data_18300
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18300
_Entry.PDB_ID 2LQA
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 18300
_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 3 3 CYS HA H 3 4.345 4.345 5.233 -0.888 18300
2 1 1 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.423 -0.938 18300
3 1 1 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.401 13.901 18300
4 1 1 . 1 1 3 3 CYS H H 3 7.453 7.453 7.565 -0.112 18300
5 1 1 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.708 -0.139 18300
6 1 1 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.508 0.192 18300
7 1 1 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.922 2.123 18300
8 1 1 . 1 1 4 4 ALA H H 4 8.479 8.479 8.317 0.162 18300
9 1 1 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.792 -0.213 18300
10 1 1 . 1 1 5 5 PHE CA C 5 55.510 55.510 54.994 0.516 18300
11 1 1 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.414 -0.549 18300
12 1 1 . 1 1 5 5 PHE H H 5 7.862 7.862 7.523 0.339 18300
13 1 1 . 1 1 6 6 GLU HA H 6 3.641 3.641 3.987 -0.346 18300
14 1 1 . 1 1 6 6 GLU CA C 6 57.762 57.762 58.258 -0.496 18300
15 1 1 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.630 -1.735 18300
16 1 1 . 1 1 6 6 GLU H H 6 8.271 8.271 8.644 -0.373 18300
17 1 1 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.843 0.088 18300
18 1 1 . 1 1 7 7 GLY H H 7 9.358 9.358 8.553 0.805 18300
19 1 1 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.660 -0.028 18300
20 1 1 . 1 1 8 8 GLU CA C 8 53.905 53.905 54.167 -0.262 18300
21 1 1 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.126 2.546 18300
22 1 1 . 1 1 8 8 GLU H H 8 7.811 7.811 7.689 0.122 18300
23 1 1 . 1 1 9 9 SER HA H 9 4.969 4.969 5.340 -0.371 18300
24 1 1 . 1 1 9 9 SER CA C 9 59.134 59.134 57.054 2.080 18300
25 1 1 . 1 1 9 9 SER CB C 9 64.097 64.097 64.687 -0.590 18300
26 1 1 . 1 1 9 9 SER H H 9 8.309 8.309 8.314 -0.005 18300
27 1 1 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.910 0.477 18300
28 1 1 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.069 -4.147 18300
29 1 1 . 1 1 10 10 CYS CB C 10 51.011 51.011 29.684 21.327 18300
30 1 1 . 1 1 10 10 CYS H H 10 8.540 8.540 8.992 -0.452 18300
31 1 1 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.110 0.275 18300
32 1 1 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.441 0.486 18300
33 1 1 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.079 2.764 18300
34 1 1 . 1 1 11 11 ASN H H 11 8.727 8.727 8.505 0.222 18300
35 1 1 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.939 -0.289 18300
36 1 1 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.370 2.046 18300
37 1 1 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.043 0.773 18300
38 1 1 . 1 1 12 12 VAL H H 12 8.498 8.498 8.448 0.050 18300
39 1 1 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.287 -0.014 18300
40 1 1 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.037 -3.038 18300
41 1 1 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.907 0.328 18300
42 1 1 . 1 1 13 13 GLN H H 13 7.749 7.749 7.664 0.085 18300
43 1 1 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.735 0.097 18300
44 1 1 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.795 0.401 18300
45 1 1 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.574 1.563 18300
46 1 1 . 1 1 14 14 PHE H H 14 8.178 8.178 6.924 1.254 18300
47 1 1 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.149 -0.328 18300
48 1 1 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.191 2.255 18300
49 1 1 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.792 -1.761 18300
50 1 1 . 1 1 15 15 TYR H H 15 8.605 8.605 7.516 1.089 18300
51 1 1 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.478 -0.211 18300
52 1 1 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.129 0.245 18300
53 1 1 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.496 -1.503 18300
54 1 1 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.659 0.182 18300
55 1 1 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.179 -2.284 18300
56 1 1 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.307 12.358 18300
57 1 1 . 1 1 17 17 CYS H H 17 8.138 8.138 8.286 -0.148 18300
58 1 1 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.679 -0.163 18300
59 1 1 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.212 -4.211 18300
60 1 1 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.621 13.088 18300
61 1 1 . 1 1 18 18 CYS H H 18 9.645 9.645 8.679 0.966 18300
62 1 1 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.497 -0.031 18300
63 1 1 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.912 0.104 18300
64 1 1 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.428 -0.336 18300
65 1 1 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.199 0.617 18300
66 1 1 . 1 1 20 20 GLY H H 20 8.510 8.510 8.704 -0.194 18300
67 1 1 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.406 0.198 18300
68 1 1 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.158 -1.248 18300
69 1 1 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.118 0.806 18300
70 1 1 . 1 1 21 21 LEU H H 21 7.616 7.616 8.021 -0.405 18300
71 1 1 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.297 1.983 18300
72 1 1 . 1 1 22 22 GLY H H 22 8.351 8.351 7.954 0.397 18300
73 1 1 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.701 -0.774 18300
74 1 1 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.362 -2.598 18300
75 1 1 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.621 -1.361 18300
76 1 1 . 1 1 23 23 LEU H H 23 7.695 7.695 7.804 -0.109 18300
77 1 1 . 1 1 24 24 THR HA H 24 4.370 4.370 4.604 -0.234 18300
78 1 1 . 1 1 24 24 THR CA C 24 60.616 60.616 60.654 -0.038 18300
79 1 1 . 1 1 24 24 THR CB C 24 70.621 70.621 71.689 -1.067 18300
80 1 1 . 1 1 24 24 THR H H 24 9.043 9.043 8.891 0.152 18300
81 1 1 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.172 -0.475 18300
82 1 1 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.349 -3.521 18300
83 1 1 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.479 12.910 18300
84 1 1 . 1 1 25 25 CYS H H 25 8.099 8.099 8.780 -0.681 18300
85 1 1 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.512 0.116 18300
86 1 1 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.217 -2.226 18300
87 1 1 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.906 0.095 18300
88 1 1 . 1 1 26 26 ILE H H 26 8.555 8.555 8.705 -0.150 18300
89 1 1 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.407 0.136 18300
90 1 1 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.349 0.981 18300
91 1 1 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.427 1.423 18300
92 1 1 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.144 1.931 18300
93 1 1 . 1 1 28 28 GLY H H 28 7.880 7.880 8.387 -0.507 18300
94 1 1 . 1 1 29 29 ASN HA H 29 5.021 5.021 5.015 0.006 18300
95 1 1 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.843 -0.936 18300
96 1 1 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.630 0.059 18300
97 1 1 . 1 1 29 29 ASN H H 29 7.996 7.996 7.766 0.230 18300
98 1 1 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.552 -0.198 18300
99 1 1 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.589 -0.069 18300
100 1 1 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.803 1.931 18300
101 1 1 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.839 1.022 18300
102 1 1 . 1 1 31 31 ASP CA C 31 52.483 52.483 54.957 -2.474 18300
103 1 1 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.508 -2.480 18300
104 1 1 . 1 1 31 31 ASP H H 31 8.148 8.148 7.704 0.444 18300
105 1 1 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.856 2.190 18300
106 1 1 . 1 1 32 32 GLY H H 32 8.459 8.459 8.261 0.198 18300
107 1 1 . 1 1 33 33 THR HA H 33 4.835 4.835 5.055 -0.220 18300
108 1 1 . 1 1 33 33 THR CA C 33 61.752 61.752 61.225 0.527 18300
109 1 1 . 1 1 33 33 THR CB C 33 71.796 71.796 71.498 0.298 18300
110 1 1 . 1 1 33 33 THR H H 33 8.667 8.667 8.176 0.491 18300
111 1 1 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.138 -0.009 18300
112 1 1 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.447 -3.098 18300
113 1 1 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.840 16.193 18300
114 1 1 . 1 1 34 34 CYS H H 34 8.253 8.253 8.655 -0.402 18300
115 1 1 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.802 0.054 18300
116 1 1 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.102 0.623 18300
117 1 1 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.782 -0.300 18300
118 1 1 . 1 1 35 35 TYR H H 35 9.299 9.299 9.049 0.250 18300
119 1 1 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.521 -0.694 18300
120 1 1 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.972 0.269 18300
121 1 1 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.815 -0.720 18300
122 1 1 . 1 1 36 36 TYR H H 36 8.548 8.548 8.872 -0.324 18300
123 1 2 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.301 -0.956 18300
124 1 2 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.510 -1.025 18300
125 1 2 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.482 13.820 18300
126 1 2 . 1 1 3 3 CYS H H 3 7.453 7.453 7.618 -0.165 18300
127 1 2 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.733 -0.164 18300
128 1 2 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.539 0.161 18300
129 1 2 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.852 2.193 18300
130 1 2 . 1 1 4 4 ALA H H 4 8.479 8.479 8.391 0.088 18300
131 1 2 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.781 -0.202 18300
132 1 2 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.117 0.393 18300
133 1 2 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.404 -0.539 18300
134 1 2 . 1 1 5 5 PHE H H 5 7.862 7.862 7.550 0.312 18300
135 1 2 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.107 -0.466 18300
136 1 2 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.994 -0.232 18300
137 1 2 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.746 -1.851 18300
138 1 2 . 1 1 6 6 GLU H H 6 8.271 8.271 8.591 -0.320 18300
139 1 2 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.943 -0.012 18300
140 1 2 . 1 1 7 7 GLY H H 7 9.358 9.358 8.497 0.861 18300
141 1 2 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.678 -0.046 18300
142 1 2 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.870 0.035 18300
143 1 2 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.406 2.266 18300
144 1 2 . 1 1 8 8 GLU H H 8 7.811 7.811 7.719 0.092 18300
145 1 2 . 1 1 9 9 SER HA H 9 4.969 4.969 5.391 -0.422 18300
146 1 2 . 1 1 9 9 SER CA C 9 59.134 59.134 57.256 1.878 18300
147 1 2 . 1 1 9 9 SER CB C 9 64.097 64.097 64.608 -0.511 18300
148 1 2 . 1 1 9 9 SER H H 9 8.309 8.309 8.275 0.034 18300
149 1 2 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.827 0.560 18300
150 1 2 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.130 -4.208 18300
151 1 2 . 1 1 10 10 CYS CB C 10 51.011 51.011 29.486 21.525 18300
152 1 2 . 1 1 10 10 CYS H H 10 8.540 8.540 8.992 -0.452 18300
153 1 2 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.135 0.250 18300
154 1 2 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.457 0.470 18300
155 1 2 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.162 2.681 18300
156 1 2 . 1 1 11 11 ASN H H 11 8.727 8.727 8.489 0.238 18300
157 1 2 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.910 -0.260 18300
158 1 2 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.392 2.024 18300
159 1 2 . 1 1 12 12 VAL CB C 12 31.816 31.816 30.985 0.831 18300
160 1 2 . 1 1 12 12 VAL H H 12 8.498 8.498 8.466 0.032 18300
161 1 2 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.221 0.052 18300
162 1 2 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.112 -3.113 18300
163 1 2 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.858 0.377 18300
164 1 2 . 1 1 13 13 GLN H H 13 7.749 7.749 7.667 0.082 18300
165 1 2 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.692 0.140 18300
166 1 2 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.688 0.508 18300
167 1 2 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.232 1.905 18300
168 1 2 . 1 1 14 14 PHE H H 14 8.178 8.178 6.963 1.215 18300
169 1 2 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.188 -0.367 18300
170 1 2 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.206 2.240 18300
171 1 2 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.646 -1.615 18300
172 1 2 . 1 1 15 15 TYR H H 15 8.605 8.605 7.514 1.091 18300
173 1 2 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.490 -0.223 18300
174 1 2 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.103 0.271 18300
175 1 2 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.466 -1.473 18300
176 1 2 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.687 0.154 18300
177 1 2 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.182 -2.287 18300
178 1 2 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.337 12.328 18300
179 1 2 . 1 1 17 17 CYS H H 17 8.138 8.138 8.272 -0.134 18300
180 1 2 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.683 -0.167 18300
181 1 2 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.200 -4.199 18300
182 1 2 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.603 13.106 18300
183 1 2 . 1 1 18 18 CYS H H 18 9.645 9.645 8.688 0.957 18300
184 1 2 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.499 -0.033 18300
185 1 2 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.900 0.116 18300
186 1 2 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.434 -0.342 18300
187 1 2 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.285 0.531 18300
188 1 2 . 1 1 20 20 GLY H H 20 8.510 8.510 8.754 -0.244 18300
189 1 2 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.425 0.179 18300
190 1 2 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.406 -1.496 18300
191 1 2 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.121 0.803 18300
192 1 2 . 1 1 21 21 LEU H H 21 7.616 7.616 7.981 -0.365 18300
193 1 2 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.359 1.921 18300
194 1 2 . 1 1 22 22 GLY H H 22 8.351 8.351 8.006 0.345 18300
195 1 2 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.669 -0.742 18300
196 1 2 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.299 -2.535 18300
197 1 2 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.440 -1.180 18300
198 1 2 . 1 1 23 23 LEU H H 23 7.695 7.695 7.826 -0.131 18300
199 1 2 . 1 1 24 24 THR HA H 24 4.370 4.370 4.627 -0.257 18300
200 1 2 . 1 1 24 24 THR CA C 24 60.616 60.616 60.415 0.201 18300
201 1 2 . 1 1 24 24 THR CB C 24 70.621 70.621 71.990 -1.369 18300
202 1 2 . 1 1 24 24 THR H H 24 9.043 9.043 8.767 0.276 18300
203 1 2 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.237 -0.540 18300
204 1 2 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.261 -3.433 18300
205 1 2 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.489 12.900 18300
206 1 2 . 1 1 25 25 CYS H H 25 8.099 8.099 8.763 -0.664 18300
207 1 2 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.519 0.109 18300
208 1 2 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.157 -2.166 18300
209 1 2 . 1 1 26 26 ILE CB C 26 41.001 41.001 41.054 -0.054 18300
210 1 2 . 1 1 26 26 ILE H H 26 8.555 8.555 8.749 -0.194 18300
211 1 2 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.396 0.147 18300
212 1 2 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.395 0.935 18300
213 1 2 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.462 1.388 18300
214 1 2 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.143 1.932 18300
215 1 2 . 1 1 28 28 GLY H H 28 7.880 7.880 8.386 -0.506 18300
216 1 2 . 1 1 29 29 ASN HA H 29 5.021 5.021 5.014 0.007 18300
217 1 2 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.840 -0.932 18300
218 1 2 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.636 0.054 18300
219 1 2 . 1 1 29 29 ASN H H 29 7.996 7.996 7.763 0.233 18300
220 1 2 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.550 -0.196 18300
221 1 2 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.597 -0.077 18300
222 1 2 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.800 1.934 18300
223 1 2 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.870 0.991 18300
224 1 2 . 1 1 31 31 ASP CA C 31 52.483 52.483 54.893 -2.410 18300
225 1 2 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.573 -2.545 18300
226 1 2 . 1 1 31 31 ASP H H 31 8.148 8.148 7.694 0.454 18300
227 1 2 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.873 2.173 18300
228 1 2 . 1 1 32 32 GLY H H 32 8.459 8.459 8.269 0.190 18300
229 1 2 . 1 1 33 33 THR HA H 33 4.835 4.835 5.172 -0.337 18300
230 1 2 . 1 1 33 33 THR CA C 33 61.752 61.752 61.071 0.681 18300
231 1 2 . 1 1 33 33 THR CB C 33 71.796 71.796 71.659 0.137 18300
232 1 2 . 1 1 33 33 THR H H 33 8.667 8.667 8.167 0.500 18300
233 1 2 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.214 -0.085 18300
234 1 2 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.319 -2.970 18300
235 1 2 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.933 16.100 18300
236 1 2 . 1 1 34 34 CYS H H 34 8.253 8.253 8.643 -0.390 18300
237 1 2 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.806 0.050 18300
238 1 2 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.087 0.638 18300
239 1 2 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.786 -0.304 18300
240 1 2 . 1 1 35 35 TYR H H 35 9.299 9.299 9.030 0.269 18300
241 1 2 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.435 -0.608 18300
242 1 2 . 1 1 36 36 TYR CA C 36 58.241 58.241 58.009 0.232 18300
243 1 2 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.800 -0.704 18300
244 1 2 . 1 1 36 36 TYR H H 36 8.548 8.548 8.863 -0.315 18300
245 1 3 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.283 -0.938 18300
246 1 3 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.473 -0.988 18300
247 1 3 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.473 13.829 18300
248 1 3 . 1 1 3 3 CYS H H 3 7.453 7.453 7.585 -0.132 18300
249 1 3 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.718 -0.149 18300
250 1 3 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.546 0.154 18300
251 1 3 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.869 2.176 18300
252 1 3 . 1 1 4 4 ALA H H 4 8.479 8.479 8.359 0.120 18300
253 1 3 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.791 -0.212 18300
254 1 3 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.014 0.496 18300
255 1 3 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.383 -0.518 18300
256 1 3 . 1 1 5 5 PHE H H 5 7.862 7.862 7.519 0.343 18300
257 1 3 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.002 -0.361 18300
258 1 3 . 1 1 6 6 GLU CA C 6 57.762 57.762 58.226 -0.464 18300
259 1 3 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.695 -1.800 18300
260 1 3 . 1 1 6 6 GLU H H 6 8.271 8.271 8.636 -0.365 18300
261 1 3 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.863 0.068 18300
262 1 3 . 1 1 7 7 GLY H H 7 9.358 9.358 8.571 0.787 18300
263 1 3 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.633 -0.001 18300
264 1 3 . 1 1 8 8 GLU CA C 8 53.905 53.905 54.345 -0.440 18300
265 1 3 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.010 2.662 18300
266 1 3 . 1 1 8 8 GLU H H 8 7.811 7.811 7.678 0.133 18300
267 1 3 . 1 1 9 9 SER HA H 9 4.969 4.969 5.223 -0.254 18300
268 1 3 . 1 1 9 9 SER CA C 9 59.134 59.134 57.167 1.967 18300
269 1 3 . 1 1 9 9 SER CB C 9 64.097 64.097 64.824 -0.727 18300
270 1 3 . 1 1 9 9 SER H H 9 8.309 8.309 8.305 0.004 18300
271 1 3 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.891 0.496 18300
272 1 3 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.103 -4.181 18300
273 1 3 . 1 1 10 10 CYS CB C 10 51.011 51.011 29.736 21.275 18300
274 1 3 . 1 1 10 10 CYS H H 10 8.540 8.540 9.165 -0.625 18300
275 1 3 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.158 0.227 18300
276 1 3 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.378 0.549 18300
277 1 3 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.256 2.587 18300
278 1 3 . 1 1 11 11 ASN H H 11 8.727 8.727 8.525 0.202 18300
279 1 3 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.912 -0.262 18300
280 1 3 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.638 1.778 18300
281 1 3 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.011 0.805 18300
282 1 3 . 1 1 12 12 VAL H H 12 8.498 8.498 8.485 0.013 18300
283 1 3 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.223 0.050 18300
284 1 3 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.216 -3.217 18300
285 1 3 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.887 0.348 18300
286 1 3 . 1 1 13 13 GLN H H 13 7.749 7.749 7.646 0.103 18300
287 1 3 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.681 0.151 18300
288 1 3 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.777 0.419 18300
289 1 3 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.009 2.128 18300
290 1 3 . 1 1 14 14 PHE H H 14 8.178 8.178 6.887 1.291 18300
291 1 3 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.168 -0.347 18300
292 1 3 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.193 2.253 18300
293 1 3 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.671 -1.640 18300
294 1 3 . 1 1 15 15 TYR H H 15 8.605 8.605 7.528 1.077 18300
295 1 3 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.489 -0.222 18300
296 1 3 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.122 0.252 18300
297 1 3 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.477 -1.484 18300
298 1 3 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.662 0.179 18300
299 1 3 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.300 -2.405 18300
300 1 3 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.303 12.362 18300
301 1 3 . 1 1 17 17 CYS H H 17 8.138 8.138 8.289 -0.151 18300
302 1 3 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.685 -0.169 18300
303 1 3 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.220 -4.219 18300
304 1 3 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.662 13.047 18300
305 1 3 . 1 1 18 18 CYS H H 18 9.645 9.645 8.689 0.956 18300
306 1 3 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.498 -0.032 18300
307 1 3 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.924 0.092 18300
308 1 3 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.448 -0.356 18300
309 1 3 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.327 0.489 18300
310 1 3 . 1 1 20 20 GLY H H 20 8.510 8.510 8.755 -0.245 18300
311 1 3 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.429 0.175 18300
312 1 3 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.389 -1.479 18300
313 1 3 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.145 0.779 18300
314 1 3 . 1 1 21 21 LEU H H 21 7.616 7.616 7.967 -0.351 18300
315 1 3 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.328 1.952 18300
316 1 3 . 1 1 22 22 GLY H H 22 8.351 8.351 7.985 0.366 18300
317 1 3 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.666 -0.739 18300
318 1 3 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.285 -2.521 18300
319 1 3 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.597 -1.337 18300
320 1 3 . 1 1 23 23 LEU H H 23 7.695 7.695 7.817 -0.122 18300
321 1 3 . 1 1 24 24 THR HA H 24 4.370 4.370 4.644 -0.274 18300
322 1 3 . 1 1 24 24 THR CA C 24 60.616 60.616 60.452 0.164 18300
323 1 3 . 1 1 24 24 THR CB C 24 70.621 70.621 71.593 -0.972 18300
324 1 3 . 1 1 24 24 THR H H 24 9.043 9.043 8.875 0.168 18300
325 1 3 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.170 -0.473 18300
326 1 3 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.053 -3.225 18300
327 1 3 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.024 13.365 18300
328 1 3 . 1 1 25 25 CYS H H 25 8.099 8.099 8.861 -0.762 18300
329 1 3 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.545 0.083 18300
330 1 3 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.210 -2.219 18300
331 1 3 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.761 0.240 18300
332 1 3 . 1 1 26 26 ILE H H 26 8.555 8.555 8.912 -0.357 18300
333 1 3 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.420 0.123 18300
334 1 3 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.511 0.819 18300
