data_19200
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19200
_Entry.PDB_ID 2M7P
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 19200
_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 5 5 VAL N N 5 122.070 122.070 121.778 0.292 19200
2 1 1 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.219 -0.020 19200
3 1 1 . 1 1 5 5 VAL CA C 5 62.696 62.696 63.578 -0.882 19200
4 1 1 . 1 1 5 5 VAL CB C 5 33.858 33.858 31.817 2.041 19200
5 1 1 . 1 1 5 5 VAL H H 5 8.246 8.246 7.892 0.354 19200
6 1 1 . 1 1 6 6 THR N N 6 119.169 119.169 120.089 -0.920 19200
7 1 1 . 1 1 6 6 THR HA H 6 4.376 4.376 4.528 -0.152 19200
8 1 1 . 1 1 6 6 THR CA C 6 61.781 61.781 61.666 0.115 19200
9 1 1 . 1 1 6 6 THR CB C 6 70.908 70.908 70.882 0.026 19200
10 1 1 . 1 1 6 6 THR H H 6 8.243 8.243 8.210 0.033 19200
11 1 1 . 1 1 7 7 CYS N N 7 121.405 121.405 120.737 0.668 19200
12 1 1 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.778 0.046 19200
13 1 1 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.757 -4.539 19200
14 1 1 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.572 11.553 19200
15 1 1 . 1 1 7 7 CYS H H 7 8.656 8.656 8.238 0.418 19200
16 1 1 . 1 1 8 8 SER N N 8 118.316 118.316 116.024 2.292 19200
17 1 1 . 1 1 8 8 SER HA H 8 4.349 4.349 4.663 -0.314 19200
18 1 1 . 1 1 8 8 SER CA C 8 58.967 58.967 57.650 1.317 19200
19 1 1 . 1 1 8 8 SER CB C 8 64.571 64.571 63.717 0.855 19200
20 1 1 . 1 1 8 8 SER H H 8 8.574 8.574 8.204 0.370 19200
21 1 1 . 1 1 9 9 LEU N N 9 121.658 121.658 121.676 -0.018 19200
22 1 1 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.241 -0.011 19200
23 1 1 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.599 1.105 19200
24 1 1 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.227 1.073 19200
25 1 1 . 1 1 9 9 LEU H H 9 8.260 8.260 8.398 -0.138 19200
26 1 1 . 1 1 10 10 GLY N N 10 112.236 112.236 106.352 5.884 19200
27 1 1 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.821 0.848 19200
28 1 1 . 1 1 10 10 GLY H H 10 9.031 9.031 8.652 0.379 19200
29 1 1 . 1 1 11 11 TYR N N 11 121.166 121.166 119.240 1.926 19200
30 1 1 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.502 -0.436 19200
31 1 1 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.144 0.141 19200
32 1 1 . 1 1 11 11 TYR CB C 11 41.830 41.830 43.031 -1.200 19200
33 1 1 . 1 1 11 11 TYR H H 11 8.335 8.335 7.681 0.654 19200
34 1 1 . 1 1 12 12 PHE N N 12 121.724 121.724 116.340 5.384 19200
35 1 1 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.176 0.007 19200
36 1 1 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.542 0.301 19200
37 1 1 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.697 1.043 19200
38 1 1 . 1 1 12 12 PHE H H 12 9.791 9.791 9.142 0.649 19200
39 1 1 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.690 0.312 19200
40 1 1 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.625 -0.532 19200
41 1 1 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.689 -1.052 19200
42 1 1 . 1 1 14 14 CYS N N 14 117.951 117.951 117.186 0.765 19200
43 1 1 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.727 0.170 19200
44 1 1 . 1 1 14 14 CYS CA C 14 55.375 55.375 59.575 -4.200 19200
45 1 1 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.641 13.940 19200
46 1 1 . 1 1 14 14 CYS H H 14 8.630 8.630 8.256 0.374 19200
47 1 1 . 1 1 15 15 GLY N N 15 108.668 108.668 105.630 3.038 19200
48 1 1 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.035 0.700 19200
49 1 1 . 1 1 15 15 GLY H H 15 8.372 8.372 7.683 0.689 19200
50 1 1 . 1 1 16 16 ASN N N 16 121.627 121.627 119.013 2.614 19200
51 1 1 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.444 0.089 19200
52 1 1 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.440 0.103 19200
53 1 1 . 1 1 16 16 ASN CB C 16 38.841 38.841 37.978 0.863 19200
54 1 1 . 1 1 16 16 ASN H H 16 9.709 9.709 8.518 1.191 19200
55 1 1 . 1 1 17 17 ILE N N 17 119.731 119.731 119.223 0.508 19200
56 1 1 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.978 0.237 19200
57 1 1 . 1 1 17 17 ILE CA C 17 61.465 61.465 63.064 -1.599 19200
58 1 1 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.930 -0.017 19200
59 1 1 . 1 1 17 17 ILE H H 17 8.196 8.196 7.928 0.268 19200
60 1 1 . 1 1 18 18 THR N N 18 117.836 117.836 108.232 9.604 19200
61 1 1 . 1 1 18 18 THR HA H 18 3.985 3.985 4.061 -0.076 19200
62 1 1 . 1 1 18 18 THR CA C 18 64.041 64.041 62.973 1.068 19200
63 1 1 . 1 1 18 18 THR CB C 18 69.529 69.529 67.124 2.405 19200
64 1 1 . 1 1 18 18 THR H H 18 7.969 7.969 7.722 0.247 19200
65 1 1 . 1 1 19 19 LYS N N 19 124.340 124.340 121.291 3.049 19200
66 1 1 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.065 0.403 19200
67 1 1 . 1 1 19 19 LYS CA C 19 56.099 56.099 57.026 -0.927 19200
68 1 1 . 1 1 19 19 LYS CB C 19 35.855 35.855 33.072 2.783 19200
69 1 1 . 1 1 19 19 LYS H H 19 8.271 8.271 7.767 0.504 19200
70 1 1 . 1 1 20 20 CYS N N 20 121.675 121.675 125.232 -3.557 19200
71 1 1 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.601 0.602 19200
72 1 1 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.474 -3.107 19200
73 1 1 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.779 18.639 19200
74 1 1 . 1 1 20 20 CYS H H 20 8.543 8.543 8.691 -0.148 19200
75 1 1 . 1 1 21 21 ILE N N 21 118.395 118.395 119.701 -1.306 19200
76 1 1 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.864 -0.174 19200
77 1 1 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.470 0.826 19200
78 1 1 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.982 -0.128 19200
79 1 1 . 1 1 21 21 ILE H H 21 9.070 9.070 8.885 0.185 19200
80 1 1 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.839 -0.528 19200
81 1 1 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.566 1.525 19200
82 1 1 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.597 0.706 19200
83 1 1 . 1 1 23 23 GLN N N 23 120.837 120.837 124.659 -3.822 19200
84 1 1 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.088 -0.174 19200
85 1 1 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.700 -0.271 19200
86 1 1 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.272 -0.043 19200
87 1 1 . 1 1 23 23 GLN H H 23 8.285 8.285 8.180 0.105 19200
88 1 1 . 1 1 24 24 PHE N N 24 112.558 112.558 117.964 -5.406 19200
89 1 1 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.267 0.516 19200
90 1 1 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.571 -2.366 19200
91 1 1 . 1 1 24 24 PHE CB C 24 37.991 37.991 38.919 -0.928 19200
92 1 1 . 1 1 24 24 PHE H H 24 7.218 7.218 8.126 -0.908 19200
93 1 1 . 1 1 25 25 TRP N N 25 118.981 118.981 117.333 1.648 19200
94 1 1 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.192 0.071 19200
95 1 1 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.694 0.137 19200
96 1 1 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.218 0.695 19200
97 1 1 . 1 1 25 25 TRP H H 25 7.925 7.925 7.808 0.117 19200
98 1 1 . 1 1 26 26 ARG N N 26 126.158 126.158 120.575 5.583 19200
99 1 1 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.566 -0.151 19200
100 1 1 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.656 1.309 19200
101 1 1 . 1 1 26 26 ARG CB C 26 30.716 30.716 31.513 -0.797 19200
102 1 1 . 1 1 26 26 ARG H H 26 8.126 8.126 8.001 0.125 19200
103 1 1 . 1 1 27 27 CYS N N 27 123.356 123.356 125.318 -1.962 19200
104 1 1 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.291 0.549 19200
105 1 1 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.508 -3.418 19200
106 1 1 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.174 11.206 19200
107 1 1 . 1 1 27 27 CYS H H 27 8.927 8.927 9.079 -0.152 19200
108 1 1 . 1 1 28 28 ASP N N 28 120.779 120.779 121.612 -0.833 19200
109 1 1 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.784 0.081 19200
110 1 1 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.195 -1.376 19200
111 1 1 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.745 0.444 19200
112 1 1 . 1 1 28 28 ASP H H 28 9.642 9.642 8.560 1.082 19200
113 1 1 . 1 1 29 29 GLY N N 29 111.028 111.028 108.493 2.535 19200
114 1 1 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.622 1.491 19200
115 1 1 . 1 1 29 29 GLY H H 29 9.361 9.361 8.148 1.213 19200
116 1 1 . 1 1 30 30 GLN N N 30 118.561 118.561 119.176 -0.615 19200
117 1 1 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.622 -0.052 19200
118 1 1 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.543 -0.590 19200
119 1 1 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.577 -1.324 19200
120 1 1 . 1 1 30 30 GLN H H 30 7.513 7.513 8.058 -0.545 19200
121 1 1 . 1 1 31 31 VAL N N 31 129.747 129.747 122.271 7.476 19200
122 1 1 . 1 1 31 31 VAL HA H 31 3.949 3.949 4.024 -0.075 19200
123 1 1 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.096 3.077 19200
124 1 1 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.169 0.334 19200
125 1 1 . 1 1 31 31 VAL H H 31 9.403 9.403 8.580 0.823 19200
126 1 1 . 1 1 32 32 ASP N N 32 130.844 130.844 120.040 10.804 19200
127 1 1 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.237 0.622 19200
128 1 1 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.445 0.191 19200
129 1 1 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.328 5.489 19200
130 1 1 . 1 1 32 32 ASP H H 32 10.474 10.474 8.041 2.433 19200
131 1 1 . 1 1 33 33 CYS N N 33 118.607 118.607 116.617 1.990 19200
132 1 1 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.255 0.729 19200
133 1 1 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.427 -6.016 19200
134 1 1 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.941 15.189 19200
135 1 1 . 1 1 33 33 CYS H H 33 8.231 8.231 8.142 0.089 19200
136 1 1 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.537 -0.254 19200
137 1 1 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.300 1.351 19200
138 1 1 . 1 1 34 34 ASP CB C 34 40.574 40.574 41.110 -0.536 19200
139 1 1 . 1 1 35 35 ASN N N 35 114.357 114.357 115.168 -0.811 19200
140 1 1 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.813 -0.017 19200
141 1 1 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.458 -0.427 19200
142 1 1 . 1 1 35 35 ASN CB C 35 38.525 38.525 37.969 0.556 19200
143 1 1 . 1 1 35 35 ASN H H 35 7.842 7.842 7.841 0.001 19200
144 1 1 . 1 1 36 36 GLY N N 36 106.237 106.237 108.458 -2.221 19200
145 1 1 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.256 0.639 19200
146 1 1 . 1 1 36 36 GLY H H 36 8.269 8.269 8.501 -0.232 19200
147 1 1 . 1 1 37 37 SER N N 37 115.105 115.105 114.790 0.315 19200
148 1 1 . 1 1 37 37 SER HA H 37 4.026 4.026 4.243 -0.217 19200
149 1 1 . 1 1 37 37 SER CA C 37 62.619 62.619 61.179 1.440 19200
150 1 1 . 1 1 37 37 SER CB C 37 63.494 63.494 63.336 0.158 19200
151 1 1 . 1 1 37 37 SER H H 37 7.900 7.900 7.880 0.020 19200
152 1 1 . 1 1 38 38 ASP N N 38 116.663 116.663 117.184 -0.521 19200
153 1 1 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.555 -0.118 19200
154 1 1 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.791 0.607 19200
155 1 1 . 1 1 38 38 ASP CB C 38 41.045 41.045 39.735 1.310 19200
156 1 1 . 1 1 38 38 ASP H H 38 9.737 9.737 8.837 0.900 19200
157 1 1 . 1 1 39 39 GLU N N 39 116.396 116.396 117.615 -1.219 19200
158 1 1 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.601 0.265 19200
159 1 1 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.674 0.100 19200
160 1 1 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.556 1.818 19200
161 1 1 . 1 1 39 39 GLU H H 39 7.511 7.511 7.553 -0.042 19200
162 1 1 . 1 1 40 40 GLN N N 40 119.983 119.983 119.935 0.048 19200
163 1 1 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.549 -0.014 19200
164 1 1 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.821 -0.450 19200
165 1 1 . 1 1 40 40 GLN CB C 40 30.705 30.705 28.222 2.483 19200
166 1 1 . 1 1 40 40 GLN H H 40 7.084 7.084 7.759 -0.675 19200
167 1 1 . 1 1 41 41 GLY N N 41 113.322 113.322 107.616 5.706 19200
168 1 1 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.825 2.320 19200
169 1 1 . 1 1 41 41 GLY H H 41 8.992 8.992 8.658 0.334 19200
170 1 2 . 1 1 5 5 VAL N N 5 122.070 122.070 115.281 6.789 19200
171 1 2 . 1 1 5 5 VAL HA H 5 4.199 4.199 3.955 0.244 19200
172 1 2 . 1 1 5 5 VAL CA C 5 62.696 62.696 63.235 -0.539 19200
173 1 2 . 1 1 5 5 VAL CB C 5 33.858 33.858 32.322 1.536 19200
174 1 2 . 1 1 5 5 VAL H H 5 8.246 8.246 7.906 0.340 19200
175 1 2 . 1 1 6 6 THR N N 6 119.169 119.169 117.938 1.231 19200
176 1 2 . 1 1 6 6 THR HA H 6 4.376 4.376 4.596 -0.220 19200
177 1 2 . 1 1 6 6 THR CA C 6 61.781 61.781 61.349 0.432 19200
178 1 2 . 1 1 6 6 THR CB C 6 70.908 70.908 70.887 0.021 19200
179 1 2 . 1 1 6 6 THR H H 6 8.243 8.243 8.074 0.169 19200
180 1 2 . 1 1 7 7 CYS N N 7 121.405 121.405 121.240 0.165 19200
181 1 2 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.779 0.045 19200
182 1 2 . 1 1 7 7 CYS CA C 7 53.218 53.218 56.976 -3.758 19200
183 1 2 . 1 1 7 7 CYS CB C 7 41.125 41.125 30.485 10.640 19200
184 1 2 . 1 1 7 7 CYS H H 7 8.656 8.656 8.344 0.312 19200
185 1 2 . 1 1 8 8 SER N N 8 118.316 118.316 116.027 2.289 19200
186 1 2 . 1 1 8 8 SER HA H 8 4.349 4.349 4.648 -0.299 19200
187 1 2 . 1 1 8 8 SER CA C 8 58.967 58.967 57.751 1.216 19200
188 1 2 . 1 1 8 8 SER CB C 8 64.571 64.571 63.681 0.890 19200
189 1 2 . 1 1 8 8 SER H H 8 8.574 8.574 8.214 0.360 19200
190 1 2 . 1 1 9 9 LEU N N 9 121.658 121.658 121.629 0.029 19200
191 1 2 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.257 -0.027 19200
192 1 2 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.583 1.121 19200
193 1 2 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.220 1.080 19200
194 1 2 . 1 1 9 9 LEU H H 9 8.260 8.260 8.399 -0.139 19200
195 1 2 . 1 1 10 10 GLY N N 10 112.236 112.236 106.459 5.777 19200
196 1 2 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.846 0.823 19200
197 1 2 . 1 1 10 10 GLY H H 10 9.031 9.031 8.665 0.366 19200
198 1 2 . 1 1 11 11 TYR N N 11 121.166 121.166 119.208 1.958 19200
199 1 2 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.487 -0.421 19200
200 1 2 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.116 0.169 19200
201 1 2 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.999 -1.169 19200
202 1 2 . 1 1 11 11 TYR H H 11 8.335 8.335 7.683 0.652 19200
203 1 2 . 1 1 12 12 PHE N N 12 121.724 121.724 116.319 5.405 19200
204 1 2 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.183 0.001 19200
205 1 2 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.544 0.299 19200
206 1 2 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.650 1.090 19200
207 1 2 . 1 1 12 12 PHE H H 12 9.791 9.791 9.087 0.704 19200
208 1 2 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.784 0.218 19200
209 1 2 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.603 -0.510 19200
210 1 2 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.653 -1.016 19200
211 1 2 . 1 1 14 14 CYS N N 14 117.951 117.951 116.691 1.260 19200
212 1 2 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.760 0.137 19200
213 1 2 . 1 1 14 14 CYS CA C 14 55.375 55.375 60.018 -4.643 19200
214 1 2 . 1 1 14 14 CYS CB C 14 42.581 42.581 29.035 13.546 19200
215 1 2 . 1 1 14 14 CYS H H 14 8.630 8.630 8.312 0.318 19200
216 1 2 . 1 1 15 15 GLY N N 15 108.668 108.668 105.471 3.197 19200
217 1 2 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.508 0.227 19200
218 1 2 . 1 1 15 15 GLY H H 15 8.372 8.372 7.983 0.389 19200
219 1 2 . 1 1 16 16 ASN N N 16 121.627 121.627 119.790 1.837 19200
220 1 2 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.451 0.082 19200
221 1 2 . 1 1 16 16 ASN CA C 16 55.543 55.543 56.041 -0.498 19200
222 1 2 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.294 0.547 19200
223 1 2 . 1 1 16 16 ASN H H 16 9.709 9.709 8.512 1.197 19200
224 1 2 . 1 1 17 17 ILE N N 17 119.731 119.731 118.546 1.185 19200
225 1 2 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.862 0.353 19200
226 1 2 . 1 1 17 17 ILE CA C 17 61.465 61.465 63.302 -1.837 19200
227 1 2 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.424 0.489 19200
228 1 2 . 1 1 17 17 ILE H H 17 8.196 8.196 8.077 0.119 19200
229 1 2 . 1 1 18 18 THR N N 18 117.836 117.836 109.332 8.504 19200
230 1 2 . 1 1 18 18 THR HA H 18 3.985 3.985 4.037 -0.052 19200
231 1 2 . 1 1 18 18 THR CA C 18 64.041 64.041 62.853 1.188 19200
232 1 2 . 1 1 18 18 THR CB C 18 69.529 69.529 67.110 2.419 19200
233 1 2 . 1 1 18 18 THR H H 18 7.969 7.969 7.664 0.305 19200
234 1 2 . 1 1 19 19 LYS N N 19 124.340 124.340 121.350 2.990 19200
235 1 2 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.085 0.383 19200
236 1 2 . 1 1 19 19 LYS CA C 19 56.099 56.099 57.263 -1.164 19200
237 1 2 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.869 2.986 19200
238 1 2 . 1 1 19 19 LYS H H 19 8.271 8.271 7.849 0.422 19200
239 1 2 . 1 1 20 20 CYS N N 20 121.675 121.675 124.107 -2.432 19200
240 1 2 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.466 0.737 19200
241 1 2 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.393 -3.026 19200
242 1 2 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.742 18.675 19200
243 1 2 . 1 1 20 20 CYS H H 20 8.543 8.543 8.541 0.002 19200
244 1 2 . 1 1 21 21 ILE N N 21 118.395 118.395 120.161 -1.766 19200
245 1 2 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.858 -0.168 19200
246 1 2 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.425 0.871 19200
247 1 2 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.870 -0.016 19200
248 1 2 . 1 1 21 21 ILE H H 21 9.070 9.070 8.867 0.203 19200
249 1 2 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.798 -0.487 19200
250 1 2 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.525 1.566 19200
251 1 2 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.557 0.746 19200
252 1 2 . 1 1 23 23 GLN N N 23 120.837 120.837 124.639 -3.802 19200
253 1 2 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.177 -0.263 19200
254 1 2 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.767 -0.337 19200
255 1 2 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.290 -0.061 19200
256 1 2 . 1 1 23 23 GLN H H 23 8.285 8.285 8.239 0.046 19200
257 1 2 . 1 1 24 24 PHE N N 24 112.558 112.558 118.764 -6.206 19200
258 1 2 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.264 0.519 19200
259 1 2 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.217 -2.012 19200
260 1 2 . 1 1 24 24 PHE CB C 24 37.991 37.991 39.067 -1.076 19200
261 1 2 . 1 1 24 24 PHE H H 24 7.218 7.218 8.206 -0.988 19200
262 1 2 . 1 1 25 25 TRP N N 25 118.981 118.981 117.614 1.367 19200
263 1 2 . 1 1 25 25 TRP HA H 25 5.263 5.263 4.984 0.279 19200
264 1 2 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.510 0.321 19200
265 1 2 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.334 0.579 19200
266 1 2 . 1 1 25 25 TRP H H 25 7.925 7.925 7.886 0.039 19200
267 1 2 . 1 1 26 26 ARG N N 26 126.158 126.158 121.064 5.094 19200
268 1 2 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.643 -0.228 19200
269 1 2 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.905 1.060 19200
270 1 2 . 1 1 26 26 ARG CB C 26 30.716 30.716 30.775 -0.059 19200
271 1 2 . 1 1 26 26 ARG H H 26 8.126 8.126 8.062 0.064 19200
272 1 2 . 1 1 27 27 CYS N N 27 123.356 123.356 122.292 1.064 19200
273 1 2 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.472 0.368 19200
274 1 2 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.841 -3.751 19200
275 1 2 . 1 1 27 27 CYS CB C 27 36.380 36.380 24.935 11.445 19200
276 1 2 . 1 1 27 27 CYS H H 27 8.927 8.927 9.050 -0.123 19200
277 1 2 . 1 1 28 28 ASP N N 28 120.779 120.779 120.992 -0.213 19200
278 1 2 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.631 0.234 19200
279 1 2 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.517 -1.698 19200
280 1 2 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.511 0.678 19200
281 1 2 . 1 1 28 28 ASP H H 28 9.642 9.642 8.558 1.084 19200
282 1 2 . 1 1 29 29 GLY N N 29 111.028 111.028 108.355 2.673 19200
283 1 2 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.408 1.705 19200
284 1 2 . 1 1 29 29 GLY H H 29 9.361 9.361 7.997 1.364 19200
285 1 2 . 1 1 30 30 GLN N N 30 118.561 118.561 118.876 -0.315 19200
286 1 2 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.609 -0.039 19200
287 1 2 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.205 -0.252 19200
288 1 2 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.558 -1.305 19200
289 1 2 . 1 1 30 30 GLN H H 30 7.513 7.513 8.109 -0.596 19200
290 1 2 . 1 1 31 31 VAL N N 31 129.747 129.747 121.541 8.206 19200
291 1 2 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.968 -0.019 19200
292 1 2 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.813 2.360 19200
293 1 2 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.430 0.073 19200
294 1 2 . 1 1 31 31 VAL H H 31 9.403 9.403 8.618 0.785 19200
295 1 2 . 1 1 32 32 ASP N N 32 130.844 130.844 120.371 10.473 19200
296 1 2 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.290 0.569 19200
297 1 2 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.282 0.354 19200
298 1 2 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.569 5.247 19200
299 1 2 . 1 1 32 32 ASP H H 32 10.474 10.474 7.881 2.593 19200
300 1 2 . 1 1 33 33 CYS N N 33 118.607 118.607 116.654 1.953 19200
301 1 2 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.256 0.728 19200
302 1 2 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.519 -6.108 19200
303 1 2 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.921 15.209 19200
304 1 2 . 1 1 33 33 CYS H H 33 8.231 8.231 8.358 -0.127 19200
305 1 2 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.673 -0.390 19200
306 1 2 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.231 1.419 19200
307 1 2 . 1 1 34 34 ASP CB C 34 40.574 40.574 41.070 -0.496 19200
308 1 2 . 1 1 35 35 ASN N N 35 114.357 114.357 115.047 -0.690 19200
309 1 2 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.799 -0.003 19200
310 1 2 . 1 1 35 35 ASN CA C 35 52.031 52.031 53.267 -1.236 19200
311 1 2 . 1 1 35 35 ASN CB C 35 38.525 38.525 38.855 -0.330 19200
312 1 2 . 1 1 35 35 ASN H H 35 7.842 7.842 8.237 -0.395 19200
313 1 2 . 1 1 36 36 GLY N N 36 106.237 106.237 107.831 -1.594 19200
314 1 2 . 1 1 36 36 GLY CA C 36 46.895 46.895 45.193 1.702 19200
315 1 2 . 1 1 36 36 GLY H H 36 8.269 8.269 8.289 -0.020 19200
316 1 2 . 1 1 37 37 SER N N 37 115.105 115.105 116.227 -1.122 19200
317 1 2 . 1 1 37 37 SER HA H 37 4.026 4.026 4.357 -0.331 19200
318 1 2 . 1 1 37 37 SER CA C 37 62.619 62.619 61.275 1.344 19200
319 1 2 . 1 1 37 37 SER CB C 37 63.494 63.494 63.204 0.290 19200
320 1 2 . 1 1 37 37 SER H H 37 7.900 7.900 7.890 0.010 19200
321 1 2 . 1 1 38 38 ASP N N 38 116.663 116.663 117.187 -0.524 19200
322 1 2 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.550 -0.113 19200
323 1 2 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.772 0.626 19200
324 1 2 . 1 1 38 38 ASP CB C 38 41.045 41.045 39.689 1.356 19200
325 1 2 . 1 1 38 38 ASP H H 38 9.737 9.737 8.857 0.880 19200
326 1 2 . 1 1 39 39 GLU N N 39 116.396 116.396 117.359 -0.963 19200
327 1 2 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.718 0.148 19200
328 1 2 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.204 0.570 19200
329 1 2 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.340 2.034 19200
330 1 2 . 1 1 39 39 GLU H H 39 7.511 7.511 7.738 -0.227 19200
331 1 2 . 1 1 40 40 GLN N N 40 119.983 119.983 120.612 -0.629 19200
332 1 2 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.393 0.142 19200
333 1 2 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.710 -0.339 19200
334 1 2 . 1 1 40 40 GLN CB C 40 30.705 30.705 27.476 3.229 19200
335 1 2 . 1 1 40 40 GLN H H 40 7.084 7.084 7.843 -0.759 19200
336 1 2 . 1 1 41 41 GLY N N 41 113.322 113.322 109.607 3.715 19200
337 1 2 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.992 2.153 19200
338 1 2 . 1 1 41 41 GLY H H 41 8.992 8.992 8.526 0.466 19200
339 1 3 . 1 1 5 5 VAL N N 5 122.070 122.070 120.652 1.418 19200
340 1 3 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.083 0.116 19200
341 1 3 . 1 1 5 5 VAL CA C 5 62.696 62.696 62.403 0.293 19200
342 1 3 . 1 1 5 5 VAL CB C 5 33.858 33.858 32.152 1.706 19200
343 1 3 . 1 1 5 5 VAL H H 5 8.246 8.246 7.808 0.438 19200
344 1 3 . 1 1 6 6 THR N N 6 119.169 119.169 117.889 1.280 19200
345 1 3 . 1 1 6 6 THR HA H 6 4.376 4.376 4.633 -0.257 19200
346 1 3 . 1 1 6 6 THR CA C 6 61.781 61.781 61.345 0.436 19200
347 1 3 . 1 1 6 6 THR CB C 6 70.908 70.908 71.266 -0.359 19200
348 1 3 . 1 1 6 6 THR H H 6 8.243 8.243 8.204 0.039 19200
349 1 3 . 1 1 7 7 CYS N N 7 121.405 121.405 120.543 0.862 19200
350 1 3 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.816 0.008 19200
351 1 3 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.034 -3.816 19200
352 1 3 . 1 1 7 7 CYS CB C 7 41.125 41.125 30.004 11.121 19200
353 1 3 . 1 1 7 7 CYS H H 7 8.656 8.656 8.301 0.355 19200
354 1 3 . 1 1 8 8 SER N N 8 118.316 118.316 115.854 2.462 19200
355 1 3 . 1 1 8 8 SER HA H 8 4.349 4.349 4.603 -0.254 19200
356 1 3 . 1 1 8 8 SER CA C 8 58.967 58.967 57.785 1.182 19200
357 1 3 . 1 1 8 8 SER CB C 8 64.571 64.571 63.559 1.012 19200
358 1 3 . 1 1 8 8 SER H H 8 8.574 8.574 8.239 0.335 19200
359 1 3 . 1 1 9 9 LEU N N 9 121.658 121.658 121.935 -0.277 19200
360 1 3 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.204 0.026 19200
361 1 3 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.850 0.854 19200
362 1 3 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.505 0.795 19200
363 1 3 . 1 1 9 9 LEU H H 9 8.260 8.260 8.371 -0.111 19200
364 1 3 . 1 1 10 10 GLY N N 10 112.236 112.236 106.262 5.974 19200
365 1 3 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.848 0.821 19200
366 1 3 . 1 1 10 10 GLY H H 10 9.031 9.031 8.652 0.379 19200
367 1 3 . 1 1 11 11 TYR N N 11 121.166 121.166 119.246 1.920 19200
368 1 3 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.567 -0.501 19200
369 1 3 . 1 1 11 11 TYR CA C 11 57.285 57.285 56.881 0.404 19200
370 1 3 . 1 1 11 11 TYR CB C 11 41.830 41.830 43.056 -1.226 19200
371 1 3 . 1 1 11 11 TYR H H 11 8.335 8.335 7.695 0.640 19200
372 1 3 . 1 1 12 12 PHE N N 12 121.724 121.724 117.719 4.005 19200
373 1 3 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.178 0.005 19200
374 1 3 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.502 0.341 19200
375 1 3 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.274 1.466 19200
376 1 3 . 1 1 12 12 PHE H H 12 9.791 9.791 9.182 0.609 19200
377 1 3 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.667 0.335 19200
378 1 3 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.517 -0.424 19200
379 1 3 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.668 -1.031 19200
380 1 3 . 1 1 14 14 CYS N N 14 117.951 117.951 116.468 1.483 19200
381 1 3 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.744 0.153 19200
382 1 3 . 1 1 14 14 CYS CA C 14 55.375 55.375 60.029 -4.654 19200
383 1 3 . 1 1 14 14 CYS CB C 14 42.581 42.581 29.005 13.576 19200
384 1 3 . 1 1 14 14 CYS H H 14 8.630 8.630 8.311 0.319 19200
385 1 3 . 1 1 15 15 GLY N N 15 108.668 108.668 106.112 2.556 19200
386 1 3 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.460 0.275 19200
387 1 3 . 1 1 15 15 GLY H H 15 8.372 8.372 7.812 0.560 19200
388 1 3 . 1 1 16 16 ASN N N 16 121.627 121.627 118.403 3.224 19200
389 1 3 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.463 0.070 19200
390 1 3 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.284 0.259 19200
391 1 3 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.249 0.592 19200
392 1 3 . 1 1 16 16 ASN H H 16 9.709 9.709 8.533 1.176 19200
393 1 3 . 1 1 17 17 ILE N N 17 119.731 119.731 117.137 2.594 19200
394 1 3 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.950 0.265 19200
395 1 3 . 1 1 17 17 ILE CA C 17 61.465 61.465 62.400 -0.935 19200
396 1 3 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.595 0.318 19200
397 1 3 . 1 1 17 17 ILE H H 17 8.196 8.196 7.825 0.371 19200
398 1 3 . 1 1 18 18 THR N N 18 117.836 117.836 109.929 7.907 19200
399 1 3 . 1 1 18 18 THR HA H 18 3.985 3.985 4.077 -0.092 19200
400 1 3 . 1 1 18 18 THR CA C 18 64.041 64.041 63.016 1.026 19200
401 1 3 . 1 1 18 18 THR CB C 18 69.529 69.529 67.081 2.448 19200
402 1 3 . 1 1 18 18 THR H H 18 7.969 7.969 7.684 0.285 19200
403 1 3 . 1 1 19 19 LYS N N 19 124.340 124.340 121.233 3.107 19200
404 1 3 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.008 0.460 19200
405 1 3 . 1 1 19 19 LYS CA C 19 56.099 56.099 56.924 -0.825 19200
406 1 3 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.516 3.339 19200
407 1 3 . 1 1 19 19 LYS H H 19 8.271 8.271 7.785 0.486 19200
408 1 3 . 1 1 20 20 CYS N N 20 121.675 121.675 123.850 -2.175 19200
409 1 3 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.457 0.746 19200
410 1 3 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.041 -2.674 19200
411 1 3 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.944 18.474 19200
412 1 3 . 1 1 20 20 CYS H H 20 8.543 8.543 8.354 0.189 19200
413 1 3 . 1 1 21 21 ILE N N 21 118.395 118.395 120.337 -1.942 19200
414 1 3 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.856 -0.166 19200
415 1 3 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.413 0.883 19200
416 1 3 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.807 0.047 19200
417 1 3 . 1 1 21 21 ILE H H 21 9.070 9.070 8.871 0.199 19200
418 1 3 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.415 -0.104 19200
419 1 3 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.547 1.544 19200
420 1 3 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.555 0.748 19200
421 1 3 . 1 1 23 23 GLN N N 23 120.837 120.837 124.652 -3.815 19200
422 1 3 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.134 -0.220 19200
423 1 3 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.765 -0.336 19200
424 1 3 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.357 -0.128 19200
425 1 3 . 1 1 23 23 GLN H H 23 8.285 8.285 8.436 -0.151 19200
426 1 3 . 1 1 24 24 PHE N N 24 112.558 112.558 117.969 -5.411 19200
427 1 3 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.253 0.530 19200
428 1 3 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.477 -2.272 19200
429 1 3 . 1 1 24 24 PHE CB C 24 37.991 37.991 39.030 -1.039 19200
430 1 3 . 1 1 24 24 PHE H H 24 7.218 7.218 8.197 -0.979 19200
431 1 3 . 1 1 25 25 TRP N N 25 118.981 118.981 117.634 1.347 19200
432 1 3 . 1 1 25 25 TRP HA H 25 5.263 5.263 4.940 0.323 19200
433 1 3 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.738 0.093 19200
434 1 3 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.350 0.563 19200
435 1 3 . 1 1 25 25 TRP H H 25 7.925 7.925 7.887 0.038 19200
436 1 3 . 1 1 26 26 ARG N N 26 126.158 126.158 120.500 5.658 19200
437 1 3 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.661 -0.246 19200
438 1 3 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.682 1.283 19200
439 1 3 . 1 1 26 26 ARG CB C 26 30.716 30.716 31.561 -0.845 19200
440 1 3 . 1 1 26 26 ARG H H 26 8.126 8.126 7.999 0.127 19200
441 1 3 . 1 1 27 27 CYS N N 27 123.356 123.356 121.321 2.035 19200
442 1 3 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.312 0.528 19200
443 1 3 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.598 -3.508 19200
444 1 3 . 1 1 27 27 CYS CB C 27 36.380 36.380 24.577 11.803 19200
445 1 3 . 1 1 27 27 CYS H H 27 8.927 8.927 9.151 -0.224 19200
446 1 3 . 1 1 28 28 ASP N N 28 120.779 120.779 121.316 -0.537 19200
447 1 3 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.616 0.249 19200
448 1 3 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.839 -2.020 19200
449 1 3 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.505 0.684 19200
450 1 3 . 1 1 28 28 ASP H H 28 9.642 9.642 8.550 1.092 19200
451 1 3 . 1 1 29 29 GLY N N 29 111.028 111.028 109.512 1.516 19200
452 1 3 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.605 1.508 19200
453 1 3 . 1 1 29 29 GLY H H 29 9.361 9.361 8.180 1.181 19200
454 1 3 . 1 1 30 30 GLN N N 30 118.561 118.561 119.012 -0.451 19200
455 1 3 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.621 -0.051 19200
456 1 3 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.460 -0.507 19200
457 1 3 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.602 -1.349 19200
458 1 3 . 1 1 30 30 GLN H H 30 7.513 7.513 8.079 -0.566 19200
459 1 3 . 1 1 31 31 VAL N N 31 129.747 129.747 122.211 7.536 19200
