 119.872 119.872 121.536 -1.664 18463
1305 1 11 . 1 1 22 22 ARG HA H 22 3.993 3.993 3.973 0.020 18463
1306 1 11 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.791 0.824 18463
1307 1 11 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.853 0.871 18463
1308 1 11 . 1 1 22 22 ARG H H 22 6.965 6.965 7.500 -0.535 18463
1309 1 11 . 1 1 23 23 THR HA H 23 4.277 4.277 4.328 -0.051 18463
1310 1 11 . 1 1 23 23 THR CB C 23 70.344 70.344 69.725 0.619 18463
1311 1 11 . 1 1 23 23 THR H H 23 8.837 8.837 8.339 0.498 18463
1312 1 11 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.214 -0.056 18463
1313 1 11 . 1 1 24 24 GLY H H 24 7.354 7.354 7.200 0.154 18463
1314 1 11 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.107 1.694 18463
1315 1 11 . 1 1 25 25 GLY H H 25 8.054 8.054 7.702 0.351 18463
1316 1 11 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.950 -0.176 18463
1317 1 11 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.207 -2.486 18463
1318 1 11 . 1 1 26 26 TYR H H 26 8.932 8.932 8.918 0.014 18463
1319 1 11 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.614 -0.426 18463
1320 1 11 . 1 1 27 27 CYS CA C 27 52.852 52.852 58.054 -5.202 18463
1321 1 11 . 1 1 27 27 CYS CB C 27 37.300 37.300 28.694 8.606 18463
1322 1 11 . 1 1 27 27 CYS H H 27 8.753 8.753 8.771 -0.018 18463
1323 1 11 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.720 -0.066 18463
1324 1 11 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.677 -0.074 18463
1325 1 11 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.000 -1.242 18463
1326 1 11 . 1 1 28 28 ALA H H 28 9.122 9.122 9.136 -0.014 18463
1327 1 11 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.371 0.337 18463
1328 1 11 . 1 1 29 29 GLY H H 29 8.548 8.548 8.364 0.184 18463
1329 1 11 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.385 -0.037 18463
1330 1 11 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.039 -0.199 18463
1331 1 11 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.454 0.346 18463
1332 1 11 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.120 -1.414 18463
1333 1 11 . 1 1 31 31 TRP H H 31 9.002 9.002 8.232 0.770 18463
1334 1 11 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.678 -0.796 18463
1335 1 11 . 1 1 32 32 TYR CA C 32 58.010 58.010 56.067 1.943 18463
1336 1 11 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.248 -3.838 18463
1337 1 11 . 1 1 32 32 TYR H H 32 6.367 6.367 7.069 -0.702 18463
1338 1 11 . 1 1 33 33 LEU HA H 33 4.450 4.450 4.003 0.447 18463
1339 1 11 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.161 -1.473 18463
1340 1 11 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.039 0.739 18463
1341 1 11 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.320 0.490 18463
1342 1 11 . 1 1 34 34 GLY H H 34 7.632 7.632 8.331 -0.699 18463
1343 1 11 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.983 -1.278 18463
1344 1 11 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.992 -4.228 18463
1345 1 11 . 1 1 35 35 HIS H H 35 7.334 7.334 8.336 -1.002 18463
1346 1 11 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.387 -0.513 18463
1347 1 11 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.614 0.458 18463
1348 1 11 . 1 1 37 37 THR HA H 37 4.356 4.356 4.468 -0.112 18463
1349 1 11 . 1 1 37 37 THR CB C 37 69.525 69.525 69.694 -0.168 18463
1350 1 11 . 1 1 37 37 THR H H 37 8.185 8.185 8.173 0.012 18463
1351 1 11 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.941 0.085 18463
1352 1 11 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.774 -1.724 18463
1353 1 11 . 1 1 38 38 CYS CB C 38 34.921 34.921 27.639 7.282 18463
1354 1 11 . 1 1 38 38 CYS H H 38 9.046 9.046 9.168 -0.121 18463
1355 1 11 . 1 1 39 39 THR HA H 39 4.277 4.277 4.701 -0.424 18463
1356 1 11 . 1 1 39 39 THR CB C 39 70.474 70.474 71.141 -0.667 18463
1357 1 11 . 1 1 39 39 THR H H 39 9.272 9.272 9.229 0.043 18463
1358 1 11 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.617 0.850 18463
1359 1 11 . 1 1 40 40 CYS CA C 40 52.065 52.065 58.045 -5.980 18463
1360 1 11 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.461 6.625 18463
1361 1 11 . 1 1 40 40 CYS H H 40 8.658 8.658 8.835 -0.177 18463
1362 1 11 . 1 1 41 41 SER HA H 41 4.771 4.771 4.866 -0.095 18463
1363 1 11 . 1 1 41 41 SER CB C 41 66.158 66.158 64.667 1.491 18463
1364 1 11 . 1 1 41 41 SER H H 41 8.680 8.680 8.567 0.113 18463
1365 1 12 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.179 -0.208 18463
1366 1 12 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.170 0.872 18463
1367 1 12 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.453 0.867 18463
1368 1 12 . 1 1 2 2 PHE H H 2 8.600 8.600 8.161 0.439 18463
1369 1 12 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.069 -0.196 18463
1370 1 12 . 1 1 3 3 GLY H H 3 8.004 8.004 8.345 -0.341 18463
1371 1 12 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.188 -0.415 18463
1372 1 12 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.447 9.340 18463
1373 1 12 . 1 1 4 4 CYS H H 4 7.575 7.575 7.733 -0.158 18463
1374 1 12 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.442 0.247 18463
1375 1 12 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.680 -0.571 18463
1376 1 12 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.355 3.028 18463
1377 1 12 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.906 1.688 18463
1378 1 12 . 1 1 6 6 GLY H H 6 8.907 8.907 8.345 0.562 18463
1379 1 12 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.999 0.008 18463
1380 1 12 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.459 0.017 18463
1381 1 12 . 1 1 7 7 ASP CB C 7 40.265 40.265 41.746 -1.481 18463
1382 1 12 . 1 1 7 7 ASP H H 7 8.466 8.466 8.250 0.216 18463
1383 1 12 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.325 -0.328 18463
1384 1 12 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.118 -0.219 18463
1385 1 12 . 1 1 8 8 ALA H H 8 8.560 8.560 8.831 -0.271 18463
1386 1 12 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.060 0.250 18463
1387 1 12 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.794 -1.315 18463
1388 1 12 . 1 1 9 9 TYR H H 9 8.432 8.432 8.799 -0.367 18463
1389 1 12 . 1 1 10 10 GLN HA H 10 3.944 3.944 3.960 -0.016 18463
1390 1 12 . 1 1 10 10 GLN CA C 10 58.635 58.635 59.007 -0.372 18463
1391 1 12 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.411 -0.052 18463
1392 1 12 . 1 1 10 10 GLN H H 10 7.861 7.861 8.859 -0.998 18463
1393 1 12 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.284 0.603 18463
1394 1 12 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.736 -3.178 18463
1395 1 12 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.411 10.463 18463
1396 1 12 . 1 1 11 11 CYS H H 11 7.341 7.341 8.004 -0.663 18463
1397 1 12 . 1 1 12 12 SER N N 12 117.382 117.382 116.499 0.883 18463
1398 1 12 . 1 1 12 12 SER HA H 12 3.692 3.692 3.951 -0.259 18463
1399 1 12 . 1 1 12 12 SER CB C 12 62.945 62.945 62.688 0.257 18463
1400 1 12 . 1 1 12 12 SER H H 12 8.513 8.513 8.167 0.346 18463
1401 1 12 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.748 0.082 18463
1402 1 12 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.330 -0.230 18463
1403 1 12 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.486 -0.186 18463
1404 1 12 . 1 1 13 13 GLU H H 13 8.199 8.199 8.065 0.134 18463
1405 1 12 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.147 0.120 18463
1406 1 12 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.435 -0.800 18463
1407 1 12 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.438 -2.363 18463
1408 1 12 . 1 1 14 14 HIS H H 14 8.250 8.250 8.267 -0.017 18463
1409 1 12 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.680 0.064 18463
1410 1 12 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.504 -2.596 18463
1411 1 12 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.662 13.697 18463
1412 1 12 . 1 1 15 15 CYS H H 15 8.419 8.419 7.860 0.559 18463
1413 1 12 . 1 1 16 16 ARG HA H 16 3.595 3.595 3.898 -0.303 18463
1414 1 12 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.885 1.304 18463
1415 1 12 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.857 0.451 18463
1416 1 12 . 1 1 16 16 ARG H H 16 8.081 8.081 8.255 -0.174 18463
1417 1 12 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.108 -0.029 18463
1418 1 12 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.303 -0.143 18463
1419 1 12 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.254 -0.482 18463
1420 1 12 . 1 1 17 17 ALA H H 17 7.763 7.763 7.945 -0.182 18463
1421 1 12 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.027 -0.020 18463
1422 1 12 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.078 0.295 18463
1423 1 12 . 1 1 18 18 LEU H H 18 7.265 7.265 7.115 0.150 18463
1424 1 12 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.313 0.761 18463
1425 1 12 . 1 1 20 20 GLY H H 20 9.107 9.107 8.708 0.399 18463
1426 1 12 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.774 -0.243 18463
1427 1 12 . 1 1 21 21 GLY H H 21 8.671 8.671 8.096 0.575 18463
1428 1 12 . 1 1 22 22 ARG N N 22 119.872 119.872 121.739 -1.867 18463
1429 1 12 . 1 1 22 22 ARG HA H 22 3.993 3.993 3.885 0.108 18463
1430 1 12 . 1 1 22 22 ARG CA C 22 56.615 56.615 56.016 0.599 18463
1431 1 12 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.756 0.968 18463
1432 1 12 . 1 1 22 22 ARG H H 22 6.965 6.965 7.543 -0.578 18463
1433 1 12 . 1 1 23 23 THR HA H 23 4.277 4.277 4.305 -0.028 18463
1434 1 12 . 1 1 23 23 THR CB C 23 70.344 70.344 69.652 0.692 18463
1435 1 12 . 1 1 23 23 THR H H 23 8.837 8.837 8.162 0.675 18463
1436 1 12 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.175 -0.018 18463
1437 1 12 . 1 1 24 24 GLY H H 24 7.354 7.354 7.214 0.140 18463
1438 1 12 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.058 1.743 18463
1439 1 12 . 1 1 25 25 GLY H H 25 8.054 8.054 7.756 0.298 18463
1440 1 12 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.952 -0.178 18463
1441 1 12 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.185 -2.464 18463
1442 1 12 . 1 1 26 26 TYR H H 26 8.932 8.932 8.960 -0.028 18463
1443 1 12 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.509 -0.321 18463
1444 1 12 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.988 -5.136 18463
1445 1 12 . 1 1 27 27 CYS CB C 27 37.300 37.300 28.292 9.008 18463
1446 1 12 . 1 1 27 27 CYS H H 27 8.753 8.753 8.734 0.019 18463
1447 1 12 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.664 -0.010 18463
1448 1 12 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.026 0.577 18463
1449 1 12 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.267 -1.509 18463
1450 1 12 . 1 1 28 28 ALA H H 28 9.122 9.122 9.056 0.066 18463
1451 1 12 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.617 0.091 18463
1452 1 12 . 1 1 29 29 GLY H H 29 8.548 8.548 8.334 0.214 18463
1453 1 12 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.103 0.245 18463
1454 1 12 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.033 -0.193 18463
1455 1 12 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.496 0.304 18463
1456 1 12 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.078 -1.371 18463
1457 1 12 . 1 1 31 31 TRP H H 31 9.002 9.002 8.186 0.816 18463
1458 1 12 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.776 -0.894 18463
1459 1 12 . 1 1 32 32 TYR CA C 32 58.010 58.010 55.441 2.568 18463
1460 1 12 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.985 -4.575 18463
1461 1 12 . 1 1 32 32 TYR H H 32 6.367 6.367 6.768 -0.401 18463
1462 1 12 . 1 1 33 33 LEU HA H 33 4.450 4.450 3.991 0.459 18463
1463 1 12 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.306 -1.618 18463
1464 1 12 . 1 1 33 33 LEU CB C 33 42.778 42.778 41.877 0.901 18463
1465 1 12 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.201 0.609 18463
1466 1 12 . 1 1 34 34 GLY H H 34 7.632 7.632 8.253 -0.621 18463
1467 1 12 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.951 -1.246 18463
1468 1 12 . 1 1 35 35 HIS CB C 35 25.764 25.764 30.135 -4.371 18463
1469 1 12 . 1 1 35 35 HIS H H 35 7.334 7.334 8.370 -1.036 18463
1470 1 12 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.588 -0.714 18463
1471 1 12 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.515 0.557 18463
1472 1 12 . 1 1 37 37 THR HA H 37 4.356 4.356 4.495 -0.139 18463
1473 1 12 . 1 1 37 37 THR CB C 37 69.525 69.525 69.519 0.006 18463
1474 1 12 . 1 1 37 37 THR H H 37 8.185 8.185 8.233 -0.048 18463
1475 1 12 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.998 0.028 18463
1476 1 12 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.684 -1.634 18463