335 1 3 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.331 1.519 18300
336 1 3 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.087 1.988 18300
337 1 3 . 1 1 28 28 GLY H H 28 7.880 7.880 8.335 -0.455 18300
338 1 3 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.963 0.058 18300
339 1 3 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.800 -0.893 18300
340 1 3 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.767 -0.077 18300
341 1 3 . 1 1 29 29 ASN H H 29 7.996 7.996 7.837 0.159 18300
342 1 3 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.657 -0.303 18300
343 1 3 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.472 0.048 18300
344 1 3 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.430 2.304 18300
345 1 3 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.940 0.921 18300
346 1 3 . 1 1 31 31 ASP CA C 31 52.483 52.483 54.724 -2.241 18300
347 1 3 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.279 -2.251 18300
348 1 3 . 1 1 31 31 ASP H H 31 8.148 8.148 8.050 0.098 18300
349 1 3 . 1 1 32 32 GLY CA C 32 47.046 47.046 45.015 2.031 18300
350 1 3 . 1 1 32 32 GLY H H 32 8.459 8.459 8.427 0.032 18300
351 1 3 . 1 1 33 33 THR HA H 33 4.835 4.835 4.938 -0.103 18300
352 1 3 . 1 1 33 33 THR CA C 33 61.752 61.752 61.682 0.070 18300
353 1 3 . 1 1 33 33 THR CB C 33 71.796 71.796 70.326 1.470 18300
354 1 3 . 1 1 33 33 THR H H 33 8.667 8.667 8.652 0.015 18300
355 1 3 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.178 -0.049 18300
356 1 3 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.453 -3.104 18300
357 1 3 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.814 16.219 18300
358 1 3 . 1 1 34 34 CYS H H 34 8.253 8.253 8.533 -0.280 18300
359 1 3 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.814 0.042 18300
360 1 3 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.047 0.678 18300
361 1 3 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.672 -0.190 18300
362 1 3 . 1 1 35 35 TYR H H 35 9.299 9.299 9.053 0.246 18300
363 1 3 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.636 -0.809 18300
364 1 3 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.846 0.395 18300
365 1 3 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.887 -0.792 18300
366 1 3 . 1 1 36 36 TYR H H 36 8.548 8.548 8.862 -0.314 18300
367 1 4 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.340 -0.995 18300
368 1 4 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.264 -0.779 18300
369 1 4 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.916 13.386 18300
370 1 4 . 1 1 3 3 CYS H H 3 7.453 7.453 7.608 -0.155 18300
371 1 4 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.721 -0.152 18300
372 1 4 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.496 0.204 18300
373 1 4 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.940 2.105 18300
374 1 4 . 1 1 4 4 ALA H H 4 8.479 8.479 8.273 0.206 18300
375 1 4 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.796 -0.217 18300
376 1 4 . 1 1 5 5 PHE CA C 5 55.510 55.510 54.994 0.516 18300
377 1 4 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.396 -0.531 18300
378 1 4 . 1 1 5 5 PHE H H 5 7.862 7.862 7.549 0.313 18300
379 1 4 . 1 1 6 6 GLU HA H 6 3.641 3.641 3.997 -0.356 18300
380 1 4 . 1 1 6 6 GLU CA C 6 57.762 57.762 58.264 -0.502 18300
381 1 4 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.621 -1.726 18300
382 1 4 . 1 1 6 6 GLU H H 6 8.271 8.271 8.647 -0.376 18300
383 1 4 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.760 0.171 18300
384 1 4 . 1 1 7 7 GLY H H 7 9.358 9.358 8.813 0.545 18300
385 1 4 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.627 0.005 18300
386 1 4 . 1 1 8 8 GLU CA C 8 53.905 53.905 54.325 -0.420 18300
387 1 4 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.383 2.289 18300
388 1 4 . 1 1 8 8 GLU H H 8 7.811 7.811 7.602 0.209 18300
389 1 4 . 1 1 9 9 SER HA H 9 4.969 4.969 5.244 -0.275 18300
390 1 4 . 1 1 9 9 SER CA C 9 59.134 59.134 58.179 0.955 18300
391 1 4 . 1 1 9 9 SER CB C 9 64.097 64.097 64.318 -0.221 18300
392 1 4 . 1 1 9 9 SER H H 9 8.309 8.309 8.331 -0.022 18300
393 1 4 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.828 0.559 18300
394 1 4 . 1 1 10 10 CYS CA C 10 52.922 52.922 56.924 -4.002 18300
395 1 4 . 1 1 10 10 CYS CB C 10 51.011 51.011 29.713 21.298 18300
396 1 4 . 1 1 10 10 CYS H H 10 8.540 8.540 9.077 -0.537 18300
397 1 4 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.115 0.270 18300
398 1 4 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.399 0.528 18300
399 1 4 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.242 2.602 18300
400 1 4 . 1 1 11 11 ASN H H 11 8.727 8.727 8.499 0.228 18300
401 1 4 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.941 -0.291 18300
402 1 4 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.331 2.085 18300
403 1 4 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.049 0.766 18300
404 1 4 . 1 1 12 12 VAL H H 12 8.498 8.498 8.435 0.063 18300
405 1 4 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.285 -0.012 18300
406 1 4 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.060 -3.061 18300
407 1 4 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.879 0.356 18300
408 1 4 . 1 1 13 13 GLN H H 13 7.749 7.749 7.675 0.074 18300
409 1 4 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.732 0.100 18300
410 1 4 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.760 0.436 18300
411 1 4 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.591 1.546 18300
412 1 4 . 1 1 14 14 PHE H H 14 8.178 8.178 6.927 1.251 18300
413 1 4 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.163 -0.342 18300
414 1 4 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.189 2.257 18300
415 1 4 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.849 -1.818 18300
416 1 4 . 1 1 15 15 TYR H H 15 8.605 8.605 7.526 1.079 18300
417 1 4 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.474 -0.207 18300
418 1 4 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.129 0.245 18300
419 1 4 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.488 -1.495 18300
420 1 4 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.648 0.193 18300
421 1 4 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.189 -2.294 18300
422 1 4 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.304 12.361 18300
423 1 4 . 1 1 17 17 CYS H H 17 8.138 8.138 8.285 -0.147 18300
424 1 4 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.678 -0.162 18300
425 1 4 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.211 -4.210 18300
426 1 4 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.606 13.103 18300
427 1 4 . 1 1 18 18 CYS H H 18 9.645 9.645 8.678 0.967 18300
428 1 4 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.498 -0.032 18300
429 1 4 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.900 0.116 18300
430 1 4 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.438 -0.346 18300
431 1 4 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.307 0.509 18300
432 1 4 . 1 1 20 20 GLY H H 20 8.510 8.510 8.752 -0.242 18300
433 1 4 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.416 0.188 18300
434 1 4 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.379 -1.469 18300
435 1 4 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.203 0.721 18300
436 1 4 . 1 1 21 21 LEU H H 21 7.616 7.616 8.030 -0.414 18300
437 1 4 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.277 2.003 18300
438 1 4 . 1 1 22 22 GLY H H 22 8.351 8.351 7.944 0.407 18300
439 1 4 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.701 -0.774 18300
440 1 4 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.385 -2.621 18300
441 1 4 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.605 -1.345 18300
442 1 4 . 1 1 23 23 LEU H H 23 7.695 7.695 7.824 -0.129 18300
443 1 4 . 1 1 24 24 THR HA H 24 4.370 4.370 4.605 -0.235 18300
444 1 4 . 1 1 24 24 THR CA C 24 60.616 60.616 60.654 -0.037 18300
445 1 4 . 1 1 24 24 THR CB C 24 70.621 70.621 71.695 -1.074 18300
446 1 4 . 1 1 24 24 THR H H 24 9.043 9.043 8.896 0.147 18300
447 1 4 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.254 -0.557 18300
448 1 4 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.310 -3.482 18300
449 1 4 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.531 12.858 18300
450 1 4 . 1 1 25 25 CYS H H 25 8.099 8.099 8.779 -0.680 18300
451 1 4 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.533 0.095 18300
452 1 4 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.190 -2.199 18300
453 1 4 . 1 1 26 26 ILE CB C 26 41.001 41.001 41.052 -0.051 18300
454 1 4 . 1 1 26 26 ILE H H 26 8.555 8.555 8.758 -0.203 18300
455 1 4 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.407 0.136 18300
456 1 4 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.501 0.829 18300
457 1 4 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.404 1.446 18300
458 1 4 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.081 1.994 18300
459 1 4 . 1 1 28 28 GLY H H 28 7.880 7.880 8.322 -0.442 18300
460 1 4 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.972 0.049 18300
461 1 4 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.743 -0.836 18300
462 1 4 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.783 -0.094 18300
463 1 4 . 1 1 29 29 ASN H H 29 7.996 7.996 7.827 0.169 18300
464 1 4 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.665 -0.311 18300
465 1 4 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.634 -0.114 18300
466 1 4 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.475 2.259 18300
467 1 4 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.869 0.992 18300
468 1 4 . 1 1 31 31 ASP CA C 31 52.483 52.483 52.878 -0.395 18300
469 1 4 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.154 -2.127 18300
470 1 4 . 1 1 31 31 ASP H H 31 8.148 8.148 7.977 0.171 18300
471 1 4 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.879 2.167 18300
472 1 4 . 1 1 32 32 GLY H H 32 8.459 8.459 8.275 0.184 18300
473 1 4 . 1 1 33 33 THR HA H 33 4.835 4.835 5.033 -0.198 18300
474 1 4 . 1 1 33 33 THR CA C 33 61.752 61.752 60.854 0.898 18300
475 1 4 . 1 1 33 33 THR CB C 33 71.796 71.796 71.316 0.480 18300
476 1 4 . 1 1 33 33 THR H H 33 8.667 8.667 8.233 0.434 18300
477 1 4 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.083 0.046 18300
478 1 4 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.312 -2.963 18300
479 1 4 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.803 16.230 18300
480 1 4 . 1 1 34 34 CYS H H 34 8.253 8.253 8.651 -0.398 18300
481 1 4 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.806 0.050 18300
482 1 4 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.096 0.629 18300
483 1 4 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.759 -0.277 18300
484 1 4 . 1 1 35 35 TYR H H 35 9.299 9.299 9.059 0.240 18300
485 1 4 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.489 -0.662 18300
486 1 4 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.975 0.266 18300
487 1 4 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.837 -0.742 18300
488 1 4 . 1 1 36 36 TYR H H 36 8.548 8.548 8.869 -0.321 18300
489 1 5 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.342 -0.997 18300
490 1 5 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.292 -0.807 18300
491 1 5 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.695 13.607 18300
492 1 5 . 1 1 3 3 CYS H H 3 7.453 7.453 7.590 -0.137 18300
493 1 5 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.713 -0.144 18300
494 1 5 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.519 0.181 18300
495 1 5 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.864 2.181 18300
496 1 5 . 1 1 4 4 ALA H H 4 8.479 8.479 8.341 0.138 18300
497 1 5 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.774 -0.195 18300
498 1 5 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.120 0.390 18300
499 1 5 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.449 -0.584 18300
500 1 5 . 1 1 5 5 PHE H H 5 7.862 7.862 7.550 0.312 18300
501 1 5 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.120 -0.479 18300
502 1 5 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.937 -0.175 18300
503 1 5 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.740 -1.845 18300
504 1 5 . 1 1 6 6 GLU H H 6 8.271 8.271 8.585 -0.314 18300
505 1 5 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.955 -0.024 18300
506 1 5 . 1 1 7 7 GLY H H 7 9.358 9.358 8.494 0.864 18300
507 1 5 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.638 -0.006 18300
508 1 5 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.728 0.177 18300
509 1 5 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.578 2.094 18300
510 1 5 . 1 1 8 8 GLU H H 8 7.811 7.811 7.688 0.123 18300
511 1 5 . 1 1 9 9 SER HA H 9 4.969 4.969 5.347 -0.378 18300
512 1 5 . 1 1 9 9 SER CA C 9 59.134 59.134 58.203 0.931 18300
513 1 5 . 1 1 9 9 SER CB C 9 64.097 64.097 64.219 -0.122 18300
514 1 5 . 1 1 9 9 SER H H 9 8.309 8.309 8.356 -0.047 18300
515 1 5 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.871 0.516 18300
516 1 5 . 1 1 10 10 CYS CA C 10 52.922 52.922 56.820 -3.898 18300
517 1 5 . 1 1 10 10 CYS CB C 10 51.011 51.011 29.870 21.141 18300
518 1 5 . 1 1 10 10 CYS H H 10 8.540 8.540 9.073 -0.533 18300
519 1 5 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.101 0.284 18300
520 1 5 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.387 0.540 18300
521 1 5 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.166 2.678 18300
522 1 5 . 1 1 11 11 ASN H H 11 8.727 8.727 8.471 0.256 18300
523 1 5 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.913 -0.263 18300
524 1 5 . 1 1 12 12 VAL CA C 12 65.416 65.416 64.050 1.366 18300
525 1 5 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.475 0.341 18300
526 1 5 . 1 1 12 12 VAL H H 12 8.498 8.498 8.413 0.085 18300
527 1 5 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.285 -0.012 18300
528 1 5 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.147 -3.147 18300
529 1 5 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.650 0.585 18300
530 1 5 . 1 1 13 13 GLN H H 13 7.749 7.749 7.659 0.090 18300
531 1 5 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.740 0.092 18300
532 1 5 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.758 0.438 18300
533 1 5 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.611 1.526 18300
534 1 5 . 1 1 14 14 PHE H H 14 8.178 8.178 6.915 1.263 18300
535 1 5 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.170 -0.349 18300
536 1 5 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.190 2.256 18300
537 1 5 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.817 -1.786 18300
538 1 5 . 1 1 15 15 TYR H H 15 8.605 8.605 7.521 1.084 18300
539 1 5 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.475 -0.208 18300
540 1 5 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.099 0.275 18300
541 1 5 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.480 -1.487 18300
542 1 5 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.663 0.178 18300
543 1 5 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.141 -2.245 18300
544 1 5 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.372 12.293 18300
545 1 5 . 1 1 17 17 CYS H H 17 8.138 8.138 8.258 -0.120 18300
546 1 5 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.678 -0.162 18300
547 1 5 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.182 -4.181 18300
548 1 5 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.591 13.118 18300
549 1 5 . 1 1 18 18 CYS H H 18 9.645 9.645 8.680 0.965 18300
550 1 5 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.497 -0.031 18300
551 1 5 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.896 0.120 18300
552 1 5 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.433 -0.341 18300
553 1 5 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.287 0.529 18300
554 1 5 . 1 1 20 20 GLY H H 20 8.510 8.510 8.753 -0.243 18300
555 1 5 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.422 0.182 18300
556 1 5 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.414 -1.504 18300
557 1 5 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.114 0.810 18300
558 1 5 . 1 1 21 21 LEU H H 21 7.616 7.616 7.981 -0.365 18300
559 1 5 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.356 1.924 18300
560 1 5 . 1 1 22 22 GLY H H 22 8.351 8.351 8.002 0.349 18300
561 1 5 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.697 -0.770 18300
562 1 5 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.392 -2.627 18300
563 1 5 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.505 -1.245 18300
564 1 5 . 1 1 23 23 LEU H H 23 7.695 7.695 7.827 -0.132 18300
565 1 5 . 1 1 24 24 THR HA H 24 4.370 4.370 4.599 -0.229 18300
566 1 5 . 1 1 24 24 THR CA C 24 60.616 60.616 60.684 -0.069 18300
567 1 5 . 1 1 24 24 THR CB C 24 70.621 70.621 71.682 -1.061 18300
568 1 5 . 1 1 24 24 THR H H 24 9.043 9.043 8.851 0.192 18300
569 1 5 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.260 -0.562 18300
570 1 5 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.328 -3.500 18300
571 1 5 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.546 12.843 18300
572 1 5 . 1 1 25 25 CYS H H 25 8.099 8.099 8.778 -0.679 18300
573 1 5 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.516 0.112 18300
574 1 5 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.216 -2.225 18300
575 1 5 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.908 0.092 18300
576 1 5 . 1 1 26 26 ILE H H 26 8.555 8.555 8.763 -0.208 18300
577 1 5 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.411 0.132 18300
578 1 5 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.337 0.993 18300
579 1 5 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.429 1.421 18300
580 1 5 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.084 1.991 18300
581 1 5 . 1 1 28 28 GLY H H 28 7.880 7.880 8.319 -0.439 18300
582 1 5 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.974 0.047 18300
583 1 5 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.729 -0.822 18300
584 1 5 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.775 -0.085 18300
585 1 5 . 1 1 29 29 ASN H H 29 7.996 7.996 7.824 0.172 18300
586 1 5 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.667 -0.313 18300
587 1 5 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.634 -0.114 18300
588 1 5 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.484 2.250 18300
589 1 5 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.896 0.965 18300
590 1 5 . 1 1 31 31 ASP CA C 31 52.483 52.483 52.821 -0.338 18300
591 1 5 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.212 -2.184 18300
592 1 5 . 1 1 31 31 ASP H H 31 8.148 8.148 7.971 0.177 18300
593 1 5 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.795 2.251 18300
594 1 5 . 1 1 32 32 GLY H H 32 8.459 8.459 8.310 0.149 18300
595 1 5 . 1 1 33 33 THR HA H 33 4.835 4.835 5.106 -0.271 18300
596 1 5 . 1 1 33 33 THR CA C 33 61.752 61.752 60.602 1.151 18300
597 1 5 . 1 1 33 33 THR CB C 33 71.796 71.796 71.713 0.083 18300
598 1 5 . 1 1 33 33 THR H H 33 8.667 8.667 8.228 0.439 18300
599 1 5 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.223 -0.094 18300
600 1 5 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.166 -2.817 18300
601 1 5 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.878 16.155 18300
602 1 5 . 1 1 34 34 CYS H H 34 8.253 8.253 8.655 -0.402 18300
603 1 5 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.810 0.046 18300
604 1 5 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.076 0.649 18300
605 1 5 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.760 -0.278 18300
606 1 5 . 1 1 35 35 TYR H H 35 9.299 9.299 9.036 0.263 18300
607 1 5 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.440 -0.613 18300
608 1 5 . 1 1 36 36 TYR CA C 36 58.241 58.241 58.007 0.234 18300
609 1 5 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.829 -0.734 18300
610 1 5 . 1 1 36 36 TYR H H 36 8.548 8.548 8.860 -0.312 18300
611 1 6 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.179 -0.834 18300
612 1 6 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.659 -1.174 18300
613 1 6 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.297 14.005 18300
614 1 6 . 1 1 3 3 CYS H H 3 7.453 7.453 7.615 -0.162 18300
615 1 6 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.669 -0.100 18300
616 1 6 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.649 0.051 18300
617 1 6 . 1 1 4 4 ALA CB C 4 23.045 23.045 21.125 1.920 18300
618 1 6 . 1 1 4 4 ALA H H 4 8.479 8.479 8.286 0.193 18300
619 1 6 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.793 -0.214 18300
620 1 6 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.002 0.508 18300
621 1 6 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.396 -0.531 18300
622 1 6 . 1 1 5 5 PHE H H 5 7.862 7.862 7.552 0.310 18300
623 1 6 . 1 1 6 6 GLU HA H 6 3.641 3.641 3.996 -0.355 18300
624 1 6 . 1 1 6 6 GLU CA C 6 57.762 57.762 58.245 -0.483 18300
625 1 6 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.624 -1.729 18300
626 1 6 . 1 1 6 6 GLU H H 6 8.271 8.271 8.646 -0.375 18300
627 1 6 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.835 0.096 18300
628 1 6 . 1 1 7 7 GLY H H 7 9.358 9.358 8.546 0.812 18300
629 1 6 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.662 -0.030 18300
630 1 6 . 1 1 8 8 GLU CA C 8 53.905 53.905 54.077 -0.172 18300
631 1 6 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.280 2.392 18300
632 1 6 . 1 1 8 8 GLU H H 8 7.811 7.811 7.682 0.129 18300
633 1 6 . 1 1 9 9 SER HA H 9 4.969 4.969 5.252 -0.283 18300
634 1 6 . 1 1 9 9 SER CA C 9 59.134 59.134 58.264 0.870 18300
635 1 6 . 1 1 9 9 SER CB C 9 64.097 64.097 64.340 -0.243 18300
636 1 6 . 1 1 9 9 SER H H 9 8.309 8.309 8.355 -0.046 18300
637 1 6 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.884 0.503 18300
638 1 6 . 1 1 10 10 CYS CA C 10 52.922 52.922 56.873 -3.951 18300
639 1 6 . 1 1 10 10 CYS CB C 10 51.011 51.011 29.889 21.122 18300
640 1 6 . 1 1 10 10 CYS H H 10 8.540 8.540 9.081 -0.541 18300
641 1 6 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.107 0.278 18300
642 1 6 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.391 0.536 18300
643 1 6 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.158 2.685 18300
644 1 6 . 1 1 11 11 ASN H H 11 8.727 8.727 8.494 0.233 18300
645 1 6 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.909 -0.259 18300
646 1 6 . 1 1 12 12 VAL CA C 12 65.416 65.416 64.117 1.299 18300
647 1 6 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.498 0.318 18300
648 1 6 . 1 1 12 12 VAL H H 12 8.498 8.498 8.439 0.059 18300
649 1 6 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.279 -0.006 18300
650 1 6 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.208 -3.209 18300
651 1 6 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.635 0.600 18300
652 1 6 . 1 1 13 13 GLN H H 13 7.749 7.749 7.679 0.070 18300
653 1 6 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.735 0.097 18300
654 1 6 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.790 0.406 18300
655 1 6 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.577 1.560 18300
656 1 6 . 1 1 14 14 PHE H H 14 8.178 8.178 6.919 1.259 18300
657 1 6 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.140 -0.319 18300
658 1 6 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.215 2.231 18300
659 1 6 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.842 -1.810 18300
660 1 6 . 1 1 15 15 TYR H H 15 8.605 8.605 7.530 1.075 18300
661 1 6 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.476 -0.209 18300
662 1 6 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.142 0.232 18300
663 1 6 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.489 -1.496 18300
664 1 6 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.659 0.182 18300
665 1 6 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.195 -2.300 18300
666 1 6 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.316 12.349 18300
667 1 6 . 1 1 17 17 CYS H H 17 8.138 8.138 8.295 -0.157 18300
668 1 6 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.681 -0.165 18300
669 1 6 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.216 -4.215 18300