460 1 3 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.966 -0.017 19200
461 1 3 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.837 2.336 19200
462 1 3 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.602 -0.099 19200
463 1 3 . 1 1 31 31 VAL H H 31 9.403 9.403 8.563 0.840 19200
464 1 3 . 1 1 32 32 ASP N N 32 130.844 130.844 120.889 9.955 19200
465 1 3 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.280 0.579 19200
466 1 3 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.455 0.181 19200
467 1 3 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.520 5.296 19200
468 1 3 . 1 1 32 32 ASP H H 32 10.474 10.474 8.014 2.460 19200
469 1 3 . 1 1 33 33 CYS N N 33 118.607 118.607 118.148 0.459 19200
470 1 3 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.264 0.720 19200
471 1 3 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.192 -5.781 19200
472 1 3 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.579 15.550 19200
473 1 3 . 1 1 33 33 CYS H H 33 8.231 8.231 7.922 0.309 19200
474 1 3 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.418 -0.135 19200
475 1 3 . 1 1 34 34 ASP CA C 34 57.651 57.651 57.025 0.626 19200
476 1 3 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.892 -0.318 19200
477 1 3 . 1 1 35 35 ASN N N 35 114.357 114.357 112.617 1.740 19200
478 1 3 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.790 0.006 19200
479 1 3 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.507 -0.476 19200
480 1 3 . 1 1 35 35 ASN CB C 35 38.525 38.525 37.944 0.581 19200
481 1 3 . 1 1 35 35 ASN H H 35 7.842 7.842 7.978 -0.136 19200
482 1 3 . 1 1 36 36 GLY N N 36 106.237 106.237 108.484 -2.247 19200
483 1 3 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.324 0.571 19200
484 1 3 . 1 1 36 36 GLY H H 36 8.269 8.269 7.977 0.292 19200
485 1 3 . 1 1 37 37 SER N N 37 115.105 115.105 114.857 0.248 19200
486 1 3 . 1 1 37 37 SER HA H 37 4.026 4.026 4.225 -0.199 19200
487 1 3 . 1 1 37 37 SER CA C 37 62.619 62.619 60.092 2.527 19200
488 1 3 . 1 1 37 37 SER CB C 37 63.494 63.494 63.333 0.161 19200
489 1 3 . 1 1 37 37 SER H H 37 7.900 7.900 7.798 0.102 19200
490 1 3 . 1 1 38 38 ASP N N 38 116.663 116.663 117.730 -1.067 19200
491 1 3 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.535 -0.098 19200
492 1 3 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.845 0.553 19200
493 1 3 . 1 1 38 38 ASP CB C 38 41.045 41.045 39.728 1.317 19200
494 1 3 . 1 1 38 38 ASP H H 38 9.737 9.737 8.785 0.952 19200
495 1 3 . 1 1 39 39 GLU N N 39 116.396 116.396 117.787 -1.391 19200
496 1 3 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.567 0.299 19200
497 1 3 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.733 0.041 19200
498 1 3 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.334 2.040 19200
499 1 3 . 1 1 39 39 GLU H H 39 7.511 7.511 7.577 -0.066 19200
500 1 3 . 1 1 40 40 GLN N N 40 119.983 119.983 119.519 0.464 19200
501 1 3 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.520 0.015 19200
502 1 3 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.730 -0.359 19200
503 1 3 . 1 1 40 40 GLN CB C 40 30.705 30.705 28.406 2.299 19200
504 1 3 . 1 1 40 40 GLN H H 40 7.084 7.084 7.799 -0.715 19200
505 1 3 . 1 1 41 41 GLY N N 41 113.322 113.322 107.304 6.018 19200
506 1 3 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.736 2.409 19200
507 1 3 . 1 1 41 41 GLY H H 41 8.992 8.992 8.590 0.402 19200
508 1 4 . 1 1 5 5 VAL N N 5 122.070 122.070 117.711 4.359 19200
509 1 4 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.142 0.057 19200
510 1 4 . 1 1 5 5 VAL CA C 5 62.696 62.696 62.882 -0.186 19200
511 1 4 . 1 1 5 5 VAL CB C 5 33.858 33.858 32.254 1.605 19200
512 1 4 . 1 1 5 5 VAL H H 5 8.246 8.246 7.765 0.481 19200
513 1 4 . 1 1 6 6 THR N N 6 119.169 119.169 118.646 0.523 19200
514 1 4 . 1 1 6 6 THR HA H 6 4.376 4.376 4.627 -0.251 19200
515 1 4 . 1 1 6 6 THR CA C 6 61.781 61.781 61.221 0.560 19200
516 1 4 . 1 1 6 6 THR CB C 6 70.908 70.908 71.690 -0.782 19200
517 1 4 . 1 1 6 6 THR H H 6 8.243 8.243 8.374 -0.131 19200
518 1 4 . 1 1 7 7 CYS N N 7 121.405 121.405 119.289 2.116 19200
519 1 4 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.830 -0.006 19200
520 1 4 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.041 -3.823 19200
521 1 4 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.882 11.243 19200
522 1 4 . 1 1 7 7 CYS H H 7 8.656 8.656 8.341 0.315 19200
523 1 4 . 1 1 8 8 SER N N 8 118.316 118.316 116.406 1.910 19200
524 1 4 . 1 1 8 8 SER HA H 8 4.349 4.349 4.639 -0.290 19200
525 1 4 . 1 1 8 8 SER CA C 8 58.967 58.967 57.647 1.320 19200
526 1 4 . 1 1 8 8 SER CB C 8 64.571 64.571 63.505 1.066 19200
527 1 4 . 1 1 8 8 SER H H 8 8.574 8.574 8.290 0.284 19200
528 1 4 . 1 1 9 9 LEU N N 9 121.658 121.658 121.449 0.209 19200
529 1 4 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.254 -0.024 19200
530 1 4 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.560 1.144 19200
531 1 4 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.056 1.244 19200
532 1 4 . 1 1 9 9 LEU H H 9 8.260 8.260 8.412 -0.152 19200
533 1 4 . 1 1 10 10 GLY N N 10 112.236 112.236 106.729 5.507 19200
534 1 4 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.732 0.937 19200
535 1 4 . 1 1 10 10 GLY H H 10 9.031 9.031 8.717 0.314 19200
536 1 4 . 1 1 11 11 TYR N N 11 121.166 121.166 119.010 2.156 19200
537 1 4 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.497 -0.431 19200
538 1 4 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.043 0.242 19200
539 1 4 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.909 -1.079 19200
540 1 4 . 1 1 11 11 TYR H H 11 8.335 8.335 7.658 0.677 19200
541 1 4 . 1 1 12 12 PHE N N 12 121.724 121.724 116.109 5.615 19200
542 1 4 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.180 0.003 19200
543 1 4 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.370 0.473 19200
544 1 4 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.591 1.149 19200
545 1 4 . 1 1 12 12 PHE H H 12 9.791 9.791 9.124 0.667 19200
546 1 4 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.675 0.327 19200
547 1 4 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.594 -0.502 19200
548 1 4 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.679 -1.042 19200
549 1 4 . 1 1 14 14 CYS N N 14 117.951 117.951 116.790 1.161 19200
550 1 4 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.750 0.147 19200
551 1 4 . 1 1 14 14 CYS CA C 14 55.375 55.375 60.144 -4.769 19200
552 1 4 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.920 13.661 19200
553 1 4 . 1 1 14 14 CYS H H 14 8.630 8.630 8.445 0.185 19200
554 1 4 . 1 1 15 15 GLY N N 15 108.668 108.668 106.127 2.541 19200
555 1 4 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.406 0.329 19200
556 1 4 . 1 1 15 15 GLY H H 15 8.372 8.372 8.042 0.330 19200
557 1 4 . 1 1 16 16 ASN N N 16 121.627 121.627 120.085 1.542 19200
558 1 4 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.532 0.001 19200
559 1 4 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.656 -0.113 19200
560 1 4 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.519 0.322 19200
561 1 4 . 1 1 16 16 ASN H H 16 9.709 9.709 8.628 1.081 19200
562 1 4 . 1 1 17 17 ILE N N 17 119.731 119.731 119.484 0.247 19200
563 1 4 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.918 0.297 19200
564 1 4 . 1 1 17 17 ILE CA C 17 61.465 61.465 63.047 -1.582 19200
565 1 4 . 1 1 17 17 ILE CB C 17 37.913 37.913 38.080 -0.167 19200
566 1 4 . 1 1 17 17 ILE H H 17 8.196 8.196 7.824 0.372 19200
567 1 4 . 1 1 18 18 THR N N 18 117.836 117.836 108.960 8.876 19200
568 1 4 . 1 1 18 18 THR HA H 18 3.985 3.985 4.101 -0.116 19200
569 1 4 . 1 1 18 18 THR CA C 18 64.041 64.041 62.993 1.048 19200
570 1 4 . 1 1 18 18 THR CB C 18 69.529 69.529 67.082 2.447 19200
571 1 4 . 1 1 18 18 THR H H 18 7.969 7.969 7.684 0.285 19200
572 1 4 . 1 1 19 19 LYS N N 19 124.340 124.340 121.204 3.136 19200
573 1 4 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.020 0.448 19200
574 1 4 . 1 1 19 19 LYS CA C 19 56.099 56.099 57.146 -1.047 19200
575 1 4 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.812 3.043 19200
576 1 4 . 1 1 19 19 LYS H H 19 8.271 8.271 7.846 0.425 19200
577 1 4 . 1 1 20 20 CYS N N 20 121.675 121.675 123.003 -1.328 19200
578 1 4 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.491 0.712 19200
579 1 4 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.498 -3.131 19200
580 1 4 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.753 18.665 19200
581 1 4 . 1 1 20 20 CYS H H 20 8.543 8.543 8.272 0.271 19200
582 1 4 . 1 1 21 21 ILE N N 21 118.395 118.395 122.034 -3.639 19200
583 1 4 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.853 -0.163 19200
584 1 4 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.156 1.140 19200
585 1 4 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.576 0.278 19200
586 1 4 . 1 1 21 21 ILE H H 21 9.070 9.070 8.727 0.343 19200
587 1 4 . 1 1 22 22 PRO HA H 22 3.311 3.311 4.007 -0.696 19200
588 1 4 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.645 1.446 19200
589 1 4 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.637 0.667 19200
590 1 4 . 1 1 23 23 GLN N N 23 120.837 120.837 124.314 -3.477 19200
591 1 4 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.106 -0.192 19200
592 1 4 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.534 -0.105 19200
593 1 4 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.216 0.013 19200
594 1 4 . 1 1 23 23 GLN H H 23 8.285 8.285 8.257 0.028 19200
595 1 4 . 1 1 24 24 PHE N N 24 112.558 112.558 117.797 -5.239 19200
596 1 4 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.249 0.534 19200
597 1 4 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.452 -2.247 19200
598 1 4 . 1 1 24 24 PHE CB C 24 37.991 37.991 39.024 -1.033 19200
599 1 4 . 1 1 24 24 PHE H H 24 7.218 7.218 8.160 -0.942 19200
600 1 4 . 1 1 25 25 TRP N N 25 118.981 118.981 119.367 -0.386 19200
601 1 4 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.291 -0.028 19200
602 1 4 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.335 0.496 19200
603 1 4 . 1 1 25 25 TRP CB C 25 28.913 28.913 27.751 1.162 19200
604 1 4 . 1 1 25 25 TRP H H 25 7.925 7.925 7.791 0.134 19200
605 1 4 . 1 1 26 26 ARG N N 26 126.158 126.158 120.578 5.580 19200
606 1 4 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.688 -0.273 19200
607 1 4 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.310 1.655 19200
608 1 4 . 1 1 26 26 ARG CB C 26 30.716 30.716 32.346 -1.630 19200
609 1 4 . 1 1 26 26 ARG H H 26 8.126 8.126 7.814 0.312 19200
610 1 4 . 1 1 27 27 CYS N N 27 123.356 123.356 124.123 -0.767 19200
611 1 4 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.303 0.537 19200
612 1 4 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.774 -3.684 19200
613 1 4 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.487 10.893 19200
614 1 4 . 1 1 27 27 CYS H H 27 8.927 8.927 9.074 -0.147 19200
615 1 4 . 1 1 28 28 ASP N N 28 120.779 120.779 120.806 -0.027 19200
616 1 4 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.712 0.153 19200
617 1 4 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.316 -1.497 19200
618 1 4 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.526 0.663 19200
619 1 4 . 1 1 28 28 ASP H H 28 9.642 9.642 8.557 1.085 19200
620 1 4 . 1 1 29 29 GLY N N 29 111.028 111.028 108.761 2.267 19200
621 1 4 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.460 1.653 19200
622 1 4 . 1 1 29 29 GLY H H 29 9.361 9.361 8.262 1.099 19200
623 1 4 . 1 1 30 30 GLN N N 30 118.561 118.561 118.764 -0.203 19200
624 1 4 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.578 -0.008 19200
625 1 4 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.571 -0.618 19200
626 1 4 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.204 -0.951 19200
627 1 4 . 1 1 30 30 GLN H H 30 7.513 7.513 7.749 -0.236 19200
628 1 4 . 1 1 31 31 VAL N N 31 129.747 129.747 122.822 6.925 19200
629 1 4 . 1 1 31 31 VAL HA H 31 3.949 3.949 4.126 -0.177 19200
630 1 4 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.450 2.723 19200
631 1 4 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.880 -0.377 19200
632 1 4 . 1 1 31 31 VAL H H 31 9.403 9.403 8.562 0.841 19200
633 1 4 . 1 1 32 32 ASP N N 32 130.844 130.844 119.064 11.780 19200
634 1 4 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.271 0.588 19200
635 1 4 . 1 1 32 32 ASP CA C 32 56.636 56.636 55.430 1.206 19200
636 1 4 . 1 1 32 32 ASP CB C 32 45.816 45.816 39.631 6.185 19200
637 1 4 . 1 1 32 32 ASP H H 32 10.474 10.474 8.041 2.433 19200
638 1 4 . 1 1 33 33 CYS N N 33 118.607 118.607 119.436 -0.829 19200
639 1 4 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.284 0.700 19200
640 1 4 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.336 -5.925 19200
641 1 4 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.484 15.646 19200
642 1 4 . 1 1 33 33 CYS H H 33 8.231 8.231 7.875 0.356 19200
643 1 4 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.461 -0.178 19200
644 1 4 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.886 0.765 19200
645 1 4 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.843 -0.268 19200
646 1 4 . 1 1 35 35 ASN N N 35 114.357 114.357 114.632 -0.275 19200
647 1 4 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.850 -0.054 19200
648 1 4 . 1 1 35 35 ASN CA C 35 52.031 52.031 53.085 -1.054 19200
649 1 4 . 1 1 35 35 ASN CB C 35 38.525 38.525 38.718 -0.193 19200
650 1 4 . 1 1 35 35 ASN H H 35 7.842 7.842 8.010 -0.168 19200
651 1 4 . 1 1 36 36 GLY N N 36 106.237 106.237 108.954 -2.717 19200
652 1 4 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.194 0.702 19200
653 1 4 . 1 1 36 36 GLY H H 36 8.269 8.269 7.837 0.432 19200
654 1 4 . 1 1 37 37 SER N N 37 115.105 115.105 114.743 0.362 19200
655 1 4 . 1 1 37 37 SER HA H 37 4.026 4.026 4.233 -0.207 19200
656 1 4 . 1 1 37 37 SER CA C 37 62.619 62.619 60.581 2.038 19200
657 1 4 . 1 1 37 37 SER CB C 37 63.494 63.494 63.225 0.269 19200
658 1 4 . 1 1 37 37 SER H H 37 7.900 7.900 8.186 -0.286 19200
659 1 4 . 1 1 38 38 ASP N N 38 116.663 116.663 117.146 -0.483 19200
660 1 4 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.542 -0.105 19200
661 1 4 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.471 0.927 19200
662 1 4 . 1 1 38 38 ASP CB C 38 41.045 41.045 39.770 1.275 19200
663 1 4 . 1 1 38 38 ASP H H 38 9.737 9.737 8.799 0.938 19200
664 1 4 . 1 1 39 39 GLU N N 39 116.396 116.396 117.832 -1.436 19200
665 1 4 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.606 0.260 19200
666 1 4 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.756 0.018 19200
667 1 4 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.662 1.712 19200
668 1 4 . 1 1 39 39 GLU H H 39 7.511 7.511 7.689 -0.178 19200
669 1 4 . 1 1 40 40 GLN N N 40 119.983 119.983 119.618 0.365 19200
670 1 4 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.563 -0.028 19200
671 1 4 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.921 -0.550 19200
672 1 4 . 1 1 40 40 GLN CB C 40 30.705 30.705 28.704 2.001 19200
673 1 4 . 1 1 40 40 GLN H H 40 7.084 7.084 7.764 -0.680 19200
674 1 4 . 1 1 41 41 GLY N N 41 113.322 113.322 107.359 5.963 19200
675 1 4 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.755 2.390 19200
676 1 4 . 1 1 41 41 GLY H H 41 8.992 8.992 8.574 0.418 19200
677 1 5 . 1 1 5 5 VAL N N 5 122.070 122.070 116.815 5.255 19200
678 1 5 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.003 0.196 19200
679 1 5 . 1 1 5 5 VAL CA C 5 62.696 62.696 63.452 -0.756 19200
680 1 5 . 1 1 5 5 VAL CB C 5 33.858 33.858 31.861 1.997 19200
681 1 5 . 1 1 5 5 VAL H H 5 8.246 8.246 8.004 0.242 19200
682 1 5 . 1 1 6 6 THR N N 6 119.169 119.169 118.313 0.856 19200
683 1 5 . 1 1 6 6 THR HA H 6 4.376 4.376 4.532 -0.156 19200
684 1 5 . 1 1 6 6 THR CA C 6 61.781 61.781 61.561 0.220 19200
685 1 5 . 1 1 6 6 THR CB C 6 70.908 70.908 71.199 -0.291 19200
686 1 5 . 1 1 6 6 THR H H 6 8.243 8.243 8.307 -0.064 19200
687 1 5 . 1 1 7 7 CYS N N 7 121.405 121.405 120.300 1.105 19200
688 1 5 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.784 0.040 19200
689 1 5 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.254 -4.036 19200
690 1 5 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.785 11.340 19200
691 1 5 . 1 1 7 7 CYS H H 7 8.656 8.656 8.374 0.282 19200
692 1 5 . 1 1 8 8 SER N N 8 118.316 118.316 115.738 2.578 19200
693 1 5 . 1 1 8 8 SER HA H 8 4.349 4.349 4.716 -0.367 19200
694 1 5 . 1 1 8 8 SER CA C 8 58.967 58.967 58.111 0.856 19200
695 1 5 . 1 1 8 8 SER CB C 8 64.571 64.571 63.911 0.660 19200
696 1 5 . 1 1 8 8 SER H H 8 8.574 8.574 8.339 0.235 19200
697 1 5 . 1 1 9 9 LEU N N 9 121.658 121.658 120.768 0.890 19200
698 1 5 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.420 -0.190 19200
699 1 5 . 1 1 9 9 LEU CA C 9 57.704 57.704 57.053 0.651 19200
700 1 5 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.385 0.915 19200
701 1 5 . 1 1 9 9 LEU H H 9 8.260 8.260 8.417 -0.157 19200
702 1 5 . 1 1 10 10 GLY N N 10 112.236 112.236 105.400 6.836 19200
703 1 5 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.718 0.951 19200
704 1 5 . 1 1 10 10 GLY H H 10 9.031 9.031 8.377 0.654 19200
705 1 5 . 1 1 11 11 TYR N N 11 121.166 121.166 118.565 2.601 19200
706 1 5 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.521 -0.455 19200
707 1 5 . 1 1 11 11 TYR CA C 11 57.285 57.285 56.856 0.429 19200
708 1 5 . 1 1 11 11 TYR CB C 11 41.830 41.830 43.110 -1.280 19200
709 1 5 . 1 1 11 11 TYR H H 11 8.335 8.335 7.493 0.842 19200
710 1 5 . 1 1 12 12 PHE N N 12 121.724 121.724 116.344 5.380 19200
711 1 5 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.173 0.011 19200
712 1 5 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.653 0.190 19200
713 1 5 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.503 1.237 19200
714 1 5 . 1 1 12 12 PHE H H 12 9.791 9.791 9.166 0.625 19200
715 1 5 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.668 0.334 19200
716 1 5 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.637 -0.544 19200
717 1 5 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.495 -0.858 19200
718 1 5 . 1 1 14 14 CYS N N 14 117.951 117.951 117.687 0.264 19200
719 1 5 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.753 0.144 19200
720 1 5 . 1 1 14 14 CYS CA C 14 55.375 55.375 59.020 -3.645 19200
721 1 5 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.663 13.918 19200
722 1 5 . 1 1 14 14 CYS H H 14 8.630 8.630 8.427 0.203 19200
723 1 5 . 1 1 15 15 GLY N N 15 108.668 108.668 105.886 2.782 19200
724 1 5 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.245 0.490 19200
725 1 5 . 1 1 15 15 GLY H H 15 8.372 8.372 7.791 0.581 19200
726 1 5 . 1 1 16 16 ASN N N 16 121.627 121.627 119.817 1.810 19200
727 1 5 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.415 0.118 19200
728 1 5 . 1 1 16 16 ASN CA C 16 55.543 55.543 56.030 -0.487 19200
729 1 5 . 1 1 16 16 ASN CB C 16 38.841 38.841 37.974 0.867 19200
730 1 5 . 1 1 16 16 ASN H H 16 9.709 9.709 8.583 1.126 19200
731 1 5 . 1 1 17 17 ILE N N 17 119.731 119.731 117.711 2.020 19200
732 1 5 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.998 0.217 19200
733 1 5 . 1 1 17 17 ILE CA C 17 61.465 61.465 62.604 -1.139 19200
734 1 5 . 1 1 17 17 ILE CB C 17 37.913 37.913 36.816 1.097 19200
735 1 5 . 1 1 17 17 ILE H H 17 8.196 8.196 7.975 0.221 19200
736 1 5 . 1 1 18 18 THR N N 18 117.836 117.836 108.970 8.866 19200
737 1 5 . 1 1 18 18 THR HA H 18 3.985 3.985 4.071 -0.086 19200
738 1 5 . 1 1 18 18 THR CA C 18 64.041 64.041 63.034 1.007 19200
739 1 5 . 1 1 18 18 THR CB C 18 69.529 69.529 67.293 2.236 19200
740 1 5 . 1 1 18 18 THR H H 18 7.969 7.969 7.758 0.211 19200
741 1 5 . 1 1 19 19 LYS N N 19 124.340 124.340 120.940 3.400 19200
742 1 5 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.061 0.407 19200
743 1 5 . 1 1 19 19 LYS CA C 19 56.099 56.099 56.677 -0.578 19200
744 1 5 . 1 1 19 19 LYS CB C 19 35.855 35.855 33.073 2.782 19200
745 1 5 . 1 1 19 19 LYS H H 19 8.271 8.271 7.859 0.412 19200
746 1 5 . 1 1 20 20 CYS N N 20 121.675 121.675 123.640 -1.965 19200
747 1 5 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.537 0.666 19200
748 1 5 . 1 1 20 20 CYS CA C 20 55.367 55.367 57.685 -2.318 19200
749 1 5 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.933 18.485 19200
750 1 5 . 1 1 20 20 CYS H H 20 8.543 8.543 8.355 0.188 19200
751 1 5 . 1 1 21 21 ILE N N 21 118.395 118.395 120.891 -2.496 19200
752 1 5 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.865 -0.175 19200
753 1 5 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.426 0.870 19200
754 1 5 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.556 0.298 19200
755 1 5 . 1 1 21 21 ILE H H 21 9.070 9.070 8.864 0.206 19200
756 1 5 . 1 1 22 22 PRO HA H 22 3.311 3.311 4.019 -0.708 19200
757 1 5 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.678 1.413 19200
758 1 5 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.639 0.665 19200
759 1 5 . 1 1 23 23 GLN N N 23 120.837 120.837 124.355 -3.518 19200
760 1 5 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.150 -0.236 19200
761 1 5 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.636 -0.207 19200
762 1 5 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.255 -0.026 19200
763 1 5 . 1 1 23 23 GLN H H 23 8.285 8.285 8.281 0.004 19200
764 1 5 . 1 1 24 24 PHE N N 24 112.558 112.558 118.635 -6.077 19200
765 1 5 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.279 0.504 19200
766 1 5 . 1 1 24 24 PHE CA C 24 58.205 58.205 59.921 -1.716 19200
767 1 5 . 1 1 24 24 PHE CB C 24 37.991 37.991 39.099 -1.108 19200
768 1 5 . 1 1 24 24 PHE H H 24 7.218 7.218 8.263 -1.045 19200
769 1 5 . 1 1 25 25 TRP N N 25 118.981 118.981 119.932 -0.951 19200
770 1 5 . 1 1 25 25 TRP HA H 25 5.263 5.263 4.990 0.273 19200
771 1 5 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.651 0.180 19200
772 1 5 . 1 1 25 25 TRP CB C 25 28.913 28.913 27.532 1.381 19200
773 1 5 . 1 1 25 25 TRP H H 25 7.925 7.925 7.944 -0.019 19200
774 1 5 . 1 1 26 26 ARG N N 26 126.158 126.158 120.122 6.036 19200
775 1 5 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.512 -0.097 19200
776 1 5 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.486 1.479 19200
777 1 5 . 1 1 26 26 ARG CB C 26 30.716 30.716 32.035 -1.319 19200
778 1 5 . 1 1 26 26 ARG H H 26 8.126 8.126 7.792 0.334 19200
779 1 5 . 1 1 27 27 CYS N N 27 123.356 123.356 122.543 0.813 19200
780 1 5 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.263 0.577 19200
781 1 5 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.896 -3.806 19200
782 1 5 . 1 1 27 27 CYS CB C 27 36.380 36.380 24.807 11.573 19200
783 1 5 . 1 1 27 27 CYS H H 27 8.927 8.927 9.088 -0.161 19200
784 1 5 . 1 1 28 28 ASP N N 28 120.779 120.779 120.813 -0.034 19200
785 1 5 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.682 0.183 19200
786 1 5 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.193 -1.374 19200
787 1 5 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.679 0.510 19200
788 1 5 . 1 1 28 28 ASP H H 28 9.642 9.642 8.420 1.222 19200
789 1 5 . 1 1 29 29 GLY N N 29 111.028 111.028 108.520 2.508 19200
790 1 5 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.890 1.223 19200
791 1 5 . 1 1 29 29 GLY H H 29 9.361 9.361 8.029 1.332 19200
792 1 5 . 1 1 30 30 GLN N N 30 118.561 118.561 119.612 -1.051 19200
793 1 5 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.686 -0.116 19200
794 1 5 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.060 -0.108 19200
795 1 5 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.227 -0.974 19200
796 1 5 . 1 1 30 30 GLN H H 30 7.513 7.513 8.371 -0.858 19200
797 1 5 . 1 1 31 31 VAL N N 31 129.747 129.747 121.939 7.808 19200
798 1 5 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.969 -0.020 19200
799 1 5 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.857 2.316 19200
800 1 5 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.578 -0.075 19200
801 1 5 . 1 1 31 31 VAL H H 31 9.403 9.403 8.577 0.826 19200
802 1 5 . 1 1 32 32 ASP N N 32 130.844 130.844 119.028 11.816 19200
803 1 5 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.243 0.616 19200
804 1 5 . 1 1 32 32 ASP CA C 32 56.636 56.636 55.724 0.912 19200
805 1 5 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.112 5.704 19200
806 1 5 . 1 1 32 32 ASP H H 32 10.474 10.474 7.943 2.531 19200
807 1 5 . 1 1 33 33 CYS N N 33 118.607 118.607 119.510 -0.903 19200
808 1 5 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.325 0.659 19200
809 1 5 . 1 1 33 33 CYS CA C 33 54.411 54.411 59.983 -5.572 19200
810 1 5 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.210 15.920 19200
811 1 5 . 1 1 33 33 CYS H H 33 8.231 8.231 7.998 0.233 19200
812 1 5 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.393 -0.110 19200
813 1 5 . 1 1 34 34 ASP CA C 34 57.651 57.651 57.082 0.569 19200
814 1 5 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.897 -0.323 19200
815 1 5 . 1 1 35 35 ASN N N 35 114.357 114.357 113.200 1.157 19200
816 1 5 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.783 0.013 19200
817 1 5 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.525 -0.494 19200
818 1 5 . 1 1 35 35 ASN CB C 35 38.525 38.525 38.077 0.448 19200
819 1 5 . 1 1 35 35 ASN H H 35 7.842 7.842 7.990 -0.148 19200
820 1 5 . 1 1 36 36 GLY N N 36 106.237 106.237 108.651 -2.414 19200
821 1 5 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.381 0.514 19200
822 1 5 . 1 1 36 36 GLY H H 36 8.269 8.269 8.222 0.047 19200
823 1 5 . 1 1 37 37 SER N N 37 115.105 115.105 114.651 0.454 19200
824 1 5 . 1 1 37 37 SER HA H 37 4.026 4.026 4.230 -0.204 19200
825 1 5 . 1 1 37 37 SER CA C 37 62.619 62.619 61.018 1.601 19200
826 1 5 . 1 1 37 37 SER CB C 37 63.494 63.494 63.214 0.280 19200
827 1 5 . 1 1 37 37 SER H H 37 7.900 7.900 7.813 0.087 19200
828 1 5 . 1 1 38 38 ASP N N 38 116.663 116.663 117.926 -1.263 19200
829 1 5 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.591 -0.154 19200
830 1 5 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.731 0.667 19200
831 1 5 . 1 1 38 38 ASP CB C 38 41.045 41.045 39.809 1.236 19200
832 1 5 . 1 1 38 38 ASP H H 38 9.737 9.737 8.769 0.968 19200
833 1 5 . 1 1 39 39 GLU N N 39 116.396 116.396 118.639 -2.243 19200
834 1 5 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.652 0.214 19200
835 1 5 . 1 1 39 39 GLU CA C 39 54.774 54.774 55.618 -0.844 19200
836 1 5 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.479 1.895 19200
837 1 5 . 1 1 39 39 GLU H H 39 7.511 7.511 7.902 -0.391 19200
838 1 5 . 1 1 40 40 GLN N N 40 119.983 119.983 117.690 2.293 19200
839 1 5 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.503 0.032 19200
840 1 5 . 1 1 40 40 GLN CA C 40 55.371 55.371 56.331 -0.960 19200
841 1 5 . 1 1 40 40 GLN CB C 40 30.705 30.705 30.468 0.237 19200
842 1 5 . 1 1 40 40 GLN H H 40 7.084 7.084 7.823 -0.739 19200
843 1 5 . 1 1 41 41 GLY N N 41 113.322 113.322 106.459 6.863 19200
844 1 5 . 1 1 41 41 GLY CA C 41 47.145 47.145 45.399 1.746 19200
845 1 5 . 1 1 41 41 GLY H H 41 8.992 8.992 8.576 0.416 19200
846 1 6 . 1 1 5 5 VAL N N 5 122.070 122.070 121.261 0.809 19200
847 1 6 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.301 -0.102 19200
848 1 6 . 1 1 5 5 VAL CA C 5 62.696 62.696 62.302 0.394 19200
849 1 6 . 1 1 5 5 VAL CB C 5 33.858 33.858 32.060 1.798 19200
850 1 6 . 1 1 5 5 VAL H H 5 8.246 8.246 8.437 -0.191 19200
851 1 6 . 1 1 6 6 THR N N 6 119.169 119.169 119.244 -0.075 19200
852 1 6 . 1 1 6 6 THR HA H 6 4.376 4.376 4.555 -0.179 19200
853 1 6 . 1 1 6 6 THR CA C 6 61.781 61.781 61.198 0.583 19200
854 1 6 . 1 1 6 6 THR CB C 6 70.908 70.908 71.130 -0.222 19200
855 1 6 . 1 1 6 6 THR H H 6 8.243 8.243 8.431 -0.189 19200
856 1 6 . 1 1 7 7 CYS N N 7 121.405 121.405 119.129 2.276 19200
857 1 6 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.772 0.052 19200
858 1 6 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.310 -4.092 19200
859 1 6 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.593 11.532 19200
860 1 6 . 1 1 7 7 CYS H H 7 8.656 8.656 8.398 0.258 19200
861 1 6 . 1 1 8 8 SER N N 8 118.316 118.316 115.630 2.686 19200
862 1 6 . 1 1 8 8 SER HA H 8 4.349 4.349 4.780 -0.431 19200
863 1 6 . 1 1 8 8 SER CA C 8 58.967 58.967 57.714 1.253 19200
864 1 6 . 1 1 8 8 SER CB C 8 64.571 64.571 64.023 0.548 19200
865 1 6 . 1 1 8 8 SER H H 8 8.574 8.574 8.348 0.226 19200
866 1 6 . 1 1 9 9 LEU N N 9 121.658 121.658 120.600 1.058 19200
867 1 6 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.393 -0.163 19200
868 1 6 . 1 1 9 9 LEU CA C 9 57.704 57.704 57.088 0.616 19200
869 1 6 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.394 0.906 19200
870 1 6 . 1 1 9 9 LEU H H 9 8.260 8.260 8.458 -0.198 19200
871 1 6 . 1 1 10 10 GLY N N 10 112.236 112.236 105.334 6.902 19200
872 1 6 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.698 0.971 19200
873 1 6 . 1 1 10 10 GLY H H 10 9.031 9.031 8.348 0.683 19200
874 1 6 . 1 1 11 11 TYR N N 11 121.166 121.166 118.660 2.506 19200
875 1 6 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.458 -0.392 19200
876 1 6 . 1 1 11 11 TYR CA C 11 57.285 57.285 56.973 0.312 19200
877 1 6 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.690 -0.859 19200
878 1 6 . 1 1 11 11 TYR H H 11 8.335 8.335 7.490 0.845 19200
879 1 6 . 1 1 12 12 PHE N N 12 121.724 121.724 116.323 5.401 19200
880 1 6 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.197 -0.014 19200
881 1 6 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.349 0.493 19200
882 1 6 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.832 0.908 19200
883 1 6 . 1 1 12 12 PHE H H 12 9.791 9.791 9.126 0.665 19200
884 1 6 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.708 0.294 19200
885 1 6 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.591 -0.498 19200
886 1 6 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.539 -0.902 19200
887 1 6 . 1 1 14 14 CYS N N 14 117.951 117.951 117.461 0.490 19200
888 1 6 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.711 0.186 19200
889 1 6 . 1 1 14 14 CYS CA C 14 55.375 55.375 59.085 -3.710 19200
890 1 6 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.643 13.938 19200
891 1 6 . 1 1 14 14 CYS H H 14 8.630 8.630 8.443 0.187 19200
892 1 6 . 1 1 15 15 GLY N N 15 108.668 108.668 106.155 2.513 19200
893 1 6 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.438 0.297 19200
894 1 6 . 1 1 15 15 GLY H H 15 8.372 8.372 7.745 0.627 19200
895 1 6 . 1 1 16 16 ASN N N 16 121.627 121.627 119.509 2.118 19200
896 1 6 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.462 0.071 19200
897 1 6 . 1 1 16 16 ASN CA C 16 55.543 55.543 56.163 -0.620 19200
898 1 6 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.142 0.700 19200
899 1 6 . 1 1 16 16 ASN H H 16 9.709 9.709 8.468 1.241 19200
900 1 6 . 1 1 17 17 ILE N N 17 119.731 119.731 117.806 1.925 19200
901 1 6 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.955 0.260 19200
902 1 6 . 1 1 17 17 ILE CA C 17 61.465 61.465 63.014 -1.549 19200
903 1 6 . 1 1 17 17 ILE CB C 17 37.913 37.913 36.380 1.533 19200
904 1 6 . 1 1 17 17 ILE H H 17 8.196 8.196 8.109 0.087 19200
905 1 6 . 1 1 18 18 THR N N 18 117.836 117.836 108.723 9.113 19200
906 1 6 . 1 1 18 18 THR HA H 18 3.985 3.985 4.031 -0.046 19200
907 1 6 . 1 1 18 18 THR CA C 18 64.041 64.041 63.154 0.887 19200
908 1 6 . 1 1 18 18 THR CB C 18 69.529 69.529 67.581 1.948 19200
909 1 6 . 1 1 18 18 THR H H 18 7.969 7.969 7.194 0.775 19200
910 1 6 . 1 1 19 19 LYS N N 19 124.340 124.340 121.757 2.583 19200
911 1 6 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.071 0.397 19200
912 1 6 . 1 1 19 19 LYS CA C 19 56.099 56.099 57.001 -0.902 19200
913 1 6 . 1 1 19 19 LYS CB C 19 35.855 35.855 33.069 2.786 19200
914 1 6 . 1 1 19 19 LYS H H 19 8.271 8.271 7.798 0.473 19200
915 1 6 . 1 1 20 20 CYS N N 20 121.675 121.675 123.749 -2.074 19200
916 1 6 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.550 0.653 19200
917 1 6 . 1 1 20 20 CYS CA C 20 55.367 55.367 57.775 -2.408 19200
918 1 6 . 1 1 20 20 CYS CB C 20 44.418 44.418 26.271 18.146 19200
919 1 6 . 1 1 20 20 CYS H H 20 8.543 8.543 8.399 0.144 19200
920 1 6 . 1 1 21 21 ILE N N 21 118.395 118.395 120.277 -1.882 19200
921 1 6 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.849 -0.159 19200
922 1 6 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.409 0.887 19200
