data_19880
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19880
_Entry.PDB_ID 2MN5
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 19880
_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 N N 3 117.561 117.561 117.761 -0.200 19880
2 1 1 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.324 -0.504 19880
3 1 1 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.329 -2.629 19880
4 1 1 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.325 20.326 19880
5 1 1 . 1 1 3 3 CYS H H 3 7.950 7.950 8.068 -0.118 19880
6 1 1 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.589 -0.084 19880
7 1 1 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.749 0.981 19880
8 1 1 . 1 1 4 4 PRO CB C 4 33.299 33.299 33.120 0.179 19880
9 1 1 . 1 1 5 5 THR N N 5 118.207 118.207 116.070 2.137 19880
10 1 1 . 1 1 5 5 THR HA H 5 4.814 4.814 4.659 0.155 19880
11 1 1 . 1 1 5 5 THR CA C 5 61.618 61.618 62.125 -0.507 19880
12 1 1 . 1 1 5 5 THR CB C 5 70.257 70.257 69.444 0.813 19880
13 1 1 . 1 1 5 5 THR H H 5 8.529 8.529 8.307 0.222 19880
14 1 1 . 1 1 6 6 ARG N N 6 123.211 123.211 126.425 -3.214 19880
15 1 1 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.473 0.055 19880
16 1 1 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.519 -0.588 19880
17 1 1 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.191 0.561 19880
18 1 1 . 1 1 6 6 ARG H H 6 7.693 7.693 8.435 -0.742 19880
19 1 1 . 1 1 7 7 ARG N N 7 121.558 121.558 120.572 0.986 19880
20 1 1 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.478 0.188 19880
21 1 1 . 1 1 7 7 ARG CA C 7 54.415 54.415 56.158 -1.743 19880
22 1 1 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.138 0.535 19880
23 1 1 . 1 1 7 7 ARG H H 7 8.450 8.450 8.433 0.017 19880
24 1 1 . 1 1 8 8 GLY N N 8 111.006 111.006 108.971 2.035 19880
25 1 1 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.158 1.495 19880
26 1 1 . 1 1 8 8 GLY H H 8 9.382 9.382 8.296 1.086 19880
27 1 1 . 1 1 9 9 LEU N N 9 119.202 119.202 120.350 -1.148 19880
28 1 1 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.085 -0.195 19880
29 1 1 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.427 1.327 19880
30 1 1 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.706 1.064 19880
31 1 1 . 1 1 9 9 LEU H H 9 8.215 8.215 7.920 0.295 19880
32 1 1 . 1 1 10 10 CYS N N 10 115.050 115.050 114.530 0.520 19880
33 1 1 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.446 -0.556 19880
34 1 1 . 1 1 10 10 CYS CA C 10 61.378 61.378 59.131 2.247 19880
35 1 1 . 1 1 10 10 CYS CB C 10 42.589 42.589 25.480 17.108 19880
36 1 1 . 1 1 10 10 CYS H H 10 9.282 9.282 8.065 1.217 19880
37 1 1 . 1 1 11 11 VAL N N 11 117.792 117.792 120.283 -2.491 19880
38 1 1 . 1 1 11 11 VAL HA H 11 3.771 3.771 3.979 -0.208 19880
39 1 1 . 1 1 11 11 VAL CA C 11 64.508 64.508 65.029 -0.521 19880
40 1 1 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.267 0.331 19880
41 1 1 . 1 1 11 11 VAL H H 11 7.315 7.315 7.888 -0.573 19880
42 1 1 . 1 1 12 12 THR N N 12 109.816 109.816 111.197 -1.381 19880
43 1 1 . 1 1 12 12 THR HA H 12 4.044 4.044 4.375 -0.331 19880
44 1 1 . 1 1 12 12 THR CA C 12 63.575 63.575 63.141 0.434 19880
45 1 1 . 1 1 12 12 THR CB C 12 69.400 69.400 69.184 0.215 19880
46 1 1 . 1 1 12 12 THR H H 12 8.214 8.214 7.701 0.513 19880
47 1 1 . 1 1 13 13 SER N N 13 114.455 114.455 117.499 -3.044 19880
48 1 1 . 1 1 13 13 SER HA H 13 4.607 4.607 4.526 0.081 19880
49 1 1 . 1 1 13 13 SER CA C 13 59.460 59.460 58.851 0.609 19880
50 1 1 . 1 1 13 13 SER CB C 13 64.586 64.586 63.587 0.999 19880
51 1 1 . 1 1 13 13 SER H H 13 7.511 7.511 8.332 -0.821 19880
52 1 1 . 1 1 14 14 GLY N N 14 109.125 109.125 108.677 0.448 19880
53 1 1 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.478 -0.154 19880
54 1 1 . 1 1 14 14 GLY H H 14 8.376 8.376 7.485 0.891 19880
55 1 1 . 1 1 15 15 LEU N N 15 120.782 120.782 119.751 1.031 19880
56 1 1 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.245 -0.309 19880
57 1 1 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.166 0.820 19880
58 1 1 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.120 -0.594 19880
59 1 1 . 1 1 15 15 LEU H H 15 8.469 8.469 8.541 -0.072 19880
60 1 1 . 1 1 16 16 THR N N 16 115.887 115.887 113.758 2.129 19880
61 1 1 . 1 1 16 16 THR HA H 16 3.602 3.602 3.970 -0.368 19880
62 1 1 . 1 1 16 16 THR CA C 16 67.196 67.196 66.246 0.950 19880
63 1 1 . 1 1 16 16 THR CB C 16 68.003 68.003 68.043 -0.040 19880
64 1 1 . 1 1 16 16 THR H H 16 8.487 8.487 8.270 0.217 19880
65 1 1 . 1 1 17 17 ALA N N 17 122.643 122.643 123.705 -1.062 19880
66 1 1 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.298 -0.284 19880
67 1 1 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.756 0.085 19880
68 1 1 . 1 1 17 17 ALA CB C 17 18.931 18.931 17.993 0.938 19880
69 1 1 . 1 1 17 17 ALA H H 17 7.609 7.609 7.629 -0.020 19880
70 1 1 . 1 1 18 18 CYS N N 18 118.252 118.252 118.576 -0.324 19880
71 1 1 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.249 0.004 19880
72 1 1 . 1 1 18 18 CYS CA C 18 58.453 58.453 60.971 -2.518 19880
73 1 1 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.258 12.388 19880
74 1 1 . 1 1 18 18 CYS H H 18 7.644 7.644 7.771 -0.127 19880
75 1 1 . 1 1 19 19 ARG N N 19 120.422 120.422 119.910 0.512 19880
76 1 1 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.102 -0.627 19880
77 1 1 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.533 1.019 19880
78 1 1 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.356 -0.555 19880
79 1 1 . 1 1 19 19 ARG H H 19 9.072 9.072 8.309 0.763 19880
80 1 1 . 1 1 20 20 ASN N N 20 117.466 117.466 117.259 0.207 19880
81 1 1 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.602 -0.390 19880
82 1 1 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.623 -0.012 19880
83 1 1 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.256 -1.001 19880
84 1 1 . 1 1 20 20 ASN H H 20 8.411 8.411 7.854 0.557 19880
85 1 1 . 1 1 21 21 HIS N N 21 120.420 120.420 120.581 -0.161 19880
86 1 1 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.457 -0.283 19880
87 1 1 . 1 1 21 21 HIS CA C 21 59.154 59.154 60.194 -1.040 19880
88 1 1 . 1 1 21 21 HIS CB C 21 31.588 31.588 29.979 1.609 19880
89 1 1 . 1 1 21 21 HIS H H 21 7.827 7.827 8.143 -0.316 19880
90 1 1 . 1 1 22 22 CYS N N 22 117.510 117.510 117.139 0.371 19880
91 1 1 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.222 -1.063 19880
92 1 1 . 1 1 22 22 CYS CA C 22 58.221 58.221 62.108 -3.888 19880
93 1 1 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.047 11.131 19880
94 1 1 . 1 1 22 22 CYS H H 22 8.500 8.500 7.924 0.576 19880
95 1 1 . 1 1 23 23 ARG N N 23 116.564 116.564 117.676 -1.112 19880
96 1 1 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.631 0.022 19880
97 1 1 . 1 1 23 23 ARG CA C 23 57.028 57.028 57.894 -0.866 19880
98 1 1 . 1 1 23 23 ARG CB C 23 30.655 30.655 31.025 -0.370 19880
99 1 1 . 1 1 23 23 ARG H H 23 7.985 7.985 7.574 0.411 19880
100 1 1 . 1 1 24 24 SER N N 24 116.727 116.727 113.519 3.208 19880
101 1 1 . 1 1 24 24 SER HA H 24 4.552 4.552 4.557 -0.005 19880
102 1 1 . 1 1 24 24 SER CA C 24 57.592 57.592 57.223 0.369 19880
103 1 1 . 1 1 24 24 SER CB C 24 65.284 65.284 65.467 -0.183 19880
104 1 1 . 1 1 24 24 SER H H 24 7.435 7.435 7.358 0.077 19880
105 1 1 . 1 1 25 25 CYS N N 25 121.909 121.909 123.157 -1.248 19880
106 1 1 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.442 0.194 19880
107 1 1 . 1 1 25 25 CYS CA C 25 56.614 56.614 59.062 -2.448 19880
108 1 1 . 1 1 25 25 CYS CB C 25 39.273 39.273 25.660 13.613 19880
109 1 1 . 1 1 25 25 CYS H H 25 9.000 9.000 8.722 0.278 19880
110 1 1 . 1 1 26 26 HIS N N 26 126.609 126.609 124.795 1.814 19880
111 1 1 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.127 -0.175 19880
112 1 1 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.216 0.506 19880
113 1 1 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.826 0.274 19880
114 1 1 . 1 1 26 26 HIS H H 26 9.255 9.255 8.716 0.539 19880
115 1 1 . 1 1 27 27 ARG N N 27 122.033 122.033 121.643 0.390 19880
116 1 1 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.297 -0.275 19880
117 1 1 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.513 1.964 19880
118 1 1 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.202 -0.322 19880
119 1 1 . 1 1 27 27 ARG H H 27 8.314 8.314 8.183 0.131 19880
120 1 1 . 1 1 28 28 GLY N N 28 119.213 119.213 113.952 5.261 19880
121 1 1 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.436 -0.464 19880
122 1 1 . 1 1 28 28 GLY H H 28 8.495 8.495 8.153 0.342 19880
123 1 1 . 1 1 29 29 ASP N N 29 121.258 121.258 118.139 3.119 19880
124 1 1 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.567 -0.303 19880
125 1 1 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.640 1.806 19880
126 1 1 . 1 1 29 29 ASP CB C 29 40.438 40.438 40.894 -0.456 19880
127 1 1 . 1 1 29 29 ASP H H 29 8.646 8.646 8.572 0.074 19880
128 1 1 . 1 1 30 30 VAL N N 30 112.703 112.703 117.606 -4.903 19880
129 1 1 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.271 -0.048 19880
130 1 1 . 1 1 30 30 VAL CA C 30 61.407 61.407 61.609 -0.202 19880
131 1 1 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.093 -0.188 19880
132 1 1 . 1 1 30 30 VAL H H 30 8.026 8.026 7.685 0.341 19880
133 1 1 . 1 1 31 31 GLY N N 31 109.481 109.481 106.969 2.512 19880
134 1 1 . 1 1 31 31 GLY CA C 31 44.366 44.366 44.923 -0.557 19880
135 1 1 . 1 1 31 31 GLY H H 31 7.511 7.511 7.536 -0.025 19880
136 1 1 . 1 1 32 32 CYS N N 32 121.673 121.673 120.228 1.445 19880
137 1 1 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.179 -0.234 19880
138 1 1 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.677 -4.496 19880
139 1 1 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.416 14.880 19880
140 1 1 . 1 1 32 32 CYS H H 32 8.554 8.554 8.580 -0.026 19880
141 1 1 . 1 1 33 33 VAL N N 33 119.401 119.401 117.007 2.394 19880
142 1 1 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.917 -0.122 19880
143 1 1 . 1 1 33 33 VAL CA C 33 59.311 59.311 59.646 -0.335 19880
144 1 1 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.235 1.245 19880
145 1 1 . 1 1 33 33 VAL H H 33 9.025 9.025 9.049 -0.024 19880
146 1 1 . 1 1 34 34 ARG N N 34 120.394 120.394 116.354 4.040 19880
147 1 1 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.768 -0.069 19880
148 1 1 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.340 0.852 19880
149 1 1 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.295 -0.157 19880
150 1 1 . 1 1 34 34 ARG H H 34 8.350 8.350 8.555 -0.205 19880
151 1 1 . 1 1 35 35 CYS N N 35 118.098 118.098 119.069 -0.971 19880
152 1 1 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.469 0.582 19880
153 1 1 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.640 -2.363 19880
154 1 1 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.443 13.110 19880
155 1 1 . 1 1 35 35 CYS H H 35 8.567 8.567 9.229 -0.662 19880
156 1 1 . 1 1 36 36 SER N N 36 114.009 114.009 115.901 -1.892 19880
157 1 1 . 1 1 36 36 SER HA H 36 4.326 4.326 4.518 -0.192 19880
158 1 1 . 1 1 36 36 SER CA C 36 60.945 60.945 59.991 0.954 19880
159 1 1 . 1 1 36 36 SER CB C 36 64.743 64.743 63.816 0.927 19880
160 1 1 . 1 1 36 36 SER H H 36 7.669 7.669 8.379 -0.710 19880
161 1 1 . 1 1 37 37 ASN N N 37 117.050 117.050 116.182 0.868 19880
162 1 1 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.911 -0.503 19880
163 1 1 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.379 -0.293 19880
164 1 1 . 1 1 37 37 ASN CB C 37 41.374 41.374 41.165 0.209 19880
165 1 1 . 1 1 37 37 ASN H H 37 7.755 7.755 7.497 0.258 19880
166 1 1 . 1 1 38 38 ALA N N 38 123.735 123.735 120.284 3.451 19880
167 1 1 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.941 0.221 19880
168 1 1 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.593 0.541 19880
169 1 1 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.015 -2.821 19880
170 1 1 . 1 1 38 38 ALA H H 38 9.323 9.323 8.302 1.021 19880
171 1 1 . 1 1 39 39 GLN N N 39 116.531 116.531 116.494 0.037 19880
172 1 1 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.804 -0.491 19880
173 1 1 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.230 0.519 19880
174 1 1 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.242 1.575 19880
175 1 1 . 1 1 39 39 GLN H H 39 8.746 8.746 8.806 -0.060 19880
176 1 1 . 1 1 40 40 CYS N N 40 122.074 122.074 120.502 1.572 19880
177 1 1 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.381 0.168 19880
178 1 1 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.900 -3.487 19880
179 1 1 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.516 13.386 19880
180 1 1 . 1 1 40 40 CYS H H 40 8.536 8.536 8.710 -0.174 19880
181 1 1 . 1 1 41 41 THR N N 41 117.753 117.753 115.917 1.836 19880
182 1 1 . 1 1 41 41 THR HA H 41 4.641 4.641 4.607 0.034 19880
183 1 1 . 1 1 41 41 THR CA C 41 60.550 60.550 60.147 0.403 19880
184 1 1 . 1 1 41 41 THR CB C 41 71.033 71.033 71.201 -0.168 19880
185 1 1 . 1 1 41 41 THR H H 41 9.779 9.779 9.075 0.704 19880
186 1 1 . 1 1 42 42 GLY N N 42 105.809 105.809 107.881 -2.072 19880
187 1 1 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.873 -0.858 19880
188 1 1 . 1 1 42 42 GLY H H 42 8.247 8.247 8.151 0.096 19880
189 1 1 . 1 1 43 43 PHE N N 43 123.293 123.293 120.891 2.402 19880
190 1 1 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.563 -0.265 19880
191 1 1 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.454 0.742 19880
192 1 1 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.491 -0.841 19880
193 1 1 . 1 1 43 43 PHE H H 43 8.707 8.707 8.897 -0.190 19880
194 1 1 . 1 1 44 44 LEU N N 44 120.771 120.771 117.364 3.407 19880
195 1 1 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.395 -0.547 19880
196 1 1 . 1 1 44 44 LEU CB C 44 40.386 40.386 42.837 -2.451 19880
197 1 1 . 1 1 44 44 LEU H H 44 8.645 8.645 7.840 0.805 19880
198 1 1 . 1 1 45 45 GLY N N 45 107.545 107.545 107.729 -0.184 19880
199 1 1 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.775 1.536 19880
200 1 1 . 1 1 45 45 GLY H H 45 7.831 7.831 7.597 0.234 19880
201 1 1 . 1 1 46 46 THR N N 46 104.485 104.485 109.492 -5.007 19880
202 1 1 . 1 1 46 46 THR HA H 46 3.901 3.901 4.204 -0.303 19880
203 1 1 . 1 1 46 46 THR CA C 46 62.180 62.180 62.926 -0.746 19880
204 1 1 . 1 1 46 46 THR CB C 46 70.021 70.021 69.079 0.942 19880
205 1 1 . 1 1 46 46 THR H H 46 6.823 6.823 7.830 -1.007 19880
206 1 1 . 1 1 47 47 THR N N 47 123.300 123.300 118.195 5.105 19880
207 1 1 . 1 1 47 47 THR HA H 47 4.371 4.371 5.086 -0.715 19880
208 1 1 . 1 1 47 47 THR CA C 47 62.843 62.843 61.682 1.161 19880
209 1 1 . 1 1 47 47 THR CB C 47 70.176 70.176 72.481 -2.305 19880
210 1 1 . 1 1 47 47 THR H H 47 8.763 8.763 7.718 1.045 19880
211 1 1 . 1 1 48 48 CYS N N 48 128.024 128.024 124.297 3.727 19880
212 1 1 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.947 0.026 19880
213 1 1 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.115 -1.131 19880
214 1 1 . 1 1 48 48 CYS CB C 48 36.282 36.282 28.918 7.364 19880
215 1 1 . 1 1 48 48 CYS H H 48 9.276 9.276 8.890 0.386 19880
216 1 1 . 1 1 49 49 THR N N 49 131.810 131.810 121.162 10.648 19880
217 1 1 . 1 1 49 49 THR HA H 49 4.364 4.364 4.737 -0.373 19880
218 1 1 . 1 1 49 49 THR CA C 49 61.871 61.871 62.060 -0.189 19880
219 1 1 . 1 1 49 49 THR CB C 49 69.789 69.789 72.959 -3.170 19880
220 1 1 . 1 1 49 49 THR H H 49 9.194 9.194 8.794 0.400 19880
221 1 1 . 1 1 50 50 CYS N N 50 123.835 123.835 121.758 2.077 19880
222 1 1 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.125 -0.090 19880
223 1 1 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.225 -6.345 19880
224 1 1 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.808 5.126 19880
225 1 1 . 1 1 50 50 CYS H H 50 8.879 8.879 8.616 0.263 19880
226 1 1 . 1 1 51 51 ILE N N 51 123.986 123.986 123.101 0.885 19880
227 1 1 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.430 -0.287 19880
228 1 1 . 1 1 51 51 ILE CA C 51 59.619 59.619 58.989 0.630 19880
229 1 1 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.748 -0.368 19880
230 1 1 . 1 1 51 51 ILE H H 51 8.098 8.098 8.927 -0.829 19880
231 1 1 . 1 1 52 52 ASN N N 52 126.122 126.122 125.821 0.301 19880
232 1 1 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.787 -0.071 19880
233 1 1 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.900 0.991 19880
234 1 1 . 1 1 52 52 ASN CB C 52 37.913 37.913 37.633 0.280 19880
235 1 1 . 1 1 52 52 ASN H H 52 8.323 8.323 8.634 -0.311 19880
236 1 1 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.451 -0.144 19880
237 1 1 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.605 0.429 19880
238 1 1 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.387 3.473 19880
239 1 1 . 1 1 54 54 CYS N N 54 123.090 123.090 117.769 5.321 19880
240 1 1 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.033 0.703 19880
241 1 1 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.794 -2.644 19880
242 1 1 . 1 1 54 54 CYS CB C 54 46.154 46.154 27.029 19.125 19880
243 1 1 . 1 1 54 54 CYS H H 54 8.865 8.865 8.422 0.443 19880
244 1 1 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.431 -0.145 19880
245 1 1 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.711 -0.453 19880
246 1 1 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.250 0.200 19880
247 1 1 . 1 1 56 56 ARG N N 56 117.289 117.289 117.516 -0.227 19880
248 1 1 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.353 0.132 19880
249 1 1 . 1 1 56 56 ARG CA C 56 56.121 56.121 55.681 0.440 19880
250 1 1 . 1 1 56 56 ARG CB C 56 30.539 30.539 30.706 -0.167 19880
251 1 1 . 1 1 56 56 ARG H H 56 7.902 7.902 8.426 -0.524 19880
252 1 2 . 1 1 3 3 CYS N N 3 117.561 117.561 115.857 1.704 19880
253 1 2 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.249 -0.429 19880
254 1 2 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.489 -2.789 19880
255 1 2 . 1 1 3 3 CYS CB C 3 46.651 46.651 27.064 19.587 19880
256 1 2 . 1 1 3 3 CYS H H 3 7.950 7.950 8.009 -0.059 19880
257 1 2 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.773 -0.268 19880