670 1 6 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.625 13.084 18300
671 1 6 . 1 1 18 18 CYS H H 18 9.645 9.645 8.685 0.960 18300
672 1 6 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.499 -0.033 18300
673 1 6 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.916 0.100 18300
674 1 6 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.424 -0.332 18300
675 1 6 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.197 0.619 18300
676 1 6 . 1 1 20 20 GLY H H 20 8.510 8.510 8.703 -0.193 18300
677 1 6 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.410 0.194 18300
678 1 6 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.164 -1.254 18300
679 1 6 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.120 0.804 18300
680 1 6 . 1 1 21 21 LEU H H 21 7.616 7.616 8.023 -0.407 18300
681 1 6 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.308 1.972 18300
682 1 6 . 1 1 22 22 GLY H H 22 8.351 8.351 7.965 0.386 18300
683 1 6 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.660 -0.733 18300
684 1 6 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.296 -2.532 18300
685 1 6 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.444 -1.184 18300
686 1 6 . 1 1 23 23 LEU H H 23 7.695 7.695 7.812 -0.117 18300
687 1 6 . 1 1 24 24 THR HA H 24 4.370 4.370 4.617 -0.247 18300
688 1 6 . 1 1 24 24 THR CA C 24 60.616 60.616 60.808 -0.192 18300
689 1 6 . 1 1 24 24 THR CB C 24 70.621 70.621 71.713 -1.092 18300
690 1 6 . 1 1 24 24 THR H H 24 9.043 9.043 8.884 0.159 18300
691 1 6 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.293 -0.596 18300
692 1 6 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.208 -3.380 18300
693 1 6 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.497 12.893 18300
694 1 6 . 1 1 25 25 CYS H H 25 8.099 8.099 8.765 -0.666 18300
695 1 6 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.515 0.113 18300
696 1 6 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.209 -2.217 18300
697 1 6 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.860 0.141 18300
698 1 6 . 1 1 26 26 ILE H H 26 8.555 8.555 8.730 -0.175 18300
699 1 6 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.408 0.135 18300
700 1 6 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.363 0.967 18300
701 1 6 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.416 1.434 18300
702 1 6 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.134 1.941 18300
703 1 6 . 1 1 28 28 GLY H H 28 7.880 7.880 8.372 -0.492 18300
704 1 6 . 1 1 29 29 ASN HA H 29 5.021 5.021 5.025 -0.004 18300
705 1 6 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.720 -0.813 18300
706 1 6 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.661 0.029 18300
707 1 6 . 1 1 29 29 ASN H H 29 7.996 7.996 7.748 0.248 18300
708 1 6 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.500 -0.146 18300
709 1 6 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.619 -0.099 18300
710 1 6 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.993 1.741 18300
711 1 6 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.788 1.073 18300
712 1 6 . 1 1 31 31 ASP CA C 31 52.483 52.483 52.850 -0.367 18300
713 1 6 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.927 -2.899 18300
714 1 6 . 1 1 31 31 ASP H H 31 8.148 8.148 7.666 0.482 18300
715 1 6 . 1 1 32 32 GLY CA C 32 47.046 47.046 45.050 1.996 18300
716 1 6 . 1 1 32 32 GLY H H 32 8.459 8.459 8.331 0.128 18300
717 1 6 . 1 1 33 33 THR HA H 33 4.835 4.835 5.059 -0.224 18300
718 1 6 . 1 1 33 33 THR CA C 33 61.752 61.752 61.181 0.571 18300
719 1 6 . 1 1 33 33 THR CB C 33 71.796 71.796 71.612 0.183 18300
720 1 6 . 1 1 33 33 THR H H 33 8.667 8.667 8.188 0.479 18300
721 1 6 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.135 -0.006 18300
722 1 6 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.417 -3.068 18300
723 1 6 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.847 16.186 18300
724 1 6 . 1 1 34 34 CYS H H 34 8.253 8.253 8.642 -0.389 18300
725 1 6 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.806 0.050 18300
726 1 6 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.102 0.622 18300
727 1 6 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.774 -0.292 18300
728 1 6 . 1 1 35 35 TYR H H 35 9.299 9.299 9.062 0.237 18300
729 1 6 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.503 -0.676 18300
730 1 6 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.969 0.272 18300
731 1 6 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.845 -0.750 18300
732 1 6 . 1 1 36 36 TYR H H 36 8.548 8.548 8.870 -0.322 18300
733 1 7 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.323 -0.978 18300
734 1 7 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.842 -1.357 18300
735 1 7 . 1 1 3 3 CYS CB C 3 43.302 43.302 30.772 12.530 18300
736 1 7 . 1 1 3 3 CYS H H 3 7.453 7.453 7.541 -0.088 18300
737 1 7 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.716 -0.147 18300
738 1 7 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.535 0.165 18300
739 1 7 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.861 2.184 18300
740 1 7 . 1 1 4 4 ALA H H 4 8.479 8.479 8.355 0.124 18300
741 1 7 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.790 -0.211 18300
742 1 7 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.020 0.490 18300
743 1 7 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.411 -0.546 18300
744 1 7 . 1 1 5 5 PHE H H 5 7.862 7.862 7.884 -0.022 18300
745 1 7 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.108 -0.467 18300
746 1 7 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.899 -0.137 18300
747 1 7 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.779 -1.884 18300
748 1 7 . 1 1 6 6 GLU H H 6 8.271 8.271 8.567 -0.296 18300
749 1 7 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.991 -0.060 18300
750 1 7 . 1 1 7 7 GLY H H 7 9.358 9.358 8.509 0.849 18300
751 1 7 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.684 -0.052 18300
752 1 7 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.645 0.260 18300
753 1 7 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.517 2.155 18300
754 1 7 . 1 1 8 8 GLU H H 8 7.811 7.811 7.672 0.139 18300
755 1 7 . 1 1 9 9 SER HA H 9 4.969 4.969 5.395 -0.426 18300
756 1 7 . 1 1 9 9 SER CA C 9 59.134 59.134 57.092 2.042 18300
757 1 7 . 1 1 9 9 SER CB C 9 64.097 64.097 63.945 0.152 18300
758 1 7 . 1 1 9 9 SER H H 9 8.309 8.309 8.371 -0.062 18300
759 1 7 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.805 0.582 18300
760 1 7 . 1 1 10 10 CYS CA C 10 52.922 52.922 56.889 -3.967 18300
761 1 7 . 1 1 10 10 CYS CB C 10 51.011 51.011 30.231 20.780 18300
762 1 7 . 1 1 10 10 CYS H H 10 8.540 8.540 9.096 -0.556 18300
763 1 7 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.073 0.312 18300
764 1 7 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.458 0.469 18300
765 1 7 . 1 1 11 11 ASN CB C 11 42.843 42.843 39.871 2.972 18300
766 1 7 . 1 1 11 11 ASN H H 11 8.727 8.727 8.466 0.261 18300
767 1 7 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.913 -0.263 18300
768 1 7 . 1 1 12 12 VAL CA C 12 65.416 65.416 64.061 1.355 18300
769 1 7 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.444 0.372 18300
770 1 7 . 1 1 12 12 VAL H H 12 8.498 8.498 8.439 0.059 18300
771 1 7 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.286 -0.013 18300
772 1 7 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.136 -3.136 18300
773 1 7 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.672 0.563 18300
774 1 7 . 1 1 13 13 GLN H H 13 7.749 7.749 7.652 0.097 18300
775 1 7 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.744 0.088 18300
776 1 7 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.738 0.458 18300
777 1 7 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.615 1.522 18300
778 1 7 . 1 1 14 14 PHE H H 14 8.178 8.178 6.889 1.289 18300
779 1 7 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.130 -0.309 18300
780 1 7 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.217 2.229 18300
781 1 7 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.839 -1.808 18300
782 1 7 . 1 1 15 15 TYR H H 15 8.605 8.605 7.519 1.086 18300
783 1 7 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.475 -0.208 18300
784 1 7 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.093 0.281 18300
785 1 7 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.471 -1.478 18300
786 1 7 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.638 0.203 18300
787 1 7 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.211 -2.316 18300
788 1 7 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.323 12.342 18300
789 1 7 . 1 1 17 17 CYS H H 17 8.138 8.138 8.259 -0.121 18300
790 1 7 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.673 -0.157 18300
791 1 7 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.195 -4.194 18300
792 1 7 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.583 13.126 18300
793 1 7 . 1 1 18 18 CYS H H 18 9.645 9.645 8.668 0.977 18300
794 1 7 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.496 -0.030 18300
795 1 7 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.905 0.111 18300
796 1 7 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.428 -0.336 18300
797 1 7 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.291 0.525 18300
798 1 7 . 1 1 20 20 GLY H H 20 8.510 8.510 8.749 -0.239 18300
799 1 7 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.420 0.184 18300
800 1 7 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.437 -1.527 18300
801 1 7 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.243 0.681 18300
802 1 7 . 1 1 21 21 LEU H H 21 7.616 7.616 8.010 -0.394 18300
803 1 7 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.296 1.984 18300
804 1 7 . 1 1 22 22 GLY H H 22 8.351 8.351 7.952 0.399 18300
805 1 7 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.680 -0.753 18300
806 1 7 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.285 -2.521 18300
807 1 7 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.571 -1.311 18300
808 1 7 . 1 1 23 23 LEU H H 23 7.695 7.695 7.853 -0.158 18300
809 1 7 . 1 1 24 24 THR HA H 24 4.370 4.370 4.631 -0.261 18300
810 1 7 . 1 1 24 24 THR CA C 24 60.616 60.616 60.468 0.148 18300
811 1 7 . 1 1 24 24 THR CB C 24 70.621 70.621 71.564 -0.943 18300
812 1 7 . 1 1 24 24 THR H H 24 9.043 9.043 8.748 0.295 18300
813 1 7 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.210 -0.513 18300
814 1 7 . 1 1 25 25 CYS CA C 25 54.828 54.828 57.983 -3.155 18300
815 1 7 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.076 13.313 18300
816 1 7 . 1 1 25 25 CYS H H 25 8.099 8.099 8.852 -0.753 18300
817 1 7 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.529 0.099 18300
818 1 7 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.037 -2.046 18300
819 1 7 . 1 1 26 26 ILE CB C 26 41.001 41.001 41.056 -0.055 18300
820 1 7 . 1 1 26 26 ILE H H 26 8.555 8.555 8.971 -0.416 18300
821 1 7 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.363 0.180 18300
822 1 7 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.803 0.527 18300
823 1 7 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.399 1.451 18300
824 1 7 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.283 1.792 18300
825 1 7 . 1 1 28 28 GLY H H 28 7.880 7.880 8.371 -0.491 18300
826 1 7 . 1 1 29 29 ASN HA H 29 5.021 5.021 5.001 0.020 18300
827 1 7 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.740 -0.833 18300
828 1 7 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.697 -0.007 18300
829 1 7 . 1 1 29 29 ASN H H 29 7.996 7.996 7.760 0.236 18300
830 1 7 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.471 -0.117 18300
831 1 7 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.664 -0.144 18300
832 1 7 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.903 1.831 18300
833 1 7 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.736 1.125 18300
834 1 7 . 1 1 31 31 ASP CA C 31 52.483 52.483 52.962 -0.479 18300
835 1 7 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.676 -2.648 18300
836 1 7 . 1 1 31 31 ASP H H 31 8.148 8.148 7.683 0.465 18300
837 1 7 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.867 2.179 18300
838 1 7 . 1 1 32 32 GLY H H 32 8.459 8.459 8.362 0.097 18300
839 1 7 . 1 1 33 33 THR HA H 33 4.835 4.835 5.172 -0.337 18300
840 1 7 . 1 1 33 33 THR CA C 33 61.752 61.752 61.024 0.728 18300
841 1 7 . 1 1 33 33 THR CB C 33 71.796 71.796 71.694 0.102 18300
842 1 7 . 1 1 33 33 THR H H 33 8.667 8.667 8.142 0.525 18300
843 1 7 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.298 -0.169 18300
844 1 7 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.262 -2.913 18300
845 1 7 . 1 1 34 34 CYS CB C 34 42.033 42.033 26.000 16.033 18300
846 1 7 . 1 1 34 34 CYS H H 34 8.253 8.253 8.623 -0.370 18300
847 1 7 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.811 0.045 18300
848 1 7 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.023 0.702 18300
849 1 7 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.706 -0.224 18300
850 1 7 . 1 1 35 35 TYR H H 35 9.299 9.299 9.038 0.261 18300
851 1 7 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.466 -0.639 18300
852 1 7 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.945 0.296 18300
853 1 7 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.802 -0.707 18300
854 1 7 . 1 1 36 36 TYR H H 36 8.548 8.548 8.855 -0.307 18300
855 1 8 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.317 -0.972 18300
856 1 8 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.745 -1.260 18300
857 1 8 . 1 1 3 3 CYS CB C 3 43.302 43.302 30.706 12.596 18300
858 1 8 . 1 1 3 3 CYS H H 3 7.453 7.453 7.586 -0.133 18300
859 1 8 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.737 -0.168 18300
860 1 8 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.706 -0.006 18300
861 1 8 . 1 1 4 4 ALA CB C 4 23.045 23.045 21.128 1.917 18300
862 1 8 . 1 1 4 4 ALA H H 4 8.479 8.479 8.319 0.160 18300
863 1 8 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.803 -0.224 18300
864 1 8 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.028 0.482 18300
865 1 8 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.396 -0.531 18300
866 1 8 . 1 1 5 5 PHE H H 5 7.862 7.862 7.515 0.347 18300
867 1 8 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.003 -0.362 18300
868 1 8 . 1 1 6 6 GLU CA C 6 57.762 57.762 58.262 -0.500 18300
869 1 8 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.715 -1.820 18300
870 1 8 . 1 1 6 6 GLU H H 6 8.271 8.271 8.640 -0.369 18300
871 1 8 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.883 0.048 18300
872 1 8 . 1 1 7 7 GLY H H 7 9.358 9.358 8.580 0.778 18300
873 1 8 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.622 0.010 18300
874 1 8 . 1 1 8 8 GLU CA C 8 53.905 53.905 54.350 -0.445 18300
875 1 8 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.149 2.523 18300
876 1 8 . 1 1 8 8 GLU H H 8 7.811 7.811 7.645 0.166 18300
877 1 8 . 1 1 9 9 SER HA H 9 4.969 4.969 5.116 -0.147 18300
878 1 8 . 1 1 9 9 SER CA C 9 59.134 59.134 58.353 0.781 18300
879 1 8 . 1 1 9 9 SER CB C 9 64.097 64.097 64.485 -0.388 18300
880 1 8 . 1 1 9 9 SER H H 9 8.309 8.309 8.309 0.000 18300
881 1 8 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.810 0.577 18300
882 1 8 . 1 1 10 10 CYS CA C 10 52.922 52.922 56.950 -4.029 18300
883 1 8 . 1 1 10 10 CYS CB C 10 51.011 51.011 29.742 21.269 18300
884 1 8 . 1 1 10 10 CYS H H 10 8.540 8.540 9.249 -0.709 18300
885 1 8 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.175 0.210 18300
886 1 8 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.556 0.371 18300
887 1 8 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.435 2.408 18300
888 1 8 . 1 1 11 11 ASN H H 11 8.727 8.727 8.466 0.261 18300
889 1 8 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.899 -0.249 18300
890 1 8 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.942 1.474 18300
891 1 8 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.476 0.340 18300
892 1 8 . 1 1 12 12 VAL H H 12 8.498 8.498 8.544 -0.046 18300
893 1 8 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.237 0.036 18300
894 1 8 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.319 -3.320 18300
895 1 8 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.606 0.629 18300
896 1 8 . 1 1 13 13 GLN H H 13 7.749 7.749 7.688 0.061 18300
897 1 8 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.687 0.145 18300
898 1 8 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.685 0.511 18300
899 1 8 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.049 2.088 18300
900 1 8 . 1 1 14 14 PHE H H 14 8.178 8.178 6.840 1.338 18300
901 1 8 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.144 -0.323 18300
902 1 8 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.210 2.236 18300
903 1 8 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.742 -1.711 18300
904 1 8 . 1 1 15 15 TYR H H 15 8.605 8.605 7.541 1.064 18300
905 1 8 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.494 -0.227 18300
906 1 8 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.139 0.235 18300
907 1 8 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.453 -1.460 18300
908 1 8 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.640 0.201 18300
909 1 8 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.396 -2.501 18300
910 1 8 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.242 12.423 18300
911 1 8 . 1 1 17 17 CYS H H 17 8.138 8.138 8.296 -0.158 18300
912 1 8 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.685 -0.169 18300
913 1 8 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.242 -4.241 18300
914 1 8 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.656 13.053 18300
915 1 8 . 1 1 18 18 CYS H H 18 9.645 9.645 8.684 0.961 18300
916 1 8 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.498 -0.032 18300
917 1 8 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.930 0.086 18300
918 1 8 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.447 -0.355 18300
919 1 8 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.334 0.482 18300
920 1 8 . 1 1 20 20 GLY H H 20 8.510 8.510 8.752 -0.242 18300
921 1 8 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.418 0.186 18300
922 1 8 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.444 -1.534 18300
923 1 8 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.260 0.665 18300
924 1 8 . 1 1 21 21 LEU H H 21 7.616 7.616 7.992 -0.376 18300
925 1 8 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.253 2.027 18300
926 1 8 . 1 1 22 22 GLY H H 22 8.351 8.351 7.915 0.436 18300
927 1 8 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.693 -0.766 18300
928 1 8 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.237 -2.473 18300
929 1 8 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.856 -1.596 18300
930 1 8 . 1 1 23 23 LEU H H 23 7.695 7.695 7.778 -0.083 18300
931 1 8 . 1 1 24 24 THR HA H 24 4.370 4.370 4.623 -0.253 18300
932 1 8 . 1 1 24 24 THR CA C 24 60.616 60.616 60.795 -0.179 18300
933 1 8 . 1 1 24 24 THR CB C 24 70.621 70.621 71.768 -1.147 18300
934 1 8 . 1 1 24 24 THR H H 24 9.043 9.043 8.856 0.187 18300
935 1 8 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.219 -0.522 18300
936 1 8 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.073 -3.245 18300
937 1 8 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.178 13.211 18300
938 1 8 . 1 1 25 25 CYS H H 25 8.099 8.099 8.793 -0.694 18300
939 1 8 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.556 0.072 18300
940 1 8 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.044 -2.053 18300
941 1 8 . 1 1 26 26 ILE CB C 26 41.001 41.001 41.007 -0.006 18300
942 1 8 . 1 1 26 26 ILE H H 26 8.555 8.555 8.994 -0.439 18300
943 1 8 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.370 0.173 18300
944 1 8 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.997 0.333 18300
945 1 8 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.318 1.532 18300
946 1 8 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.240 1.835 18300
947 1 8 . 1 1 28 28 GLY H H 28 7.880 7.880 8.378 -0.498 18300
948 1 8 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.983 0.038 18300
949 1 8 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.935 -1.028 18300
950 1 8 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.645 0.045 18300
951 1 8 . 1 1 29 29 ASN H H 29 7.996 7.996 7.775 0.221 18300
952 1 8 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.522 -0.168 18300
953 1 8 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.664 -0.144 18300
954 1 8 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.751 1.983 18300
955 1 8 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.935 0.926 18300
956 1 8 . 1 1 31 31 ASP CA C 31 52.483 52.483 54.900 -2.417 18300
957 1 8 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.563 -2.535 18300
958 1 8 . 1 1 31 31 ASP H H 31 8.148 8.148 7.711 0.437 18300
959 1 8 . 1 1 32 32 GLY CA C 32 47.046 47.046 45.035 2.011 18300
960 1 8 . 1 1 32 32 GLY H H 32 8.459 8.459 8.494 -0.035 18300
961 1 8 . 1 1 33 33 THR HA H 33 4.835 4.835 4.880 -0.045 18300
962 1 8 . 1 1 33 33 THR CA C 33 61.752 61.752 61.317 0.435 18300
963 1 8 . 1 1 33 33 THR CB C 33 71.796 71.796 70.082 1.714 18300
964 1 8 . 1 1 33 33 THR H H 33 8.667 8.667 8.736 -0.069 18300
965 1 8 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.168 -0.039 18300
966 1 8 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.343 -2.994 18300
967 1 8 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.814 16.219 18300
968 1 8 . 1 1 34 34 CYS H H 34 8.253 8.253 8.508 -0.255 18300
969 1 8 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.815 0.041 18300
970 1 8 . 1 1 35 35 TYR CA C 35 56.725 56.725 55.979 0.746 18300
971 1 8 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.535 -0.054 18300
972 1 8 . 1 1 35 35 TYR H H 35 9.299 9.299 9.044 0.254 18300
973 1 8 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.624 -0.797 18300
974 1 8 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.806 0.436 18300
975 1 8 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.895 -0.800 18300
976 1 8 . 1 1 36 36 TYR H H 36 8.548 8.548 8.852 -0.304 18300
977 1 9 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.297 -0.952 18300
978 1 9 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.413 -0.928 18300
979 1 9 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.519 13.783 18300
980 1 9 . 1 1 3 3 CYS H H 3 7.453 7.453 7.699 -0.246 18300
981 1 9 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.686 -0.117 18300
982 1 9 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.670 0.030 18300
983 1 9 . 1 1 4 4 ALA CB C 4 23.045 23.045 21.073 1.972 18300
984 1 9 . 1 1 4 4 ALA H H 4 8.479 8.479 8.360 0.119 18300
985 1 9 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.773 -0.194 18300
986 1 9 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.121 0.389 18300
987 1 9 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.431 -0.566 18300
988 1 9 . 1 1 5 5 PHE H H 5 7.862 7.862 7.551 0.311 18300
989 1 9 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.118 -0.477 18300
990 1 9 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.920 -0.159 18300
991 1 9 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.742 -1.847 18300
992 1 9 . 1 1 6 6 GLU H H 6 8.271 8.271 8.583 -0.312 18300
993 1 9 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.953 -0.022 18300
994 1 9 . 1 1 7 7 GLY H H 7 9.358 9.358 8.492 0.866 18300
995 1 9 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.610 0.022 18300
996 1 9 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.718 0.187 18300
997 1 9 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.711 1.961 18300
998 1 9 . 1 1 8 8 GLU H H 8 7.811 7.811 7.625 0.186 18300
999 1 9 . 1 1 9 9 SER HA H 9 4.969 4.969 5.338 -0.369 18300
1000 1 9 . 1 1 9 9 SER CA C 9 59.134 59.134 57.532 1.602 18300
1001 1 9 . 1 1 9 9 SER CB C 9 64.097 64.097 64.047 0.050 18300
1002 1 9 . 1 1 9 9 SER H H 9 8.309 8.309 8.389 -0.080 18300
1003 1 9 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.875 0.512 18300
1004 1 9 . 1 1 10 10 CYS CA C 10 52.922 52.922 56.526 -3.604 18300
1005 1 9 . 1 1 10 10 CYS CB C 10 51.011 51.011 30.120 20.891 18300
1006 1 9 . 1 1 10 10 CYS H H 10 8.540 8.540 9.013 -0.473 18300