923 1 6 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.728 0.126 19200
924 1 6 . 1 1 21 21 ILE H H 21 9.070 9.070 8.852 0.218 19200
925 1 6 . 1 1 22 22 PRO HA H 22 3.311 3.311 4.090 -0.779 19200
926 1 6 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.695 1.396 19200
927 1 6 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.653 0.650 19200
928 1 6 . 1 1 23 23 GLN N N 23 120.837 120.837 124.432 -3.595 19200
929 1 6 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.211 -0.297 19200
930 1 6 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.699 -0.270 19200
931 1 6 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.359 -0.130 19200
932 1 6 . 1 1 23 23 GLN H H 23 8.285 8.285 8.308 -0.023 19200
933 1 6 . 1 1 24 24 PHE N N 24 112.558 112.558 118.074 -5.516 19200
934 1 6 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.274 0.509 19200
935 1 6 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.480 -2.275 19200
936 1 6 . 1 1 24 24 PHE CB C 24 37.991 37.991 38.876 -0.885 19200
937 1 6 . 1 1 24 24 PHE H H 24 7.218 7.218 8.271 -1.053 19200
938 1 6 . 1 1 25 25 TRP N N 25 118.981 118.981 117.245 1.736 19200
939 1 6 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.092 0.171 19200
940 1 6 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.449 0.382 19200
941 1 6 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.170 0.743 19200
942 1 6 . 1 1 25 25 TRP H H 25 7.925 7.925 7.815 0.110 19200
943 1 6 . 1 1 26 26 ARG N N 26 126.158 126.158 120.530 5.628 19200
944 1 6 . 1 1 26 26 ARG HA H 26 4.415 4.415 5.009 -0.594 19200
945 1 6 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.445 1.520 19200
946 1 6 . 1 1 26 26 ARG CB C 26 30.716 30.716 30.942 -0.226 19200
947 1 6 . 1 1 26 26 ARG H H 26 8.126 8.126 7.894 0.232 19200
948 1 6 . 1 1 27 27 CYS N N 27 123.356 123.356 125.731 -2.375 19200
949 1 6 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.556 0.284 19200
950 1 6 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.814 -3.724 19200
951 1 6 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.673 10.707 19200
952 1 6 . 1 1 27 27 CYS H H 27 8.927 8.927 9.230 -0.303 19200
953 1 6 . 1 1 28 28 ASP N N 28 120.779 120.779 120.788 -0.009 19200
954 1 6 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.665 0.200 19200
955 1 6 . 1 1 28 28 ASP CA C 28 52.819 52.819 52.481 0.338 19200
956 1 6 . 1 1 28 28 ASP CB C 28 42.189 42.189 40.356 1.833 19200
957 1 6 . 1 1 28 28 ASP H H 28 9.642 9.642 8.160 1.482 19200
958 1 6 . 1 1 29 29 GLY N N 29 111.028 111.028 109.046 1.982 19200
959 1 6 . 1 1 29 29 GLY CA C 29 46.113 46.113 46.092 0.021 19200
960 1 6 . 1 1 29 29 GLY H H 29 9.361 9.361 7.974 1.387 19200
961 1 6 . 1 1 30 30 GLN N N 30 118.561 118.561 118.673 -0.112 19200
962 1 6 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.619 -0.049 19200
963 1 6 . 1 1 30 30 GLN CA C 30 53.953 53.953 53.797 0.156 19200
964 1 6 . 1 1 30 30 GLN CB C 30 31.253 31.253 31.165 0.088 19200
965 1 6 . 1 1 30 30 GLN H H 30 7.513 7.513 7.928 -0.415 19200
966 1 6 . 1 1 31 31 VAL N N 31 129.747 129.747 122.279 7.468 19200
967 1 6 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.933 0.016 19200
968 1 6 . 1 1 31 31 VAL CA C 31 65.173 65.173 63.235 1.938 19200
969 1 6 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.395 0.108 19200
970 1 6 . 1 1 31 31 VAL H H 31 9.403 9.403 8.609 0.794 19200
971 1 6 . 1 1 32 32 ASP N N 32 130.844 130.844 119.747 11.097 19200
972 1 6 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.231 0.628 19200
973 1 6 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.385 0.251 19200
974 1 6 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.544 5.272 19200
975 1 6 . 1 1 32 32 ASP H H 32 10.474 10.474 8.222 2.252 19200
976 1 6 . 1 1 33 33 CYS N N 33 118.607 118.607 117.915 0.692 19200
977 1 6 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.294 0.690 19200
978 1 6 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.116 -5.705 19200
979 1 6 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.580 15.550 19200
980 1 6 . 1 1 33 33 CYS H H 33 8.231 8.231 8.138 0.093 19200
981 1 6 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.359 -0.076 19200
982 1 6 . 1 1 34 34 ASP CA C 34 57.651 57.651 57.330 0.321 19200
983 1 6 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.982 -0.408 19200
984 1 6 . 1 1 35 35 ASN N N 35 114.357 114.357 113.481 0.876 19200
985 1 6 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.767 0.029 19200
986 1 6 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.534 -0.503 19200
987 1 6 . 1 1 35 35 ASN CB C 35 38.525 38.525 37.791 0.734 19200
988 1 6 . 1 1 35 35 ASN H H 35 7.842 7.842 8.039 -0.197 19200
989 1 6 . 1 1 36 36 GLY N N 36 106.237 106.237 108.455 -2.218 19200
990 1 6 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.267 0.628 19200
991 1 6 . 1 1 36 36 GLY H H 36 8.269 8.269 7.968 0.301 19200
992 1 6 . 1 1 37 37 SER N N 37 115.105 115.105 114.457 0.648 19200
993 1 6 . 1 1 37 37 SER HA H 37 4.026 4.026 4.329 -0.303 19200
994 1 6 . 1 1 37 37 SER CA C 37 62.619 62.619 59.339 3.280 19200
995 1 6 . 1 1 37 37 SER CB C 37 63.494 63.494 63.449 0.045 19200
996 1 6 . 1 1 37 37 SER H H 37 7.900 7.900 7.881 0.019 19200
997 1 6 . 1 1 38 38 ASP N N 38 116.663 116.663 120.448 -3.785 19200
998 1 6 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.696 -0.259 19200
999 1 6 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.935 0.463 19200
1000 1 6 . 1 1 38 38 ASP CB C 38 41.045 41.045 41.178 -0.133 19200
1001 1 6 . 1 1 38 38 ASP H H 38 9.737 9.737 8.810 0.927 19200
1002 1 6 . 1 1 39 39 GLU N N 39 116.396 116.396 116.792 -0.396 19200
1003 1 6 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.687 0.179 19200
1004 1 6 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.441 0.333 19200
1005 1 6 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.102 2.272 19200
1006 1 6 . 1 1 39 39 GLU H H 39 7.511 7.511 7.656 -0.145 19200
1007 1 6 . 1 1 40 40 GLN N N 40 119.983 119.983 119.518 0.465 19200
1008 1 6 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.465 0.070 19200
1009 1 6 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.306 0.065 19200
1010 1 6 . 1 1 40 40 GLN CB C 40 30.705 30.705 27.035 3.670 19200
1011 1 6 . 1 1 40 40 GLN H H 40 7.084 7.084 7.857 -0.773 19200
1012 1 6 . 1 1 41 41 GLY N N 41 113.322 113.322 108.397 4.925 19200
1013 1 6 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.779 2.366 19200
1014 1 6 . 1 1 41 41 GLY H H 41 8.992 8.992 8.264 0.728 19200
1015 1 7 . 1 1 5 5 VAL N N 5 122.070 122.070 118.867 3.203 19200
1016 1 7 . 1 1 5 5 VAL HA H 5 4.199 4.199 3.793 0.406 19200
1017 1 7 . 1 1 5 5 VAL CA C 5 62.696 62.696 63.280 -0.584 19200
1018 1 7 . 1 1 5 5 VAL CB C 5 33.858 33.858 31.957 1.901 19200
1019 1 7 . 1 1 5 5 VAL H H 5 8.246 8.246 7.779 0.467 19200
1020 1 7 . 1 1 6 6 THR N N 6 119.169 119.169 115.916 3.253 19200
1021 1 7 . 1 1 6 6 THR HA H 6 4.376 4.376 4.687 -0.311 19200
1022 1 7 . 1 1 6 6 THR CA C 6 61.781 61.781 61.268 0.513 19200
1023 1 7 . 1 1 6 6 THR CB C 6 70.908 70.908 70.863 0.045 19200
1024 1 7 . 1 1 6 6 THR H H 6 8.243 8.243 8.250 -0.007 19200
1025 1 7 . 1 1 7 7 CYS N N 7 121.405 121.405 121.553 -0.148 19200
1026 1 7 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.827 -0.003 19200
1027 1 7 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.002 -3.784 19200
1028 1 7 . 1 1 7 7 CYS CB C 7 41.125 41.125 30.509 10.616 19200
1029 1 7 . 1 1 7 7 CYS H H 7 8.656 8.656 8.279 0.377 19200
1030 1 7 . 1 1 8 8 SER N N 8 118.316 118.316 116.099 2.217 19200
1031 1 7 . 1 1 8 8 SER HA H 8 4.349 4.349 4.625 -0.276 19200
1032 1 7 . 1 1 8 8 SER CA C 8 58.967 58.967 57.490 1.477 19200
1033 1 7 . 1 1 8 8 SER CB C 8 64.571 64.571 63.506 1.065 19200
1034 1 7 . 1 1 8 8 SER H H 8 8.574 8.574 8.172 0.402 19200
1035 1 7 . 1 1 9 9 LEU N N 9 121.658 121.658 121.711 -0.053 19200
1036 1 7 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.241 -0.011 19200
1037 1 7 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.580 1.124 19200
1038 1 7 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.252 1.048 19200
1039 1 7 . 1 1 9 9 LEU H H 9 8.260 8.260 8.356 -0.096 19200
1040 1 7 . 1 1 10 10 GLY N N 10 112.236 112.236 106.486 5.750 19200
1041 1 7 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.833 0.836 19200
1042 1 7 . 1 1 10 10 GLY H H 10 9.031 9.031 8.676 0.355 19200
1043 1 7 . 1 1 11 11 TYR N N 11 121.166 121.166 119.134 2.032 19200
1044 1 7 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.553 -0.487 19200
1045 1 7 . 1 1 11 11 TYR CA C 11 57.285 57.285 56.954 0.331 19200
1046 1 7 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.735 -0.905 19200
1047 1 7 . 1 1 11 11 TYR H H 11 8.335 8.335 7.629 0.706 19200
1048 1 7 . 1 1 12 12 PHE N N 12 121.724 121.724 117.005 4.719 19200
1049 1 7 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.186 -0.003 19200
1050 1 7 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.296 0.547 19200
1051 1 7 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.441 1.299 19200
1052 1 7 . 1 1 12 12 PHE H H 12 9.791 9.791 9.097 0.694 19200
1053 1 7 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.662 0.340 19200
1054 1 7 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.460 -0.367 19200
1055 1 7 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.450 -0.813 19200
1056 1 7 . 1 1 14 14 CYS N N 14 117.951 117.951 117.038 0.913 19200
1057 1 7 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.612 0.285 19200
1058 1 7 . 1 1 14 14 CYS CA C 14 55.375 55.375 59.311 -3.936 19200
1059 1 7 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.662 13.919 19200
1060 1 7 . 1 1 14 14 CYS H H 14 8.630 8.630 8.120 0.510 19200
1061 1 7 . 1 1 15 15 GLY N N 15 108.668 108.668 106.012 2.656 19200
1062 1 7 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.489 0.246 19200
1063 1 7 . 1 1 15 15 GLY H H 15 8.372 8.372 7.617 0.755 19200
1064 1 7 . 1 1 16 16 ASN N N 16 121.627 121.627 119.269 2.358 19200
1065 1 7 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.437 0.096 19200
1066 1 7 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.506 0.037 19200
1067 1 7 . 1 1 16 16 ASN CB C 16 38.841 38.841 37.763 1.078 19200
1068 1 7 . 1 1 16 16 ASN H H 16 9.709 9.709 8.369 1.340 19200
1069 1 7 . 1 1 17 17 ILE N N 17 119.731 119.731 117.370 2.361 19200
1070 1 7 . 1 1 17 17 ILE HA H 17 4.215 4.215 4.017 0.198 19200
1071 1 7 . 1 1 17 17 ILE CA C 17 61.465 61.465 61.467 -0.002 19200
1072 1 7 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.092 0.821 19200
1073 1 7 . 1 1 17 17 ILE H H 17 8.196 8.196 7.780 0.416 19200
1074 1 7 . 1 1 18 18 THR N N 18 117.836 117.836 110.421 7.415 19200
1075 1 7 . 1 1 18 18 THR HA H 18 3.985 3.985 3.922 0.063 19200
1076 1 7 . 1 1 18 18 THR CA C 18 64.041 64.041 62.675 1.366 19200
1077 1 7 . 1 1 18 18 THR CB C 18 69.529 69.529 67.650 1.879 19200
1078 1 7 . 1 1 18 18 THR H H 18 7.969 7.969 7.460 0.509 19200
1079 1 7 . 1 1 19 19 LYS N N 19 124.340 124.340 120.907 3.433 19200
1080 1 7 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.214 0.254 19200
1081 1 7 . 1 1 19 19 LYS CA C 19 56.099 56.099 57.093 -0.994 19200
1082 1 7 . 1 1 19 19 LYS CB C 19 35.855 35.855 33.282 2.573 19200
1083 1 7 . 1 1 19 19 LYS H H 19 8.271 8.271 7.814 0.457 19200
1084 1 7 . 1 1 20 20 CYS N N 20 121.675 121.675 124.127 -2.452 19200
1085 1 7 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.680 0.523 19200
1086 1 7 . 1 1 20 20 CYS CA C 20 55.367 55.367 57.780 -2.413 19200
1087 1 7 . 1 1 20 20 CYS CB C 20 44.418 44.418 26.153 18.265 19200
1088 1 7 . 1 1 20 20 CYS H H 20 8.543 8.543 8.556 -0.013 19200
1089 1 7 . 1 1 21 21 ILE N N 21 118.395 118.395 119.818 -1.423 19200
1090 1 7 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.830 -0.140 19200
1091 1 7 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.396 0.900 19200
1092 1 7 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.791 0.063 19200
1093 1 7 . 1 1 21 21 ILE H H 21 9.070 9.070 8.903 0.167 19200
1094 1 7 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.239 0.072 19200
1095 1 7 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.557 1.534 19200
1096 1 7 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.529 0.774 19200
1097 1 7 . 1 1 23 23 GLN N N 23 120.837 120.837 124.444 -3.607 19200
1098 1 7 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.169 -0.255 19200
1099 1 7 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.751 -0.322 19200
1100 1 7 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.414 -0.185 19200
1101 1 7 . 1 1 23 23 GLN H H 23 8.285 8.285 8.469 -0.184 19200
1102 1 7 . 1 1 24 24 PHE N N 24 112.558 112.558 117.874 -5.316 19200
1103 1 7 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.263 0.520 19200
1104 1 7 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.463 -2.258 19200
1105 1 7 . 1 1 24 24 PHE CB C 24 37.991 37.991 38.877 -0.886 19200
1106 1 7 . 1 1 24 24 PHE H H 24 7.218 7.218 8.223 -1.005 19200
1107 1 7 . 1 1 25 25 TRP N N 25 118.981 118.981 118.028 0.953 19200
1108 1 7 . 1 1 25 25 TRP HA H 25 5.263 5.263 4.911 0.352 19200
1109 1 7 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.785 0.046 19200
1110 1 7 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.337 0.576 19200
1111 1 7 . 1 1 25 25 TRP H H 25 7.925 7.925 7.808 0.117 19200
1112 1 7 . 1 1 26 26 ARG N N 26 126.158 126.158 120.292 5.866 19200
1113 1 7 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.583 -0.168 19200
1114 1 7 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.355 1.611 19200
1115 1 7 . 1 1 26 26 ARG CB C 26 30.716 30.716 32.294 -1.578 19200
1116 1 7 . 1 1 26 26 ARG H H 26 8.126 8.126 7.930 0.196 19200
1117 1 7 . 1 1 27 27 CYS N N 27 123.356 123.356 123.801 -0.445 19200
1118 1 7 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.280 0.560 19200
1119 1 7 . 1 1 27 27 CYS CA C 27 56.090 56.090 60.116 -4.026 19200
1120 1 7 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.541 10.839 19200
1121 1 7 . 1 1 27 27 CYS H H 27 8.927 8.927 9.223 -0.296 19200
1122 1 7 . 1 1 28 28 ASP N N 28 120.779 120.779 121.728 -0.949 19200
1123 1 7 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.596 0.269 19200
1124 1 7 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.622 -1.803 19200
1125 1 7 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.309 0.879 19200
1126 1 7 . 1 1 28 28 ASP H H 28 9.642 9.642 8.455 1.187 19200
1127 1 7 . 1 1 29 29 GLY N N 29 111.028 111.028 109.532 1.496 19200
1128 1 7 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.677 1.436 19200
1129 1 7 . 1 1 29 29 GLY H H 29 9.361 9.361 8.026 1.335 19200
1130 1 7 . 1 1 30 30 GLN N N 30 118.561 118.561 119.077 -0.516 19200
1131 1 7 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.604 -0.034 19200
1132 1 7 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.246 -0.293 19200
1133 1 7 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.120 -0.867 19200
1134 1 7 . 1 1 30 30 GLN H H 30 7.513 7.513 8.093 -0.580 19200
1135 1 7 . 1 1 31 31 VAL N N 31 129.747 129.747 122.629 7.118 19200
1136 1 7 . 1 1 31 31 VAL HA H 31 3.949 3.949 4.030 -0.082 19200
1137 1 7 . 1 1 31 31 VAL CA C 31 65.173 65.173 61.833 3.340 19200
1138 1 7 . 1 1 31 31 VAL CB C 31 31.503 31.503 30.969 0.534 19200
1139 1 7 . 1 1 31 31 VAL H H 31 9.403 9.403 8.606 0.797 19200
1140 1 7 . 1 1 32 32 ASP N N 32 130.844 130.844 119.960 10.884 19200
1141 1 7 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.270 0.589 19200
1142 1 7 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.498 0.138 19200
1143 1 7 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.494 5.322 19200
1144 1 7 . 1 1 32 32 ASP H H 32 10.474 10.474 8.046 2.428 19200
1145 1 7 . 1 1 33 33 CYS N N 33 118.607 118.607 118.097 0.510 19200
1146 1 7 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.262 0.722 19200
1147 1 7 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.217 -5.806 19200
1148 1 7 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.703 15.428 19200
1149 1 7 . 1 1 33 33 CYS H H 33 8.231 8.231 7.940 0.291 19200
1150 1 7 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.425 -0.142 19200
1151 1 7 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.799 0.852 19200
1152 1 7 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.959 -0.384 19200
1153 1 7 . 1 1 35 35 ASN N N 35 114.357 114.357 112.987 1.370 19200
1154 1 7 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.777 0.019 19200
1155 1 7 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.829 -0.798 19200
1156 1 7 . 1 1 35 35 ASN CB C 35 38.525 38.525 38.388 0.137 19200
1157 1 7 . 1 1 35 35 ASN H H 35 7.842 7.842 8.136 -0.294 19200
1158 1 7 . 1 1 36 36 GLY N N 36 106.237 106.237 107.330 -1.093 19200
1159 1 7 . 1 1 36 36 GLY CA C 36 46.895 46.895 45.862 1.033 19200
1160 1 7 . 1 1 36 36 GLY H H 36 8.269 8.269 8.089 0.180 19200
1161 1 7 . 1 1 37 37 SER N N 37 115.105 115.105 115.547 -0.442 19200
1162 1 7 . 1 1 37 37 SER HA H 37 4.026 4.026 4.374 -0.348 19200
1163 1 7 . 1 1 37 37 SER CA C 37 62.619 62.619 60.782 1.837 19200
1164 1 7 . 1 1 37 37 SER CB C 37 63.494 63.494 63.296 0.198 19200
1165 1 7 . 1 1 37 37 SER H H 37 7.900 7.900 7.909 -0.009 19200
1166 1 7 . 1 1 38 38 ASP N N 38 116.663 116.663 118.677 -2.014 19200
1167 1 7 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.586 -0.149 19200
1168 1 7 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.857 0.541 19200
1169 1 7 . 1 1 38 38 ASP CB C 38 41.045 41.045 39.817 1.228 19200
1170 1 7 . 1 1 38 38 ASP H H 38 9.737 9.737 8.803 0.934 19200
1171 1 7 . 1 1 39 39 GLU N N 39 116.396 116.396 118.095 -1.699 19200
1172 1 7 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.673 0.193 19200
1173 1 7 . 1 1 39 39 GLU CA C 39 54.774 54.774 55.120 -0.346 19200
1174 1 7 . 1 1 39 39 GLU CB C 39 30.374 30.374 27.919 2.455 19200
1175 1 7 . 1 1 39 39 GLU H H 39 7.511 7.511 7.885 -0.374 19200
1176 1 7 . 1 1 40 40 GLN N N 40 119.983 119.983 117.780 2.203 19200
1177 1 7 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.450 0.085 19200
1178 1 7 . 1 1 40 40 GLN CA C 40 55.371 55.371 56.487 -1.116 19200
1179 1 7 . 1 1 40 40 GLN CB C 40 30.705 30.705 30.299 0.406 19200
1180 1 7 . 1 1 40 40 GLN H H 40 7.084 7.084 7.864 -0.780 19200
1181 1 7 . 1 1 41 41 GLY N N 41 113.322 113.322 106.503 6.819 19200
1182 1 7 . 1 1 41 41 GLY CA C 41 47.145 47.145 45.231 1.914 19200
1183 1 7 . 1 1 41 41 GLY H H 41 8.992 8.992 8.435 0.557 19200
1184 1 8 . 1 1 5 5 VAL N N 5 122.070 122.070 121.373 0.697 19200
1185 1 8 . 1 1 5 5 VAL HA H 5 4.199 4.199 3.960 0.239 19200
1186 1 8 . 1 1 5 5 VAL CA C 5 62.696 62.696 62.979 -0.283 19200
1187 1 8 . 1 1 5 5 VAL CB C 5 33.858 33.858 32.267 1.591 19200
1188 1 8 . 1 1 5 5 VAL H H 5 8.246 8.246 8.203 0.043 19200
1189 1 8 . 1 1 6 6 THR N N 6 119.169 119.169 119.271 -0.102 19200
1190 1 8 . 1 1 6 6 THR HA H 6 4.376 4.376 4.717 -0.341 19200
1191 1 8 . 1 1 6 6 THR CA C 6 61.781 61.781 61.328 0.453 19200
1192 1 8 . 1 1 6 6 THR CB C 6 70.908 70.908 70.981 -0.073 19200
1193 1 8 . 1 1 6 6 THR H H 6 8.243 8.243 8.233 0.010 19200
1194 1 8 . 1 1 7 7 CYS N N 7 121.405 121.405 121.869 -0.464 19200
1195 1 8 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.767 0.057 19200
1196 1 8 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.383 -4.165 19200
1197 1 8 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.321 11.804 19200
1198 1 8 . 1 1 7 7 CYS H H 7 8.656 8.656 8.403 0.253 19200
1199 1 8 . 1 1 8 8 SER N N 8 118.316 118.316 114.910 3.406 19200
1200 1 8 . 1 1 8 8 SER HA H 8 4.349 4.349 4.696 -0.347 19200
1201 1 8 . 1 1 8 8 SER CA C 8 58.967 58.967 57.255 1.712 19200
1202 1 8 . 1 1 8 8 SER CB C 8 64.571 64.571 63.668 0.903 19200
1203 1 8 . 1 1 8 8 SER H H 8 8.574 8.574 8.161 0.413 19200
1204 1 8 . 1 1 9 9 LEU N N 9 121.658 121.658 121.966 -0.308 19200
1205 1 8 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.348 -0.118 19200
1206 1 8 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.258 1.446 19200
1207 1 8 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.595 0.705 19200
1208 1 8 . 1 1 9 9 LEU H H 9 8.260 8.260 8.342 -0.082 19200
1209 1 8 . 1 1 10 10 GLY N N 10 112.236 112.236 106.686 5.550 19200
1210 1 8 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.823 0.846 19200
1211 1 8 . 1 1 10 10 GLY H H 10 9.031 9.031 8.657 0.374 19200
1212 1 8 . 1 1 11 11 TYR N N 11 121.166 121.166 119.158 2.008 19200
1213 1 8 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.466 -0.400 19200
1214 1 8 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.138 0.147 19200
1215 1 8 . 1 1 11 11 TYR CB C 11 41.830 41.830 43.125 -1.295 19200
1216 1 8 . 1 1 11 11 TYR H H 11 8.335 8.335 7.679 0.656 19200
1217 1 8 . 1 1 12 12 PHE N N 12 121.724 121.724 115.729 5.995 19200
1218 1 8 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.170 0.013 19200
1219 1 8 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.629 0.214 19200
1220 1 8 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.607 1.133 19200
1221 1 8 . 1 1 12 12 PHE H H 12 9.791 9.791 9.076 0.715 19200
1222 1 8 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.798 0.204 19200
1223 1 8 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.719 -0.627 19200
1224 1 8 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.621 -0.984 19200
1225 1 8 . 1 1 14 14 CYS N N 14 117.951 117.951 117.463 0.488 19200
1226 1 8 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.733 0.164 19200
1227 1 8 . 1 1 14 14 CYS CA C 14 55.375 55.375 58.967 -3.592 19200
1228 1 8 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.644 13.937 19200
1229 1 8 . 1 1 14 14 CYS H H 14 8.630 8.630 8.300 0.330 19200
1230 1 8 . 1 1 15 15 GLY N N 15 108.668 108.668 106.101 2.567 19200
1231 1 8 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.443 0.292 19200
1232 1 8 . 1 1 15 15 GLY H H 15 8.372 8.372 7.754 0.618 19200
1233 1 8 . 1 1 16 16 ASN N N 16 121.627 121.627 119.838 1.789 19200
1234 1 8 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.446 0.087 19200
1235 1 8 . 1 1 16 16 ASN CA C 16 55.543 55.543 56.056 -0.513 19200
1236 1 8 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.280 0.561 19200
1237 1 8 . 1 1 16 16 ASN H H 16 9.709 9.709 8.508 1.201 19200
1238 1 8 . 1 1 17 17 ILE N N 17 119.731 119.731 118.668 1.063 19200
1239 1 8 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.877 0.338 19200
1240 1 8 . 1 1 17 17 ILE CA C 17 61.465 61.465 63.232 -1.767 19200
1241 1 8 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.437 0.476 19200
1242 1 8 . 1 1 17 17 ILE H H 17 8.196 8.196 8.067 0.129 19200
1243 1 8 . 1 1 18 18 THR N N 18 117.836 117.836 109.412 8.424 19200
1244 1 8 . 1 1 18 18 THR HA H 18 3.985 3.985 4.039 -0.054 19200
1245 1 8 . 1 1 18 18 THR CA C 18 64.041 64.041 62.816 1.225 19200
1246 1 8 . 1 1 18 18 THR CB C 18 69.529 69.529 67.111 2.418 19200
1247 1 8 . 1 1 18 18 THR H H 18 7.969 7.969 7.670 0.299 19200
1248 1 8 . 1 1 19 19 LYS N N 19 124.340 124.340 121.494 2.846 19200
1249 1 8 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.054 0.414 19200
1250 1 8 . 1 1 19 19 LYS CA C 19 56.099 56.099 57.209 -1.109 19200
1251 1 8 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.610 3.245 19200
1252 1 8 . 1 1 19 19 LYS H H 19 8.271 8.271 7.898 0.373 19200
1253 1 8 . 1 1 20 20 CYS N N 20 121.675 121.675 123.745 -2.070 19200
1254 1 8 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.540 0.663 19200
1255 1 8 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.002 -2.635 19200
1256 1 8 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.981 18.437 19200
1257 1 8 . 1 1 20 20 CYS H H 20 8.543 8.543 8.335 0.208 19200
1258 1 8 . 1 1 21 21 ILE N N 21 118.395 118.395 120.365 -1.970 19200
1259 1 8 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.870 -0.180 19200
1260 1 8 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.431 0.866 19200
1261 1 8 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.848 0.006 19200
1262 1 8 . 1 1 21 21 ILE H H 21 9.070 9.070 8.836 0.234 19200
1263 1 8 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.904 -0.593 19200
1264 1 8 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.511 1.580 19200
1265 1 8 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.558 0.746 19200
1266 1 8 . 1 1 23 23 GLN N N 23 120.837 120.837 124.384 -3.547 19200
1267 1 8 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.131 -0.217 19200
1268 1 8 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.570 -0.141 19200
1269 1 8 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.222 0.007 19200
1270 1 8 . 1 1 23 23 GLN H H 23 8.285 8.285 8.122 0.163 19200
1271 1 8 . 1 1 24 24 PHE N N 24 112.558 112.558 117.718 -5.160 19200
1272 1 8 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.280 0.503 19200
1273 1 8 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.317 -2.112 19200
1274 1 8 . 1 1 24 24 PHE CB C 24 37.991 37.991 38.987 -0.996 19200
1275 1 8 . 1 1 24 24 PHE H H 24 7.218 7.218 8.175 -0.957 19200
1276 1 8 . 1 1 25 25 TRP N N 25 118.981 118.981 119.352 -0.371 19200
1277 1 8 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.104 0.159 19200
1278 1 8 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.679 0.152 19200
1279 1 8 . 1 1 25 25 TRP CB C 25 28.913 28.913 27.534 1.379 19200
1280 1 8 . 1 1 25 25 TRP H H 25 7.925 7.925 7.971 -0.046 19200
1281 1 8 . 1 1 26 26 ARG N N 26 126.158 126.158 120.398 5.760 19200
1282 1 8 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.527 -0.112 19200
1283 1 8 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.414 1.551 19200
1284 1 8 . 1 1 26 26 ARG CB C 26 30.716 30.716 31.963 -1.247 19200
1285 1 8 . 1 1 26 26 ARG H H 26 8.126 8.126 7.808 0.318 19200
1286 1 8 . 1 1 27 27 CYS N N 27 123.356 123.356 126.017 -2.661 19200
1287 1 8 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.262 0.578 19200
1288 1 8 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.609 -3.519 19200
1289 1 8 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.173 11.207 19200
1290 1 8 . 1 1 27 27 CYS H H 27 8.927 8.927 9.040 -0.113 19200
1291 1 8 . 1 1 28 28 ASP N N 28 120.779 120.779 121.721 -0.942 19200
1292 1 8 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.770 0.095 19200
1293 1 8 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.170 -1.351 19200
1294 1 8 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.988 0.201 19200
1295 1 8 . 1 1 28 28 ASP H H 28 9.642 9.642 8.280 1.362 19200
1296 1 8 . 1 1 29 29 GLY N N 29 111.028 111.028 108.451 2.577 19200
1297 1 8 . 1 1 29 29 GLY CA C 29 46.113 46.113 45.099 1.014 19200
1298 1 8 . 1 1 29 29 GLY H H 29 9.361 9.361 8.125 1.236 19200
1299 1 8 . 1 1 30 30 GLN N N 30 118.561 118.561 119.860 -1.299 19200
1300 1 8 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.608 -0.038 19200
1301 1 8 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.525 -0.572 19200
1302 1 8 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.184 -0.931 19200
1303 1 8 . 1 1 30 30 GLN H H 30 7.513 7.513 8.244 -0.731 19200
1304 1 8 . 1 1 31 31 VAL N N 31 129.747 129.747 123.344 6.403 19200
1305 1 8 . 1 1 31 31 VAL HA H 31 3.949 3.949 4.033 -0.084 19200
1306 1 8 . 1 1 31 31 VAL CA C 31 65.173 65.173 61.536 3.637 19200
1307 1 8 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.009 0.494 19200
1308 1 8 . 1 1 31 31 VAL H H 31 9.403 9.403 8.624 0.779 19200
1309 1 8 . 1 1 32 32 ASP N N 32 130.844 130.844 118.767 12.077 19200
1310 1 8 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.238 0.621 19200
1311 1 8 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.050 0.586 19200
1312 1 8 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.177 5.639 19200
1313 1 8 . 1 1 32 32 ASP H H 32 10.474 10.474 7.941 2.533 19200
1314 1 8 . 1 1 33 33 CYS N N 33 118.607 118.607 119.207 -0.600 19200
1315 1 8 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.333 0.651 19200
1316 1 8 . 1 1 33 33 CYS CA C 33 54.411 54.411 59.813 -5.402 19200
1317 1 8 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.501 15.629 19200
1318 1 8 . 1 1 33 33 CYS H H 33 8.231 8.231 8.011 0.220 19200
1319 1 8 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.456 -0.173 19200
1320 1 8 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.876 0.775 19200
1321 1 8 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.904 -0.330 19200
1322 1 8 . 1 1 35 35 ASN N N 35 114.357 114.357 113.249 1.108 19200
1323 1 8 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.805 -0.009 19200
1324 1 8 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.403 -0.372 19200
1325 1 8 . 1 1 35 35 ASN CB C 35 38.525 38.525 37.711 0.814 19200
1326 1 8 . 1 1 35 35 ASN H H 35 7.842 7.842 7.998 -0.156 19200
1327 1 8 . 1 1 36 36 GLY N N 36 106.237 106.237 108.200 -1.963 19200
1328 1 8 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.362 0.533 19200
1329 1 8 . 1 1 36 36 GLY H H 36 8.269 8.269 7.776 0.493 19200
1330 1 8 . 1 1 37 37 SER N N 37 115.105 115.105 114.888 0.217 19200
1331 1 8 . 1 1 37 37 SER HA H 37 4.026 4.026 4.249 -0.223 19200
1332 1 8 . 1 1 37 37 SER CA C 37 62.619 62.619 60.169 2.450 19200
1333 1 8 . 1 1 37 37 SER CB C 37 63.494 63.494 63.351 0.143 19200
1334 1 8 . 1 1 37 37 SER H H 37 7.900 7.900 7.791 0.109 19200
1335 1 8 . 1 1 38 38 ASP N N 38 116.663 116.663 117.707 -1.044 19200
1336 1 8 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.602 -0.165 19200
1337 1 8 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.322 1.076 19200
1338 1 8 . 1 1 38 38 ASP CB C 38 41.045 41.045 40.055 0.990 19200
1339 1 8 . 1 1 38 38 ASP H H 38 9.737 9.737 8.673 1.064 19200
1340 1 8 . 1 1 39 39 GLU N N 39 116.396 116.396 117.456 -1.060 19200
1341 1 8 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.696 0.170 19200
1342 1 8 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.853 -0.079 19200
1343 1 8 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.750 1.625 19200
1344 1 8 . 1 1 39 39 GLU H H 39 7.511 7.511 7.833 -0.322 19200
1345 1 8 . 1 1 40 40 GLN N N 40 119.983 119.983 118.248 1.735 19200
1346 1 8 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.515 0.020 19200
1347 1 8 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.188 0.183 19200
1348 1 8 . 1 1 40 40 GLN CB C 40 30.705 30.705 26.968 3.737 19200
1349 1 8 . 1 1 40 40 GLN H H 40 7.084 7.084 7.912 -0.828 19200
1350 1 8 . 1 1 41 41 GLY N N 41 113.322 113.322 107.444 5.878 19200
1351 1 8 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.897 2.248 19200
1352 1 8 . 1 1 41 41 GLY H H 41 8.992 8.992 8.456 0.536 19200
1353 1 9 . 1 1 5 5 VAL N N 5 122.070 122.070 127.010 -4.940 19200
1354 1 9 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.374 -0.175 19200
1355 1 9 . 1 1 5 5 VAL CA C 5 62.696 62.696 61.186 1.510 19200
1356 1 9 . 1 1 5 5 VAL CB C 5 33.858 33.858 33.338 0.520 19200
1357 1 9 . 1 1 5 5 VAL H H 5 8.246 8.246 8.041 0.205 19200
1358 1 9 . 1 1 6 6 THR N N 6 119.169 119.169 119.816 -0.647 19200
1359 1 9 . 1 1 6 6 THR HA H 6 4.376 4.376 4.579 -0.203 19200
1360 1 9 . 1 1 6 6 THR CA C 6 61.781 61.781 61.202 0.579 19200
1361 1 9 . 1 1 6 6 THR CB C 6 70.908 70.908 69.949 0.959 19200
1362 1 9 . 1 1 6 6 THR H H 6 8.243 8.243 8.073 0.170 19200
1363 1 9 . 1 1 7 7 CYS N N 7 121.405 121.405 120.617 0.788 19200
1364 1 9 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.834 -0.010 19200
1365 1 9 . 1 1 7 7 CYS CA C 7 53.218 53.218 58.136 -4.918 19200
1366 1 9 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.960 11.165 19200
1367 1 9 . 1 1 7 7 CYS H H 7 8.656 8.656 8.444 0.212 19200
1368 1 9 . 1 1 8 8 SER N N 8 118.316 118.316 115.129 3.187 19200
1369 1 9 . 1 1 8 8 SER HA H 8 4.349 4.349 4.746 -0.397 19200
1370 1 9 . 1 1 8 8 SER CA C 8 58.967 58.967 57.602 1.365 19200
1371 1 9 . 1 1 8 8 SER CB C 8 64.571 64.571 63.767 0.804 19200
1372 1 9 . 1 1 8 8 SER H H 8 8.574 8.574 8.160 0.414 19200
1373 1 9 . 1 1 9 9 LEU N N 9 121.658 121.658 119.452 2.206 19200
1374 1 9 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.615 -0.385 19200
1375 1 9 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.746 0.958 19200
1376 1 9 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.769 0.531 19200
1377 1 9 . 1 1 9 9 LEU H H 9 8.260 8.260 8.365 -0.105 19200
1378 1 9 . 1 1 10 10 GLY N N 10 112.236 112.236 105.559 6.677 19200
1379 1 9 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.785 0.884 19200
1380 1 9 . 1 1 10 10 GLY H H 10 9.031 9.031 8.422 0.609 19200