258 1 2 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.967 0.763 19880
259 1 2 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.565 0.734 19880
260 1 2 . 1 1 5 5 THR N N 5 118.207 118.207 115.250 2.957 19880
261 1 2 . 1 1 5 5 THR HA H 5 4.814 4.814 4.681 0.133 19880
262 1 2 . 1 1 5 5 THR CA C 5 61.618 61.618 61.580 0.038 19880
263 1 2 . 1 1 5 5 THR CB C 5 70.257 70.257 70.236 0.021 19880
264 1 2 . 1 1 5 5 THR H H 5 8.529 8.529 8.337 0.192 19880
265 1 2 . 1 1 6 6 ARG N N 6 123.211 123.211 125.201 -1.990 19880
266 1 2 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.594 -0.066 19880
267 1 2 . 1 1 6 6 ARG CA C 6 54.931 54.931 54.626 0.305 19880
268 1 2 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.493 0.259 19880
269 1 2 . 1 1 6 6 ARG H H 6 7.693 7.693 8.526 -0.833 19880
270 1 2 . 1 1 7 7 ARG N N 7 121.558 121.558 123.287 -1.729 19880
271 1 2 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.494 0.172 19880
272 1 2 . 1 1 7 7 ARG CA C 7 54.415 54.415 54.359 0.056 19880
273 1 2 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.423 0.250 19880
274 1 2 . 1 1 7 7 ARG H H 7 8.450 8.450 8.046 0.404 19880
275 1 2 . 1 1 8 8 GLY N N 8 111.006 111.006 108.074 2.932 19880
276 1 2 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.639 1.014 19880
277 1 2 . 1 1 8 8 GLY H H 8 9.382 9.382 8.608 0.774 19880
278 1 2 . 1 1 9 9 LEU N N 9 119.202 119.202 118.598 0.604 19880
279 1 2 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.050 -0.160 19880
280 1 2 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.758 0.997 19880
281 1 2 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.609 1.161 19880
282 1 2 . 1 1 9 9 LEU H H 9 8.215 8.215 8.051 0.164 19880
283 1 2 . 1 1 10 10 CYS N N 10 115.050 115.050 114.402 0.648 19880
284 1 2 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.243 -0.353 19880
285 1 2 . 1 1 10 10 CYS CA C 10 61.378 61.378 59.985 1.393 19880
286 1 2 . 1 1 10 10 CYS CB C 10 42.589 42.589 24.877 17.712 19880
287 1 2 . 1 1 10 10 CYS H H 10 9.282 9.282 8.338 0.944 19880
288 1 2 . 1 1 11 11 VAL N N 11 117.792 117.792 119.815 -2.023 19880
289 1 2 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.261 -0.490 19880
290 1 2 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.272 0.236 19880
291 1 2 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.087 0.511 19880
292 1 2 . 1 1 11 11 VAL H H 11 7.315 7.315 8.223 -0.908 19880
293 1 2 . 1 1 12 12 THR N N 12 109.816 109.816 111.409 -1.593 19880
294 1 2 . 1 1 12 12 THR HA H 12 4.044 4.044 4.432 -0.388 19880
295 1 2 . 1 1 12 12 THR CA C 12 63.575 63.575 63.725 -0.150 19880
296 1 2 . 1 1 12 12 THR CB C 12 69.400 69.400 69.784 -0.384 19880
297 1 2 . 1 1 12 12 THR H H 12 8.214 8.214 7.767 0.447 19880
298 1 2 . 1 1 13 13 SER N N 13 114.455 114.455 114.788 -0.333 19880
299 1 2 . 1 1 13 13 SER HA H 13 4.607 4.607 4.667 -0.060 19880
300 1 2 . 1 1 13 13 SER CA C 13 59.460 59.460 58.954 0.506 19880
301 1 2 . 1 1 13 13 SER CB C 13 64.586 64.586 66.166 -1.580 19880
302 1 2 . 1 1 13 13 SER H H 13 7.511 7.511 7.896 -0.385 19880
303 1 2 . 1 1 14 14 GLY N N 14 109.125 109.125 109.486 -0.361 19880
304 1 2 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.521 -0.197 19880
305 1 2 . 1 1 14 14 GLY H H 14 8.376 8.376 8.139 0.237 19880
306 1 2 . 1 1 15 15 LEU N N 15 120.782 120.782 121.294 -0.512 19880
307 1 2 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.160 -0.224 19880
308 1 2 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.108 0.878 19880
309 1 2 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.049 -0.523 19880
310 1 2 . 1 1 15 15 LEU H H 15 8.469 8.469 8.676 -0.207 19880
311 1 2 . 1 1 16 16 THR N N 16 115.887 115.887 114.190 1.697 19880
312 1 2 . 1 1 16 16 THR HA H 16 3.602 3.602 3.933 -0.331 19880
313 1 2 . 1 1 16 16 THR CA C 16 67.196 67.196 66.434 0.762 19880
314 1 2 . 1 1 16 16 THR CB C 16 68.003 68.003 68.295 -0.292 19880
315 1 2 . 1 1 16 16 THR H H 16 8.487 8.487 8.263 0.224 19880
316 1 2 . 1 1 17 17 ALA N N 17 122.643 122.643 123.407 -0.764 19880
317 1 2 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.347 -0.333 19880
318 1 2 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.560 0.281 19880
319 1 2 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.099 0.832 19880
320 1 2 . 1 1 17 17 ALA H H 17 7.609 7.609 7.660 -0.051 19880
321 1 2 . 1 1 18 18 CYS N N 18 118.252 118.252 118.711 -0.459 19880
322 1 2 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.208 0.045 19880
323 1 2 . 1 1 18 18 CYS CA C 18 58.453 58.453 61.083 -2.630 19880
324 1 2 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.205 12.441 19880
325 1 2 . 1 1 18 18 CYS H H 18 7.644 7.644 7.752 -0.108 19880
326 1 2 . 1 1 19 19 ARG N N 19 120.422 120.422 120.276 0.146 19880
327 1 2 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.076 -0.601 19880
328 1 2 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.623 0.929 19880
329 1 2 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.366 -0.565 19880
330 1 2 . 1 1 19 19 ARG H H 19 9.072 9.072 8.493 0.579 19880
331 1 2 . 1 1 20 20 ASN N N 20 117.466 117.466 115.886 1.580 19880
332 1 2 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.537 -0.325 19880
333 1 2 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.304 0.307 19880
334 1 2 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.129 -0.874 19880
335 1 2 . 1 1 20 20 ASN H H 20 8.411 8.411 7.897 0.514 19880
336 1 2 . 1 1 21 21 HIS N N 21 120.420 120.420 118.461 1.959 19880
337 1 2 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.518 -0.344 19880
338 1 2 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.057 0.097 19880
339 1 2 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.986 0.602 19880
340 1 2 . 1 1 21 21 HIS H H 21 7.827 7.827 7.804 0.023 19880
341 1 2 . 1 1 22 22 CYS N N 22 117.510 117.510 117.550 -0.040 19880
342 1 2 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.305 -1.146 19880
343 1 2 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.372 -3.151 19880
344 1 2 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.141 11.037 19880
345 1 2 . 1 1 22 22 CYS H H 22 8.500 8.500 7.776 0.724 19880
346 1 2 . 1 1 23 23 ARG N N 23 116.564 116.564 118.377 -1.813 19880
347 1 2 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.569 0.084 19880
348 1 2 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.042 0.986 19880
349 1 2 . 1 1 23 23 ARG CB C 23 30.655 30.655 29.829 0.826 19880
350 1 2 . 1 1 23 23 ARG H H 23 7.985 7.985 8.223 -0.238 19880
351 1 2 . 1 1 24 24 SER N N 24 116.727 116.727 112.621 4.106 19880
352 1 2 . 1 1 24 24 SER HA H 24 4.552 4.552 4.600 -0.048 19880
353 1 2 . 1 1 24 24 SER CA C 24 57.592 57.592 56.266 1.326 19880
354 1 2 . 1 1 24 24 SER CB C 24 65.284 65.284 65.213 0.071 19880
355 1 2 . 1 1 24 24 SER H H 24 7.435 7.435 7.416 0.019 19880
356 1 2 . 1 1 25 25 CYS N N 25 121.909 121.909 120.886 1.023 19880
357 1 2 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.890 -0.254 19880
358 1 2 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.170 -1.556 19880
359 1 2 . 1 1 25 25 CYS CB C 25 39.273 39.273 25.990 13.283 19880
360 1 2 . 1 1 25 25 CYS H H 25 9.000 9.000 8.866 0.134 19880
361 1 2 . 1 1 26 26 HIS N N 26 126.609 126.609 120.755 5.854 19880
362 1 2 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.335 -0.383 19880
363 1 2 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.362 0.360 19880
364 1 2 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.737 0.363 19880
365 1 2 . 1 1 26 26 HIS H H 26 9.255 9.255 8.806 0.449 19880
366 1 2 . 1 1 27 27 ARG N N 27 122.033 122.033 120.575 1.458 19880
367 1 2 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.410 -0.388 19880
368 1 2 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.313 2.164 19880
369 1 2 . 1 1 27 27 ARG CB C 27 29.880 29.880 31.119 -1.238 19880
370 1 2 . 1 1 27 27 ARG H H 27 8.314 8.314 8.252 0.062 19880
371 1 2 . 1 1 28 28 GLY N N 28 119.213 119.213 112.733 6.480 19880
372 1 2 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.526 -0.555 19880
373 1 2 . 1 1 28 28 GLY H H 28 8.495 8.495 7.962 0.533 19880
374 1 2 . 1 1 29 29 ASP N N 29 121.258 121.258 119.255 2.003 19880
375 1 2 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.636 -0.372 19880
376 1 2 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.079 2.367 19880
377 1 2 . 1 1 29 29 ASP CB C 29 40.438 40.438 42.068 -1.630 19880
378 1 2 . 1 1 29 29 ASP H H 29 8.646 8.646 8.341 0.305 19880
379 1 2 . 1 1 30 30 VAL N N 30 112.703 112.703 117.672 -4.969 19880
380 1 2 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.235 -0.012 19880
381 1 2 . 1 1 30 30 VAL CA C 30 61.407 61.407 62.029 -0.622 19880
382 1 2 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.567 -0.662 19880
383 1 2 . 1 1 30 30 VAL H H 30 8.026 8.026 7.690 0.336 19880
384 1 2 . 1 1 31 31 GLY N N 31 109.481 109.481 107.369 2.112 19880
385 1 2 . 1 1 31 31 GLY CA C 31 44.366 44.366 44.960 -0.594 19880
386 1 2 . 1 1 31 31 GLY H H 31 7.511 7.511 7.615 -0.104 19880
387 1 2 . 1 1 32 32 CYS N N 32 121.673 121.673 120.118 1.555 19880
388 1 2 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.059 -0.113 19880
389 1 2 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.499 -4.318 19880
390 1 2 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.674 14.621 19880
391 1 2 . 1 1 32 32 CYS H H 32 8.554 8.554 8.466 0.088 19880
392 1 2 . 1 1 33 33 VAL N N 33 119.401 119.401 118.692 0.709 19880
393 1 2 . 1 1 33 33 VAL HA H 33 4.795 4.795 5.050 -0.255 19880
394 1 2 . 1 1 33 33 VAL CA C 33 59.311 59.311 59.845 -0.534 19880
395 1 2 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.747 0.733 19880
396 1 2 . 1 1 33 33 VAL H H 33 9.025 9.025 8.870 0.155 19880
397 1 2 . 1 1 34 34 ARG N N 34 120.394 120.394 115.895 4.499 19880
398 1 2 . 1 1 34 34 ARG HA H 34 4.699 4.699 5.006 -0.307 19880
399 1 2 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.203 0.989 19880
400 1 2 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.203 -0.065 19880
401 1 2 . 1 1 34 34 ARG H H 34 8.350 8.350 8.499 -0.149 19880
402 1 2 . 1 1 35 35 CYS N N 35 118.098 118.098 119.596 -1.498 19880
403 1 2 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.531 0.520 19880
404 1 2 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.535 -2.258 19880
405 1 2 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.869 12.684 19880
406 1 2 . 1 1 35 35 CYS H H 35 8.567 8.567 9.020 -0.453 19880
407 1 2 . 1 1 36 36 SER N N 36 114.009 114.009 115.938 -1.929 19880
408 1 2 . 1 1 36 36 SER HA H 36 4.326 4.326 4.503 -0.177 19880
409 1 2 . 1 1 36 36 SER CA C 36 60.945 60.945 59.614 1.331 19880
410 1 2 . 1 1 36 36 SER CB C 36 64.743 64.743 63.928 0.815 19880
411 1 2 . 1 1 36 36 SER H H 36 7.669 7.669 8.415 -0.746 19880
412 1 2 . 1 1 37 37 ASN N N 37 117.050 117.050 116.374 0.676 19880
413 1 2 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.840 -0.432 19880
414 1 2 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.645 -0.559 19880
415 1 2 . 1 1 37 37 ASN CB C 37 41.374 41.374 40.561 0.813 19880
416 1 2 . 1 1 37 37 ASN H H 37 7.755 7.755 7.485 0.270 19880
417 1 2 . 1 1 38 38 ALA N N 38 123.735 123.735 120.221 3.514 19880
418 1 2 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.921 0.241 19880
419 1 2 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.569 0.565 19880
420 1 2 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.000 -2.808 19880
421 1 2 . 1 1 38 38 ALA H H 38 9.323 9.323 8.294 1.029 19880
422 1 2 . 1 1 39 39 GLN N N 39 116.531 116.531 116.501 0.030 19880
423 1 2 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.798 -0.485 19880
424 1 2 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.277 0.472 19880
425 1 2 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.258 1.559 19880
426 1 2 . 1 1 39 39 GLN H H 39 8.746 8.746 8.801 -0.055 19880
427 1 2 . 1 1 40 40 CYS N N 40 122.074 122.074 120.445 1.629 19880
428 1 2 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.410 0.139 19880
429 1 2 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.854 -3.441 19880
430 1 2 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.478 13.424 19880
431 1 2 . 1 1 40 40 CYS H H 40 8.536 8.536 8.696 -0.160 19880
432 1 2 . 1 1 41 41 THR N N 41 117.753 117.753 115.507 2.246 19880
433 1 2 . 1 1 41 41 THR HA H 41 4.641 4.641 4.645 -0.004 19880
434 1 2 . 1 1 41 41 THR CA C 41 60.550 60.550 60.037 0.513 19880
435 1 2 . 1 1 41 41 THR CB C 41 71.033 71.033 71.738 -0.705 19880
436 1 2 . 1 1 41 41 THR H H 41 9.779 9.779 8.884 0.895 19880
437 1 2 . 1 1 42 42 GLY N N 42 105.809 105.809 108.936 -3.127 19880
438 1 2 . 1 1 42 42 GLY CA C 42 44.015 44.015 45.031 -1.016 19880
439 1 2 . 1 1 42 42 GLY H H 42 8.247 8.247 8.255 -0.008 19880
440 1 2 . 1 1 43 43 PHE N N 43 123.293 123.293 120.937 2.356 19880
441 1 2 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.441 -0.143 19880
442 1 2 . 1 1 43 43 PHE CA C 43 60.196 60.196 56.470 3.726 19880
443 1 2 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.400 -0.750 19880
444 1 2 . 1 1 43 43 PHE H H 43 8.707 8.707 8.695 0.012 19880
445 1 2 . 1 1 44 44 LEU N N 44 120.771 120.771 123.194 -2.423 19880
446 1 2 . 1 1 44 44 LEU HA H 44 3.848 3.848 3.600 0.248 19880
447 1 2 . 1 1 44 44 LEU CB C 44 40.386 40.386 39.410 0.976 19880
448 1 2 . 1 1 44 44 LEU H H 44 8.645 8.645 8.412 0.233 19880
449 1 2 . 1 1 45 45 GLY N N 45 107.545 107.545 105.042 2.503 19880
450 1 2 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.910 1.401 19880
451 1 2 . 1 1 45 45 GLY H H 45 7.831 7.831 7.920 -0.089 19880
452 1 2 . 1 1 46 46 THR N N 46 104.485 104.485 111.229 -6.744 19880
453 1 2 . 1 1 46 46 THR HA H 46 3.901 3.901 4.111 -0.210 19880
454 1 2 . 1 1 46 46 THR CA C 46 62.180 62.180 63.558 -1.378 19880
455 1 2 . 1 1 46 46 THR CB C 46 70.021 70.021 69.158 0.863 19880
456 1 2 . 1 1 46 46 THR H H 46 6.823 6.823 7.947 -1.123 19880
457 1 2 . 1 1 47 47 THR N N 47 123.300 123.300 116.460 6.840 19880
458 1 2 . 1 1 47 47 THR HA H 47 4.371 4.371 4.603 -0.232 19880
459 1 2 . 1 1 47 47 THR CA C 47 62.843 62.843 60.482 2.361 19880
460 1 2 . 1 1 47 47 THR CB C 47 70.176 70.176 72.075 -1.899 19880
461 1 2 . 1 1 47 47 THR H H 47 8.763 8.763 7.866 0.897 19880
462 1 2 . 1 1 48 48 CYS N N 48 128.024 128.024 123.710 4.314 19880
463 1 2 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.940 0.033 19880
464 1 2 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.330 -1.346 19880
465 1 2 . 1 1 48 48 CYS CB C 48 36.282 36.282 29.182 7.100 19880
466 1 2 . 1 1 48 48 CYS H H 48 9.276 9.276 8.563 0.713 19880
467 1 2 . 1 1 49 49 THR N N 49 131.810 131.810 120.617 11.193 19880
468 1 2 . 1 1 49 49 THR HA H 49 4.364 4.364 4.708 -0.344 19880
469 1 2 . 1 1 49 49 THR CA C 49 61.871 61.871 61.583 0.288 19880
470 1 2 . 1 1 49 49 THR CB C 49 69.789 69.789 72.523 -2.734 19880
471 1 2 . 1 1 49 49 THR H H 49 9.194 9.194 8.966 0.228 19880
472 1 2 . 1 1 50 50 CYS N N 50 123.835 123.835 121.620 2.215 19880
473 1 2 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.063 -0.028 19880
474 1 2 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.254 -6.374 19880
475 1 2 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.800 5.134 19880
476 1 2 . 1 1 50 50 CYS H H 50 8.879 8.879 8.631 0.248 19880
477 1 2 . 1 1 51 51 ILE N N 51 123.986 123.986 122.291 1.695 19880
478 1 2 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.460 -0.317 19880
479 1 2 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.014 0.605 19880
480 1 2 . 1 1 51 51 ILE CB C 51 39.380 39.380 40.211 -0.831 19880
481 1 2 . 1 1 51 51 ILE H H 51 8.098 8.098 8.903 -0.805 19880
482 1 2 . 1 1 52 52 ASN N N 52 126.122 126.122 124.702 1.420 19880
483 1 2 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.796 -0.080 19880
484 1 2 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.924 0.967 19880
485 1 2 . 1 1 52 52 ASN CB C 52 37.913 37.913 38.057 -0.144 19880
486 1 2 . 1 1 52 52 ASN H H 52 8.323 8.323 8.550 -0.227 19880
487 1 2 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.439 -0.132 19880
488 1 2 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.385 0.649 19880
489 1 2 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.710 3.150 19880
490 1 2 . 1 1 54 54 CYS N N 54 123.090 123.090 117.890 5.200 19880
491 1 2 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.134 0.602 19880
492 1 2 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.831 -2.682 19880
493 1 2 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.892 19.262 19880
494 1 2 . 1 1 54 54 CYS H H 54 8.865 8.865 8.476 0.389 19880
495 1 2 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.418 -0.132 19880
496 1 2 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.730 -0.472 19880
497 1 2 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.278 0.172 19880
498 1 2 . 1 1 56 56 ARG N N 56 117.289 117.289 117.379 -0.090 19880
499 1 2 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.688 -0.203 19880
500 1 2 . 1 1 56 56 ARG CA C 56 56.121 56.121 55.804 0.317 19880
501 1 2 . 1 1 56 56 ARG CB C 56 30.539 30.539 30.712 -0.173 19880
502 1 2 . 1 1 56 56 ARG H H 56 7.902 7.902 8.456 -0.554 19880
503 1 3 . 1 1 3 3 CYS N N 3 117.561 117.561 116.574 0.987 19880
504 1 3 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.241 -0.421 19880
505 1 3 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.216 -2.516 19880
506 1 3 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.791 19.860 19880
507 1 3 . 1 1 3 3 CYS H H 3 7.950 7.950 7.873 0.077 19880
508 1 3 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.569 -0.064 19880
509 1 3 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.858 0.872 19880
510 1 3 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.608 0.691 19880
511 1 3 . 1 1 5 5 THR N N 5 118.207 118.207 116.456 1.751 19880
512 1 3 . 1 1 5 5 THR HA H 5 4.814 4.814 4.710 0.104 19880
513 1 3 . 1 1 5 5 THR CA C 5 61.618 61.618 61.948 -0.330 19880
514 1 3 . 1 1 5 5 THR CB C 5 70.257 70.257 69.813 0.444 19880
515 1 3 . 1 1 5 5 THR H H 5 8.529 8.529 8.295 0.234 19880