1007 1 9 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.109 0.276 18300
1008 1 9 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.397 0.530 18300
1009 1 9 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.228 2.615 18300
1010 1 9 . 1 1 11 11 ASN H H 11 8.727 8.727 8.476 0.251 18300
1011 1 9 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.945 -0.295 18300
1012 1 9 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.275 2.141 18300
1013 1 9 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.026 0.790 18300
1014 1 9 . 1 1 12 12 VAL H H 12 8.498 8.498 8.424 0.074 18300
1015 1 9 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.291 -0.018 18300
1016 1 9 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.020 -3.021 18300
1017 1 9 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.913 0.322 18300
1018 1 9 . 1 1 13 13 GLN H H 13 7.749 7.749 7.658 0.091 18300
1019 1 9 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.740 0.092 18300
1020 1 9 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.791 0.405 18300
1021 1 9 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.590 1.547 18300
1022 1 9 . 1 1 14 14 PHE H H 14 8.178 8.178 6.913 1.265 18300
1023 1 9 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.157 -0.336 18300
1024 1 9 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.215 2.231 18300
1025 1 9 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.819 -1.788 18300
1026 1 9 . 1 1 15 15 TYR H H 15 8.605 8.605 7.522 1.083 18300
1027 1 9 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.480 -0.213 18300
1028 1 9 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.113 0.261 18300
1029 1 9 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.474 -1.481 18300
1030 1 9 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.673 0.168 18300
1031 1 9 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.160 -2.265 18300
1032 1 9 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.367 12.298 18300
1033 1 9 . 1 1 17 17 CYS H H 17 8.138 8.138 8.267 -0.129 18300
1034 1 9 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.680 -0.164 18300
1035 1 9 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.191 -4.190 18300
1036 1 9 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.598 13.111 18300
1037 1 9 . 1 1 18 18 CYS H H 18 9.645 9.645 8.686 0.959 18300
1038 1 9 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.499 -0.033 18300
1039 1 9 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.901 0.115 18300
1040 1 9 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.432 -0.340 18300
1041 1 9 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.286 0.530 18300
1042 1 9 . 1 1 20 20 GLY H H 20 8.510 8.510 8.753 -0.243 18300
1043 1 9 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.429 0.175 18300
1044 1 9 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.404 -1.494 18300
1045 1 9 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.117 0.807 18300
1046 1 9 . 1 1 21 21 LEU H H 21 7.616 7.616 7.982 -0.366 18300
1047 1 9 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.363 1.917 18300
1048 1 9 . 1 1 22 22 GLY H H 22 8.351 8.351 8.011 0.340 18300
1049 1 9 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.656 -0.729 18300
1050 1 9 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.316 -2.552 18300
1051 1 9 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.354 -1.094 18300
1052 1 9 . 1 1 23 23 LEU H H 23 7.695 7.695 7.860 -0.165 18300
1053 1 9 . 1 1 24 24 THR HA H 24 4.370 4.370 4.631 -0.261 18300
1054 1 9 . 1 1 24 24 THR CA C 24 60.616 60.616 60.479 0.137 18300
1055 1 9 . 1 1 24 24 THR CB C 24 70.621 70.621 71.556 -0.935 18300
1056 1 9 . 1 1 24 24 THR H H 24 9.043 9.043 8.799 0.244 18300
1057 1 9 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.264 -0.567 18300
1058 1 9 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.086 -3.258 18300
1059 1 9 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.345 13.044 18300
1060 1 9 . 1 1 25 25 CYS H H 25 8.099 8.099 8.832 -0.733 18300
1061 1 9 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.517 0.111 18300
1062 1 9 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.211 -2.220 18300
1063 1 9 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.901 0.100 18300
1064 1 9 . 1 1 26 26 ILE H H 26 8.555 8.555 8.760 -0.205 18300
1065 1 9 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.411 0.132 18300
1066 1 9 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.338 0.992 18300
1067 1 9 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.425 1.425 18300
1068 1 9 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.087 1.988 18300
1069 1 9 . 1 1 28 28 GLY H H 28 7.880 7.880 8.321 -0.441 18300
1070 1 9 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.974 0.047 18300
1071 1 9 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.720 -0.813 18300
1072 1 9 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.774 -0.084 18300
1073 1 9 . 1 1 29 29 ASN H H 29 7.996 7.996 7.826 0.170 18300
1074 1 9 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.669 -0.315 18300
1075 1 9 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.627 -0.107 18300
1076 1 9 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.485 2.249 18300
1077 1 9 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.890 0.971 18300
1078 1 9 . 1 1 31 31 ASP CA C 31 52.483 52.483 52.833 -0.350 18300
1079 1 9 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.197 -2.169 18300
1080 1 9 . 1 1 31 31 ASP H H 31 8.148 8.148 7.972 0.176 18300
1081 1 9 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.896 2.150 18300
1082 1 9 . 1 1 32 32 GLY H H 32 8.459 8.459 8.268 0.191 18300
1083 1 9 . 1 1 33 33 THR HA H 33 4.835 4.835 5.190 -0.355 18300
1084 1 9 . 1 1 33 33 THR CA C 33 61.752 61.752 61.014 0.738 18300
1085 1 9 . 1 1 33 33 THR CB C 33 71.796 71.796 71.804 -0.008 18300
1086 1 9 . 1 1 33 33 THR H H 33 8.667 8.667 8.179 0.488 18300
1087 1 9 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.209 -0.080 18300
1088 1 9 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.294 -2.945 18300
1089 1 9 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.940 16.093 18300
1090 1 9 . 1 1 34 34 CYS H H 34 8.253 8.253 8.631 -0.378 18300
1091 1 9 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.810 0.046 18300
1092 1 9 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.078 0.647 18300
1093 1 9 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.766 -0.284 18300
1094 1 9 . 1 1 35 35 TYR H H 35 9.299 9.299 9.039 0.260 18300
1095 1 9 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.432 -0.605 18300
1096 1 9 . 1 1 36 36 TYR CA C 36 58.241 58.241 58.000 0.241 18300
1097 1 9 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.825 -0.730 18300
1098 1 9 . 1 1 36 36 TYR H H 36 8.548 8.548 8.860 -0.312 18300
1099 1 10 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.178 -0.833 18300
1100 1 10 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.689 -1.204 18300
1101 1 10 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.256 14.046 18300
1102 1 10 . 1 1 3 3 CYS H H 3 7.453 7.453 7.604 -0.151 18300
1103 1 10 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.663 -0.094 18300
1104 1 10 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.659 0.041 18300
1105 1 10 . 1 1 4 4 ALA CB C 4 23.045 23.045 21.122 1.923 18300
1106 1 10 . 1 1 4 4 ALA H H 4 8.479 8.479 8.321 0.158 18300
1107 1 10 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.790 -0.211 18300
1108 1 10 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.012 0.498 18300
1109 1 10 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.428 -0.563 18300
1110 1 10 . 1 1 5 5 PHE H H 5 7.862 7.862 7.505 0.357 18300
1111 1 10 . 1 1 6 6 GLU HA H 6 3.641 3.641 3.999 -0.358 18300
1112 1 10 . 1 1 6 6 GLU CA C 6 57.762 57.762 58.238 -0.476 18300
1113 1 10 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.655 -1.760 18300
1114 1 10 . 1 1 6 6 GLU H H 6 8.271 8.271 8.642 -0.371 18300
1115 1 10 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.849 0.082 18300
1116 1 10 . 1 1 7 7 GLY H H 7 9.358 9.358 8.550 0.808 18300
1117 1 10 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.720 -0.088 18300
1118 1 10 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.993 -0.089 18300
1119 1 10 . 1 1 8 8 GLU CB C 8 33.672 33.672 30.945 2.727 18300
1120 1 10 . 1 1 8 8 GLU H H 8 7.811 7.811 7.659 0.152 18300
1121 1 10 . 1 1 9 9 SER HA H 9 4.969 4.969 5.305 -0.336 18300
1122 1 10 . 1 1 9 9 SER CA C 9 59.134 59.134 56.559 2.575 18300
1123 1 10 . 1 1 9 9 SER CB C 9 64.097 64.097 64.513 -0.416 18300
1124 1 10 . 1 1 9 9 SER H H 9 8.309 8.309 8.354 -0.045 18300
1125 1 10 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.845 0.542 18300
1126 1 10 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.153 -4.231 18300
1127 1 10 . 1 1 10 10 CYS CB C 10 51.011 51.011 30.194 20.817 18300
1128 1 10 . 1 1 10 10 CYS H H 10 8.540 8.540 8.959 -0.419 18300
1129 1 10 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.109 0.276 18300
1130 1 10 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.402 0.525 18300
1131 1 10 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.228 2.615 18300
1132 1 10 . 1 1 11 11 ASN H H 11 8.727 8.727 8.498 0.229 18300
1133 1 10 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.940 -0.290 18300
1134 1 10 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.348 2.068 18300
1135 1 10 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.048 0.768 18300
1136 1 10 . 1 1 12 12 VAL H H 12 8.498 8.498 8.435 0.063 18300
1137 1 10 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.287 -0.014 18300
1138 1 10 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.049 -3.050 18300
1139 1 10 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.895 0.340 18300
1140 1 10 . 1 1 13 13 GLN H H 13 7.749 7.749 7.673 0.076 18300
1141 1 10 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.735 0.097 18300
1142 1 10 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.806 0.390 18300
1143 1 10 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.568 1.569 18300
1144 1 10 . 1 1 14 14 PHE H H 14 8.178 8.178 6.920 1.258 18300
1145 1 10 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.142 -0.321 18300
1146 1 10 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.200 2.246 18300
1147 1 10 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.813 -1.782 18300
1148 1 10 . 1 1 15 15 TYR H H 15 8.605 8.605 7.524 1.081 18300
1149 1 10 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.478 -0.211 18300
1150 1 10 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.132 0.242 18300
1151 1 10 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.492 -1.499 18300
1152 1 10 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.661 0.180 18300
1153 1 10 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.195 -2.300 18300
1154 1 10 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.324 12.341 18300
1155 1 10 . 1 1 17 17 CYS H H 17 8.138 8.138 8.290 -0.152 18300
1156 1 10 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.680 -0.164 18300
1157 1 10 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.211 -4.210 18300
1158 1 10 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.621 13.088 18300
1159 1 10 . 1 1 18 18 CYS H H 18 9.645 9.645 8.681 0.964 18300
1160 1 10 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.497 -0.031 18300
1161 1 10 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.910 0.106 18300
1162 1 10 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.428 -0.336 18300
1163 1 10 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.197 0.619 18300
1164 1 10 . 1 1 20 20 GLY H H 20 8.510 8.510 8.703 -0.193 18300
1165 1 10 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.403 0.201 18300
1166 1 10 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.139 -1.229 18300
1167 1 10 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.210 0.714 18300
1168 1 10 . 1 1 21 21 LEU H H 21 7.616 7.616 8.037 -0.421 18300
1169 1 10 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.241 2.039 18300
1170 1 10 . 1 1 22 22 GLY H H 22 8.351 8.351 7.886 0.465 18300
1171 1 10 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.660 -0.733 18300
1172 1 10 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.279 -2.514 18300
1173 1 10 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.521 -1.261 18300
1174 1 10 . 1 1 23 23 LEU H H 23 7.695 7.695 7.828 -0.133 18300
1175 1 10 . 1 1 24 24 THR HA H 24 4.370 4.370 4.635 -0.265 18300
1176 1 10 . 1 1 24 24 THR CA C 24 60.616 60.616 60.468 0.148 18300
1177 1 10 . 1 1 24 24 THR CB C 24 70.621 70.621 71.563 -0.942 18300
1178 1 10 . 1 1 24 24 THR H H 24 9.043 9.043 8.825 0.218 18300
1179 1 10 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.233 -0.536 18300
1180 1 10 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.084 -3.256 18300
1181 1 10 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.315 13.074 18300
1182 1 10 . 1 1 25 25 CYS H H 25 8.099 8.099 8.831 -0.732 18300
1183 1 10 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.520 0.108 18300
1184 1 10 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.165 -2.174 18300
1185 1 10 . 1 1 26 26 ILE CB C 26 41.001 41.001 41.031 -0.030 18300
1186 1 10 . 1 1 26 26 ILE H H 26 8.555 8.555 8.711 -0.156 18300
1187 1 10 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.399 0.144 18300
1188 1 10 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.399 0.931 18300
1189 1 10 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.456 1.395 18300
1190 1 10 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.080 1.995 18300
1191 1 10 . 1 1 28 28 GLY H H 28 7.880 7.880 8.323 -0.443 18300
1192 1 10 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.973 0.048 18300
1193 1 10 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.730 -0.823 18300
1194 1 10 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.784 -0.094 18300
1195 1 10 . 1 1 29 29 ASN H H 29 7.996 7.996 7.826 0.170 18300
1196 1 10 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.665 -0.311 18300
1197 1 10 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.636 -0.116 18300
1198 1 10 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.480 2.254 18300
1199 1 10 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.868 0.993 18300
1200 1 10 . 1 1 31 31 ASP CA C 31 52.483 52.483 52.863 -0.380 18300
1201 1 10 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.172 -2.144 18300
1202 1 10 . 1 1 31 31 ASP H H 31 8.148 8.148 7.976 0.172 18300
1203 1 10 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.872 2.174 18300
1204 1 10 . 1 1 32 32 GLY H H 32 8.459 8.459 8.268 0.191 18300
1205 1 10 . 1 1 33 33 THR HA H 33 4.835 4.835 5.033 -0.198 18300
1206 1 10 . 1 1 33 33 THR CA C 33 61.752 61.752 60.844 0.908 18300
1207 1 10 . 1 1 33 33 THR CB C 33 71.796 71.796 71.312 0.484 18300
1208 1 10 . 1 1 33 33 THR H H 33 8.667 8.667 8.233 0.434 18300
1209 1 10 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.093 0.036 18300
1210 1 10 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.294 -2.945 18300
1211 1 10 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.814 16.219 18300
1212 1 10 . 1 1 34 34 CYS H H 34 8.253 8.253 8.645 -0.392 18300
1213 1 10 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.806 0.050 18300
1214 1 10 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.088 0.637 18300
1215 1 10 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.738 -0.256 18300
1216 1 10 . 1 1 35 35 TYR H H 35 9.299 9.299 9.047 0.252 18300
1217 1 10 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.519 -0.692 18300
1218 1 10 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.955 0.287 18300
1219 1 10 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.842 -0.747 18300
1220 1 10 . 1 1 36 36 TYR H H 36 8.548 8.548 8.869 -0.321 18300
1221 1 11 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.278 -0.933 18300
1222 1 11 . 1 1 3 3 CYS CA C 3 53.485 53.485 55.030 -1.545 18300
1223 1 11 . 1 1 3 3 CYS CB C 3 43.302 43.302 30.680 12.622 18300
1224 1 11 . 1 1 3 3 CYS H H 3 7.453 7.453 7.461 -0.008 18300
1225 1 11 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.726 -0.157 18300
1226 1 11 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.694 0.006 18300
1227 1 11 . 1 1 4 4 ALA CB C 4 23.045 23.045 21.082 1.963 18300
1228 1 11 . 1 1 4 4 ALA H H 4 8.479 8.479 8.414 0.065 18300
1229 1 11 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.779 -0.200 18300
1230 1 11 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.097 0.413 18300
1231 1 11 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.426 -0.561 18300
1232 1 11 . 1 1 5 5 PHE H H 5 7.862 7.862 7.548 0.314 18300
1233 1 11 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.005 -0.364 18300
1234 1 11 . 1 1 6 6 GLU CA C 6 57.762 57.762 58.006 -0.244 18300
1235 1 11 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.711 -1.816 18300
1236 1 11 . 1 1 6 6 GLU H H 6 8.271 8.271 8.597 -0.326 18300
1237 1 11 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.939 -0.008 18300
1238 1 11 . 1 1 7 7 GLY H H 7 9.358 9.358 8.501 0.857 18300
1239 1 11 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.714 -0.082 18300
1240 1 11 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.706 0.199 18300
1241 1 11 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.238 2.434 18300
1242 1 11 . 1 1 8 8 GLU H H 8 7.811 7.811 7.688 0.123 18300
1243 1 11 . 1 1 9 9 SER HA H 9 4.969 4.969 5.463 -0.494 18300
1244 1 11 . 1 1 9 9 SER CA C 9 59.134 59.134 56.580 2.554 18300
1245 1 11 . 1 1 9 9 SER CB C 9 64.097 64.097 64.629 -0.532 18300
1246 1 11 . 1 1 9 9 SER H H 9 8.309 8.309 8.355 -0.046 18300
1247 1 11 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.826 0.561 18300
1248 1 11 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.276 -4.354 18300
1249 1 11 . 1 1 10 10 CYS CB C 10 51.011 51.011 30.242 20.769 18300
1250 1 11 . 1 1 10 10 CYS H H 10 8.540 8.540 8.997 -0.457 18300
1251 1 11 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.135 0.250 18300
1252 1 11 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.467 0.460 18300
1253 1 11 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.074 2.769 18300
1254 1 11 . 1 1 11 11 ASN H H 11 8.727 8.727 8.519 0.208 18300
1255 1 11 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.911 -0.261 18300
1256 1 11 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.629 1.788 18300
1257 1 11 . 1 1 12 12 VAL CB C 12 31.816 31.816 30.980 0.836 18300
1258 1 11 . 1 1 12 12 VAL H H 12 8.498 8.498 8.473 0.025 18300
1259 1 11 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.223 0.050 18300
1260 1 11 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.242 -3.243 18300
1261 1 11 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.898 0.337 18300
1262 1 11 . 1 1 13 13 GLN H H 13 7.749 7.749 7.652 0.097 18300
1263 1 11 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.688 0.144 18300
1264 1 11 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.759 0.437 18300
1265 1 11 . 1 1 14 14 PHE CB C 14 42.137 42.137 39.981 2.156 18300
1266 1 11 . 1 1 14 14 PHE H H 14 8.178 8.178 6.839 1.339 18300
1267 1 11 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.106 -0.285 18300
1268 1 11 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.224 2.222 18300
1269 1 11 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.636 -1.605 18300
1270 1 11 . 1 1 15 15 TYR H H 15 8.605 8.605 7.535 1.070 18300
1271 1 11 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.488 -0.221 18300
1272 1 11 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.115 0.259 18300
1273 1 11 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.469 -1.476 18300
1274 1 11 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.680 0.161 18300
1275 1 11 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.195 -2.300 18300
1276 1 11 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.347 12.318 18300
1277 1 11 . 1 1 17 17 CYS H H 17 8.138 8.138 8.279 -0.141 18300
1278 1 11 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.684 -0.168 18300
1279 1 11 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.192 -4.191 18300
1280 1 11 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.600 13.109 18300
1281 1 11 . 1 1 18 18 CYS H H 18 9.645 9.645 8.689 0.956 18300
1282 1 11 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.499 -0.033 18300
1283 1 11 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.926 0.090 18300
1284 1 11 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.418 -0.326 18300
1285 1 11 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.181 0.635 18300
1286 1 11 . 1 1 20 20 GLY H H 20 8.510 8.510 8.703 -0.193 18300
1287 1 11 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.413 0.191 18300
1288 1 11 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.106 -1.196 18300
1289 1 11 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.201 0.723 18300
1290 1 11 . 1 1 21 21 LEU H H 21 7.616 7.616 8.068 -0.452 18300
1291 1 11 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.270 2.010 18300
1292 1 11 . 1 1 22 22 GLY H H 22 8.351 8.351 7.903 0.448 18300
1293 1 11 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.699 -0.772 18300
1294 1 11 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.402 -2.638 18300
1295 1 11 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.459 -1.199 18300
1296 1 11 . 1 1 23 23 LEU H H 23 7.695 7.695 7.826 -0.131 18300
1297 1 11 . 1 1 24 24 THR HA H 24 4.370 4.370 4.609 -0.239 18300
1298 1 11 . 1 1 24 24 THR CA C 24 60.616 60.616 60.194 0.423 18300
1299 1 11 . 1 1 24 24 THR CB C 24 70.621 70.621 71.920 -1.299 18300
1300 1 11 . 1 1 24 24 THR H H 24 9.043 9.043 8.855 0.188 18300
1301 1 11 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.188 -0.491 18300
1302 1 11 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.357 -3.529 18300
1303 1 11 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.472 12.917 18300
1304 1 11 . 1 1 25 25 CYS H H 25 8.099 8.099 8.785 -0.686 18300
1305 1 11 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.513 0.115 18300
1306 1 11 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.216 -2.225 18300
1307 1 11 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.907 0.094 18300
1308 1 11 . 1 1 26 26 ILE H H 26 8.555 8.555 8.775 -0.220 18300
1309 1 11 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.409 0.134 18300
1310 1 11 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.342 0.988 18300
1311 1 11 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.432 1.418 18300
1312 1 11 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.145 1.930 18300
1313 1 11 . 1 1 28 28 GLY H H 28 7.880 7.880 8.393 -0.513 18300
1314 1 11 . 1 1 29 29 ASN HA H 29 5.021 5.021 5.015 0.006 18300
1315 1 11 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.795 -0.888 18300
1316 1 11 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.651 0.039 18300
1317 1 11 . 1 1 29 29 ASN H H 29 7.996 7.996 7.765 0.231 18300
1318 1 11 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.546 -0.192 18300
1319 1 11 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.603 -0.083 18300
1320 1 11 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.799 1.935 18300
1321 1 11 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.880 0.981 18300
1322 1 11 . 1 1 31 31 ASP CA C 31 52.483 52.483 54.907 -2.424 18300
1323 1 11 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.600 -2.572 18300
1324 1 11 . 1 1 31 31 ASP H H 31 8.148 8.148 7.697 0.451 18300
1325 1 11 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.743 2.303 18300
1326 1 11 . 1 1 32 32 GLY H H 32 8.459 8.459 8.309 0.150 18300
1327 1 11 . 1 1 33 33 THR HA H 33 4.835 4.835 5.099 -0.264 18300
1328 1 11 . 1 1 33 33 THR CA C 33 61.752 61.752 60.684 1.068 18300
1329 1 11 . 1 1 33 33 THR CB C 33 71.796 71.796 71.519 0.277 18300
1330 1 11 . 1 1 33 33 THR H H 33 8.667 8.667 8.210 0.457 18300
1331 1 11 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.202 -0.073 18300
1332 1 11 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.233 -2.884 18300
1333 1 11 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.842 16.191 18300