1381 1 9 . 1 1 11 11 TYR N N 11 121.166 121.166 118.631 2.535 19200
1382 1 9 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.609 -0.543 19200
1383 1 9 . 1 1 11 11 TYR CA C 11 57.285 57.285 56.749 0.536 19200
1384 1 9 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.815 -0.985 19200
1385 1 9 . 1 1 11 11 TYR H H 11 8.335 8.335 7.468 0.867 19200
1386 1 9 . 1 1 12 12 PHE N N 12 121.724 121.724 115.379 6.345 19200
1387 1 9 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.178 0.005 19200
1388 1 9 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.543 0.300 19200
1389 1 9 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.619 1.121 19200
1390 1 9 . 1 1 12 12 PHE H H 12 9.791 9.791 9.138 0.653 19200
1391 1 9 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.741 0.261 19200
1392 1 9 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.646 -0.553 19200
1393 1 9 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.548 -0.911 19200
1394 1 9 . 1 1 14 14 CYS N N 14 117.951 117.951 117.604 0.347 19200
1395 1 9 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.685 0.212 19200
1396 1 9 . 1 1 14 14 CYS CA C 14 55.375 55.375 59.299 -3.924 19200
1397 1 9 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.513 14.068 19200
1398 1 9 . 1 1 14 14 CYS H H 14 8.630 8.630 8.317 0.313 19200
1399 1 9 . 1 1 15 15 GLY N N 15 108.668 108.668 106.254 2.414 19200
1400 1 9 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.585 0.150 19200
1401 1 9 . 1 1 15 15 GLY H H 15 8.372 8.372 7.804 0.568 19200
1402 1 9 . 1 1 16 16 ASN N N 16 121.627 121.627 119.791 1.836 19200
1403 1 9 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.581 -0.048 19200
1404 1 9 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.325 0.217 19200
1405 1 9 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.401 0.439 19200
1406 1 9 . 1 1 16 16 ASN H H 16 9.709 9.709 8.514 1.195 19200
1407 1 9 . 1 1 17 17 ILE N N 17 119.731 119.731 117.873 1.858 19200
1408 1 9 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.870 0.345 19200
1409 1 9 . 1 1 17 17 ILE CA C 17 61.465 61.465 62.590 -1.125 19200
1410 1 9 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.938 -0.026 19200
1411 1 9 . 1 1 17 17 ILE H H 17 8.196 8.196 8.016 0.180 19200
1412 1 9 . 1 1 18 18 THR N N 18 117.836 117.836 108.739 9.097 19200
1413 1 9 . 1 1 18 18 THR HA H 18 3.985 3.985 4.008 -0.023 19200
1414 1 9 . 1 1 18 18 THR CA C 18 64.041 64.041 62.586 1.456 19200
1415 1 9 . 1 1 18 18 THR CB C 18 69.529 69.529 67.778 1.751 19200
1416 1 9 . 1 1 18 18 THR H H 18 7.969 7.969 7.696 0.273 19200
1417 1 9 . 1 1 19 19 LYS N N 19 124.340 124.340 121.595 2.745 19200
1418 1 9 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.063 0.405 19200
1419 1 9 . 1 1 19 19 LYS CA C 19 56.099 56.099 56.732 -0.633 19200
1420 1 9 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.959 2.896 19200
1421 1 9 . 1 1 19 19 LYS H H 19 8.271 8.271 7.867 0.404 19200
1422 1 9 . 1 1 20 20 CYS N N 20 121.675 121.675 123.609 -1.934 19200
1423 1 9 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.440 0.763 19200
1424 1 9 . 1 1 20 20 CYS CA C 20 55.367 55.367 57.781 -2.414 19200
1425 1 9 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.624 18.794 19200
1426 1 9 . 1 1 20 20 CYS H H 20 8.543 8.543 8.361 0.182 19200
1427 1 9 . 1 1 21 21 ILE N N 21 118.395 118.395 121.543 -3.148 19200
1428 1 9 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.867 -0.177 19200
1429 1 9 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.468 0.828 19200
1430 1 9 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.315 0.539 19200
1431 1 9 . 1 1 21 21 ILE H H 21 9.070 9.070 8.862 0.208 19200
1432 1 9 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.914 -0.603 19200
1433 1 9 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.773 1.318 19200
1434 1 9 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.658 0.645 19200
1435 1 9 . 1 1 23 23 GLN N N 23 120.837 120.837 124.671 -3.834 19200
1436 1 9 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.134 -0.220 19200
1437 1 9 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.728 -0.299 19200
1438 1 9 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.317 -0.087 19200
1439 1 9 . 1 1 23 23 GLN H H 23 8.285 8.285 8.379 -0.094 19200
1440 1 9 . 1 1 24 24 PHE N N 24 112.558 112.558 118.113 -5.555 19200
1441 1 9 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.252 0.531 19200
1442 1 9 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.337 -2.132 19200
1443 1 9 . 1 1 24 24 PHE CB C 24 37.991 37.991 39.136 -1.145 19200
1444 1 9 . 1 1 24 24 PHE H H 24 7.218 7.218 8.178 -0.960 19200
1445 1 9 . 1 1 25 25 TRP N N 25 118.981 118.981 117.157 1.824 19200
1446 1 9 . 1 1 25 25 TRP HA H 25 5.263 5.263 4.987 0.276 19200
1447 1 9 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.737 0.094 19200
1448 1 9 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.494 0.419 19200
1449 1 9 . 1 1 25 25 TRP H H 25 7.925 7.925 7.817 0.108 19200
1450 1 9 . 1 1 26 26 ARG N N 26 126.158 126.158 120.450 5.708 19200
1451 1 9 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.618 -0.203 19200
1452 1 9 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.345 1.620 19200
1453 1 9 . 1 1 26 26 ARG CB C 26 30.716 30.716 32.230 -1.514 19200
1454 1 9 . 1 1 26 26 ARG H H 26 8.126 8.126 7.877 0.249 19200
1455 1 9 . 1 1 27 27 CYS N N 27 123.356 123.356 124.249 -0.893 19200
1456 1 9 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.281 0.559 19200
1457 1 9 . 1 1 27 27 CYS CA C 27 56.090 56.090 60.020 -3.929 19200
1458 1 9 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.490 10.890 19200
1459 1 9 . 1 1 27 27 CYS H H 27 8.927 8.927 9.160 -0.233 19200
1460 1 9 . 1 1 28 28 ASP N N 28 120.779 120.779 121.160 -0.381 19200
1461 1 9 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.647 0.218 19200
1462 1 9 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.634 -1.815 19200
1463 1 9 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.315 0.874 19200
1464 1 9 . 1 1 28 28 ASP H H 28 9.642 9.642 8.532 1.110 19200
1465 1 9 . 1 1 29 29 GLY N N 29 111.028 111.028 109.383 1.645 19200
1466 1 9 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.579 1.534 19200
1467 1 9 . 1 1 29 29 GLY H H 29 9.361 9.361 8.130 1.231 19200
1468 1 9 . 1 1 30 30 GLN N N 30 118.561 118.561 118.922 -0.361 19200
1469 1 9 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.586 -0.016 19200
1470 1 9 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.461 -0.508 19200
1471 1 9 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.077 -0.824 19200
1472 1 9 . 1 1 30 30 GLN H H 30 7.513 7.513 8.102 -0.589 19200
1473 1 9 . 1 1 31 31 VAL N N 31 129.747 129.747 122.011 7.736 19200
1474 1 9 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.964 -0.015 19200
1475 1 9 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.298 2.874 19200
1476 1 9 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.279 0.224 19200
1477 1 9 . 1 1 31 31 VAL H H 31 9.403 9.403 8.574 0.829 19200
1478 1 9 . 1 1 32 32 ASP N N 32 130.844 130.844 120.105 10.739 19200
1479 1 9 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.263 0.596 19200
1480 1 9 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.207 0.429 19200
1481 1 9 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.364 5.452 19200
1482 1 9 . 1 1 32 32 ASP H H 32 10.474 10.474 8.016 2.458 19200
1483 1 9 . 1 1 33 33 CYS N N 33 118.607 118.607 116.618 1.989 19200
1484 1 9 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.264 0.720 19200
1485 1 9 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.257 -5.846 19200
1486 1 9 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.929 15.201 19200
1487 1 9 . 1 1 33 33 CYS H H 33 8.231 8.231 8.261 -0.030 19200
1488 1 9 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.690 -0.407 19200
1489 1 9 . 1 1 34 34 ASP CA C 34 57.651 57.651 55.724 1.927 19200
1490 1 9 . 1 1 34 34 ASP CB C 34 40.574 40.574 41.095 -0.521 19200
1491 1 9 . 1 1 35 35 ASN N N 35 114.357 114.357 115.781 -1.424 19200
1492 1 9 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.789 0.007 19200
1493 1 9 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.614 -0.583 19200
1494 1 9 . 1 1 35 35 ASN CB C 35 38.525 38.525 38.147 0.378 19200
1495 1 9 . 1 1 35 35 ASN H H 35 7.842 7.842 8.005 -0.163 19200
1496 1 9 . 1 1 36 36 GLY N N 36 106.237 106.237 108.192 -1.955 19200
1497 1 9 . 1 1 36 36 GLY CA C 36 46.895 46.895 45.991 0.904 19200
1498 1 9 . 1 1 36 36 GLY H H 36 8.269 8.269 8.472 -0.203 19200
1499 1 9 . 1 1 37 37 SER N N 37 115.105 115.105 114.402 0.703 19200
1500 1 9 . 1 1 37 37 SER HA H 37 4.026 4.026 4.550 -0.524 19200
1501 1 9 . 1 1 37 37 SER CA C 37 62.619 62.619 59.296 3.323 19200
1502 1 9 . 1 1 37 37 SER CB C 37 63.494 63.494 63.399 0.095 19200
1503 1 9 . 1 1 37 37 SER H H 37 7.900 7.900 7.840 0.060 19200
1504 1 9 . 1 1 38 38 ASP N N 38 116.663 116.663 118.336 -1.673 19200
1505 1 9 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.650 -0.213 19200
1506 1 9 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.227 1.171 19200
1507 1 9 . 1 1 38 38 ASP CB C 38 41.045 41.045 40.345 0.700 19200
1508 1 9 . 1 1 38 38 ASP H H 38 9.737 9.737 8.665 1.072 19200
1509 1 9 . 1 1 39 39 GLU N N 39 116.396 116.396 118.047 -1.651 19200
1510 1 9 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.716 0.150 19200
1511 1 9 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.806 -0.032 19200
1512 1 9 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.246 2.128 19200
1513 1 9 . 1 1 39 39 GLU H H 39 7.511 7.511 7.760 -0.249 19200
1514 1 9 . 1 1 40 40 GLN N N 40 119.983 119.983 117.368 2.615 19200
1515 1 9 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.513 0.022 19200
1516 1 9 . 1 1 40 40 GLN CA C 40 55.371 55.371 56.362 -0.991 19200
1517 1 9 . 1 1 40 40 GLN CB C 40 30.705 30.705 29.481 1.224 19200
1518 1 9 . 1 1 40 40 GLN H H 40 7.084 7.084 8.019 -0.935 19200
1519 1 9 . 1 1 41 41 GLY N N 41 113.322 113.322 107.650 5.672 19200
1520 1 9 . 1 1 41 41 GLY CA C 41 47.145 47.145 45.117 2.027 19200
1521 1 9 . 1 1 41 41 GLY H H 41 8.992 8.992 8.573 0.419 19200
1522 1 10 . 1 1 5 5 VAL N N 5 122.070 122.070 121.839 0.231 19200
1523 1 10 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.029 0.170 19200
1524 1 10 . 1 1 5 5 VAL CA C 5 62.696 62.696 63.590 -0.894 19200
1525 1 10 . 1 1 5 5 VAL CB C 5 33.858 33.858 32.334 1.524 19200
1526 1 10 . 1 1 5 5 VAL H H 5 8.246 8.246 8.244 0.002 19200
1527 1 10 . 1 1 6 6 THR N N 6 119.169 119.169 119.270 -0.101 19200
1528 1 10 . 1 1 6 6 THR HA H 6 4.376 4.376 4.647 -0.271 19200
1529 1 10 . 1 1 6 6 THR CA C 6 61.781 61.781 61.154 0.627 19200
1530 1 10 . 1 1 6 6 THR CB C 6 70.908 70.908 70.896 0.012 19200
1531 1 10 . 1 1 6 6 THR H H 6 8.243 8.243 8.086 0.157 19200
1532 1 10 . 1 1 7 7 CYS N N 7 121.405 121.405 122.639 -1.234 19200
1533 1 10 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.869 -0.045 19200
1534 1 10 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.998 -4.780 19200
1535 1 10 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.882 11.243 19200
1536 1 10 . 1 1 7 7 CYS H H 7 8.656 8.656 8.593 0.063 19200
1537 1 10 . 1 1 8 8 SER N N 8 118.316 118.316 114.322 3.994 19200
1538 1 10 . 1 1 8 8 SER HA H 8 4.349 4.349 4.773 -0.424 19200
1539 1 10 . 1 1 8 8 SER CA C 8 58.967 58.967 57.510 1.457 19200
1540 1 10 . 1 1 8 8 SER CB C 8 64.571 64.571 63.675 0.895 19200
1541 1 10 . 1 1 8 8 SER H H 8 8.574 8.574 8.059 0.515 19200
1542 1 10 . 1 1 9 9 LEU N N 9 121.658 121.658 121.888 -0.230 19200
1543 1 10 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.343 -0.113 19200
1544 1 10 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.324 1.380 19200
1545 1 10 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.646 0.654 19200
1546 1 10 . 1 1 9 9 LEU H H 9 8.260 8.260 8.308 -0.048 19200
1547 1 10 . 1 1 10 10 GLY N N 10 112.236 112.236 106.654 5.582 19200
1548 1 10 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.829 0.840 19200
1549 1 10 . 1 1 10 10 GLY H H 10 9.031 9.031 8.656 0.375 19200
1550 1 10 . 1 1 11 11 TYR N N 11 121.166 121.166 119.217 1.949 19200
1551 1 10 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.547 -0.481 19200
1552 1 10 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.148 0.137 19200
1553 1 10 . 1 1 11 11 TYR CB C 11 41.830 41.830 43.093 -1.263 19200
1554 1 10 . 1 1 11 11 TYR H H 11 8.335 8.335 7.692 0.643 19200
1555 1 10 . 1 1 12 12 PHE N N 12 121.724 121.724 116.115 5.609 19200
1556 1 10 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.174 0.009 19200
1557 1 10 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.518 0.325 19200
1558 1 10 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.656 1.084 19200
1559 1 10 . 1 1 12 12 PHE H H 12 9.791 9.791 9.185 0.606 19200
1560 1 10 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.657 0.344 19200
1561 1 10 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.439 -0.346 19200
1562 1 10 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.627 -0.990 19200
1563 1 10 . 1 1 14 14 CYS N N 14 117.951 117.951 117.894 0.057 19200
1564 1 10 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.643 0.254 19200
1565 1 10 . 1 1 14 14 CYS CA C 14 55.375 55.375 59.284 -3.909 19200
1566 1 10 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.543 14.038 19200
1567 1 10 . 1 1 14 14 CYS H H 14 8.630 8.630 8.349 0.281 19200
1568 1 10 . 1 1 15 15 GLY N N 15 108.668 108.668 105.956 2.712 19200
1569 1 10 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.287 0.448 19200
1570 1 10 . 1 1 15 15 GLY H H 15 8.372 8.372 7.568 0.804 19200
1571 1 10 . 1 1 16 16 ASN N N 16 121.627 121.627 118.126 3.501 19200
1572 1 10 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.453 0.080 19200
1573 1 10 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.498 0.045 19200
1574 1 10 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.208 0.633 19200
1575 1 10 . 1 1 16 16 ASN H H 16 9.709 9.709 8.539 1.170 19200
1576 1 10 . 1 1 17 17 ILE N N 17 119.731 119.731 116.642 3.089 19200
1577 1 10 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.923 0.292 19200
1578 1 10 . 1 1 17 17 ILE CA C 17 61.465 61.465 61.991 -0.526 19200
1579 1 10 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.989 -0.076 19200
1580 1 10 . 1 1 17 17 ILE H H 17 8.196 8.196 7.710 0.486 19200
1581 1 10 . 1 1 18 18 THR N N 18 117.836 117.836 110.165 7.671 19200
1582 1 10 . 1 1 18 18 THR HA H 18 3.985 3.985 4.002 -0.017 19200
1583 1 10 . 1 1 18 18 THR CA C 18 64.041 64.041 62.674 1.367 19200
1584 1 10 . 1 1 18 18 THR CB C 18 69.529 69.529 67.922 1.607 19200
1585 1 10 . 1 1 18 18 THR H H 18 7.969 7.969 7.608 0.361 19200
1586 1 10 . 1 1 19 19 LYS N N 19 124.340 124.340 121.748 2.592 19200
1587 1 10 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.044 0.424 19200
1588 1 10 . 1 1 19 19 LYS CA C 19 56.099 56.099 56.698 -0.599 19200
1589 1 10 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.614 3.241 19200
1590 1 10 . 1 1 19 19 LYS H H 19 8.271 8.271 7.848 0.423 19200
1591 1 10 . 1 1 20 20 CYS N N 20 121.675 121.675 123.689 -2.014 19200
1592 1 10 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.410 0.793 19200
1593 1 10 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.222 -2.855 19200
1594 1 10 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.850 18.568 19200
1595 1 10 . 1 1 20 20 CYS H H 20 8.543 8.543 8.343 0.200 19200
1596 1 10 . 1 1 21 21 ILE N N 21 118.395 118.395 120.694 -2.299 19200
1597 1 10 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.913 -0.223 19200
1598 1 10 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.484 0.812 19200
1599 1 10 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.915 -0.061 19200
1600 1 10 . 1 1 21 21 ILE H H 21 9.070 9.070 8.883 0.187 19200
1601 1 10 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.881 -0.570 19200
1602 1 10 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.555 1.536 19200
1603 1 10 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.554 0.749 19200
1604 1 10 . 1 1 23 23 GLN N N 23 120.837 120.837 124.923 -4.086 19200
1605 1 10 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.010 -0.096 19200
1606 1 10 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.630 -0.201 19200
1607 1 10 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.214 0.015 19200
1608 1 10 . 1 1 23 23 GLN H H 23 8.285 8.285 8.143 0.142 19200
1609 1 10 . 1 1 24 24 PHE N N 24 112.558 112.558 118.041 -5.483 19200
1610 1 10 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.243 0.540 19200
1611 1 10 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.575 -2.370 19200
1612 1 10 . 1 1 24 24 PHE CB C 24 37.991 37.991 38.922 -0.931 19200
1613 1 10 . 1 1 24 24 PHE H H 24 7.218 7.218 8.129 -0.911 19200
1614 1 10 . 1 1 25 25 TRP N N 25 118.981 118.981 117.449 1.532 19200
1615 1 10 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.007 0.256 19200
1616 1 10 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.656 0.175 19200
1617 1 10 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.312 0.601 19200
1618 1 10 . 1 1 25 25 TRP H H 25 7.925 7.925 7.911 0.014 19200
1619 1 10 . 1 1 26 26 ARG N N 26 126.158 126.158 120.928 5.230 19200
1620 1 10 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.698 -0.283 19200
1621 1 10 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.717 1.248 19200
1622 1 10 . 1 1 26 26 ARG CB C 26 30.716 30.716 31.596 -0.880 19200
1623 1 10 . 1 1 26 26 ARG H H 26 8.126 8.126 8.075 0.051 19200
1624 1 10 . 1 1 27 27 CYS N N 27 123.356 123.356 123.642 -0.286 19200
1625 1 10 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.344 0.496 19200
1626 1 10 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.334 -3.244 19200
1627 1 10 . 1 1 27 27 CYS CB C 27 36.380 36.380 24.456 11.924 19200
1628 1 10 . 1 1 27 27 CYS H H 27 8.927 8.927 9.121 -0.194 19200
1629 1 10 . 1 1 28 28 ASP N N 28 120.779 120.779 120.358 0.421 19200
1630 1 10 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.722 0.143 19200
1631 1 10 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.612 -1.793 19200
1632 1 10 . 1 1 28 28 ASP CB C 28 42.189 42.189 42.281 -0.092 19200
1633 1 10 . 1 1 28 28 ASP H H 28 9.642 9.642 8.539 1.103 19200
1634 1 10 . 1 1 29 29 GLY N N 29 111.028 111.028 109.938 1.090 19200
1635 1 10 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.717 1.396 19200
1636 1 10 . 1 1 29 29 GLY H H 29 9.361 9.361 8.151 1.210 19200
1637 1 10 . 1 1 30 30 GLN N N 30 118.561 118.561 119.013 -0.452 19200
1638 1 10 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.573 -0.003 19200
1639 1 10 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.687 -0.734 19200
1640 1 10 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.522 -1.269 19200
1641 1 10 . 1 1 30 30 GLN H H 30 7.513 7.513 8.079 -0.566 19200
1642 1 10 . 1 1 31 31 VAL N N 31 129.747 129.747 121.607 8.140 19200
1643 1 10 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.978 -0.029 19200
1644 1 10 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.245 2.928 19200
1645 1 10 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.302 0.201 19200
1646 1 10 . 1 1 31 31 VAL H H 31 9.403 9.403 8.562 0.841 19200
1647 1 10 . 1 1 32 32 ASP N N 32 130.844 130.844 119.882 10.962 19200
1648 1 10 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.207 0.652 19200
1649 1 10 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.341 0.295 19200
1650 1 10 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.223 5.593 19200
1651 1 10 . 1 1 32 32 ASP H H 32 10.474 10.474 8.062 2.412 19200
1652 1 10 . 1 1 33 33 CYS N N 33 118.607 118.607 116.447 2.160 19200
1653 1 10 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.245 0.739 19200
1654 1 10 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.158 -5.747 19200
1655 1 10 . 1 1 33 33 CYS CB C 33 43.130 43.130 28.011 15.119 19200
1656 1 10 . 1 1 33 33 CYS H H 33 8.231 8.231 8.119 0.112 19200
1657 1 10 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.680 -0.397 19200
1658 1 10 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.116 1.535 19200
1659 1 10 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.978 -0.404 19200
1660 1 10 . 1 1 35 35 ASN N N 35 114.357 114.357 114.750 -0.393 19200
1661 1 10 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.799 -0.003 19200
1662 1 10 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.392 -0.362 19200
1663 1 10 . 1 1 35 35 ASN CB C 35 38.525 38.525 37.937 0.589 19200
1664 1 10 . 1 1 35 35 ASN H H 35 7.842 7.842 7.981 -0.139 19200
1665 1 10 . 1 1 36 36 GLY N N 36 106.237 106.237 108.111 -1.874 19200
1666 1 10 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.276 0.619 19200
1667 1 10 . 1 1 36 36 GLY H H 36 8.269 8.269 8.522 -0.253 19200
1668 1 10 . 1 1 37 37 SER N N 37 115.105 115.105 115.496 -0.391 19200
1669 1 10 . 1 1 37 37 SER HA H 37 4.026 4.026 4.460 -0.434 19200
1670 1 10 . 1 1 37 37 SER CA C 37 62.619 62.619 60.399 2.220 19200
1671 1 10 . 1 1 37 37 SER CB C 37 63.494 63.494 63.342 0.152 19200
1672 1 10 . 1 1 37 37 SER H H 37 7.900 7.900 7.872 0.028 19200
1673 1 10 . 1 1 38 38 ASP N N 38 116.663 116.663 117.405 -0.742 19200
1674 1 10 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.543 -0.106 19200
1675 1 10 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.805 0.593 19200
1676 1 10 . 1 1 38 38 ASP CB C 38 41.045 41.045 39.752 1.293 19200
1677 1 10 . 1 1 38 38 ASP H H 38 9.737 9.737 8.884 0.853 19200
1678 1 10 . 1 1 39 39 GLU N N 39 116.396 116.396 117.689 -1.293 19200
1679 1 10 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.670 0.196 19200
1680 1 10 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.468 0.306 19200
1681 1 10 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.372 2.002 19200
1682 1 10 . 1 1 39 39 GLU H H 39 7.511 7.511 7.594 -0.083 19200
1683 1 10 . 1 1 40 40 GLN N N 40 119.983 119.983 120.282 -0.299 19200
1684 1 10 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.479 0.056 19200
1685 1 10 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.569 -0.198 19200
1686 1 10 . 1 1 40 40 GLN CB C 40 30.705 30.705 27.843 2.862 19200
1687 1 10 . 1 1 40 40 GLN H H 40 7.084 7.084 7.802 -0.718 19200
1688 1 10 . 1 1 41 41 GLY N N 41 113.322 113.322 109.318 4.004 19200
1689 1 10 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.961 2.184 19200
1690 1 10 . 1 1 41 41 GLY H H 41 8.992 8.992 8.770 0.222 19200
1691 1 11 . 1 1 5 5 VAL N N 5 122.070 122.070 116.997 5.073 19200
1692 1 11 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.096 0.103 19200
1693 1 11 . 1 1 5 5 VAL CA C 5 62.696 62.696 63.504 -0.808 19200
1694 1 11 . 1 1 5 5 VAL CB C 5 33.858 33.858 31.560 2.298 19200
1695 1 11 . 1 1 5 5 VAL H H 5 8.246 8.246 8.230 0.016 19200
1696 1 11 . 1 1 6 6 THR N N 6 119.169 119.169 118.218 0.951 19200
1697 1 11 . 1 1 6 6 THR HA H 6 4.376 4.376 4.536 -0.160 19200
1698 1 11 . 1 1 6 6 THR CA C 6 61.781 61.781 61.645 0.136 19200
1699 1 11 . 1 1 6 6 THR CB C 6 70.908 70.908 72.032 -1.124 19200
1700 1 11 . 1 1 6 6 THR H H 6 8.243 8.243 8.181 0.062 19200
1701 1 11 . 1 1 7 7 CYS N N 7 121.405 121.405 120.820 0.585 19200
1702 1 11 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.779 0.045 19200
1703 1 11 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.623 -4.405 19200
1704 1 11 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.372 11.753 19200
1705 1 11 . 1 1 7 7 CYS H H 7 8.656 8.656 8.366 0.290 19200
1706 1 11 . 1 1 8 8 SER N N 8 118.316 118.316 115.225 3.091 19200
1707 1 11 . 1 1 8 8 SER HA H 8 4.349 4.349 4.652 -0.303 19200
1708 1 11 . 1 1 8 8 SER CA C 8 58.967 58.967 57.759 1.208 19200
1709 1 11 . 1 1 8 8 SER CB C 8 64.571 64.571 63.579 0.992 19200
1710 1 11 . 1 1 8 8 SER H H 8 8.574 8.574 8.268 0.306 19200
1711 1 11 . 1 1 9 9 LEU N N 9 121.658 121.658 121.989 -0.331 19200
1712 1 11 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.289 -0.059 19200
1713 1 11 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.594 1.110 19200
1714 1 11 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.344 0.956 19200
1715 1 11 . 1 1 9 9 LEU H H 9 8.260 8.260 8.324 -0.064 19200
1716 1 11 . 1 1 10 10 GLY N N 10 112.236 112.236 106.898 5.338 19200
1717 1 11 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.755 0.914 19200
1718 1 11 . 1 1 10 10 GLY H H 10 9.031 9.031 8.703 0.328 19200
1719 1 11 . 1 1 11 11 TYR N N 11 121.166 121.166 119.028 2.138 19200
1720 1 11 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.537 -0.471 19200
1721 1 11 . 1 1 11 11 TYR CA C 11 57.285 57.285 56.866 0.419 19200
1722 1 11 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.961 -1.131 19200
1723 1 11 . 1 1 11 11 TYR H H 11 8.335 8.335 7.676 0.659 19200
1724 1 11 . 1 1 12 12 PHE N N 12 121.724 121.724 117.787 3.937 19200
1725 1 11 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.186 -0.003 19200
1726 1 11 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.482 0.361 19200
1727 1 11 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.396 1.344 19200
1728 1 11 . 1 1 12 12 PHE H H 12 9.791 9.791 9.186 0.605 19200
1729 1 11 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.666 0.336 19200
1730 1 11 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.475 -0.382 19200
1731 1 11 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.681 -1.044 19200
1732 1 11 . 1 1 14 14 CYS N N 14 117.951 117.951 116.632 1.319 19200
1733 1 11 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.734 0.163 19200
1734 1 11 . 1 1 14 14 CYS CA C 14 55.375 55.375 59.536 -4.161 19200
1735 1 11 . 1 1 14 14 CYS CB C 14 42.581 42.581 29.131 13.450 19200
1736 1 11 . 1 1 14 14 CYS H H 14 8.630 8.630 8.401 0.229 19200
1737 1 11 . 1 1 15 15 GLY N N 15 108.668 108.668 105.496 3.172 19200
1738 1 11 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.435 0.300 19200
1739 1 11 . 1 1 15 15 GLY H H 15 8.372 8.372 7.706 0.666 19200
1740 1 11 . 1 1 16 16 ASN N N 16 121.627 121.627 118.446 3.181 19200
1741 1 11 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.471 0.062 19200
1742 1 11 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.343 0.200 19200
1743 1 11 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.179 0.662 19200
1744 1 11 . 1 1 16 16 ASN H H 16 9.709 9.709 8.356 1.353 19200
1745 1 11 . 1 1 17 17 ILE N N 17 119.731 119.731 117.266 2.465 19200
1746 1 11 . 1 1 17 17 ILE HA H 17 4.215 4.215 4.027 0.188 19200
1747 1 11 . 1 1 17 17 ILE CA C 17 61.465 61.465 61.854 -0.389 19200
1748 1 11 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.816 0.097 19200
1749 1 11 . 1 1 17 17 ILE H H 17 8.196 8.196 7.760 0.436 19200
1750 1 11 . 1 1 18 18 THR N N 18 117.836 117.836 110.133 7.703 19200
1751 1 11 . 1 1 18 18 THR HA H 18 3.985 3.985 3.988 -0.003 19200
1752 1 11 . 1 1 18 18 THR CA C 18 64.041 64.041 62.950 1.091 19200
1753 1 11 . 1 1 18 18 THR CB C 18 69.529 69.529 67.033 2.496 19200
1754 1 11 . 1 1 18 18 THR H H 18 7.969 7.969 7.311 0.658 19200
1755 1 11 . 1 1 19 19 LYS N N 19 124.340 124.340 121.054 3.286 19200
1756 1 11 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.068 0.400 19200
1757 1 11 . 1 1 19 19 LYS CA C 19 56.099 56.099 57.107 -1.008 19200
1758 1 11 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.713 3.142 19200
1759 1 11 . 1 1 19 19 LYS H H 19 8.271 8.271 8.064 0.207 19200
1760 1 11 . 1 1 20 20 CYS N N 20 121.675 121.675 123.405 -1.730 19200
1761 1 11 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.454 0.749 19200
1762 1 11 . 1 1 20 20 CYS CA C 20 55.367 55.367 57.969 -2.602 19200
1763 1 11 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.908 18.510 19200
1764 1 11 . 1 1 20 20 CYS H H 20 8.543 8.543 8.321 0.222 19200
1765 1 11 . 1 1 21 21 ILE N N 21 118.395 118.395 120.952 -2.557 19200
1766 1 11 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.841 -0.151 19200
1767 1 11 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.413 0.883 19200
1768 1 11 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.578 0.276 19200
1769 1 11 . 1 1 21 21 ILE H H 21 9.070 9.070 8.863 0.207 19200
1770 1 11 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.880 -0.569 19200
1771 1 11 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.711 1.380 19200
1772 1 11 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.662 0.641 19200
1773 1 11 . 1 1 23 23 GLN N N 23 120.837 120.837 124.742 -3.905 19200
1774 1 11 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.199 -0.285 19200
1775 1 11 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.809 -0.380 19200
1776 1 11 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.421 -0.192 19200
1777 1 11 . 1 1 23 23 GLN H H 23 8.285 8.285 8.270 0.015 19200
1778 1 11 . 1 1 24 24 PHE N N 24 112.558 112.558 117.896 -5.338 19200
1779 1 11 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.278 0.505 19200
1780 1 11 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.377 -2.172 19200
1781 1 11 . 1 1 24 24 PHE CB C 24 37.991 37.991 38.758 -0.767 19200
1782 1 11 . 1 1 24 24 PHE H H 24 7.218 7.218 8.288 -1.070 19200
1783 1 11 . 1 1 25 25 TRP N N 25 118.981 118.981 117.516 1.465 19200
1784 1 11 . 1 1 25 25 TRP HA H 25 5.263 5.263 4.926 0.337 19200
1785 1 11 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.642 0.189 19200
1786 1 11 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.378 0.535 19200
1787 1 11 . 1 1 25 25 TRP H H 25 7.925 7.925 7.953 -0.028 19200
1788 1 11 . 1 1 26 26 ARG N N 26 126.158 126.158 120.634 5.524 19200
1789 1 11 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.696 -0.281 19200
1790 1 11 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.873 1.092 19200
1791 1 11 . 1 1 26 26 ARG CB C 26 30.716 30.716 31.372 -0.656 19200
1792 1 11 . 1 1 26 26 ARG H H 26 8.126 8.126 8.029 0.097 19200
1793 1 11 . 1 1 27 27 CYS N N 27 123.356 123.356 121.097 2.259 19200
1794 1 11 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.333 0.507 19200
1795 1 11 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.550 -3.461 19200
1796 1 11 . 1 1 27 27 CYS CB C 27 36.380 36.380 24.572 11.808 19200
1797 1 11 . 1 1 27 27 CYS H H 27 8.927 8.927 9.088 -0.161 19200
1798 1 11 . 1 1 28 28 ASP N N 28 120.779 120.779 121.314 -0.535 19200
1799 1 11 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.592 0.273 19200
1800 1 11 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.817 -1.998 19200
1801 1 11 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.496 0.693 19200
1802 1 11 . 1 1 28 28 ASP H H 28 9.642 9.642 8.565 1.077 19200
1803 1 11 . 1 1 29 29 GLY N N 29 111.028 111.028 109.499 1.529 19200
1804 1 11 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.541 1.572 19200
1805 1 11 . 1 1 29 29 GLY H H 29 9.361 9.361 8.130 1.231 19200
1806 1 11 . 1 1 30 30 GLN N N 30 118.561 118.561 118.887 -0.326 19200
1807 1 11 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.603 -0.033 19200
1808 1 11 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.237 -0.284 19200
1809 1 11 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.361 -1.108 19200
1810 1 11 . 1 1 30 30 GLN H H 30 7.513 7.513 8.046 -0.533 19200
1811 1 11 . 1 1 31 31 VAL N N 31 129.747 129.747 121.957 7.790 19200
1812 1 11 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.967 -0.018 19200
1813 1 11 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.798 2.374 19200
1814 1 11 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.475 0.028 19200
1815 1 11 . 1 1 31 31 VAL H H 31 9.403 9.403 8.605 0.798 19200
1816 1 11 . 1 1 32 32 ASP N N 32 130.844 130.844 120.558 10.286 19200
1817 1 11 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.280 0.579 19200
1818 1 11 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.330 0.306 19200
1819 1 11 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.510 5.306 19200
1820 1 11 . 1 1 32 32 ASP H H 32 10.474 10.474 8.018 2.456 19200
1821 1 11 . 1 1 33 33 CYS N N 33 118.607 118.607 118.136 0.471 19200
1822 1 11 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.268 0.716 19200
1823 1 11 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.098 -5.687 19200
1824 1 11 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.643 15.487 19200
1825 1 11 . 1 1 33 33 CYS H H 33 8.231 8.231 7.903 0.328 19200
1826 1 11 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.413 -0.130 19200
1827 1 11 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.971 0.680 19200