1477 1 12 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.247 6.674 18463
1478 1 12 . 1 1 38 38 CYS H H 38 9.046 9.046 9.199 -0.153 18463
1479 1 12 . 1 1 39 39 THR HA H 39 4.277 4.277 4.626 -0.349 18463
1480 1 12 . 1 1 39 39 THR CB C 39 70.474 70.474 70.377 0.097 18463
1481 1 12 . 1 1 39 39 THR H H 39 9.272 9.272 9.068 0.204 18463
1482 1 12 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.441 1.026 18463
1483 1 12 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.624 -5.559 18463
1484 1 12 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.834 6.252 18463
1485 1 12 . 1 1 40 40 CYS H H 40 8.658 8.658 8.798 -0.140 18463
1486 1 12 . 1 1 41 41 SER HA H 41 4.771 4.771 4.920 -0.149 18463
1487 1 12 . 1 1 41 41 SER CB C 41 66.158 66.158 64.278 1.880 18463
1488 1 12 . 1 1 41 41 SER H H 41 8.680 8.680 8.406 0.274 18463
1489 1 13 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.180 -0.209 18463
1490 1 13 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.236 0.806 18463
1491 1 13 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.436 0.884 18463
1492 1 13 . 1 1 2 2 PHE H H 2 8.600 8.600 8.094 0.506 18463
1493 1 13 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.151 -0.278 18463
1494 1 13 . 1 1 3 3 GLY H H 3 8.004 8.004 8.392 -0.388 18463
1495 1 13 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.202 -0.429 18463
1496 1 13 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.552 9.236 18463
1497 1 13 . 1 1 4 4 CYS H H 4 7.575 7.575 7.713 -0.138 18463
1498 1 13 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.441 0.248 18463
1499 1 13 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.714 -0.605 18463
1500 1 13 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.486 2.897 18463
1501 1 13 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.832 1.762 18463
1502 1 13 . 1 1 6 6 GLY H H 6 8.907 8.907 8.446 0.461 18463
1503 1 13 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.986 0.021 18463
1504 1 13 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.587 -0.111 18463
1505 1 13 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.574 -2.309 18463
1506 1 13 . 1 1 7 7 ASP H H 7 8.466 8.466 8.284 0.182 18463
1507 1 13 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.432 -0.435 18463
1508 1 13 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.458 -0.559 18463
1509 1 13 . 1 1 8 8 ALA H H 8 8.560 8.560 8.711 -0.151 18463
1510 1 13 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.041 0.269 18463
1511 1 13 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.769 -1.290 18463
1512 1 13 . 1 1 9 9 TYR H H 9 8.432 8.432 8.863 -0.431 18463
1513 1 13 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.143 -0.199 18463
1514 1 13 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.955 -0.320 18463
1515 1 13 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.379 -0.020 18463
1516 1 13 . 1 1 10 10 GLN H H 10 7.861 7.861 9.088 -1.227 18463
1517 1 13 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.304 0.583 18463
1518 1 13 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.517 -2.959 18463
1519 1 13 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.375 10.499 18463
1520 1 13 . 1 1 11 11 CYS H H 11 7.341 7.341 8.343 -1.002 18463
1521 1 13 . 1 1 12 12 SER N N 12 117.382 117.382 116.572 0.810 18463
1522 1 13 . 1 1 12 12 SER HA H 12 3.692 3.692 3.911 -0.219 18463
1523 1 13 . 1 1 12 12 SER CB C 12 62.945 62.945 62.636 0.309 18463
1524 1 13 . 1 1 12 12 SER H H 12 8.513 8.513 8.132 0.381 18463
1525 1 13 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.734 0.096 18463
1526 1 13 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.483 -0.383 18463
1527 1 13 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.490 -0.190 18463
1528 1 13 . 1 1 13 13 GLU H H 13 8.199 8.199 7.977 0.222 18463
1529 1 13 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.110 0.157 18463
1530 1 13 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.342 -0.707 18463
1531 1 13 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.374 -2.299 18463
1532 1 13 . 1 1 14 14 HIS H H 14 8.250 8.250 8.127 0.123 18463
1533 1 13 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.756 -0.012 18463
1534 1 13 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.666 -2.758 18463
1535 1 13 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.670 13.689 18463
1536 1 13 . 1 1 15 15 CYS H H 15 8.419 8.419 7.880 0.539 18463
1537 1 13 . 1 1 16 16 ARG HA H 16 3.595 3.595 3.900 -0.305 18463
1538 1 13 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.887 1.302 18463
1539 1 13 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.893 0.415 18463
1540 1 13 . 1 1 16 16 ARG H H 16 8.081 8.081 8.321 -0.240 18463
1541 1 13 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.102 -0.023 18463
1542 1 13 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.406 -0.246 18463
1543 1 13 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.248 -0.476 18463
1544 1 13 . 1 1 17 17 ALA H H 17 7.763 7.763 7.982 -0.219 18463
1545 1 13 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.010 -0.003 18463
1546 1 13 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.058 0.315 18463
1547 1 13 . 1 1 18 18 LEU H H 18 7.265 7.265 7.115 0.150 18463
1548 1 13 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.312 0.762 18463
1549 1 13 . 1 1 20 20 GLY H H 20 9.107 9.107 8.694 0.413 18463
1550 1 13 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.761 -0.231 18463
1551 1 13 . 1 1 21 21 GLY H H 21 8.671 8.671 8.118 0.553 18463
1552 1 13 . 1 1 22 22 ARG N N 22 119.872 119.872 121.716 -1.844 18463
1553 1 13 . 1 1 22 22 ARG HA H 22 3.993 3.993 3.977 0.016 18463
1554 1 13 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.873 0.742 18463
1555 1 13 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.792 0.932 18463
1556 1 13 . 1 1 22 22 ARG H H 22 6.965 6.965 7.492 -0.527 18463
1557 1 13 . 1 1 23 23 THR HA H 23 4.277 4.277 4.344 -0.067 18463
1558 1 13 . 1 1 23 23 THR CB C 23 70.344 70.344 69.718 0.626 18463
1559 1 13 . 1 1 23 23 THR H H 23 8.837 8.837 8.264 0.573 18463
1560 1 13 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.181 -0.024 18463
1561 1 13 . 1 1 24 24 GLY H H 24 7.354 7.354 7.285 0.069 18463
1562 1 13 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.142 1.659 18463
1563 1 13 . 1 1 25 25 GLY H H 25 8.054 8.054 7.215 0.839 18463
1564 1 13 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.890 -0.116 18463
1565 1 13 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.639 -2.918 18463
1566 1 13 . 1 1 26 26 TYR H H 26 8.932 8.932 8.980 -0.048 18463
1567 1 13 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.571 -0.383 18463
1568 1 13 . 1 1 27 27 CYS CA C 27 52.852 52.852 58.017 -5.165 18463
1569 1 13 . 1 1 27 27 CYS CB C 27 37.300 37.300 28.878 8.422 18463
1570 1 13 . 1 1 27 27 CYS H H 27 8.753 8.753 8.775 -0.022 18463
1571 1 13 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.766 -0.112 18463
1572 1 13 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.609 -0.006 18463
1573 1 13 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.015 -1.257 18463
1574 1 13 . 1 1 28 28 ALA H H 28 9.122 9.122 9.042 0.080 18463
1575 1 13 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.568 0.140 18463
1576 1 13 . 1 1 29 29 GLY H H 29 8.548 8.548 8.341 0.207 18463
1577 1 13 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.125 0.223 18463
1578 1 13 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.111 -0.271 18463
1579 1 13 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.457 0.343 18463
1580 1 13 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.145 -1.439 18463
1581 1 13 . 1 1 31 31 TRP H H 31 9.002 9.002 8.139 0.863 18463
1582 1 13 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.797 -0.915 18463
1583 1 13 . 1 1 32 32 TYR CA C 32 58.010 58.010 55.340 2.670 18463
1584 1 13 . 1 1 32 32 TYR CB C 32 35.410 35.410 40.062 -4.652 18463
1585 1 13 . 1 1 32 32 TYR H H 32 6.367 6.367 6.741 -0.374 18463
1586 1 13 . 1 1 33 33 LEU HA H 33 4.450 4.450 4.006 0.444 18463
1587 1 13 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.155 -1.467 18463
1588 1 13 . 1 1 33 33 LEU CB C 33 42.778 42.778 41.963 0.815 18463
1589 1 13 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.257 0.554 18463
1590 1 13 . 1 1 34 34 GLY H H 34 7.632 7.632 8.291 -0.659 18463
1591 1 13 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.969 -1.264 18463
1592 1 13 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.965 -4.201 18463
1593 1 13 . 1 1 35 35 HIS H H 35 7.334 7.334 8.381 -1.047 18463
1594 1 13 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.576 -0.702 18463
1595 1 13 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.532 0.540 18463
1596 1 13 . 1 1 37 37 THR HA H 37 4.356 4.356 4.478 -0.121 18463
1597 1 13 . 1 1 37 37 THR CB C 37 69.525 69.525 69.561 -0.036 18463
1598 1 13 . 1 1 37 37 THR H H 37 8.185 8.185 8.191 -0.006 18463
1599 1 13 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.858 0.168 18463
1600 1 13 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.798 -1.748 18463
1601 1 13 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.264 6.657 18463
1602 1 13 . 1 1 38 38 CYS H H 38 9.046 9.046 9.164 -0.118 18463
1603 1 13 . 1 1 39 39 THR HA H 39 4.277 4.277 4.641 -0.364 18463
1604 1 13 . 1 1 39 39 THR CB C 39 70.474 70.474 70.372 0.102 18463
1605 1 13 . 1 1 39 39 THR H H 39 9.272 9.272 9.101 0.171 18463
1606 1 13 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.499 0.968 18463
1607 1 13 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.599 -5.534 18463
1608 1 13 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.979 6.107 18463
1609 1 13 . 1 1 40 40 CYS H H 40 8.658 8.658 8.820 -0.162 18463
1610 1 13 . 1 1 41 41 SER HA H 41 4.771 4.771 4.999 -0.228 18463
1611 1 13 . 1 1 41 41 SER CB C 41 66.158 66.158 64.420 1.738 18463
1612 1 13 . 1 1 41 41 SER H H 41 8.680 8.680 8.523 0.157 18463
1613 1 14 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.133 -0.162 18463
1614 1 14 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.115 0.926 18463
1615 1 14 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.354 0.966 18463
1616 1 14 . 1 1 2 2 PHE H H 2 8.600 8.600 8.146 0.454 18463
1617 1 14 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.173 -0.300 18463
1618 1 14 . 1 1 3 3 GLY H H 3 8.004 8.004 8.317 -0.313 18463
1619 1 14 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.207 -0.434 18463
1620 1 14 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.826 8.961 18463
1621 1 14 . 1 1 4 4 CYS H H 4 7.575 7.575 7.785 -0.210 18463
1622 1 14 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.417 0.272 18463
1623 1 14 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.708 -0.599 18463
1624 1 14 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.314 3.069 18463
1625 1 14 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.901 1.693 18463
1626 1 14 . 1 1 6 6 GLY H H 6 8.907 8.907 8.376 0.531 18463
1627 1 14 . 1 1 7 7 ASP HA H 7 5.007 5.007 5.024 -0.017 18463
1628 1 14 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.617 -0.141 18463
1629 1 14 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.664 -2.399 18463
1630 1 14 . 1 1 7 7 ASP H H 7 8.466 8.466 8.304 0.162 18463
1631 1 14 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.397 -0.400 18463
1632 1 14 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.253 -0.354 18463
1633 1 14 . 1 1 8 8 ALA H H 8 8.560 8.560 8.780 -0.220 18463
1634 1 14 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.052 0.258 18463
1635 1 14 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.734 -1.255 18463
1636 1 14 . 1 1 9 9 TYR H H 9 8.432 8.432 8.835 -0.403 18463
1637 1 14 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.021 -0.077 18463
1638 1 14 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.894 -0.259 18463
1639 1 14 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.425 -0.066 18463
1640 1 14 . 1 1 10 10 GLN H H 10 7.861 7.861 9.031 -1.170 18463
1641 1 14 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.278 0.609 18463
1642 1 14 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.637 -3.079 18463
1643 1 14 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.402 10.472 18463
1644 1 14 . 1 1 11 11 CYS H H 11 7.341 7.341 8.045 -0.704 18463
1645 1 14 . 1 1 12 12 SER N N 12 117.382 117.382 116.563 0.819 18463
1646 1 14 . 1 1 12 12 SER HA H 12 3.692 3.692 3.899 -0.207 18463
1647 1 14 . 1 1 12 12 SER CB C 12 62.945 62.945 62.642 0.302 18463