1334 1 11 . 1 1 34 34 CYS H H 34 8.253 8.253 8.675 -0.422 18300
1335 1 11 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.805 0.051 18300
1336 1 11 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.090 0.635 18300
1337 1 11 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.789 -0.307 18300
1338 1 11 . 1 1 35 35 TYR H H 35 9.299 9.299 9.041 0.258 18300
1339 1 11 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.423 -0.596 18300
1340 1 11 . 1 1 36 36 TYR CA C 36 58.241 58.241 58.024 0.217 18300
1341 1 11 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.788 -0.693 18300
1342 1 11 . 1 1 36 36 TYR H H 36 8.548 8.548 8.866 -0.318 18300
1343 1 12 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.240 -0.895 18300
1344 1 12 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.109 -0.624 18300
1345 1 12 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.723 13.579 18300
1346 1 12 . 1 1 3 3 CYS H H 3 7.453 7.453 7.496 -0.043 18300
1347 1 12 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.558 0.011 18300
1348 1 12 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.695 0.005 18300
1349 1 12 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.831 2.214 18300
1350 1 12 . 1 1 4 4 ALA H H 4 8.479 8.479 8.084 0.395 18300
1351 1 12 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.481 0.098 18300
1352 1 12 . 1 1 5 5 PHE CA C 5 55.510 55.510 56.764 -1.254 18300
1353 1 12 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.488 -0.623 18300
1354 1 12 . 1 1 5 5 PHE H H 5 7.862 7.862 8.488 -0.626 18300
1355 1 12 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.103 -0.462 18300
1356 1 12 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.422 0.340 18300
1357 1 12 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.979 -2.084 18300
1358 1 12 . 1 1 6 6 GLU H H 6 8.271 8.271 8.464 -0.193 18300
1359 1 12 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.985 -0.054 18300
1360 1 12 . 1 1 7 7 GLY H H 7 9.358 9.358 8.531 0.827 18300
1361 1 12 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.702 -0.070 18300
1362 1 12 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.953 -0.048 18300
1363 1 12 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.620 2.052 18300
1364 1 12 . 1 1 8 8 GLU H H 8 7.811 7.811 7.788 0.023 18300
1365 1 12 . 1 1 9 9 SER HA H 9 4.969 4.969 5.436 -0.467 18300
1366 1 12 . 1 1 9 9 SER CA C 9 59.134 59.134 57.247 1.887 18300
1367 1 12 . 1 1 9 9 SER CB C 9 64.097 64.097 64.537 -0.440 18300
1368 1 12 . 1 1 9 9 SER H H 9 8.309 8.309 8.418 -0.109 18300
1369 1 12 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.923 0.464 18300
1370 1 12 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.191 -4.269 18300
1371 1 12 . 1 1 10 10 CYS CB C 10 51.011 51.011 29.652 21.359 18300
1372 1 12 . 1 1 10 10 CYS H H 10 8.540 8.540 9.010 -0.470 18300
1373 1 12 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.140 0.245 18300
1374 1 12 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.579 0.348 18300
1375 1 12 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.532 2.311 18300
1376 1 12 . 1 1 11 11 ASN H H 11 8.727 8.727 8.470 0.257 18300
1377 1 12 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.932 -0.282 18300
1378 1 12 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.905 1.511 18300
1379 1 12 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.536 0.280 18300
1380 1 12 . 1 1 12 12 VAL H H 12 8.498 8.498 8.488 0.011 18300
1381 1 12 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.295 -0.022 18300
1382 1 12 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.135 -3.136 18300
1383 1 12 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.561 0.674 18300
1384 1 12 . 1 1 13 13 GLN H H 13 7.749 7.749 7.717 0.032 18300
1385 1 12 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.730 0.102 18300
1386 1 12 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.755 0.441 18300
1387 1 12 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.587 1.550 18300
1388 1 12 . 1 1 14 14 PHE H H 14 8.178 8.178 6.918 1.260 18300
1389 1 12 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.170 -0.349 18300
1390 1 12 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.074 2.372 18300
1391 1 12 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.721 -1.690 18300
1392 1 12 . 1 1 15 15 TYR H H 15 8.605 8.605 7.524 1.081 18300
1393 1 12 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.443 -0.176 18300
1394 1 12 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.079 0.295 18300
1395 1 12 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.455 -1.462 18300
1396 1 12 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.574 0.267 18300
1397 1 12 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.084 -2.189 18300
1398 1 12 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.309 12.356 18300
1399 1 12 . 1 1 17 17 CYS H H 17 8.138 8.138 8.229 -0.091 18300
1400 1 12 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.598 -0.082 18300
1401 1 12 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.129 -4.128 18300
1402 1 12 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.447 13.262 18300
1403 1 12 . 1 1 18 18 CYS H H 18 9.645 9.645 8.549 1.096 18300
1404 1 12 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.487 -0.021 18300
1405 1 12 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.828 0.188 18300
1406 1 12 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.428 -0.336 18300
1407 1 12 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.313 0.503 18300
1408 1 12 . 1 1 20 20 GLY H H 20 8.510 8.510 8.755 -0.245 18300
1409 1 12 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.438 0.166 18300
1410 1 12 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.368 -1.458 18300
1411 1 12 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.114 0.810 18300
1412 1 12 . 1 1 21 21 LEU H H 21 7.616 7.616 7.972 -0.356 18300
1413 1 12 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.380 1.900 18300
1414 1 12 . 1 1 22 22 GLY H H 22 8.351 8.351 8.014 0.337 18300
1415 1 12 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.666 -0.739 18300
1416 1 12 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.312 -2.547 18300
1417 1 12 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.405 -1.145 18300
1418 1 12 . 1 1 23 23 LEU H H 23 7.695 7.695 7.867 -0.172 18300
1419 1 12 . 1 1 24 24 THR HA H 24 4.370 4.370 4.662 -0.292 18300
1420 1 12 . 1 1 24 24 THR CA C 24 60.616 60.616 59.915 0.701 18300
1421 1 12 . 1 1 24 24 THR CB C 24 70.621 70.621 71.804 -1.183 18300
1422 1 12 . 1 1 24 24 THR H H 24 9.043 9.043 8.734 0.309 18300
1423 1 12 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.233 -0.536 18300
1424 1 12 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.131 -3.303 18300
1425 1 12 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.287 13.102 18300
1426 1 12 . 1 1 25 25 CYS H H 25 8.099 8.099 8.839 -0.740 18300
1427 1 12 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.522 0.106 18300
1428 1 12 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.220 -2.229 18300
1429 1 12 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.916 0.085 18300
1430 1 12 . 1 1 26 26 ILE H H 26 8.555 8.555 8.828 -0.273 18300
1431 1 12 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.413 0.130 18300
1432 1 12 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.363 0.967 18300
1433 1 12 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.431 1.419 18300
1434 1 12 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.141 1.934 18300
1435 1 12 . 1 1 28 28 GLY H H 28 7.880 7.880 8.375 -0.495 18300
1436 1 12 . 1 1 29 29 ASN HA H 29 5.021 5.021 5.028 -0.007 18300
1437 1 12 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.693 -0.785 18300
1438 1 12 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.681 0.009 18300
1439 1 12 . 1 1 29 29 ASN H H 29 7.996 7.996 7.752 0.244 18300
1440 1 12 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.572 -0.218 18300
1441 1 12 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.633 -0.113 18300
1442 1 12 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.929 1.805 18300
1443 1 12 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.922 0.939 18300
1444 1 12 . 1 1 31 31 ASP CA C 31 52.483 52.483 52.652 -0.169 18300
1445 1 12 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.847 -2.819 18300
1446 1 12 . 1 1 31 31 ASP H H 31 8.148 8.148 7.585 0.563 18300
1447 1 12 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.957 2.089 18300
1448 1 12 . 1 1 32 32 GLY H H 32 8.459 8.459 8.300 0.159 18300
1449 1 12 . 1 1 33 33 THR HA H 33 4.835 4.835 5.190 -0.355 18300
1450 1 12 . 1 1 33 33 THR CA C 33 61.752 61.752 60.725 1.027 18300
1451 1 12 . 1 1 33 33 THR CB C 33 71.796 71.796 71.466 0.330 18300
1452 1 12 . 1 1 33 33 THR H H 33 8.667 8.667 8.240 0.427 18300
1453 1 12 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.211 -0.082 18300
1454 1 12 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.072 -2.724 18300
1455 1 12 . 1 1 34 34 CYS CB C 34 42.033 42.033 26.023 16.010 18300
1456 1 12 . 1 1 34 34 CYS H H 34 8.253 8.253 8.689 -0.436 18300
1457 1 12 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.802 0.054 18300
1458 1 12 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.102 0.623 18300
1459 1 12 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.771 -0.289 18300
1460 1 12 . 1 1 35 35 TYR H H 35 9.299 9.299 9.034 0.265 18300
1461 1 12 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.479 -0.652 18300
1462 1 12 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.963 0.278 18300
1463 1 12 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.682 -0.587 18300
1464 1 12 . 1 1 36 36 TYR H H 36 8.548 8.548 8.868 -0.320 18300
1465 1 13 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.240 -0.895 18300
1466 1 13 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.118 -0.633 18300
1467 1 13 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.730 13.572 18300
1468 1 13 . 1 1 3 3 CYS H H 3 7.453 7.453 7.515 -0.062 18300
1469 1 13 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.559 0.010 18300
1470 1 13 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.696 0.004 18300
1471 1 13 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.826 2.219 18300
1472 1 13 . 1 1 4 4 ALA H H 4 8.479 8.479 8.073 0.406 18300
1473 1 13 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.480 0.099 18300
1474 1 13 . 1 1 5 5 PHE CA C 5 55.510 55.510 56.776 -1.266 18300
1475 1 13 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.486 -0.620 18300
1476 1 13 . 1 1 5 5 PHE H H 5 7.862 7.862 8.490 -0.628 18300
1477 1 13 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.105 -0.464 18300
1478 1 13 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.413 0.349 18300
1479 1 13 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.981 -2.086 18300
1480 1 13 . 1 1 6 6 GLU H H 6 8.271 8.271 8.464 -0.193 18300
1481 1 13 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.989 -0.058 18300
1482 1 13 . 1 1 7 7 GLY H H 7 9.358 9.358 8.533 0.825 18300
1483 1 13 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.691 -0.059 18300
1484 1 13 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.920 -0.015 18300
1485 1 13 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.781 1.891 18300
1486 1 13 . 1 1 8 8 GLU H H 8 7.811 7.811 7.748 0.063 18300
1487 1 13 . 1 1 9 9 SER HA H 9 4.969 4.969 5.360 -0.391 18300
1488 1 13 . 1 1 9 9 SER CA C 9 59.134 59.134 58.259 0.875 18300
1489 1 13 . 1 1 9 9 SER CB C 9 64.097 64.097 64.231 -0.134 18300
1490 1 13 . 1 1 9 9 SER H H 9 8.309 8.309 8.424 -0.115 18300
1491 1 13 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.881 0.506 18300
1492 1 13 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.013 -4.091 18300
1493 1 13 . 1 1 10 10 CYS CB C 10 51.011 51.011 29.559 21.452 18300
1494 1 13 . 1 1 10 10 CYS H H 10 8.540 8.540 9.093 -0.553 18300
1495 1 13 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.141 0.244 18300
1496 1 13 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.569 0.358 18300
1497 1 13 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.558 2.285 18300
1498 1 13 . 1 1 11 11 ASN H H 11 8.727 8.727 8.467 0.260 18300
1499 1 13 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.933 -0.283 18300
1500 1 13 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.910 1.506 18300
1501 1 13 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.537 0.279 18300
1502 1 13 . 1 1 12 12 VAL H H 12 8.498 8.498 8.476 0.022 18300
1503 1 13 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.294 -0.021 18300
1504 1 13 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.134 -3.135 18300
1505 1 13 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.559 0.676 18300
1506 1 13 . 1 1 13 13 GLN H H 13 7.749 7.749 7.716 0.033 18300
1507 1 13 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.732 0.100 18300
1508 1 13 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.754 0.442 18300
1509 1 13 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.587 1.550 18300
1510 1 13 . 1 1 14 14 PHE H H 14 8.178 8.178 6.913 1.265 18300
1511 1 13 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.166 -0.345 18300
1512 1 13 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.075 2.371 18300
1513 1 13 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.720 -1.689 18300
1514 1 13 . 1 1 15 15 TYR H H 15 8.605 8.605 7.524 1.081 18300
1515 1 13 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.444 -0.177 18300
1516 1 13 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.077 0.297 18300
1517 1 13 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.451 -1.458 18300
1518 1 13 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.571 0.270 18300
1519 1 13 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.102 -2.207 18300
1520 1 13 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.305 12.360 18300
1521 1 13 . 1 1 17 17 CYS H H 17 8.138 8.138 8.229 -0.091 18300
1522 1 13 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.599 -0.083 18300
1523 1 13 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.132 -4.131 18300
1524 1 13 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.455 13.254 18300
1525 1 13 . 1 1 18 18 CYS H H 18 9.645 9.645 8.549 1.096 18300
1526 1 13 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.486 -0.020 18300
1527 1 13 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.845 0.171 18300
1528 1 13 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.413 -0.321 18300
1529 1 13 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.205 0.611 18300
1530 1 13 . 1 1 20 20 GLY H H 20 8.510 8.510 8.705 -0.195 18300
1531 1 13 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.425 0.179 18300
1532 1 13 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.122 -1.212 18300
1533 1 13 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.127 0.797 18300
1534 1 13 . 1 1 21 21 LEU H H 21 7.616 7.616 8.019 -0.403 18300
1535 1 13 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.335 1.945 18300
1536 1 13 . 1 1 22 22 GLY H H 22 8.351 8.351 7.975 0.376 18300
1537 1 13 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.673 -0.746 18300
1538 1 13 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.297 -2.533 18300
1539 1 13 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.448 -1.188 18300
1540 1 13 . 1 1 23 23 LEU H H 23 7.695 7.695 7.825 -0.130 18300
1541 1 13 . 1 1 24 24 THR HA H 24 4.370 4.370 4.617 -0.247 18300
1542 1 13 . 1 1 24 24 THR CA C 24 60.616 60.616 60.450 0.166 18300
1543 1 13 . 1 1 24 24 THR CB C 24 70.621 70.621 71.973 -1.352 18300
1544 1 13 . 1 1 24 24 THR H H 24 9.043 9.043 8.741 0.302 18300
1545 1 13 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.289 -0.592 18300
1546 1 13 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.260 -3.432 18300
1547 1 13 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.458 12.931 18300
1548 1 13 . 1 1 25 25 CYS H H 25 8.099 8.099 8.766 -0.667 18300
1549 1 13 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.537 0.091 18300
1550 1 13 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.197 -2.205 18300
1551 1 13 . 1 1 26 26 ILE CB C 26 41.001 41.001 41.068 -0.067 18300
1552 1 13 . 1 1 26 26 ILE H H 26 8.555 8.555 8.867 -0.312 18300
1553 1 13 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.411 0.132 18300
1554 1 13 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.482 0.848 18300
1555 1 13 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.420 1.430 18300
1556 1 13 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.091 1.984 18300
1557 1 13 . 1 1 28 28 GLY H H 28 7.880 7.880 8.325 -0.445 18300
1558 1 13 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.976 0.045 18300
1559 1 13 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.720 -0.813 18300
1560 1 13 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.800 -0.110 18300
1561 1 13 . 1 1 29 29 ASN H H 29 7.996 7.996 7.832 0.164 18300
1562 1 13 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.666 -0.312 18300
1563 1 13 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.648 -0.128 18300
1564 1 13 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.489 2.245 18300
1565 1 13 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.928 0.933 18300
1566 1 13 . 1 1 31 31 ASP CA C 31 52.483 52.483 52.800 -0.317 18300
1567 1 13 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.267 -2.239 18300
1568 1 13 . 1 1 31 31 ASP H H 31 8.148 8.148 7.974 0.174 18300
1569 1 13 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.834 2.212 18300
1570 1 13 . 1 1 32 32 GLY H H 32 8.459 8.459 8.322 0.137 18300
1571 1 13 . 1 1 33 33 THR HA H 33 4.835 4.835 5.139 -0.304 18300
1572 1 13 . 1 1 33 33 THR CA C 33 61.752 61.752 60.639 1.113 18300
1573 1 13 . 1 1 33 33 THR CB C 33 71.796 71.796 71.719 0.077 18300
1574 1 13 . 1 1 33 33 THR H H 33 8.667 8.667 8.252 0.415 18300
1575 1 13 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.289 -0.160 18300
1576 1 13 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.041 -2.692 18300
1577 1 13 . 1 1 34 34 CYS CB C 34 42.033 42.033 26.018 16.015 18300
1578 1 13 . 1 1 34 34 CYS H H 34 8.253 8.253 8.702 -0.449 18300
1579 1 13 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.801 0.055 18300
1580 1 13 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.099 0.626 18300
1581 1 13 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.761 -0.279 18300
1582 1 13 . 1 1 35 35 TYR H H 35 9.299 9.299 9.036 0.263 18300
1583 1 13 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.493 -0.666 18300
1584 1 13 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.958 0.283 18300
1585 1 13 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.679 -0.584 18300
1586 1 13 . 1 1 36 36 TYR H H 36 8.548 8.548 8.869 -0.321 18300
1587 1 14 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.350 -1.005 18300
1588 1 14 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.483 -0.997 18300
1589 1 14 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.598 13.704 18300
1590 1 14 . 1 1 3 3 CYS H H 3 7.453 7.453 7.843 -0.390 18300
1591 1 14 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.702 -0.133 18300
1592 1 14 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.664 0.036 18300
1593 1 14 . 1 1 4 4 ALA CB C 4 23.045 23.045 21.161 1.884 18300
1594 1 14 . 1 1 4 4 ALA H H 4 8.479 8.479 8.280 0.199 18300
1595 1 14 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.809 -0.230 18300
1596 1 14 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.011 0.499 18300
1597 1 14 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.393 -0.528 18300
1598 1 14 . 1 1 5 5 PHE H H 5 7.862 7.862 7.560 0.302 18300
1599 1 14 . 1 1 6 6 GLU HA H 6 3.641 3.641 3.972 -0.331 18300
1600 1 14 . 1 1 6 6 GLU CA C 6 57.762 57.762 58.263 -0.501 18300
1601 1 14 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.657 -1.762 18300
1602 1 14 . 1 1 6 6 GLU H H 6 8.271 8.271 8.642 -0.371 18300
1603 1 14 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.854 0.077 18300
1604 1 14 . 1 1 7 7 GLY H H 7 9.358 9.358 8.557 0.801 18300
1605 1 14 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.597 0.035 18300
1606 1 14 . 1 1 8 8 GLU CA C 8 53.905 53.905 54.118 -0.213 18300
1607 1 14 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.579 2.093 18300
1608 1 14 . 1 1 8 8 GLU H H 8 7.811 7.811 7.629 0.182 18300
1609 1 14 . 1 1 9 9 SER HA H 9 4.969 4.969 5.163 -0.194 18300
1610 1 14 . 1 1 9 9 SER CA C 9 59.134 59.134 57.196 1.938 18300
1611 1 14 . 1 1 9 9 SER CB C 9 64.097 64.097 64.030 0.067 18300
1612 1 14 . 1 1 9 9 SER H H 9 8.309 8.309 8.337 -0.028 18300
1613 1 14 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.864 0.523 18300
1614 1 14 . 1 1 10 10 CYS CA C 10 52.922 52.922 56.451 -3.529 18300
1615 1 14 . 1 1 10 10 CYS CB C 10 51.011 51.011 29.650 21.361 18300
1616 1 14 . 1 1 10 10 CYS H H 10 8.540 8.540 8.964 -0.424 18300
1617 1 14 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.104 0.281 18300
1618 1 14 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.479 0.448 18300
1619 1 14 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.047 2.796 18300
1620 1 14 . 1 1 11 11 ASN H H 11 8.727 8.727 8.488 0.239 18300
1621 1 14 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.910 -0.261 18300
1622 1 14 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.475 1.941 18300
1623 1 14 . 1 1 12 12 VAL CB C 12 31.816 31.816 30.982 0.834 18300
1624 1 14 . 1 1 12 12 VAL H H 12 8.498 8.498 8.481 0.017 18300
1625 1 14 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.225 0.048 18300
1626 1 14 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.108 -3.109 18300
1627 1 14 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.883 0.352 18300
1628 1 14 . 1 1 13 13 GLN H H 13 7.749 7.749 7.685 0.064 18300
1629 1 14 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.688 0.144 18300
1630 1 14 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.683 0.513 18300
1631 1 14 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.243 1.894 18300
1632 1 14 . 1 1 14 14 PHE H H 14 8.178 8.178 6.969 1.209 18300
1633 1 14 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.149 -0.328 18300
1634 1 14 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.236 2.210 18300
1635 1 14 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.754 -1.723 18300
1636 1 14 . 1 1 15 15 TYR H H 15 8.605 8.605 7.516 1.089 18300
1637 1 14 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.490 -0.223 18300
1638 1 14 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.163 0.211 18300
1639 1 14 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.437 -1.444 18300
1640 1 14 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.659 0.182 18300
1641 1 14 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.299 -2.404 18300
1642 1 14 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.284 12.381 18300
1643 1 14 . 1 1 17 17 CYS H H 17 8.138 8.138 8.314 -0.176 18300
1644 1 14 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.684 -0.169 18300
1645 1 14 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.228 -4.227 18300
1646 1 14 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.601 13.108 18300
1647 1 14 . 1 1 18 18 CYS H H 18 9.645 9.645 8.680 0.965 18300
1648 1 14 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.499 -0.033 18300
1649 1 14 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.919 0.097 18300
1650 1 14 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.433 -0.341 18300
1651 1 14 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.306 0.510 18300
1652 1 14 . 1 1 20 20 GLY H H 20 8.510 8.510 8.750 -0.240 18300
1653 1 14 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.429 0.175 18300
1654 1 14 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.389 -1.479 18300
1655 1 14 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.166 0.758 18300
1656 1 14 . 1 1 21 21 LEU H H 21 7.616 7.616 7.966 -0.350 18300
1657 1 14 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.360 1.920 18300
1658 1 14 . 1 1 22 22 GLY H H 22 8.351 8.351 7.998 0.353 18300