1828 1 11 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.850 -0.276 19200
1829 1 11 . 1 1 35 35 ASN N N 35 114.357 114.357 112.527 1.830 19200
1830 1 11 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.786 0.010 19200
1831 1 11 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.566 -0.535 19200
1832 1 11 . 1 1 35 35 ASN CB C 35 38.525 38.525 38.055 0.470 19200
1833 1 11 . 1 1 35 35 ASN H H 35 7.842 7.842 7.978 -0.136 19200
1834 1 11 . 1 1 36 36 GLY N N 36 106.237 106.237 108.640 -2.403 19200
1835 1 11 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.263 0.632 19200
1836 1 11 . 1 1 36 36 GLY H H 36 8.269 8.269 7.947 0.322 19200
1837 1 11 . 1 1 37 37 SER N N 37 115.105 115.105 114.965 0.140 19200
1838 1 11 . 1 1 37 37 SER HA H 37 4.026 4.026 4.362 -0.336 19200
1839 1 11 . 1 1 37 37 SER CA C 37 62.619 62.619 60.069 2.550 19200
1840 1 11 . 1 1 37 37 SER CB C 37 63.494 63.494 63.280 0.214 19200
1841 1 11 . 1 1 37 37 SER H H 37 7.900 7.900 7.796 0.104 19200
1842 1 11 . 1 1 38 38 ASP N N 38 116.663 116.663 118.232 -1.569 19200
1843 1 11 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.512 -0.075 19200
1844 1 11 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.990 0.408 19200
1845 1 11 . 1 1 38 38 ASP CB C 38 41.045 41.045 39.784 1.261 19200
1846 1 11 . 1 1 38 38 ASP H H 38 9.737 9.737 8.778 0.959 19200
1847 1 11 . 1 1 39 39 GLU N N 39 116.396 116.396 118.020 -1.624 19200
1848 1 11 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.598 0.268 19200
1849 1 11 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.549 0.225 19200
1850 1 11 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.083 2.291 19200
1851 1 11 . 1 1 39 39 GLU H H 39 7.511 7.511 7.602 -0.091 19200
1852 1 11 . 1 1 40 40 GLN N N 40 119.983 119.983 119.841 0.142 19200
1853 1 11 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.538 -0.003 19200
1854 1 11 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.756 -0.385 19200
1855 1 11 . 1 1 40 40 GLN CB C 40 30.705 30.705 28.339 2.366 19200
1856 1 11 . 1 1 40 40 GLN H H 40 7.084 7.084 7.753 -0.669 19200
1857 1 11 . 1 1 41 41 GLY N N 41 113.322 113.322 107.387 5.935 19200
1858 1 11 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.721 2.424 19200
1859 1 11 . 1 1 41 41 GLY H H 41 8.992 8.992 8.613 0.379 19200
1860 1 12 . 1 1 5 5 VAL N N 5 122.070 122.070 114.913 7.157 19200
1861 1 12 . 1 1 5 5 VAL HA H 5 4.199 4.199 3.804 0.395 19200
1862 1 12 . 1 1 5 5 VAL CA C 5 62.696 62.696 62.960 -0.264 19200
1863 1 12 . 1 1 5 5 VAL CB C 5 33.858 33.858 32.170 1.688 19200
1864 1 12 . 1 1 5 5 VAL H H 5 8.246 8.246 7.960 0.286 19200
1865 1 12 . 1 1 6 6 THR N N 6 119.169 119.169 113.316 5.853 19200
1866 1 12 . 1 1 6 6 THR HA H 6 4.376 4.376 4.659 -0.283 19200
1867 1 12 . 1 1 6 6 THR CA C 6 61.781 61.781 60.790 0.991 19200
1868 1 12 . 1 1 6 6 THR CB C 6 70.908 70.908 70.957 -0.049 19200
1869 1 12 . 1 1 6 6 THR H H 6 8.243 8.243 8.206 0.037 19200
1870 1 12 . 1 1 7 7 CYS N N 7 121.405 121.405 119.412 1.993 19200
1871 1 12 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.779 0.045 19200
1872 1 12 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.445 -4.227 19200
1873 1 12 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.731 11.394 19200
1874 1 12 . 1 1 7 7 CYS H H 7 8.656 8.656 8.392 0.264 19200
1875 1 12 . 1 1 8 8 SER N N 8 118.316 118.316 115.592 2.724 19200
1876 1 12 . 1 1 8 8 SER HA H 8 4.349 4.349 4.732 -0.383 19200
1877 1 12 . 1 1 8 8 SER CA C 8 58.967 58.967 57.638 1.329 19200
1878 1 12 . 1 1 8 8 SER CB C 8 64.571 64.571 63.810 0.761 19200
1879 1 12 . 1 1 8 8 SER H H 8 8.574 8.574 8.383 0.191 19200
1880 1 12 . 1 1 9 9 LEU N N 9 121.658 121.658 122.377 -0.719 19200
1881 1 12 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.237 -0.007 19200
1882 1 12 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.870 0.834 19200
1883 1 12 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.235 1.065 19200
1884 1 12 . 1 1 9 9 LEU H H 9 8.260 8.260 8.459 -0.199 19200
1885 1 12 . 1 1 10 10 GLY N N 10 112.236 112.236 106.627 5.609 19200
1886 1 12 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.708 0.961 19200
1887 1 12 . 1 1 10 10 GLY H H 10 9.031 9.031 8.669 0.362 19200
1888 1 12 . 1 1 11 11 TYR N N 11 121.166 121.166 119.179 1.987 19200
1889 1 12 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.370 -0.304 19200
1890 1 12 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.277 0.008 19200
1891 1 12 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.828 -0.998 19200
1892 1 12 . 1 1 11 11 TYR H H 11 8.335 8.335 7.667 0.668 19200
1893 1 12 . 1 1 12 12 PHE N N 12 121.724 121.724 118.917 2.807 19200
1894 1 12 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.186 -0.003 19200
1895 1 12 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.359 0.484 19200
1896 1 12 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.653 1.087 19200
1897 1 12 . 1 1 12 12 PHE H H 12 9.791 9.791 9.391 0.400 19200
1898 1 12 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.617 0.385 19200
1899 1 12 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.380 -0.287 19200
1900 1 12 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.633 -0.996 19200
1901 1 12 . 1 1 14 14 CYS N N 14 117.951 117.951 117.746 0.205 19200
1902 1 12 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.671 0.226 19200
1903 1 12 . 1 1 14 14 CYS CA C 14 55.375 55.375 60.194 -4.819 19200
1904 1 12 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.021 14.560 19200
1905 1 12 . 1 1 14 14 CYS H H 14 8.630 8.630 8.216 0.414 19200
1906 1 12 . 1 1 15 15 GLY N N 15 108.668 108.668 106.804 1.864 19200
1907 1 12 . 1 1 15 15 GLY CA C 15 45.735 45.735 44.925 0.810 19200
1908 1 12 . 1 1 15 15 GLY H H 15 8.372 8.372 7.857 0.515 19200
1909 1 12 . 1 1 16 16 ASN N N 16 121.627 121.627 119.070 2.557 19200
1910 1 12 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.441 0.092 19200
1911 1 12 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.540 0.003 19200
1912 1 12 . 1 1 16 16 ASN CB C 16 38.841 38.841 37.964 0.877 19200
1913 1 12 . 1 1 16 16 ASN H H 16 9.709 9.709 8.548 1.161 19200
1914 1 12 . 1 1 17 17 ILE N N 17 119.731 119.731 119.541 0.190 19200
1915 1 12 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.963 0.252 19200
1916 1 12 . 1 1 17 17 ILE CA C 17 61.465 61.465 63.198 -1.733 19200
1917 1 12 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.839 0.074 19200
1918 1 12 . 1 1 17 17 ILE H H 17 8.196 8.196 7.950 0.246 19200
1919 1 12 . 1 1 18 18 THR N N 18 117.836 117.836 109.572 8.264 19200
1920 1 12 . 1 1 18 18 THR HA H 18 3.985 3.985 4.078 -0.093 19200
1921 1 12 . 1 1 18 18 THR CA C 18 64.041 64.041 63.003 1.038 19200
1922 1 12 . 1 1 18 18 THR CB C 18 69.529 69.529 67.329 2.200 19200
1923 1 12 . 1 1 18 18 THR H H 18 7.969 7.969 7.700 0.269 19200
1924 1 12 . 1 1 19 19 LYS N N 19 124.340 124.340 121.844 2.496 19200
1925 1 12 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.011 0.457 19200
1926 1 12 . 1 1 19 19 LYS CA C 19 56.099 56.099 56.992 -0.893 19200
1927 1 12 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.486 3.369 19200
1928 1 12 . 1 1 19 19 LYS H H 19 8.271 8.271 7.797 0.474 19200
1929 1 12 . 1 1 20 20 CYS N N 20 121.675 121.675 123.854 -2.179 19200
1930 1 12 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.418 0.785 19200
1931 1 12 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.111 -2.744 19200
1932 1 12 . 1 1 20 20 CYS CB C 20 44.418 44.418 26.177 18.241 19200
1933 1 12 . 1 1 20 20 CYS H H 20 8.543 8.543 8.343 0.200 19200
1934 1 12 . 1 1 21 21 ILE N N 21 118.395 118.395 120.269 -1.874 19200
1935 1 12 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.834 -0.144 19200
1936 1 12 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.454 0.842 19200
1937 1 12 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.871 -0.017 19200
1938 1 12 . 1 1 21 21 ILE H H 21 9.070 9.070 8.869 0.201 19200
1939 1 12 . 1 1 22 22 PRO HA H 22 3.311 3.311 4.242 -0.931 19200
1940 1 12 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.773 1.318 19200
1941 1 12 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.760 0.543 19200
1942 1 12 . 1 1 23 23 GLN N N 23 120.837 120.837 124.665 -3.828 19200
1943 1 12 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.186 -0.272 19200
1944 1 12 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.664 -0.235 19200
1945 1 12 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.322 -0.093 19200
1946 1 12 . 1 1 23 23 GLN H H 23 8.285 8.285 8.145 0.140 19200
1947 1 12 . 1 1 24 24 PHE N N 24 112.558 112.558 117.981 -5.423 19200
1948 1 12 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.268 0.515 19200
1949 1 12 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.487 -2.282 19200
1950 1 12 . 1 1 24 24 PHE CB C 24 37.991 37.991 39.025 -1.034 19200
1951 1 12 . 1 1 24 24 PHE H H 24 7.218 7.218 8.265 -1.047 19200
1952 1 12 . 1 1 25 25 TRP N N 25 118.981 118.981 116.622 2.359 19200
1953 1 12 . 1 1 25 25 TRP HA H 25 5.263 5.263 4.962 0.301 19200
1954 1 12 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.231 0.600 19200
1955 1 12 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.732 0.181 19200
1956 1 12 . 1 1 25 25 TRP H H 25 7.925 7.925 7.843 0.082 19200
1957 1 12 . 1 1 26 26 ARG N N 26 126.158 126.158 120.501 5.657 19200
1958 1 12 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.651 -0.236 19200
1959 1 12 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.543 1.422 19200
1960 1 12 . 1 1 26 26 ARG CB C 26 30.716 30.716 32.212 -1.496 19200
1961 1 12 . 1 1 26 26 ARG H H 26 8.126 8.126 7.963 0.163 19200
1962 1 12 . 1 1 27 27 CYS N N 27 123.356 123.356 124.080 -0.724 19200
1963 1 12 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.284 0.556 19200
1964 1 12 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.956 -3.866 19200
1965 1 12 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.447 10.933 19200
1966 1 12 . 1 1 27 27 CYS H H 27 8.927 8.927 9.157 -0.230 19200
1967 1 12 . 1 1 28 28 ASP N N 28 120.779 120.779 121.211 -0.432 19200
1968 1 12 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.643 0.222 19200
1969 1 12 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.621 -1.802 19200
1970 1 12 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.306 0.883 19200
1971 1 12 . 1 1 28 28 ASP H H 28 9.642 9.642 8.548 1.094 19200
1972 1 12 . 1 1 29 29 GLY N N 29 111.028 111.028 109.691 1.337 19200
1973 1 12 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.526 1.587 19200
1974 1 12 . 1 1 29 29 GLY H H 29 9.361 9.361 8.154 1.207 19200
1975 1 12 . 1 1 30 30 GLN N N 30 118.561 118.561 118.899 -0.338 19200
1976 1 12 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.568 0.002 19200
1977 1 12 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.525 -0.572 19200
1978 1 12 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.281 -1.028 19200
1979 1 12 . 1 1 30 30 GLN H H 30 7.513 7.513 8.193 -0.680 19200
1980 1 12 . 1 1 31 31 VAL N N 31 129.747 129.747 121.765 7.982 19200
1981 1 12 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.982 -0.033 19200
1982 1 12 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.441 2.732 19200
1983 1 12 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.262 0.241 19200
1984 1 12 . 1 1 31 31 VAL H H 31 9.403 9.403 8.600 0.803 19200
1985 1 12 . 1 1 32 32 ASP N N 32 130.844 130.844 120.436 10.408 19200
1986 1 12 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.265 0.594 19200
1987 1 12 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.359 0.277 19200
1988 1 12 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.541 5.275 19200
1989 1 12 . 1 1 32 32 ASP H H 32 10.474 10.474 7.938 2.536 19200
1990 1 12 . 1 1 33 33 CYS N N 33 118.607 118.607 116.308 2.299 19200
1991 1 12 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.252 0.732 19200
1992 1 12 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.638 -6.227 19200
1993 1 12 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.819 15.312 19200
1994 1 12 . 1 1 33 33 CYS H H 33 8.231 8.231 8.224 0.007 19200
1995 1 12 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.694 -0.411 19200
1996 1 12 . 1 1 34 34 ASP CA C 34 57.651 57.651 55.870 1.781 19200
1997 1 12 . 1 1 34 34 ASP CB C 34 40.574 40.574 41.070 -0.496 19200
1998 1 12 . 1 1 35 35 ASN N N 35 114.357 114.357 115.333 -0.976 19200
1999 1 12 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.779 0.017 19200
2000 1 12 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.761 -0.730 19200
2001 1 12 . 1 1 35 35 ASN CB C 35 38.525 38.525 38.511 0.014 19200
2002 1 12 . 1 1 35 35 ASN H H 35 7.842 7.842 8.016 -0.174 19200
2003 1 12 . 1 1 36 36 GLY N N 36 106.237 106.237 108.397 -2.160 19200
2004 1 12 . 1 1 36 36 GLY CA C 36 46.895 46.895 45.782 1.113 19200
2005 1 12 . 1 1 36 36 GLY H H 36 8.269 8.269 8.466 -0.197 19200
2006 1 12 . 1 1 37 37 SER N N 37 115.105 115.105 114.255 0.850 19200
2007 1 12 . 1 1 37 37 SER HA H 37 4.026 4.026 4.589 -0.563 19200
2008 1 12 . 1 1 37 37 SER CA C 37 62.619 62.619 60.141 2.478 19200
2009 1 12 . 1 1 37 37 SER CB C 37 63.494 63.494 63.398 0.096 19200
2010 1 12 . 1 1 37 37 SER H H 37 7.900 7.900 7.886 0.014 19200
2011 1 12 . 1 1 38 38 ASP N N 38 116.663 116.663 117.692 -1.029 19200
2012 1 12 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.645 -0.208 19200
2013 1 12 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.370 1.028 19200
2014 1 12 . 1 1 38 38 ASP CB C 38 41.045 41.045 40.307 0.738 19200
2015 1 12 . 1 1 38 38 ASP H H 38 9.737 9.737 8.693 1.044 19200
2016 1 12 . 1 1 39 39 GLU N N 39 116.396 116.396 118.344 -1.948 19200
2017 1 12 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.636 0.230 19200
2018 1 12 . 1 1 39 39 GLU CA C 39 54.774 54.774 55.302 -0.528 19200
2019 1 12 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.251 2.123 19200
2020 1 12 . 1 1 39 39 GLU H H 39 7.511 7.511 7.807 -0.296 19200
2021 1 12 . 1 1 40 40 GLN N N 40 119.983 119.983 117.401 2.582 19200
2022 1 12 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.516 0.019 19200
2023 1 12 . 1 1 40 40 GLN CA C 40 55.371 55.371 56.348 -0.977 19200
2024 1 12 . 1 1 40 40 GLN CB C 40 30.705 30.705 29.471 1.234 19200
2025 1 12 . 1 1 40 40 GLN H H 40 7.084 7.084 8.028 -0.944 19200
2026 1 12 . 1 1 41 41 GLY N N 41 113.322 113.322 107.708 5.614 19200
2027 1 12 . 1 1 41 41 GLY CA C 41 47.145 47.145 45.123 2.022 19200
2028 1 12 . 1 1 41 41 GLY H H 41 8.992 8.992 8.579 0.413 19200
2029 1 13 . 1 1 5 5 VAL N N 5 122.070 122.070 123.312 -1.242 19200
2030 1 13 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.098 0.101 19200
2031 1 13 . 1 1 5 5 VAL CA C 5 62.696 62.696 62.804 -0.108 19200
2032 1 13 . 1 1 5 5 VAL CB C 5 33.858 33.858 31.936 1.922 19200
2033 1 13 . 1 1 5 5 VAL H H 5 8.246 8.246 8.565 -0.319 19200
2034 1 13 . 1 1 6 6 THR N N 6 119.169 119.169 119.054 0.115 19200
2035 1 13 . 1 1 6 6 THR HA H 6 4.376 4.376 4.447 -0.071 19200
2036 1 13 . 1 1 6 6 THR CA C 6 61.781 61.781 61.901 -0.120 19200
2037 1 13 . 1 1 6 6 THR CB C 6 70.908 70.908 70.485 0.423 19200
2038 1 13 . 1 1 6 6 THR H H 6 8.243 8.243 8.602 -0.359 19200
2039 1 13 . 1 1 7 7 CYS N N 7 121.405 121.405 120.987 0.418 19200
2040 1 13 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.825 -0.001 19200
2041 1 13 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.608 -4.390 19200
2042 1 13 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.664 11.461 19200
2043 1 13 . 1 1 7 7 CYS H H 7 8.656 8.656 8.425 0.231 19200
2044 1 13 . 1 1 8 8 SER N N 8 118.316 118.316 115.367 2.949 19200
2045 1 13 . 1 1 8 8 SER HA H 8 4.349 4.349 4.693 -0.344 19200
2046 1 13 . 1 1 8 8 SER CA C 8 58.967 58.967 57.680 1.287 19200
2047 1 13 . 1 1 8 8 SER CB C 8 64.571 64.571 63.736 0.835 19200
2048 1 13 . 1 1 8 8 SER H H 8 8.574 8.574 8.288 0.286 19200
2049 1 13 . 1 1 9 9 LEU N N 9 121.658 121.658 122.152 -0.494 19200
2050 1 13 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.271 -0.041 19200
2051 1 13 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.593 1.111 19200
2052 1 13 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.331 0.969 19200
2053 1 13 . 1 1 9 9 LEU H H 9 8.260 8.260 8.393 -0.133 19200
2054 1 13 . 1 1 10 10 GLY N N 10 112.236 112.236 106.742 5.494 19200
2055 1 13 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.715 0.954 19200
2056 1 13 . 1 1 10 10 GLY H H 10 9.031 9.031 8.674 0.357 19200
2057 1 13 . 1 1 11 11 TYR N N 11 121.166 121.166 119.143 2.023 19200
2058 1 13 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.390 -0.324 19200
2059 1 13 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.104 0.181 19200
2060 1 13 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.814 -0.984 19200
2061 1 13 . 1 1 11 11 TYR H H 11 8.335 8.335 7.676 0.659 19200
2062 1 13 . 1 1 12 12 PHE N N 12 121.724 121.724 118.874 2.850 19200
2063 1 13 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.191 -0.008 19200
2064 1 13 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.443 0.400 19200
2065 1 13 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.550 1.190 19200
2066 1 13 . 1 1 12 12 PHE H H 12 9.791 9.791 9.319 0.471 19200
2067 1 13 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.758 0.244 19200
2068 1 13 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.806 -0.713 19200
2069 1 13 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.273 -0.636 19200
2070 1 13 . 1 1 14 14 CYS N N 14 117.951 117.951 116.411 1.540 19200
2071 1 13 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.781 0.116 19200
2072 1 13 . 1 1 14 14 CYS CA C 14 55.375 55.375 60.311 -4.936 19200
2073 1 13 . 1 1 14 14 CYS CB C 14 42.581 42.581 29.029 13.552 19200
2074 1 13 . 1 1 14 14 CYS H H 14 8.630 8.630 8.353 0.277 19200
2075 1 13 . 1 1 15 15 GLY N N 15 108.668 108.668 106.797 1.871 19200
2076 1 13 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.471 0.264 19200
2077 1 13 . 1 1 15 15 GLY H H 15 8.372 8.372 7.985 0.387 19200
2078 1 13 . 1 1 16 16 ASN N N 16 121.627 121.627 119.746 1.881 19200
2079 1 13 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.588 -0.055 19200
2080 1 13 . 1 1 16 16 ASN CA C 16 55.543 55.543 54.998 0.545 19200
2081 1 13 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.340 0.501 19200
2082 1 13 . 1 1 16 16 ASN H H 16 9.709 9.709 8.317 1.392 19200
2083 1 13 . 1 1 17 17 ILE N N 17 119.731 119.731 118.911 0.820 19200
2084 1 13 . 1 1 17 17 ILE HA H 17 4.215 4.215 4.001 0.214 19200
2085 1 13 . 1 1 17 17 ILE CA C 17 61.465 61.465 62.463 -0.998 19200
2086 1 13 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.890 0.023 19200
2087 1 13 . 1 1 17 17 ILE H H 17 8.196 8.196 7.915 0.281 19200
2088 1 13 . 1 1 18 18 THR N N 18 117.836 117.836 109.425 8.411 19200
2089 1 13 . 1 1 18 18 THR HA H 18 3.985 3.985 4.067 -0.082 19200
2090 1 13 . 1 1 18 18 THR CA C 18 64.041 64.041 62.973 1.068 19200
2091 1 13 . 1 1 18 18 THR CB C 18 69.529 69.529 66.874 2.655 19200
2092 1 13 . 1 1 18 18 THR H H 18 7.969 7.969 7.727 0.242 19200
2093 1 13 . 1 1 19 19 LYS N N 19 124.340 124.340 120.868 3.472 19200
2094 1 13 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.028 0.440 19200
2095 1 13 . 1 1 19 19 LYS CA C 19 56.099 56.099 57.125 -1.026 19200
2096 1 13 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.347 3.508 19200
2097 1 13 . 1 1 19 19 LYS H H 19 8.271 8.271 7.841 0.430 19200
2098 1 13 . 1 1 20 20 CYS N N 20 121.675 121.675 123.960 -2.285 19200
2099 1 13 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.361 0.842 19200
2100 1 13 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.221 -2.854 19200
2101 1 13 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.906 18.512 19200
2102 1 13 . 1 1 20 20 CYS H H 20 8.543 8.543 8.368 0.175 19200
2103 1 13 . 1 1 21 21 ILE N N 21 118.395 118.395 120.757 -2.362 19200
2104 1 13 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.840 -0.150 19200
2105 1 13 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.446 0.850 19200
2106 1 13 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.723 0.131 19200
2107 1 13 . 1 1 21 21 ILE H H 21 9.070 9.070 8.843 0.227 19200
2108 1 13 . 1 1 22 22 PRO HA H 22 3.311 3.311 4.189 -0.878 19200
2109 1 13 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.780 1.311 19200
2110 1 13 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.806 0.497 19200
2111 1 13 . 1 1 23 23 GLN N N 23 120.837 120.837 124.672 -3.835 19200
2112 1 13 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.188 -0.274 19200
2113 1 13 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.744 -0.315 19200
2114 1 13 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.340 -0.111 19200
2115 1 13 . 1 1 23 23 GLN H H 23 8.285 8.285 8.124 0.161 19200
2116 1 13 . 1 1 24 24 PHE N N 24 112.558 112.558 118.108 -5.550 19200
2117 1 13 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.255 0.528 19200
2118 1 13 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.443 -2.238 19200
2119 1 13 . 1 1 24 24 PHE CB C 24 37.991 37.991 39.071 -1.080 19200
2120 1 13 . 1 1 24 24 PHE H H 24 7.218 7.218 8.243 -1.025 19200
2121 1 13 . 1 1 25 25 TRP N N 25 118.981 118.981 117.597 1.384 19200
2122 1 13 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.211 0.052 19200
2123 1 13 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.448 0.383 19200
2124 1 13 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.216 0.697 19200
2125 1 13 . 1 1 25 25 TRP H H 25 7.925 7.925 7.789 0.136 19200
2126 1 13 . 1 1 26 26 ARG N N 26 126.158 126.158 121.083 5.075 19200
2127 1 13 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.680 -0.265 19200
2128 1 13 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.966 0.999 19200
2129 1 13 . 1 1 26 26 ARG CB C 26 30.716 30.716 30.837 -0.121 19200
2130 1 13 . 1 1 26 26 ARG H H 26 8.126 8.126 8.085 0.041 19200
2131 1 13 . 1 1 27 27 CYS N N 27 123.356 123.356 121.720 1.636 19200
2132 1 13 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.471 0.369 19200
2133 1 13 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.416 -3.326 19200
2134 1 13 . 1 1 27 27 CYS CB C 27 36.380 36.380 24.658 11.722 19200
2135 1 13 . 1 1 27 27 CYS H H 27 8.927 8.927 9.025 -0.098 19200
2136 1 13 . 1 1 28 28 ASP N N 28 120.779 120.779 120.506 0.273 19200
2137 1 13 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.652 0.213 19200
2138 1 13 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.386 -1.567 19200
2139 1 13 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.299 0.890 19200
2140 1 13 . 1 1 28 28 ASP H H 28 9.642 9.642 8.528 1.114 19200
2141 1 13 . 1 1 29 29 GLY N N 29 111.028 111.028 108.237 2.791 19200
2142 1 13 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.475 1.638 19200
2143 1 13 . 1 1 29 29 GLY H H 29 9.361 9.361 7.983 1.378 19200
2144 1 13 . 1 1 30 30 GLN N N 30 118.561 118.561 119.230 -0.669 19200
2145 1 13 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.602 -0.032 19200
2146 1 13 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.491 -0.538 19200
2147 1 13 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.062 -0.809 19200
2148 1 13 . 1 1 30 30 GLN H H 30 7.513 7.513 8.229 -0.716 19200
2149 1 13 . 1 1 31 31 VAL N N 31 129.747 129.747 121.862 7.885 19200
2150 1 13 . 1 1 31 31 VAL HA H 31 3.949 3.949 4.010 -0.061 19200
2151 1 13 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.070 3.103 19200
2152 1 13 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.092 0.411 19200
2153 1 13 . 1 1 31 31 VAL H H 31 9.403 9.403 8.609 0.794 19200
2154 1 13 . 1 1 32 32 ASP N N 32 130.844 130.844 120.369 10.475 19200
2155 1 13 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.283 0.576 19200
2156 1 13 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.409 0.227 19200
2157 1 13 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.598 5.218 19200
2158 1 13 . 1 1 32 32 ASP H H 32 10.474 10.474 7.975 2.499 19200
2159 1 13 . 1 1 33 33 CYS N N 33 118.607 118.607 116.592 2.015 19200
2160 1 13 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.260 0.724 19200
2161 1 13 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.477 -6.066 19200
2162 1 13 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.801 15.329 19200
2163 1 13 . 1 1 33 33 CYS H H 33 8.231 8.231 8.474 -0.243 19200
2164 1 13 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.687 -0.404 19200
2165 1 13 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.057 1.593 19200
2166 1 13 . 1 1 34 34 ASP CB C 34 40.574 40.574 41.290 -0.716 19200
2167 1 13 . 1 1 35 35 ASN N N 35 114.357 114.357 115.586 -1.229 19200
2168 1 13 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.828 -0.032 19200
2169 1 13 . 1 1 35 35 ASN CA C 35 52.031 52.031 53.300 -1.269 19200
2170 1 13 . 1 1 35 35 ASN CB C 35 38.525 38.525 38.682 -0.157 19200
2171 1 13 . 1 1 35 35 ASN H H 35 7.842 7.842 8.297 -0.455 19200
2172 1 13 . 1 1 36 36 GLY N N 36 106.237 106.237 108.453 -2.216 19200
2173 1 13 . 1 1 36 36 GLY CA C 36 46.895 46.895 45.184 1.712 19200
2174 1 13 . 1 1 36 36 GLY H H 36 8.269 8.269 8.203 0.066 19200
2175 1 13 . 1 1 37 37 SER N N 37 115.105 115.105 115.785 -0.680 19200
2176 1 13 . 1 1 37 37 SER HA H 37 4.026 4.026 4.367 -0.341 19200
2177 1 13 . 1 1 37 37 SER CA C 37 62.619 62.619 60.301 2.318 19200
2178 1 13 . 1 1 37 37 SER CB C 37 63.494 63.494 63.162 0.332 19200
2179 1 13 . 1 1 37 37 SER H H 37 7.900 7.900 7.881 0.019 19200
2180 1 13 . 1 1 38 38 ASP N N 38 116.663 116.663 118.392 -1.729 19200
2181 1 13 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.650 -0.213 19200
2182 1 13 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.529 0.869 19200
2183 1 13 . 1 1 38 38 ASP CB C 38 41.045 41.045 40.051 0.994 19200
2184 1 13 . 1 1 38 38 ASP H H 38 9.737 9.737 8.714 1.023 19200
2185 1 13 . 1 1 39 39 GLU N N 39 116.396 116.396 118.175 -1.779 19200
2186 1 13 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.760 0.106 19200
2187 1 13 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.208 0.566 19200
2188 1 13 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.277 2.097 19200
2189 1 13 . 1 1 39 39 GLU H H 39 7.511 7.511 7.735 -0.224 19200
2190 1 13 . 1 1 40 40 GLN N N 40 119.983 119.983 118.689 1.294 19200
2191 1 13 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.408 0.127 19200
2192 1 13 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.346 0.025 19200
2193 1 13 . 1 1 40 40 GLN CB C 40 30.705 30.705 26.563 4.142 19200
2194 1 13 . 1 1 40 40 GLN H H 40 7.084 7.084 7.969 -0.885 19200
2195 1 13 . 1 1 41 41 GLY N N 41 113.322 113.322 107.421 5.901 19200
2196 1 13 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.903 2.242 19200
2197 1 13 . 1 1 41 41 GLY H H 41 8.992 8.992 8.117 0.875 19200
2198 1 14 . 1 1 5 5 VAL N N 5 122.070 122.070 126.413 -4.343 19200
2199 1 14 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.042 0.157 19200
2200 1 14 . 1 1 5 5 VAL CA C 5 62.696 62.696 63.532 -0.836 19200
2201 1 14 . 1 1 5 5 VAL CB C 5 33.858 33.858 32.268 1.590 19200
2202 1 14 . 1 1 5 5 VAL H H 5 8.246 8.246 8.190 0.056 19200
2203 1 14 . 1 1 6 6 THR N N 6 119.169 119.169 118.870 0.299 19200
2204 1 14 . 1 1 6 6 THR HA H 6 4.376 4.376 4.574 -0.198 19200
2205 1 14 . 1 1 6 6 THR CA C 6 61.781 61.781 60.638 1.143 19200
2206 1 14 . 1 1 6 6 THR CB C 6 70.908 70.908 71.808 -0.900 19200
2207 1 14 . 1 1 6 6 THR H H 6 8.243 8.243 8.338 -0.095 19200
2208 1 14 . 1 1 7 7 CYS N N 7 121.405 121.405 119.456 1.949 19200
2209 1 14 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.859 -0.035 19200
2210 1 14 . 1 1 7 7 CYS CA C 7 53.218 53.218 56.590 -3.372 19200
2211 1 14 . 1 1 7 7 CYS CB C 7 41.125 41.125 30.161 10.964 19200
2212 1 14 . 1 1 7 7 CYS H H 7 8.656 8.656 8.288 0.368 19200
2213 1 14 . 1 1 8 8 SER N N 8 118.316 118.316 115.934 2.382 19200
2214 1 14 . 1 1 8 8 SER HA H 8 4.349 4.349 4.658 -0.309 19200
2215 1 14 . 1 1 8 8 SER CA C 8 58.967 58.967 57.678 1.289 19200
2216 1 14 . 1 1 8 8 SER CB C 8 64.571 64.571 63.729 0.842 19200
2217 1 14 . 1 1 8 8 SER H H 8 8.574 8.574 8.197 0.377 19200
2218 1 14 . 1 1 9 9 LEU N N 9 121.658 121.658 121.727 -0.069 19200
2219 1 14 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.230 -0.000 19200
2220 1 14 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.689 1.015 19200
2221 1 14 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.205 1.095 19200
2222 1 14 . 1 1 9 9 LEU H H 9 8.260 8.260 8.410 -0.150 19200
2223 1 14 . 1 1 10 10 GLY N N 10 112.236 112.236 106.120 6.116 19200
2224 1 14 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.811 0.858 19200
2225 1 14 . 1 1 10 10 GLY H H 10 9.031 9.031 8.670 0.361 19200
2226 1 14 . 1 1 11 11 TYR N N 11 121.166 121.166 119.102 2.064 19200
2227 1 14 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.406 -0.340 19200
2228 1 14 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.092 0.193 19200
2229 1 14 . 1 1 11 11 TYR CB C 11 41.830 41.830 43.109 -1.279 19200
2230 1 14 . 1 1 11 11 TYR H H 11 8.335 8.335 7.670 0.665 19200
2231 1 14 . 1 1 12 12 PHE N N 12 121.724 121.724 115.886 5.838 19200
2232 1 14 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.173 0.010 19200
2233 1 14 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.563 0.280 19200
2234 1 14 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.879 0.861 19200
2235 1 14 . 1 1 12 12 PHE H H 12 9.791 9.791 9.005 0.786 19200
2236 1 14 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.679 0.323 19200
2237 1 14 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.507 -0.414 19200
2238 1 14 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.481 -0.844 19200
2239 1 14 . 1 1 14 14 CYS N N 14 117.951 117.951 117.956 -0.005 19200
2240 1 14 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.744 0.153 19200
2241 1 14 . 1 1 14 14 CYS CA C 14 55.375 55.375 60.180 -4.805 19200
2242 1 14 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.058 14.523 19200
2243 1 14 . 1 1 14 14 CYS H H 14 8.630 8.630 8.422 0.208 19200
2244 1 14 . 1 1 15 15 GLY N N 15 108.668 108.668 106.953 1.715 19200
2245 1 14 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.164 0.571 19200
2246 1 14 . 1 1 15 15 GLY H H 15 8.372 8.372 7.889 0.483 19200
2247 1 14 . 1 1 16 16 ASN N N 16 121.627 121.627 119.826 1.801 19200
2248 1 14 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.556 -0.023 19200
2249 1 14 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.433 0.110 19200
2250 1 14 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.120 0.721 19200
2251 1 14 . 1 1 16 16 ASN H H 16 9.709 9.709 8.409 1.300 19200
2252 1 14 . 1 1 17 17 ILE N N 17 119.731 119.731 117.878 1.853 19200
2253 1 14 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.999 0.216 19200
2254 1 14 . 1 1 17 17 ILE CA C 17 61.465 61.465 61.982 -0.517 19200
2255 1 14 . 1 1 17 17 ILE CB C 17 37.913 37.913 36.838 1.075 19200
2256 1 14 . 1 1 17 17 ILE H H 17 8.196 8.196 7.907 0.289 19200
2257 1 14 . 1 1 18 18 THR N N 18 117.836 117.836 109.959 7.877 19200
2258 1 14 . 1 1 18 18 THR HA H 18 3.985 3.985 3.994 -0.009 19200
2259 1 14 . 1 1 18 18 THR CA C 18 64.041 64.041 63.301 0.740 19200
2260 1 14 . 1 1 18 18 THR CB C 18 69.529 69.529 67.178 2.351 19200
2261 1 14 . 1 1 18 18 THR H H 18 7.969 7.969 7.677 0.292 19200
2262 1 14 . 1 1 19 19 LYS N N 19 124.340 124.340 121.711 2.629 19200
2263 1 14 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.061 0.407 19200
2264 1 14 . 1 1 19 19 LYS CA C 19 56.099 56.099 56.646 -0.547 19200
2265 1 14 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.418 3.437 19200
2266 1 14 . 1 1 19 19 LYS H H 19 8.271 8.271 7.754 0.517 19200
2267 1 14 . 1 1 20 20 CYS N N 20 121.675 121.675 124.580 -2.905 19200
2268 1 14 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.626 0.577 19200
2269 1 14 . 1 1 20 20 CYS CA C 20 55.367 55.367 57.916 -2.549 19200
2270 1 14 . 1 1 20 20 CYS CB C 20 44.418 44.418 26.493 17.925 19200
2271 1 14 . 1 1 20 20 CYS H H 20 8.543 8.543 8.469 0.074 19200
2272 1 14 . 1 1 21 21 ILE N N 21 118.395 118.395 119.535 -1.140 19200
2273 1 14 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.852 -0.162 19200
2274 1 14 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.406 0.890 19200
2275 1 14 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.882 -0.028 19200
2276 1 14 . 1 1 21 21 ILE H H 21 9.070 9.070 8.760 0.310 19200
2277 1 14 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.971 -0.660 19200