1648 1 14 . 1 1 12 12 SER H H 12 8.513 8.513 8.172 0.341 18463
1649 1 14 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.729 0.101 18463
1650 1 14 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.407 -0.307 18463
1651 1 14 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.470 -0.170 18463
1652 1 14 . 1 1 13 13 GLU H H 13 8.199 8.199 7.842 0.357 18463
1653 1 14 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.099 0.168 18463
1654 1 14 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.242 -0.607 18463
1655 1 14 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.249 -2.174 18463
1656 1 14 . 1 1 14 14 HIS H H 14 8.250 8.250 8.136 0.114 18463
1657 1 14 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.603 0.141 18463
1658 1 14 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.443 -2.535 18463
1659 1 14 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.580 13.779 18463
1660 1 14 . 1 1 15 15 CYS H H 15 8.419 8.419 7.821 0.598 18463
1661 1 14 . 1 1 16 16 ARG HA H 16 3.595 3.595 3.904 -0.309 18463
1662 1 14 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.858 1.331 18463
1663 1 14 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.871 0.437 18463
1664 1 14 . 1 1 16 16 ARG H H 16 8.081 8.081 8.294 -0.213 18463
1665 1 14 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.095 -0.016 18463
1666 1 14 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.364 -0.204 18463
1667 1 14 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.213 -0.441 18463
1668 1 14 . 1 1 17 17 ALA H H 17 7.763 7.763 7.800 -0.037 18463
1669 1 14 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.033 -0.026 18463
1670 1 14 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.028 0.345 18463
1671 1 14 . 1 1 18 18 LEU H H 18 7.265 7.265 7.054 0.211 18463
1672 1 14 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.210 0.864 18463
1673 1 14 . 1 1 20 20 GLY H H 20 9.107 9.107 8.706 0.401 18463
1674 1 14 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.855 -0.324 18463
1675 1 14 . 1 1 21 21 GLY H H 21 8.671 8.671 8.135 0.536 18463
1676 1 14 . 1 1 22 22 ARG N N 22 119.872 119.872 121.682 -1.810 18463
1677 1 14 . 1 1 22 22 ARG HA H 22 3.993 3.993 4.065 -0.072 18463
1678 1 14 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.895 0.720 18463
1679 1 14 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.815 0.909 18463
1680 1 14 . 1 1 22 22 ARG H H 22 6.965 6.965 7.546 -0.581 18463
1681 1 14 . 1 1 23 23 THR HA H 23 4.277 4.277 4.317 -0.040 18463
1682 1 14 . 1 1 23 23 THR CB C 23 70.344 70.344 69.667 0.677 18463
1683 1 14 . 1 1 23 23 THR H H 23 8.837 8.837 8.207 0.630 18463
1684 1 14 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.174 -0.017 18463
1685 1 14 . 1 1 24 24 GLY H H 24 7.354 7.354 7.330 0.024 18463
1686 1 14 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.120 1.681 18463
1687 1 14 . 1 1 25 25 GLY H H 25 8.054 8.054 7.628 0.426 18463
1688 1 14 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.902 -0.128 18463
1689 1 14 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.618 -2.897 18463
1690 1 14 . 1 1 26 26 TYR H H 26 8.932 8.932 8.976 -0.044 18463
1691 1 14 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.613 -0.425 18463
1692 1 14 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.958 -5.106 18463
1693 1 14 . 1 1 27 27 CYS CB C 27 37.300 37.300 28.870 8.430 18463
1694 1 14 . 1 1 27 27 CYS H H 27 8.753 8.753 8.798 -0.045 18463
1695 1 14 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.448 0.206 18463
1696 1 14 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.473 0.130 18463
1697 1 14 . 1 1 28 28 ALA CB C 28 20.758 20.758 21.881 -1.123 18463
1698 1 14 . 1 1 28 28 ALA H H 28 9.122 9.122 9.085 0.037 18463
1699 1 14 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.336 0.372 18463
1700 1 14 . 1 1 29 29 GLY H H 29 8.548 8.548 8.237 0.311 18463
1701 1 14 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.007 0.341 18463
1702 1 14 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.044 -0.204 18463
1703 1 14 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.549 0.251 18463
1704 1 14 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.160 -1.454 18463
1705 1 14 . 1 1 31 31 TRP H H 31 9.002 9.002 7.695 1.307 18463
1706 1 14 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.717 -0.835 18463
1707 1 14 . 1 1 32 32 TYR CA C 32 58.010 58.010 56.206 1.804 18463
1708 1 14 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.407 -3.997 18463
1709 1 14 . 1 1 32 32 TYR H H 32 6.367 6.367 7.080 -0.713 18463
1710 1 14 . 1 1 33 33 LEU HA H 33 4.450 4.450 3.967 0.483 18463
1711 1 14 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.262 -1.574 18463
1712 1 14 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.254 0.524 18463
1713 1 14 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.200 0.610 18463
1714 1 14 . 1 1 34 34 GLY H H 34 7.632 7.632 8.291 -0.659 18463
1715 1 14 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.937 -1.232 18463
1716 1 14 . 1 1 35 35 HIS CB C 35 25.764 25.764 30.193 -4.429 18463
1717 1 14 . 1 1 35 35 HIS H H 35 7.334 7.334 8.336 -1.002 18463
1718 1 14 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.515 -0.641 18463
1719 1 14 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.680 0.392 18463
1720 1 14 . 1 1 37 37 THR HA H 37 4.356 4.356 4.456 -0.100 18463
1721 1 14 . 1 1 37 37 THR CB C 37 69.525 69.525 69.743 -0.218 18463
1722 1 14 . 1 1 37 37 THR H H 37 8.185 8.185 8.149 0.036 18463
1723 1 14 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.901 0.125 18463
1724 1 14 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.869 -1.819 18463
1725 1 14 . 1 1 38 38 CYS CB C 38 34.921 34.921 27.931 6.990 18463
1726 1 14 . 1 1 38 38 CYS H H 38 9.046 9.046 9.161 -0.115 18463
1727 1 14 . 1 1 39 39 THR HA H 39 4.277 4.277 4.691 -0.414 18463
1728 1 14 . 1 1 39 39 THR CB C 39 70.474 70.474 71.371 -0.897 18463
1729 1 14 . 1 1 39 39 THR H H 39 9.272 9.272 9.220 0.052 18463
1730 1 14 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.573 0.894 18463
1731 1 14 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.817 -5.752 18463
1732 1 14 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.772 6.314 18463
1733 1 14 . 1 1 40 40 CYS H H 40 8.658 8.658 8.888 -0.230 18463
1734 1 14 . 1 1 41 41 SER HA H 41 4.771 4.771 4.942 -0.171 18463
1735 1 14 . 1 1 41 41 SER CB C 41 66.158 66.158 64.489 1.669 18463
1736 1 14 . 1 1 41 41 SER H H 41 8.680 8.680 8.488 0.192 18463
1737 1 15 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.196 -0.225 18463
1738 1 15 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.364 0.678 18463
1739 1 15 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.544 0.776 18463
1740 1 15 . 1 1 2 2 PHE H H 2 8.600 8.600 8.137 0.463 18463
1741 1 15 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.246 -0.373 18463
1742 1 15 . 1 1 3 3 GLY H H 3 8.004 8.004 8.415 -0.411 18463
1743 1 15 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.192 -0.419 18463
1744 1 15 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.610 9.177 18463
1745 1 15 . 1 1 4 4 CYS H H 4 7.575 7.575 7.686 -0.111 18463
1746 1 15 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.442 0.247 18463
1747 1 15 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.662 -0.553 18463
1748 1 15 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.591 2.792 18463
1749 1 15 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.844 1.750 18463
1750 1 15 . 1 1 6 6 GLY H H 6 8.907 8.907 8.468 0.439 18463
1751 1 15 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.976 0.031 18463
1752 1 15 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.786 -0.310 18463
1753 1 15 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.825 -2.560 18463
1754 1 15 . 1 1 7 7 ASP H H 7 8.466 8.466 8.336 0.130 18463
1755 1 15 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.328 -0.331 18463
1756 1 15 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.124 -0.225 18463
1757 1 15 . 1 1 8 8 ALA H H 8 8.560 8.560 8.687 -0.127 18463
1758 1 15 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.031 0.279 18463
1759 1 15 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.782 -1.303 18463
1760 1 15 . 1 1 9 9 TYR H H 9 8.432 8.432 8.938 -0.506 18463
1761 1 15 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.187 -0.243 18463
1762 1 15 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.786 -0.151 18463
1763 1 15 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.442 -0.083 18463
1764 1 15 . 1 1 10 10 GLN H H 10 7.861 7.861 8.315 -0.454 18463
1765 1 15 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.292 0.595 18463
1766 1 15 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.531 -2.973 18463
1767 1 15 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.428 10.446 18463
1768 1 15 . 1 1 11 11 CYS H H 11 7.341 7.341 8.212 -0.871 18463
1769 1 15 . 1 1 12 12 SER N N 12 117.382 117.382 116.777 0.605 18463
1770 1 15 . 1 1 12 12 SER HA H 12 3.692 3.692 3.916 -0.224 18463
1771 1 15 . 1 1 12 12 SER CB C 12 62.945 62.945 62.659 0.286 18463
1772 1 15 . 1 1 12 12 SER H H 12 8.513 8.513 8.311 0.202 18463
1773 1 15 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.717 0.113 18463
1774 1 15 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.327 -0.227 18463
1775 1 15 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.440 -0.140 18463
1776 1 15 . 1 1 13 13 GLU H H 13 8.199 8.199 7.852 0.347 18463
1777 1 15 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.044 0.223 18463
1778 1 15 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.222 -0.587 18463
1779 1 15 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.177 -2.102 18463
1780 1 15 . 1 1 14 14 HIS H H 14 8.250 8.250 8.098 0.152 18463
1781 1 15 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.696 0.048 18463
1782 1 15 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.467 -2.558 18463
1783 1 15 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.661 13.698 18463
1784 1 15 . 1 1 15 15 CYS H H 15 8.419 8.419 7.918 0.501 18463
1785 1 15 . 1 1 16 16 ARG HA H 16 3.595 3.595 4.031 -0.436 18463
1786 1 15 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.830 1.359 18463
1787 1 15 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.878 0.430 18463
1788 1 15 . 1 1 16 16 ARG H H 16 8.081 8.081 8.306 -0.225 18463
1789 1 15 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.095 -0.016 18463
1790 1 15 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.318 -0.158 18463
1791 1 15 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.251 -0.479 18463
1792 1 15 . 1 1 17 17 ALA H H 17 7.763 7.763 7.824 -0.061 18463
1793 1 15 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.044 -0.037 18463
1794 1 15 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.035 0.338 18463
1795 1 15 . 1 1 18 18 LEU H H 18 7.265 7.265 7.040 0.225 18463
1796 1 15 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.254 0.820 18463
1797 1 15 . 1 1 20 20 GLY H H 20 9.107 9.107 8.680 0.427 18463
1798 1 15 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.832 -0.301 18463
1799 1 15 . 1 1 21 21 GLY H H 21 8.671 8.671 8.142 0.529 18463
1800 1 15 . 1 1 22 22 ARG N N 22 119.872 119.872 121.698 -1.826 18463
1801 1 15 . 1 1 22 22 ARG HA H 22 3.993 3.993 3.819 0.174 18463
1802 1 15 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.894 0.721 18463
1803 1 15 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.659 1.065 18463
1804 1 15 . 1 1 22 22 ARG H H 22 6.965 6.965 7.447 -0.482 18463
1805 1 15 . 1 1 23 23 THR HA H 23 4.277 4.277 4.333 -0.056 18463
1806 1 15 . 1 1 23 23 THR CB C 23 70.344 70.344 69.745 0.600 18463
1807 1 15 . 1 1 23 23 THR H H 23 8.837 8.837 8.169 0.668 18463
1808 1 15 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.114 0.043 18463
1809 1 15 . 1 1 24 24 GLY H H 24 7.354 7.354 7.264 0.090 18463
1810 1 15 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.080 1.721 18463
1811 1 15 . 1 1 25 25 GLY H H 25 8.054 8.054 7.673 0.381 18463
1812 1 15 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.961 -0.187 18463
1813 1 15 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.272 -2.551 18463
1814 1 15 . 1 1 26 26 TYR H H 26 8.932 8.932 8.991 -0.059 18463
1815 1 15 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.655 -0.467 18463
1816 1 15 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.834 -4.981 18463
1817 1 15 . 1 1 27 27 CYS CB C 27 37.300 37.300 29.512 7.788 18463
1818 1 15 . 1 1 27 27 CYS H H 27 8.753 8.753 8.698 0.055 18463