1659 1 14 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.729 -0.802 18300
1660 1 14 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.370 -2.606 18300
1661 1 14 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.819 -1.560 18300
1662 1 14 . 1 1 23 23 LEU H H 23 7.695 7.695 7.830 -0.135 18300
1663 1 14 . 1 1 24 24 THR HA H 24 4.370 4.370 4.609 -0.239 18300
1664 1 14 . 1 1 24 24 THR CA C 24 60.616 60.616 60.642 -0.026 18300
1665 1 14 . 1 1 24 24 THR CB C 24 70.621 70.621 71.732 -1.111 18300
1666 1 14 . 1 1 24 24 THR H H 24 9.043 9.043 8.844 0.199 18300
1667 1 14 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.249 -0.552 18300
1668 1 14 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.167 -3.339 18300
1669 1 14 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.325 13.065 18300
1670 1 14 . 1 1 25 25 CYS H H 25 8.099 8.099 8.796 -0.697 18300
1671 1 14 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.590 0.038 18300
1672 1 14 . 1 1 26 26 ILE CA C 26 56.991 56.991 58.910 -1.919 18300
1673 1 14 . 1 1 26 26 ILE CB C 26 41.001 41.001 41.076 -0.075 18300
1674 1 14 . 1 1 26 26 ILE H H 26 8.555 8.555 8.903 -0.348 18300
1675 1 14 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.369 0.174 18300
1676 1 14 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.767 0.563 18300
1677 1 14 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.425 1.425 18300
1678 1 14 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.209 1.866 18300
1679 1 14 . 1 1 28 28 GLY H H 28 7.880 7.880 8.308 -0.428 18300
1680 1 14 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.945 0.076 18300
1681 1 14 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.813 -0.906 18300
1682 1 14 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.801 -0.111 18300
1683 1 14 . 1 1 29 29 ASN H H 29 7.996 7.996 7.860 0.136 18300
1684 1 14 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.607 -0.253 18300
1685 1 14 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.741 -0.221 18300
1686 1 14 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.411 2.323 18300
1687 1 14 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.696 1.165 18300
1688 1 14 . 1 1 31 31 ASP CA C 31 52.483 52.483 53.264 -0.781 18300
1689 1 14 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.414 -2.386 18300
1690 1 14 . 1 1 31 31 ASP H H 31 8.148 8.148 8.007 0.141 18300
1691 1 14 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.822 2.224 18300
1692 1 14 . 1 1 32 32 GLY H H 32 8.459 8.459 8.339 0.120 18300
1693 1 14 . 1 1 33 33 THR HA H 33 4.835 4.835 5.014 -0.179 18300
1694 1 14 . 1 1 33 33 THR CA C 33 61.752 61.752 61.200 0.551 18300
1695 1 14 . 1 1 33 33 THR CB C 33 71.796 71.796 71.566 0.230 18300
1696 1 14 . 1 1 33 33 THR H H 33 8.667 8.667 8.155 0.512 18300
1697 1 14 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.254 -0.125 18300
1698 1 14 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.341 -2.992 18300
1699 1 14 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.930 16.103 18300
1700 1 14 . 1 1 34 34 CYS H H 34 8.253 8.253 8.614 -0.361 18300
1701 1 14 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.809 0.047 18300
1702 1 14 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.039 0.686 18300
1703 1 14 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.703 -0.221 18300
1704 1 14 . 1 1 35 35 TYR H H 35 9.299 9.299 9.048 0.251 18300
1705 1 14 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.530 -0.703 18300
1706 1 14 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.907 0.334 18300
1707 1 14 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.830 -0.735 18300
1708 1 14 . 1 1 36 36 TYR H H 36 8.548 8.548 8.860 -0.312 18300
1709 1 15 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.149 -0.804 18300
1710 1 15 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.319 -0.834 18300
1711 1 15 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.334 13.968 18300
1712 1 15 . 1 1 3 3 CYS H H 3 7.453 7.453 7.420 0.033 18300
1713 1 15 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.547 0.022 18300
1714 1 15 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.745 -0.044 18300
1715 1 15 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.762 2.283 18300
1716 1 15 . 1 1 4 4 ALA H H 4 8.479 8.479 8.095 0.384 18300
1717 1 15 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.480 0.099 18300
1718 1 15 . 1 1 5 5 PHE CA C 5 55.510 55.510 56.780 -1.270 18300
1719 1 15 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.496 -0.631 18300
1720 1 15 . 1 1 5 5 PHE H H 5 7.862 7.862 8.486 -0.624 18300
1721 1 15 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.105 -0.464 18300
1722 1 15 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.407 0.355 18300
1723 1 15 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.982 -2.087 18300
1724 1 15 . 1 1 6 6 GLU H H 6 8.271 8.271 8.467 -0.196 18300
1725 1 15 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.994 -0.063 18300
1726 1 15 . 1 1 7 7 GLY H H 7 9.358 9.358 8.541 0.817 18300
1727 1 15 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.718 -0.086 18300
1728 1 15 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.877 0.028 18300
1729 1 15 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.537 2.135 18300
1730 1 15 . 1 1 8 8 GLU H H 8 7.811 7.811 7.798 0.013 18300
1731 1 15 . 1 1 9 9 SER HA H 9 4.969 4.969 5.433 -0.464 18300
1732 1 15 . 1 1 9 9 SER CA C 9 59.134 59.134 57.588 1.546 18300
1733 1 15 . 1 1 9 9 SER CB C 9 64.097 64.097 64.605 -0.508 18300
1734 1 15 . 1 1 9 9 SER H H 9 8.309 8.309 8.464 -0.155 18300
1735 1 15 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.929 0.458 18300
1736 1 15 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.238 -4.316 18300
1737 1 15 . 1 1 10 10 CYS CB C 10 51.011 51.011 30.080 20.931 18300
1738 1 15 . 1 1 10 10 CYS H H 10 8.540 8.540 9.023 -0.483 18300
1739 1 15 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.124 0.261 18300
1740 1 15 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.394 0.533 18300
1741 1 15 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.187 2.656 18300
1742 1 15 . 1 1 11 11 ASN H H 11 8.727 8.727 8.520 0.207 18300
1743 1 15 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.897 -0.247 18300
1744 1 15 . 1 1 12 12 VAL CA C 12 65.416 65.416 64.145 1.271 18300
1745 1 15 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.526 0.290 18300
1746 1 15 . 1 1 12 12 VAL H H 12 8.498 8.498 8.430 0.068 18300
1747 1 15 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.269 0.004 18300
1748 1 15 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.273 -3.274 18300
1749 1 15 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.600 0.635 18300
1750 1 15 . 1 1 13 13 GLN H H 13 7.749 7.749 7.694 0.055 18300
1751 1 15 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.731 0.101 18300
1752 1 15 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.801 0.395 18300
1753 1 15 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.559 1.579 18300
1754 1 15 . 1 1 14 14 PHE H H 14 8.178 8.178 6.913 1.265 18300
1755 1 15 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.139 -0.319 18300
1756 1 15 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.101 2.345 18300
1757 1 15 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.729 -1.698 18300
1758 1 15 . 1 1 15 15 TYR H H 15 8.605 8.605 7.527 1.078 18300
1759 1 15 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.450 -0.183 18300
1760 1 15 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.090 0.284 18300
1761 1 15 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.455 -1.462 18300
1762 1 15 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.572 0.269 18300
1763 1 15 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.147 -2.252 18300
1764 1 15 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.289 12.376 18300
1765 1 15 . 1 1 17 17 CYS H H 17 8.138 8.138 8.251 -0.113 18300
1766 1 15 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.599 -0.083 18300
1767 1 15 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.142 -4.141 18300
1768 1 15 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.438 13.271 18300
1769 1 15 . 1 1 18 18 CYS H H 18 9.645 9.645 8.546 1.099 18300
1770 1 15 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.487 -0.021 18300
1771 1 15 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.810 0.206 18300
1772 1 15 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.438 -0.346 18300
1773 1 15 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.328 0.488 18300
1774 1 15 . 1 1 20 20 GLY H H 20 8.510 8.510 8.762 -0.252 18300
1775 1 15 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.420 0.184 18300
1776 1 15 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.379 -1.469 18300
1777 1 15 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.207 0.717 18300
1778 1 15 . 1 1 21 21 LEU H H 21 7.616 7.616 8.011 -0.395 18300
1779 1 15 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.288 1.992 18300
1780 1 15 . 1 1 22 22 GLY H H 22 8.351 8.351 7.956 0.395 18300
1781 1 15 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.680 -0.753 18300
1782 1 15 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.277 -2.513 18300
1783 1 15 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.539 -1.279 18300
1784 1 15 . 1 1 23 23 LEU H H 23 7.695 7.695 7.815 -0.120 18300
1785 1 15 . 1 1 24 24 THR HA H 24 4.370 4.370 4.620 -0.250 18300
1786 1 15 . 1 1 24 24 THR CA C 24 60.616 60.616 60.452 0.164 18300
1787 1 15 . 1 1 24 24 THR CB C 24 70.621 70.621 71.965 -1.344 18300
1788 1 15 . 1 1 24 24 THR H H 24 9.043 9.043 8.740 0.303 18300
1789 1 15 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.294 -0.597 18300
1790 1 15 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.259 -3.431 18300
1791 1 15 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.455 12.934 18300
1792 1 15 . 1 1 25 25 CYS H H 25 8.099 8.099 8.769 -0.670 18300
1793 1 15 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.524 0.104 18300
1794 1 15 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.221 -2.230 18300
1795 1 15 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.936 0.065 18300
1796 1 15 . 1 1 26 26 ILE H H 26 8.555 8.555 8.833 -0.278 18300
1797 1 15 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.416 0.127 18300
1798 1 15 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.348 0.982 18300
1799 1 15 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.435 1.415 18300
1800 1 15 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.096 1.980 18300
1801 1 15 . 1 1 28 28 GLY H H 28 7.880 7.880 8.326 -0.446 18300
1802 1 15 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.977 0.044 18300
1803 1 15 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.709 -0.802 18300
1804 1 15 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.799 -0.109 18300
1805 1 15 . 1 1 29 29 ASN H H 29 7.996 7.996 7.831 0.165 18300
1806 1 15 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.668 -0.314 18300
1807 1 15 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.642 -0.122 18300
1808 1 15 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.492 2.242 18300
1809 1 15 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.913 0.948 18300
1810 1 15 . 1 1 31 31 ASP CA C 31 52.483 52.483 52.815 -0.332 18300
1811 1 15 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.254 -2.226 18300
1812 1 15 . 1 1 31 31 ASP H H 31 8.148 8.148 7.975 0.173 18300
1813 1 15 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.829 2.217 18300
1814 1 15 . 1 1 32 32 GLY H H 32 8.459 8.459 8.314 0.145 18300
1815 1 15 . 1 1 33 33 THR HA H 33 4.835 4.835 5.143 -0.308 18300
1816 1 15 . 1 1 33 33 THR CA C 33 61.752 61.752 60.645 1.107 18300
1817 1 15 . 1 1 33 33 THR CB C 33 71.796 71.796 71.747 0.049 18300
1818 1 15 . 1 1 33 33 THR H H 33 8.667 8.667 8.258 0.409 18300
1819 1 15 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.290 -0.161 18300
1820 1 15 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.042 -2.693 18300
1821 1 15 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.995 16.038 18300
1822 1 15 . 1 1 34 34 CYS H H 34 8.253 8.253 8.709 -0.456 18300
1823 1 15 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.800 0.056 18300
1824 1 15 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.099 0.626 18300
1825 1 15 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.722 -0.240 18300
1826 1 15 . 1 1 35 35 TYR H H 35 9.299 9.299 9.045 0.254 18300
1827 1 15 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.510 -0.683 18300
1828 1 15 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.923 0.318 18300
1829 1 15 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.684 -0.590 18300
1830 1 15 . 1 1 36 36 TYR H H 36 8.548 8.548 8.872 -0.324 18300
1831 1 16 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.163 -0.818 18300
1832 1 16 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.294 -0.809 18300
1833 1 16 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.430 13.872 18300
1834 1 16 . 1 1 3 3 CYS H H 3 7.453 7.453 7.420 0.033 18300
1835 1 16 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.633 -0.064 18300
1836 1 16 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.693 0.007 18300
1837 1 16 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.797 2.248 18300
1838 1 16 . 1 1 4 4 ALA H H 4 8.479 8.479 8.093 0.386 18300
1839 1 16 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.485 0.094 18300
1840 1 16 . 1 1 5 5 PHE CA C 5 55.510 55.510 56.735 -1.225 18300
1841 1 16 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.520 -0.655 18300
1842 1 16 . 1 1 5 5 PHE H H 5 7.862 7.862 8.497 -0.635 18300
1843 1 16 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.107 -0.466 18300
1844 1 16 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.445 0.317 18300
1845 1 16 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.947 -2.052 18300
1846 1 16 . 1 1 6 6 GLU H H 6 8.271 8.271 8.476 -0.205 18300
1847 1 16 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.980 -0.049 18300
1848 1 16 . 1 1 7 7 GLY H H 7 9.358 9.358 8.534 0.824 18300
1849 1 16 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.702 -0.070 18300
1850 1 16 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.918 -0.013 18300
1851 1 16 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.776 1.896 18300
1852 1 16 . 1 1 8 8 GLU H H 8 7.811 7.811 7.730 0.081 18300
1853 1 16 . 1 1 9 9 SER HA H 9 4.969 4.969 5.416 -0.447 18300
1854 1 16 . 1 1 9 9 SER CA C 9 59.134 59.134 58.302 0.832 18300
1855 1 16 . 1 1 9 9 SER CB C 9 64.097 64.097 64.322 -0.225 18300
1856 1 16 . 1 1 9 9 SER H H 9 8.309 8.309 8.419 -0.110 18300
1857 1 16 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.818 0.569 18300
1858 1 16 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.226 -4.304 18300
1859 1 16 . 1 1 10 10 CYS CB C 10 51.011 51.011 30.118 20.893 18300
1860 1 16 . 1 1 10 10 CYS H H 10 8.540 8.540 8.993 -0.453 18300
1861 1 16 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.177 0.208 18300
1862 1 16 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.245 0.682 18300
1863 1 16 . 1 1 11 11 ASN CB C 11 42.843 42.843 41.270 1.573 18300
1864 1 16 . 1 1 11 11 ASN H H 11 8.727 8.727 8.500 0.227 18300
1865 1 16 . 1 1 12 12 VAL HA H 12 3.650 3.650 4.056 -0.406 18300
1866 1 16 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.786 1.630 18300
1867 1 16 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.135 0.681 18300
1868 1 16 . 1 1 12 12 VAL H H 12 8.498 8.498 8.667 -0.169 18300
1869 1 16 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.310 -0.037 18300
1870 1 16 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.205 -3.206 18300
1871 1 16 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.903 0.332 18300
1872 1 16 . 1 1 13 13 GLN H H 13 7.749 7.749 7.628 0.121 18300
1873 1 16 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.732 0.100 18300
1874 1 16 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.777 0.419 18300
1875 1 16 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.533 1.604 18300
1876 1 16 . 1 1 14 14 PHE H H 14 8.178 8.178 6.902 1.276 18300
1877 1 16 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.156 -0.335 18300
1878 1 16 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.079 2.367 18300
1879 1 16 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.609 -1.578 18300
1880 1 16 . 1 1 15 15 TYR H H 15 8.605 8.605 7.519 1.086 18300
1881 1 16 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.452 -0.185 18300
1882 1 16 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.072 0.302 18300
1883 1 16 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.447 -1.454 18300
1884 1 16 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.578 0.263 18300
1885 1 16 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.149 -2.254 18300
1886 1 16 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.294 12.371 18300
1887 1 16 . 1 1 17 17 CYS H H 17 8.138 8.138 8.240 -0.102 18300
1888 1 16 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.603 -0.087 18300
1889 1 16 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.138 -4.137 18300
1890 1 16 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.487 13.222 18300
1891 1 16 . 1 1 18 18 CYS H H 18 9.645 9.645 8.554 1.091 18300
1892 1 16 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.488 -0.022 18300
1893 1 16 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.868 0.148 18300
1894 1 16 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.417 -0.325 18300
1895 1 16 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.218 0.599 18300
1896 1 16 . 1 1 20 20 GLY H H 20 8.510 8.510 8.703 -0.193 18300
1897 1 16 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.426 0.178 18300
1898 1 16 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.106 -1.196 18300
1899 1 16 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.137 0.787 18300
1900 1 16 . 1 1 21 21 LEU H H 21 7.616 7.616 8.015 -0.399 18300
1901 1 16 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.336 1.944 18300
1902 1 16 . 1 1 22 22 GLY H H 22 8.351 8.351 7.974 0.377 18300
1903 1 16 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.683 -0.756 18300
1904 1 16 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.280 -2.516 18300
1905 1 16 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.492 -1.232 18300
1906 1 16 . 1 1 23 23 LEU H H 23 7.695 7.695 7.847 -0.152 18300
1907 1 16 . 1 1 24 24 THR HA H 24 4.370 4.370 4.664 -0.294 18300
1908 1 16 . 1 1 24 24 THR CA C 24 60.616 60.616 59.896 0.720 18300
1909 1 16 . 1 1 24 24 THR CB C 24 70.621 70.621 71.815 -1.194 18300
1910 1 16 . 1 1 24 24 THR H H 24 9.043 9.043 8.738 0.305 18300
1911 1 16 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.184 -0.487 18300
1912 1 16 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.138 -3.310 18300
1913 1 16 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.211 13.178 18300
1914 1 16 . 1 1 25 25 CYS H H 25 8.099 8.099 8.842 -0.743 18300
1915 1 16 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.522 0.106 18300
1916 1 16 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.228 -2.237 18300
1917 1 16 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.911 0.090 18300
1918 1 16 . 1 1 26 26 ILE H H 26 8.555 8.555 8.856 -0.301 18300
1919 1 16 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.414 0.129 18300
1920 1 16 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.379 0.951 18300
1921 1 16 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.433 1.417 18300
1922 1 16 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.134 1.941 18300
1923 1 16 . 1 1 28 28 GLY H H 28 7.880 7.880 8.392 -0.512 18300
1924 1 16 . 1 1 29 29 ASN HA H 29 5.021 5.021 5.028 -0.007 18300
1925 1 16 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.653 -0.746 18300
1926 1 16 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.707 -0.017 18300
1927 1 16 . 1 1 29 29 ASN H H 29 7.996 7.996 7.757 0.239 18300
1928 1 16 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.490 -0.136 18300
1929 1 16 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.819 -0.299 18300
1930 1 16 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.804 1.930 18300
1931 1 16 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.962 0.899 18300
1932 1 16 . 1 1 31 31 ASP CA C 31 52.483 52.483 53.761 -1.278 18300
1933 1 16 . 1 1 31 31 ASP CB C 31 40.028 40.028 43.044 -3.016 18300
1934 1 16 . 1 1 31 31 ASP H H 31 8.148 8.148 7.644 0.504 18300
1935 1 16 . 1 1 32 32 GLY CA C 32 47.046 47.046 45.089 1.957 18300
1936 1 16 . 1 1 32 32 GLY H H 32 8.459 8.459 8.289 0.170 18300
1937 1 16 . 1 1 33 33 THR HA H 33 4.835 4.835 5.226 -0.391 18300
1938 1 16 . 1 1 33 33 THR CA C 33 61.752 61.752 61.045 0.707 18300
1939 1 16 . 1 1 33 33 THR CB C 33 71.796 71.796 71.654 0.142 18300
1940 1 16 . 1 1 33 33 THR H H 33 8.667 8.667 8.191 0.476 18300
1941 1 16 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.298 -0.169 18300
1942 1 16 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.205 -2.856 18300
1943 1 16 . 1 1 34 34 CYS CB C 34 42.033 42.033 26.085 15.948 18300
1944 1 16 . 1 1 34 34 CYS H H 34 8.253 8.253 8.681 -0.428 18300
1945 1 16 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.801 0.055 18300
1946 1 16 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.090 0.635 18300
1947 1 16 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.764 -0.282 18300
1948 1 16 . 1 1 35 35 TYR H H 35 9.299 9.299 9.037 0.262 18300
1949 1 16 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.544 -0.717 18300
1950 1 16 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.920 0.320 18300
1951 1 16 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.669 -0.574 18300
1952 1 16 . 1 1 36 36 TYR H H 36 8.548 8.548 8.868 -0.320 18300
1953 1 17 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.186 -0.841 18300
1954 1 17 . 1 1 3 3 CYS CA C 3 53.485 53.485 55.003 -1.518 18300
1955 1 17 . 1 1 3 3 CYS CB C 3 43.302 43.302 30.644 12.658 18300
1956 1 17 . 1 1 3 3 CYS H H 3 7.453 7.453 7.523 -0.070 18300
1957 1 17 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.674 -0.105 18300
1958 1 17 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.653 0.047 18300
1959 1 17 . 1 1 4 4 ALA CB C 4 23.045 23.045 21.065 1.980 18300
1960 1 17 . 1 1 4 4 ALA H H 4 8.479 8.479 8.418 0.061 18300
1961 1 17 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.780 -0.201 18300
1962 1 17 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.018 0.492 18300
1963 1 17 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.404 -0.539 18300
1964 1 17 . 1 1 5 5 PHE H H 5 7.862 7.862 7.813 0.049 18300
1965 1 17 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.124 -0.483 18300
1966 1 17 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.881 -0.119 18300
1967 1 17 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.765 -1.870 18300
1968 1 17 . 1 1 6 6 GLU H H 6 8.271 8.271 8.571 -0.300 18300
1969 1 17 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.982 -0.051 18300
1970 1 17 . 1 1 7 7 GLY H H 7 9.358 9.358 8.498 0.860 18300
1971 1 17 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.639 -0.007 18300
1972 1 17 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.807 0.098 18300
1973 1 17 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.363 2.309 18300
1974 1 17 . 1 1 8 8 GLU H H 8 7.811 7.811 7.743 0.068 18300
1975 1 17 . 1 1 9 9 SER HA H 9 4.969 4.969 5.442 -0.473 18300
1976 1 17 . 1 1 9 9 SER CA C 9 59.134 59.134 57.194 1.940 18300
1977 1 17 . 1 1 9 9 SER CB C 9 64.097 64.097 64.654 -0.557 18300
1978 1 17 . 1 1 9 9 SER H H 9 8.309 8.309 8.330 -0.021 18300
1979 1 17 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.877 0.510 18300
1980 1 17 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.069 -4.146 18300
1981 1 17 . 1 1 10 10 CYS CB C 10 51.011 51.011 30.030 20.981 18300
1982 1 17 . 1 1 10 10 CYS H H 10 8.540 8.540 8.986 -0.446 18300
1983 1 17 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.112 0.273 18300
1984 1 17 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.594 0.333 18300
1985 1 17 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.427 2.416 18300