2278 1 14 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.492 1.599 19200
2279 1 14 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.566 0.737 19200
2280 1 14 . 1 1 23 23 GLN N N 23 120.837 120.837 124.263 -3.426 19200
2281 1 14 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.170 -0.256 19200
2282 1 14 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.588 -0.159 19200
2283 1 14 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.256 -0.027 19200
2284 1 14 . 1 1 23 23 GLN H H 23 8.285 8.285 8.168 0.117 19200
2285 1 14 . 1 1 24 24 PHE N N 24 112.558 112.558 117.646 -5.088 19200
2286 1 14 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.259 0.524 19200
2287 1 14 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.455 -2.250 19200
2288 1 14 . 1 1 24 24 PHE CB C 24 37.991 37.991 38.972 -0.981 19200
2289 1 14 . 1 1 24 24 PHE H H 24 7.218 7.218 8.182 -0.964 19200
2290 1 14 . 1 1 25 25 TRP N N 25 118.981 118.981 118.984 -0.003 19200
2291 1 14 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.207 0.056 19200
2292 1 14 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.328 0.503 19200
2293 1 14 . 1 1 25 25 TRP CB C 25 28.913 28.913 27.684 1.229 19200
2294 1 14 . 1 1 25 25 TRP H H 25 7.925 7.925 7.826 0.099 19200
2295 1 14 . 1 1 26 26 ARG N N 26 126.158 126.158 120.665 5.493 19200
2296 1 14 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.619 -0.204 19200
2297 1 14 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.623 1.343 19200
2298 1 14 . 1 1 26 26 ARG CB C 26 30.716 30.716 31.500 -0.784 19200
2299 1 14 . 1 1 26 26 ARG H H 26 8.126 8.126 7.821 0.305 19200
2300 1 14 . 1 1 27 27 CYS N N 27 123.356 123.356 121.593 1.763 19200
2301 1 14 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.473 0.367 19200
2302 1 14 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.858 -3.768 19200
2303 1 14 . 1 1 27 27 CYS CB C 27 36.380 36.380 24.993 11.387 19200
2304 1 14 . 1 1 27 27 CYS H H 27 8.927 8.927 9.054 -0.127 19200
2305 1 14 . 1 1 28 28 ASP N N 28 120.779 120.779 120.548 0.231 19200
2306 1 14 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.652 0.213 19200
2307 1 14 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.448 -1.629 19200
2308 1 14 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.381 0.808 19200
2309 1 14 . 1 1 28 28 ASP H H 28 9.642 9.642 8.542 1.100 19200
2310 1 14 . 1 1 29 29 GLY N N 29 111.028 111.028 107.859 3.169 19200
2311 1 14 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.550 1.563 19200
2312 1 14 . 1 1 29 29 GLY H H 29 9.361 9.361 7.935 1.426 19200
2313 1 14 . 1 1 30 30 GLN N N 30 118.561 118.561 118.871 -0.310 19200
2314 1 14 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.635 -0.065 19200
2315 1 14 . 1 1 30 30 GLN CA C 30 53.953 53.953 53.959 -0.006 19200
2316 1 14 . 1 1 30 30 GLN CB C 30 31.253 31.253 31.796 -0.542 19200
2317 1 14 . 1 1 30 30 GLN H H 30 7.513 7.513 7.909 -0.396 19200
2318 1 14 . 1 1 31 31 VAL N N 31 129.747 129.747 122.167 7.580 19200
2319 1 14 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.990 -0.041 19200
2320 1 14 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.698 2.475 19200
2321 1 14 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.824 -0.321 19200
2322 1 14 . 1 1 31 31 VAL H H 31 9.403 9.403 8.545 0.858 19200
2323 1 14 . 1 1 32 32 ASP N N 32 130.844 130.844 120.279 10.565 19200
2324 1 14 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.274 0.585 19200
2325 1 14 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.099 0.537 19200
2326 1 14 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.697 5.119 19200
2327 1 14 . 1 1 32 32 ASP H H 32 10.474 10.474 7.898 2.576 19200
2328 1 14 . 1 1 33 33 CYS N N 33 118.607 118.607 119.107 -0.500 19200
2329 1 14 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.380 0.604 19200
2330 1 14 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.333 -5.922 19200
2331 1 14 . 1 1 33 33 CYS CB C 33 43.130 43.130 26.742 16.388 19200
2332 1 14 . 1 1 33 33 CYS H H 33 8.231 8.231 8.131 0.100 19200
2333 1 14 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.385 -0.102 19200
2334 1 14 . 1 1 34 34 ASP CA C 34 57.651 57.651 57.063 0.588 19200
2335 1 14 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.951 -0.377 19200
2336 1 14 . 1 1 35 35 ASN N N 35 114.357 114.357 112.793 1.564 19200
2337 1 14 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.766 0.030 19200
2338 1 14 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.588 -0.557 19200
2339 1 14 . 1 1 35 35 ASN CB C 35 38.525 38.525 37.849 0.677 19200
2340 1 14 . 1 1 35 35 ASN H H 35 7.842 7.842 8.000 -0.158 19200
2341 1 14 . 1 1 36 36 GLY N N 36 106.237 106.237 108.617 -2.380 19200
2342 1 14 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.353 0.542 19200
2343 1 14 . 1 1 36 36 GLY H H 36 8.269 8.269 8.358 -0.089 19200
2344 1 14 . 1 1 37 37 SER N N 37 115.105 115.105 115.534 -0.429 19200
2345 1 14 . 1 1 37 37 SER HA H 37 4.026 4.026 4.261 -0.235 19200
2346 1 14 . 1 1 37 37 SER CA C 37 62.619 62.619 60.733 1.886 19200
2347 1 14 . 1 1 37 37 SER CB C 37 63.494 63.494 63.150 0.344 19200
2348 1 14 . 1 1 37 37 SER H H 37 7.900 7.900 7.854 0.046 19200
2349 1 14 . 1 1 38 38 ASP N N 38 116.663 116.663 118.273 -1.610 19200
2350 1 14 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.603 -0.166 19200
2351 1 14 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.200 1.198 19200
2352 1 14 . 1 1 38 38 ASP CB C 38 41.045 41.045 40.071 0.974 19200
2353 1 14 . 1 1 38 38 ASP H H 38 9.737 9.737 8.750 0.987 19200
2354 1 14 . 1 1 39 39 GLU N N 39 116.396 116.396 117.984 -1.588 19200
2355 1 14 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.723 0.143 19200
2356 1 14 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.326 0.448 19200
2357 1 14 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.557 1.817 19200
2358 1 14 . 1 1 39 39 GLU H H 39 7.511 7.511 7.746 -0.235 19200
2359 1 14 . 1 1 40 40 GLN N N 40 119.983 119.983 120.213 -0.230 19200
2360 1 14 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.462 0.073 19200
2361 1 14 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.581 -0.210 19200
2362 1 14 . 1 1 40 40 GLN CB C 40 30.705 30.705 27.581 3.124 19200
2363 1 14 . 1 1 40 40 GLN H H 40 7.084 7.084 7.937 -0.853 19200
2364 1 14 . 1 1 41 41 GLY N N 41 113.322 113.322 109.776 3.546 19200
2365 1 14 . 1 1 41 41 GLY CA C 41 47.145 47.145 45.093 2.052 19200
2366 1 14 . 1 1 41 41 GLY H H 41 8.992 8.992 8.779 0.213 19200
2367 1 15 . 1 1 5 5 VAL N N 5 122.070 122.070 122.203 -0.133 19200
2368 1 15 . 1 1 5 5 VAL HA H 5 4.199 4.199 3.769 0.430 19200
2369 1 15 . 1 1 5 5 VAL CA C 5 62.696 62.696 63.457 -0.761 19200
2370 1 15 . 1 1 5 5 VAL CB C 5 33.858 33.858 31.989 1.869 19200
2371 1 15 . 1 1 5 5 VAL H H 5 8.246 8.246 8.736 -0.490 19200
2372 1 15 . 1 1 6 6 THR N N 6 119.169 119.169 113.720 5.449 19200
2373 1 15 . 1 1 6 6 THR HA H 6 4.376 4.376 4.077 0.299 19200
2374 1 15 . 1 1 6 6 THR CA C 6 61.781 61.781 62.639 -0.858 19200
2375 1 15 . 1 1 6 6 THR CB C 6 70.908 70.908 68.749 2.159 19200
2376 1 15 . 1 1 6 6 THR H H 6 8.243 8.243 8.458 -0.215 19200
2377 1 15 . 1 1 7 7 CYS N N 7 121.405 121.405 122.413 -1.008 19200
2378 1 15 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.678 0.146 19200
2379 1 15 . 1 1 7 7 CYS CA C 7 53.218 53.218 56.910 -3.692 19200
2380 1 15 . 1 1 7 7 CYS CB C 7 41.125 41.125 30.973 10.152 19200
2381 1 15 . 1 1 7 7 CYS H H 7 8.656 8.656 8.299 0.357 19200
2382 1 15 . 1 1 8 8 SER N N 8 118.316 118.316 116.081 2.235 19200
2383 1 15 . 1 1 8 8 SER HA H 8 4.349 4.349 4.645 -0.296 19200
2384 1 15 . 1 1 8 8 SER CA C 8 58.967 58.967 57.833 1.135 19200
2385 1 15 . 1 1 8 8 SER CB C 8 64.571 64.571 63.572 0.999 19200
2386 1 15 . 1 1 8 8 SER H H 8 8.574 8.574 8.229 0.345 19200
2387 1 15 . 1 1 9 9 LEU N N 9 121.658 121.658 121.750 -0.092 19200
2388 1 15 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.229 0.001 19200
2389 1 15 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.686 1.018 19200
2390 1 15 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.200 1.100 19200
2391 1 15 . 1 1 9 9 LEU H H 9 8.260 8.260 8.403 -0.143 19200
2392 1 15 . 1 1 10 10 GLY N N 10 112.236 112.236 106.170 6.066 19200
2393 1 15 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.825 0.844 19200
2394 1 15 . 1 1 10 10 GLY H H 10 9.031 9.031 8.660 0.371 19200
2395 1 15 . 1 1 11 11 TYR N N 11 121.166 121.166 119.085 2.081 19200
2396 1 15 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.497 -0.431 19200
2397 1 15 . 1 1 11 11 TYR CA C 11 57.285 57.285 56.995 0.290 19200
2398 1 15 . 1 1 11 11 TYR CB C 11 41.830 41.830 43.245 -1.415 19200
2399 1 15 . 1 1 11 11 TYR H H 11 8.335 8.335 7.710 0.625 19200
2400 1 15 . 1 1 12 12 PHE N N 12 121.724 121.724 116.465 5.259 19200
2401 1 15 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.172 0.011 19200
2402 1 15 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.536 0.306 19200
2403 1 15 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.288 1.452 19200
2404 1 15 . 1 1 12 12 PHE H H 12 9.791 9.791 9.121 0.670 19200
2405 1 15 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.655 0.347 19200
2406 1 15 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.525 -0.432 19200
2407 1 15 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.585 -0.948 19200
2408 1 15 . 1 1 14 14 CYS N N 14 117.951 117.951 117.872 0.079 19200
2409 1 15 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.660 0.237 19200
2410 1 15 . 1 1 14 14 CYS CA C 14 55.375 55.375 59.332 -3.957 19200
2411 1 15 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.393 14.188 19200
2412 1 15 . 1 1 14 14 CYS H H 14 8.630 8.630 8.395 0.235 19200
2413 1 15 . 1 1 15 15 GLY N N 15 108.668 108.668 106.020 2.648 19200
2414 1 15 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.382 0.353 19200
2415 1 15 . 1 1 15 15 GLY H H 15 8.372 8.372 7.620 0.752 19200
2416 1 15 . 1 1 16 16 ASN N N 16 121.627 121.627 118.729 2.898 19200
2417 1 15 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.466 0.067 19200
2418 1 15 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.409 0.134 19200
2419 1 15 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.120 0.721 19200
2420 1 15 . 1 1 16 16 ASN H H 16 9.709 9.709 8.380 1.329 19200
2421 1 15 . 1 1 17 17 ILE N N 17 119.731 119.731 118.206 1.525 19200
2422 1 15 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.965 0.250 19200
2423 1 15 . 1 1 17 17 ILE CA C 17 61.465 61.465 62.874 -1.409 19200
2424 1 15 . 1 1 17 17 ILE CB C 17 37.913 37.913 38.020 -0.108 19200
2425 1 15 . 1 1 17 17 ILE H H 17 8.196 8.196 7.810 0.386 19200
2426 1 15 . 1 1 18 18 THR N N 18 117.836 117.836 107.526 10.310 19200
2427 1 15 . 1 1 18 18 THR HA H 18 3.985 3.985 4.027 -0.042 19200
2428 1 15 . 1 1 18 18 THR CA C 18 64.041 64.041 62.677 1.364 19200
2429 1 15 . 1 1 18 18 THR CB C 18 69.529 69.529 67.648 1.881 19200
2430 1 15 . 1 1 18 18 THR H H 18 7.969 7.969 7.704 0.265 19200
2431 1 15 . 1 1 19 19 LYS N N 19 124.340 124.340 120.920 3.420 19200
2432 1 15 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.071 0.397 19200
2433 1 15 . 1 1 19 19 LYS CA C 19 56.099 56.099 57.020 -0.921 19200
2434 1 15 . 1 1 19 19 LYS CB C 19 35.855 35.855 33.067 2.788 19200
2435 1 15 . 1 1 19 19 LYS H H 19 8.271 8.271 7.808 0.463 19200
2436 1 15 . 1 1 20 20 CYS N N 20 121.675 121.675 123.376 -1.701 19200
2437 1 15 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.622 0.581 19200
2438 1 15 . 1 1 20 20 CYS CA C 20 55.367 55.367 57.984 -2.617 19200
2439 1 15 . 1 1 20 20 CYS CB C 20 44.418 44.418 26.140 18.278 19200
2440 1 15 . 1 1 20 20 CYS H H 20 8.543 8.543 8.485 0.058 19200
2441 1 15 . 1 1 21 21 ILE N N 21 118.395 118.395 120.275 -1.880 19200
2442 1 15 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.876 -0.186 19200
2443 1 15 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.400 0.896 19200
2444 1 15 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.848 0.006 19200
2445 1 15 . 1 1 21 21 ILE H H 21 9.070 9.070 8.859 0.211 19200
2446 1 15 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.948 -0.637 19200
2447 1 15 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.534 1.557 19200
2448 1 15 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.605 0.698 19200
2449 1 15 . 1 1 23 23 GLN N N 23 120.837 120.837 124.510 -3.673 19200
2450 1 15 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.066 -0.152 19200
2451 1 15 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.644 -0.215 19200
2452 1 15 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.216 0.013 19200
2453 1 15 . 1 1 23 23 GLN H H 23 8.285 8.285 8.176 0.109 19200
2454 1 15 . 1 1 24 24 PHE N N 24 112.558 112.558 118.176 -5.618 19200
2455 1 15 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.268 0.515 19200
2456 1 15 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.499 -2.295 19200
2457 1 15 . 1 1 24 24 PHE CB C 24 37.991 37.991 38.956 -0.965 19200
2458 1 15 . 1 1 24 24 PHE H H 24 7.218 7.218 8.115 -0.897 19200
2459 1 15 . 1 1 25 25 TRP N N 25 118.981 118.981 117.385 1.596 19200
2460 1 15 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.126 0.137 19200
2461 1 15 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.545 0.285 19200
2462 1 15 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.153 0.760 19200
2463 1 15 . 1 1 25 25 TRP H H 25 7.925 7.925 7.838 0.087 19200
2464 1 15 . 1 1 26 26 ARG N N 26 126.158 126.158 120.256 5.902 19200
2465 1 15 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.910 -0.495 19200
2466 1 15 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.619 1.346 19200
2467 1 15 . 1 1 26 26 ARG CB C 26 30.716 30.716 31.093 -0.377 19200
2468 1 15 . 1 1 26 26 ARG H H 26 8.126 8.126 7.874 0.252 19200
2469 1 15 . 1 1 27 27 CYS N N 27 123.356 123.356 122.416 0.940 19200
2470 1 15 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.283 0.557 19200
2471 1 15 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.504 -3.414 19200
2472 1 15 . 1 1 27 27 CYS CB C 27 36.380 36.380 24.837 11.543 19200
2473 1 15 . 1 1 27 27 CYS H H 27 8.927 8.927 8.941 -0.014 19200
2474 1 15 . 1 1 28 28 ASP N N 28 120.779 120.779 120.368 0.411 19200
2475 1 15 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.665 0.200 19200
2476 1 15 . 1 1 28 28 ASP CA C 28 52.819 52.819 52.522 0.297 19200
2477 1 15 . 1 1 28 28 ASP CB C 28 42.189 42.189 40.296 1.893 19200
2478 1 15 . 1 1 28 28 ASP H H 28 9.642 9.642 8.245 1.397 19200
2479 1 15 . 1 1 29 29 GLY N N 29 111.028 111.028 109.133 1.895 19200
2480 1 15 . 1 1 29 29 GLY CA C 29 46.113 46.113 45.864 0.249 19200
2481 1 15 . 1 1 29 29 GLY H H 29 9.361 9.361 8.109 1.252 19200
2482 1 15 . 1 1 30 30 GLN N N 30 118.561 118.561 119.067 -0.506 19200
2483 1 15 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.559 0.011 19200
2484 1 15 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.016 -0.063 19200
2485 1 15 . 1 1 30 30 GLN CB C 30 31.253 31.253 30.750 0.503 19200
2486 1 15 . 1 1 30 30 GLN H H 30 7.513 7.513 8.208 -0.695 19200
2487 1 15 . 1 1 31 31 VAL N N 31 129.747 129.747 122.113 7.634 19200
2488 1 15 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.954 -0.005 19200
2489 1 15 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.530 2.643 19200
2490 1 15 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.118 0.385 19200
2491 1 15 . 1 1 31 31 VAL H H 31 9.403 9.403 8.574 0.829 19200
2492 1 15 . 1 1 32 32 ASP N N 32 130.844 130.844 119.359 11.485 19200
2493 1 15 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.263 0.596 19200
2494 1 15 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.323 0.313 19200
2495 1 15 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.402 5.414 19200
2496 1 15 . 1 1 32 32 ASP H H 32 10.474 10.474 8.245 2.229 19200
2497 1 15 . 1 1 33 33 CYS N N 33 118.607 118.607 118.295 0.312 19200
2498 1 15 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.321 0.663 19200
2499 1 15 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.074 -5.663 19200
2500 1 15 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.744 15.386 19200
2501 1 15 . 1 1 33 33 CYS H H 33 8.231 8.231 8.275 -0.044 19200
2502 1 15 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.462 -0.179 19200
2503 1 15 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.578 1.073 19200
2504 1 15 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.937 -0.363 19200
2505 1 15 . 1 1 35 35 ASN N N 35 114.357 114.357 113.553 0.804 19200
2506 1 15 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.770 0.026 19200
2507 1 15 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.816 -0.785 19200
2508 1 15 . 1 1 35 35 ASN CB C 35 38.525 38.525 38.508 0.017 19200
2509 1 15 . 1 1 35 35 ASN H H 35 7.842 7.842 8.017 -0.175 19200
2510 1 15 . 1 1 36 36 GLY N N 36 106.237 106.237 108.024 -1.787 19200
2511 1 15 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.023 0.873 19200
2512 1 15 . 1 1 36 36 GLY H H 36 8.269 8.269 8.180 0.089 19200
2513 1 15 . 1 1 37 37 SER N N 37 115.105 115.105 115.348 -0.243 19200
2514 1 15 . 1 1 37 37 SER HA H 37 4.026 4.026 4.244 -0.218 19200
2515 1 15 . 1 1 37 37 SER CA C 37 62.619 62.619 60.730 1.889 19200
2516 1 15 . 1 1 37 37 SER CB C 37 63.494 63.494 62.953 0.541 19200
2517 1 15 . 1 1 37 37 SER H H 37 7.900 7.900 7.839 0.061 19200
2518 1 15 . 1 1 38 38 ASP N N 38 116.663 116.663 119.202 -2.539 19200
2519 1 15 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.612 -0.175 19200
2520 1 15 . 1 1 38 38 ASP CA C 38 56.398 56.398 56.383 0.015 19200
2521 1 15 . 1 1 38 38 ASP CB C 38 41.045 41.045 40.924 0.121 19200
2522 1 15 . 1 1 38 38 ASP H H 38 9.737 9.737 8.744 0.993 19200
2523 1 15 . 1 1 39 39 GLU N N 39 116.396 116.396 116.535 -0.139 19200
2524 1 15 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.678 0.188 19200
2525 1 15 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.648 0.126 19200
2526 1 15 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.673 1.701 19200
2527 1 15 . 1 1 39 39 GLU H H 39 7.511 7.511 7.814 -0.303 19200
2528 1 15 . 1 1 40 40 GLN N N 40 119.983 119.983 120.187 -0.204 19200
2529 1 15 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.622 -0.087 19200
2530 1 15 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.309 0.062 19200
2531 1 15 . 1 1 40 40 GLN CB C 40 30.705 30.705 28.600 2.105 19200
2532 1 15 . 1 1 40 40 GLN H H 40 7.084 7.084 7.568 -0.484 19200
2533 1 15 . 1 1 41 41 GLY N N 41 113.322 113.322 107.840 5.482 19200
2534 1 15 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.654 2.491 19200
2535 1 15 . 1 1 41 41 GLY H H 41 8.992 8.992 8.691 0.301 19200
2536 1 16 . 1 1 5 5 VAL N N 5 122.070 122.070 122.479 -0.409 19200
2537 1 16 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.310 -0.111 19200
2538 1 16 . 1 1 5 5 VAL CA C 5 62.696 62.696 62.159 0.537 19200
2539 1 16 . 1 1 5 5 VAL CB C 5 33.858 33.858 33.260 0.598 19200
2540 1 16 . 1 1 5 5 VAL H H 5 8.246 8.246 8.019 0.227 19200
2541 1 16 . 1 1 6 6 THR N N 6 119.169 119.169 118.435 0.734 19200
2542 1 16 . 1 1 6 6 THR HA H 6 4.376 4.376 4.575 -0.199 19200
2543 1 16 . 1 1 6 6 THR CA C 6 61.781 61.781 61.267 0.514 19200
2544 1 16 . 1 1 6 6 THR CB C 6 70.908 70.908 71.613 -0.705 19200
2545 1 16 . 1 1 6 6 THR H H 6 8.243 8.243 8.345 -0.102 19200
2546 1 16 . 1 1 7 7 CYS N N 7 121.405 121.405 119.194 2.211 19200
2547 1 16 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.722 0.102 19200
2548 1 16 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.303 -4.085 19200
2549 1 16 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.150 11.975 19200
2550 1 16 . 1 1 7 7 CYS H H 7 8.656 8.656 8.361 0.295 19200
2551 1 16 . 1 1 8 8 SER N N 8 118.316 118.316 115.439 2.877 19200
2552 1 16 . 1 1 8 8 SER HA H 8 4.349 4.349 4.796 -0.447 19200
2553 1 16 . 1 1 8 8 SER CA C 8 58.967 58.967 57.465 1.502 19200
2554 1 16 . 1 1 8 8 SER CB C 8 64.571 64.571 64.006 0.565 19200
2555 1 16 . 1 1 8 8 SER H H 8 8.574 8.574 8.314 0.260 19200
2556 1 16 . 1 1 9 9 LEU N N 9 121.658 121.658 120.542 1.116 19200
2557 1 16 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.391 -0.161 19200
2558 1 16 . 1 1 9 9 LEU CA C 9 57.704 57.704 57.037 0.667 19200
2559 1 16 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.394 0.906 19200
2560 1 16 . 1 1 9 9 LEU H H 9 8.260 8.260 8.436 -0.176 19200
2561 1 16 . 1 1 10 10 GLY N N 10 112.236 112.236 105.452 6.784 19200
2562 1 16 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.702 0.967 19200
2563 1 16 . 1 1 10 10 GLY H H 10 9.031 9.031 8.331 0.700 19200
2564 1 16 . 1 1 11 11 TYR N N 11 121.166 121.166 118.604 2.562 19200
2565 1 16 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.460 -0.394 19200
2566 1 16 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.056 0.229 19200
2567 1 16 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.956 -1.126 19200
2568 1 16 . 1 1 11 11 TYR H H 11 8.335 8.335 7.483 0.852 19200
2569 1 16 . 1 1 12 12 PHE N N 12 121.724 121.724 115.398 6.326 19200
2570 1 16 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.183 0.000 19200
2571 1 16 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.389 0.454 19200
2572 1 16 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.598 1.142 19200
2573 1 16 . 1 1 12 12 PHE H H 12 9.791 9.791 9.069 0.722 19200
2574 1 16 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.672 0.330 19200
2575 1 16 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.668 -0.575 19200
2576 1 16 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.229 -0.592 19200
2577 1 16 . 1 1 14 14 CYS N N 14 117.951 117.951 117.807 0.144 19200
2578 1 16 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.707 0.190 19200
2579 1 16 . 1 1 14 14 CYS CA C 14 55.375 55.375 60.438 -5.063 19200
2580 1 16 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.788 13.793 19200
2581 1 16 . 1 1 14 14 CYS H H 14 8.630 8.630 8.518 0.112 19200
2582 1 16 . 1 1 15 15 GLY N N 15 108.668 108.668 105.707 2.961 19200
2583 1 16 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.384 0.351 19200
2584 1 16 . 1 1 15 15 GLY H H 15 8.372 8.372 7.929 0.443 19200
2585 1 16 . 1 1 16 16 ASN N N 16 121.627 121.627 119.215 2.412 19200
2586 1 16 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.462 0.071 19200
2587 1 16 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.833 -0.290 19200
2588 1 16 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.314 0.527 19200
2589 1 16 . 1 1 16 16 ASN H H 16 9.709 9.709 8.444 1.265 19200
2590 1 16 . 1 1 17 17 ILE N N 17 119.731 119.731 117.014 2.717 19200
2591 1 16 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.922 0.293 19200
2592 1 16 . 1 1 17 17 ILE CA C 17 61.465 61.465 62.581 -1.116 19200
2593 1 16 . 1 1 17 17 ILE CB C 17 37.913 37.913 36.547 1.366 19200
2594 1 16 . 1 1 17 17 ILE H H 17 8.196 8.196 8.016 0.180 19200
2595 1 16 . 1 1 18 18 THR N N 18 117.836 117.836 108.635 9.201 19200
2596 1 16 . 1 1 18 18 THR HA H 18 3.985 3.985 4.025 -0.040 19200
2597 1 16 . 1 1 18 18 THR CA C 18 64.041 64.041 63.022 1.019 19200
2598 1 16 . 1 1 18 18 THR CB C 18 69.529 69.529 67.832 1.697 19200
2599 1 16 . 1 1 18 18 THR H H 18 7.969 7.969 7.231 0.738 19200
2600 1 16 . 1 1 19 19 LYS N N 19 124.340 124.340 121.241 3.099 19200
2601 1 16 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.074 0.394 19200
2602 1 16 . 1 1 19 19 LYS CA C 19 56.099 56.099 56.850 -0.751 19200
2603 1 16 . 1 1 19 19 LYS CB C 19 35.855 35.855 33.082 2.773 19200
2604 1 16 . 1 1 19 19 LYS H H 19 8.271 8.271 7.768 0.503 19200
2605 1 16 . 1 1 20 20 CYS N N 20 121.675 121.675 123.895 -2.220 19200
2606 1 16 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.785 0.418 19200
2607 1 16 . 1 1 20 20 CYS CA C 20 55.367 55.367 57.603 -2.236 19200
2608 1 16 . 1 1 20 20 CYS CB C 20 44.418 44.418 26.403 18.015 19200
2609 1 16 . 1 1 20 20 CYS H H 20 8.543 8.543 8.365 0.178 19200
2610 1 16 . 1 1 21 21 ILE N N 21 118.395 118.395 120.410 -2.015 19200
2611 1 16 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.860 -0.170 19200
2612 1 16 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.388 0.908 19200
2613 1 16 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.741 0.113 19200
2614 1 16 . 1 1 21 21 ILE H H 21 9.070 9.070 8.812 0.258 19200
2615 1 16 . 1 1 22 22 PRO HA H 22 3.311 3.311 4.185 -0.874 19200
2616 1 16 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.607 1.484 19200
2617 1 16 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.616 0.687 19200
2618 1 16 . 1 1 23 23 GLN N N 23 120.837 120.837 124.071 -3.234 19200
2619 1 16 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.108 -0.194 19200
2620 1 16 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.494 -0.065 19200
2621 1 16 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.254 -0.025 19200
2622 1 16 . 1 1 23 23 GLN H H 23 8.285 8.285 8.185 0.100 19200
2623 1 16 . 1 1 24 24 PHE N N 24 112.558 112.558 117.655 -5.097 19200
2624 1 16 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.265 0.518 19200
2625 1 16 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.308 -2.103 19200
2626 1 16 . 1 1 24 24 PHE CB C 24 37.991 37.991 38.913 -0.923 19200
2627 1 16 . 1 1 24 24 PHE H H 24 7.218 7.218 8.271 -1.053 19200
2628 1 16 . 1 1 25 25 TRP N N 25 118.981 118.981 118.696 0.285 19200
2629 1 16 . 1 1 25 25 TRP HA H 25 5.263 5.263 4.963 0.300 19200
2630 1 16 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.467 0.364 19200
2631 1 16 . 1 1 25 25 TRP CB C 25 28.913 28.913 27.726 1.187 19200
2632 1 16 . 1 1 25 25 TRP H H 25 7.925 7.925 7.912 0.013 19200
2633 1 16 . 1 1 26 26 ARG N N 26 126.158 126.158 120.324 5.834 19200
2634 1 16 . 1 1 26 26 ARG HA H 26 4.415 4.415 5.039 -0.624 19200
2635 1 16 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.105 1.861 19200
2636 1 16 . 1 1 26 26 ARG CB C 26 30.716 30.716 31.791 -1.075 19200
2637 1 16 . 1 1 26 26 ARG H H 26 8.126 8.126 7.750 0.376 19200
2638 1 16 . 1 1 27 27 CYS N N 27 123.356 123.356 127.023 -3.667 19200
2639 1 16 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.256 0.584 19200
2640 1 16 . 1 1 27 27 CYS CA C 27 56.090 56.090 60.012 -3.922 19200
2641 1 16 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.639 10.741 19200
2642 1 16 . 1 1 27 27 CYS H H 27 8.927 8.927 9.000 -0.073 19200
2643 1 16 . 1 1 28 28 ASP N N 28 120.779 120.779 120.906 -0.127 19200
2644 1 16 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.709 0.156 19200
2645 1 16 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.229 -1.410 19200
2646 1 16 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.956 0.233 19200
2647 1 16 . 1 1 28 28 ASP H H 28 9.642 9.642 8.288 1.354 19200
2648 1 16 . 1 1 29 29 GLY N N 29 111.028 111.028 109.535 1.493 19200
2649 1 16 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.832 1.281 19200
2650 1 16 . 1 1 29 29 GLY H H 29 9.361 9.361 8.512 0.849 19200
2651 1 16 . 1 1 30 30 GLN N N 30 118.561 118.561 119.011 -0.450 19200
2652 1 16 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.649 -0.079 19200
2653 1 16 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.136 -0.183 19200
2654 1 16 . 1 1 30 30 GLN CB C 30 31.253 31.253 31.761 -0.508 19200
2655 1 16 . 1 1 30 30 GLN H H 30 7.513 7.513 8.296 -0.783 19200
2656 1 16 . 1 1 31 31 VAL N N 31 129.747 129.747 123.508 6.239 19200
2657 1 16 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.951 -0.002 19200
2658 1 16 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.953 2.220 19200
2659 1 16 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.712 -0.209 19200
2660 1 16 . 1 1 31 31 VAL H H 31 9.403 9.403 8.510 0.893 19200
2661 1 16 . 1 1 32 32 ASP N N 32 130.844 130.844 119.009 11.835 19200
2662 1 16 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.314 0.545 19200
2663 1 16 . 1 1 32 32 ASP CA C 32 56.636 56.636 55.434 1.202 19200
2664 1 16 . 1 1 32 32 ASP CB C 32 45.816 45.816 39.803 6.013 19200
2665 1 16 . 1 1 32 32 ASP H H 32 10.474 10.474 8.134 2.340 19200
2666 1 16 . 1 1 33 33 CYS N N 33 118.607 118.607 120.231 -1.624 19200
2667 1 16 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.415 0.569 19200
2668 1 16 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.022 -5.611 19200
2669 1 16 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.654 15.476 19200
2670 1 16 . 1 1 33 33 CYS H H 33 8.231 8.231 8.297 -0.066 19200
2671 1 16 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.368 -0.085 19200
2672 1 16 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.865 0.786 19200
2673 1 16 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.828 -0.254 19200
2674 1 16 . 1 1 35 35 ASN N N 35 114.357 114.357 112.615 1.742 19200
2675 1 16 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.775 0.021 19200
2676 1 16 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.570 -0.539 19200
2677 1 16 . 1 1 35 35 ASN CB C 35 38.525 38.525 37.851 0.674 19200
2678 1 16 . 1 1 35 35 ASN H H 35 7.842 7.842 8.034 -0.192 19200
2679 1 16 . 1 1 36 36 GLY N N 36 106.237 106.237 108.603 -2.366 19200
2680 1 16 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.238 0.657 19200
2681 1 16 . 1 1 36 36 GLY H H 36 8.269 8.269 7.980 0.289 19200
2682 1 16 . 1 1 37 37 SER N N 37 115.105 115.105 114.832 0.273 19200
2683 1 16 . 1 1 37 37 SER HA H 37 4.026 4.026 4.654 -0.628 19200
2684 1 16 . 1 1 37 37 SER CA C 37 62.619 62.619 59.763 2.857 19200
2685 1 16 . 1 1 37 37 SER CB C 37 63.494 63.494 62.747 0.747 19200
2686 1 16 . 1 1 37 37 SER H H 37 7.900 7.900 7.854 0.046 19200
2687 1 16 . 1 1 38 38 ASP N N 38 116.663 116.663 120.401 -3.738 19200
2688 1 16 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.741 -0.304 19200
2689 1 16 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.668 0.730 19200
2690 1 16 . 1 1 38 38 ASP CB C 38 41.045 41.045 41.366 -0.321 19200
2691 1 16 . 1 1 38 38 ASP H H 38 9.737 9.737 8.637 1.100 19200
2692 1 16 . 1 1 39 39 GLU N N 39 116.396 116.396 117.361 -0.965 19200
2693 1 16 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.685 0.181 19200
2694 1 16 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.931 -0.158 19200
2695 1 16 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.897 1.477 19200
2696 1 16 . 1 1 39 39 GLU H H 39 7.511 7.511 7.567 -0.056 19200
2697 1 16 . 1 1 40 40 GLN N N 40 119.983 119.983 118.302 1.681 19200
2698 1 16 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.586 -0.051 19200
2699 1 16 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.431 -0.061 19200
2700 1 16 . 1 1 40 40 GLN CB C 40 30.705 30.705 27.223 3.482 19200
2701 1 16 . 1 1 40 40 GLN H H 40 7.084 7.084 8.077 -0.993 19200
2702 1 16 . 1 1 41 41 GLY N N 41 113.322 113.322 107.720 5.602 19200
2703 1 16 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.827 2.318 19200
2704 1 16 . 1 1 41 41 GLY H H 41 8.992 8.992 8.593 0.399 19200
2705 1 17 . 1 1 5 5 VAL N N 5 122.070 122.070 124.768 -2.698 19200
2706 1 17 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.262 -0.063 19200
2707 1 17 . 1 1 5 5 VAL CA C 5 62.696 62.696 62.830 -0.134 19200
2708 1 17 . 1 1 5 5 VAL CB C 5 33.858 33.858 32.414 1.444 19200
2709 1 17 . 1 1 5 5 VAL H H 5 8.246 8.246 8.452 -0.206 19200
2710 1 17 . 1 1 6 6 THR N N 6 119.169 119.169 120.101 -0.932 19200
2711 1 17 . 1 1 6 6 THR HA H 6 4.376 4.376 4.609 -0.233 19200
2712 1 17 . 1 1 6 6 THR CA C 6 61.781 61.781 60.748 1.033 19200
2713 1 17 . 1 1 6 6 THR CB C 6 70.908 70.908 71.357 -0.449 19200
2714 1 17 . 1 1 6 6 THR H H 6 8.243 8.243 8.508 -0.265 19200
2715 1 17 . 1 1 7 7 CYS N N 7 121.405 121.405 118.852 2.553 19200
2716 1 17 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.763 0.061 19200
2717 1 17 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.349 -4.131 19200
2718 1 17 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.166 11.959 19200
2719 1 17 . 1 1 7 7 CYS H H 7 8.656 8.656 8.369 0.287 19200
2720 1 17 . 1 1 8 8 SER N N 8 118.316 118.316 115.346 2.970 19200
2721 1 17 . 1 1 8 8 SER HA H 8 4.349 4.349 4.734 -0.385 19200
2722 1 17 . 1 1 8 8 SER CA C 8 58.967 58.967 57.434 1.533 19200
2723 1 17 . 1 1 8 8 SER CB C 8 64.571 64.571 63.863 0.708 19200
2724 1 17 . 1 1 8 8 SER H H 8 8.574 8.574 8.303 0.271 19200
2725 1 17 . 1 1 9 9 LEU N N 9 121.658 121.658 122.209 -0.551 19200
2726 1 17 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.269 -0.039 19200
2727 1 17 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.649 1.055 19200