516 1 3 . 1 1 6 6 ARG N N 6 123.211 123.211 125.605 -2.394 19880
517 1 3 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.551 -0.023 19880
518 1 3 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.016 -0.085 19880
519 1 3 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.474 0.278 19880
520 1 3 . 1 1 6 6 ARG H H 6 7.693 7.693 8.373 -0.680 19880
521 1 3 . 1 1 7 7 ARG N N 7 121.558 121.558 123.043 -1.485 19880
522 1 3 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.494 0.172 19880
523 1 3 . 1 1 7 7 ARG CA C 7 54.415 54.415 54.349 0.067 19880
524 1 3 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.873 -0.200 19880
525 1 3 . 1 1 7 7 ARG H H 7 8.450 8.450 8.105 0.345 19880
526 1 3 . 1 1 8 8 GLY N N 8 111.006 111.006 108.179 2.827 19880
527 1 3 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.703 0.950 19880
528 1 3 . 1 1 8 8 GLY H H 8 9.382 9.382 8.693 0.689 19880
529 1 3 . 1 1 9 9 LEU N N 9 119.202 119.202 118.474 0.728 19880
530 1 3 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.057 -0.167 19880
531 1 3 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.702 1.052 19880
532 1 3 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.617 1.153 19880
533 1 3 . 1 1 9 9 LEU H H 9 8.215 8.215 8.062 0.153 19880
534 1 3 . 1 1 10 10 CYS N N 10 115.050 115.050 114.814 0.236 19880
535 1 3 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.253 -0.363 19880
536 1 3 . 1 1 10 10 CYS CA C 10 61.378 61.378 60.008 1.370 19880
537 1 3 . 1 1 10 10 CYS CB C 10 42.589 42.589 24.825 17.764 19880
538 1 3 . 1 1 10 10 CYS H H 10 9.282 9.282 8.329 0.953 19880
539 1 3 . 1 1 11 11 VAL N N 11 117.792 117.792 119.849 -2.057 19880
540 1 3 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.201 -0.430 19880
541 1 3 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.462 0.046 19880
542 1 3 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.603 -0.005 19880
543 1 3 . 1 1 11 11 VAL H H 11 7.315 7.315 8.153 -0.838 19880
544 1 3 . 1 1 12 12 THR N N 12 109.816 109.816 112.448 -2.632 19880
545 1 3 . 1 1 12 12 THR HA H 12 4.044 4.044 4.386 -0.342 19880
546 1 3 . 1 1 12 12 THR CA C 12 63.575 63.575 64.071 -0.496 19880
547 1 3 . 1 1 12 12 THR CB C 12 69.400 69.400 69.829 -0.429 19880
548 1 3 . 1 1 12 12 THR H H 12 8.214 8.214 7.795 0.419 19880
549 1 3 . 1 1 13 13 SER N N 13 114.455 114.455 115.652 -1.197 19880
550 1 3 . 1 1 13 13 SER HA H 13 4.607 4.607 4.622 -0.015 19880
551 1 3 . 1 1 13 13 SER CA C 13 59.460 59.460 58.569 0.891 19880
552 1 3 . 1 1 13 13 SER CB C 13 64.586 64.586 65.683 -1.097 19880
553 1 3 . 1 1 13 13 SER H H 13 7.511 7.511 7.712 -0.201 19880
554 1 3 . 1 1 14 14 GLY N N 14 109.125 109.125 109.465 -0.340 19880
555 1 3 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.488 -0.164 19880
556 1 3 . 1 1 14 14 GLY H H 14 8.376 8.376 8.021 0.355 19880
557 1 3 . 1 1 15 15 LEU N N 15 120.782 120.782 121.429 -0.647 19880
558 1 3 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.214 -0.278 19880
559 1 3 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.204 0.782 19880
560 1 3 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.029 -0.503 19880
561 1 3 . 1 1 15 15 LEU H H 15 8.469 8.469 8.678 -0.209 19880
562 1 3 . 1 1 16 16 THR N N 16 115.887 115.887 114.277 1.610 19880
563 1 3 . 1 1 16 16 THR HA H 16 3.602 3.602 3.945 -0.343 19880
564 1 3 . 1 1 16 16 THR CA C 16 67.196 67.196 67.058 0.138 19880
565 1 3 . 1 1 16 16 THR CB C 16 68.003 68.003 68.004 -0.001 19880
566 1 3 . 1 1 16 16 THR H H 16 8.487 8.487 8.248 0.239 19880
567 1 3 . 1 1 17 17 ALA N N 17 122.643 122.643 123.327 -0.684 19880
568 1 3 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.357 -0.343 19880
569 1 3 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.489 0.352 19880
570 1 3 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.073 0.858 19880
571 1 3 . 1 1 17 17 ALA H H 17 7.609 7.609 7.722 -0.113 19880
572 1 3 . 1 1 18 18 CYS N N 18 118.252 118.252 118.574 -0.322 19880
573 1 3 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.229 0.024 19880
574 1 3 . 1 1 18 18 CYS CA C 18 58.453 58.453 61.022 -2.569 19880
575 1 3 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.264 12.382 19880
576 1 3 . 1 1 18 18 CYS H H 18 7.644 7.644 7.729 -0.085 19880
577 1 3 . 1 1 19 19 ARG N N 19 120.422 120.422 119.837 0.585 19880
578 1 3 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.127 -0.652 19880
579 1 3 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.463 1.089 19880
580 1 3 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.372 -0.570 19880
581 1 3 . 1 1 19 19 ARG H H 19 9.072 9.072 8.320 0.752 19880
582 1 3 . 1 1 20 20 ASN N N 20 117.466 117.466 117.231 0.235 19880
583 1 3 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.625 -0.413 19880
584 1 3 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.386 0.225 19880
585 1 3 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.254 -0.999 19880
586 1 3 . 1 1 20 20 ASN H H 20 8.411 8.411 7.918 0.493 19880
587 1 3 . 1 1 21 21 HIS N N 21 120.420 120.420 120.413 0.007 19880
588 1 3 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.512 -0.338 19880
589 1 3 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.998 -0.844 19880
590 1 3 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.126 1.462 19880
591 1 3 . 1 1 21 21 HIS H H 21 7.827 7.827 7.911 -0.084 19880
592 1 3 . 1 1 22 22 CYS N N 22 117.510 117.510 117.207 0.303 19880
593 1 3 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.210 -1.051 19880
594 1 3 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.947 -3.725 19880
595 1 3 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.255 10.924 19880
596 1 3 . 1 1 22 22 CYS H H 22 8.500 8.500 7.866 0.634 19880
597 1 3 . 1 1 23 23 ARG N N 23 116.564 116.564 116.730 -0.166 19880
598 1 3 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.715 -0.062 19880
599 1 3 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.313 0.715 19880
600 1 3 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.581 0.074 19880
601 1 3 . 1 1 23 23 ARG H H 23 7.985 7.985 7.570 0.415 19880
602 1 3 . 1 1 24 24 SER N N 24 116.727 116.727 113.696 3.031 19880
603 1 3 . 1 1 24 24 SER HA H 24 4.552 4.552 4.632 -0.080 19880
604 1 3 . 1 1 24 24 SER CA C 24 57.592 57.592 57.147 0.445 19880
605 1 3 . 1 1 24 24 SER CB C 24 65.284 65.284 66.804 -1.520 19880
606 1 3 . 1 1 24 24 SER H H 24 7.435 7.435 7.414 0.021 19880
607 1 3 . 1 1 25 25 CYS N N 25 121.909 121.909 123.264 -1.355 19880
608 1 3 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.483 0.153 19880
609 1 3 . 1 1 25 25 CYS CA C 25 56.614 56.614 59.050 -2.437 19880
610 1 3 . 1 1 25 25 CYS CB C 25 39.273 39.273 25.775 13.498 19880
611 1 3 . 1 1 25 25 CYS H H 25 9.000 9.000 8.723 0.277 19880
612 1 3 . 1 1 26 26 HIS N N 26 126.609 126.609 124.846 1.763 19880
613 1 3 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.260 -0.308 19880
614 1 3 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.284 0.438 19880
615 1 3 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.782 0.318 19880
616 1 3 . 1 1 26 26 HIS H H 26 9.255 9.255 8.716 0.539 19880
617 1 3 . 1 1 27 27 ARG N N 27 122.033 122.033 121.013 1.020 19880
618 1 3 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.405 -0.383 19880
619 1 3 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.084 2.393 19880
620 1 3 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.920 -1.040 19880
621 1 3 . 1 1 27 27 ARG H H 27 8.314 8.314 8.171 0.143 19880
622 1 3 . 1 1 28 28 GLY N N 28 119.213 119.213 113.790 5.423 19880
623 1 3 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.507 -0.535 19880
624 1 3 . 1 1 28 28 GLY H H 28 8.495 8.495 8.163 0.332 19880
625 1 3 . 1 1 29 29 ASP N N 29 121.258 121.258 119.026 2.232 19880
626 1 3 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.627 -0.363 19880
627 1 3 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.244 2.202 19880
628 1 3 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.685 -1.247 19880
629 1 3 . 1 1 29 29 ASP H H 29 8.646 8.646 8.448 0.198 19880
630 1 3 . 1 1 30 30 VAL N N 30 112.703 112.703 118.559 -5.856 19880
631 1 3 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.277 -0.054 19880
632 1 3 . 1 1 30 30 VAL CA C 30 61.407 61.407 61.836 -0.429 19880
633 1 3 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.442 -0.537 19880
634 1 3 . 1 1 30 30 VAL H H 30 8.026 8.026 7.527 0.499 19880
635 1 3 . 1 1 31 31 GLY N N 31 109.481 109.481 107.044 2.437 19880
636 1 3 . 1 1 31 31 GLY CA C 31 44.366 44.366 45.001 -0.635 19880
637 1 3 . 1 1 31 31 GLY H H 31 7.511 7.511 7.535 -0.024 19880
638 1 3 . 1 1 32 32 CYS N N 32 121.673 121.673 120.461 1.212 19880
639 1 3 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.257 -0.311 19880
640 1 3 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.625 -4.444 19880
641 1 3 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.805 14.491 19880
642 1 3 . 1 1 32 32 CYS H H 32 8.554 8.554 8.598 -0.044 19880
643 1 3 . 1 1 33 33 VAL N N 33 119.401 119.401 118.757 0.644 19880
644 1 3 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.877 -0.082 19880
645 1 3 . 1 1 33 33 VAL CA C 33 59.311 59.311 60.138 -0.827 19880
646 1 3 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.686 0.794 19880
647 1 3 . 1 1 33 33 VAL H H 33 9.025 9.025 8.908 0.117 19880
648 1 3 . 1 1 34 34 ARG N N 34 120.394 120.394 116.373 4.021 19880
649 1 3 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.991 -0.292 19880
650 1 3 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.070 1.122 19880
651 1 3 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.426 -0.288 19880
652 1 3 . 1 1 34 34 ARG H H 34 8.350 8.350 8.662 -0.312 19880
653 1 3 . 1 1 35 35 CYS N N 35 118.098 118.098 118.763 -0.665 19880
654 1 3 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.470 0.581 19880
655 1 3 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.501 -2.224 19880
656 1 3 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.750 12.803 19880
657 1 3 . 1 1 35 35 CYS H H 35 8.567 8.567 9.167 -0.600 19880
658 1 3 . 1 1 36 36 SER N N 36 114.009 114.009 116.249 -2.240 19880
659 1 3 . 1 1 36 36 SER HA H 36 4.326 4.326 4.563 -0.237 19880
660 1 3 . 1 1 36 36 SER CA C 36 60.945 60.945 60.091 0.854 19880
661 1 3 . 1 1 36 36 SER CB C 36 64.743 64.743 64.170 0.573 19880
662 1 3 . 1 1 36 36 SER H H 36 7.669 7.669 8.383 -0.714 19880
663 1 3 . 1 1 37 37 ASN N N 37 117.050 117.050 116.221 0.829 19880
664 1 3 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.851 -0.443 19880
665 1 3 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.606 -0.520 19880
666 1 3 . 1 1 37 37 ASN CB C 37 41.374 41.374 40.531 0.843 19880
667 1 3 . 1 1 37 37 ASN H H 37 7.755 7.755 7.428 0.327 19880
668 1 3 . 1 1 38 38 ALA N N 38 123.735 123.735 120.336 3.399 19880
669 1 3 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.940 0.222 19880
670 1 3 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.573 0.561 19880
671 1 3 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.006 -2.813 19880
672 1 3 . 1 1 38 38 ALA H H 38 9.323 9.323 8.310 1.013 19880
673 1 3 . 1 1 39 39 GLN N N 39 116.531 116.531 116.448 0.083 19880
674 1 3 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.800 -0.487 19880
675 1 3 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.249 0.500 19880
676 1 3 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.209 1.609 19880
677 1 3 . 1 1 39 39 GLN H H 39 8.746 8.746 8.760 -0.014 19880
678 1 3 . 1 1 40 40 CYS N N 40 122.074 122.074 120.808 1.266 19880
679 1 3 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.435 0.114 19880
680 1 3 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.971 -3.558 19880
681 1 3 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.504 13.398 19880
682 1 3 . 1 1 40 40 CYS H H 40 8.536 8.536 8.711 -0.175 19880
683 1 3 . 1 1 41 41 THR N N 41 117.753 117.753 116.161 1.592 19880
684 1 3 . 1 1 41 41 THR HA H 41 4.641 4.641 4.665 -0.024 19880
685 1 3 . 1 1 41 41 THR CA C 41 60.550 60.550 60.120 0.430 19880
686 1 3 . 1 1 41 41 THR CB C 41 71.033 71.033 71.456 -0.423 19880
687 1 3 . 1 1 41 41 THR H H 41 9.779 9.779 8.883 0.896 19880
688 1 3 . 1 1 42 42 GLY N N 42 105.809 105.809 108.518 -2.709 19880
689 1 3 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.873 -0.858 19880
690 1 3 . 1 1 42 42 GLY H H 42 8.247 8.247 8.351 -0.104 19880
691 1 3 . 1 1 43 43 PHE N N 43 123.293 123.293 121.260 2.033 19880
692 1 3 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.428 -0.130 19880
693 1 3 . 1 1 43 43 PHE CA C 43 60.196 60.196 56.531 3.665 19880
694 1 3 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.358 -0.708 19880
695 1 3 . 1 1 43 43 PHE H H 43 8.707 8.707 8.657 0.050 19880
696 1 3 . 1 1 44 44 LEU N N 44 120.771 120.771 123.275 -2.504 19880
697 1 3 . 1 1 44 44 LEU HA H 44 3.848 3.848 3.598 0.250 19880
698 1 3 . 1 1 44 44 LEU CB C 44 40.386 40.386 39.239 1.147 19880
699 1 3 . 1 1 44 44 LEU H H 44 8.645 8.645 8.442 0.203 19880
700 1 3 . 1 1 45 45 GLY N N 45 107.545 107.545 104.845 2.700 19880
701 1 3 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.871 1.440 19880
702 1 3 . 1 1 45 45 GLY H H 45 7.831 7.831 7.885 -0.054 19880
703 1 3 . 1 1 46 46 THR N N 46 104.485 104.485 111.437 -6.952 19880
704 1 3 . 1 1 46 46 THR HA H 46 3.901 3.901 4.111 -0.210 19880
705 1 3 . 1 1 46 46 THR CA C 46 62.180 62.180 63.483 -1.303 19880
706 1 3 . 1 1 46 46 THR CB C 46 70.021 70.021 68.877 1.144 19880
707 1 3 . 1 1 46 46 THR H H 46 6.823 6.823 8.108 -1.285 19880
708 1 3 . 1 1 47 47 THR N N 47 123.300 123.300 117.812 5.488 19880
709 1 3 . 1 1 47 47 THR HA H 47 4.371 4.371 4.600 -0.229 19880
710 1 3 . 1 1 47 47 THR CA C 47 62.843 62.843 61.784 1.059 19880
711 1 3 . 1 1 47 47 THR CB C 47 70.176 70.176 72.528 -2.352 19880
712 1 3 . 1 1 47 47 THR H H 47 8.763 8.763 7.898 0.865 19880
713 1 3 . 1 1 48 48 CYS N N 48 128.024 128.024 123.835 4.189 19880
714 1 3 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.936 0.037 19880
715 1 3 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.635 -1.651 19880
716 1 3 . 1 1 48 48 CYS CB C 48 36.282 36.282 28.448 7.834 19880
717 1 3 . 1 1 48 48 CYS H H 48 9.276 9.276 8.770 0.506 19880
718 1 3 . 1 1 49 49 THR N N 49 131.810 131.810 121.248 10.562 19880
719 1 3 . 1 1 49 49 THR HA H 49 4.364 4.364 4.660 -0.296 19880
720 1 3 . 1 1 49 49 THR CA C 49 61.871 61.871 61.736 0.135 19880
721 1 3 . 1 1 49 49 THR CB C 49 69.789 69.789 72.743 -2.954 19880
722 1 3 . 1 1 49 49 THR H H 49 9.194 9.194 8.946 0.248 19880
723 1 3 . 1 1 50 50 CYS N N 50 123.835 123.835 121.623 2.212 19880
724 1 3 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.111 -0.076 19880
725 1 3 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.230 -6.350 19880
726 1 3 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.716 5.218 19880
727 1 3 . 1 1 50 50 CYS H H 50 8.879 8.879 8.606 0.273 19880
728 1 3 . 1 1 51 51 ILE N N 51 123.986 123.986 121.960 2.026 19880
729 1 3 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.392 -0.249 19880
730 1 3 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.036 0.583 19880
731 1 3 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.952 -0.572 19880
732 1 3 . 1 1 51 51 ILE H H 51 8.098 8.098 8.854 -0.756 19880
733 1 3 . 1 1 52 52 ASN N N 52 126.122 126.122 125.234 0.888 19880
734 1 3 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.810 -0.094 19880
735 1 3 . 1 1 52 52 ASN CA C 52 52.891 52.891 52.700 0.191 19880
736 1 3 . 1 1 52 52 ASN CB C 52 37.913 37.913 38.418 -0.505 19880
737 1 3 . 1 1 52 52 ASN H H 52 8.323 8.323 8.687 -0.364 19880
738 1 3 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.574 -0.267 19880
739 1 3 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.589 0.444 19880
740 1 3 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.876 2.985 19880
741 1 3 . 1 1 54 54 CYS N N 54 123.090 123.090 117.667 5.423 19880
742 1 3 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.101 0.635 19880
743 1 3 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.859 -2.709 19880
744 1 3 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.896 19.258 19880
745 1 3 . 1 1 54 54 CYS H H 54 8.865 8.865 8.472 0.393 19880
746 1 3 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.466 -0.180 19880
747 1 3 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.693 -0.435 19880
748 1 3 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.355 0.095 19880
749 1 3 . 1 1 56 56 ARG N N 56 117.289 117.289 117.655 -0.366 19880
750 1 3 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.517 -0.032 19880
751 1 3 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.860 -0.739 19880
752 1 3 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.199 -0.660 19880
753 1 3 . 1 1 56 56 ARG H H 56 7.902 7.902 8.436 -0.534 19880
754 1 4 . 1 1 3 3 CYS N N 3 117.561 117.561 116.062 1.499 19880
755 1 4 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.275 -0.455 19880
756 1 4 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.087 -2.388 19880
757 1 4 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.716 19.935 19880
758 1 4 . 1 1 3 3 CYS H H 3 7.950 7.950 7.956 -0.006 19880
759 1 4 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.801 -0.296 19880
760 1 4 . 1 1 4 4 PRO CA C 4 63.730 63.730 63.000 0.730 19880
761 1 4 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.585 0.714 19880
762 1 4 . 1 1 5 5 THR N N 5 118.207 118.207 115.492 2.715 19880
763 1 4 . 1 1 5 5 THR HA H 5 4.814 4.814 4.694 0.120 19880
764 1 4 . 1 1 5 5 THR CA C 5 61.618 61.618 61.849 -0.231 19880
765 1 4 . 1 1 5 5 THR CB C 5 70.257 70.257 69.889 0.368 19880
766 1 4 . 1 1 5 5 THR H H 5 8.529 8.529 8.321 0.208 19880
767 1 4 . 1 1 6 6 ARG N N 6 123.211 123.211 125.809 -2.598 19880
768 1 4 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.665 -0.137 19880
769 1 4 . 1 1 6 6 ARG CA C 6 54.931 54.931 54.406 0.525 19880
770 1 4 . 1 1 6 6 ARG CB C 6 32.752 32.752 31.985 0.767 19880
771 1 4 . 1 1 6 6 ARG H H 6 7.693 7.693 8.464 -0.771 19880
772 1 4 . 1 1 7 7 ARG N N 7 121.558 121.558 120.371 1.187 19880