1986 1 17 . 1 1 11 11 ASN H H 11 8.727 8.727 8.443 0.284 18300
1987 1 17 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.944 -0.294 18300
1988 1 17 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.839 1.577 18300
1989 1 17 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.507 0.309 18300
1990 1 17 . 1 1 12 12 VAL H H 12 8.498 8.498 8.492 0.006 18300
1991 1 17 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.306 -0.033 18300
1992 1 17 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.075 -3.076 18300
1993 1 17 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.600 0.635 18300
1994 1 17 . 1 1 13 13 GLN H H 13 7.749 7.749 7.707 0.042 18300
1995 1 17 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.737 0.095 18300
1996 1 17 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.904 0.292 18300
1997 1 17 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.483 1.654 18300
1998 1 17 . 1 1 14 14 PHE H H 14 8.178 8.178 6.907 1.271 18300
1999 1 17 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.097 -0.276 18300
2000 1 17 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.161 2.285 18300
2001 1 17 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.757 -1.726 18300
2002 1 17 . 1 1 15 15 TYR H H 15 8.605 8.605 7.524 1.081 18300
2003 1 17 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.475 -0.208 18300
2004 1 17 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.098 0.276 18300
2005 1 17 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.465 -1.472 18300
2006 1 17 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.660 0.181 18300
2007 1 17 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.149 -2.254 18300
2008 1 17 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.369 12.296 18300
2009 1 17 . 1 1 17 17 CYS H H 17 8.138 8.138 8.250 -0.112 18300
2010 1 17 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.678 -0.162 18300
2011 1 17 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.176 -4.175 18300
2012 1 17 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.596 13.113 18300
2013 1 17 . 1 1 18 18 CYS H H 18 9.645 9.645 8.680 0.965 18300
2014 1 17 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.497 -0.031 18300
2015 1 17 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.913 0.103 18300
2016 1 17 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.423 -0.331 18300
2017 1 17 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.186 0.630 18300
2018 1 17 . 1 1 20 20 GLY H H 20 8.510 8.510 8.704 -0.194 18300
2019 1 17 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.411 0.193 18300
2020 1 17 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.150 -1.240 18300
2021 1 17 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.117 0.806 18300
2022 1 17 . 1 1 21 21 LEU H H 21 7.616 7.616 8.028 -0.412 18300
2023 1 17 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.310 1.970 18300
2024 1 17 . 1 1 22 22 GLY H H 22 8.351 8.351 7.967 0.384 18300
2025 1 17 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.660 -0.733 18300
2026 1 17 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.290 -2.526 18300
2027 1 17 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.371 -1.111 18300
2028 1 17 . 1 1 23 23 LEU H H 23 7.695 7.695 7.807 -0.112 18300
2029 1 17 . 1 1 24 24 THR HA H 24 4.370 4.370 4.611 -0.241 18300
2030 1 17 . 1 1 24 24 THR CA C 24 60.616 60.616 60.831 -0.215 18300
2031 1 17 . 1 1 24 24 THR CB C 24 70.621 70.621 71.695 -1.074 18300
2032 1 17 . 1 1 24 24 THR H H 24 9.043 9.043 8.820 0.223 18300
2033 1 17 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.254 -0.557 18300
2034 1 17 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.253 -3.425 18300
2035 1 17 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.471 12.918 18300
2036 1 17 . 1 1 25 25 CYS H H 25 8.099 8.099 8.762 -0.663 18300
2037 1 17 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.515 0.113 18300
2038 1 17 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.219 -2.228 18300
2039 1 17 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.901 0.099 18300
2040 1 17 . 1 1 26 26 ILE H H 26 8.555 8.555 8.802 -0.247 18300
2041 1 17 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.410 0.133 18300
2042 1 17 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.354 0.976 18300
2043 1 17 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.432 1.418 18300
2044 1 17 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.139 1.936 18300
2045 1 17 . 1 1 28 28 GLY H H 28 7.880 7.880 8.396 -0.516 18300
2046 1 17 . 1 1 29 29 ASN HA H 29 5.021 5.021 5.020 0.001 18300
2047 1 17 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.770 -0.863 18300
2048 1 17 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.666 0.024 18300
2049 1 17 . 1 1 29 29 ASN H H 29 7.996 7.996 7.773 0.223 18300
2050 1 17 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.417 -0.063 18300
2051 1 17 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.733 -0.213 18300
2052 1 17 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.812 1.922 18300
2053 1 17 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.847 1.014 18300
2054 1 17 . 1 1 31 31 ASP CA C 31 52.483 52.483 53.764 -1.281 18300
2055 1 17 . 1 1 31 31 ASP CB C 31 40.028 40.028 43.142 -3.114 18300
2056 1 17 . 1 1 31 31 ASP H H 31 8.148 8.148 7.706 0.442 18300
2057 1 17 . 1 1 32 32 GLY CA C 32 47.046 47.046 45.268 1.778 18300
2058 1 17 . 1 1 32 32 GLY H H 32 8.459 8.459 8.402 0.057 18300
2059 1 17 . 1 1 33 33 THR HA H 33 4.835 4.835 5.174 -0.339 18300
2060 1 17 . 1 1 33 33 THR CA C 33 61.752 61.752 60.715 1.037 18300
2061 1 17 . 1 1 33 33 THR CB C 33 71.796 71.796 71.369 0.427 18300
2062 1 17 . 1 1 33 33 THR H H 33 8.667 8.667 8.212 0.455 18300
2063 1 17 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.179 -0.050 18300
2064 1 17 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.159 -2.810 18300
2065 1 17 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.935 16.098 18300
2066 1 17 . 1 1 34 34 CYS H H 34 8.253 8.253 8.648 -0.395 18300
2067 1 17 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.808 0.048 18300
2068 1 17 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.079 0.646 18300
2069 1 17 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.778 -0.296 18300
2070 1 17 . 1 1 35 35 TYR H H 35 9.299 9.299 9.034 0.265 18300
2071 1 17 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.464 -0.637 18300
2072 1 17 . 1 1 36 36 TYR CA C 36 58.241 58.241 58.020 0.221 18300
2073 1 17 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.782 -0.688 18300
2074 1 17 . 1 1 36 36 TYR H H 36 8.548 8.548 8.862 -0.314 18300
2075 1 18 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.106 -0.761 18300
2076 1 18 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.574 -1.089 18300
2077 1 18 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.457 13.845 18300
2078 1 18 . 1 1 3 3 CYS H H 3 7.453 7.453 7.631 -0.178 18300
2079 1 18 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.521 0.048 18300
2080 1 18 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.665 0.035 18300
2081 1 18 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.951 2.094 18300
2082 1 18 . 1 1 4 4 ALA H H 4 8.479 8.479 8.172 0.307 18300
2083 1 18 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.485 0.094 18300
2084 1 18 . 1 1 5 5 PHE CA C 5 55.510 55.510 56.741 -1.231 18300
2085 1 18 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.501 -0.636 18300
2086 1 18 . 1 1 5 5 PHE H H 5 7.862 7.862 8.486 -0.624 18300
2087 1 18 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.094 -0.453 18300
2088 1 18 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.457 0.305 18300
2089 1 18 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.965 -2.070 18300
2090 1 18 . 1 1 6 6 GLU H H 6 8.271 8.271 8.465 -0.194 18300
2091 1 18 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.974 -0.042 18300
2092 1 18 . 1 1 7 7 GLY H H 7 9.358 9.358 8.515 0.843 18300
2093 1 18 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.752 -0.120 18300
2094 1 18 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.802 0.103 18300
2095 1 18 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.689 1.984 18300
2096 1 18 . 1 1 8 8 GLU H H 8 7.811 7.811 7.707 0.104 18300
2097 1 18 . 1 1 9 9 SER HA H 9 4.969 4.969 5.447 -0.478 18300
2098 1 18 . 1 1 9 9 SER CA C 9 59.134 59.134 57.649 1.485 18300
2099 1 18 . 1 1 9 9 SER CB C 9 64.097 64.097 64.243 -0.146 18300
2100 1 18 . 1 1 9 9 SER H H 9 8.309 8.309 8.475 -0.166 18300
2101 1 18 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.869 0.518 18300
2102 1 18 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.100 -4.178 18300
2103 1 18 . 1 1 10 10 CYS CB C 10 51.011 51.011 30.313 20.698 18300
2104 1 18 . 1 1 10 10 CYS H H 10 8.540 8.540 9.125 -0.585 18300
2105 1 18 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.124 0.261 18300
2106 1 18 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.393 0.534 18300
2107 1 18 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.168 2.675 18300
2108 1 18 . 1 1 11 11 ASN H H 11 8.727 8.727 8.516 0.211 18300
2109 1 18 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.895 -0.245 18300
2110 1 18 . 1 1 12 12 VAL CA C 12 65.416 65.416 64.152 1.264 18300
2111 1 18 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.525 0.291 18300
2112 1 18 . 1 1 12 12 VAL H H 12 8.498 8.498 8.425 0.073 18300
2113 1 18 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.268 0.005 18300
2114 1 18 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.273 -3.274 18300
2115 1 18 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.601 0.634 18300
2116 1 18 . 1 1 13 13 GLN H H 13 7.749 7.749 7.689 0.060 18300
2117 1 18 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.727 0.105 18300
2118 1 18 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.722 0.474 18300
2119 1 18 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.571 1.567 18300
2120 1 18 . 1 1 14 14 PHE H H 14 8.178 8.178 6.913 1.265 18300
2121 1 18 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.169 -0.348 18300
2122 1 18 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.091 2.355 18300
2123 1 18 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.707 -1.676 18300
2124 1 18 . 1 1 15 15 TYR H H 15 8.605 8.605 7.515 1.090 18300
2125 1 18 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.447 -0.180 18300
2126 1 18 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.096 0.278 18300
2127 1 18 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.442 -1.449 18300
2128 1 18 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.585 0.256 18300
2129 1 18 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.106 -2.211 18300
2130 1 18 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.306 12.359 18300
2131 1 18 . 1 1 17 17 CYS H H 17 8.138 8.138 8.237 -0.099 18300
2132 1 18 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.602 -0.086 18300
2133 1 18 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.130 -4.129 18300
2134 1 18 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.475 13.234 18300
2135 1 18 . 1 1 18 18 CYS H H 18 9.645 9.645 8.558 1.087 18300
2136 1 18 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.486 -0.020 18300
2137 1 18 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.853 0.162 18300
2138 1 18 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.424 -0.332 18300
2139 1 18 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.311 0.505 18300
2140 1 18 . 1 1 20 20 GLY H H 20 8.510 8.510 8.752 -0.242 18300
2141 1 18 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.444 0.160 18300
2142 1 18 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.355 -1.445 18300
2143 1 18 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.118 0.806 18300
2144 1 18 . 1 1 21 21 LEU H H 21 7.616 7.616 7.973 -0.357 18300
2145 1 18 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.375 1.905 18300
2146 1 18 . 1 1 22 22 GLY H H 22 8.351 8.351 8.012 0.339 18300
2147 1 18 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.705 -0.778 18300
2148 1 18 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.414 -2.650 18300
2149 1 18 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.465 -1.205 18300
2150 1 18 . 1 1 23 23 LEU H H 23 7.695 7.695 7.842 -0.147 18300
2151 1 18 . 1 1 24 24 THR HA H 24 4.370 4.370 4.599 -0.229 18300
2152 1 18 . 1 1 24 24 THR CA C 24 60.616 60.616 60.205 0.411 18300
2153 1 18 . 1 1 24 24 THR CB C 24 70.621 70.621 71.919 -1.298 18300
2154 1 18 . 1 1 24 24 THR H H 24 9.043 9.043 8.859 0.184 18300
2155 1 18 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.230 -0.533 18300
2156 1 18 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.357 -3.529 18300
2157 1 18 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.490 12.899 18300
2158 1 18 . 1 1 25 25 CYS H H 25 8.099 8.099 8.783 -0.684 18300
2159 1 18 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.521 0.107 18300
2160 1 18 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.222 -2.231 18300
2161 1 18 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.897 0.104 18300
2162 1 18 . 1 1 26 26 ILE H H 26 8.555 8.555 8.843 -0.288 18300
2163 1 18 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.415 0.128 18300
2164 1 18 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.346 0.984 18300
2165 1 18 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.435 1.415 18300
2166 1 18 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.084 1.991 18300
2167 1 18 . 1 1 28 28 GLY H H 28 7.880 7.880 8.326 -0.446 18300
2168 1 18 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.976 0.045 18300
2169 1 18 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.718 -0.811 18300
2170 1 18 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.799 -0.109 18300
2171 1 18 . 1 1 29 29 ASN H H 29 7.996 7.996 7.830 0.166 18300
2172 1 18 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.634 -0.280 18300
2173 1 18 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.726 -0.206 18300
2174 1 18 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.516 2.218 18300
2175 1 18 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.844 1.017 18300
2176 1 18 . 1 1 31 31 ASP CA C 31 52.483 52.483 53.026 -0.543 18300
2177 1 18 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.856 -2.828 18300
2178 1 18 . 1 1 31 31 ASP H H 31 8.148 8.148 7.989 0.159 18300
2179 1 18 . 1 1 32 32 GLY CA C 32 47.046 47.046 45.008 2.038 18300
2180 1 18 . 1 1 32 32 GLY H H 32 8.459 8.459 8.378 0.081 18300
2181 1 18 . 1 1 33 33 THR HA H 33 4.835 4.835 5.132 -0.297 18300
2182 1 18 . 1 1 33 33 THR CA C 33 61.752 61.752 60.653 1.099 18300
2183 1 18 . 1 1 33 33 THR CB C 33 71.796 71.796 71.690 0.106 18300
2184 1 18 . 1 1 33 33 THR H H 33 8.667 8.667 8.240 0.427 18300
2185 1 18 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.285 -0.156 18300
2186 1 18 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.063 -2.714 18300
2187 1 18 . 1 1 34 34 CYS CB C 34 42.033 42.033 26.021 16.012 18300
2188 1 18 . 1 1 34 34 CYS H H 34 8.253 8.253 8.691 -0.438 18300
2189 1 18 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.805 0.051 18300
2190 1 18 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.105 0.620 18300
2191 1 18 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.818 -0.336 18300
2192 1 18 . 1 1 35 35 TYR H H 35 9.299 9.299 9.028 0.271 18300
2193 1 18 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.500 -0.673 18300
2194 1 18 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.987 0.254 18300
2195 1 18 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.707 -0.612 18300
2196 1 18 . 1 1 36 36 TYR H H 36 8.548 8.548 8.864 -0.316 18300
2197 1 19 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.251 -0.906 18300
2198 1 19 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.176 -0.691 18300
2199 1 19 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.691 13.611 18300
2200 1 19 . 1 1 3 3 CYS H H 3 7.453 7.453 7.592 -0.139 18300
2201 1 19 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.638 -0.069 18300
2202 1 19 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.677 0.023 18300
2203 1 19 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.818 2.227 18300
2204 1 19 . 1 1 4 4 ALA H H 4 8.479 8.479 8.093 0.386 18300
2205 1 19 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.482 0.097 18300
2206 1 19 . 1 1 5 5 PHE CA C 5 55.510 55.510 56.756 -1.246 18300
2207 1 19 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.500 -0.635 18300
2208 1 19 . 1 1 5 5 PHE H H 5 7.862 7.862 8.502 -0.640 18300
2209 1 19 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.105 -0.464 18300
2210 1 19 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.458 0.304 18300
2211 1 19 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.947 -2.052 18300
2212 1 19 . 1 1 6 6 GLU H H 6 8.271 8.271 8.475 -0.204 18300
2213 1 19 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.919 0.012 18300
2214 1 19 . 1 1 7 7 GLY H H 7 9.358 9.358 8.815 0.543 18300
2215 1 19 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.671 -0.039 18300
2216 1 19 . 1 1 8 8 GLU CA C 8 53.905 53.905 54.207 -0.302 18300
2217 1 19 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.938 1.734 18300
2218 1 19 . 1 1 8 8 GLU H H 8 7.811 7.811 7.595 0.216 18300
2219 1 19 . 1 1 9 9 SER HA H 9 4.969 4.969 5.438 -0.469 18300
2220 1 19 . 1 1 9 9 SER CA C 9 59.134 59.134 58.084 1.050 18300
2221 1 19 . 1 1 9 9 SER CB C 9 64.097 64.097 64.318 -0.221 18300
2222 1 19 . 1 1 9 9 SER H H 9 8.309 8.309 8.438 -0.129 18300
2223 1 19 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.804 0.583 18300
2224 1 19 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.250 -4.328 18300
2225 1 19 . 1 1 10 10 CYS CB C 10 51.011 51.011 30.344 20.667 18300
2226 1 19 . 1 1 10 10 CYS H H 10 8.540 8.540 9.014 -0.474 18300
2227 1 19 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.168 0.217 18300
2228 1 19 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.106 0.820 18300
2229 1 19 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.920 1.923 18300
2230 1 19 . 1 1 11 11 ASN H H 11 8.727 8.727 8.569 0.158 18300
2231 1 19 . 1 1 12 12 VAL HA H 12 3.650 3.650 4.069 -0.419 18300
2232 1 19 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.457 1.959 18300
2233 1 19 . 1 1 12 12 VAL CB C 12 31.816 31.816 30.426 1.390 18300
2234 1 19 . 1 1 12 12 VAL H H 12 8.498 8.498 8.633 -0.135 18300
2235 1 19 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.286 -0.013 18300
2236 1 19 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.239 -3.240 18300
2237 1 19 . 1 1 13 13 GLN CB C 13 30.235 30.235 30.205 0.030 18300
2238 1 19 . 1 1 13 13 GLN H H 13 7.749 7.749 7.649 0.100 18300
2239 1 19 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.735 0.097 18300
2240 1 19 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.775 0.421 18300
2241 1 19 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.548 1.589 18300
2242 1 19 . 1 1 14 14 PHE H H 14 8.178 8.178 6.896 1.282 18300
2243 1 19 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.160 -0.339 18300
2244 1 19 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.068 2.378 18300
2245 1 19 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.607 -1.576 18300
2246 1 19 . 1 1 15 15 TYR H H 15 8.605 8.605 7.519 1.086 18300
2247 1 19 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.452 -0.185 18300
2248 1 19 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.059 0.315 18300
2249 1 19 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.449 -1.456 18300
2250 1 19 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.578 0.263 18300
2251 1 19 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.137 -2.242 18300
2252 1 19 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.298 12.367 18300
2253 1 19 . 1 1 17 17 CYS H H 17 8.138 8.138 8.231 -0.093 18300
2254 1 19 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.601 -0.085 18300
2255 1 19 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.133 -4.132 18300
2256 1 19 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.480 13.229 18300
2257 1 19 . 1 1 18 18 CYS H H 18 9.645 9.645 8.552 1.093 18300
2258 1 19 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.487 -0.021 18300
2259 1 19 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.873 0.143 18300
2260 1 19 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.410 -0.318 18300
2261 1 19 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.211 0.606 18300
2262 1 19 . 1 1 20 20 GLY H H 20 8.510 8.510 8.700 -0.190 18300
2263 1 19 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.431 0.173 18300
2264 1 19 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.106 -1.196 18300
2265 1 19 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.148 0.776 18300
2266 1 19 . 1 1 21 21 LEU H H 21 7.616 7.616 8.016 -0.400 18300
2267 1 19 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.348 1.932 18300
2268 1 19 . 1 1 22 22 GLY H H 22 8.351 8.351 7.982 0.369 18300
2269 1 19 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.692 -0.765 18300
2270 1 19 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.289 -2.525 18300
2271 1 19 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.491 -1.231 18300
2272 1 19 . 1 1 23 23 LEU H H 23 7.695 7.695 7.829 -0.134 18300
2273 1 19 . 1 1 24 24 THR HA H 24 4.370 4.370 4.618 -0.248 18300
2274 1 19 . 1 1 24 24 THR CA C 24 60.616 60.616 60.435 0.181 18300
2275 1 19 . 1 1 24 24 THR CB C 24 70.621 70.621 71.984 -1.363 18300
2276 1 19 . 1 1 24 24 THR H H 24 9.043 9.043 8.740 0.303 18300
2277 1 19 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.257 -0.560 18300
2278 1 19 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.252 -3.425 18300
2279 1 19 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.397 12.992 18300
2280 1 19 . 1 1 25 25 CYS H H 25 8.099 8.099 8.769 -0.670 18300
2281 1 19 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.526 0.102 18300
2282 1 19 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.227 -2.236 18300
2283 1 19 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.944 0.057 18300
2284 1 19 . 1 1 26 26 ILE H H 26 8.555 8.555 8.860 -0.305 18300
2285 1 19 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.418 0.125 18300
2286 1 19 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.367 0.963 18300
2287 1 19 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.438 1.412 18300
2288 1 19 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.073 2.002 18300
2289 1 19 . 1 1 28 28 GLY H H 28 7.880 7.880 8.349 -0.469 18300
2290 1 19 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.980 0.041 18300
2291 1 19 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.643 -0.736 18300
2292 1 19 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.844 -0.154 18300
2293 1 19 . 1 1 29 29 ASN H H 29 7.996 7.996 7.843 0.153 18300
2294 1 19 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.623 -0.269 18300
2295 1 19 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.543 -0.023 18300
2296 1 19 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.630 2.104 18300
2297 1 19 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.971 0.890 18300
2298 1 19 . 1 1 31 31 ASP CA C 31 52.483 52.483 53.737 -1.254 18300
2299 1 19 . 1 1 31 31 ASP CB C 31 40.028 40.028 43.514 -3.486 18300
2300 1 19 . 1 1 31 31 ASP H H 31 8.148 8.148 8.012 0.136 18300
2301 1 19 . 1 1 32 32 GLY CA C 32 47.046 47.046 45.108 1.938 18300
2302 1 19 . 1 1 32 32 GLY H H 32 8.459 8.459 8.294 0.165 18300
2303 1 19 . 1 1 33 33 THR HA H 33 4.835 4.835 5.230 -0.395 18300
2304 1 19 . 1 1 33 33 THR CA C 33 61.752 61.752 61.019 0.733 18300
2305 1 19 . 1 1 33 33 THR CB C 33 71.796 71.796 71.714 0.082 18300
2306 1 19 . 1 1 33 33 THR H H 33 8.667 8.667 8.199 0.468 18300
2307 1 19 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.301 -0.172 18300
2308 1 19 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.185 -2.836 18300
2309 1 19 . 1 1 34 34 CYS CB C 34 42.033 42.033 26.091 15.942 18300
2310 1 19 . 1 1 34 34 CYS H H 34 8.253 8.253 8.667 -0.414 18300
2311 1 19 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.801 0.055 18300