2728 1 17 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.327 0.973 19200
2729 1 17 . 1 1 9 9 LEU H H 9 8.260 8.260 8.469 -0.209 19200
2730 1 17 . 1 1 10 10 GLY N N 10 112.236 112.236 106.540 5.696 19200
2731 1 17 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.729 0.940 19200
2732 1 17 . 1 1 10 10 GLY H H 10 9.031 9.031 8.682 0.349 19200
2733 1 17 . 1 1 11 11 TYR N N 11 121.166 121.166 119.037 2.129 19200
2734 1 17 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.407 -0.341 19200
2735 1 17 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.236 0.049 19200
2736 1 17 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.961 -1.131 19200
2737 1 17 . 1 1 11 11 TYR H H 11 8.335 8.335 7.710 0.625 19200
2738 1 17 . 1 1 12 12 PHE N N 12 121.724 121.724 115.936 5.788 19200
2739 1 17 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.187 -0.004 19200
2740 1 17 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.346 0.497 19200
2741 1 17 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.576 1.164 19200
2742 1 17 . 1 1 12 12 PHE H H 12 9.791 9.791 9.099 0.692 19200
2743 1 17 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.652 0.350 19200
2744 1 17 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.570 -0.477 19200
2745 1 17 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.523 -0.886 19200
2746 1 17 . 1 1 14 14 CYS N N 14 117.951 117.951 118.073 -0.122 19200
2747 1 17 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.747 0.150 19200
2748 1 17 . 1 1 14 14 CYS CA C 14 55.375 55.375 60.115 -4.740 19200
2749 1 17 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.186 14.395 19200
2750 1 17 . 1 1 14 14 CYS H H 14 8.630 8.630 8.392 0.238 19200
2751 1 17 . 1 1 15 15 GLY N N 15 108.668 108.668 107.344 1.324 19200
2752 1 17 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.290 0.445 19200
2753 1 17 . 1 1 15 15 GLY H H 15 8.372 8.372 8.020 0.352 19200
2754 1 17 . 1 1 16 16 ASN N N 16 121.627 121.627 119.010 2.617 19200
2755 1 17 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.521 0.012 19200
2756 1 17 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.437 0.106 19200
2757 1 17 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.072 0.769 19200
2758 1 17 . 1 1 16 16 ASN H H 16 9.709 9.709 8.383 1.326 19200
2759 1 17 . 1 1 17 17 ILE N N 17 119.731 119.731 117.452 2.279 19200
2760 1 17 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.993 0.222 19200
2761 1 17 . 1 1 17 17 ILE CA C 17 61.465 61.465 61.572 -0.107 19200
2762 1 17 . 1 1 17 17 ILE CB C 17 37.913 37.913 36.739 1.174 19200
2763 1 17 . 1 1 17 17 ILE H H 17 8.196 8.196 7.804 0.392 19200
2764 1 17 . 1 1 18 18 THR N N 18 117.836 117.836 109.672 8.164 19200
2765 1 17 . 1 1 18 18 THR HA H 18 3.985 3.985 3.978 0.007 19200
2766 1 17 . 1 1 18 18 THR CA C 18 64.041 64.041 63.099 0.942 19200
2767 1 17 . 1 1 18 18 THR CB C 18 69.529 69.529 67.712 1.817 19200
2768 1 17 . 1 1 18 18 THR H H 18 7.969 7.969 7.593 0.376 19200
2769 1 17 . 1 1 19 19 LYS N N 19 124.340 124.340 121.205 3.135 19200
2770 1 17 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.083 0.385 19200
2771 1 17 . 1 1 19 19 LYS CA C 19 56.099 56.099 56.601 -0.502 19200
2772 1 17 . 1 1 19 19 LYS CB C 19 35.855 35.855 33.019 2.837 19200
2773 1 17 . 1 1 19 19 LYS H H 19 8.271 8.271 7.723 0.548 19200
2774 1 17 . 1 1 20 20 CYS N N 20 121.675 121.675 124.180 -2.505 19200
2775 1 17 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.748 0.455 19200
2776 1 17 . 1 1 20 20 CYS CA C 20 55.367 55.367 57.722 -2.355 19200
2777 1 17 . 1 1 20 20 CYS CB C 20 44.418 44.418 26.305 18.113 19200
2778 1 17 . 1 1 20 20 CYS H H 20 8.543 8.543 8.414 0.129 19200
2779 1 17 . 1 1 21 21 ILE N N 21 118.395 118.395 120.428 -2.033 19200
2780 1 17 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.860 -0.170 19200
2781 1 17 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.406 0.890 19200
2782 1 17 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.807 0.047 19200
2783 1 17 . 1 1 21 21 ILE H H 21 9.070 9.070 8.823 0.247 19200
2784 1 17 . 1 1 22 22 PRO HA H 22 3.311 3.311 4.294 -0.983 19200
2785 1 17 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.648 1.443 19200
2786 1 17 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.705 0.598 19200
2787 1 17 . 1 1 23 23 GLN N N 23 120.837 120.837 124.197 -3.360 19200
2788 1 17 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.079 -0.165 19200
2789 1 17 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.500 -0.071 19200
2790 1 17 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.236 -0.007 19200
2791 1 17 . 1 1 23 23 GLN H H 23 8.285 8.285 8.123 0.162 19200
2792 1 17 . 1 1 24 24 PHE N N 24 112.558 112.558 117.687 -5.129 19200
2793 1 17 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.246 0.537 19200
2794 1 17 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.390 -2.185 19200
2795 1 17 . 1 1 24 24 PHE CB C 24 37.991 37.991 39.152 -1.161 19200
2796 1 17 . 1 1 24 24 PHE H H 24 7.218 7.218 8.231 -1.013 19200
2797 1 17 . 1 1 25 25 TRP N N 25 118.981 118.981 119.092 -0.111 19200
2798 1 17 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.049 0.214 19200
2799 1 17 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.603 0.228 19200
2800 1 17 . 1 1 25 25 TRP CB C 25 28.913 28.913 27.866 1.047 19200
2801 1 17 . 1 1 25 25 TRP H H 25 7.925 7.925 7.895 0.030 19200
2802 1 17 . 1 1 26 26 ARG N N 26 126.158 126.158 120.304 5.854 19200
2803 1 17 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.959 -0.544 19200
2804 1 17 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.261 1.704 19200
2805 1 17 . 1 1 26 26 ARG CB C 26 30.716 30.716 32.074 -1.358 19200
2806 1 17 . 1 1 26 26 ARG H H 26 8.126 8.126 7.738 0.388 19200
2807 1 17 . 1 1 27 27 CYS N N 27 123.356 123.356 124.884 -1.528 19200
2808 1 17 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.285 0.555 19200
2809 1 17 . 1 1 27 27 CYS CA C 27 56.090 56.090 60.248 -4.158 19200
2810 1 17 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.502 10.878 19200
2811 1 17 . 1 1 27 27 CYS H H 27 8.927 8.927 9.147 -0.220 19200
2812 1 17 . 1 1 28 28 ASP N N 28 120.779 120.779 121.253 -0.474 19200
2813 1 17 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.635 0.230 19200
2814 1 17 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.686 -1.867 19200
2815 1 17 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.766 0.423 19200
2816 1 17 . 1 1 28 28 ASP H H 28 9.642 9.642 8.434 1.208 19200
2817 1 17 . 1 1 29 29 GLY N N 29 111.028 111.028 109.727 1.301 19200
2818 1 17 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.672 1.441 19200
2819 1 17 . 1 1 29 29 GLY H H 29 9.361 9.361 8.291 1.070 19200
2820 1 17 . 1 1 30 30 GLN N N 30 118.561 118.561 119.385 -0.824 19200
2821 1 17 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.641 -0.071 19200
2822 1 17 . 1 1 30 30 GLN CA C 30 53.953 53.953 53.751 0.202 19200
2823 1 17 . 1 1 30 30 GLN CB C 30 31.253 31.253 31.536 -0.283 19200
2824 1 17 . 1 1 30 30 GLN H H 30 7.513 7.513 8.082 -0.569 19200
2825 1 17 . 1 1 31 31 VAL N N 31 129.747 129.747 123.700 6.047 19200
2826 1 17 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.971 -0.022 19200
2827 1 17 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.873 2.300 19200
2828 1 17 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.551 -0.048 19200
2829 1 17 . 1 1 31 31 VAL H H 31 9.403 9.403 8.675 0.728 19200
2830 1 17 . 1 1 32 32 ASP N N 32 130.844 130.844 117.625 13.219 19200
2831 1 17 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.312 0.547 19200
2832 1 17 . 1 1 32 32 ASP CA C 32 56.636 56.636 55.543 1.093 19200
2833 1 17 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.195 5.621 19200
2834 1 17 . 1 1 32 32 ASP H H 32 10.474 10.474 8.067 2.407 19200
2835 1 17 . 1 1 33 33 CYS N N 33 118.607 118.607 120.098 -1.491 19200
2836 1 17 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.378 0.606 19200
2837 1 17 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.186 -5.775 19200
2838 1 17 . 1 1 33 33 CYS CB C 33 43.130 43.130 26.981 16.149 19200
2839 1 17 . 1 1 33 33 CYS H H 33 8.231 8.231 8.294 -0.063 19200
2840 1 17 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.377 -0.094 19200
2841 1 17 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.700 0.951 19200
2842 1 17 . 1 1 34 34 ASP CB C 34 40.574 40.574 41.143 -0.569 19200
2843 1 17 . 1 1 35 35 ASN N N 35 114.357 114.357 113.110 1.247 19200
2844 1 17 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.744 0.052 19200
2845 1 17 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.950 -0.919 19200
2846 1 17 . 1 1 35 35 ASN CB C 35 38.525 38.525 38.429 0.096 19200
2847 1 17 . 1 1 35 35 ASN H H 35 7.842 7.842 7.867 -0.025 19200
2848 1 17 . 1 1 36 36 GLY N N 36 106.237 106.237 108.426 -2.189 19200
2849 1 17 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.015 0.880 19200
2850 1 17 . 1 1 36 36 GLY H H 36 8.269 8.269 7.784 0.485 19200
2851 1 17 . 1 1 37 37 SER N N 37 115.105 115.105 114.899 0.206 19200
2852 1 17 . 1 1 37 37 SER HA H 37 4.026 4.026 4.578 -0.552 19200
2853 1 17 . 1 1 37 37 SER CA C 37 62.619 62.619 59.780 2.839 19200
2854 1 17 . 1 1 37 37 SER CB C 37 63.494 63.494 62.970 0.524 19200
2855 1 17 . 1 1 37 37 SER H H 37 7.900 7.900 7.911 -0.011 19200
2856 1 17 . 1 1 38 38 ASP N N 38 116.663 116.663 120.078 -3.415 19200
2857 1 17 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.725 -0.288 19200
2858 1 17 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.858 0.540 19200
2859 1 17 . 1 1 38 38 ASP CB C 38 41.045 41.045 41.310 -0.265 19200
2860 1 17 . 1 1 38 38 ASP H H 38 9.737 9.737 8.721 1.016 19200
2861 1 17 . 1 1 39 39 GLU N N 39 116.396 116.396 118.163 -1.767 19200
2862 1 17 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.659 0.207 19200
2863 1 17 . 1 1 39 39 GLU CA C 39 54.774 54.774 55.583 -0.809 19200
2864 1 17 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.725 1.649 19200
2865 1 17 . 1 1 39 39 GLU H H 39 7.511 7.511 7.610 -0.099 19200
2866 1 17 . 1 1 40 40 GLN N N 40 119.983 119.983 117.218 2.765 19200
2867 1 17 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.534 0.001 19200
2868 1 17 . 1 1 40 40 GLN CA C 40 55.371 55.371 56.335 -0.964 19200
2869 1 17 . 1 1 40 40 GLN CB C 40 30.705 30.705 29.664 1.041 19200
2870 1 17 . 1 1 40 40 GLN H H 40 7.084 7.084 8.023 -0.939 19200
2871 1 17 . 1 1 41 41 GLY N N 41 113.322 113.322 107.726 5.596 19200
2872 1 17 . 1 1 41 41 GLY CA C 41 47.145 47.145 45.195 1.950 19200
2873 1 17 . 1 1 41 41 GLY H H 41 8.992 8.992 8.563 0.429 19200
2874 1 18 . 1 1 5 5 VAL N N 5 122.070 122.070 117.514 4.556 19200
2875 1 18 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.349 -0.150 19200
2876 1 18 . 1 1 5 5 VAL CA C 5 62.696 62.696 61.347 1.349 19200
2877 1 18 . 1 1 5 5 VAL CB C 5 33.858 33.858 33.955 -0.097 19200
2878 1 18 . 1 1 5 5 VAL H H 5 8.246 8.246 7.895 0.351 19200
2879 1 18 . 1 1 6 6 THR N N 6 119.169 119.169 113.415 5.754 19200
2880 1 18 . 1 1 6 6 THR HA H 6 4.376 4.376 4.077 0.299 19200
2881 1 18 . 1 1 6 6 THR CA C 6 61.781 61.781 62.655 -0.874 19200
2882 1 18 . 1 1 6 6 THR CB C 6 70.908 70.908 68.390 2.518 19200
2883 1 18 . 1 1 6 6 THR H H 6 8.243 8.243 8.395 -0.152 19200
2884 1 18 . 1 1 7 7 CYS N N 7 121.405 121.405 121.860 -0.455 19200
2885 1 18 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.660 0.164 19200
2886 1 18 . 1 1 7 7 CYS CA C 7 53.218 53.218 56.961 -3.743 19200
2887 1 18 . 1 1 7 7 CYS CB C 7 41.125 41.125 30.920 10.205 19200
2888 1 18 . 1 1 7 7 CYS H H 7 8.656 8.656 8.300 0.356 19200
2889 1 18 . 1 1 8 8 SER N N 8 118.316 118.316 115.990 2.326 19200
2890 1 18 . 1 1 8 8 SER HA H 8 4.349 4.349 4.634 -0.285 19200
2891 1 18 . 1 1 8 8 SER CA C 8 58.967 58.967 57.862 1.105 19200
2892 1 18 . 1 1 8 8 SER CB C 8 64.571 64.571 63.464 1.107 19200
2893 1 18 . 1 1 8 8 SER H H 8 8.574 8.574 8.269 0.305 19200
2894 1 18 . 1 1 9 9 LEU N N 9 121.658 121.658 121.962 -0.304 19200
2895 1 18 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.201 0.029 19200
2896 1 18 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.909 0.795 19200
2897 1 18 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.161 1.139 19200
2898 1 18 . 1 1 9 9 LEU H H 9 8.260 8.260 8.391 -0.131 19200
2899 1 18 . 1 1 10 10 GLY N N 10 112.236 112.236 106.041 6.195 19200
2900 1 18 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.809 0.860 19200
2901 1 18 . 1 1 10 10 GLY H H 10 9.031 9.031 8.655 0.376 19200
2902 1 18 . 1 1 11 11 TYR N N 11 121.166 121.166 119.166 2.000 19200
2903 1 18 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.520 -0.454 19200
2904 1 18 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.141 0.144 19200
2905 1 18 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.885 -1.055 19200
2906 1 18 . 1 1 11 11 TYR H H 11 8.335 8.335 7.672 0.663 19200
2907 1 18 . 1 1 12 12 PHE N N 12 121.724 121.724 116.724 5.000 19200
2908 1 18 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.187 -0.004 19200
2909 1 18 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.385 0.458 19200
2910 1 18 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.813 0.927 19200
2911 1 18 . 1 1 12 12 PHE H H 12 9.791 9.791 9.206 0.585 19200
2912 1 18 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.528 0.474 19200
2913 1 18 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.407 -0.314 19200
2914 1 18 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.339 -0.702 19200
2915 1 18 . 1 1 14 14 CYS N N 14 117.951 117.951 118.224 -0.273 19200
2916 1 18 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.510 0.387 19200
2917 1 18 . 1 1 14 14 CYS CA C 14 55.375 55.375 59.594 -4.219 19200
2918 1 18 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.385 14.196 19200
2919 1 18 . 1 1 14 14 CYS H H 14 8.630 8.630 8.017 0.613 19200
2920 1 18 . 1 1 15 15 GLY N N 15 108.668 108.668 105.617 3.051 19200
2921 1 18 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.236 0.499 19200
2922 1 18 . 1 1 15 15 GLY H H 15 8.372 8.372 7.636 0.736 19200
2923 1 18 . 1 1 16 16 ASN N N 16 121.627 121.627 119.744 1.883 19200
2924 1 18 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.466 0.067 19200
2925 1 18 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.599 -0.056 19200
2926 1 18 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.074 0.767 19200
2927 1 18 . 1 1 16 16 ASN H H 16 9.709 9.709 8.684 1.025 19200
2928 1 18 . 1 1 17 17 ILE N N 17 119.731 119.731 118.156 1.575 19200
2929 1 18 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.811 0.404 19200
2930 1 18 . 1 1 17 17 ILE CA C 17 61.465 61.465 63.167 -1.702 19200
2931 1 18 . 1 1 17 17 ILE CB C 17 37.913 37.913 38.157 -0.244 19200
2932 1 18 . 1 1 17 17 ILE H H 17 8.196 8.196 7.577 0.619 19200
2933 1 18 . 1 1 18 18 THR N N 18 117.836 117.836 108.591 9.245 19200
2934 1 18 . 1 1 18 18 THR HA H 18 3.985 3.985 3.975 0.010 19200
2935 1 18 . 1 1 18 18 THR CA C 18 64.041 64.041 62.597 1.444 19200
2936 1 18 . 1 1 18 18 THR CB C 18 69.529 69.529 67.809 1.720 19200
2937 1 18 . 1 1 18 18 THR H H 18 7.969 7.969 7.602 0.367 19200
2938 1 18 . 1 1 19 19 LYS N N 19 124.340 124.340 122.044 2.296 19200
2939 1 18 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.293 0.175 19200
2940 1 18 . 1 1 19 19 LYS CA C 19 56.099 56.099 57.182 -1.083 19200
2941 1 18 . 1 1 19 19 LYS CB C 19 35.855 35.855 33.021 2.834 19200
2942 1 18 . 1 1 19 19 LYS H H 19 8.271 8.271 7.777 0.494 19200
2943 1 18 . 1 1 20 20 CYS N N 20 121.675 121.675 124.205 -2.530 19200
2944 1 18 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.666 0.537 19200
2945 1 18 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.112 -2.745 19200
2946 1 18 . 1 1 20 20 CYS CB C 20 44.418 44.418 26.608 17.810 19200
2947 1 18 . 1 1 20 20 CYS H H 20 8.543 8.543 8.440 0.103 19200
2948 1 18 . 1 1 21 21 ILE N N 21 118.395 118.395 118.677 -0.282 19200
2949 1 18 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.832 -0.142 19200
2950 1 18 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.539 0.757 19200
2951 1 18 . 1 1 21 21 ILE CB C 21 39.854 39.854 40.053 -0.199 19200
2952 1 18 . 1 1 21 21 ILE H H 21 9.070 9.070 8.874 0.196 19200
2953 1 18 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.908 -0.597 19200
2954 1 18 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.640 1.451 19200
2955 1 18 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.589 0.714 19200
2956 1 18 . 1 1 23 23 GLN N N 23 120.837 120.837 124.961 -4.124 19200
2957 1 18 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.105 -0.191 19200
2958 1 18 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.806 -0.377 19200
2959 1 18 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.312 -0.083 19200
2960 1 18 . 1 1 23 23 GLN H H 23 8.285 8.285 8.180 0.105 19200
2961 1 18 . 1 1 24 24 PHE N N 24 112.558 112.558 118.710 -6.152 19200
2962 1 18 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.251 0.532 19200
2963 1 18 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.215 -2.010 19200
2964 1 18 . 1 1 24 24 PHE CB C 24 37.991 37.991 39.055 -1.064 19200
2965 1 18 . 1 1 24 24 PHE H H 24 7.218 7.218 8.215 -0.997 19200
2966 1 18 . 1 1 25 25 TRP N N 25 118.981 118.981 117.599 1.382 19200
2967 1 18 . 1 1 25 25 TRP HA H 25 5.263 5.263 4.878 0.385 19200
2968 1 18 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.115 0.716 19200
2969 1 18 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.614 0.299 19200
2970 1 18 . 1 1 25 25 TRP H H 25 7.925 7.925 7.864 0.061 19200
2971 1 18 . 1 1 26 26 ARG N N 26 126.158 126.158 120.551 5.607 19200
2972 1 18 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.654 -0.239 19200
2973 1 18 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.596 1.369 19200
2974 1 18 . 1 1 26 26 ARG CB C 26 30.716 30.716 32.038 -1.322 19200
2975 1 18 . 1 1 26 26 ARG H H 26 8.126 8.126 7.994 0.132 19200
2976 1 18 . 1 1 27 27 CYS N N 27 123.356 123.356 122.510 0.846 19200
2977 1 18 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.281 0.559 19200
2978 1 18 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.886 -3.796 19200
2979 1 18 . 1 1 27 27 CYS CB C 27 36.380 36.380 24.864 11.516 19200
2980 1 18 . 1 1 27 27 CYS H H 27 8.927 8.927 9.063 -0.136 19200
2981 1 18 . 1 1 28 28 ASP N N 28 120.779 120.779 121.143 -0.364 19200
2982 1 18 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.567 0.298 19200
2983 1 18 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.578 -1.760 19200
2984 1 18 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.333 0.856 19200
2985 1 18 . 1 1 28 28 ASP H H 28 9.642 9.642 8.471 1.171 19200
2986 1 18 . 1 1 29 29 GLY N N 29 111.028 111.028 109.173 1.855 19200
2987 1 18 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.747 1.366 19200
2988 1 18 . 1 1 29 29 GLY H H 29 9.361 9.361 8.173 1.188 19200
2989 1 18 . 1 1 30 30 GLN N N 30 118.561 118.561 118.699 -0.138 19200
2990 1 18 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.603 -0.033 19200
2991 1 18 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.322 -0.369 19200
2992 1 18 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.076 -0.823 19200
2993 1 18 . 1 1 30 30 GLN H H 30 7.513 7.513 8.464 -0.951 19200
2994 1 18 . 1 1 31 31 VAL N N 31 129.747 129.747 123.291 6.456 19200
2995 1 18 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.985 -0.035 19200
2996 1 18 . 1 1 31 31 VAL CA C 31 65.173 65.173 63.004 2.169 19200
2997 1 18 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.553 -0.050 19200
2998 1 18 . 1 1 31 31 VAL H H 31 9.403 9.403 8.624 0.779 19200
2999 1 18 . 1 1 32 32 ASP N N 32 130.844 130.844 119.988 10.856 19200
3000 1 18 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.245 0.614 19200
3001 1 18 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.319 0.317 19200
3002 1 18 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.474 5.342 19200
3003 1 18 . 1 1 32 32 ASP H H 32 10.474 10.474 8.020 2.454 19200
3004 1 18 . 1 1 33 33 CYS N N 33 118.607 118.607 116.400 2.207 19200
3005 1 18 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.254 0.730 19200
3006 1 18 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.674 -6.263 19200
3007 1 18 . 1 1 33 33 CYS CB C 33 43.130 43.130 28.001 15.129 19200
3008 1 18 . 1 1 33 33 CYS H H 33 8.231 8.231 8.175 0.056 19200
3009 1 18 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.782 -0.499 19200
3010 1 18 . 1 1 34 34 ASP CA C 34 57.651 57.651 55.284 2.367 19200
3011 1 18 . 1 1 34 34 ASP CB C 34 40.574 40.574 41.008 -0.434 19200
3012 1 18 . 1 1 35 35 ASN N N 35 114.357 114.357 116.674 -2.317 19200
3013 1 18 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.782 0.014 19200
3014 1 18 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.436 -0.405 19200
3015 1 18 . 1 1 35 35 ASN CB C 35 38.525 38.525 39.212 -0.687 19200
3016 1 18 . 1 1 35 35 ASN H H 35 7.842 7.842 7.994 -0.152 19200
3017 1 18 . 1 1 36 36 GLY N N 36 106.237 106.237 108.675 -2.438 19200
3018 1 18 . 1 1 36 36 GLY CA C 36 46.895 46.895 45.961 0.934 19200
3019 1 18 . 1 1 36 36 GLY H H 36 8.269 8.269 8.292 -0.023 19200
3020 1 18 . 1 1 37 37 SER N N 37 115.105 115.105 113.737 1.368 19200
3021 1 18 . 1 1 37 37 SER HA H 37 4.026 4.026 4.436 -0.410 19200
3022 1 18 . 1 1 37 37 SER CA C 37 62.619 62.619 58.895 3.724 19200
3023 1 18 . 1 1 37 37 SER CB C 37 63.494 63.494 63.838 -0.344 19200
3024 1 18 . 1 1 37 37 SER H H 37 7.900 7.900 7.889 0.011 19200
3025 1 18 . 1 1 38 38 ASP N N 38 116.663 116.663 120.383 -3.720 19200
3026 1 18 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.623 -0.186 19200
3027 1 18 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.792 0.606 19200
3028 1 18 . 1 1 38 38 ASP CB C 38 41.045 41.045 40.580 0.465 19200
3029 1 18 . 1 1 38 38 ASP H H 38 9.737 9.737 8.666 1.071 19200
3030 1 18 . 1 1 39 39 GLU N N 39 116.396 116.396 116.522 -0.126 19200
3031 1 18 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.597 0.269 19200
3032 1 18 . 1 1 39 39 GLU CA C 39 54.774 54.774 55.000 -0.226 19200
3033 1 18 . 1 1 39 39 GLU CB C 39 30.374 30.374 27.777 2.597 19200
3034 1 18 . 1 1 39 39 GLU H H 39 7.511 7.511 8.676 -1.165 19200
3035 1 18 . 1 1 40 40 GLN N N 40 119.983 119.983 118.453 1.530 19200
3036 1 18 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.485 0.050 19200
3037 1 18 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.233 0.138 19200
3038 1 18 . 1 1 40 40 GLN CB C 40 30.705 30.705 26.848 3.857 19200
3039 1 18 . 1 1 40 40 GLN H H 40 7.084 7.084 7.978 -0.894 19200
3040 1 18 . 1 1 41 41 GLY N N 41 113.322 113.322 107.057 6.265 19200
3041 1 18 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.525 2.620 19200
3042 1 18 . 1 1 41 41 GLY H H 41 8.992 8.992 8.290 0.702 19200
3043 1 19 . 1 1 5 5 VAL N N 5 122.070 122.070 119.665 2.405 19200
3044 1 19 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.232 -0.033 19200
3045 1 19 . 1 1 5 5 VAL CA C 5 62.696 62.696 61.554 1.142 19200
3046 1 19 . 1 1 5 5 VAL CB C 5 33.858 33.858 33.480 0.378 19200
3047 1 19 . 1 1 5 5 VAL H H 5 8.246 8.246 7.562 0.684 19200
3048 1 19 . 1 1 6 6 THR N N 6 119.169 119.169 116.233 2.936 19200
3049 1 19 . 1 1 6 6 THR HA H 6 4.376 4.376 4.317 0.058 19200
3050 1 19 . 1 1 6 6 THR CA C 6 61.781 61.781 62.512 -0.731 19200
3051 1 19 . 1 1 6 6 THR CB C 6 70.908 70.908 68.605 2.303 19200
3052 1 19 . 1 1 6 6 THR H H 6 8.243 8.243 8.538 -0.295 19200
3053 1 19 . 1 1 7 7 CYS N N 7 121.405 121.405 119.548 1.857 19200
3054 1 19 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.461 0.363 19200
3055 1 19 . 1 1 7 7 CYS CA C 7 53.218 53.218 58.086 -4.868 19200
3056 1 19 . 1 1 7 7 CYS CB C 7 41.125 41.125 27.751 13.374 19200
3057 1 19 . 1 1 7 7 CYS H H 7 8.656 8.656 7.891 0.764 19200
3058 1 19 . 1 1 8 8 SER N N 8 118.316 118.316 114.352 3.964 19200
3059 1 19 . 1 1 8 8 SER HA H 8 4.349 4.349 4.579 -0.230 19200
3060 1 19 . 1 1 8 8 SER CA C 8 58.967 58.967 57.891 1.076 19200
3061 1 19 . 1 1 8 8 SER CB C 8 64.571 64.571 63.674 0.897 19200
3062 1 19 . 1 1 8 8 SER H H 8 8.574 8.574 8.190 0.384 19200
3063 1 19 . 1 1 9 9 LEU N N 9 121.658 121.658 121.930 -0.272 19200
3064 1 19 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.309 -0.079 19200
3065 1 19 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.672 1.032 19200
3066 1 19 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.605 0.695 19200
3067 1 19 . 1 1 9 9 LEU H H 9 8.260 8.260 8.321 -0.061 19200
3068 1 19 . 1 1 10 10 GLY N N 10 112.236 112.236 106.432 5.804 19200
3069 1 19 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.817 0.852 19200
3070 1 19 . 1 1 10 10 GLY H H 10 9.031 9.031 8.659 0.372 19200
3071 1 19 . 1 1 11 11 TYR N N 11 121.166 121.166 119.148 2.018 19200
3072 1 19 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.517 -0.451 19200
3073 1 19 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.008 0.277 19200
3074 1 19 . 1 1 11 11 TYR CB C 11 41.830 41.830 43.139 -1.309 19200
3075 1 19 . 1 1 11 11 TYR H H 11 8.335 8.335 7.696 0.639 19200
3076 1 19 . 1 1 12 12 PHE N N 12 121.724 121.724 117.281 4.443 19200
3077 1 19 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.185 -0.002 19200
3078 1 19 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.627 0.216 19200
3079 1 19 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.469 1.271 19200
3080 1 19 . 1 1 12 12 PHE H H 12 9.791 9.791 9.101 0.690 19200
3081 1 19 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.724 0.278 19200
3082 1 19 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.600 -0.507 19200
3083 1 19 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.457 -0.820 19200
3084 1 19 . 1 1 14 14 CYS N N 14 117.951 117.951 117.215 0.736 19200
3085 1 19 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.776 0.121 19200
3086 1 19 . 1 1 14 14 CYS CA C 14 55.375 55.375 58.895 -3.520 19200
3087 1 19 . 1 1 14 14 CYS CB C 14 42.581 42.581 29.275 13.306 19200
3088 1 19 . 1 1 14 14 CYS H H 14 8.630 8.630 8.460 0.170 19200
3089 1 19 . 1 1 15 15 GLY N N 15 108.668 108.668 106.306 2.362 19200
3090 1 19 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.486 0.249 19200
3091 1 19 . 1 1 15 15 GLY H H 15 8.372 8.372 8.112 0.260 19200
3092 1 19 . 1 1 16 16 ASN N N 16 121.627 121.627 119.004 2.623 19200
3093 1 19 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.606 -0.073 19200
3094 1 19 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.249 0.294 19200
3095 1 19 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.381 0.460 19200
3096 1 19 . 1 1 16 16 ASN H H 16 9.709 9.709 8.536 1.173 19200
3097 1 19 . 1 1 17 17 ILE N N 17 119.731 119.731 118.690 1.041 19200
3098 1 19 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.936 0.279 19200
3099 1 19 . 1 1 17 17 ILE CA C 17 61.465 61.465 62.232 -0.767 19200
3100 1 19 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.612 0.301 19200
3101 1 19 . 1 1 17 17 ILE H H 17 8.196 8.196 7.906 0.290 19200
3102 1 19 . 1 1 18 18 THR N N 18 117.836 117.836 108.457 9.379 19200
3103 1 19 . 1 1 18 18 THR HA H 18 3.985 3.985 3.891 0.094 19200
3104 1 19 . 1 1 18 18 THR CA C 18 64.041 64.041 62.740 1.301 19200
3105 1 19 . 1 1 18 18 THR CB C 18 69.529 69.529 66.884 2.645 19200
3106 1 19 . 1 1 18 18 THR H H 18 7.969 7.969 7.789 0.180 19200
3107 1 19 . 1 1 19 19 LYS N N 19 124.340 124.340 121.508 2.832 19200
3108 1 19 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.071 0.397 19200
3109 1 19 . 1 1 19 19 LYS CA C 19 56.099 56.099 57.532 -1.433 19200
3110 1 19 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.946 2.909 19200
3111 1 19 . 1 1 19 19 LYS H H 19 8.271 8.271 7.845 0.426 19200
3112 1 19 . 1 1 20 20 CYS N N 20 121.675 121.675 123.150 -1.475 19200
3113 1 19 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.518 0.685 19200
3114 1 19 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.147 -2.780 19200
3115 1 19 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.936 18.482 19200
3116 1 19 . 1 1 20 20 CYS H H 20 8.543 8.543 8.537 0.006 19200
3117 1 19 . 1 1 21 21 ILE N N 21 118.395 118.395 120.612 -2.217 19200
3118 1 19 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.865 -0.175 19200
3119 1 19 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.397 0.899 19200
3120 1 19 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.827 0.028 19200
3121 1 19 . 1 1 21 21 ILE H H 21 9.070 9.070 8.859 0.211 19200
3122 1 19 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.947 -0.636 19200
3123 1 19 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.567 1.524 19200
3124 1 19 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.588 0.715 19200
3125 1 19 . 1 1 23 23 GLN N N 23 120.837 120.837 124.755 -3.918 19200
3126 1 19 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.173 -0.259 19200
3127 1 19 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.758 -0.329 19200
3128 1 19 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.369 -0.140 19200
3129 1 19 . 1 1 23 23 GLN H H 23 8.285 8.285 8.148 0.137 19200
3130 1 19 . 1 1 24 24 PHE N N 24 112.558 112.558 117.901 -5.343 19200
3131 1 19 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.268 0.515 19200
3132 1 19 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.517 -2.312 19200
3133 1 19 . 1 1 24 24 PHE CB C 24 37.991 37.991 38.901 -0.910 19200
3134 1 19 . 1 1 24 24 PHE H H 24 7.218 7.218 8.270 -1.052 19200
3135 1 19 . 1 1 25 25 TRP N N 25 118.981 118.981 117.507 1.474 19200
3136 1 19 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.178 0.085 19200
3137 1 19 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.507 0.324 19200
3138 1 19 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.227 0.686 19200
3139 1 19 . 1 1 25 25 TRP H H 25 7.925 7.925 7.839 0.086 19200
3140 1 19 . 1 1 26 26 ARG N N 26 126.158 126.158 120.417 5.741 19200
3141 1 19 . 1 1 26 26 ARG HA H 26 4.415 4.415 5.019 -0.604 19200
3142 1 19 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.614 1.351 19200
3143 1 19 . 1 1 26 26 ARG CB C 26 30.716 30.716 30.824 -0.108 19200
3144 1 19 . 1 1 26 26 ARG H H 26 8.126 8.126 7.857 0.269 19200
3145 1 19 . 1 1 27 27 CYS N N 27 123.356 123.356 123.060 0.296 19200
3146 1 19 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.498 0.342 19200
3147 1 19 . 1 1 27 27 CYS CA C 27 56.090 56.090 60.037 -3.947 19200
3148 1 19 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.282 11.098 19200
3149 1 19 . 1 1 27 27 CYS H H 27 8.927 8.927 9.096 -0.169 19200
3150 1 19 . 1 1 28 28 ASP N N 28 120.779 120.779 120.214 0.565 19200
3151 1 19 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.680 0.185 19200
3152 1 19 . 1 1 28 28 ASP CA C 28 52.819 52.819 52.479 0.340 19200
3153 1 19 . 1 1 28 28 ASP CB C 28 42.189 42.189 40.058 2.131 19200
3154 1 19 . 1 1 28 28 ASP H H 28 9.642 9.642 8.101 1.541 19200
3155 1 19 . 1 1 29 29 GLY N N 29 111.028 111.028 108.792 2.236 19200
3156 1 19 . 1 1 29 29 GLY CA C 29 46.113 46.113 45.992 0.121 19200
3157 1 19 . 1 1 29 29 GLY H H 29 9.361 9.361 8.185 1.176 19200
3158 1 19 . 1 1 30 30 GLN N N 30 118.561 118.561 118.785 -0.224 19200
3159 1 19 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.514 0.056 19200
3160 1 19 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.273 -0.320 19200
3161 1 19 . 1 1 30 30 GLN CB C 30 31.253 31.253 30.914 0.339 19200
3162 1 19 . 1 1 30 30 GLN H H 30 7.513 7.513 8.225 -0.712 19200
3163 1 19 . 1 1 31 31 VAL N N 31 129.747 129.747 122.188 7.559 19200
3164 1 19 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.924 0.025 19200
3165 1 19 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.671 2.502 19200
3166 1 19 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.087 0.416 19200
3167 1 19 . 1 1 31 31 VAL H H 31 9.403 9.403 8.626 0.777 19200
3168 1 19 . 1 1 32 32 ASP N N 32 130.844 130.844 119.558 11.286 19200
3169 1 19 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.268 0.591 19200
3170 1 19 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.306 0.330 19200
3171 1 19 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.374 5.441 19200
3172 1 19 . 1 1 32 32 ASP H H 32 10.474 10.474 8.249 2.225 19200
3173 1 19 . 1 1 33 33 CYS N N 33 118.607 118.607 118.322 0.285 19200
3174 1 19 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.351 0.633 19200
3175 1 19 . 1 1 33 33 CYS CA C 33 54.411 54.411 59.910 -5.499 19200
3176 1 19 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.871 15.259 19200