1819 1 15 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.951 -0.297 18463
1820 1 15 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.531 0.072 18463
1821 1 15 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.203 -1.445 18463
1822 1 15 . 1 1 28 28 ALA H H 28 9.122 9.122 9.169 -0.047 18463
1823 1 15 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.503 0.205 18463
1824 1 15 . 1 1 29 29 GLY H H 29 8.548 8.548 8.359 0.189 18463
1825 1 15 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.361 -0.013 18463
1826 1 15 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.305 -0.465 18463
1827 1 15 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.455 0.345 18463
1828 1 15 . 1 1 31 31 TRP CB C 31 27.706 27.706 28.906 -1.200 18463
1829 1 15 . 1 1 31 31 TRP H H 31 9.002 9.002 8.539 0.463 18463
1830 1 15 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.708 -0.826 18463
1831 1 15 . 1 1 32 32 TYR CA C 32 58.010 58.010 55.500 2.510 18463
1832 1 15 . 1 1 32 32 TYR CB C 32 35.410 35.410 40.055 -4.645 18463
1833 1 15 . 1 1 32 32 TYR H H 32 6.367 6.367 7.156 -0.789 18463
1834 1 15 . 1 1 33 33 LEU HA H 33 4.450 4.450 3.960 0.490 18463
1835 1 15 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.109 -1.421 18463
1836 1 15 . 1 1 33 33 LEU CB C 33 42.778 42.778 41.760 1.018 18463
1837 1 15 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.190 0.620 18463
1838 1 15 . 1 1 34 34 GLY H H 34 7.632 7.632 8.210 -0.578 18463
1839 1 15 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.972 -1.267 18463
1840 1 15 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.755 -3.991 18463
1841 1 15 . 1 1 35 35 HIS H H 35 7.334 7.334 8.461 -1.127 18463
1842 1 15 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.576 -0.702 18463
1843 1 15 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.430 0.642 18463
1844 1 15 . 1 1 37 37 THR HA H 37 4.356 4.356 4.387 -0.031 18463
1845 1 15 . 1 1 37 37 THR CB C 37 69.525 69.525 69.295 0.230 18463
1846 1 15 . 1 1 37 37 THR H H 37 8.185 8.185 8.071 0.114 18463
1847 1 15 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.926 0.100 18463
1848 1 15 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.733 -1.683 18463
1849 1 15 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.556 6.365 18463
1850 1 15 . 1 1 38 38 CYS H H 38 9.046 9.046 9.091 -0.045 18463
1851 1 15 . 1 1 39 39 THR HA H 39 4.277 4.277 4.649 -0.372 18463
1852 1 15 . 1 1 39 39 THR CB C 39 70.474 70.474 70.490 -0.016 18463
1853 1 15 . 1 1 39 39 THR H H 39 9.272 9.272 9.060 0.212 18463
1854 1 15 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.484 0.983 18463
1855 1 15 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.633 -5.568 18463
1856 1 15 . 1 1 40 40 CYS CB C 40 35.086 35.086 29.023 6.063 18463
1857 1 15 . 1 1 40 40 CYS H H 40 8.658 8.658 8.825 -0.167 18463
1858 1 15 . 1 1 41 41 SER HA H 41 4.771 4.771 4.988 -0.217 18463
1859 1 15 . 1 1 41 41 SER CB C 41 66.158 66.158 64.393 1.765 18463
1860 1 15 . 1 1 41 41 SER H H 41 8.680 8.680 8.482 0.198 18463
1861 1 16 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.163 -0.192 18463
1862 1 16 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.192 0.850 18463
1863 1 16 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.504 0.816 18463
1864 1 16 . 1 1 2 2 PHE H H 2 8.600 8.600 8.161 0.439 18463
1865 1 16 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.084 -0.211 18463
1866 1 16 . 1 1 3 3 GLY H H 3 8.004 8.004 8.259 -0.255 18463
1867 1 16 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.159 -0.386 18463
1868 1 16 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.172 9.614 18463
1869 1 16 . 1 1 4 4 CYS H H 4 7.575 7.575 7.698 -0.123 18463
1870 1 16 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.482 0.207 18463
1871 1 16 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.453 -0.343 18463
1872 1 16 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.600 2.783 18463
1873 1 16 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.822 1.772 18463
1874 1 16 . 1 1 6 6 GLY H H 6 8.907 8.907 8.506 0.401 18463
1875 1 16 . 1 1 7 7 ASP HA H 7 5.007 5.007 5.010 -0.003 18463
1876 1 16 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.609 -0.133 18463
1877 1 16 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.565 -2.300 18463
1878 1 16 . 1 1 7 7 ASP H H 7 8.466 8.466 8.294 0.172 18463
1879 1 16 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.390 -0.393 18463
1880 1 16 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.238 -0.339 18463
1881 1 16 . 1 1 8 8 ALA H H 8 8.560 8.560 8.768 -0.208 18463
1882 1 16 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.062 0.248 18463
1883 1 16 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.764 -1.285 18463
1884 1 16 . 1 1 9 9 TYR H H 9 8.432 8.432 8.838 -0.406 18463
1885 1 16 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.027 -0.083 18463
1886 1 16 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.876 -0.241 18463
1887 1 16 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.428 -0.069 18463
1888 1 16 . 1 1 10 10 GLN H H 10 7.861 7.861 9.078 -1.217 18463
1889 1 16 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.303 0.584 18463
1890 1 16 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.589 -3.030 18463
1891 1 16 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.362 10.512 18463
1892 1 16 . 1 1 11 11 CYS H H 11 7.341 7.341 8.223 -0.882 18463
1893 1 16 . 1 1 12 12 SER N N 12 117.382 117.382 116.636 0.746 18463
1894 1 16 . 1 1 12 12 SER HA H 12 3.692 3.692 3.931 -0.239 18463
1895 1 16 . 1 1 12 12 SER CB C 12 62.945 62.945 62.685 0.260 18463
1896 1 16 . 1 1 12 12 SER H H 12 8.513 8.513 8.192 0.321 18463
1897 1 16 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.732 0.098 18463
1898 1 16 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.437 -0.337 18463
1899 1 16 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.477 -0.177 18463
1900 1 16 . 1 1 13 13 GLU H H 13 8.199 8.199 7.997 0.202 18463
1901 1 16 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.066 0.201 18463
1902 1 16 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.279 -0.644 18463
1903 1 16 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.278 -2.203 18463
1904 1 16 . 1 1 14 14 HIS H H 14 8.250 8.250 8.204 0.046 18463
1905 1 16 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.702 0.042 18463
1906 1 16 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.543 -2.635 18463
1907 1 16 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.652 13.707 18463
1908 1 16 . 1 1 15 15 CYS H H 15 8.419 8.419 7.873 0.546 18463
1909 1 16 . 1 1 16 16 ARG HA H 16 3.595 3.595 4.044 -0.449 18463
1910 1 16 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.877 1.312 18463
1911 1 16 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.874 0.434 18463
1912 1 16 . 1 1 16 16 ARG H H 16 8.081 8.081 8.238 -0.157 18463
1913 1 16 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.087 -0.008 18463
1914 1 16 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.389 -0.229 18463
1915 1 16 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.210 -0.438 18463
1916 1 16 . 1 1 17 17 ALA H H 17 7.763 7.763 7.867 -0.104 18463
1917 1 16 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.019 -0.012 18463
1918 1 16 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.016 0.357 18463
1919 1 16 . 1 1 18 18 LEU H H 18 7.265 7.265 7.005 0.260 18463
1920 1 16 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.307 0.767 18463
1921 1 16 . 1 1 20 20 GLY H H 20 9.107 9.107 8.700 0.407 18463
1922 1 16 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.797 -0.266 18463
1923 1 16 . 1 1 21 21 GLY H H 21 8.671 8.671 8.117 0.554 18463
1924 1 16 . 1 1 22 22 ARG N N 22 119.872 119.872 121.786 -1.914 18463
1925 1 16 . 1 1 22 22 ARG HA H 22 3.993 3.993 4.022 -0.029 18463
1926 1 16 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.850 0.765 18463
1927 1 16 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.767 0.957 18463
1928 1 16 . 1 1 22 22 ARG H H 22 6.965 6.965 7.521 -0.556 18463
1929 1 16 . 1 1 23 23 THR HA H 23 4.277 4.277 4.313 -0.036 18463
1930 1 16 . 1 1 23 23 THR CB C 23 70.344 70.344 69.635 0.709 18463
1931 1 16 . 1 1 23 23 THR H H 23 8.837 8.837 8.127 0.710 18463
1932 1 16 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.182 -0.025 18463
1933 1 16 . 1 1 24 24 GLY H H 24 7.354 7.354 7.205 0.149 18463
1934 1 16 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.059 1.742 18463
1935 1 16 . 1 1 25 25 GLY H H 25 8.054 8.054 7.741 0.313 18463
1936 1 16 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.952 -0.178 18463
1937 1 16 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.332 -2.611 18463
1938 1 16 . 1 1 26 26 TYR H H 26 8.932 8.932 8.962 -0.030 18463
1939 1 16 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.618 -0.430 18463
1940 1 16 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.775 -4.923 18463
1941 1 16 . 1 1 27 27 CYS CB C 27 37.300 37.300 29.333 7.967 18463
1942 1 16 . 1 1 27 27 CYS H H 27 8.753 8.753 8.688 0.065 18463
1943 1 16 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.705 -0.051 18463
1944 1 16 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.207 0.396 18463
1945 1 16 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.153 -1.395 18463
1946 1 16 . 1 1 28 28 ALA H H 28 9.122 9.122 9.130 -0.008 18463
1947 1 16 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.590 0.117 18463
1948 1 16 . 1 1 29 29 GLY H H 29 8.548 8.548 8.340 0.208 18463
1949 1 16 . 1 1 30 30 PRO HA H 30 4.348 4.348 3.990 0.358 18463
1950 1 16 . 1 1 30 30 PRO CB C 30 31.840 31.840 31.968 -0.128 18463
1951 1 16 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.533 0.267 18463
1952 1 16 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.044 -1.338 18463
1953 1 16 . 1 1 31 31 TRP H H 31 9.002 9.002 7.588 1.414 18463
1954 1 16 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.688 -0.806 18463
1955 1 16 . 1 1 32 32 TYR CA C 32 58.010 58.010 56.161 1.849 18463
1956 1 16 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.294 -3.884 18463
1957 1 16 . 1 1 32 32 TYR H H 32 6.367 6.367 7.019 -0.652 18463
1958 1 16 . 1 1 33 33 LEU HA H 33 4.450 4.450 3.994 0.456 18463
1959 1 16 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.222 -1.534 18463
1960 1 16 . 1 1 33 33 LEU CB C 33 42.778 42.778 41.997 0.781 18463
1961 1 16 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.332 0.478 18463
1962 1 16 . 1 1 34 34 GLY H H 34 7.632 7.632 8.299 -0.667 18463
1963 1 16 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.960 -1.255 18463
1964 1 16 . 1 1 35 35 HIS CB C 35 25.764 25.764 30.123 -4.359 18463
1965 1 16 . 1 1 35 35 HIS H H 35 7.334 7.334 8.334 -1.000 18463
1966 1 16 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.498 -0.624 18463
1967 1 16 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.647 0.425 18463
1968 1 16 . 1 1 37 37 THR HA H 37 4.356 4.356 4.465 -0.109 18463
1969 1 16 . 1 1 37 37 THR CB C 37 69.525 69.525 69.116 0.409 18463
1970 1 16 . 1 1 37 37 THR H H 37 8.185 8.185 8.234 -0.049 18463
1971 1 16 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.871 0.155 18463
1972 1 16 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.835 -1.785 18463
1973 1 16 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.232 6.689 18463
1974 1 16 . 1 1 38 38 CYS H H 38 9.046 9.046 9.124 -0.078 18463
1975 1 16 . 1 1 39 39 THR HA H 39 4.277 4.277 4.627 -0.350 18463
1976 1 16 . 1 1 39 39 THR CB C 39 70.474 70.474 70.580 -0.106 18463
1977 1 16 . 1 1 39 39 THR H H 39 9.272 9.272 9.055 0.217 18463
1978 1 16 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.545 0.922 18463
1979 1 16 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.642 -5.577 18463
1980 1 16 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.831 6.255 18463
1981 1 16 . 1 1 40 40 CYS H H 40 8.658 8.658 8.794 -0.136 18463
1982 1 16 . 1 1 41 41 SER HA H 41 4.771 4.771 4.948 -0.177 18463
1983 1 16 . 1 1 41 41 SER CB C 41 66.158 66.158 64.378 1.780 18463
1984 1 16 . 1 1 41 41 SER H H 41 8.680 8.680 8.446 0.234 18463
1985 1 17 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.191 -0.220 18463
1986 1 17 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.217 0.825 18463
1987 1 17 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.420 0.900 18463
1988 1 17 . 1 1 2 2 PHE H H 2 8.600 8.600 8.105 0.495 18463
1989 1 17 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.135 -0.262 18463
1990 1 17 . 1 1 3 3 GLY H H 3 8.004 8.004 8.406 -0.402 18463