773 1 4 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.492 0.174 19880
774 1 4 . 1 1 7 7 ARG CA C 7 54.415 54.415 56.257 -1.842 19880
775 1 4 . 1 1 7 7 ARG CB C 7 32.673 32.673 31.735 0.938 19880
776 1 4 . 1 1 7 7 ARG H H 7 8.450 8.450 8.485 -0.035 19880
777 1 4 . 1 1 8 8 GLY N N 8 111.006 111.006 108.665 2.341 19880
778 1 4 . 1 1 8 8 GLY CA C 8 46.653 46.653 44.776 1.877 19880
779 1 4 . 1 1 8 8 GLY H H 8 9.382 9.382 8.243 1.139 19880
780 1 4 . 1 1 9 9 LEU N N 9 119.202 119.202 120.932 -1.730 19880
781 1 4 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.166 -0.276 19880
782 1 4 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.624 1.130 19880
783 1 4 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.559 1.212 19880
784 1 4 . 1 1 9 9 LEU H H 9 8.215 8.215 7.978 0.237 19880
785 1 4 . 1 1 10 10 CYS N N 10 115.050 115.050 114.742 0.308 19880
786 1 4 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.434 -0.544 19880
787 1 4 . 1 1 10 10 CYS CA C 10 61.378 61.378 60.212 1.166 19880
788 1 4 . 1 1 10 10 CYS CB C 10 42.589 42.589 25.062 17.527 19880
789 1 4 . 1 1 10 10 CYS H H 10 9.282 9.282 8.438 0.844 19880
790 1 4 . 1 1 11 11 VAL N N 11 117.792 117.792 120.543 -2.751 19880
791 1 4 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.162 -0.391 19880
792 1 4 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.679 -0.171 19880
793 1 4 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.297 0.301 19880
794 1 4 . 1 1 11 11 VAL H H 11 7.315 7.315 8.384 -1.069 19880
795 1 4 . 1 1 12 12 THR N N 12 109.816 109.816 111.911 -2.095 19880
796 1 4 . 1 1 12 12 THR HA H 12 4.044 4.044 4.322 -0.278 19880
797 1 4 . 1 1 12 12 THR CA C 12 63.575 63.575 64.040 -0.465 19880
798 1 4 . 1 1 12 12 THR CB C 12 69.400 69.400 69.380 0.020 19880
799 1 4 . 1 1 12 12 THR H H 12 8.214 8.214 7.954 0.260 19880
800 1 4 . 1 1 13 13 SER N N 13 114.455 114.455 115.984 -1.529 19880
801 1 4 . 1 1 13 13 SER HA H 13 4.607 4.607 4.585 0.022 19880
802 1 4 . 1 1 13 13 SER CA C 13 59.460 59.460 58.386 1.073 19880
803 1 4 . 1 1 13 13 SER CB C 13 64.586 64.586 65.010 -0.424 19880
804 1 4 . 1 1 13 13 SER H H 13 7.511 7.511 7.641 -0.130 19880
805 1 4 . 1 1 14 14 GLY N N 14 109.125 109.125 109.332 -0.207 19880
806 1 4 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.590 -0.266 19880
807 1 4 . 1 1 14 14 GLY H H 14 8.376 8.376 8.095 0.281 19880
808 1 4 . 1 1 15 15 LEU N N 15 120.782 120.782 122.186 -1.404 19880
809 1 4 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.260 -0.324 19880
810 1 4 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.206 0.779 19880
811 1 4 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.002 -0.476 19880
812 1 4 . 1 1 15 15 LEU H H 15 8.469 8.469 8.662 -0.193 19880
813 1 4 . 1 1 16 16 THR N N 16 115.887 115.887 114.439 1.448 19880
814 1 4 . 1 1 16 16 THR HA H 16 3.602 3.602 3.940 -0.338 19880
815 1 4 . 1 1 16 16 THR CA C 16 67.196 67.196 67.342 -0.146 19880
816 1 4 . 1 1 16 16 THR CB C 16 68.003 68.003 68.013 -0.010 19880
817 1 4 . 1 1 16 16 THR H H 16 8.487 8.487 8.217 0.270 19880
818 1 4 . 1 1 17 17 ALA N N 17 122.643 122.643 123.229 -0.586 19880
819 1 4 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.330 -0.316 19880
820 1 4 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.498 0.343 19880
821 1 4 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.015 0.916 19880
822 1 4 . 1 1 17 17 ALA H H 17 7.609 7.609 7.679 -0.070 19880
823 1 4 . 1 1 18 18 CYS N N 18 118.252 118.252 118.445 -0.193 19880
824 1 4 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.234 0.019 19880
825 1 4 . 1 1 18 18 CYS CA C 18 58.453 58.453 61.002 -2.550 19880
826 1 4 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.295 12.351 19880
827 1 4 . 1 1 18 18 CYS H H 18 7.644 7.644 7.746 -0.102 19880
828 1 4 . 1 1 19 19 ARG N N 19 120.422 120.422 120.118 0.304 19880
829 1 4 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.098 -0.623 19880
830 1 4 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.578 0.974 19880
831 1 4 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.360 -0.559 19880
832 1 4 . 1 1 19 19 ARG H H 19 9.072 9.072 8.442 0.630 19880
833 1 4 . 1 1 20 20 ASN N N 20 117.466 117.466 115.869 1.597 19880
834 1 4 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.631 -0.419 19880
835 1 4 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.115 0.495 19880
836 1 4 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.319 -1.064 19880
837 1 4 . 1 1 20 20 ASN H H 20 8.411 8.411 7.916 0.495 19880
838 1 4 . 1 1 21 21 HIS N N 21 120.420 120.420 119.735 0.685 19880
839 1 4 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.601 -0.427 19880
840 1 4 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.480 -0.326 19880
841 1 4 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.364 1.224 19880
842 1 4 . 1 1 21 21 HIS H H 21 7.827 7.827 7.791 0.036 19880
843 1 4 . 1 1 22 22 CYS N N 22 117.510 117.510 118.505 -0.995 19880
844 1 4 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.448 -1.289 19880
845 1 4 . 1 1 22 22 CYS CA C 22 58.221 58.221 62.006 -3.785 19880
846 1 4 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.311 10.867 19880
847 1 4 . 1 1 22 22 CYS H H 22 8.500 8.500 8.013 0.487 19880
848 1 4 . 1 1 23 23 ARG N N 23 116.564 116.564 118.574 -2.010 19880
849 1 4 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.615 0.038 19880
850 1 4 . 1 1 23 23 ARG CA C 23 57.028 57.028 58.035 -1.007 19880
851 1 4 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.854 -0.199 19880
852 1 4 . 1 1 23 23 ARG H H 23 7.985 7.985 8.002 -0.017 19880
853 1 4 . 1 1 24 24 SER N N 24 116.727 116.727 113.967 2.760 19880
854 1 4 . 1 1 24 24 SER HA H 24 4.552 4.552 4.614 -0.062 19880
855 1 4 . 1 1 24 24 SER CA C 24 57.592 57.592 56.870 0.722 19880
856 1 4 . 1 1 24 24 SER CB C 24 65.284 65.284 65.409 -0.125 19880
857 1 4 . 1 1 24 24 SER H H 24 7.435 7.435 7.316 0.119 19880
858 1 4 . 1 1 25 25 CYS N N 25 121.909 121.909 121.280 0.629 19880
859 1 4 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.602 0.034 19880
860 1 4 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.153 -1.539 19880
861 1 4 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.609 12.664 19880
862 1 4 . 1 1 25 25 CYS H H 25 9.000 9.000 8.627 0.373 19880
863 1 4 . 1 1 26 26 HIS N N 26 126.609 126.609 123.480 3.129 19880
864 1 4 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.160 -0.208 19880
865 1 4 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.469 0.253 19880
866 1 4 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.477 0.623 19880
867 1 4 . 1 1 26 26 HIS H H 26 9.255 9.255 8.790 0.465 19880
868 1 4 . 1 1 27 27 ARG N N 27 122.033 122.033 121.255 0.778 19880
869 1 4 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.312 -0.290 19880
870 1 4 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.814 1.663 19880
871 1 4 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.680 -0.800 19880
872 1 4 . 1 1 27 27 ARG H H 27 8.314 8.314 8.178 0.136 19880
873 1 4 . 1 1 28 28 GLY N N 28 119.213 119.213 112.810 6.403 19880
874 1 4 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.653 -0.680 19880
875 1 4 . 1 1 28 28 GLY H H 28 8.495 8.495 7.823 0.672 19880
876 1 4 . 1 1 29 29 ASP N N 29 121.258 121.258 117.864 3.394 19880
877 1 4 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.651 -0.387 19880
878 1 4 . 1 1 29 29 ASP CA C 29 57.446 57.446 54.819 2.627 19880
879 1 4 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.420 -0.982 19880
880 1 4 . 1 1 29 29 ASP H H 29 8.646 8.646 8.337 0.309 19880
881 1 4 . 1 1 30 30 VAL N N 30 112.703 112.703 117.917 -5.214 19880
882 1 4 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.429 -0.206 19880
883 1 4 . 1 1 30 30 VAL CA C 30 61.407 61.407 62.089 -0.682 19880
884 1 4 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.654 -0.749 19880
885 1 4 . 1 1 30 30 VAL H H 30 8.026 8.026 7.786 0.240 19880
886 1 4 . 1 1 31 31 GLY N N 31 109.481 109.481 106.911 2.570 19880
887 1 4 . 1 1 31 31 GLY CA C 31 44.366 44.366 44.927 -0.561 19880
888 1 4 . 1 1 31 31 GLY H H 31 7.511 7.511 7.618 -0.107 19880
889 1 4 . 1 1 32 32 CYS N N 32 121.673 121.673 120.104 1.569 19880
890 1 4 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.059 -0.113 19880
891 1 4 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.510 -4.329 19880
892 1 4 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.717 14.579 19880
893 1 4 . 1 1 32 32 CYS H H 32 8.554 8.554 8.488 0.066 19880
894 1 4 . 1 1 33 33 VAL N N 33 119.401 119.401 118.253 1.148 19880
895 1 4 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.988 -0.193 19880
896 1 4 . 1 1 33 33 VAL CA C 33 59.311 59.311 60.013 -0.702 19880
897 1 4 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.648 0.832 19880
898 1 4 . 1 1 33 33 VAL H H 33 9.025 9.025 8.927 0.098 19880
899 1 4 . 1 1 34 34 ARG N N 34 120.394 120.394 117.138 3.256 19880
900 1 4 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.701 -0.002 19880
901 1 4 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.077 1.115 19880
902 1 4 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.421 -0.283 19880
903 1 4 . 1 1 34 34 ARG H H 34 8.350 8.350 8.615 -0.265 19880
904 1 4 . 1 1 35 35 CYS N N 35 118.098 118.098 119.559 -1.461 19880
905 1 4 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.516 0.535 19880
906 1 4 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.544 -2.267 19880
907 1 4 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.260 13.293 19880
908 1 4 . 1 1 35 35 CYS H H 35 8.567 8.567 9.155 -0.588 19880
909 1 4 . 1 1 36 36 SER N N 36 114.009 114.009 116.058 -2.049 19880
910 1 4 . 1 1 36 36 SER HA H 36 4.326 4.326 4.406 -0.080 19880
911 1 4 . 1 1 36 36 SER CA C 36 60.945 60.945 60.013 0.932 19880
912 1 4 . 1 1 36 36 SER CB C 36 64.743 64.743 63.796 0.947 19880
913 1 4 . 1 1 36 36 SER H H 36 7.669 7.669 8.393 -0.724 19880
914 1 4 . 1 1 37 37 ASN N N 37 117.050 117.050 116.282 0.768 19880
915 1 4 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.893 -0.485 19880
916 1 4 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.633 -0.547 19880
917 1 4 . 1 1 37 37 ASN CB C 37 41.374 41.374 40.488 0.886 19880
918 1 4 . 1 1 37 37 ASN H H 37 7.755 7.755 7.452 0.303 19880
919 1 4 . 1 1 38 38 ALA N N 38 123.735 123.735 120.302 3.433 19880
920 1 4 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.922 0.240 19880
921 1 4 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.560 0.574 19880
922 1 4 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.029 -2.836 19880
923 1 4 . 1 1 38 38 ALA H H 38 9.323 9.323 8.310 1.013 19880
924 1 4 . 1 1 39 39 GLN N N 39 116.531 116.531 116.223 0.308 19880
925 1 4 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.715 -0.402 19880
926 1 4 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.274 0.475 19880
927 1 4 . 1 1 39 39 GLN CB C 39 33.817 33.817 31.956 1.861 19880
928 1 4 . 1 1 39 39 GLN H H 39 8.746 8.746 8.749 -0.003 19880
929 1 4 . 1 1 40 40 CYS N N 40 122.074 122.074 120.557 1.517 19880
930 1 4 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.442 0.107 19880
931 1 4 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.880 -3.467 19880
932 1 4 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.975 12.927 19880
933 1 4 . 1 1 40 40 CYS H H 40 8.536 8.536 8.709 -0.173 19880
934 1 4 . 1 1 41 41 THR N N 41 117.753 117.753 115.842 1.911 19880
935 1 4 . 1 1 41 41 THR HA H 41 4.641 4.641 4.669 -0.028 19880
936 1 4 . 1 1 41 41 THR CA C 41 60.550 60.550 60.164 0.386 19880
937 1 4 . 1 1 41 41 THR CB C 41 71.033 71.033 71.323 -0.290 19880
938 1 4 . 1 1 41 41 THR H H 41 9.779 9.779 8.986 0.793 19880
939 1 4 . 1 1 42 42 GLY N N 42 105.809 105.809 108.499 -2.690 19880
940 1 4 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.945 -0.930 19880
941 1 4 . 1 1 42 42 GLY H H 42 8.247 8.247 8.161 0.086 19880
942 1 4 . 1 1 43 43 PHE N N 43 123.293 123.293 121.092 2.201 19880
943 1 4 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.490 -0.192 19880
944 1 4 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.886 0.310 19880
945 1 4 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.586 -0.936 19880
946 1 4 . 1 1 43 43 PHE H H 43 8.707 8.707 8.989 -0.282 19880
947 1 4 . 1 1 44 44 LEU N N 44 120.771 120.771 119.368 1.403 19880
948 1 4 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.384 -0.536 19880
949 1 4 . 1 1 44 44 LEU CB C 44 40.386 40.386 42.779 -2.393 19880
950 1 4 . 1 1 44 44 LEU H H 44 8.645 8.645 7.627 1.018 19880
951 1 4 . 1 1 45 45 GLY N N 45 107.545 107.545 108.094 -0.549 19880
952 1 4 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.620 1.692 19880
953 1 4 . 1 1 45 45 GLY H H 45 7.831 7.831 7.657 0.174 19880
954 1 4 . 1 1 46 46 THR N N 46 104.485 104.485 109.017 -4.532 19880
955 1 4 . 1 1 46 46 THR HA H 46 3.901 3.901 4.176 -0.275 19880
956 1 4 . 1 1 46 46 THR CA C 46 62.180 62.180 62.547 -0.367 19880
957 1 4 . 1 1 46 46 THR CB C 46 70.021 70.021 69.360 0.661 19880
958 1 4 . 1 1 46 46 THR H H 46 6.823 6.823 7.888 -1.065 19880
959 1 4 . 1 1 47 47 THR N N 47 123.300 123.300 117.082 6.218 19880
960 1 4 . 1 1 47 47 THR HA H 47 4.371 4.371 5.131 -0.760 19880
961 1 4 . 1 1 47 47 THR CA C 47 62.843 62.843 60.856 1.986 19880
962 1 4 . 1 1 47 47 THR CB C 47 70.176 70.176 72.414 -2.238 19880
963 1 4 . 1 1 47 47 THR H H 47 8.763 8.763 7.750 1.013 19880
964 1 4 . 1 1 48 48 CYS N N 48 128.024 128.024 124.043 3.981 19880
965 1 4 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.965 0.008 19880
966 1 4 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.093 -1.109 19880
967 1 4 . 1 1 48 48 CYS CB C 48 36.282 36.282 28.809 7.473 19880
968 1 4 . 1 1 48 48 CYS H H 48 9.276 9.276 8.634 0.642 19880
969 1 4 . 1 1 49 49 THR N N 49 131.810 131.810 120.888 10.922 19880
970 1 4 . 1 1 49 49 THR HA H 49 4.364 4.364 4.734 -0.370 19880
971 1 4 . 1 1 49 49 THR CA C 49 61.871 61.871 61.785 0.086 19880
972 1 4 . 1 1 49 49 THR CB C 49 69.789 69.789 72.617 -2.828 19880
973 1 4 . 1 1 49 49 THR H H 49 9.194 9.194 8.843 0.351 19880
974 1 4 . 1 1 50 50 CYS N N 50 123.835 123.835 121.632 2.203 19880
975 1 4 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.084 -0.049 19880
976 1 4 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.161 -6.281 19880
977 1 4 . 1 1 50 50 CYS CB C 50 34.934 34.934 30.033 4.901 19880
978 1 4 . 1 1 50 50 CYS H H 50 8.879 8.879 8.625 0.254 19880
979 1 4 . 1 1 51 51 ILE N N 51 123.986 123.986 122.019 1.967 19880
980 1 4 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.390 -0.247 19880
981 1 4 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.026 0.593 19880
982 1 4 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.786 -0.406 19880
983 1 4 . 1 1 51 51 ILE H H 51 8.098 8.098 8.854 -0.756 19880
984 1 4 . 1 1 52 52 ASN N N 52 126.122 126.122 126.498 -0.376 19880
985 1 4 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.844 -0.128 19880
986 1 4 . 1 1 52 52 ASN CA C 52 52.891 52.891 52.983 -0.092 19880
987 1 4 . 1 1 52 52 ASN CB C 52 37.913 37.913 38.431 -0.518 19880
988 1 4 . 1 1 52 52 ASN H H 52 8.323 8.323 8.639 -0.316 19880
989 1 4 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.515 -0.208 19880
990 1 4 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.395 0.638 19880
991 1 4 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.820 3.040 19880
992 1 4 . 1 1 54 54 CYS N N 54 123.090 123.090 117.195 5.895 19880
993 1 4 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.096 0.640 19880
994 1 4 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.926 -2.776 19880
995 1 4 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.846 19.308 19880
996 1 4 . 1 1 54 54 CYS H H 54 8.865 8.865 8.463 0.402 19880
997 1 4 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.463 -0.177 19880
998 1 4 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.627 -0.369 19880
999 1 4 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.240 0.210 19880
1000 1 4 . 1 1 56 56 ARG N N 56 117.289 117.289 117.537 -0.248 19880
1001 1 4 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.615 -0.131 19880
1002 1 4 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.040 0.081 19880
1003 1 4 . 1 1 56 56 ARG CB C 56 30.539 30.539 30.811 -0.272 19880
1004 1 4 . 1 1 56 56 ARG H H 56 7.902 7.902 8.424 -0.522 19880
1005 1 5 . 1 1 3 3 CYS N N 3 117.561 117.561 116.599 0.962 19880
1006 1 5 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.238 -0.418 19880
1007 1 5 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.468 -2.768 19880
1008 1 5 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.785 19.866 19880
1009 1 5 . 1 1 3 3 CYS H H 3 7.950 7.950 7.878 0.072 19880
1010 1 5 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.620 -0.115 19880
1011 1 5 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.805 0.925 19880
1012 1 5 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.730 0.569 19880
1013 1 5 . 1 1 5 5 THR N N 5 118.207 118.207 115.927 2.280 19880
1014 1 5 . 1 1 5 5 THR HA H 5 4.814 4.814 4.654 0.160 19880
1015 1 5 . 1 1 5 5 THR CA C 5 61.618 61.618 61.735 -0.117 19880
1016 1 5 . 1 1 5 5 THR CB C 5 70.257 70.257 69.921 0.336 19880
1017 1 5 . 1 1 5 5 THR H H 5 8.529 8.529 8.362 0.167 19880
1018 1 5 . 1 1 6 6 ARG N N 6 123.211 123.211 126.760 -3.549 19880
1019 1 5 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.576 -0.048 19880
1020 1 5 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.122 -0.191 19880
1021 1 5 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.626 0.126 19880
1022 1 5 . 1 1 6 6 ARG H H 6 7.693 7.693 8.630 -0.937 19880
1023 1 5 . 1 1 7 7 ARG N N 7 121.558 121.558 120.071 1.487 19880
1024 1 5 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.494 0.172 19880
1025 1 5 . 1 1 7 7 ARG CA C 7 54.415 54.415 56.184 -1.769 19880
1026 1 5 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.042 0.631 19880
1027 1 5 . 1 1 7 7 ARG H H 7 8.450 8.450 8.536 -0.086 19880
1028 1 5 . 1 1 8 8 GLY N N 8 111.006 111.006 108.777 2.229 19880
1029 1 5 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.145 1.508 19880