2312 1 19 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.083 0.642 18300
2313 1 19 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.724 -0.242 18300
2314 1 19 . 1 1 35 35 TYR H H 35 9.299 9.299 9.039 0.260 18300
2315 1 19 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.522 -0.695 18300
2316 1 19 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.910 0.331 18300
2317 1 19 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.675 -0.580 18300
2318 1 19 . 1 1 36 36 TYR H H 36 8.548 8.548 8.868 -0.320 18300
2319 1 20 . 1 1 3 3 CYS HA H 3 4.345 4.345 5.359 -1.014 18300
2320 1 20 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.306 -0.821 18300
2321 1 20 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.587 13.715 18300
2322 1 20 . 1 1 3 3 CYS H H 3 7.453 7.453 7.580 -0.127 18300
2323 1 20 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.717 -0.148 18300
2324 1 20 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.536 0.164 18300
2325 1 20 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.835 2.210 18300
2326 1 20 . 1 1 4 4 ALA H H 4 8.479 8.479 8.382 0.097 18300
2327 1 20 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.780 -0.201 18300
2328 1 20 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.079 0.431 18300
2329 1 20 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.413 -0.548 18300
2330 1 20 . 1 1 5 5 PHE H H 5 7.862 7.862 7.572 0.290 18300
2331 1 20 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.017 -0.376 18300
2332 1 20 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.990 -0.228 18300
2333 1 20 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.743 -1.848 18300
2334 1 20 . 1 1 6 6 GLU H H 6 8.271 8.271 8.585 -0.314 18300
2335 1 20 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.962 -0.031 18300
2336 1 20 . 1 1 7 7 GLY H H 7 9.358 9.358 8.497 0.861 18300
2337 1 20 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.701 -0.069 18300
2338 1 20 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.679 0.226 18300
2339 1 20 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.305 2.366 18300
2340 1 20 . 1 1 8 8 GLU H H 8 7.811 7.811 7.701 0.110 18300
2341 1 20 . 1 1 9 9 SER HA H 9 4.969 4.969 5.457 -0.488 18300
2342 1 20 . 1 1 9 9 SER CA C 9 59.134 59.134 56.415 2.719 18300
2343 1 20 . 1 1 9 9 SER CB C 9 64.097 64.097 64.466 -0.368 18300
2344 1 20 . 1 1 9 9 SER H H 9 8.309 8.309 8.347 -0.038 18300
2345 1 20 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.807 0.580 18300
2346 1 20 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.154 -4.232 18300
2347 1 20 . 1 1 10 10 CYS CB C 10 51.011 51.011 30.442 20.569 18300
2348 1 20 . 1 1 10 10 CYS H H 10 8.540 8.540 8.970 -0.430 18300
2349 1 20 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.126 0.259 18300
2350 1 20 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.416 0.511 18300
2351 1 20 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.144 2.699 18300
2352 1 20 . 1 1 11 11 ASN H H 11 8.727 8.727 8.501 0.226 18300
2353 1 20 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.879 -0.229 18300
2354 1 20 . 1 1 12 12 VAL CA C 12 65.416 65.416 64.143 1.273 18300
2355 1 20 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.436 0.380 18300
2356 1 20 . 1 1 12 12 VAL H H 12 8.498 8.498 8.487 0.011 18300
2357 1 20 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.224 0.049 18300
2358 1 20 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.387 -3.388 18300
2359 1 20 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.692 0.543 18300
2360 1 20 . 1 1 13 13 GLN H H 13 7.749 7.749 7.679 0.070 18300
2361 1 20 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.694 0.138 18300
2362 1 20 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.676 0.520 18300
2363 1 20 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.081 2.056 18300
2364 1 20 . 1 1 14 14 PHE H H 14 8.178 8.178 6.832 1.346 18300
2365 1 20 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.178 -0.357 18300
2366 1 20 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.184 2.262 18300
2367 1 20 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.684 -1.653 18300
2368 1 20 . 1 1 15 15 TYR H H 15 8.605 8.605 7.535 1.070 18300
2369 1 20 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.487 -0.220 18300
2370 1 20 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.098 0.276 18300
2371 1 20 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.459 -1.466 18300
2372 1 20 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.679 0.162 18300
2373 1 20 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.199 -2.304 18300
2374 1 20 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.343 12.322 18300
2375 1 20 . 1 1 17 17 CYS H H 17 8.138 8.138 8.260 -0.122 18300
2376 1 20 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.683 -0.167 18300
2377 1 20 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.204 -4.203 18300
2378 1 20 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.621 13.088 18300
2379 1 20 . 1 1 18 18 CYS H H 18 9.645 9.645 8.691 0.954 18300
2380 1 20 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.498 -0.032 18300
2381 1 20 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.928 0.088 18300
2382 1 20 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.417 -0.325 18300
2383 1 20 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.181 0.635 18300
2384 1 20 . 1 1 20 20 GLY H H 20 8.510 8.510 8.700 -0.190 18300
2385 1 20 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.416 0.188 18300
2386 1 20 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.085 -1.175 18300
2387 1 20 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.218 0.707 18300
2388 1 20 . 1 1 21 21 LEU H H 21 7.616 7.616 8.063 -0.447 18300
2389 1 20 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.274 2.006 18300
2390 1 20 . 1 1 22 22 GLY H H 22 8.351 8.351 7.901 0.450 18300
2391 1 20 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.670 -0.743 18300
2392 1 20 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.278 -2.514 18300
2393 1 20 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.514 -1.254 18300
2394 1 20 . 1 1 23 23 LEU H H 23 7.695 7.695 7.848 -0.153 18300
2395 1 20 . 1 1 24 24 THR HA H 24 4.370 4.370 4.631 -0.261 18300
2396 1 20 . 1 1 24 24 THR CA C 24 60.616 60.616 60.488 0.128 18300
2397 1 20 . 1 1 24 24 THR CB C 24 70.621 70.621 71.555 -0.934 18300
2398 1 20 . 1 1 24 24 THR H H 24 9.043 9.043 8.763 0.280 18300
2399 1 20 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.220 -0.523 18300
2400 1 20 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.104 -3.276 18300
2401 1 20 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.284 13.105 18300
2402 1 20 . 1 1 25 25 CYS H H 25 8.099 8.099 8.834 -0.735 18300
2403 1 20 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.518 0.110 18300
2404 1 20 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.219 -2.228 18300
2405 1 20 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.924 0.077 18300
2406 1 20 . 1 1 26 26 ILE H H 26 8.555 8.555 8.792 -0.237 18300
2407 1 20 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.414 0.129 18300
2408 1 20 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.335 0.995 18300
2409 1 20 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.437 1.413 18300
2410 1 20 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.087 1.988 18300
2411 1 20 . 1 1 28 28 GLY H H 28 7.880 7.880 8.350 -0.470 18300
2412 1 20 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.965 0.056 18300
2413 1 20 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.789 -0.882 18300
2414 1 20 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.792 -0.103 18300
2415 1 20 . 1 1 29 29 ASN H H 29 7.996 7.996 7.865 0.131 18300
2416 1 20 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.592 -0.238 18300
2417 1 20 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.578 -0.058 18300
2418 1 20 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.606 2.128 18300
2419 1 20 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.887 0.974 18300
2420 1 20 . 1 1 31 31 ASP CA C 31 52.483 52.483 53.830 -1.347 18300
2421 1 20 . 1 1 31 31 ASP CB C 31 40.028 40.028 43.706 -3.678 18300
2422 1 20 . 1 1 31 31 ASP H H 31 8.148 8.148 8.016 0.132 18300
2423 1 20 . 1 1 32 32 GLY CA C 32 47.046 47.046 45.145 1.901 18300
2424 1 20 . 1 1 32 32 GLY H H 32 8.459 8.459 8.382 0.077 18300
2425 1 20 . 1 1 33 33 THR HA H 33 4.835 4.835 5.109 -0.274 18300
2426 1 20 . 1 1 33 33 THR CA C 33 61.752 61.752 60.615 1.137 18300
2427 1 20 . 1 1 33 33 THR CB C 33 71.796 71.796 71.623 0.173 18300
2428 1 20 . 1 1 33 33 THR H H 33 8.667 8.667 8.225 0.442 18300
2429 1 20 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.250 -0.121 18300
2430 1 20 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.178 -2.829 18300
2431 1 20 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.905 16.128 18300
2432 1 20 . 1 1 34 34 CYS H H 34 8.253 8.253 8.653 -0.400 18300
2433 1 20 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.809 0.047 18300
2434 1 20 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.065 0.660 18300
2435 1 20 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.749 -0.267 18300
2436 1 20 . 1 1 35 35 TYR H H 35 9.299 9.299 9.032 0.267 18300
2437 1 20 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.443 -0.616 18300
2438 1 20 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.999 0.242 18300
2439 1 20 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.798 -0.703 18300
2440 1 20 . 1 1 36 36 TYR H H 36 8.548 8.548 8.862 -0.314 18300
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 0 0.000 0.000 0.000 18300
2 1 1 "Average Difference" HA 39 0.413 0.083 0.410 18300
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18300
4 1 1 "Average Difference" CA 34 1.892 0.413 1.874 18300
5 1 1 "Average Difference" CB 29 7.067 -3.175 6.425 18300
6 1 1 "Average Difference" HN 30 0.481 -0.113 0.475 18300
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18300
8 1 2 "Average Difference" HA 39 0.421 0.096 0.415 18300
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18300
10 1 2 "Average Difference" CA 34 1.876 0.405 1.859 18300
11 1 2 "Average Difference" CB 29 7.073 -3.168 6.436 18300
12 1 2 "Average Difference" HN 30 0.478 -0.113 0.473 18300
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18300
14 1 3 "Average Difference" HA 39 0.411 0.084 0.407 18300
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18300
16 1 3 "Average Difference" CA 34 1.867 0.439 1.842 18300
17 1 3 "Average Difference" CB 29 7.096 -3.275 6.407 18300
18 1 3 "Average Difference" HN 30 0.472 -0.065 0.475 18300
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18300
20 1 4 "Average Difference" HA 39 0.414 0.084 0.411 18300
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18300
22 1 4 "Average Difference" CA 34 1.808 0.370 1.797 18300
23 1 4 "Average Difference" CB 29 7.024 -3.171 6.378 18300
24 1 4 "Average Difference" HN 30 0.462 -0.087 0.462 18300
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18300
26 1 5 "Average Difference" HA 39 0.423 0.100 0.417 18300
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18300
28 1 5 "Average Difference" CA 34 1.781 0.356 1.771 18300
29 1 5 "Average Difference" CB 29 7.011 -3.154 6.372 18300
30 1 5 "Average Difference" HN 30 0.474 -0.100 0.472 18300
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18300
32 1 6 "Average Difference" HA 39 0.407 0.074 0.406 18300
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18300
34 1 6 "Average Difference" CA 34 1.775 0.416 1.752 18300
35 1 6 "Average Difference" CB 29 7.047 -3.141 6.420 18300
36 1 6 "Average Difference" HN 30 0.482 -0.106 0.479 18300
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18300
38 1 7 "Average Difference" HA 39 0.424 0.087 0.421 18300
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18300
40 1 7 "Average Difference" CA 34 1.783 0.354 1.773 18300
41 1 7 "Average Difference" CB 29 6.934 -3.109 6.307 18300
42 1 7 "Average Difference" HN 30 0.496 -0.096 0.495 18300
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18300
44 1 8 "Average Difference" HA 39 0.405 0.069 0.405 18300
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18300
46 1 8 "Average Difference" CA 34 1.831 0.525 1.780 18300
47 1 8 "Average Difference" CB 29 7.006 -3.180 6.354 18300
48 1 8 "Average Difference" HN 30 0.490 -0.075 0.492 18300
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18300
50 1 9 "Average Difference" HA 39 0.417 0.098 0.410 18300
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18300
52 1 9 "Average Difference" CA 34 1.773 0.315 1.771 18300
53 1 9 "Average Difference" CB 29 6.999 -3.163 6.354 18300
54 1 9 "Average Difference" HN 30 0.479 -0.100 0.476 18300
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18300
56 1 10 "Average Difference" HA 39 0.406 0.080 0.403 18300
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18300
58 1 10 "Average Difference" CA 34 1.853 0.308 1.855 18300
59 1 10 "Average Difference" CB 29 7.032 -3.191 6.377 18300
60 1 10 "Average Difference" HN 30 0.476 -0.104 0.472 18300
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18300
62 1 11 "Average Difference" HA 39 0.418 0.094 0.413 18300
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18300
64 1 11 "Average Difference" CA 34 1.934 0.386 1.923 18300
65 1 11 "Average Difference" CB 29 6.927 -3.121 6.294 18300
66 1 11 "Average Difference" HN 30 0.490 -0.111 0.485 18300
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18300
68 1 12 "Average Difference" HA 39 0.407 0.081 0.405 18300
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18300
70 1 12 "Average Difference" CA 34 1.810 0.342 1.804 18300
71 1 12 "Average Difference" CB 29 7.051 -3.122 6.434 18300
72 1 12 "Average Difference" HN 30 0.509 -0.091 0.510 18300
73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18300
74 1 13 "Average Difference" HA 39 0.418 0.085 0.415 18300
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18300
76 1 13 "Average Difference" CA 34 1.780 0.374 1.766 18300
77 1 13 "Average Difference" CB 29 7.045 -3.135 6.421 18300
78 1 13 "Average Difference" HN 30 0.499 -0.077 0.501 18300
79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18300
80 1 14 "Average Difference" HA 39 0.426 0.077 0.424 18300
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18300
82 1 14 "Average Difference" CA 34 1.783 0.371 1.770 18300
83 1 14 "Average Difference" CB 29 7.061 -3.186 6.413 18300
84 1 14 "Average Difference" HN 30 0.473 -0.084 0.473 18300
85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18300
86 1 15 "Average Difference" HA 39 0.414 0.086 0.411 18300
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18300
88 1 15 "Average Difference" CA 34 1.824 0.381 1.810 18300
89 1 15 "Average Difference" CB 29 7.030 -3.140 6.401 18300
90 1 15 "Average Difference" HN 30 0.495 -0.078 0.498 18300
91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18300
92 1 16 "Average Difference" HA 39 0.414 0.086 0.410 18300
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18300
94 1 16 "Average Difference" CA 34 1.809 0.411 1.788 18300
95 1 16 "Average Difference" CB 29 7.015 -3.089 6.410 18300
96 1 16 "Average Difference" HN 30 0.513 -0.091 0.513 18300
97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18300
98 1 17 "Average Difference" HA 39 0.407 0.082 0.404 18300
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18300
100 1 17 "Average Difference" CA 34 1.816 0.397 1.799 18300
101 1 17 "Average Difference" CB 29 6.939 -3.079 6.329 18300
102 1 17 "Average Difference" HN 30 0.477 -0.098 0.475 18300
103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18300
104 1 18 "Average Difference" HA 39 0.416 0.077 0.414 18300
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18300
106 1 18 "Average Difference" CA 34 1.820 0.397 1.803 18300
107 1 18 "Average Difference" CB 29 6.993 -3.112 6.373 18300
108 1 18 "Average Difference" HN 30 0.496 -0.063 0.501 18300
109 1 19 "Average Difference" N 0 0.000 0.000 0.000 18300
110 1 19 "Average Difference" HA 39 0.422 0.093 0.417 18300
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18300
112 1 19 "Average Difference" CA 34 1.829 0.402 1.811 18300
113 1 19 "Average Difference" CB 29 6.977 -3.063 6.380 18300
114 1 19 "Average Difference" HN 30 0.487 -0.067 0.491 18300
115 1 20 "Average Difference" N 0 0.000 0.000 0.000 18300
116 1 20 "Average Difference" HA 39 0.421 0.096 0.415 18300
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18300
118 1 20 "Average Difference" CA 34 1.854 0.334 1.851 18300
119 1 20 "Average Difference" CB 29 7.000 -3.122 6.376 18300
120 1 20 "Average Difference" HN 30 0.483 -0.095 0.482 18300
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 18300
_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 3 3 CYS HA H 3 4.345 4.345 5.256 -0.911 18300
2 1 . 1 1 3 3 CYS CA C 3 53.485 53.485 54.486 -1.001 18300
3 1 . 1 1 3 3 CYS CB C 3 43.302 43.302 29.770 13.532 18300
4 1 . 1 1 3 3 CYS H H 3 7.453 7.453 7.575 -0.122 18300
5 1 . 1 1 4 4 ALA HA H 4 4.569 4.569 4.667 -0.098 18300
6 1 . 1 1 4 4 ALA CA C 4 50.700 50.700 50.627 0.073 18300
7 1 . 1 1 4 4 ALA CB C 4 23.045 23.045 20.944 2.101 18300
8 1 . 1 1 4 4 ALA H H 4 8.479 8.479 8.271 0.208 18300
9 1 . 1 1 5 5 PHE HA H 5 4.579 4.579 4.696 -0.117 18300
10 1 . 1 1 5 5 PHE CA C 5 55.510 55.510 55.559 -0.049 18300
11 1 . 1 1 5 5 PHE CB C 5 39.865 39.865 40.437 -0.572 18300
12 1 . 1 1 5 5 PHE H H 5 7.862 7.862 7.857 0.005 18300
13 1 . 1 1 6 6 GLU HA H 6 3.641 3.641 4.059 -0.418 18300
14 1 . 1 1 6 6 GLU CA C 6 57.762 57.762 57.899 -0.137 18300
15 1 . 1 1 6 6 GLU CB C 6 27.895 27.895 29.781 -1.886 18300
16 1 . 1 1 6 6 GLU H H 6 8.271 8.271 8.569 -0.298 18300
17 1 . 1 1 7 7 GLY CA C 7 44.931 44.931 44.923 0.008 18300
18 1 . 1 1 7 7 GLY H H 7 9.358 9.358 8.556 0.802 18300
19 1 . 1 1 8 8 GLU HA H 8 4.632 4.632 4.671 -0.039 18300
20 1 . 1 1 8 8 GLU CA C 8 53.905 53.905 53.960 -0.055 18300
21 1 . 1 1 8 8 GLU CB C 8 33.672 33.672 31.447 2.225 18300
22 1 . 1 1 8 8 GLU H H 8 7.811 7.811 7.689 0.122 18300
23 1 . 1 1 9 9 SER HA H 9 4.969 4.969 5.350 -0.381 18300
24 1 . 1 1 9 9 SER CA C 9 59.134 59.134 57.509 1.625 18300
25 1 . 1 1 9 9 SER CB C 9 64.097 64.097 64.401 -0.304 18300
26 1 . 1 1 9 9 SER H H 9 8.309 8.309 8.368 -0.059 18300
27 1 . 1 1 10 10 CYS HA H 10 5.387 5.387 4.857 0.530 18300
28 1 . 1 1 10 10 CYS CA C 10 52.922 52.922 57.020 -4.098 18300
29 1 . 1 1 10 10 CYS CB C 10 51.011 51.011 29.955 21.056 18300
30 1 . 1 1 10 10 CYS H H 10 8.540 8.540 9.044 -0.504 18300
31 1 . 1 1 11 11 ASN HA H 11 5.385 5.385 5.127 0.258 18300
32 1 . 1 1 11 11 ASN CA C 11 52.927 52.927 52.425 0.502 18300
33 1 . 1 1 11 11 ASN CB C 11 42.843 42.843 40.308 2.535 18300
34 1 . 1 1 11 11 ASN H H 11 8.727 8.727 8.494 0.233 18300
35 1 . 1 1 12 12 VAL HA H 12 3.650 3.650 3.932 -0.282 18300
36 1 . 1 1 12 12 VAL CA C 12 65.416 65.416 63.748 1.668 18300
37 1 . 1 1 12 12 VAL CB C 12 31.816 31.816 31.232 0.584 18300
38 1 . 1 1 12 12 VAL H H 12 8.498 8.498 8.479 0.019 18300
39 1 . 1 1 13 13 GLN HA H 13 4.273 4.273 4.269 0.004 18300
40 1 . 1 1 13 13 GLN CA C 13 53.999 53.999 57.169 -3.170 18300
41 1 . 1 1 13 13 GLN CB C 13 30.235 30.235 29.770 0.465 18300
42 1 . 1 1 13 13 GLN H H 13 7.749 7.749 7.674 0.075 18300
43 1 . 1 1 14 14 PHE HA H 14 4.832 4.832 4.721 0.111 18300
44 1 . 1 1 14 14 PHE CA C 14 58.196 58.196 57.760 0.436 18300
45 1 . 1 1 14 14 PHE CB C 14 42.137 42.137 40.429 1.708 18300
46 1 . 1 1 14 14 PHE H H 14 8.178 8.178 6.905 1.273 18300
47 1 . 1 1 15 15 TYR HA H 15 4.821 4.821 5.152 -0.331 18300
48 1 . 1 1 15 15 TYR CA C 15 57.446 57.446 55.166 2.280 18300
49 1 . 1 1 15 15 TYR CB C 15 39.031 39.031 40.738 -1.707 18300
50 1 . 1 1 15 15 TYR H H 15 8.605 8.605 7.524 1.081 18300
51 1 . 1 1 16 16 PRO HA H 16 4.267 4.267 4.472 -0.205 18300
52 1 . 1 1 16 16 PRO CA C 16 62.374 62.374 62.107 0.267 18300
53 1 . 1 1 16 16 PRO CB C 16 31.993 31.993 33.466 -1.473 18300
54 1 . 1 1 17 17 CYS HA H 17 4.841 4.841 4.636 0.205 18300
55 1 . 1 1 17 17 CYS CA C 17 55.895 55.895 58.186 -2.291 18300
56 1 . 1 1 17 17 CYS CB C 17 40.665 40.665 28.317 12.348 18300
57 1 . 1 1 17 17 CYS H H 17 8.138 8.138 8.266 -0.128 18300
58 1 . 1 1 18 18 CYS HA H 18 4.516 4.516 4.657 -0.141 18300
59 1 . 1 1 18 18 CYS CA C 18 53.001 53.001 57.184 -4.183 18300
60 1 . 1 1 18 18 CYS CB C 18 38.709 38.709 25.568 13.141 18300
61 1 . 1 1 18 18 CYS H H 18 9.645 9.645 8.643 1.002 18300
62 1 . 1 1 19 19 PRO HA H 19 4.466 4.466 4.495 -0.029 18300
63 1 . 1 1 19 19 PRO CA C 19 63.016 63.016 62.893 0.123 18300
64 1 . 1 1 19 19 PRO CB C 19 32.092 32.092 32.428 -0.336 18300
65 1 . 1 1 20 20 GLY CA C 20 45.816 45.816 45.258 0.559 18300
66 1 . 1 1 20 20 GLY H H 20 8.510 8.510 8.731 -0.221 18300
67 1 . 1 1 21 21 LEU HA H 21 4.604 4.604 4.422 0.182 18300
68 1 . 1 1 21 21 LEU CA C 21 53.910 53.910 55.275 -1.365 18300
69 1 . 1 1 21 21 LEU CB C 21 43.924 43.924 43.160 0.764 18300
70 1 . 1 1 21 21 LEU H H 21 7.616 7.616 8.008 -0.392 18300
71 1 . 1 1 22 22 GLY CA C 22 46.280 46.280 44.318 1.962 18300
72 1 . 1 1 22 22 GLY H H 22 8.351 8.351 7.965 0.386 18300
73 1 . 1 1 23 23 LEU HA H 23 4.927 4.927 5.682 -0.755 18300
74 1 . 1 1 23 23 LEU CA C 23 50.764 50.764 53.317 -2.553 18300
75 1 . 1 1 23 23 LEU CB C 23 44.260 44.260 45.526 -1.266 18300
76 1 . 1 1 23 23 LEU H H 23 7.695 7.695 7.828 -0.133 18300
77 1 . 1 1 24 24 THR HA H 24 4.370 4.370 4.623 -0.253 18300
78 1 . 1 1 24 24 THR CA C 24 60.616 60.616 60.469 0.147 18300
79 1 . 1 1 24 24 THR CB C 24 70.621 70.621 71.759 -1.138 18300
80 1 . 1 1 24 24 THR H H 24 9.043 9.043 8.811 0.232 18300
81 1 . 1 1 25 25 CYS HA H 25 4.697 4.697 5.236 -0.538 18300
82 1 . 1 1 25 25 CYS CA C 25 54.828 54.828 58.201 -3.373 18300
83 1 . 1 1 25 25 CYS CB C 25 40.389 40.389 27.366 13.023 18300
84 1 . 1 1 25 25 CYS H H 25 8.099 8.099 8.799 -0.700 18300
85 1 . 1 1 26 26 ILE HA H 26 4.628 4.628 4.527 0.101 18300
86 1 . 1 1 26 26 ILE CA C 26 56.991 56.991 59.177 -2.186 18300
87 1 . 1 1 26 26 ILE CB C 26 41.001 41.001 40.951 0.050 18300
88 1 . 1 1 26 26 ILE H H 26 8.555 8.555 8.821 -0.266 18300
89 1 . 1 1 27 27 PRO HA H 27 4.543 4.543 4.404 0.139 18300
90 1 . 1 1 27 27 PRO CA C 27 64.330 64.330 63.454 0.876 18300
91 1 . 1 1 27 27 PRO CB C 27 33.850 33.850 32.419 1.431 18300
92 1 . 1 1 28 28 GLY CA C 28 47.075 47.075 45.128 1.947 18300
93 1 . 1 1 28 28 GLY H H 28 7.880 7.880 8.353 -0.473 18300
94 1 . 1 1 29 29 ASN HA H 29 5.021 5.021 4.990 0.031 18300
95 1 . 1 1 29 29 ASN CA C 29 50.907 50.907 51.755 -0.848 18300
96 1 . 1 1 29 29 ASN CB C 29 38.690 38.690 38.735 -0.045 18300
97 1 . 1 1 29 29 ASN H H 29 7.996 7.996 7.803 0.193 18300
98 1 . 1 1 30 30 PRO HA H 30 4.354 4.354 4.587 -0.233 18300
99 1 . 1 1 30 30 PRO CA C 30 63.520 63.520 63.640 -0.120 18300
100 1 . 1 1 30 30 PRO CB C 30 34.734 34.734 32.655 2.079 18300
101 1 . 1 1 31 31 ASP HA H 31 5.861 5.861 4.874 0.987 18300
102 1 . 1 1 31 31 ASP CA C 31 52.483 52.483 53.562 -1.079 18300
103 1 . 1 1 31 31 ASP CB C 31 40.028 40.028 42.645 -2.617 18300
104 1 . 1 1 31 31 ASP H H 31 8.148 8.148 7.850 0.298 18300
105 1 . 1 1 32 32 GLY CA C 32 47.046 47.046 44.947 2.099 18300
106 1 . 1 1 32 32 GLY H H 32 8.459 8.459 8.330 0.129 18300
107 1 . 1 1 33 33 THR HA H 33 4.835 4.835 5.105 -0.270 18300
108 1 . 1 1 33 33 THR CA C 33 61.752 61.752 60.938 0.814 18300
109 1 . 1 1 33 33 THR CB C 33 71.796 71.796 71.454 0.342 18300
110 1 . 1 1 33 33 THR H H 33 8.667 8.667 8.256 0.411 18300
111 1 . 1 1 34 34 CYS HA H 34 5.129 5.129 5.215 -0.086 18300
112 1 . 1 1 34 34 CYS CA C 34 56.349 56.349 59.241 -2.892 18300
113 1 . 1 1 34 34 CYS CB C 34 42.033 42.033 25.926 16.107 18300
114 1 . 1 1 34 34 CYS H H 34 8.253 8.253 8.646 -0.393 18300
115 1 . 1 1 35 35 TYR HA H 35 4.856 4.856 4.806 0.050 18300
116 1 . 1 1 35 35 TYR CA C 35 56.725 56.725 56.076 0.649 18300
117 1 . 1 1 35 35 TYR CB C 35 42.482 42.482 42.743 -0.261 18300
118 1 . 1 1 35 35 TYR H H 35 9.299 9.299 9.042 0.257 18300
119 1 . 1 1 36 36 TYR HA H 36 4.827 4.827 5.499 -0.672 18300
120 1 . 1 1 36 36 TYR CA C 36 58.241 58.241 57.955 0.286 18300
121 1 . 1 1 36 36 TYR CB C 36 39.095 39.095 39.784 -0.689 18300
122 1 . 1 1 36 36 TYR H H 36 8.548 8.548 8.865 -0.317 18300
stop_
save_