1991 1 17 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.198 -0.425 18463
1992 1 17 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.636 9.151 18463
1993 1 17 . 1 1 4 4 CYS H H 4 7.575 7.575 7.750 -0.175 18463
1994 1 17 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.432 0.257 18463
1995 1 17 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.707 -0.598 18463
1996 1 17 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.291 3.092 18463
1997 1 17 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.865 1.729 18463
1998 1 17 . 1 1 6 6 GLY H H 6 8.907 8.907 8.304 0.603 18463
1999 1 17 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.991 0.016 18463
2000 1 17 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.544 -0.067 18463
2001 1 17 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.521 -2.256 18463
2002 1 17 . 1 1 7 7 ASP H H 7 8.466 8.466 8.284 0.182 18463
2003 1 17 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.417 -0.420 18463
2004 1 17 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.320 -0.421 18463
2005 1 17 . 1 1 8 8 ALA H H 8 8.560 8.560 8.747 -0.187 18463
2006 1 17 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.042 0.268 18463
2007 1 17 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.783 -1.304 18463
2008 1 17 . 1 1 9 9 TYR H H 9 8.432 8.432 8.869 -0.437 18463
2009 1 17 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.057 -0.113 18463
2010 1 17 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.849 -0.214 18463
2011 1 17 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.428 -0.069 18463
2012 1 17 . 1 1 10 10 GLN H H 10 7.861 7.861 9.104 -1.243 18463
2013 1 17 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.290 0.597 18463
2014 1 17 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.588 -3.030 18463
2015 1 17 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.355 10.519 18463
2016 1 17 . 1 1 11 11 CYS H H 11 7.341 7.341 8.288 -0.947 18463
2017 1 17 . 1 1 12 12 SER N N 12 117.382 117.382 116.504 0.878 18463
2018 1 17 . 1 1 12 12 SER HA H 12 3.692 3.692 3.932 -0.240 18463
2019 1 17 . 1 1 12 12 SER CB C 12 62.945 62.945 62.678 0.267 18463
2020 1 17 . 1 1 12 12 SER H H 12 8.513 8.513 8.146 0.367 18463
2021 1 17 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.703 0.127 18463
2022 1 17 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.366 -0.266 18463
2023 1 17 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.420 -0.120 18463
2024 1 17 . 1 1 13 13 GLU H H 13 8.199 8.199 7.870 0.329 18463
2025 1 17 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.103 0.164 18463
2026 1 17 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.311 -0.676 18463
2027 1 17 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.317 -2.242 18463
2028 1 17 . 1 1 14 14 HIS H H 14 8.250 8.250 8.233 0.017 18463
2029 1 17 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.693 0.051 18463
2030 1 17 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.569 -2.660 18463
2031 1 17 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.613 13.746 18463
2032 1 17 . 1 1 15 15 CYS H H 15 8.419 8.419 7.774 0.645 18463
2033 1 17 . 1 1 16 16 ARG HA H 16 3.595 3.595 3.900 -0.305 18463
2034 1 17 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.917 1.272 18463
2035 1 17 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.872 0.436 18463
2036 1 17 . 1 1 16 16 ARG H H 16 8.081 8.081 8.331 -0.249 18463
2037 1 17 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.082 -0.003 18463
2038 1 17 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.431 -0.271 18463
2039 1 17 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.205 -0.433 18463
2040 1 17 . 1 1 17 17 ALA H H 17 7.763 7.763 7.877 -0.114 18463
2041 1 17 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.013 -0.006 18463
2042 1 17 . 1 1 18 18 LEU CB C 18 42.373 42.373 41.994 0.379 18463
2043 1 17 . 1 1 18 18 LEU H H 18 7.265 7.265 6.984 0.281 18463
2044 1 17 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.290 0.784 18463
2045 1 17 . 1 1 20 20 GLY H H 20 9.107 9.107 8.700 0.407 18463
2046 1 17 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.790 -0.259 18463
2047 1 17 . 1 1 21 21 GLY H H 21 8.671 8.671 8.113 0.558 18463
2048 1 17 . 1 1 22 22 ARG N N 22 119.872 119.872 121.788 -1.916 18463
2049 1 17 . 1 1 22 22 ARG HA H 22 3.993 3.993 4.069 -0.076 18463
2050 1 17 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.747 0.868 18463
2051 1 17 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.852 0.872 18463
2052 1 17 . 1 1 22 22 ARG H H 22 6.965 6.965 7.555 -0.590 18463
2053 1 17 . 1 1 23 23 THR HA H 23 4.277 4.277 4.257 0.020 18463
2054 1 17 . 1 1 23 23 THR CB C 23 70.344 70.344 69.577 0.767 18463
2055 1 17 . 1 1 23 23 THR H H 23 8.837 8.837 8.228 0.609 18463
2056 1 17 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.132 0.025 18463
2057 1 17 . 1 1 24 24 GLY H H 24 7.354 7.354 7.188 0.166 18463
2058 1 17 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.112 1.689 18463
2059 1 17 . 1 1 25 25 GLY H H 25 8.054 8.054 7.698 0.356 18463
2060 1 17 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.938 -0.164 18463
2061 1 17 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.459 -2.738 18463
2062 1 17 . 1 1 26 26 TYR H H 26 8.932 8.932 8.923 0.009 18463
2063 1 17 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.513 -0.325 18463
2064 1 17 . 1 1 27 27 CYS CA C 27 52.852 52.852 58.142 -5.290 18463
2065 1 17 . 1 1 27 27 CYS CB C 27 37.300 37.300 28.292 9.008 18463
2066 1 17 . 1 1 27 27 CYS H H 27 8.753 8.753 8.809 -0.056 18463
2067 1 17 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.621 0.033 18463
2068 1 17 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.499 0.104 18463
2069 1 17 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.042 -1.284 18463
2070 1 17 . 1 1 28 28 ALA H H 28 9.122 9.122 9.092 0.030 18463
2071 1 17 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.442 0.266 18463
2072 1 17 . 1 1 29 29 GLY H H 29 8.548 8.548 8.306 0.242 18463
2073 1 17 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.235 0.113 18463
2074 1 17 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.193 -0.353 18463
2075 1 17 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.456 0.344 18463
2076 1 17 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.233 -1.527 18463
2077 1 17 . 1 1 31 31 TRP H H 31 9.002 9.002 8.209 0.793 18463
2078 1 17 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.824 -0.942 18463
2079 1 17 . 1 1 32 32 TYR CA C 32 58.010 58.010 55.367 2.643 18463
2080 1 17 . 1 1 32 32 TYR CB C 32 35.410 35.410 40.193 -4.783 18463
2081 1 17 . 1 1 32 32 TYR H H 32 6.367 6.367 6.804 -0.437 18463
2082 1 17 . 1 1 33 33 LEU HA H 33 4.450 4.450 4.007 0.443 18463
2083 1 17 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.037 -1.349 18463
2084 1 17 . 1 1 33 33 LEU CB C 33 42.778 42.778 42.022 0.756 18463
2085 1 17 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.252 0.559 18463
2086 1 17 . 1 1 34 34 GLY H H 34 7.632 7.632 8.318 -0.686 18463
2087 1 17 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.962 -1.257 18463
2088 1 17 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.983 -4.219 18463
2089 1 17 . 1 1 35 35 HIS H H 35 7.334 7.334 8.329 -0.995 18463
2090 1 17 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.550 -0.676 18463
2091 1 17 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.548 0.524 18463
2092 1 17 . 1 1 37 37 THR HA H 37 4.356 4.356 4.445 -0.089 18463
2093 1 17 . 1 1 37 37 THR CB C 37 69.525 69.525 69.201 0.324 18463
2094 1 17 . 1 1 37 37 THR H H 37 8.185 8.185 8.086 0.099 18463
2095 1 17 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.851 0.175 18463
2096 1 17 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.805 -1.755 18463
2097 1 17 . 1 1 38 38 CYS CB C 38 34.921 34.921 27.977 6.944 18463
2098 1 17 . 1 1 38 38 CYS H H 38 9.046 9.046 9.163 -0.117 18463
2099 1 17 . 1 1 39 39 THR HA H 39 4.277 4.277 4.638 -0.361 18463
2100 1 17 . 1 1 39 39 THR CB C 39 70.474 70.474 70.306 0.168 18463
2101 1 17 . 1 1 39 39 THR H H 39 9.272 9.272 9.102 0.170 18463
2102 1 17 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.549 0.918 18463
2103 1 17 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.667 -5.602 18463
2104 1 17 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.757 6.329 18463
2105 1 17 . 1 1 40 40 CYS H H 40 8.658 8.658 8.813 -0.155 18463
2106 1 17 . 1 1 41 41 SER HA H 41 4.771 4.771 4.972 -0.201 18463
2107 1 17 . 1 1 41 41 SER CB C 41 66.158 66.158 64.393 1.765 18463
2108 1 17 . 1 1 41 41 SER H H 41 8.680 8.680 8.515 0.165 18463
2109 1 18 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.141 -0.170 18463
2110 1 18 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.301 0.741 18463
2111 1 18 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.440 0.881 18463
2112 1 18 . 1 1 2 2 PHE H H 2 8.600 8.600 8.091 0.509 18463
2113 1 18 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.068 -0.195 18463
2114 1 18 . 1 1 3 3 GLY H H 3 8.004 8.004 8.420 -0.416 18463
2115 1 18 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.063 -0.290 18463
2116 1 18 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.341 9.446 18463
2117 1 18 . 1 1 4 4 CYS H H 4 7.575 7.575 7.746 -0.171 18463
2118 1 18 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.468 0.221 18463
2119 1 18 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.816 -0.707 18463
2120 1 18 . 1 1 5 5 PRO CB C 5 35.383 35.383 31.781 3.602 18463
2121 1 18 . 1 1 6 6 GLY CA C 6 46.594 46.594 45.439 1.155 18463
2122 1 18 . 1 1 6 6 GLY H H 6 8.907 8.907 8.222 0.685 18463
2123 1 18 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.936 0.071 18463
2124 1 18 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.597 -0.121 18463
2125 1 18 . 1 1 7 7 ASP CB C 7 40.265 40.265 40.462 -0.197 18463
2126 1 18 . 1 1 7 7 ASP H H 7 8.466 8.466 8.050 0.416 18463
2127 1 18 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.146 -0.149 18463
2128 1 18 . 1 1 8 8 ALA CB C 8 18.899 18.899 18.937 -0.038 18463
2129 1 18 . 1 1 8 8 ALA H H 8 8.560 8.560 8.337 0.223 18463
2130 1 18 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.066 0.244 18463
2131 1 18 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.750 -1.271 18463
2132 1 18 . 1 1 9 9 TYR H H 9 8.432 8.432 8.641 -0.209 18463
2133 1 18 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.100 -0.156 18463
2134 1 18 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.815 -0.180 18463
2135 1 18 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.466 -0.107 18463
2136 1 18 . 1 1 10 10 GLN H H 10 7.861 7.861 8.407 -0.546 18463
2137 1 18 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.250 0.637 18463
2138 1 18 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.833 -3.275 18463
2139 1 18 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.445 10.430 18463
2140 1 18 . 1 1 11 11 CYS H H 11 7.341 7.341 7.756 -0.415 18463
2141 1 18 . 1 1 12 12 SER N N 12 117.382 117.382 116.500 0.882 18463
2142 1 18 . 1 1 12 12 SER HA H 12 3.692 3.692 3.875 -0.183 18463
2143 1 18 . 1 1 12 12 SER CB C 12 62.945 62.945 62.587 0.359 18463
2144 1 18 . 1 1 12 12 SER H H 12 8.513 8.513 8.046 0.467 18463
2145 1 18 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.729 0.101 18463
2146 1 18 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.437 -0.337 18463
2147 1 18 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.487 -0.187 18463
2148 1 18 . 1 1 13 13 GLU H H 13 8.199 8.199 7.942 0.257 18463
2149 1 18 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.122 0.145 18463
2150 1 18 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.273 -0.638 18463
2151 1 18 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.361 -2.286 18463
2152 1 18 . 1 1 14 14 HIS H H 14 8.250 8.250 8.076 0.174 18463
2153 1 18 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.685 0.059 18463
2154 1 18 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.545 -2.637 18463
2155 1 18 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.601 13.758 18463
2156 1 18 . 1 1 15 15 CYS H H 15 8.419 8.419 7.955 0.464 18463
2157 1 18 . 1 1 16 16 ARG HA H 16 3.595 3.595 4.061 -0.466 18463
2158 1 18 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.913 1.276 18463
2159 1 18 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.876 0.432 18463
2160 1 18 . 1 1 16 16 ARG H H 16 8.081 8.081 8.312 -0.231 18463
2161 1 18 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.090 -0.011 18463
2162 1 18 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.382 -0.222 18463