1030 1 5 . 1 1 8 8 GLY H H 8 9.382 9.382 8.231 1.151 19880
1031 1 5 . 1 1 9 9 LEU N N 9 119.202 119.202 120.391 -1.189 19880
1032 1 5 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.064 -0.174 19880
1033 1 5 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.506 1.248 19880
1034 1 5 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.703 1.067 19880
1035 1 5 . 1 1 9 9 LEU H H 9 8.215 8.215 7.922 0.293 19880
1036 1 5 . 1 1 10 10 CYS N N 10 115.050 115.050 114.511 0.539 19880
1037 1 5 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.456 -0.566 19880
1038 1 5 . 1 1 10 10 CYS CA C 10 61.378 61.378 58.998 2.380 19880
1039 1 5 . 1 1 10 10 CYS CB C 10 42.589 42.589 25.611 16.978 19880
1040 1 5 . 1 1 10 10 CYS H H 10 9.282 9.282 8.049 1.233 19880
1041 1 5 . 1 1 11 11 VAL N N 11 117.792 117.792 120.329 -2.537 19880
1042 1 5 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.003 -0.232 19880
1043 1 5 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.963 -0.455 19880
1044 1 5 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.425 0.173 19880
1045 1 5 . 1 1 11 11 VAL H H 11 7.315 7.315 8.045 -0.730 19880
1046 1 5 . 1 1 12 12 THR N N 12 109.816 109.816 112.029 -2.213 19880
1047 1 5 . 1 1 12 12 THR HA H 12 4.044 4.044 4.342 -0.298 19880
1048 1 5 . 1 1 12 12 THR CA C 12 63.575 63.575 63.184 0.391 19880
1049 1 5 . 1 1 12 12 THR CB C 12 69.400 69.400 69.032 0.368 19880
1050 1 5 . 1 1 12 12 THR H H 12 8.214 8.214 7.932 0.282 19880
1051 1 5 . 1 1 13 13 SER N N 13 114.455 114.455 117.937 -3.482 19880
1052 1 5 . 1 1 13 13 SER HA H 13 4.607 4.607 4.507 0.100 19880
1053 1 5 . 1 1 13 13 SER CA C 13 59.460 59.460 58.999 0.460 19880
1054 1 5 . 1 1 13 13 SER CB C 13 64.586 64.586 63.600 0.986 19880
1055 1 5 . 1 1 13 13 SER H H 13 7.511 7.511 8.321 -0.810 19880
1056 1 5 . 1 1 14 14 GLY N N 14 109.125 109.125 108.645 0.480 19880
1057 1 5 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.450 -0.126 19880
1058 1 5 . 1 1 14 14 GLY H H 14 8.376 8.376 7.440 0.936 19880
1059 1 5 . 1 1 15 15 LEU N N 15 120.782 120.782 120.105 0.677 19880
1060 1 5 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.203 -0.267 19880
1061 1 5 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.164 0.822 19880
1062 1 5 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.106 -0.580 19880
1063 1 5 . 1 1 15 15 LEU H H 15 8.469 8.469 8.576 -0.107 19880
1064 1 5 . 1 1 16 16 THR N N 16 115.887 115.887 113.925 1.962 19880
1065 1 5 . 1 1 16 16 THR HA H 16 3.602 3.602 3.942 -0.340 19880
1066 1 5 . 1 1 16 16 THR CA C 16 67.196 67.196 66.284 0.912 19880
1067 1 5 . 1 1 16 16 THR CB C 16 68.003 68.003 68.258 -0.255 19880
1068 1 5 . 1 1 16 16 THR H H 16 8.487 8.487 8.204 0.283 19880
1069 1 5 . 1 1 17 17 ALA N N 17 122.643 122.643 123.529 -0.886 19880
1070 1 5 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.307 -0.293 19880
1071 1 5 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.651 0.189 19880
1072 1 5 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.082 0.849 19880
1073 1 5 . 1 1 17 17 ALA H H 17 7.609 7.609 7.640 -0.031 19880
1074 1 5 . 1 1 18 18 CYS N N 18 118.252 118.252 118.380 -0.128 19880
1075 1 5 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.230 0.023 19880
1076 1 5 . 1 1 18 18 CYS CA C 18 58.453 58.453 60.929 -2.476 19880
1077 1 5 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.247 12.399 19880
1078 1 5 . 1 1 18 18 CYS H H 18 7.644 7.644 7.727 -0.083 19880
1079 1 5 . 1 1 19 19 ARG N N 19 120.422 120.422 119.913 0.509 19880
1080 1 5 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.120 -0.645 19880
1081 1 5 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.454 1.098 19880
1082 1 5 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.321 -0.520 19880
1083 1 5 . 1 1 19 19 ARG H H 19 9.072 9.072 8.379 0.693 19880
1084 1 5 . 1 1 20 20 ASN N N 20 117.466 117.466 116.913 0.553 19880
1085 1 5 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.583 -0.371 19880
1086 1 5 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.346 0.265 19880
1087 1 5 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.197 -0.942 19880
1088 1 5 . 1 1 20 20 ASN H H 20 8.411 8.411 7.905 0.506 19880
1089 1 5 . 1 1 21 21 HIS N N 21 120.420 120.420 118.346 2.074 19880
1090 1 5 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.681 -0.507 19880
1091 1 5 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.183 -0.029 19880
1092 1 5 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.575 1.014 19880
1093 1 5 . 1 1 21 21 HIS H H 21 7.827 7.827 7.644 0.183 19880
1094 1 5 . 1 1 22 22 CYS N N 22 117.510 117.510 117.416 0.094 19880
1095 1 5 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.290 -1.131 19880
1096 1 5 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.429 -3.208 19880
1097 1 5 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.419 10.759 19880
1098 1 5 . 1 1 22 22 CYS H H 22 8.500 8.500 7.875 0.625 19880
1099 1 5 . 1 1 23 23 ARG N N 23 116.564 116.564 119.234 -2.670 19880
1100 1 5 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.659 -0.006 19880
1101 1 5 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.431 0.597 19880
1102 1 5 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.356 0.299 19880
1103 1 5 . 1 1 23 23 ARG H H 23 7.985 7.985 8.057 -0.072 19880
1104 1 5 . 1 1 24 24 SER N N 24 116.727 116.727 112.900 3.827 19880
1105 1 5 . 1 1 24 24 SER HA H 24 4.552 4.552 4.711 -0.159 19880
1106 1 5 . 1 1 24 24 SER CA C 24 57.592 57.592 56.077 1.515 19880
1107 1 5 . 1 1 24 24 SER CB C 24 65.284 65.284 66.925 -1.641 19880
1108 1 5 . 1 1 24 24 SER H H 24 7.435 7.435 7.370 0.065 19880
1109 1 5 . 1 1 25 25 CYS N N 25 121.909 121.909 120.917 0.992 19880
1110 1 5 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.781 -0.145 19880
1111 1 5 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.613 -1.999 19880
1112 1 5 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.109 13.164 19880
1113 1 5 . 1 1 25 25 CYS H H 25 9.000 9.000 8.906 0.094 19880
1114 1 5 . 1 1 26 26 HIS N N 26 126.609 126.609 120.328 6.281 19880
1115 1 5 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.249 -0.297 19880
1116 1 5 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.401 0.321 19880
1117 1 5 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.785 0.315 19880
1118 1 5 . 1 1 26 26 HIS H H 26 9.255 9.255 8.844 0.411 19880
1119 1 5 . 1 1 27 27 ARG N N 27 122.033 122.033 120.909 1.124 19880
1120 1 5 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.382 -0.360 19880
1121 1 5 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.222 2.255 19880
1122 1 5 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.979 -1.099 19880
1123 1 5 . 1 1 27 27 ARG H H 27 8.314 8.314 8.269 0.045 19880
1124 1 5 . 1 1 28 28 GLY N N 28 119.213 119.213 112.869 6.344 19880
1125 1 5 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.469 -0.497 19880
1126 1 5 . 1 1 28 28 GLY H H 28 8.495 8.495 7.879 0.616 19880
1127 1 5 . 1 1 29 29 ASP N N 29 121.258 121.258 119.047 2.211 19880
1128 1 5 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.657 -0.393 19880
1129 1 5 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.435 2.011 19880
1130 1 5 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.596 -1.158 19880
1131 1 5 . 1 1 29 29 ASP H H 29 8.646 8.646 8.528 0.118 19880
1132 1 5 . 1 1 30 30 VAL N N 30 112.703 112.703 117.791 -5.088 19880
1133 1 5 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.228 -0.005 19880
1134 1 5 . 1 1 30 30 VAL CA C 30 61.407 61.407 62.083 -0.676 19880
1135 1 5 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.196 -0.291 19880
1136 1 5 . 1 1 30 30 VAL H H 30 8.026 8.026 7.544 0.482 19880
1137 1 5 . 1 1 31 31 GLY N N 31 109.481 109.481 107.811 1.670 19880
1138 1 5 . 1 1 31 31 GLY CA C 31 44.366 44.366 44.862 -0.496 19880
1139 1 5 . 1 1 31 31 GLY H H 31 7.511 7.511 7.600 -0.089 19880
1140 1 5 . 1 1 32 32 CYS N N 32 121.673 121.673 119.827 1.846 19880
1141 1 5 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.084 -0.138 19880
1142 1 5 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.221 -4.040 19880
1143 1 5 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.587 14.709 19880
1144 1 5 . 1 1 32 32 CYS H H 32 8.554 8.554 8.479 0.075 19880
1145 1 5 . 1 1 33 33 VAL N N 33 119.401 119.401 117.179 2.222 19880
1146 1 5 . 1 1 33 33 VAL HA H 33 4.795 4.795 5.018 -0.223 19880
1147 1 5 . 1 1 33 33 VAL CA C 33 59.311 59.311 59.576 -0.265 19880
1148 1 5 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.623 0.857 19880
1149 1 5 . 1 1 33 33 VAL H H 33 9.025 9.025 9.005 0.020 19880
1150 1 5 . 1 1 34 34 ARG N N 34 120.394 120.394 115.849 4.545 19880
1151 1 5 . 1 1 34 34 ARG HA H 34 4.699 4.699 5.002 -0.303 19880
1152 1 5 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.101 1.091 19880
1153 1 5 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.434 -0.296 19880
1154 1 5 . 1 1 34 34 ARG H H 34 8.350 8.350 8.643 -0.293 19880
1155 1 5 . 1 1 35 35 CYS N N 35 118.098 118.098 119.345 -1.247 19880
1156 1 5 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.528 0.523 19880
1157 1 5 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.612 -2.335 19880
1158 1 5 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.604 12.950 19880
1159 1 5 . 1 1 35 35 CYS H H 35 8.567 8.567 8.996 -0.429 19880
1160 1 5 . 1 1 36 36 SER N N 36 114.009 114.009 116.103 -2.094 19880
1161 1 5 . 1 1 36 36 SER HA H 36 4.326 4.326 4.509 -0.183 19880
1162 1 5 . 1 1 36 36 SER CA C 36 60.945 60.945 59.573 1.372 19880
1163 1 5 . 1 1 36 36 SER CB C 36 64.743 64.743 64.020 0.723 19880
1164 1 5 . 1 1 36 36 SER H H 36 7.669 7.669 8.369 -0.700 19880
1165 1 5 . 1 1 37 37 ASN N N 37 117.050 117.050 116.260 0.790 19880
1166 1 5 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.896 -0.488 19880
1167 1 5 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.530 -0.444 19880
1168 1 5 . 1 1 37 37 ASN CB C 37 41.374 41.374 40.578 0.796 19880
1169 1 5 . 1 1 37 37 ASN H H 37 7.755 7.755 7.448 0.307 19880
1170 1 5 . 1 1 38 38 ALA N N 38 123.735 123.735 120.537 3.198 19880
1171 1 5 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.994 0.168 19880
1172 1 5 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.599 0.535 19880
1173 1 5 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.212 -3.019 19880
1174 1 5 . 1 1 38 38 ALA H H 38 9.323 9.323 8.324 0.999 19880
1175 1 5 . 1 1 39 39 GLN N N 39 116.531 116.531 116.399 0.132 19880
1176 1 5 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.712 -0.399 19880
1177 1 5 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.477 0.272 19880
1178 1 5 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.196 1.621 19880
1179 1 5 . 1 1 39 39 GLN H H 39 8.746 8.746 8.758 -0.012 19880
1180 1 5 . 1 1 40 40 CYS N N 40 122.074 122.074 120.661 1.413 19880
1181 1 5 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.418 0.131 19880
1182 1 5 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.787 -3.374 19880
1183 1 5 . 1 1 40 40 CYS CB C 40 40.902 40.902 28.084 12.819 19880
1184 1 5 . 1 1 40 40 CYS H H 40 8.536 8.536 8.726 -0.190 19880
1185 1 5 . 1 1 41 41 THR N N 41 117.753 117.753 116.407 1.346 19880
1186 1 5 . 1 1 41 41 THR HA H 41 4.641 4.641 4.604 0.037 19880
1187 1 5 . 1 1 41 41 THR CA C 41 60.550 60.550 60.181 0.369 19880
1188 1 5 . 1 1 41 41 THR CB C 41 71.033 71.033 71.856 -0.823 19880
1189 1 5 . 1 1 41 41 THR H H 41 9.779 9.779 8.931 0.848 19880
1190 1 5 . 1 1 42 42 GLY N N 42 105.809 105.809 108.943 -3.134 19880
1191 1 5 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.745 -0.730 19880
1192 1 5 . 1 1 42 42 GLY H H 42 8.247 8.247 8.337 -0.090 19880
1193 1 5 . 1 1 43 43 PHE N N 43 123.293 123.293 121.569 1.724 19880
1194 1 5 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.413 -0.115 19880
1195 1 5 . 1 1 43 43 PHE CA C 43 60.196 60.196 57.450 2.746 19880
1196 1 5 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.540 -0.890 19880
1197 1 5 . 1 1 43 43 PHE H H 43 8.707 8.707 8.582 0.125 19880
1198 1 5 . 1 1 44 44 LEU N N 44 120.771 120.771 125.448 -4.677 19880
1199 1 5 . 1 1 44 44 LEU HA H 44 3.848 3.848 3.625 0.223 19880
1200 1 5 . 1 1 44 44 LEU CB C 44 40.386 40.386 41.195 -0.809 19880
1201 1 5 . 1 1 44 44 LEU H H 44 8.645 8.645 8.035 0.610 19880
1202 1 5 . 1 1 45 45 GLY N N 45 107.545 107.545 105.061 2.484 19880
1203 1 5 . 1 1 45 45 GLY CA C 45 47.311 47.311 46.015 1.296 19880
1204 1 5 . 1 1 45 45 GLY H H 45 7.831 7.831 7.744 0.087 19880
1205 1 5 . 1 1 46 46 THR N N 46 104.485 104.485 111.310 -6.825 19880
1206 1 5 . 1 1 46 46 THR HA H 46 3.901 3.901 4.138 -0.237 19880
1207 1 5 . 1 1 46 46 THR CA C 46 62.180 62.180 63.395 -1.216 19880
1208 1 5 . 1 1 46 46 THR CB C 46 70.021 70.021 68.872 1.149 19880
1209 1 5 . 1 1 46 46 THR H H 46 6.823 6.823 8.027 -1.204 19880
1210 1 5 . 1 1 47 47 THR N N 47 123.300 123.300 118.191 5.109 19880
1211 1 5 . 1 1 47 47 THR HA H 47 4.371 4.371 5.137 -0.766 19880
1212 1 5 . 1 1 47 47 THR CA C 47 62.843 62.843 61.607 1.236 19880
1213 1 5 . 1 1 47 47 THR CB C 47 70.176 70.176 72.556 -2.380 19880
1214 1 5 . 1 1 47 47 THR H H 47 8.763 8.763 7.703 1.060 19880
1215 1 5 . 1 1 48 48 CYS N N 48 128.024 128.024 124.568 3.456 19880
1216 1 5 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.992 -0.019 19880
1217 1 5 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.090 -1.105 19880
1218 1 5 . 1 1 48 48 CYS CB C 48 36.282 36.282 28.786 7.496 19880
1219 1 5 . 1 1 48 48 CYS H H 48 9.276 9.276 8.454 0.822 19880
1220 1 5 . 1 1 49 49 THR N N 49 131.810 131.810 120.527 11.283 19880
1221 1 5 . 1 1 49 49 THR HA H 49 4.364 4.364 4.702 -0.338 19880
1222 1 5 . 1 1 49 49 THR CA C 49 61.871 61.871 61.574 0.297 19880
1223 1 5 . 1 1 49 49 THR CB C 49 69.789 69.789 72.712 -2.923 19880
1224 1 5 . 1 1 49 49 THR H H 49 9.194 9.194 8.878 0.316 19880
1225 1 5 . 1 1 50 50 CYS N N 50 123.835 123.835 121.310 2.525 19880
1226 1 5 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.108 -0.073 19880
1227 1 5 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.141 -6.261 19880
1228 1 5 . 1 1 50 50 CYS CB C 50 34.934 34.934 30.088 4.846 19880
1229 1 5 . 1 1 50 50 CYS H H 50 8.879 8.879 8.620 0.259 19880
1230 1 5 . 1 1 51 51 ILE N N 51 123.986 123.986 122.299 1.687 19880
1231 1 5 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.369 -0.226 19880
1232 1 5 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.135 0.485 19880
1233 1 5 . 1 1 51 51 ILE CB C 51 39.380 39.380 40.074 -0.694 19880
1234 1 5 . 1 1 51 51 ILE H H 51 8.098 8.098 8.834 -0.736 19880
1235 1 5 . 1 1 52 52 ASN N N 52 126.122 126.122 125.466 0.656 19880
1236 1 5 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.860 -0.144 19880
1237 1 5 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.675 1.216 19880
1238 1 5 . 1 1 52 52 ASN CB C 52 37.913 37.913 37.909 0.004 19880
1239 1 5 . 1 1 52 52 ASN H H 52 8.323 8.323 8.648 -0.325 19880
1240 1 5 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.532 -0.225 19880
1241 1 5 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.482 0.551 19880
1242 1 5 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.729 3.131 19880
1243 1 5 . 1 1 54 54 CYS N N 54 123.090 123.090 117.790 5.300 19880
1244 1 5 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.119 0.617 19880
1245 1 5 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.839 -2.689 19880
1246 1 5 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.923 19.231 19880
1247 1 5 . 1 1 54 54 CYS H H 54 8.865 8.865 8.478 0.387 19880
1248 1 5 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.442 -0.156 19880
1249 1 5 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.773 -0.515 19880
1250 1 5 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.345 0.105 19880
1251 1 5 . 1 1 56 56 ARG N N 56 117.289 117.289 118.628 -1.339 19880
1252 1 5 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.438 0.047 19880
1253 1 5 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.817 -0.696 19880
1254 1 5 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.178 -0.639 19880
1255 1 5 . 1 1 56 56 ARG H H 56 7.902 7.902 8.418 -0.516 19880
1256 1 6 . 1 1 3 3 CYS N N 3 117.561 117.561 116.656 0.905 19880
1257 1 6 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.126 -0.306 19880
1258 1 6 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.225 -2.525 19880
1259 1 6 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.955 19.696 19880
1260 1 6 . 1 1 3 3 CYS H H 3 7.950 7.950 7.895 0.055 19880
1261 1 6 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.785 -0.280 19880
1262 1 6 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.994 0.736 19880
1263 1 6 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.605 0.695 19880
1264 1 6 . 1 1 5 5 THR N N 5 118.207 118.207 115.352 2.855 19880
1265 1 6 . 1 1 5 5 THR HA H 5 4.814 4.814 4.652 0.162 19880
1266 1 6 . 1 1 5 5 THR CA C 5 61.618 61.618 61.624 -0.006 19880
1267 1 6 . 1 1 5 5 THR CB C 5 70.257 70.257 70.123 0.134 19880
1268 1 6 . 1 1 5 5 THR H H 5 8.529 8.529 8.337 0.192 19880
1269 1 6 . 1 1 6 6 ARG N N 6 123.211 123.211 124.780 -1.569 19880
1270 1 6 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.709 -0.181 19880
1271 1 6 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.089 -0.158 19880
1272 1 6 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.896 -0.144 19880
1273 1 6 . 1 1 6 6 ARG H H 6 7.693 7.693 8.763 -1.070 19880
1274 1 6 . 1 1 7 7 ARG N N 7 121.558 121.558 121.684 -0.126 19880
1275 1 6 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.553 0.113 19880
1276 1 6 . 1 1 7 7 ARG CA C 7 54.415 54.415 54.570 -0.155 19880
1277 1 6 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.905 -0.232 19880
1278 1 6 . 1 1 7 7 ARG H H 7 8.450 8.450 8.158 0.292 19880
1279 1 6 . 1 1 8 8 GLY N N 8 111.006 111.006 108.403 2.603 19880
1280 1 6 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.869 0.784 19880
1281 1 6 . 1 1 8 8 GLY H H 8 9.382 9.382 8.702 0.680 19880
1282 1 6 . 1 1 9 9 LEU N N 9 119.202 119.202 118.457 0.745 19880