3177 1 19 . 1 1 33 33 CYS H H 33 8.231 8.231 8.252 -0.021 19200
3178 1 19 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.332 -0.049 19200
3179 1 19 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.738 0.913 19200
3180 1 19 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.783 -0.209 19200
3181 1 19 . 1 1 35 35 ASN N N 35 114.357 114.357 113.007 1.350 19200
3182 1 19 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.781 0.015 19200
3183 1 19 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.185 -0.155 19200
3184 1 19 . 1 1 35 35 ASN CB C 35 38.525 38.525 37.767 0.758 19200
3185 1 19 . 1 1 35 35 ASN H H 35 7.842 7.842 8.104 -0.262 19200
3186 1 19 . 1 1 36 36 GLY N N 36 106.237 106.237 108.414 -2.177 19200
3187 1 19 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.406 0.489 19200
3188 1 19 . 1 1 36 36 GLY H H 36 8.269 8.269 7.971 0.298 19200
3189 1 19 . 1 1 37 37 SER N N 37 115.105 115.105 114.847 0.258 19200
3190 1 19 . 1 1 37 37 SER HA H 37 4.026 4.026 4.294 -0.268 19200
3191 1 19 . 1 1 37 37 SER CA C 37 62.619 62.619 59.767 2.852 19200
3192 1 19 . 1 1 37 37 SER CB C 37 63.494 63.494 63.494 -0.000 19200
3193 1 19 . 1 1 37 37 SER H H 37 7.900 7.900 7.820 0.080 19200
3194 1 19 . 1 1 38 38 ASP N N 38 116.663 116.663 119.640 -2.977 19200
3195 1 19 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.630 -0.193 19200
3196 1 19 . 1 1 38 38 ASP CA C 38 56.398 56.398 56.120 0.278 19200
3197 1 19 . 1 1 38 38 ASP CB C 38 41.045 41.045 40.943 0.102 19200
3198 1 19 . 1 1 38 38 ASP H H 38 9.737 9.737 8.855 0.882 19200
3199 1 19 . 1 1 39 39 GLU N N 39 116.396 116.396 117.677 -1.281 19200
3200 1 19 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.639 0.227 19200
3201 1 19 . 1 1 39 39 GLU CA C 39 54.774 54.774 55.106 -0.332 19200
3202 1 19 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.121 2.253 19200
3203 1 19 . 1 1 39 39 GLU H H 39 7.511 7.511 7.632 -0.121 19200
3204 1 19 . 1 1 40 40 GLN N N 40 119.983 119.983 118.165 1.818 19200
3205 1 19 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.505 0.030 19200
3206 1 19 . 1 1 40 40 GLN CA C 40 55.371 55.371 56.330 -0.959 19200
3207 1 19 . 1 1 40 40 GLN CB C 40 30.705 30.705 29.335 1.370 19200
3208 1 19 . 1 1 40 40 GLN H H 40 7.084 7.084 7.835 -0.751 19200
3209 1 19 . 1 1 41 41 GLY N N 41 113.322 113.322 107.387 5.935 19200
3210 1 19 . 1 1 41 41 GLY CA C 41 47.145 47.145 45.240 1.905 19200
3211 1 19 . 1 1 41 41 GLY H H 41 8.992 8.992 8.631 0.361 19200
3212 1 20 . 1 1 5 5 VAL N N 5 122.070 122.070 119.241 2.829 19200
3213 1 20 . 1 1 5 5 VAL HA H 5 4.199 4.199 3.705 0.494 19200
3214 1 20 . 1 1 5 5 VAL CA C 5 62.696 62.696 63.440 -0.744 19200
3215 1 20 . 1 1 5 5 VAL CB C 5 33.858 33.858 31.601 2.257 19200
3216 1 20 . 1 1 5 5 VAL H H 5 8.246 8.246 8.090 0.156 19200
3217 1 20 . 1 1 6 6 THR N N 6 119.169 119.169 118.860 0.309 19200
3218 1 20 . 1 1 6 6 THR HA H 6 4.376 4.376 4.692 -0.316 19200
3219 1 20 . 1 1 6 6 THR CA C 6 61.781 61.781 61.392 0.390 19200
3220 1 20 . 1 1 6 6 THR CB C 6 70.908 70.908 70.732 0.176 19200
3221 1 20 . 1 1 6 6 THR H H 6 8.243 8.243 8.399 -0.156 19200
3222 1 20 . 1 1 7 7 CYS N N 7 121.405 121.405 124.129 -2.724 19200
3223 1 20 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.879 -0.055 19200
3224 1 20 . 1 1 7 7 CYS CA C 7 53.218 53.218 58.025 -4.807 19200
3225 1 20 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.678 11.447 19200
3226 1 20 . 1 1 7 7 CYS H H 7 8.656 8.656 8.563 0.093 19200
3227 1 20 . 1 1 8 8 SER N N 8 118.316 118.316 114.977 3.339 19200
3228 1 20 . 1 1 8 8 SER HA H 8 4.349 4.349 4.779 -0.430 19200
3229 1 20 . 1 1 8 8 SER CA C 8 58.967 58.967 57.779 1.188 19200
3230 1 20 . 1 1 8 8 SER CB C 8 64.571 64.571 63.862 0.709 19200
3231 1 20 . 1 1 8 8 SER H H 8 8.574 8.574 8.162 0.412 19200
3232 1 20 . 1 1 9 9 LEU N N 9 121.658 121.658 118.965 2.693 19200
3233 1 20 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.694 -0.464 19200
3234 1 20 . 1 1 9 9 LEU CA C 9 57.704 57.704 55.902 1.802 19200
3235 1 20 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.659 0.641 19200
3236 1 20 . 1 1 9 9 LEU H H 9 8.260 8.260 8.383 -0.123 19200
3237 1 20 . 1 1 10 10 GLY N N 10 112.236 112.236 106.036 6.200 19200
3238 1 20 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.938 0.731 19200
3239 1 20 . 1 1 10 10 GLY H H 10 9.031 9.031 8.383 0.648 19200
3240 1 20 . 1 1 11 11 TYR N N 11 121.166 121.166 118.537 2.629 19200
3241 1 20 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.630 -0.564 19200
3242 1 20 . 1 1 11 11 TYR CA C 11 57.285 57.285 56.698 0.587 19200
3243 1 20 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.880 -1.050 19200
3244 1 20 . 1 1 11 11 TYR H H 11 8.335 8.335 7.435 0.900 19200
3245 1 20 . 1 1 12 12 PHE N N 12 121.724 121.724 114.953 6.771 19200
3246 1 20 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.173 0.010 19200
3247 1 20 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.546 0.297 19200
3248 1 20 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.499 1.241 19200
3249 1 20 . 1 1 12 12 PHE H H 12 9.791 9.791 9.106 0.685 19200
3250 1 20 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.668 0.334 19200
3251 1 20 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.608 -0.515 19200
3252 1 20 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.401 -0.764 19200
3253 1 20 . 1 1 14 14 CYS N N 14 117.951 117.951 118.643 -0.692 19200
3254 1 20 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.693 0.204 19200
3255 1 20 . 1 1 14 14 CYS CA C 14 55.375 55.375 60.547 -5.172 19200
3256 1 20 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.273 14.308 19200
3257 1 20 . 1 1 14 14 CYS H H 14 8.630 8.630 8.344 0.286 19200
3258 1 20 . 1 1 15 15 GLY N N 15 108.668 108.668 106.666 2.002 19200
3259 1 20 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.267 0.468 19200
3260 1 20 . 1 1 15 15 GLY H H 15 8.372 8.372 7.914 0.458 19200
3261 1 20 . 1 1 16 16 ASN N N 16 121.627 121.627 118.865 2.762 19200
3262 1 20 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.460 0.073 19200
3263 1 20 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.313 0.230 19200
3264 1 20 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.041 0.800 19200
3265 1 20 . 1 1 16 16 ASN H H 16 9.709 9.709 8.402 1.307 19200
3266 1 20 . 1 1 17 17 ILE N N 17 119.731 119.731 119.259 0.472 19200
3267 1 20 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.911 0.304 19200
3268 1 20 . 1 1 17 17 ILE CA C 17 61.465 61.465 62.871 -1.406 19200
3269 1 20 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.831 0.082 19200
3270 1 20 . 1 1 17 17 ILE H H 17 8.196 8.196 7.859 0.337 19200
3271 1 20 . 1 1 18 18 THR N N 18 117.836 117.836 109.778 8.058 19200
3272 1 20 . 1 1 18 18 THR HA H 18 3.985 3.985 4.070 -0.085 19200
3273 1 20 . 1 1 18 18 THR CA C 18 64.041 64.041 62.645 1.396 19200
3274 1 20 . 1 1 18 18 THR CB C 18 69.529 69.529 67.904 1.625 19200
3275 1 20 . 1 1 18 18 THR H H 18 7.969 7.969 7.677 0.292 19200
3276 1 20 . 1 1 19 19 LYS N N 19 124.340 124.340 121.201 3.139 19200
3277 1 20 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.092 0.376 19200
3278 1 20 . 1 1 19 19 LYS CA C 19 56.099 56.099 56.795 -0.696 19200
3279 1 20 . 1 1 19 19 LYS CB C 19 35.855 35.855 33.180 2.675 19200
3280 1 20 . 1 1 19 19 LYS H H 19 8.271 8.271 7.680 0.591 19200
3281 1 20 . 1 1 20 20 CYS N N 20 121.675 121.675 124.314 -2.639 19200
3282 1 20 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.448 0.755 19200
3283 1 20 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.397 -3.030 19200
3284 1 20 . 1 1 20 20 CYS CB C 20 44.418 44.418 25.485 18.933 19200
3285 1 20 . 1 1 20 20 CYS H H 20 8.543 8.543 8.600 -0.057 19200
3286 1 20 . 1 1 21 21 ILE N N 21 118.395 118.395 121.515 -3.120 19200
3287 1 20 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.854 -0.164 19200
3288 1 20 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.501 0.795 19200
3289 1 20 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.248 0.606 19200
3290 1 20 . 1 1 21 21 ILE H H 21 9.070 9.070 8.880 0.190 19200
3291 1 20 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.961 -0.650 19200
3292 1 20 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.832 1.259 19200
3293 1 20 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.688 0.615 19200
3294 1 20 . 1 1 23 23 GLN N N 23 120.837 120.837 124.713 -3.876 19200
3295 1 20 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.111 -0.197 19200
3296 1 20 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.707 -0.278 19200
3297 1 20 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.320 -0.091 19200
3298 1 20 . 1 1 23 23 GLN H H 23 8.285 8.285 8.390 -0.105 19200
3299 1 20 . 1 1 24 24 PHE N N 24 112.558 112.558 117.890 -5.332 19200
3300 1 20 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.256 0.527 19200
3301 1 20 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.395 -2.190 19200
3302 1 20 . 1 1 24 24 PHE CB C 24 37.991 37.991 39.107 -1.116 19200
3303 1 20 . 1 1 24 24 PHE H H 24 7.218 7.218 8.213 -0.995 19200
3304 1 20 . 1 1 25 25 TRP N N 25 118.981 118.981 117.519 1.462 19200
3305 1 20 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.007 0.256 19200
3306 1 20 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.725 0.106 19200
3307 1 20 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.291 0.622 19200
3308 1 20 . 1 1 25 25 TRP H H 25 7.925 7.925 7.871 0.054 19200
3309 1 20 . 1 1 26 26 ARG N N 26 126.158 126.158 120.613 5.545 19200
3310 1 20 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.613 -0.198 19200
3311 1 20 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.281 1.684 19200
3312 1 20 . 1 1 26 26 ARG CB C 26 30.716 30.716 31.851 -1.135 19200
3313 1 20 . 1 1 26 26 ARG H H 26 8.126 8.126 7.909 0.217 19200
3314 1 20 . 1 1 27 27 CYS N N 27 123.356 123.356 125.040 -1.684 19200
3315 1 20 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.281 0.559 19200
3316 1 20 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.895 -3.805 19200
3317 1 20 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.447 10.933 19200
3318 1 20 . 1 1 27 27 CYS H H 27 8.927 8.927 9.247 -0.320 19200
3319 1 20 . 1 1 28 28 ASP N N 28 120.779 120.779 121.606 -0.827 19200
3320 1 20 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.665 0.200 19200
3321 1 20 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.347 -1.528 19200
3322 1 20 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.472 0.716 19200
3323 1 20 . 1 1 28 28 ASP H H 28 9.642 9.642 8.531 1.111 19200
3324 1 20 . 1 1 29 29 GLY N N 29 111.028 111.028 108.731 2.297 19200
3325 1 20 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.463 1.650 19200
3326 1 20 . 1 1 29 29 GLY H H 29 9.361 9.361 8.136 1.226 19200
3327 1 20 . 1 1 30 30 GLN N N 30 118.561 118.561 118.937 -0.376 19200
3328 1 20 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.593 -0.023 19200
3329 1 20 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.643 -0.690 19200
3330 1 20 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.694 -1.442 19200
3331 1 20 . 1 1 30 30 GLN H H 30 7.513 7.513 8.173 -0.660 19200
3332 1 20 . 1 1 31 31 VAL N N 31 129.747 129.747 121.551 8.196 19200
3333 1 20 . 1 1 31 31 VAL HA H 31 3.949 3.949 4.018 -0.069 19200
3334 1 20 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.236 2.937 19200
3335 1 20 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.498 0.005 19200
3336 1 20 . 1 1 31 31 VAL H H 31 9.403 9.403 8.485 0.918 19200
3337 1 20 . 1 1 32 32 ASP N N 32 130.844 130.844 120.630 10.214 19200
3338 1 20 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.218 0.641 19200
3339 1 20 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.474 0.162 19200
3340 1 20 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.399 5.417 19200
3341 1 20 . 1 1 32 32 ASP H H 32 10.474 10.474 7.946 2.528 19200
3342 1 20 . 1 1 33 33 CYS N N 33 118.607 118.607 118.642 -0.035 19200
3343 1 20 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.281 0.703 19200
3344 1 20 . 1 1 33 33 CYS CA C 33 54.411 54.411 59.819 -5.408 19200
3345 1 20 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.373 15.757 19200
3346 1 20 . 1 1 33 33 CYS H H 33 8.231 8.231 8.569 -0.338 19200
3347 1 20 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.383 -0.100 19200
3348 1 20 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.964 0.687 19200
3349 1 20 . 1 1 34 34 ASP CB C 34 40.574 40.574 41.006 -0.432 19200
3350 1 20 . 1 1 35 35 ASN N N 35 114.357 114.357 112.931 1.426 19200
3351 1 20 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.779 0.017 19200
3352 1 20 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.403 -0.372 19200
3353 1 20 . 1 1 35 35 ASN CB C 35 38.525 38.525 37.800 0.726 19200
3354 1 20 . 1 1 35 35 ASN H H 35 7.842 7.842 7.921 -0.079 19200
3355 1 20 . 1 1 36 36 GLY N N 36 106.237 106.237 108.692 -2.455 19200
3356 1 20 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.391 0.504 19200
3357 1 20 . 1 1 36 36 GLY H H 36 8.269 8.269 8.253 0.016 19200
3358 1 20 . 1 1 37 37 SER N N 37 115.105 115.105 114.975 0.130 19200
3359 1 20 . 1 1 37 37 SER HA H 37 4.026 4.026 4.204 -0.178 19200
3360 1 20 . 1 1 37 37 SER CA C 37 62.619 62.619 60.801 1.818 19200
3361 1 20 . 1 1 37 37 SER CB C 37 63.494 63.494 63.395 0.099 19200
3362 1 20 . 1 1 37 37 SER H H 37 7.900 7.900 7.774 0.126 19200
3363 1 20 . 1 1 38 38 ASP N N 38 116.663 116.663 117.753 -1.090 19200
3364 1 20 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.512 -0.075 19200
3365 1 20 . 1 1 38 38 ASP CA C 38 56.398 56.398 56.200 0.198 19200
3366 1 20 . 1 1 38 38 ASP CB C 38 41.045 41.045 39.739 1.306 19200
3367 1 20 . 1 1 38 38 ASP H H 38 9.737 9.737 8.874 0.863 19200
3368 1 20 . 1 1 39 39 GLU N N 39 116.396 116.396 118.002 -1.606 19200
3369 1 20 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.647 0.219 19200
3370 1 20 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.801 -0.027 19200
3371 1 20 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.349 2.025 19200
3372 1 20 . 1 1 39 39 GLU H H 39 7.511 7.511 7.663 -0.152 19200
3373 1 20 . 1 1 40 40 GLN N N 40 119.983 119.983 119.558 0.425 19200
3374 1 20 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.581 -0.046 19200
3375 1 20 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.692 -0.321 19200
3376 1 20 . 1 1 40 40 GLN CB C 40 30.705 30.705 29.026 1.679 19200
3377 1 20 . 1 1 40 40 GLN H H 40 7.084 7.084 8.106 -1.022 19200
3378 1 20 . 1 1 41 41 GLY N N 41 113.322 113.322 107.472 5.850 19200
3379 1 20 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.645 2.500 19200
3380 1 20 . 1 1 41 41 GLY H H 41 8.992 8.992 8.460 0.532 19200
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 34 3.882 -1.439 3.660 19200
2 1 1 "Average Difference" HA 42 0.319 -0.047 0.320 19200
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19200
4 1 1 "Average Difference" CA 37 1.949 0.270 1.957 19200
5 1 1 "Average Difference" CB 32 5.868 -2.799 5.240 19200
6 1 1 "Average Difference" HN 34 0.681 -0.315 0.613 19200
7 1 2 "Average Difference" N 34 3.895 -1.674 3.570 19200
8 1 2 "Average Difference" HA 42 0.330 -0.060 0.329 19200
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19200
10 1 2 "Average Difference" CA 37 1.951 0.275 1.958 19200
11 1 2 "Average Difference" CB 32 5.808 -2.790 5.176 19200
12 1 2 "Average Difference" HN 34 0.707 -0.289 0.655 19200
13 1 3 "Average Difference" N 34 3.681 -1.660 3.335 19200
14 1 3 "Average Difference" HA 42 0.326 -0.085 0.319 19200
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19200
16 1 3 "Average Difference" CA 37 1.883 0.220 1.896 19200
17 1 3 "Average Difference" CB 32 5.869 -2.798 5.241 19200
18 1 3 "Average Difference" HN 34 0.690 -0.330 0.615 19200
19 1 4 "Average Difference" N 34 3.901 -1.539 3.638 19200
20 1 4 "Average Difference" HA 42 0.331 -0.041 0.333 19200
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19200
22 1 4 "Average Difference" CA 37 1.975 0.206 1.991 19200
23 1 4 "Average Difference" CB 32 5.873 -2.740 5.278 19200
24 1 4 "Average Difference" HN 34 0.674 -0.329 0.597 19200
25 1 5 "Average Difference" N 34 4.191 -1.808 3.838 19200
26 1 5 "Average Difference" HA 42 0.336 -0.035 0.338 19200
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19200
28 1 5 "Average Difference" CA 37 1.747 0.278 1.748 19200
29 1 5 "Average Difference" CB 32 5.916 -2.795 5.298 19200
30 1 5 "Average Difference" HN 34 0.727 -0.307 0.668 19200
31 1 6 "Average Difference" N 34 3.917 -1.584 3.636 19200
32 1 6 "Average Difference" HA 42 0.352 -0.033 0.355 19200
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19200
34 1 6 "Average Difference" CA 37 1.823 0.165 1.841 19200
35 1 6 "Average Difference" CB 32 5.827 -2.899 5.135 19200
36 1 6 "Average Difference" HN 34 0.730 -0.331 0.660 19200
37 1 7 "Average Difference" N 34 3.797 -1.687 3.453 19200
38 1 7 "Average Difference" HA 42 0.321 -0.064 0.318 19200
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19200
40 1 7 "Average Difference" CA 37 1.892 0.194 1.908 19200
41 1 7 "Average Difference" CB 32 5.752 -2.742 5.138 19200
42 1 7 "Average Difference" HN 34 0.734 -0.339 0.660 19200
43 1 8 "Average Difference" N 34 3.844 -1.383 3.641 19200
44 1 8 "Average Difference" HA 42 0.336 -0.043 0.337 19200
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19200
46 1 8 "Average Difference" CA 37 1.886 0.142 1.907 19200
47 1 8 "Average Difference" CB 32 5.928 -2.874 5.267 19200
48 1 8 "Average Difference" HN 34 0.730 -0.336 0.658 19200
49 1 9 "Average Difference" N 34 4.072 -1.479 3.851 19200
50 1 9 "Average Difference" HA 42 0.365 -0.002 0.369 19200
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19200
52 1 9 "Average Difference" CA 37 2.028 0.100 2.053 19200
53 1 9 "Average Difference" CB 32 5.823 -2.681 5.251 19200
54 1 9 "Average Difference" HN 34 0.712 -0.307 0.653 19200
55 1 10 "Average Difference" N 34 3.755 -1.451 3.515 19200
56 1 10 "Average Difference" HA 42 0.357 -0.049 0.358 19200
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19200
58 1 10 "Average Difference" CA 37 1.920 0.164 1.939 19200
59 1 10 "Average Difference" CB 32 5.889 -2.770 5.280 19200
60 1 10 "Average Difference" HN 34 0.681 -0.304 0.618 19200
61 1 11 "Average Difference" N 34 3.809 -1.744 3.437 19200
62 1 11 "Average Difference" HA 42 0.334 -0.071 0.331 19200
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19200
64 1 11 "Average Difference" CA 37 1.874 0.222 1.886 19200
65 1 11 "Average Difference" CB 32 5.902 -2.837 5.258 19200
66 1 11 "Average Difference" HN 34 0.702 -0.331 0.628 19200
67 1 12 "Average Difference" N 34 4.002 -1.799 3.628 19200
68 1 12 "Average Difference" HA 42 0.370 -0.039 0.372 19200
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19200
70 1 12 "Average Difference" CA 37 2.039 0.231 2.054 19200
71 1 12 "Average Difference" CB 32 5.845 -2.709 5.263 19200
72 1 12 "Average Difference" HN 34 0.705 -0.277 0.658 19200
73 1 13 "Average Difference" N 34 3.704 -1.368 3.494 19200
74 1 13 "Average Difference" HA 42 0.350 -0.047 0.351 19200
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19200
76 1 13 "Average Difference" CA 37 2.014 0.184 2.033 19200
77 1 13 "Average Difference" CB 32 5.895 -2.919 5.204 19200
78 1 13 "Average Difference" HN 34 0.733 -0.267 0.693 19200
79 1 14 "Average Difference" N 34 3.714 -1.306 3.529 19200
80 1 14 "Average Difference" HA 42 0.304 -0.052 0.303 19200
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19200
82 1 14 "Average Difference" CA 37 1.873 0.155 1.892 19200
83 1 14 "Average Difference" CB 32 5.926 -2.872 5.266 19200
84 1 14 "Average Difference" HN 34 0.721 -0.319 0.657 19200
85 1 15 "Average Difference" N 34 4.076 -1.733 3.744 19200
86 1 15 "Average Difference" HA 42 0.341 -0.072 0.337 19200
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19200
88 1 15 "Average Difference" CA 37 1.796 0.203 1.810 19200
89 1 15 "Average Difference" CB 32 5.806 -2.891 5.116 19200
90 1 15 "Average Difference" HN 34 0.694 -0.300 0.636 19200
91 1 16 "Average Difference" N 34 4.054 -1.536 3.809 19200
92 1 16 "Average Difference" HA 42 0.358 -0.027 0.362 19200
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19200
94 1 16 "Average Difference" CA 37 1.935 0.142 1.956 19200
95 1 16 "Average Difference" CB 32 5.827 -2.764 5.212 19200
96 1 16 "Average Difference" HN 34 0.726 -0.323 0.660 19200
97 1 17 "Average Difference" N 34 4.005 -1.287 3.850 19200
98 1 17 "Average Difference" HA 42 0.348 -0.020 0.351 19200
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19200
100 1 17 "Average Difference" CA 37 1.959 0.166 1.979 19200
101 1 17 "Average Difference" CB 32 5.913 -2.727 5.331 19200
102 1 17 "Average Difference" HN 34 0.702 -0.298 0.645 19200
103 1 18 "Average Difference" N 34 4.077 -1.736 3.744 19200
104 1 18 "Average Difference" HA 42 0.359 -0.076 0.355 19200
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19200
106 1 18 "Average Difference" CA 37 2.026 0.128 2.050 19200
107 1 18 "Average Difference" CB 32 5.765 -2.715 5.167 19200
108 1 18 "Average Difference" HN 34 0.753 -0.292 0.704 19200
109 1 19 "Average Difference" N 34 3.960 -1.803 3.578 19200
110 1 19 "Average Difference" HA 42 0.341 -0.049 0.342 19200
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19200
112 1 19 "Average Difference" CA 37 1.877 0.221 1.890 19200
113 1 19 "Average Difference" CB 32 5.926 -2.941 5.227 19200
114 1 19 "Average Difference" HN 34 0.704 -0.313 0.640 19200
115 1 20 "Average Difference" N 34 3.956 -1.479 3.724 19200
116 1 20 "Average Difference" HA 42 0.369 -0.051 0.370 19200
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19200
118 1 20 "Average Difference" CA 37 2.005 0.259 2.015 19200
119 1 20 "Average Difference" CB 32 5.934 -2.793 5.319 19200
120 1 20 "Average Difference" HN 34 0.734 -0.292 0.683 19200
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 19200
_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 5 5 VAL N N 5 122.070 122.070 120.505 1.565 19200
2 1 . 1 1 5 5 VAL HA H 5 4.199 4.199 4.076 0.123 19200
3 1 . 1 1 5 5 VAL CA C 5 62.696 62.696 62.824 -0.128 19200
4 1 . 1 1 5 5 VAL CB C 5 33.858 33.858 32.350 1.508 19200
5 1 . 1 1 5 5 VAL H H 5 8.246 8.246 8.089 0.157 19200
6 1 . 1 1 6 6 THR N N 6 119.169 119.169 117.831 1.338 19200
7 1 . 1 1 6 6 THR HA H 6 4.376 4.376 4.533 -0.157 19200
8 1 . 1 1 6 6 THR CA C 6 61.781 61.781 61.474 0.307 19200
9 1 . 1 1 6 6 THR CB C 6 70.908 70.908 70.724 0.184 19200
10 1 . 1 1 6 6 THR H H 6 8.243 8.243 8.311 -0.068 19200
11 1 . 1 1 7 7 CYS N N 7 121.405 121.405 120.729 0.676 19200
12 1 . 1 1 7 7 CYS HA H 7 4.824 4.824 4.773 0.051 19200
13 1 . 1 1 7 7 CYS CA C 7 53.218 53.218 57.390 -4.172 19200
14 1 . 1 1 7 7 CYS CB C 7 41.125 41.125 29.778 11.347 19200
15 1 . 1 1 7 7 CYS H H 7 8.656 8.656 8.348 0.307 19200
16 1 . 1 1 8 8 SER N N 8 118.316 118.316 115.522 2.794 19200
17 1 . 1 1 8 8 SER HA H 8 4.349 4.349 4.690 -0.341 19200
18 1 . 1 1 8 8 SER CA C 8 58.967 58.967 57.677 1.290 19200
19 1 . 1 1 8 8 SER CB C 8 64.571 64.571 63.715 0.856 19200
20 1 . 1 1 8 8 SER H H 8 8.574 8.574 8.239 0.335 19200
21 1 . 1 1 9 9 LEU N N 9 121.658 121.658 121.434 0.224 19200
22 1 . 1 1 9 9 LEU HA H 9 4.230 4.230 4.322 -0.092 19200
23 1 . 1 1 9 9 LEU CA C 9 57.704 57.704 56.662 1.042 19200
24 1 . 1 1 9 9 LEU CB C 9 42.300 42.300 41.376 0.925 19200
25 1 . 1 1 9 9 LEU H H 9 8.260 8.260 8.391 -0.131 19200
26 1 . 1 1 10 10 GLY N N 10 112.236 112.236 106.249 5.987 19200
27 1 . 1 1 10 10 GLY CA C 10 45.669 45.669 44.787 0.882 19200
28 1 . 1 1 10 10 GLY H H 10 9.031 9.031 8.595 0.436 19200
29 1 . 1 1 11 11 TYR N N 11 121.166 121.166 119.005 2.161 19200
30 1 . 1 1 11 11 TYR HA H 11 5.066 5.066 5.497 -0.431 19200
31 1 . 1 1 11 11 TYR CA C 11 57.285 57.285 57.024 0.261 19200
32 1 . 1 1 11 11 TYR CB C 11 41.830 41.830 42.967 -1.137 19200
33 1 . 1 1 11 11 TYR H H 11 8.335 8.335 7.628 0.707 19200
34 1 . 1 1 12 12 PHE N N 12 121.724 121.724 116.580 5.144 19200
35 1 . 1 1 12 12 PHE HA H 12 5.183 5.183 5.181 0.002 19200
36 1 . 1 1 12 12 PHE CA C 12 54.843 54.843 54.481 0.362 19200
37 1 . 1 1 12 12 PHE CB C 12 41.740 41.740 40.580 1.160 19200
38 1 . 1 1 12 12 PHE H H 12 9.791 9.791 9.146 0.645 19200
39 1 . 1 1 13 13 PRO HA H 13 5.002 5.002 4.683 0.319 19200
40 1 . 1 1 13 13 PRO CA C 13 62.093 62.093 62.569 -0.476 19200
41 1 . 1 1 13 13 PRO CB C 13 32.637 32.637 33.529 -0.892 19200
42 1 . 1 1 14 14 CYS N N 14 117.951 117.951 117.443 0.508 19200
43 1 . 1 1 14 14 CYS HA H 14 4.897 4.897 4.707 0.190 19200
44 1 . 1 1 14 14 CYS CA C 14 55.375 55.375 59.694 -4.319 19200
45 1 . 1 1 14 14 CYS CB C 14 42.581 42.581 28.640 13.941 19200
46 1 . 1 1 14 14 CYS H H 14 8.630 8.630 8.340 0.290 19200
47 1 . 1 1 15 15 GLY N N 15 108.668 108.668 106.171 2.497 19200
48 1 . 1 1 15 15 GLY CA C 15 45.735 45.735 45.347 0.388 19200
49 1 . 1 1 15 15 GLY H H 15 8.372 8.372 7.823 0.549 19200
50 1 . 1 1 16 16 ASN N N 16 121.627 121.627 119.265 2.362 19200
51 1 . 1 1 16 16 ASN HA H 16 4.533 4.533 4.486 0.047 19200
52 1 . 1 1 16 16 ASN CA C 16 55.543 55.543 55.558 -0.015 19200
53 1 . 1 1 16 16 ASN CB C 16 38.841 38.841 38.171 0.670 19200
54 1 . 1 1 16 16 ASN H H 16 9.709 9.709 8.482 1.227 19200
55 1 . 1 1 17 17 ILE N N 17 119.731 119.731 118.142 1.589 19200
56 1 . 1 1 17 17 ILE HA H 17 4.215 4.215 3.944 0.271 19200
57 1 . 1 1 17 17 ILE CA C 17 61.465 61.465 62.575 -1.110 19200
58 1 . 1 1 17 17 ILE CB C 17 37.913 37.913 37.498 0.414 19200
59 1 . 1 1 17 17 ILE H H 17 8.196 8.196 7.891 0.305 19200
60 1 . 1 1 18 18 THR N N 18 117.836 117.836 109.232 8.604 19200
61 1 . 1 1 18 18 THR HA H 18 3.985 3.985 4.022 -0.037 19200
62 1 . 1 1 18 18 THR CA C 18 64.041 64.041 62.889 1.152 19200
63 1 . 1 1 18 18 THR CB C 18 69.529 69.529 67.397 2.132 19200
64 1 . 1 1 18 18 THR H H 18 7.969 7.969 7.608 0.361 19200
65 1 . 1 1 19 19 LYS N N 19 124.340 124.340 121.356 2.984 19200
66 1 . 1 1 19 19 LYS HA H 19 4.468 4.468 4.077 0.391 19200
67 1 . 1 1 19 19 LYS CA C 19 56.099 56.099 56.981 -0.882 19200
68 1 . 1 1 19 19 LYS CB C 19 35.855 35.855 32.858 2.997 19200
69 1 . 1 1 19 19 LYS H H 19 8.271 8.271 7.819 0.452 19200
70 1 . 1 1 20 20 CYS N N 20 121.675 121.675 123.883 -2.208 19200
71 1 . 1 1 20 20 CYS HA H 20 5.203 5.203 4.541 0.662 19200
72 1 . 1 1 20 20 CYS CA C 20 55.367 55.367 58.042 -2.675 19200
73 1 . 1 1 20 20 CYS CB C 20 44.418 44.418 26.020 18.398 19200
74 1 . 1 1 20 20 CYS H H 20 8.543 8.543 8.427 0.116 19200
75 1 . 1 1 21 21 ILE N N 21 118.395 118.395 120.463 -2.068 19200
76 1 . 1 1 21 21 ILE HA H 21 4.690 4.690 4.857 -0.167 19200
77 1 . 1 1 21 21 ILE CA C 21 58.296 58.296 57.421 0.875 19200
78 1 . 1 1 21 21 ILE CB C 21 39.854 39.854 39.748 0.106 19200
79 1 . 1 1 21 21 ILE H H 21 9.070 9.070 8.850 0.220 19200
80 1 . 1 1 22 22 PRO HA H 22 3.311 3.311 3.932 -0.621 19200
81 1 . 1 1 22 22 PRO CA C 22 63.091 63.091 61.632 1.459 19200
82 1 . 1 1 22 22 PRO CB C 22 32.303 32.303 31.626 0.677 19200
83 1 . 1 1 23 23 GLN N N 23 120.837 120.837 124.551 -3.714 19200
84 1 . 1 1 23 23 GLN HA H 23 3.914 3.914 4.135 -0.221 19200
85 1 . 1 1 23 23 GLN CA C 23 59.429 59.429 59.675 -0.246 19200
86 1 . 1 1 23 23 GLN CB C 23 28.229 28.229 28.298 -0.069 19200
87 1 . 1 1 23 23 GLN H H 23 8.285 8.285 8.236 0.049 19200
88 1 . 1 1 24 24 PHE N N 24 112.558 112.558 118.030 -5.472 19200
89 1 . 1 1 24 24 PHE HA H 24 4.783 4.783 4.262 0.521 19200
90 1 . 1 1 24 24 PHE CA C 24 58.205 58.205 60.395 -2.190 19200
91 1 . 1 1 24 24 PHE CB C 24 37.991 37.991 38.992 -1.001 19200
92 1 . 1 1 24 24 PHE H H 24 7.218 7.218 8.211 -0.993 19200
93 1 . 1 1 25 25 TRP N N 25 118.981 118.981 117.981 1.000 19200
94 1 . 1 1 25 25 TRP HA H 25 5.263 5.263 5.050 0.213 19200
95 1 . 1 1 25 25 TRP CA C 25 55.831 55.831 55.542 0.289 19200
96 1 . 1 1 25 25 TRP CB C 25 28.913 28.913 28.146 0.767 19200
97 1 . 1 1 25 25 TRP H H 25 7.925 7.925 7.863 0.062 19200
98 1 . 1 1 26 26 ARG N N 26 126.158 126.158 120.539 5.619 19200
99 1 . 1 1 26 26 ARG HA H 26 4.415 4.415 4.717 -0.302 19200
100 1 . 1 1 26 26 ARG CA C 26 56.965 56.965 55.540 1.425 19200
101 1 . 1 1 26 26 ARG CB C 26 30.716 30.716 31.642 -0.926 19200
102 1 . 1 1 26 26 ARG H H 26 8.126 8.126 7.914 0.212 19200
103 1 . 1 1 27 27 CYS N N 27 123.356 123.356 123.623 -0.267 19200
104 1 . 1 1 27 27 CYS HA H 27 4.840 4.840 4.340 0.500 19200
105 1 . 1 1 27 27 CYS CA C 27 56.090 56.090 59.794 -3.704 19200
106 1 . 1 1 27 27 CYS CB C 27 36.380 36.380 25.128 11.252 19200
107 1 . 1 1 27 27 CYS H H 27 8.927 8.927 9.102 -0.175 19200
108 1 . 1 1 28 28 ASP N N 28 120.779 120.779 121.018 -0.239 19200
109 1 . 1 1 28 28 ASP HA H 28 4.865 4.865 4.664 0.201 19200
110 1 . 1 1 28 28 ASP CA C 28 52.819 52.819 54.185 -1.366 19200
111 1 . 1 1 28 28 ASP CB C 28 42.189 42.189 41.379 0.810 19200
112 1 . 1 1 28 28 ASP H H 28 9.642 9.642 8.443 1.199 19200
113 1 . 1 1 29 29 GLY N N 29 111.028 111.028 109.018 2.010 19200
114 1 . 1 1 29 29 GLY CA C 29 46.113 46.113 44.841 1.272 19200
115 1 . 1 1 29 29 GLY H H 29 9.361 9.361 8.131 1.230 19200
116 1 . 1 1 30 30 GLN N N 30 118.561 118.561 119.038 -0.477 19200
117 1 . 1 1 30 30 GLN HA H 30 4.570 4.570 4.604 -0.034 19200
118 1 . 1 1 30 30 GLN CA C 30 53.953 53.953 54.295 -0.342 19200
119 1 . 1 1 30 30 GLN CB C 30 31.253 31.253 32.023 -0.770 19200
120 1 . 1 1 30 30 GLN H H 30 7.513 7.513 8.132 -0.619 19200
121 1 . 1 1 31 31 VAL N N 31 129.747 129.747 122.338 7.409 19200
122 1 . 1 1 31 31 VAL HA H 31 3.949 3.949 3.987 -0.038 19200
123 1 . 1 1 31 31 VAL CA C 31 65.173 65.173 62.524 2.649 19200
124 1 . 1 1 31 31 VAL CB C 31 31.503 31.503 31.389 0.114 19200
125 1 . 1 1 31 31 VAL H H 31 9.403 9.403 8.586 0.817 19200
126 1 . 1 1 32 32 ASP N N 32 130.844 130.844 119.783 11.061 19200
127 1 . 1 1 32 32 ASP HA H 32 4.859 4.859 4.263 0.596 19200
128 1 . 1 1 32 32 ASP CA C 32 56.636 56.636 56.171 0.465 19200
129 1 . 1 1 32 32 ASP CB C 32 45.816 45.816 40.348 5.468 19200
130 1 . 1 1 32 32 ASP H H 32 10.474 10.474 8.035 2.439 19200
131 1 . 1 1 33 33 CYS N N 33 118.607 118.607 118.039 0.568 19200
132 1 . 1 1 33 33 CYS HA H 33 4.984 4.984 4.297 0.687 19200
133 1 . 1 1 33 33 CYS CA C 33 54.411 54.411 60.212 -5.801 19200
134 1 . 1 1 33 33 CYS CB C 33 43.130 43.130 27.624 15.506 19200
135 1 . 1 1 33 33 CYS H H 33 8.231 8.231 8.168 0.063 19200
136 1 . 1 1 34 34 ASP HA H 34 4.283 4.283 4.499 -0.216 19200
137 1 . 1 1 34 34 ASP CA C 34 57.651 57.651 56.573 1.078 19200
138 1 . 1 1 34 34 ASP CB C 34 40.574 40.574 40.980 -0.406 19200
139 1 . 1 1 35 35 ASN N N 35 114.357 114.357 113.952 0.405 19200
140 1 . 1 1 35 35 ASN HA H 35 4.796 4.796 4.788 0.008 19200
141 1 . 1 1 35 35 ASN CA C 35 52.031 52.031 52.659 -0.629 19200
142 1 . 1 1 35 35 ASN CB C 35 38.525 38.525 38.210 0.315 19200
143 1 . 1 1 35 35 ASN H H 35 7.842 7.842 8.022 -0.180 19200
144 1 . 1 1 36 36 GLY N N 36 106.237 106.237 108.380 -2.143 19200
145 1 . 1 1 36 36 GLY CA C 36 46.895 46.895 46.086 0.809 19200
146 1 . 1 1 36 36 GLY H H 36 8.269 8.269 8.154 0.115 19200
147 1 . 1 1 37 37 SER N N 37 115.105 115.105 114.962 0.143 19200
148 1 . 1 1 37 37 SER HA H 37 4.026 4.026 4.362 -0.336 19200
149 1 . 1 1 37 37 SER CA C 37 62.619 62.619 60.255 2.364 19200
150 1 . 1 1 37 37 SER CB C 37 63.494 63.494 63.277 0.217 19200
151 1 . 1 1 37 37 SER H H 37 7.900 7.900 7.868 0.032 19200
152 1 . 1 1 38 38 ASP N N 38 116.663 116.663 118.490 -1.827 19200
153 1 . 1 1 38 38 ASP HA H 38 4.437 4.437 4.605 -0.168 19200
154 1 . 1 1 38 38 ASP CA C 38 56.398 56.398 55.743 0.655 19200
155 1 . 1 1 38 38 ASP CB C 38 41.045 41.045 40.248 0.797 19200
156 1 . 1 1 38 38 ASP H H 38 9.737 9.737 8.766 0.971 19200
157 1 . 1 1 39 39 GLU N N 39 116.396 116.396 117.705 -1.309 19200
158 1 . 1 1 39 39 GLU HA H 39 4.866 4.866 4.660 0.206 19200
159 1 . 1 1 39 39 GLU CA C 39 54.774 54.774 54.806 -0.032 19200
160 1 . 1 1 39 39 GLU CB C 39 30.374 30.374 28.373 2.001 19200
161 1 . 1 1 39 39 GLU H H 39 7.511 7.511 7.752 -0.241 19200
162 1 . 1 1 40 40 GLN N N 40 119.983 119.983 118.930 1.053 19200
163 1 . 1 1 40 40 GLN HA H 40 4.535 4.535 4.509 0.026 19200
164 1 . 1 1 40 40 GLN CA C 40 55.371 55.371 55.789 -0.418 19200
165 1 . 1 1 40 40 GLN CB C 40 30.705 30.705 28.378 2.327 19200
166 1 . 1 1 40 40 GLN H H 40 7.084 7.084 7.886 -0.802 19200
167 1 . 1 1 41 41 GLY N N 41 113.322 113.322 107.758 5.564 19200
168 1 . 1 1 41 41 GLY CA C 41 47.145 47.145 44.931 2.214 19200
169 1 . 1 1 41 41 GLY H H 41 8.992 8.992 8.537 0.455 19200
stop_
save_