2163 1 18 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.215 -0.443 18463
2164 1 18 . 1 1 17 17 ALA H H 17 7.763 7.763 7.750 0.013 18463
2165 1 18 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.024 -0.017 18463
2166 1 18 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.028 0.345 18463
2167 1 18 . 1 1 18 18 LEU H H 18 7.265 7.265 6.997 0.268 18463
2168 1 18 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.327 0.747 18463
2169 1 18 . 1 1 20 20 GLY H H 20 9.107 9.107 8.695 0.412 18463
2170 1 18 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.819 -0.288 18463
2171 1 18 . 1 1 21 21 GLY H H 21 8.671 8.671 8.127 0.544 18463
2172 1 18 . 1 1 22 22 ARG N N 22 119.872 119.872 121.775 -1.903 18463
2173 1 18 . 1 1 22 22 ARG HA H 22 3.993 3.993 4.087 -0.094 18463
2174 1 18 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.813 0.802 18463
2175 1 18 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.819 0.905 18463
2176 1 18 . 1 1 22 22 ARG H H 22 6.965 6.965 7.512 -0.547 18463
2177 1 18 . 1 1 23 23 THR HA H 23 4.277 4.277 4.316 -0.039 18463
2178 1 18 . 1 1 23 23 THR CB C 23 70.344 70.344 69.694 0.650 18463
2179 1 18 . 1 1 23 23 THR H H 23 8.837 8.837 8.165 0.672 18463
2180 1 18 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.191 -0.035 18463
2181 1 18 . 1 1 24 24 GLY H H 24 7.354 7.354 7.262 0.092 18463
2182 1 18 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.227 1.573 18463
2183 1 18 . 1 1 25 25 GLY H H 25 8.054 8.054 7.629 0.425 18463
2184 1 18 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.892 -0.118 18463
2185 1 18 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.808 -3.087 18463
2186 1 18 . 1 1 26 26 TYR H H 26 8.932 8.932 8.924 0.008 18463
2187 1 18 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.687 -0.499 18463
2188 1 18 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.857 -5.005 18463
2189 1 18 . 1 1 27 27 CYS CB C 27 37.300 37.300 29.465 7.835 18463
2190 1 18 . 1 1 27 27 CYS H H 27 8.753 8.753 8.746 0.007 18463
2191 1 18 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.816 -0.162 18463
2192 1 18 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.600 0.003 18463
2193 1 18 . 1 1 28 28 ALA CB C 28 20.758 20.758 21.932 -1.174 18463
2194 1 18 . 1 1 28 28 ALA H H 28 9.122 9.122 9.089 0.033 18463
2195 1 18 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.403 0.305 18463
2196 1 18 . 1 1 29 29 GLY H H 29 8.548 8.548 8.301 0.247 18463
2197 1 18 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.046 0.302 18463
2198 1 18 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.077 -0.237 18463
2199 1 18 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.449 0.351 18463
2200 1 18 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.081 -1.375 18463
2201 1 18 . 1 1 31 31 TRP H H 31 9.002 9.002 7.954 1.048 18463
2202 1 18 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.799 -0.917 18463
2203 1 18 . 1 1 32 32 TYR CA C 32 58.010 58.010 55.382 2.628 18463
2204 1 18 . 1 1 32 32 TYR CB C 32 35.410 35.410 40.172 -4.762 18463
2205 1 18 . 1 1 32 32 TYR H H 32 6.367 6.367 6.776 -0.409 18463
2206 1 18 . 1 1 33 33 LEU HA H 33 4.450 4.450 3.976 0.474 18463
2207 1 18 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.565 -1.877 18463
2208 1 18 . 1 1 33 33 LEU CB C 33 42.778 42.778 41.448 1.330 18463
2209 1 18 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.354 0.456 18463
2210 1 18 . 1 1 34 34 GLY H H 34 7.632 7.632 8.124 -0.492 18463
2211 1 18 . 1 1 35 35 HIS HA H 35 3.705 3.705 5.007 -1.302 18463
2212 1 18 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.788 -4.024 18463
2213 1 18 . 1 1 35 35 HIS H H 35 7.334 7.334 8.329 -0.995 18463
2214 1 18 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.376 -0.502 18463
2215 1 18 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.918 0.154 18463
2216 1 18 . 1 1 37 37 THR HA H 37 4.356 4.356 4.393 -0.037 18463
2217 1 18 . 1 1 37 37 THR CB C 37 69.525 69.525 69.227 0.298 18463
2218 1 18 . 1 1 37 37 THR H H 37 8.185 8.185 8.036 0.149 18463
2219 1 18 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.772 0.254 18463
2220 1 18 . 1 1 38 38 CYS CA C 38 57.050 57.050 59.119 -2.069 18463
2221 1 18 . 1 1 38 38 CYS CB C 38 34.921 34.921 27.811 7.110 18463
2222 1 18 . 1 1 38 38 CYS H H 38 9.046 9.046 9.149 -0.103 18463
2223 1 18 . 1 1 39 39 THR HA H 39 4.277 4.277 4.697 -0.420 18463
2224 1 18 . 1 1 39 39 THR CB C 39 70.474 70.474 71.622 -1.148 18463
2225 1 18 . 1 1 39 39 THR H H 39 9.272 9.272 9.205 0.067 18463
2226 1 18 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.619 0.848 18463
2227 1 18 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.967 -5.902 18463
2228 1 18 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.659 6.427 18463
2229 1 18 . 1 1 40 40 CYS H H 40 8.658 8.658 8.894 -0.236 18463
2230 1 18 . 1 1 41 41 SER HA H 41 4.771 4.771 4.971 -0.200 18463
2231 1 18 . 1 1 41 41 SER CB C 41 66.158 66.158 64.552 1.605 18463
2232 1 18 . 1 1 41 41 SER H H 41 8.680 8.680 8.573 0.107 18463
2233 1 19 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.130 -0.159 18463
2234 1 19 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.209 0.833 18463
2235 1 19 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.294 1.026 18463
2236 1 19 . 1 1 2 2 PHE H H 2 8.600 8.600 8.082 0.518 18463
2237 1 19 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.112 -0.239 18463
2238 1 19 . 1 1 3 3 GLY H H 3 8.004 8.004 8.276 -0.272 18463
2239 1 19 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.153 -0.380 18463
2240 1 19 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.228 9.559 18463
2241 1 19 . 1 1 4 4 CYS H H 4 7.575 7.575 7.709 -0.134 18463
2242 1 19 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.478 0.211 18463
2243 1 19 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.562 -0.453 18463
2244 1 19 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.596 2.787 18463
2245 1 19 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.833 1.761 18463
2246 1 19 . 1 1 6 6 GLY H H 6 8.907 8.907 8.543 0.364 18463
2247 1 19 . 1 1 7 7 ASP HA H 7 5.007 5.007 5.005 0.002 18463
2248 1 19 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.766 -0.289 18463
2249 1 19 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.661 -2.396 18463
2250 1 19 . 1 1 7 7 ASP H H 7 8.466 8.466 8.255 0.211 18463
2251 1 19 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.374 -0.377 18463
2252 1 19 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.137 -0.239 18463
2253 1 19 . 1 1 8 8 ALA H H 8 8.560 8.560 8.768 -0.208 18463
2254 1 19 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.049 0.261 18463
2255 1 19 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.820 -1.341 18463
2256 1 19 . 1 1 9 9 TYR H H 9 8.432 8.432 8.867 -0.435 18463
2257 1 19 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.189 -0.245 18463
2258 1 19 . 1 1 10 10 GLN CA C 10 58.635 58.635 59.052 -0.417 18463
2259 1 19 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.487 -0.128 18463
2260 1 19 . 1 1 10 10 GLN H H 10 7.861 7.861 8.950 -1.089 18463
2261 1 19 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.295 0.592 18463
2262 1 19 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.539 -2.982 18463
2263 1 19 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.398 10.476 18463
2264 1 19 . 1 1 11 11 CYS H H 11 7.341 7.341 8.112 -0.771 18463
2265 1 19 . 1 1 12 12 SER N N 12 117.382 117.382 116.797 0.585 18463
2266 1 19 . 1 1 12 12 SER HA H 12 3.692 3.692 3.931 -0.239 18463
2267 1 19 . 1 1 12 12 SER CB C 12 62.945 62.945 62.650 0.295 18463
2268 1 19 . 1 1 12 12 SER H H 12 8.513 8.513 8.342 0.171 18463
2269 1 19 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.758 0.072 18463
2270 1 19 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.353 -0.253 18463
2271 1 19 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.515 -0.215 18463
2272 1 19 . 1 1 13 13 GLU H H 13 8.199 8.199 8.068 0.131 18463
2273 1 19 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.134 0.133 18463
2274 1 19 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.340 -0.705 18463
2275 1 19 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.410 -2.335 18463
2276 1 19 . 1 1 14 14 HIS H H 14 8.250 8.250 8.106 0.144 18463
2277 1 19 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.768 -0.024 18463
2278 1 19 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.654 -2.747 18463
2279 1 19 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.639 13.720 18463
2280 1 19 . 1 1 15 15 CYS H H 15 8.419 8.419 8.065 0.354 18463
2281 1 19 . 1 1 16 16 ARG HA H 16 3.595 3.595 4.061 -0.466 18463
2282 1 19 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.896 1.293 18463
2283 1 19 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.901 0.407 18463
2284 1 19 . 1 1 16 16 ARG H H 16 8.081 8.081 8.310 -0.229 18463
2285 1 19 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.118 -0.039 18463
2286 1 19 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.335 -0.175 18463
2287 1 19 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.273 -0.501 18463
2288 1 19 . 1 1 17 17 ALA H H 17 7.763 7.763 7.715 0.048 18463
2289 1 19 . 1 1 18 18 LEU HA H 18 4.007 4.007 3.982 0.025 18463
2290 1 19 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.003 0.370 18463
2291 1 19 . 1 1 18 18 LEU H H 18 7.265 7.265 7.139 0.126 18463
2292 1 19 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.301 0.773 18463
2293 1 19 . 1 1 20 20 GLY H H 20 9.107 9.107 8.702 0.405 18463
2294 1 19 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.810 -0.279 18463
2295 1 19 . 1 1 21 21 GLY H H 21 8.671 8.671 8.088 0.583 18463
2296 1 19 . 1 1 22 22 ARG N N 22 119.872 119.872 121.456 -1.584 18463
2297 1 19 . 1 1 22 22 ARG HA H 22 3.993 3.993 4.004 -0.011 18463
2298 1 19 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.722 0.893 18463
2299 1 19 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.887 0.837 18463
2300 1 19 . 1 1 22 22 ARG H H 22 6.965 6.965 7.564 -0.599 18463
2301 1 19 . 1 1 23 23 THR HA H 23 4.277 4.277 4.374 -0.097 18463
2302 1 19 . 1 1 23 23 THR CB C 23 70.344 70.344 69.685 0.659 18463
2303 1 19 . 1 1 23 23 THR H H 23 8.837 8.837 8.133 0.704 18463
2304 1 19 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.113 0.044 18463
2305 1 19 . 1 1 24 24 GLY H H 24 7.354 7.354 7.248 0.106 18463
2306 1 19 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.038 1.763 18463
2307 1 19 . 1 1 25 25 GLY H H 25 8.054 8.054 7.736 0.318 18463
2308 1 19 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.903 -0.129 18463
2309 1 19 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.135 -2.414 18463
2310 1 19 . 1 1 26 26 TYR H H 26 8.932 8.932 8.773 0.159 18463
2311 1 19 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.673 -0.485 18463
2312 1 19 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.469 -4.617 18463
2313 1 19 . 1 1 27 27 CYS CB C 27 37.300 37.300 30.492 6.808 18463
2314 1 19 . 1 1 27 27 CYS H H 27 8.753 8.753 8.576 0.177 18463
2315 1 19 . 1 1 28 28 ALA HA H 28 4.654 4.654 5.019 -0.365 18463
2316 1 19 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.478 0.125 18463
2317 1 19 . 1 1 28 28 ALA CB C 28 20.758 20.758 22.203 -1.446 18463
2318 1 19 . 1 1 28 28 ALA H H 28 9.122 9.122 9.115 0.007 18463
2319 1 19 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.550 0.158 18463
2320 1 19 . 1 1 29 29 GLY H H 29 8.548 8.548 8.338 0.210 18463
2321 1 19 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.164 0.184 18463
2322 1 19 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.130 -0.290 18463
2323 1 19 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.424 0.376 18463
2324 1 19 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.128 -1.422 18463
2325 1 19 . 1 1 31 31 TRP H H 31 9.002 9.002 8.164 0.838 18463
2326 1 19 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.782 -0.900 18463
2327 1 19 . 1 1 32 32 TYR CA C 32 58.010 58.010 55.268 2.742 18463
2328 1 19 . 1 1 32 32 TYR CB C 32 35.410 35.410 40.007 -4.597 18463
2329 1 19 . 1 1 32 32 TYR H H 32 6.367 6.367 6.754 -0.387 18463
2330 1 19 . 1 1 33 33 LEU HA H 33 4.450 4.450 4.014 0.436 18463
2331 1 19 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.143 -1.455 18463
2332 1 19 . 1 1 33 33 LEU CB C 33 42.778 42.778 41.984 0.793 18463
2333 1 19 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.311 0.499 18463
2334 1 19 . 1 1 34 34 GLY H H 34 7.632 7.632 8.313 -0.681 18463
2335 1 19 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.992 -1.287 18463