1283 1 6 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.040 -0.150 19880
1284 1 6 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.621 1.133 19880
1285 1 6 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.574 1.196 19880
1286 1 6 . 1 1 9 9 LEU H H 9 8.215 8.215 8.012 0.203 19880
1287 1 6 . 1 1 10 10 CYS N N 10 115.050 115.050 115.194 -0.144 19880
1288 1 6 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.412 -0.522 19880
1289 1 6 . 1 1 10 10 CYS CA C 10 61.378 61.378 59.561 1.817 19880
1290 1 6 . 1 1 10 10 CYS CB C 10 42.589 42.589 24.469 18.120 19880
1291 1 6 . 1 1 10 10 CYS H H 10 9.282 9.282 8.379 0.903 19880
1292 1 6 . 1 1 11 11 VAL N N 11 117.792 117.792 121.383 -3.591 19880
1293 1 6 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.184 -0.413 19880
1294 1 6 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.356 0.152 19880
1295 1 6 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.743 -0.145 19880
1296 1 6 . 1 1 11 11 VAL H H 11 7.315 7.315 8.134 -0.819 19880
1297 1 6 . 1 1 12 12 THR N N 12 109.816 109.816 111.227 -1.411 19880
1298 1 6 . 1 1 12 12 THR HA H 12 4.044 4.044 4.462 -0.418 19880
1299 1 6 . 1 1 12 12 THR CA C 12 63.575 63.575 63.786 -0.211 19880
1300 1 6 . 1 1 12 12 THR CB C 12 69.400 69.400 69.662 -0.262 19880
1301 1 6 . 1 1 12 12 THR H H 12 8.214 8.214 7.798 0.416 19880
1302 1 6 . 1 1 13 13 SER N N 13 114.455 114.455 115.654 -1.199 19880
1303 1 6 . 1 1 13 13 SER HA H 13 4.607 4.607 4.637 -0.030 19880
1304 1 6 . 1 1 13 13 SER CA C 13 59.460 59.460 58.374 1.085 19880
1305 1 6 . 1 1 13 13 SER CB C 13 64.586 64.586 65.467 -0.881 19880
1306 1 6 . 1 1 13 13 SER H H 13 7.511 7.511 7.700 -0.189 19880
1307 1 6 . 1 1 14 14 GLY N N 14 109.125 109.125 109.747 -0.622 19880
1308 1 6 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.562 -0.238 19880
1309 1 6 . 1 1 14 14 GLY H H 14 8.376 8.376 7.827 0.549 19880
1310 1 6 . 1 1 15 15 LEU N N 15 120.782 120.782 121.121 -0.339 19880
1311 1 6 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.197 -0.261 19880
1312 1 6 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.134 0.852 19880
1313 1 6 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.113 -0.587 19880
1314 1 6 . 1 1 15 15 LEU H H 15 8.469 8.469 8.715 -0.246 19880
1315 1 6 . 1 1 16 16 THR N N 16 115.887 115.887 114.316 1.571 19880
1316 1 6 . 1 1 16 16 THR HA H 16 3.602 3.602 3.944 -0.342 19880
1317 1 6 . 1 1 16 16 THR CA C 16 67.196 67.196 66.462 0.734 19880
1318 1 6 . 1 1 16 16 THR CB C 16 68.003 68.003 68.300 -0.297 19880
1319 1 6 . 1 1 16 16 THR H H 16 8.487 8.487 8.282 0.205 19880
1320 1 6 . 1 1 17 17 ALA N N 17 122.643 122.643 123.377 -0.734 19880
1321 1 6 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.353 -0.339 19880
1322 1 6 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.553 0.288 19880
1323 1 6 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.097 0.834 19880
1324 1 6 . 1 1 17 17 ALA H H 17 7.609 7.609 7.737 -0.128 19880
1325 1 6 . 1 1 18 18 CYS N N 18 118.252 118.252 118.641 -0.389 19880
1326 1 6 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.240 0.013 19880
1327 1 6 . 1 1 18 18 CYS CA C 18 58.453 58.453 60.988 -2.535 19880
1328 1 6 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.241 12.405 19880
1329 1 6 . 1 1 18 18 CYS H H 18 7.644 7.644 7.746 -0.102 19880
1330 1 6 . 1 1 19 19 ARG N N 19 120.422 120.422 120.396 0.026 19880
1331 1 6 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.080 -0.605 19880
1332 1 6 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.686 0.866 19880
1333 1 6 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.346 -0.545 19880
1334 1 6 . 1 1 19 19 ARG H H 19 9.072 9.072 8.445 0.627 19880
1335 1 6 . 1 1 20 20 ASN N N 20 117.466 117.466 116.857 0.609 19880
1336 1 6 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.564 -0.352 19880
1337 1 6 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.650 -0.039 19880
1338 1 6 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.156 -0.901 19880
1339 1 6 . 1 1 20 20 ASN H H 20 8.411 8.411 7.978 0.433 19880
1340 1 6 . 1 1 21 21 HIS N N 21 120.420 120.420 120.236 0.184 19880
1341 1 6 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.520 -0.346 19880
1342 1 6 . 1 1 21 21 HIS CA C 21 59.154 59.154 60.093 -0.938 19880
1343 1 6 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.029 1.559 19880
1344 1 6 . 1 1 21 21 HIS H H 21 7.827 7.827 7.925 -0.098 19880
1345 1 6 . 1 1 22 22 CYS N N 22 117.510 117.510 117.935 -0.425 19880
1346 1 6 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.342 -1.183 19880
1347 1 6 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.900 -3.679 19880
1348 1 6 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.360 10.818 19880
1349 1 6 . 1 1 22 22 CYS H H 22 8.500 8.500 7.918 0.582 19880
1350 1 6 . 1 1 23 23 ARG N N 23 116.564 116.564 116.726 -0.162 19880
1351 1 6 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.673 -0.020 19880
1352 1 6 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.707 0.321 19880
1353 1 6 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.704 -0.049 19880
1354 1 6 . 1 1 23 23 ARG H H 23 7.985 7.985 7.898 0.087 19880
1355 1 6 . 1 1 24 24 SER N N 24 116.727 116.727 113.082 3.645 19880
1356 1 6 . 1 1 24 24 SER HA H 24 4.552 4.552 4.593 -0.041 19880
1357 1 6 . 1 1 24 24 SER CA C 24 57.592 57.592 57.170 0.422 19880
1358 1 6 . 1 1 24 24 SER CB C 24 65.284 65.284 66.769 -1.485 19880
1359 1 6 . 1 1 24 24 SER H H 24 7.435 7.435 7.323 0.112 19880
1360 1 6 . 1 1 25 25 CYS N N 25 121.909 121.909 120.396 1.513 19880
1361 1 6 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.704 -0.068 19880
1362 1 6 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.687 -2.073 19880
1363 1 6 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.066 13.207 19880
1364 1 6 . 1 1 25 25 CYS H H 25 9.000 9.000 8.829 0.171 19880
1365 1 6 . 1 1 26 26 HIS N N 26 126.609 126.609 120.494 6.115 19880
1366 1 6 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.177 -0.225 19880
1367 1 6 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.386 0.336 19880
1368 1 6 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.739 0.361 19880
1369 1 6 . 1 1 26 26 HIS H H 26 9.255 9.255 8.790 0.465 19880
1370 1 6 . 1 1 27 27 ARG N N 27 122.033 122.033 121.612 0.421 19880
1371 1 6 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.271 -0.249 19880
1372 1 6 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.900 1.577 19880
1373 1 6 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.678 -0.798 19880
1374 1 6 . 1 1 27 27 ARG H H 27 8.314 8.314 8.180 0.134 19880
1375 1 6 . 1 1 28 28 GLY N N 28 119.213 119.213 113.946 5.267 19880
1376 1 6 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.633 -0.661 19880
1377 1 6 . 1 1 28 28 GLY H H 28 8.495 8.495 8.594 -0.099 19880
1378 1 6 . 1 1 29 29 ASP N N 29 121.258 121.258 117.827 3.431 19880
1379 1 6 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.694 -0.430 19880
1380 1 6 . 1 1 29 29 ASP CA C 29 57.446 57.446 54.806 2.640 19880
1381 1 6 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.483 -1.044 19880
1382 1 6 . 1 1 29 29 ASP H H 29 8.646 8.646 8.453 0.193 19880
1383 1 6 . 1 1 30 30 VAL N N 30 112.703 112.703 116.320 -3.617 19880
1384 1 6 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.509 -0.286 19880
1385 1 6 . 1 1 30 30 VAL CA C 30 61.407 61.407 62.160 -0.753 19880
1386 1 6 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.266 -0.361 19880
1387 1 6 . 1 1 30 30 VAL H H 30 8.026 8.026 7.958 0.068 19880
1388 1 6 . 1 1 31 31 GLY N N 31 109.481 109.481 108.546 0.935 19880
1389 1 6 . 1 1 31 31 GLY CA C 31 44.366 44.366 45.182 -0.816 19880
1390 1 6 . 1 1 31 31 GLY H H 31 7.511 7.511 7.683 -0.172 19880
1391 1 6 . 1 1 32 32 CYS N N 32 121.673 121.673 119.714 1.959 19880
1392 1 6 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.332 -0.386 19880
1393 1 6 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.173 -3.992 19880
1394 1 6 . 1 1 32 32 CYS CB C 32 41.296 41.296 29.461 11.835 19880
1395 1 6 . 1 1 32 32 CYS H H 32 8.554 8.554 8.217 0.337 19880
1396 1 6 . 1 1 33 33 VAL N N 33 119.401 119.401 118.527 0.874 19880
1397 1 6 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.946 -0.151 19880
1398 1 6 . 1 1 33 33 VAL CA C 33 59.311 59.311 60.079 -0.768 19880
1399 1 6 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.780 0.700 19880
1400 1 6 . 1 1 33 33 VAL H H 33 9.025 9.025 8.929 0.096 19880
1401 1 6 . 1 1 34 34 ARG N N 34 120.394 120.394 115.745 4.649 19880
1402 1 6 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.756 -0.057 19880
1403 1 6 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.094 1.097 19880
1404 1 6 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.477 -0.339 19880
1405 1 6 . 1 1 34 34 ARG H H 34 8.350 8.350 8.700 -0.350 19880
1406 1 6 . 1 1 35 35 CYS N N 35 118.098 118.098 118.142 -0.044 19880
1407 1 6 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.408 0.643 19880
1408 1 6 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.279 -2.002 19880
1409 1 6 . 1 1 35 35 CYS CB C 35 44.553 44.553 32.093 12.460 19880
1410 1 6 . 1 1 35 35 CYS H H 35 8.567 8.567 9.067 -0.500 19880
1411 1 6 . 1 1 36 36 SER N N 36 114.009 114.009 115.640 -1.631 19880
1412 1 6 . 1 1 36 36 SER HA H 36 4.326 4.326 4.654 -0.328 19880
1413 1 6 . 1 1 36 36 SER CA C 36 60.945 60.945 60.514 0.431 19880
1414 1 6 . 1 1 36 36 SER CB C 36 64.743 64.743 64.773 -0.030 19880
1415 1 6 . 1 1 36 36 SER H H 36 7.669 7.669 8.486 -0.817 19880
1416 1 6 . 1 1 37 37 ASN N N 37 117.050 117.050 116.379 0.671 19880
1417 1 6 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.804 -0.396 19880
1418 1 6 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.592 -0.506 19880
1419 1 6 . 1 1 37 37 ASN CB C 37 41.374 41.374 40.634 0.740 19880
1420 1 6 . 1 1 37 37 ASN H H 37 7.755 7.755 7.461 0.294 19880
1421 1 6 . 1 1 38 38 ALA N N 38 123.735 123.735 120.296 3.439 19880
1422 1 6 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.949 0.213 19880
1423 1 6 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.505 0.629 19880
1424 1 6 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.027 -2.834 19880
1425 1 6 . 1 1 38 38 ALA H H 38 9.323 9.323 8.307 1.016 19880
1426 1 6 . 1 1 39 39 GLN N N 39 116.531 116.531 117.390 -0.859 19880
1427 1 6 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.721 -0.408 19880
1428 1 6 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.208 0.541 19880
1429 1 6 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.037 1.780 19880
1430 1 6 . 1 1 39 39 GLN H H 39 8.746 8.746 9.004 -0.258 19880
1431 1 6 . 1 1 40 40 CYS N N 40 122.074 122.074 120.157 1.917 19880
1432 1 6 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.549 0.000 19880
1433 1 6 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.596 -3.183 19880
1434 1 6 . 1 1 40 40 CYS CB C 40 40.902 40.902 28.759 12.143 19880
1435 1 6 . 1 1 40 40 CYS H H 40 8.536 8.536 8.682 -0.146 19880
1436 1 6 . 1 1 41 41 THR N N 41 117.753 117.753 115.228 2.525 19880
1437 1 6 . 1 1 41 41 THR HA H 41 4.641 4.641 4.594 0.047 19880
1438 1 6 . 1 1 41 41 THR CA C 41 60.550 60.550 60.106 0.444 19880
1439 1 6 . 1 1 41 41 THR CB C 41 71.033 71.033 71.062 -0.030 19880
1440 1 6 . 1 1 41 41 THR H H 41 9.779 9.779 8.953 0.826 19880
1441 1 6 . 1 1 42 42 GLY N N 42 105.809 105.809 108.040 -2.231 19880
1442 1 6 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.915 -0.900 19880
1443 1 6 . 1 1 42 42 GLY H H 42 8.247 8.247 8.157 0.090 19880
1444 1 6 . 1 1 43 43 PHE N N 43 123.293 123.293 121.031 2.262 19880
1445 1 6 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.508 -0.210 19880
1446 1 6 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.821 0.375 19880
1447 1 6 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.581 -0.931 19880
1448 1 6 . 1 1 43 43 PHE H H 43 8.707 8.707 8.980 -0.273 19880
1449 1 6 . 1 1 44 44 LEU N N 44 120.771 120.771 118.471 2.300 19880
1450 1 6 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.348 -0.500 19880
1451 1 6 . 1 1 44 44 LEU CB C 44 40.386 40.386 43.179 -2.793 19880
1452 1 6 . 1 1 44 44 LEU H H 44 8.645 8.645 7.638 1.007 19880
1453 1 6 . 1 1 45 45 GLY N N 45 107.545 107.545 107.774 -0.229 19880
1454 1 6 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.885 1.426 19880
1455 1 6 . 1 1 45 45 GLY H H 45 7.831 7.831 7.485 0.346 19880
1456 1 6 . 1 1 46 46 THR N N 46 104.485 104.485 109.270 -4.785 19880
1457 1 6 . 1 1 46 46 THR HA H 46 3.901 3.901 4.171 -0.270 19880
1458 1 6 . 1 1 46 46 THR CA C 46 62.180 62.180 62.970 -0.790 19880
1459 1 6 . 1 1 46 46 THR CB C 46 70.021 70.021 69.385 0.636 19880
1460 1 6 . 1 1 46 46 THR H H 46 6.823 6.823 7.770 -0.947 19880
1461 1 6 . 1 1 47 47 THR N N 47 123.300 123.300 118.198 5.102 19880
1462 1 6 . 1 1 47 47 THR HA H 47 4.371 4.371 4.622 -0.251 19880
1463 1 6 . 1 1 47 47 THR CA C 47 62.843 62.843 61.808 1.035 19880
1464 1 6 . 1 1 47 47 THR CB C 47 70.176 70.176 72.154 -1.978 19880
1465 1 6 . 1 1 47 47 THR H H 47 8.763 8.763 7.937 0.826 19880
1466 1 6 . 1 1 48 48 CYS N N 48 128.024 128.024 125.051 2.973 19880
1467 1 6 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.988 -0.015 19880
1468 1 6 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.327 -1.343 19880
1469 1 6 . 1 1 48 48 CYS CB C 48 36.282 36.282 29.172 7.110 19880
1470 1 6 . 1 1 48 48 CYS H H 48 9.276 9.276 8.949 0.327 19880
1471 1 6 . 1 1 49 49 THR N N 49 131.810 131.810 121.543 10.267 19880
1472 1 6 . 1 1 49 49 THR HA H 49 4.364 4.364 4.735 -0.371 19880
1473 1 6 . 1 1 49 49 THR CA C 49 61.871 61.871 62.045 -0.174 19880
1474 1 6 . 1 1 49 49 THR CB C 49 69.789 69.789 72.933 -3.143 19880
1475 1 6 . 1 1 49 49 THR H H 49 9.194 9.194 8.921 0.273 19880
1476 1 6 . 1 1 50 50 CYS N N 50 123.835 123.835 121.445 2.390 19880
1477 1 6 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.112 -0.077 19880
1478 1 6 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.188 -6.308 19880
1479 1 6 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.987 4.947 19880
1480 1 6 . 1 1 50 50 CYS H H 50 8.879 8.879 8.612 0.267 19880
1481 1 6 . 1 1 51 51 ILE N N 51 123.986 123.986 122.647 1.339 19880
1482 1 6 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.430 -0.287 19880
1483 1 6 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.004 0.615 19880
1484 1 6 . 1 1 51 51 ILE CB C 51 39.380 39.380 40.111 -0.731 19880
1485 1 6 . 1 1 51 51 ILE H H 51 8.098 8.098 8.895 -0.797 19880
1486 1 6 . 1 1 52 52 ASN N N 52 126.122 126.122 124.095 2.027 19880
1487 1 6 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.822 -0.106 19880
1488 1 6 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.823 1.068 19880
1489 1 6 . 1 1 52 52 ASN CB C 52 37.913 37.913 38.103 -0.190 19880
1490 1 6 . 1 1 52 52 ASN H H 52 8.323 8.323 8.636 -0.313 19880
1491 1 6 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.593 -0.286 19880
1492 1 6 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.512 0.521 19880
1493 1 6 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.883 2.977 19880
1494 1 6 . 1 1 54 54 CYS N N 54 123.090 123.090 117.770 5.320 19880
1495 1 6 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.105 0.631 19880
1496 1 6 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.830 -2.680 19880
1497 1 6 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.843 19.311 19880
1498 1 6 . 1 1 54 54 CYS H H 54 8.865 8.865 8.465 0.400 19880
1499 1 6 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.462 -0.176 19880
1500 1 6 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.693 -0.435 19880
1501 1 6 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.358 0.092 19880
1502 1 6 . 1 1 56 56 ARG N N 56 117.289 117.289 118.034 -0.745 19880
1503 1 6 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.510 -0.025 19880
1504 1 6 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.849 -0.728 19880
1505 1 6 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.190 -0.651 19880
1506 1 6 . 1 1 56 56 ARG H H 56 7.902 7.902 8.427 -0.525 19880
1507 1 7 . 1 1 3 3 CYS N N 3 117.561 117.561 116.324 1.237 19880
1508 1 7 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.321 -0.501 19880
1509 1 7 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.076 -2.376 19880
1510 1 7 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.723 19.928 19880
1511 1 7 . 1 1 3 3 CYS H H 3 7.950 7.950 7.997 -0.047 19880
1512 1 7 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.631 -0.126 19880
1513 1 7 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.792 0.938 19880
1514 1 7 . 1 1 4 4 PRO CB C 4 33.299 33.299 33.370 -0.071 19880
1515 1 7 . 1 1 5 5 THR N N 5 118.207 118.207 114.642 3.565 19880
1516 1 7 . 1 1 5 5 THR HA H 5 4.814 4.814 4.703 0.111 19880
1517 1 7 . 1 1 5 5 THR CA C 5 61.618 61.618 61.675 -0.057 19880
1518 1 7 . 1 1 5 5 THR CB C 5 70.257 70.257 69.932 0.325 19880
1519 1 7 . 1 1 5 5 THR H H 5 8.529 8.529 8.312 0.217 19880
1520 1 7 . 1 1 6 6 ARG N N 6 123.211 123.211 124.849 -1.638 19880
1521 1 7 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.671 -0.143 19880
1522 1 7 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.177 -0.246 19880
1523 1 7 . 1 1 6 6 ARG CB C 6 32.752 32.752 33.118 -0.366 19880
1524 1 7 . 1 1 6 6 ARG H H 6 7.693 7.693 8.720 -1.027 19880
1525 1 7 . 1 1 7 7 ARG N N 7 121.558 121.558 121.993 -0.435 19880
1526 1 7 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.601 0.065 19880
1527 1 7 . 1 1 7 7 ARG CA C 7 54.415 54.415 54.618 -0.203 19880
1528 1 7 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.920 -0.247 19880
1529 1 7 . 1 1 7 7 ARG H H 7 8.450 8.450 8.138 0.312 19880
1530 1 7 . 1 1 8 8 GLY N N 8 111.006 111.006 108.331 2.675 19880
1531 1 7 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.841 0.812 19880
1532 1 7 . 1 1 8 8 GLY H H 8 9.382 9.382 8.707 0.675 19880
1533 1 7 . 1 1 9 9 LEU N N 9 119.202 119.202 118.423 0.779 19880
1534 1 7 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.016 -0.126 19880
1535 1 7 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.967 0.787 19880
1536 1 7 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.637 1.133 19880
1537 1 7 . 1 1 9 9 LEU H H 9 8.215 8.215 8.044 0.171 19880
1538 1 7 . 1 1 10 10 CYS N N 10 115.050 115.050 114.181 0.869 19880
1539 1 7 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.255 -0.365 19880
1540 1 7 . 1 1 10 10 CYS CA C 10 61.378 61.378 59.513 1.865 19880
1541 1 7 . 1 1 10 10 CYS CB C 10 42.589 42.589 24.821 17.768 19880
1542 1 7 . 1 1 10 10 CYS H H 10 9.282 9.282 8.285 0.997 19880
1543 1 7 . 1 1 11 11 VAL N N 11 117.792 117.792 118.899 -1.107 19880
1544 1 7 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.178 -0.407 19880
1545 1 7 . 1 1 11 11 VAL CA C 11 64.508 64.508 63.986 0.522 19880
1546 1 7 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.667 -0.069 19880
1547 1 7 . 1 1 11 11 VAL H H 11 7.315 7.315 8.166 -0.851 19880
1548 1 7 . 1 1 12 12 THR N N 12 109.816 109.816 113.256 -3.440 19880
1549 1 7 . 1 1 12 12 THR HA H 12 4.044 4.044 4.476 -0.432 19880
1550 1 7 . 1 1 12 12 THR CA C 12 63.575 63.575 62.702 0.873 19880
1551 1 7 . 1 1 12 12 THR CB C 12 69.400 69.400 69.266 0.134 19880
1552 1 7 . 1 1 12 12 THR H H 12 8.214 8.214 7.891 0.323 19880
1553 1 7 . 1 1 13 13 SER N N 13 114.455 114.455 115.365 -0.910 19880
1554 1 7 . 1 1 13 13 SER HA H 13 4.607 4.607 4.679 -0.072 19880
1555 1 7 . 1 1 13 13 SER CA C 13 59.460 59.460 58.353 1.107 19880
1556 1 7 . 1 1 13 13 SER CB C 13 64.586 64.586 65.776 -1.190 19880
1557 1 7 . 1 1 13 13 SER H H 13 7.511 7.511 7.749 -0.238 19880
1558 1 7 . 1 1 14 14 GLY N N 14 109.125 109.125 109.482 -0.357 19880
1559 1 7 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.561 -0.237 19880
1560 1 7 . 1 1 14 14 GLY H H 14 8.376 8.376 7.888 0.488 19880
1561 1 7 . 1 1 15 15 LEU N N 15 120.782 120.782 121.588 -0.806 19880
1562 1 7 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.225 -0.289 19880
1563 1 7 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.110 0.876 19880
1564 1 7 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.025 -0.499 19880
1565 1 7 . 1 1 15 15 LEU H H 15 8.469 8.469 8.653 -0.184 19880
1566 1 7 . 1 1 16 16 THR N N 16 115.887 115.887 114.666 1.221 19880
1567 1 7 . 1 1 16 16 THR HA H 16 3.602 3.602 3.941 -0.339 19880
1568 1 7 . 1 1 16 16 THR CA C 16 67.196 67.196 67.166 0.030 19880
1569 1 7 . 1 1 16 16 THR CB C 16 68.003 68.003 68.012 -0.009 19880
1570 1 7 . 1 1 16 16 THR H H 16 8.487 8.487 8.311 0.176 19880
1571 1 7 . 1 1 17 17 ALA N N 17 122.643 122.643 123.222 -0.579 19880
1572 1 7 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.370 -0.356 19880
1573 1 7 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.504 0.337 19880
1574 1 7 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.041 0.890 19880
1575 1 7 . 1 1 17 17 ALA H H 17 7.609 7.609 7.714 -0.105 19880
1576 1 7 . 1 1 18 18 CYS N N 18 118.252 118.252 118.609 -0.357 19880
1577 1 7 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.262 -0.009 19880
1578 1 7 . 1 1 18 18 CYS CA C 18 58.453 58.453 61.000 -2.547 19880
1579 1 7 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.283 12.363 19880
1580 1 7 . 1 1 18 18 CYS H H 18 7.644 7.644 7.749 -0.105 19880
1581 1 7 . 1 1 19 19 ARG N N 19 120.422 120.422 120.173 0.249 19880
1582 1 7 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.107 -0.632 19880
1583 1 7 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.575 0.977 19880
1584 1 7 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.394 -0.593 19880
1585 1 7 . 1 1 19 19 ARG H H 19 9.072 9.072 8.399 0.673 19880
1586 1 7 . 1 1 20 20 ASN N N 20 117.466 117.466 117.349 0.117 19880
1587 1 7 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.580 -0.368 19880
1588 1 7 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.743 -0.132 19880
1589 1 7 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.183 -0.928 19880
1590 1 7 . 1 1 20 20 ASN H H 20 8.411 8.411 7.940 0.471 19880
1591 1 7 . 1 1 21 21 HIS N N 21 120.420 120.420 120.420 0.000 19880
1592 1 7 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.501 -0.327 19880
1593 1 7 . 1 1 21 21 HIS CA C 21 59.154 59.154 60.108 -0.954 19880
1594 1 7 . 1 1 21 21 HIS CB C 21 31.588 31.588 29.936 1.652 19880
1595 1 7 . 1 1 21 21 HIS H H 21 7.827 7.827 8.167 -0.340 19880
1596 1 7 . 1 1 22 22 CYS N N 22 117.510 117.510 117.990 -0.480 19880
1597 1 7 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.304 -1.145 19880
1598 1 7 . 1 1 22 22 CYS CA C 22 58.221 58.221 62.299 -4.078 19880
1599 1 7 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.063 11.115 19880
1600 1 7 . 1 1 22 22 CYS H H 22 8.500 8.500 7.938 0.562 19880
1601 1 7 . 1 1 23 23 ARG N N 23 116.564 116.564 118.588 -2.024 19880
1602 1 7 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.693 -0.040 19880
1603 1 7 . 1 1 23 23 ARG CA C 23 57.028 57.028 58.032 -1.004 19880
1604 1 7 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.943 -0.288 19880
1605 1 7 . 1 1 23 23 ARG H H 23 7.985 7.985 7.985 -0.000 19880
1606 1 7 . 1 1 24 24 SER N N 24 116.727 116.727 113.688 3.039 19880
1607 1 7 . 1 1 24 24 SER HA H 24 4.552 4.552 4.536 0.016 19880
1608 1 7 . 1 1 24 24 SER CA C 24 57.592 57.592 58.418 -0.826 19880
1609 1 7 . 1 1 24 24 SER CB C 24 65.284 65.284 65.309 -0.026 19880
1610 1 7 . 1 1 24 24 SER H H 24 7.435 7.435 7.514 -0.079 19880
1611 1 7 . 1 1 25 25 CYS N N 25 121.909 121.909 120.324 1.585 19880
1612 1 7 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.669 -0.033 19880
1613 1 7 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.719 -2.105 19880
1614 1 7 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.165 13.108 19880
1615 1 7 . 1 1 25 25 CYS H H 25 9.000 9.000 8.832 0.168 19880
1616 1 7 . 1 1 26 26 HIS N N 26 126.609 126.609 120.247 6.362 19880
1617 1 7 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.311 -0.359 19880
1618 1 7 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.283 0.438 19880
1619 1 7 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.852 0.248 19880
1620 1 7 . 1 1 26 26 HIS H H 26 9.255 9.255 8.776 0.479 19880
1621 1 7 . 1 1 27 27 ARG N N 27 122.033 122.033 121.187 0.846 19880
1622 1 7 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.318 -0.296 19880
1623 1 7 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.808 1.669 19880
1624 1 7 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.698 -0.818 19880
1625 1 7 . 1 1 27 27 ARG H H 27 8.314 8.314 8.158 0.156 19880
1626 1 7 . 1 1 28 28 GLY N N 28 119.213 119.213 112.818 6.395 19880
1627 1 7 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.679 -0.707 19880
1628 1 7 . 1 1 28 28 GLY H H 28 8.495 8.495 7.831 0.664 19880
1629 1 7 . 1 1 29 29 ASP N N 29 121.258 121.258 117.824 3.434 19880
1630 1 7 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.651 -0.387 19880
1631 1 7 . 1 1 29 29 ASP CA C 29 57.446 57.446 54.882 2.564 19880
1632 1 7 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.420 -0.982 19880
1633 1 7 . 1 1 29 29 ASP H H 29 8.646 8.646 8.340 0.306 19880
1634 1 7 . 1 1 30 30 VAL N N 30 112.703 112.703 117.157 -4.454 19880
1635 1 7 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.514 -0.291 19880
1636 1 7 . 1 1 30 30 VAL CA C 30 61.407 61.407 62.761 -1.354 19880
1637 1 7 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.582 -0.677 19880
1638 1 7 . 1 1 30 30 VAL H H 30 8.026 8.026 7.921 0.105 19880
1639 1 7 . 1 1 31 31 GLY N N 31 109.481 109.481 107.742 1.739 19880
1640 1 7 . 1 1 31 31 GLY CA C 31 44.366 44.366 45.397 -1.031 19880
1641 1 7 . 1 1 31 31 GLY H H 31 7.511 7.511 7.747 -0.236 19880
1642 1 7 . 1 1 32 32 CYS N N 32 121.673 121.673 119.980 1.693 19880
1643 1 7 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.093 -0.147 19880
1644 1 7 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.386 -4.205 19880
1645 1 7 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.825 14.471 19880
1646 1 7 . 1 1 32 32 CYS H H 32 8.554 8.554 8.489 0.065 19880
1647 1 7 . 1 1 33 33 VAL N N 33 119.401 119.401 118.848 0.553 19880
1648 1 7 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.974 -0.179 19880
1649 1 7 . 1 1 33 33 VAL CA C 33 59.311 59.311 60.061 -0.750 19880
1650 1 7 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.682 0.798 19880
1651 1 7 . 1 1 33 33 VAL H H 33 9.025 9.025 8.901 0.124 19880
1652 1 7 . 1 1 34 34 ARG N N 34 120.394 120.394 116.147 4.247 19880
1653 1 7 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.710 -0.011 19880
1654 1 7 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.201 0.991 19880
1655 1 7 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.681 -0.543 19880
1656 1 7 . 1 1 34 34 ARG H H 34 8.350 8.350 8.683 -0.333 19880
1657 1 7 . 1 1 35 35 CYS N N 35 118.098 118.098 118.200 -0.102 19880
1658 1 7 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.475 0.576 19880
1659 1 7 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.217 -1.940 19880
1660 1 7 . 1 1 35 35 CYS CB C 35 44.553 44.553 32.090 12.463 19880
1661 1 7 . 1 1 35 35 CYS H H 35 8.567 8.567 9.108 -0.541 19880
1662 1 7 . 1 1 36 36 SER N N 36 114.009 114.009 115.688 -1.679 19880
1663 1 7 . 1 1 36 36 SER HA H 36 4.326 4.326 4.404 -0.078 19880
1664 1 7 . 1 1 36 36 SER CA C 36 60.945 60.945 60.457 0.488 19880
1665 1 7 . 1 1 36 36 SER CB C 36 64.743 64.743 63.867 0.876 19880
1666 1 7 . 1 1 36 36 SER H H 36 7.669 7.669 8.370 -0.701 19880
1667 1 7 . 1 1 37 37 ASN N N 37 117.050 117.050 118.054 -1.004 19880
1668 1 7 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.978 -0.570 19880
1669 1 7 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.592 -0.506 19880
1670 1 7 . 1 1 37 37 ASN CB C 37 41.374 41.374 42.306 -0.932 19880
1671 1 7 . 1 1 37 37 ASN H H 37 7.755 7.755 7.557 0.198 19880
1672 1 7 . 1 1 38 38 ALA N N 38 123.735 123.735 120.289 3.446 19880
1673 1 7 . 1 1 38 38 ALA HA H 38 5.162 5.162 5.005 0.157 19880
1674 1 7 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.667 0.467 19880
1675 1 7 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.425 -3.232 19880
1676 1 7 . 1 1 38 38 ALA H H 38 9.323 9.323 8.320 1.003 19880
1677 1 7 . 1 1 39 39 GLN N N 39 116.531 116.531 116.518 0.013 19880
1678 1 7 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.730 -0.417 19880
1679 1 7 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.405 0.344 19880
1680 1 7 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.245 1.572 19880
1681 1 7 . 1 1 39 39 GLN H H 39 8.746 8.746 8.794 -0.048 19880
1682 1 7 . 1 1 40 40 CYS N N 40 122.074 122.074 120.935 1.139 19880
1683 1 7 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.425 0.124 19880
1684 1 7 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.831 -3.418 19880
1685 1 7 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.673 13.229 19880
1686 1 7 . 1 1 40 40 CYS H H 40 8.536 8.536 8.732 -0.196 19880
1687 1 7 . 1 1 41 41 THR N N 41 117.753 117.753 116.404 1.349 19880
1688 1 7 . 1 1 41 41 THR HA H 41 4.641 4.641 4.617 0.024 19880
1689 1 7 . 1 1 41 41 THR CA C 41 60.550 60.550 60.050 0.500 19880
1690 1 7 . 1 1 41 41 THR CB C 41 71.033 71.033 71.849 -0.816 19880
1691 1 7 . 1 1 41 41 THR H H 41 9.779 9.779 8.922 0.857 19880
1692 1 7 . 1 1 42 42 GLY N N 42 105.809 105.809 109.155 -3.346 19880
1693 1 7 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.987 -0.973 19880
1694 1 7 . 1 1 42 42 GLY H H 42 8.247 8.247 8.148 0.099 19880
1695 1 7 . 1 1 43 43 PHE N N 43 123.293 123.293 121.210 2.083 19880
1696 1 7 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.510 -0.212 19880
1697 1 7 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.782 0.414 19880
1698 1 7 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.629 -0.979 19880
1699 1 7 . 1 1 43 43 PHE H H 43 8.707 8.707 8.981 -0.274 19880
1700 1 7 . 1 1 44 44 LEU N N 44 120.771 120.771 118.658 2.113 19880
1701 1 7 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.322 -0.474 19880
1702 1 7 . 1 1 44 44 LEU CB C 44 40.386 40.386 42.844 -2.458 19880
1703 1 7 . 1 1 44 44 LEU H H 44 8.645 8.645 7.765 0.880 19880
1704 1 7 . 1 1 45 45 GLY N N 45 107.545 107.545 107.293 0.252 19880
1705 1 7 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.709 1.602 19880
1706 1 7 . 1 1 45 45 GLY H H 45 7.831 7.831 7.517 0.314 19880
1707 1 7 . 1 1 46 46 THR N N 46 104.485 104.485 109.268 -4.783 19880
1708 1 7 . 1 1 46 46 THR HA H 46 3.901 3.901 4.210 -0.309 19880
1709 1 7 . 1 1 46 46 THR CA C 46 62.180 62.180 62.537 -0.357 19880
1710 1 7 . 1 1 46 46 THR CB C 46 70.021 70.021 69.202 0.819 19880
1711 1 7 . 1 1 46 46 THR H H 46 6.823 6.823 7.778 -0.955 19880
1712 1 7 . 1 1 47 47 THR N N 47 123.300 123.300 117.158 6.142 19880
1713 1 7 . 1 1 47 47 THR HA H 47 4.371 4.371 4.615 -0.244 19880
1714 1 7 . 1 1 47 47 THR CA C 47 62.843 62.843 61.389 1.454 19880
1715 1 7 . 1 1 47 47 THR CB C 47 70.176 70.176 72.151 -1.975 19880
1716 1 7 . 1 1 47 47 THR H H 47 8.763 8.763 7.848 0.915 19880
1717 1 7 . 1 1 48 48 CYS N N 48 128.024 128.024 122.951 5.073 19880
1718 1 7 . 1 1 48 48 CYS HA H 48 4.973 4.973 5.027 -0.054 19880
1719 1 7 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.321 -1.337 19880
1720 1 7 . 1 1 48 48 CYS CB C 48 36.282 36.282 29.677 6.605 19880
1721 1 7 . 1 1 48 48 CYS H H 48 9.276 9.276 8.618 0.657 19880
1722 1 7 . 1 1 49 49 THR N N 49 131.810 131.810 121.312 10.498 19880
1723 1 7 . 1 1 49 49 THR HA H 49 4.364 4.364 4.717 -0.353 19880
1724 1 7 . 1 1 49 49 THR CA C 49 61.871 61.871 61.917 -0.046 19880
1725 1 7 . 1 1 49 49 THR CB C 49 69.789 69.789 72.826 -3.038 19880
1726 1 7 . 1 1 49 49 THR H H 49 9.194 9.194 8.835 0.359 19880
1727 1 7 . 1 1 50 50 CYS N N 50 123.835 123.835 121.741 2.094 19880
1728 1 7 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.126 -0.091 19880
1729 1 7 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.279 -6.399 19880
1730 1 7 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.585 5.349 19880
1731 1 7 . 1 1 50 50 CYS H H 50 8.879 8.879 8.586 0.293 19880
1732 1 7 . 1 1 51 51 ILE N N 51 123.986 123.986 122.291 1.695 19880
1733 1 7 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.356 -0.213 19880
1734 1 7 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.224 0.396 19880
1735 1 7 . 1 1 51 51 ILE CB C 51 39.380 39.380 40.146 -0.766 19880
1736 1 7 . 1 1 51 51 ILE H H 51 8.098 8.098 8.789 -0.691 19880
1737 1 7 . 1 1 52 52 ASN N N 52 126.122 126.122 124.130 1.992 19880
1738 1 7 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.955 -0.239 19880
1739 1 7 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.362 1.529 19880
1740 1 7 . 1 1 52 52 ASN CB C 52 37.913 37.913 38.135 -0.222 19880
1741 1 7 . 1 1 52 52 ASN H H 52 8.323 8.323 8.721 -0.398 19880
1742 1 7 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.594 -0.287 19880
1743 1 7 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.369 0.664 19880
1744 1 7 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.668 3.192 19880
1745 1 7 . 1 1 54 54 CYS N N 54 123.090 123.090 117.744 5.346 19880
1746 1 7 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.086 0.650 19880
1747 1 7 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.814 -2.664 19880
1748 1 7 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.754 19.400 19880
1749 1 7 . 1 1 54 54 CYS H H 54 8.865 8.865 8.466 0.399 19880
1750 1 7 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.453 -0.167 19880
1751 1 7 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.718 -0.460 19880
1752 1 7 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.347 0.103 19880
1753 1 7 . 1 1 56 56 ARG N N 56 117.289 117.289 118.397 -1.108 19880
1754 1 7 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.426 0.059 19880
1755 1 7 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.830 -0.709 19880
1756 1 7 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.111 -0.572 19880
1757 1 7 . 1 1 56 56 ARG H H 56 7.902 7.902 8.382 -0.480 19880
1758 1 8 . 1 1 3 3 CYS N N 3 117.561 117.561 117.039 0.522 19880
1759 1 8 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.295 -0.475 19880
1760 1 8 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.432 -2.732 19880
1761 1 8 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.510 20.141 19880
1762 1 8 . 1 1 3 3 CYS H H 3 7.950 7.950 7.959 -0.009 19880
1763 1 8 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.562 -0.057 19880
1764 1 8 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.917 0.813 19880
1765 1 8 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.590 0.709 19880
1766 1 8 . 1 1 5 5 THR N N 5 118.207 118.207 116.296 1.911 19880
1767 1 8 . 1 1 5 5 THR HA H 5 4.814 4.814 4.684 0.130 19880
1768 1 8 . 1 1 5 5 THR CA C 5 61.618 61.618 61.943 -0.325 19880
1769 1 8 . 1 1 5 5 THR CB C 5 70.257 70.257 69.509 0.748 19880
1770 1 8 . 1 1 5 5 THR H H 5 8.529 8.529 8.360 0.169 19880
1771 1 8 . 1 1 6 6 ARG N N 6 123.211 123.211 126.402 -3.191 19880
1772 1 8 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.596 -0.068 19880
1773 1 8 . 1 1 6 6 ARG CA C 6 54.931 54.931 54.728 0.202 19880
1774 1 8 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.123 0.629 19880
1775 1 8 . 1 1 6 6 ARG H H 6 7.693 7.693 8.428 -0.735 19880
1776 1 8 . 1 1 7 7 ARG N N 7 121.558 121.558 120.876 0.682 19880
1777 1 8 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.480 0.186 19880
1778 1 8 . 1 1 7 7 ARG CA C 7 54.415 54.415 56.334 -1.919 19880
1779 1 8 . 1 1 7 7 ARG CB C 7 32.673 32.673 31.775 0.898 19880
1780 1 8 . 1 1 7 7 ARG H H 7 8.450 8.450 8.580 -0.130 19880
1781 1 8 . 1 1 8 8 GLY N N 8 111.006 111.006 108.897 2.109 19880
1782 1 8 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.216 1.437 19880
1783 1 8 . 1 1 8 8 GLY H H 8 9.382 9.382 8.293 1.089 19880
1784 1 8 . 1 1 9 9 LEU N N 9 119.202 119.202 121.055 -1.853 19880
1785 1 8 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.190 -0.300 19880
1786 1 8 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.557 1.197 19880
1787 1 8 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.520 1.250 19880
1788 1 8 . 1 1 9 9 LEU H H 9 8.215 8.215 7.964 0.251 19880
1789 1 8 . 1 1 10 10 CYS N N 10 115.050 115.050 115.382 -0.332 19880