2336 1 19 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.722 -3.958 18463
2337 1 19 . 1 1 35 35 HIS H H 35 7.334 7.334 8.438 -1.104 18463
2338 1 19 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.531 -0.657 18463
2339 1 19 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.617 0.455 18463
2340 1 19 . 1 1 37 37 THR HA H 37 4.356 4.356 4.474 -0.118 18463
2341 1 19 . 1 1 37 37 THR CB C 37 69.525 69.525 69.076 0.449 18463
2342 1 19 . 1 1 37 37 THR H H 37 8.185 8.185 8.292 -0.107 18463
2343 1 19 . 1 1 38 38 CYS HA H 38 5.026 5.026 5.008 0.018 18463
2344 1 19 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.842 -1.792 18463
2345 1 19 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.992 5.929 18463
2346 1 19 . 1 1 38 38 CYS H H 38 9.046 9.046 9.130 -0.084 18463
2347 1 19 . 1 1 39 39 THR HA H 39 4.277 4.277 4.626 -0.349 18463
2348 1 19 . 1 1 39 39 THR CB C 39 70.474 70.474 70.891 -0.417 18463
2349 1 19 . 1 1 39 39 THR H H 39 9.272 9.272 8.993 0.279 18463
2350 1 19 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.462 1.005 18463
2351 1 19 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.608 -5.543 18463
2352 1 19 . 1 1 40 40 CYS CB C 40 35.086 35.086 29.044 6.042 18463
2353 1 19 . 1 1 40 40 CYS H H 40 8.658 8.658 8.785 -0.127 18463
2354 1 19 . 1 1 41 41 SER HA H 41 4.771 4.771 4.921 -0.150 18463
2355 1 19 . 1 1 41 41 SER CB C 41 66.158 66.158 64.197 1.961 18463
2356 1 19 . 1 1 41 41 SER H H 41 8.680 8.680 8.417 0.263 18463
2357 1 20 . 1 1 2 2 PHE HA H 2 3.971 3.971 4.169 -0.198 18463
2358 1 20 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.220 0.822 18463
2359 1 20 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.520 0.800 18463
2360 1 20 . 1 1 2 2 PHE H H 2 8.600 8.600 8.119 0.481 18463
2361 1 20 . 1 1 3 3 GLY CA C 3 44.873 44.873 44.932 -0.059 18463
2362 1 20 . 1 1 3 3 GLY H H 3 8.004 8.004 8.355 -0.351 18463
2363 1 20 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.132 -0.359 18463
2364 1 20 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.546 9.241 18463
2365 1 20 . 1 1 4 4 CYS H H 4 7.575 7.575 7.761 -0.186 18463
2366 1 20 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.420 0.269 18463
2367 1 20 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.885 -0.775 18463
2368 1 20 . 1 1 5 5 PRO CB C 5 35.383 35.383 31.994 3.389 18463
2369 1 20 . 1 1 6 6 GLY CA C 6 46.594 46.594 45.214 1.381 18463
2370 1 20 . 1 1 6 6 GLY H H 6 8.907 8.907 8.694 0.213 18463
2371 1 20 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.976 0.031 18463
2372 1 20 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.518 -0.042 18463
2373 1 20 . 1 1 7 7 ASP CB C 7 40.265 40.265 42.543 -2.278 18463
2374 1 20 . 1 1 7 7 ASP H H 7 8.466 8.466 8.237 0.229 18463
2375 1 20 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.351 -0.354 18463
2376 1 20 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.159 -0.260 18463
2377 1 20 . 1 1 8 8 ALA H H 8 8.560 8.560 8.744 -0.184 18463
2378 1 20 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.037 0.273 18463
2379 1 20 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.904 -1.425 18463
2380 1 20 . 1 1 9 9 TYR H H 9 8.432 8.432 8.903 -0.471 18463
2381 1 20 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.249 -0.305 18463
2382 1 20 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.941 -0.306 18463
2383 1 20 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.468 -0.109 18463
2384 1 20 . 1 1 10 10 GLN H H 10 7.861 7.861 9.061 -1.200 18463
2385 1 20 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.302 0.585 18463
2386 1 20 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.672 -3.114 18463
2387 1 20 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.373 10.501 18463
2388 1 20 . 1 1 11 11 CYS H H 11 7.341 7.341 8.191 -0.850 18463
2389 1 20 . 1 1 12 12 SER N N 12 117.382 117.382 116.638 0.744 18463
2390 1 20 . 1 1 12 12 SER HA H 12 3.692 3.692 3.900 -0.208 18463
2391 1 20 . 1 1 12 12 SER CB C 12 62.945 62.945 62.616 0.329 18463
2392 1 20 . 1 1 12 12 SER H H 12 8.513 8.513 8.261 0.252 18463
2393 1 20 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.777 0.053 18463
2394 1 20 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.370 -0.270 18463
2395 1 20 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.546 -0.246 18463
2396 1 20 . 1 1 13 13 GLU H H 13 8.199 8.199 7.965 0.234 18463
2397 1 20 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.164 0.103 18463
2398 1 20 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.417 -0.783 18463
2399 1 20 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.504 -2.429 18463
2400 1 20 . 1 1 14 14 HIS H H 14 8.250 8.250 8.199 0.051 18463
2401 1 20 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.834 -0.090 18463
2402 1 20 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.695 -2.787 18463
2403 1 20 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.676 13.683 18463
2404 1 20 . 1 1 15 15 CYS H H 15 8.419 8.419 8.082 0.337 18463
2405 1 20 . 1 1 16 16 ARG HA H 16 3.595 3.595 4.042 -0.447 18463
2406 1 20 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.927 1.262 18463
2407 1 20 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.860 0.448 18463
2408 1 20 . 1 1 16 16 ARG H H 16 8.081 8.081 8.335 -0.254 18463
2409 1 20 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.098 -0.019 18463
2410 1 20 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.377 -0.217 18463
2411 1 20 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.225 -0.453 18463
2412 1 20 . 1 1 17 17 ALA H H 17 7.763 7.763 7.690 0.073 18463
2413 1 20 . 1 1 18 18 LEU HA H 18 4.007 4.007 3.974 0.033 18463
2414 1 20 . 1 1 18 18 LEU CB C 18 42.373 42.373 41.983 0.390 18463
2415 1 20 . 1 1 18 18 LEU H H 18 7.265 7.265 7.116 0.149 18463
2416 1 20 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.328 0.746 18463
2417 1 20 . 1 1 20 20 GLY H H 20 9.107 9.107 8.719 0.388 18463
2418 1 20 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.790 -0.259 18463
2419 1 20 . 1 1 21 21 GLY H H 21 8.671 8.671 8.098 0.573 18463
2420 1 20 . 1 1 22 22 ARG N N 22 119.872 119.872 121.853 -1.981 18463
2421 1 20 . 1 1 22 22 ARG HA H 22 3.993 3.993 3.937 0.056 18463
2422 1 20 . 1 1 22 22 ARG CA C 22 56.615 56.615 56.029 0.586 18463
2423 1 20 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.736 0.988 18463
2424 1 20 . 1 1 22 22 ARG H H 22 6.965 6.965 7.576 -0.611 18463
2425 1 20 . 1 1 23 23 THR HA H 23 4.277 4.277 4.319 -0.042 18463
2426 1 20 . 1 1 23 23 THR CB C 23 70.344 70.344 69.660 0.684 18463
2427 1 20 . 1 1 23 23 THR H H 23 8.837 8.837 8.142 0.695 18463
2428 1 20 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.163 -0.005 18463
2429 1 20 . 1 1 24 24 GLY H H 24 7.354 7.354 7.288 0.066 18463
2430 1 20 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.077 1.724 18463
2431 1 20 . 1 1 25 25 GLY H H 25 8.054 8.054 7.601 0.453 18463
2432 1 20 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.947 -0.173 18463
2433 1 20 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.346 -2.624 18463
2434 1 20 . 1 1 26 26 TYR H H 26 8.932 8.932 9.013 -0.081 18463
2435 1 20 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.732 -0.544 18463
2436 1 20 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.791 -4.939 18463
2437 1 20 . 1 1 27 27 CYS CB C 27 37.300 37.300 30.307 6.993 18463
2438 1 20 . 1 1 27 27 CYS H H 27 8.753 8.753 8.608 0.145 18463
2439 1 20 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.915 -0.261 18463
2440 1 20 . 1 1 28 28 ALA CA C 28 50.603 50.603 51.134 -0.531 18463
2441 1 20 . 1 1 28 28 ALA CB C 28 20.758 20.758 21.289 -0.531 18463
2442 1 20 . 1 1 28 28 ALA H H 28 9.122 9.122 9.193 -0.071 18463
2443 1 20 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.924 -0.216 18463
2444 1 20 . 1 1 29 29 GLY H H 29 8.548 8.548 8.008 0.540 18463
2445 1 20 . 1 1 30 30 PRO HA H 30 4.348 4.348 3.754 0.594 18463
2446 1 20 . 1 1 30 30 PRO CB C 30 31.840 31.840 31.810 0.030 18463
2447 1 20 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.450 0.350 18463
2448 1 20 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.230 -1.524 18463
2449 1 20 . 1 1 31 31 TRP H H 31 9.002 9.002 7.393 1.609 18463
2450 1 20 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.665 -0.783 18463
2451 1 20 . 1 1 32 32 TYR CA C 32 58.010 58.010 56.092 1.918 18463
2452 1 20 . 1 1 32 32 TYR CB C 32 35.410 35.410 38.860 -3.450 18463
2453 1 20 . 1 1 32 32 TYR H H 32 6.367 6.367 6.840 -0.473 18463
2454 1 20 . 1 1 33 33 LEU HA H 33 4.450 4.450 3.933 0.517 18463
2455 1 20 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.158 -1.470 18463
2456 1 20 . 1 1 33 33 LEU CB C 33 42.778 42.778 41.835 0.943 18463
2457 1 20 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.208 0.602 18463
2458 1 20 . 1 1 34 34 GLY H H 34 7.632 7.632 8.348 -0.716 18463
2459 1 20 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.961 -1.256 18463
2460 1 20 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.899 -4.135 18463
2461 1 20 . 1 1 35 35 HIS H H 35 7.334 7.334 8.168 -0.834 18463
2462 1 20 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.303 -0.429 18463
2463 1 20 . 1 1 36 36 PRO CA C 36 64.072 64.072 64.264 -0.192 18463
2464 1 20 . 1 1 37 37 THR HA H 37 4.356 4.356 4.463 -0.107 18463
2465 1 20 . 1 1 37 37 THR CB C 37 69.525 69.525 69.624 -0.099 18463
2466 1 20 . 1 1 37 37 THR H H 37 8.185 8.185 8.315 -0.130 18463
2467 1 20 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.830 0.196 18463
2468 1 20 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.983 -1.933 18463
2469 1 20 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.338 6.583 18463
2470 1 20 . 1 1 38 38 CYS H H 38 9.046 9.046 9.130 -0.084 18463
2471 1 20 . 1 1 39 39 THR HA H 39 4.277 4.277 4.638 -0.361 18463
2472 1 20 . 1 1 39 39 THR CB C 39 70.474 70.474 70.552 -0.078 18463
2473 1 20 . 1 1 39 39 THR H H 39 9.272 9.272 9.062 0.210 18463
2474 1 20 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.567 0.900 18463
2475 1 20 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.755 -5.690 18463
2476 1 20 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.825 6.261 18463
2477 1 20 . 1 1 40 40 CYS H H 40 8.658 8.658 8.819 -0.161 18463
2478 1 20 . 1 1 41 41 SER HA H 41 4.771 4.771 4.983 -0.212 18463
2479 1 20 . 1 1 41 41 SER CB C 41 66.158 66.158 64.561 1.597 18463
2480 1 20 . 1 1 41 41 SER H H 41 8.680 8.680 8.526 0.154 18463
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 2 1.442 0.528 1.897 18463
2 1 1 "Average Difference" HA 47 0.438 -0.009 0.443 18463
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18463
4 1 1 "Average Difference" CA 26 1.955 0.464 1.936 18463
5 1 1 "Average Difference" CB 30 4.550 -1.461 4.382 18463
6 1 1 "Average Difference" HN 35 0.451 -0.004 0.458 18463
7 1 2 "Average Difference" N 2 1.443 0.610 1.849 18463
8 1 2 "Average Difference" HA 47 0.434 0.009 0.439 18463
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18463
10 1 2 "Average Difference" CA 26 1.950 0.438 1.938 18463
11 1 2 "Average Difference" CB 30 4.538 -1.412 4.386 18463
12 1 2 "Average Difference" HN 35 0.454 0.029 0.460 18463
13 1 3 "Average Difference" N 2 1.453 0.531 1.912 18463
14 1 3 "Average Difference" HA 47 0.418 -0.047 0.420 18463
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18463
16 1 3 "Average Difference" CA 26 1.907 0.517 1.872 18463
17 1 3 "Average Difference" CB 30 4.573 -1.614 4.352 18463
18 1 3 "Average Difference" HN 35 0.476 -0.063 0.479 18463
19 1 4 "Average Difference" N 2 1.309 0.449 1.739 18463
20 1 4 "Average Difference" HA 47 0.428 -0.005 0.432 18463
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18463
22 1 4 "Average Difference" CA 26 1.895 0.484 1.869 18463
23 1 4 "Average Difference" CB 30 4.505 -1.451 4.338 18463
24 1 4 "Average Difference" HN 35 0.494 0.019 0.501 18463
25 1 5 "Average Difference" N 2 1.310 0.515 1.704 18463
26 1 5 "Average Difference" HA 47 0.422 -0.006 0.427 18463
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18463
28 1 5 "Average Difference" CA 26 1.886 0.454 1.867 18463
29 1 5 "Average Difference" CB 30 4.469 -1.448 4.301 18463
30 1 5 "Average Difference" HN 35 0.454 -0.000 0.461 18463
31 1 6 "Average Difference" N 2 1.483 0.512 1.969 18463
32 1 6 "Average Difference" HA 47 0.424 -0.025 0.428 18463
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18463
34 1 6 "Average Difference" CA 26 1.991 0.420 1.985 18463
35 1 6 "Average Difference" CB 30 4.693 -1.562 4.501 18463
36 1 6 "Average Difference" HN 35 0.455 -0.063 0.457 18463
37 1 7 "Average Difference" N 2 1.357 0.510 1.778 18463
38 1 7 "Average Difference" HA 47 0.436 -0.017 0.441 18463
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18463
40 1 7 "Average Difference" CA 26 1.903 0.498 1.873 18463
41 1 7 "Average Difference" CB 30 4.469 -1.436 4.305 18463
42 1 7 "Average Difference" HN 35 0.501 -0.016 0.508 18463
43 1 8 "Average Difference" N 2 1.334 0.516 1.739 18463
44 1 8 "Average Difference" HA 47 0.426 -0.009 0.431 18463
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18463
46 1 8 "Average Difference" CA 26 1.943 0.517 1.911 18463
47 1 8 "Average Difference" CB 30 4.507 -1.521 4.316 18463
48 1 8 "Average Difference" HN 35 0.440 -0.036 0.445 18463
49 1 9 "Average Difference" N 2 1.443 0.589 1.863 18463
50 1 9 "Average Difference" HA 47 0.413 -0.037 0.415 18463
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18463
52 1 9 "Average Difference" CA 26 1.889 0.520 1.852 18463
53 1 9 "Average Difference" CB 30 4.512 -1.549 4.310 18463
54 1 9 "Average Difference" HN 35 0.452 -0.041 0.456 18463
55 1 10 "Average Difference" N 2 1.498 0.578 1.954 18463
56 1 10 "Average Difference" HA 47 0.418 -0.019 0.422 18463
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18463
58 1 10 "Average Difference" CA 26 1.866 0.440 1.849 18463
59 1 10 "Average Difference" CB 30 4.464 -1.548 4.259 18463
60 1 10 "Average Difference" HN 35 0.450 -0.048 0.454 18463
61 1 11 "Average Difference" N 2 1.287 0.463 1.698 18463
62 1 11 "Average Difference" HA 47 0.418 0.014 0.422 18463
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18463
64 1 11 "Average Difference" CA 26 1.958 0.490 1.933 18463
65 1 11 "Average Difference" CB 30 4.561 -1.434 4.404 18463
66 1 11 "Average Difference" HN 35 0.474 0.037 0.480 18463
67 1 12 "Average Difference" N 2 1.460 0.492 1.945 18463
68 1 12 "Average Difference" HA 47 0.428 -0.011 0.432 18463
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18463
70 1 12 "Average Difference" CA 26 1.937 0.420 1.929 18463
71 1 12 "Average Difference" CB 30 4.565 -1.476 4.394 18463
72 1 12 "Average Difference" HN 35 0.440 0.003 0.446 18463
73 1 13 "Average Difference" N 2 1.424 0.517 1.877 18463
74 1 13 "Average Difference" HA 47 0.431 0.000 0.436 18463
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18463
76 1 13 "Average Difference" CA 26 1.934 0.446 1.919 18463
77 1 13 "Average Difference" CB 30 4.525 -1.391 4.380 18463
78 1 13 "Average Difference" HN 35 0.489 0.008 0.496 18463
79 1 14 "Average Difference" N 2 1.405 0.495 1.859 18463
80 1 14 "Average Difference" HA 47 0.427 -0.015 0.431 18463
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18463
82 1 14 "Average Difference" CA 26 1.917 0.465 1.896 18463
83 1 14 "Average Difference" CB 30 4.529 -1.392 4.384 18463
84 1 14 "Average Difference" HN 35 0.498 -0.002 0.505 18463
85 1 15 "Average Difference" N 2 1.360 0.610 1.719 18463
86 1 15 "Average Difference" HA 47 0.435 0.004 0.440 18463
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18463
88 1 15 "Average Difference" CA 26 1.899 0.412 1.891 18463
89 1 15 "Average Difference" CB 30 4.450 -1.388 4.300 18463
90 1 15 "Average Difference" HN 35 0.424 0.008 0.430 18463
91 1 16 "Average Difference" N 2 1.453 0.584 1.881 18463
92 1 16 "Average Difference" HA 47 0.423 -0.015 0.427 18463
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18463
94 1 16 "Average Difference" CA 26 1.878 0.440 1.862 18463
95 1 16 "Average Difference" CB 30 4.506 -1.447 4.340 18463
96 1 16 "Average Difference" HN 35 0.505 -0.004 0.512 18463
97 1 17 "Average Difference" N 2 1.490 0.519 1.976 18463
98 1 17 "Average Difference" HA 47 0.426 -0.005 0.430 18463
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18463
100 1 17 "Average Difference" CA 26 1.950 0.424 1.941 18463
101 1 17 "Average Difference" CB 30 4.594 -1.456 4.432 18463
102 1 17 "Average Difference" HN 35 0.481 0.008 0.488 18463
103 1 18 "Average Difference" N 2 1.483 0.510 1.969 18463
104 1 18 "Average Difference" HA 47 0.422 -0.012 0.426 18463
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18463
106 1 18 "Average Difference" CA 26 1.971 0.525 1.938 18463
107 1 18 "Average Difference" CB 30 4.548 -1.503 4.366 18463
108 1 18 "Average Difference" HN 35 0.427 -0.072 0.427 18463
109 1 19 "Average Difference" N 2 1.194 0.499 1.534 18463
110 1 19 "Average Difference" HA 47 0.436 0.015 0.440 18463
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18463
112 1 19 "Average Difference" CA 26 1.891 0.408 1.883 18463
113 1 19 "Average Difference" CB 30 4.407 -1.347 4.268 18463
114 1 19 "Average Difference" HN 35 0.450 0.003 0.457 18463
115 1 20 "Average Difference" N 2 1.496 0.618 1.927 18463
116 1 20 "Average Difference" HA 47 0.438 -0.030 0.442 18463
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18463
118 1 20 "Average Difference" CA 26 1.902 0.560 1.854 18463
119 1 20 "Average Difference" CB 30 4.411 -1.441 4.241 18463
120 1 20 "Average Difference" HN 35 0.514 -0.006 0.521 18463
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 18463
_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 PHE HA H 2 3.971 3.971 4.142 -0.171 18463
2 1 . 1 1 2 2 PHE CA C 2 59.042 59.042 58.239 0.803 18463
3 1 . 1 1 2 2 PHE CB C 2 37.320 37.320 36.446 0.874 18463
4 1 . 1 1 2 2 PHE H H 2 8.600 8.600 8.174 0.426 18463
5 1 . 1 1 3 3 GLY CA C 3 44.873 44.873 45.148 -0.275 18463
6 1 . 1 1 3 3 GLY H H 3 8.004 8.004 8.346 -0.342 18463
7 1 . 1 1 4 4 CYS HA H 4 4.773 4.773 5.165 -0.392 18463
8 1 . 1 1 4 4 CYS CB C 4 37.787 37.787 28.441 9.346 18463
9 1 . 1 1 4 4 CYS H H 4 7.575 7.575 7.737 -0.162 18463
10 1 . 1 1 5 5 PRO HA H 5 4.689 4.689 4.439 0.250 18463
11 1 . 1 1 5 5 PRO CA C 5 63.109 63.109 63.734 -0.625 18463
12 1 . 1 1 5 5 PRO CB C 5 35.383 35.383 32.259 3.124 18463
13 1 . 1 1 6 6 GLY CA C 6 46.594 46.594 44.994 1.600 18463
14 1 . 1 1 6 6 GLY H H 6 8.907 8.907 8.406 0.501 18463
15 1 . 1 1 7 7 ASP HA H 7 5.007 5.007 4.993 0.014 18463
16 1 . 1 1 7 7 ASP CA C 7 52.476 52.476 52.575 -0.099 18463
17 1 . 1 1 7 7 ASP CB C 7 40.265 40.265 41.886 -1.622 18463
18 1 . 1 1 7 7 ASP H H 7 8.466 8.466 8.247 0.219 18463
19 1 . 1 1 8 8 ALA HA H 8 3.997 3.997 4.315 -0.318 18463
20 1 . 1 1 8 8 ALA CB C 8 18.899 18.899 19.156 -0.257 18463
21 1 . 1 1 8 8 ALA H H 8 8.560 8.560 8.638 -0.078 18463
22 1 . 1 1 9 9 TYR HA H 9 4.310 4.310 4.053 0.257 18463
23 1 . 1 1 9 9 TYR CB C 9 37.479 37.479 38.735 -1.256 18463
24 1 . 1 1 9 9 TYR H H 9 8.432 8.432 8.702 -0.270 18463
25 1 . 1 1 10 10 GLN HA H 10 3.944 3.944 4.063 -0.119 18463
26 1 . 1 1 10 10 GLN CA C 10 58.635 58.635 58.946 -0.311 18463
27 1 . 1 1 10 10 GLN CB C 10 28.359 28.359 28.453 -0.094 18463
28 1 . 1 1 10 10 GLN H H 10 7.861 7.861 8.835 -0.974 18463
29 1 . 1 1 11 11 CYS HA H 11 4.887 4.887 4.291 0.596 18463
30 1 . 1 1 11 11 CYS CA C 11 58.558 58.558 61.658 -3.100 18463
31 1 . 1 1 11 11 CYS CB C 11 35.874 35.874 25.408 10.466 18463
32 1 . 1 1 11 11 CYS H H 11 7.341 7.341 8.030 -0.689 18463
33 1 . 1 1 12 12 SER N N 12 117.382 117.382 116.614 0.768 18463
34 1 . 1 1 12 12 SER HA H 12 3.692 3.692 3.919 -0.227 18463
35 1 . 1 1 12 12 SER CB C 12 62.945 62.945 62.652 0.293 18463
36 1 . 1 1 12 12 SER H H 12 8.513 8.513 8.171 0.342 18463
37 1 . 1 1 13 13 GLU HA H 13 3.830 3.830 3.736 0.094 18463
38 1 . 1 1 13 13 GLU CA C 13 59.100 59.100 59.392 -0.292 18463
39 1 . 1 1 13 13 GLU CB C 13 29.300 29.300 29.480 -0.180 18463
40 1 . 1 1 13 13 GLU H H 13 8.199 8.199 7.990 0.209 18463
41 1 . 1 1 14 14 HIS HA H 14 4.267 4.267 4.112 0.155 18463
42 1 . 1 1 14 14 HIS CA C 14 58.635 58.635 59.316 -0.681 18463
43 1 . 1 1 14 14 HIS CB C 14 27.075 27.075 29.349 -2.274 18463
44 1 . 1 1 14 14 HIS H H 14 8.250 8.250 8.156 0.094 18463
45 1 . 1 1 15 15 CYS HA H 15 3.744 3.744 3.697 0.047 18463
46 1 . 1 1 15 15 CYS CA C 15 59.908 59.908 62.544 -2.636 18463
47 1 . 1 1 15 15 CYS CB C 15 39.359 39.359 25.609 13.750 18463
48 1 . 1 1 15 15 CYS H H 15 8.419 8.419 7.910 0.509 18463
49 1 . 1 1 16 16 ARG HA H 16 3.595 3.595 3.977 -0.382 18463
50 1 . 1 1 16 16 ARG CA C 16 60.189 60.189 58.894 1.295 18463
51 1 . 1 1 16 16 ARG CB C 16 30.308 30.308 29.872 0.436 18463
52 1 . 1 1 16 16 ARG H H 16 8.081 8.081 8.283 -0.202 18463
53 1 . 1 1 17 17 ALA HA H 17 4.079 4.079 4.098 -0.019 18463
54 1 . 1 1 17 17 ALA CA C 17 54.160 54.160 54.363 -0.203 18463
55 1 . 1 1 17 17 ALA CB C 17 17.772 17.772 18.229 -0.457 18463
56 1 . 1 1 17 17 ALA H H 17 7.763 7.763 7.843 -0.080 18463
57 1 . 1 1 18 18 LEU HA H 18 4.007 4.007 4.014 -0.007 18463
58 1 . 1 1 18 18 LEU CB C 18 42.373 42.373 42.031 0.342 18463
59 1 . 1 1 18 18 LEU H H 18 7.265 7.265 7.081 0.184 18463
60 1 . 1 1 20 20 GLY CA C 20 47.074 47.074 46.289 0.785 18463
61 1 . 1 1 20 20 GLY H H 20 9.107 9.107 8.703 0.404 18463
62 1 . 1 1 21 21 GLY CA C 21 44.531 44.531 44.804 -0.273 18463
63 1 . 1 1 21 21 GLY H H 21 8.671 8.671 8.109 0.562 18463
64 1 . 1 1 22 22 ARG N N 22 119.872 119.872 121.705 -1.833 18463
65 1 . 1 1 22 22 ARG HA H 22 3.993 3.993 3.974 0.019 18463
66 1 . 1 1 22 22 ARG CA C 22 56.615 56.615 55.882 0.733 18463
67 1 . 1 1 22 22 ARG CB C 22 30.724 30.724 29.794 0.930 18463
68 1 . 1 1 22 22 ARG H H 22 6.965 6.965 7.531 -0.566 18463
69 1 . 1 1 23 23 THR HA H 23 4.277 4.277 4.311 -0.034 18463
70 1 . 1 1 23 23 THR CB C 23 70.344 70.344 69.665 0.679 18463
71 1 . 1 1 23 23 THR H H 23 8.837 8.837 8.193 0.644 18463
72 1 . 1 1 24 24 GLY CA C 24 45.157 45.157 45.168 -0.011 18463
73 1 . 1 1 24 24 GLY H H 24 7.354 7.354 7.259 0.094 18463
74 1 . 1 1 25 25 GLY CA C 25 46.801 46.801 45.101 1.700 18463
75 1 . 1 1 25 25 GLY H H 25 8.054 8.054 7.577 0.477 18463
76 1 . 1 1 26 26 TYR HA H 26 4.774 4.774 4.939 -0.165 18463
77 1 . 1 1 26 26 TYR CB C 26 39.721 39.721 42.420 -2.699 18463
78 1 . 1 1 26 26 TYR H H 26 8.932 8.932 8.953 -0.021 18463
79 1 . 1 1 27 27 CYS HA H 27 5.188 5.188 5.617 -0.429 18463
80 1 . 1 1 27 27 CYS CA C 27 52.852 52.852 57.899 -5.047 18463
81 1 . 1 1 27 27 CYS CB C 27 37.300 37.300 29.114 8.186 18463
82 1 . 1 1 27 27 CYS H H 27 8.753 8.753 8.717 0.036 18463
83 1 . 1 1 28 28 ALA HA H 28 4.654 4.654 4.797 -0.143 18463
84 1 . 1 1 28 28 ALA CA C 28 50.603 50.603 50.515 0.088 18463
85 1 . 1 1 28 28 ALA CB C 28 20.758 20.758 21.995 -1.237 18463
86 1 . 1 1 28 28 ALA H H 28 9.122 9.122 9.125 -0.003 18463
87 1 . 1 1 29 29 GLY CA C 29 44.708 44.708 44.468 0.240 18463
88 1 . 1 1 29 29 GLY H H 29 8.548 8.548 8.276 0.272 18463
89 1 . 1 1 30 30 PRO HA H 30 4.348 4.348 4.109 0.239 18463
90 1 . 1 1 30 30 PRO CB C 30 31.840 31.840 32.035 -0.195 18463
91 1 . 1 1 31 31 TRP HA H 31 4.800 4.800 4.474 0.327 18463
92 1 . 1 1 31 31 TRP CB C 31 27.706 27.706 29.088 -1.382 18463
93 1 . 1 1 31 31 TRP H H 31 9.002 9.002 7.962 1.040 18463
94 1 . 1 1 32 32 TYR HA H 32 3.882 3.882 4.731 -0.849 18463
95 1 . 1 1 32 32 TYR CA C 32 58.010 58.010 55.793 2.217 18463
96 1 . 1 1 32 32 TYR CB C 32 35.410 35.410 39.639 -4.229 18463
97 1 . 1 1 32 32 TYR H H 32 6.367 6.367 6.933 -0.566 18463
98 1 . 1 1 33 33 LEU HA H 33 4.450 4.450 3.995 0.455 18463
99 1 . 1 1 33 33 LEU CA C 33 53.688 53.688 55.168 -1.480 18463
100 1 . 1 1 33 33 LEU CB C 33 42.778 42.778 41.998 0.780 18463
101 1 . 1 1 34 34 GLY CA C 34 45.810 45.810 45.318 0.492 18463
102 1 . 1 1 34 34 GLY H H 34 7.632 7.632 8.308 -0.676 18463
103 1 . 1 1 35 35 HIS HA H 35 3.705 3.705 4.968 -1.263 18463
104 1 . 1 1 35 35 HIS CB C 35 25.764 25.764 29.913 -4.149 18463
105 1 . 1 1 35 35 HIS H H 35 7.334 7.334 8.347 -1.013 18463
106 1 . 1 1 36 36 PRO HA H 36 3.874 3.874 4.503 -0.629 18463
107 1 . 1 1 36 36 PRO CA C 36 64.072 64.072 63.633 0.439 18463
108 1 . 1 1 37 37 THR HA H 37 4.356 4.356 4.459 -0.103 18463
109 1 . 1 1 37 37 THR CB C 37 69.525 69.525 69.340 0.186 18463
110 1 . 1 1 37 37 THR H H 37 8.185 8.185 8.206 -0.021 18463
111 1 . 1 1 38 38 CYS HA H 38 5.026 5.026 4.899 0.127 18463
112 1 . 1 1 38 38 CYS CA C 38 57.050 57.050 58.863 -1.813 18463
113 1 . 1 1 38 38 CYS CB C 38 34.921 34.921 28.142 6.779 18463
114 1 . 1 1 38 38 CYS H H 38 9.046 9.046 9.154 -0.108 18463
115 1 . 1 1 39 39 THR HA H 39 4.277 4.277 4.654 -0.377 18463
116 1 . 1 1 39 39 THR CB C 39 70.474 70.474 70.748 -0.274 18463
117 1 . 1 1 39 39 THR H H 39 9.272 9.272 9.113 0.159 18463
118 1 . 1 1 40 40 CYS HA H 40 5.467 5.467 4.540 0.927 18463
119 1 . 1 1 40 40 CYS CA C 40 52.065 52.065 57.755 -5.690 18463
120 1 . 1 1 40 40 CYS CB C 40 35.086 35.086 28.772 6.314 18463
121 1 . 1 1 40 40 CYS H H 40 8.658 8.658 8.829 -0.171 18463
122 1 . 1 1 41 41 SER HA H 41 4.771 4.771 4.952 -0.181 18463
123 1 . 1 1 41 41 SER CB C 41 66.158 66.158 64.425 1.733 18463
124 1 . 1 1 41 41 SER H H 41 8.680 8.680 8.489 0.191 18463
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