1790 1 8 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.431 -0.541 19880
1791 1 8 . 1 1 10 10 CYS CA C 10 61.378 61.378 60.395 0.983 19880
1792 1 8 . 1 1 10 10 CYS CB C 10 42.589 42.589 25.175 17.414 19880
1793 1 8 . 1 1 10 10 CYS H H 10 9.282 9.282 8.355 0.927 19880
1794 1 8 . 1 1 11 11 VAL N N 11 117.792 117.792 120.564 -2.772 19880
1795 1 8 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.116 -0.345 19880
1796 1 8 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.552 -0.044 19880
1797 1 8 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.970 -0.372 19880
1798 1 8 . 1 1 11 11 VAL H H 11 7.315 7.315 8.294 -0.979 19880
1799 1 8 . 1 1 12 12 THR N N 12 109.816 109.816 111.916 -2.100 19880
1800 1 8 . 1 1 12 12 THR HA H 12 4.044 4.044 4.326 -0.282 19880
1801 1 8 . 1 1 12 12 THR CA C 12 63.575 63.575 64.325 -0.750 19880
1802 1 8 . 1 1 12 12 THR CB C 12 69.400 69.400 69.335 0.064 19880
1803 1 8 . 1 1 12 12 THR H H 12 8.214 8.214 7.880 0.334 19880
1804 1 8 . 1 1 13 13 SER N N 13 114.455 114.455 115.782 -1.327 19880
1805 1 8 . 1 1 13 13 SER HA H 13 4.607 4.607 4.579 0.028 19880
1806 1 8 . 1 1 13 13 SER CA C 13 59.460 59.460 58.409 1.051 19880
1807 1 8 . 1 1 13 13 SER CB C 13 64.586 64.586 64.430 0.156 19880
1808 1 8 . 1 1 13 13 SER H H 13 7.511 7.511 7.662 -0.151 19880
1809 1 8 . 1 1 14 14 GLY N N 14 109.125 109.125 109.687 -0.562 19880
1810 1 8 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.577 -0.253 19880
1811 1 8 . 1 1 14 14 GLY H H 14 8.376 8.376 8.150 0.226 19880
1812 1 8 . 1 1 15 15 LEU N N 15 120.782 120.782 122.016 -1.234 19880
1813 1 8 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.197 -0.261 19880
1814 1 8 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.148 0.838 19880
1815 1 8 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.022 -0.496 19880
1816 1 8 . 1 1 15 15 LEU H H 15 8.469 8.469 8.647 -0.178 19880
1817 1 8 . 1 1 16 16 THR N N 16 115.887 115.887 114.151 1.736 19880
1818 1 8 . 1 1 16 16 THR HA H 16 3.602 3.602 3.932 -0.330 19880
1819 1 8 . 1 1 16 16 THR CA C 16 67.196 67.196 66.545 0.651 19880
1820 1 8 . 1 1 16 16 THR CB C 16 68.003 68.003 68.312 -0.309 19880
1821 1 8 . 1 1 16 16 THR H H 16 8.487 8.487 8.191 0.296 19880
1822 1 8 . 1 1 17 17 ALA N N 17 122.643 122.643 123.318 -0.675 19880
1823 1 8 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.319 -0.305 19880
1824 1 8 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.533 0.308 19880
1825 1 8 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.076 0.855 19880
1826 1 8 . 1 1 17 17 ALA H H 17 7.609 7.609 7.688 -0.079 19880
1827 1 8 . 1 1 18 18 CYS N N 18 118.252 118.252 118.382 -0.130 19880
1828 1 8 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.205 0.048 19880
1829 1 8 . 1 1 18 18 CYS CA C 18 58.453 58.453 61.046 -2.593 19880
1830 1 8 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.238 12.408 19880
1831 1 8 . 1 1 18 18 CYS H H 18 7.644 7.644 7.752 -0.108 19880
1832 1 8 . 1 1 19 19 ARG N N 19 120.422 120.422 120.301 0.121 19880
1833 1 8 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.085 -0.610 19880
1834 1 8 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.583 0.969 19880
1835 1 8 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.358 -0.557 19880
1836 1 8 . 1 1 19 19 ARG H H 19 9.072 9.072 8.476 0.596 19880
1837 1 8 . 1 1 20 20 ASN N N 20 117.466 117.466 116.238 1.228 19880
1838 1 8 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.531 -0.319 19880
1839 1 8 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.434 0.177 19880
1840 1 8 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.136 -0.881 19880
1841 1 8 . 1 1 20 20 ASN H H 20 8.411 8.411 7.916 0.495 19880
1842 1 8 . 1 1 21 21 HIS N N 21 120.420 120.420 117.954 2.466 19880
1843 1 8 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.724 -0.550 19880
1844 1 8 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.127 0.027 19880
1845 1 8 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.687 0.901 19880
1846 1 8 . 1 1 21 21 HIS H H 21 7.827 7.827 7.628 0.199 19880
1847 1 8 . 1 1 22 22 CYS N N 22 117.510 117.510 118.053 -0.543 19880
1848 1 8 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.493 -1.334 19880
1849 1 8 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.130 -2.909 19880
1850 1 8 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.287 10.891 19880
1851 1 8 . 1 1 22 22 CYS H H 22 8.500 8.500 7.850 0.650 19880
1852 1 8 . 1 1 23 23 ARG N N 23 116.564 116.564 119.055 -2.491 19880
1853 1 8 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.523 0.130 19880
1854 1 8 . 1 1 23 23 ARG CA C 23 57.028 57.028 55.956 1.071 19880
1855 1 8 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.100 0.555 19880
1856 1 8 . 1 1 23 23 ARG H H 23 7.985 7.985 8.209 -0.224 19880
1857 1 8 . 1 1 24 24 SER N N 24 116.727 116.727 112.107 4.620 19880
1858 1 8 . 1 1 24 24 SER HA H 24 4.552 4.552 4.642 -0.090 19880
1859 1 8 . 1 1 24 24 SER CA C 24 57.592 57.592 56.066 1.526 19880
1860 1 8 . 1 1 24 24 SER CB C 24 65.284 65.284 66.406 -1.122 19880
1861 1 8 . 1 1 24 24 SER H H 24 7.435 7.435 7.324 0.111 19880
1862 1 8 . 1 1 25 25 CYS N N 25 121.909 121.909 120.824 1.085 19880
1863 1 8 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.797 -0.161 19880
1864 1 8 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.526 -1.912 19880
1865 1 8 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.229 13.044 19880
1866 1 8 . 1 1 25 25 CYS H H 25 9.000 9.000 8.904 0.096 19880
1867 1 8 . 1 1 26 26 HIS N N 26 126.609 126.609 119.995 6.614 19880
1868 1 8 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.181 -0.229 19880
1869 1 8 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.350 0.372 19880
1870 1 8 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.790 0.310 19880
1871 1 8 . 1 1 26 26 HIS H H 26 9.255 9.255 8.819 0.436 19880
1872 1 8 . 1 1 27 27 ARG N N 27 122.033 122.033 121.464 0.569 19880
1873 1 8 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.291 -0.269 19880
1874 1 8 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.735 1.742 19880
1875 1 8 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.627 -0.747 19880
1876 1 8 . 1 1 27 27 ARG H H 27 8.314 8.314 8.154 0.160 19880
1877 1 8 . 1 1 28 28 GLY N N 28 119.213 119.213 113.279 5.934 19880
1878 1 8 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.608 -0.636 19880
1879 1 8 . 1 1 28 28 GLY H H 28 8.495 8.495 7.902 0.593 19880
1880 1 8 . 1 1 29 29 ASP N N 29 121.258 121.258 119.134 2.124 19880
1881 1 8 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.613 -0.349 19880
1882 1 8 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.197 2.249 19880
1883 1 8 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.627 -1.189 19880
1884 1 8 . 1 1 29 29 ASP H H 29 8.646 8.646 8.426 0.220 19880
1885 1 8 . 1 1 30 30 VAL N N 30 112.703 112.703 118.753 -6.050 19880
1886 1 8 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.313 -0.090 19880
1887 1 8 . 1 1 30 30 VAL CA C 30 61.407 61.407 62.009 -0.602 19880
1888 1 8 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.179 -0.274 19880
1889 1 8 . 1 1 30 30 VAL H H 30 8.026 8.026 7.604 0.422 19880
1890 1 8 . 1 1 31 31 GLY N N 31 109.481 109.481 107.303 2.178 19880
1891 1 8 . 1 1 31 31 GLY CA C 31 44.366 44.366 44.874 -0.508 19880
1892 1 8 . 1 1 31 31 GLY H H 31 7.511 7.511 7.546 -0.035 19880
1893 1 8 . 1 1 32 32 CYS N N 32 121.673 121.673 119.491 2.182 19880
1894 1 8 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.101 -0.155 19880
1895 1 8 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.446 -4.265 19880
1896 1 8 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.444 14.852 19880
1897 1 8 . 1 1 32 32 CYS H H 32 8.554 8.554 8.467 0.087 19880
1898 1 8 . 1 1 33 33 VAL N N 33 119.401 119.401 117.104 2.297 19880
1899 1 8 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.972 -0.177 19880
1900 1 8 . 1 1 33 33 VAL CA C 33 59.311 59.311 59.558 -0.247 19880
1901 1 8 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.562 0.918 19880
1902 1 8 . 1 1 33 33 VAL H H 33 9.025 9.025 9.053 -0.028 19880
1903 1 8 . 1 1 34 34 ARG N N 34 120.394 120.394 115.787 4.607 19880
1904 1 8 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.964 -0.265 19880
1905 1 8 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.028 1.164 19880
1906 1 8 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.607 -0.469 19880
1907 1 8 . 1 1 34 34 ARG H H 34 8.350 8.350 8.656 -0.306 19880
1908 1 8 . 1 1 35 35 CYS N N 35 118.098 118.098 118.286 -0.188 19880
1909 1 8 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.476 0.575 19880
1910 1 8 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.259 -1.982 19880
1911 1 8 . 1 1 35 35 CYS CB C 35 44.553 44.553 32.258 12.295 19880
1912 1 8 . 1 1 35 35 CYS H H 35 8.567 8.567 8.964 -0.397 19880
1913 1 8 . 1 1 36 36 SER N N 36 114.009 114.009 116.100 -2.091 19880
1914 1 8 . 1 1 36 36 SER HA H 36 4.326 4.326 4.453 -0.127 19880
1915 1 8 . 1 1 36 36 SER CA C 36 60.945 60.945 60.134 0.811 19880
1916 1 8 . 1 1 36 36 SER CB C 36 64.743 64.743 64.423 0.320 19880
1917 1 8 . 1 1 36 36 SER H H 36 7.669 7.669 8.512 -0.843 19880
1918 1 8 . 1 1 37 37 ASN N N 37 117.050 117.050 118.208 -1.158 19880
1919 1 8 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.853 -0.445 19880
1920 1 8 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.566 -0.480 19880
1921 1 8 . 1 1 37 37 ASN CB C 37 41.374 41.374 40.560 0.814 19880
1922 1 8 . 1 1 37 37 ASN H H 37 7.755 7.755 7.538 0.217 19880
1923 1 8 . 1 1 38 38 ALA N N 38 123.735 123.735 120.255 3.480 19880
1924 1 8 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.939 0.223 19880
1925 1 8 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.521 0.613 19880
1926 1 8 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.034 -2.841 19880
1927 1 8 . 1 1 38 38 ALA H H 38 9.323 9.323 8.301 1.022 19880
1928 1 8 . 1 1 39 39 GLN N N 39 116.531 116.531 116.490 0.041 19880
1929 1 8 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.796 -0.483 19880
1930 1 8 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.299 0.450 19880
1931 1 8 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.242 1.575 19880
1932 1 8 . 1 1 39 39 GLN H H 39 8.746 8.746 8.801 -0.055 19880
1933 1 8 . 1 1 40 40 CYS N N 40 122.074 122.074 120.564 1.510 19880
1934 1 8 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.478 0.071 19880
1935 1 8 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.873 -3.460 19880
1936 1 8 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.953 12.949 19880
1937 1 8 . 1 1 40 40 CYS H H 40 8.536 8.536 8.705 -0.169 19880
1938 1 8 . 1 1 41 41 THR N N 41 117.753 117.753 115.930 1.823 19880
1939 1 8 . 1 1 41 41 THR HA H 41 4.641 4.641 4.671 -0.030 19880
1940 1 8 . 1 1 41 41 THR CA C 41 60.550 60.550 60.169 0.381 19880
1941 1 8 . 1 1 41 41 THR CB C 41 71.033 71.033 71.318 -0.285 19880
1942 1 8 . 1 1 41 41 THR H H 41 9.779 9.779 8.992 0.787 19880
1943 1 8 . 1 1 42 42 GLY N N 42 105.809 105.809 108.500 -2.691 19880
1944 1 8 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.975 -0.960 19880
1945 1 8 . 1 1 42 42 GLY H H 42 8.247 8.247 8.169 0.078 19880
1946 1 8 . 1 1 43 43 PHE N N 43 123.293 123.293 121.075 2.218 19880
1947 1 8 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.505 -0.207 19880
1948 1 8 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.844 0.352 19880
1949 1 8 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.598 -0.948 19880
1950 1 8 . 1 1 43 43 PHE H H 43 8.707 8.707 8.969 -0.262 19880
1951 1 8 . 1 1 44 44 LEU N N 44 120.771 120.771 119.295 1.476 19880
1952 1 8 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.406 -0.558 19880
1953 1 8 . 1 1 44 44 LEU CB C 44 40.386 40.386 42.933 -2.547 19880
1954 1 8 . 1 1 44 44 LEU H H 44 8.645 8.645 7.657 0.988 19880
1955 1 8 . 1 1 45 45 GLY N N 45 107.545 107.545 108.080 -0.535 19880
1956 1 8 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.644 1.667 19880
1957 1 8 . 1 1 45 45 GLY H H 45 7.831 7.831 7.669 0.162 19880
1958 1 8 . 1 1 46 46 THR N N 46 104.485 104.485 108.984 -4.499 19880
1959 1 8 . 1 1 46 46 THR HA H 46 3.901 3.901 4.175 -0.274 19880
1960 1 8 . 1 1 46 46 THR CA C 46 62.180 62.180 62.474 -0.294 19880
1961 1 8 . 1 1 46 46 THR CB C 46 70.021 70.021 69.430 0.591 19880
1962 1 8 . 1 1 46 46 THR H H 46 6.823 6.823 7.875 -1.052 19880
1963 1 8 . 1 1 47 47 THR N N 47 123.300 123.300 117.202 6.098 19880
1964 1 8 . 1 1 47 47 THR HA H 47 4.371 4.371 5.106 -0.735 19880
1965 1 8 . 1 1 47 47 THR CA C 47 62.843 62.843 60.894 1.949 19880
1966 1 8 . 1 1 47 47 THR CB C 47 70.176 70.176 72.384 -2.208 19880
1967 1 8 . 1 1 47 47 THR H H 47 8.763 8.763 7.756 1.007 19880
1968 1 8 . 1 1 48 48 CYS N N 48 128.024 128.024 124.841 3.183 19880
1969 1 8 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.926 0.047 19880
1970 1 8 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.298 -1.314 19880
1971 1 8 . 1 1 48 48 CYS CB C 48 36.282 36.282 28.666 7.616 19880
1972 1 8 . 1 1 48 48 CYS H H 48 9.276 9.276 8.657 0.619 19880
1973 1 8 . 1 1 49 49 THR N N 49 131.810 131.810 119.611 12.199 19880
1974 1 8 . 1 1 49 49 THR HA H 49 4.364 4.364 4.724 -0.360 19880
1975 1 8 . 1 1 49 49 THR CA C 49 61.871 61.871 61.483 0.388 19880
1976 1 8 . 1 1 49 49 THR CB C 49 69.789 69.789 72.555 -2.766 19880
1977 1 8 . 1 1 49 49 THR H H 49 9.194 9.194 8.791 0.403 19880
1978 1 8 . 1 1 50 50 CYS N N 50 123.835 123.835 121.459 2.376 19880
1979 1 8 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.074 -0.039 19880
1980 1 8 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.212 -6.332 19880
1981 1 8 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.940 4.994 19880
1982 1 8 . 1 1 50 50 CYS H H 50 8.879 8.879 8.611 0.268 19880
1983 1 8 . 1 1 51 51 ILE N N 51 123.986 123.986 122.739 1.247 19880
1984 1 8 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.421 -0.278 19880
1985 1 8 . 1 1 51 51 ILE CA C 51 59.619 59.619 58.975 0.644 19880
1986 1 8 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.937 -0.557 19880
1987 1 8 . 1 1 51 51 ILE H H 51 8.098 8.098 8.924 -0.826 19880
1988 1 8 . 1 1 52 52 ASN N N 52 126.122 126.122 122.818 3.304 19880
1989 1 8 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.850 -0.134 19880
1990 1 8 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.762 1.129 19880
1991 1 8 . 1 1 52 52 ASN CB C 52 37.913 37.913 38.139 -0.226 19880
1992 1 8 . 1 1 52 52 ASN H H 52 8.323 8.323 8.653 -0.330 19880
1993 1 8 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.541 -0.234 19880
1994 1 8 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.382 0.651 19880
1995 1 8 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.620 3.240 19880
1996 1 8 . 1 1 54 54 CYS N N 54 123.090 123.090 117.881 5.209 19880
1997 1 8 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.105 0.631 19880
1998 1 8 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.807 -2.657 19880
1999 1 8 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.821 19.333 19880
2000 1 8 . 1 1 54 54 CYS H H 54 8.865 8.865 8.471 0.394 19880
2001 1 8 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.444 -0.158 19880
2002 1 8 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.785 -0.527 19880
2003 1 8 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.355 0.096 19880
2004 1 8 . 1 1 56 56 ARG N N 56 117.289 117.289 118.441 -1.152 19880
2005 1 8 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.419 0.066 19880
2006 1 8 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.777 -0.656 19880
2007 1 8 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.225 -0.686 19880
2008 1 8 . 1 1 56 56 ARG H H 56 7.902 7.902 8.414 -0.512 19880
2009 1 9 . 1 1 3 3 CYS N N 3 117.561 117.561 118.443 -0.882 19880
2010 1 9 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.246 -0.426 19880
2011 1 9 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.382 -2.682 19880
2012 1 9 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.430 20.221 19880
2013 1 9 . 1 1 3 3 CYS H H 3 7.950 7.950 8.465 -0.515 19880
2014 1 9 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.551 -0.046 19880
2015 1 9 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.991 0.739 19880
2016 1 9 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.907 0.392 19880
2017 1 9 . 1 1 5 5 THR N N 5 118.207 118.207 116.146 2.061 19880
2018 1 9 . 1 1 5 5 THR HA H 5 4.814 4.814 4.615 0.199 19880
2019 1 9 . 1 1 5 5 THR CA C 5 61.618 61.618 62.021 -0.403 19880
2020 1 9 . 1 1 5 5 THR CB C 5 70.257 70.257 69.672 0.585 19880
2021 1 9 . 1 1 5 5 THR H H 5 8.529 8.529 8.388 0.141 19880
2022 1 9 . 1 1 6 6 ARG N N 6 123.211 123.211 127.216 -4.005 19880
2023 1 9 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.603 -0.075 19880
2024 1 9 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.146 -0.215 19880
2025 1 9 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.608 0.145 19880
2026 1 9 . 1 1 6 6 ARG H H 6 7.693 7.693 8.708 -1.015 19880
2027 1 9 . 1 1 7 7 ARG N N 7 121.558 121.558 120.184 1.374 19880
2028 1 9 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.517 0.149 19880
2029 1 9 . 1 1 7 7 ARG CA C 7 54.415 54.415 56.197 -1.782 19880
2030 1 9 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.031 0.642 19880
2031 1 9 . 1 1 7 7 ARG H H 7 8.450 8.450 8.592 -0.142 19880
2032 1 9 . 1 1 8 8 GLY N N 8 111.006 111.006 109.153 1.853 19880
2033 1 9 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.155 1.498 19880
2034 1 9 . 1 1 8 8 GLY H H 8 9.382 9.382 8.349 1.033 19880
2035 1 9 . 1 1 9 9 LEU N N 9 119.202 119.202 120.878 -1.676 19880
2036 1 9 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.172 -0.282 19880
2037 1 9 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.543 1.211 19880
2038 1 9 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.522 1.248 19880
2039 1 9 . 1 1 9 9 LEU H H 9 8.215 8.215 7.980 0.235 19880
2040 1 9 . 1 1 10 10 CYS N N 10 115.050 115.050 115.005 0.045 19880
2041 1 9 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.382 -0.492 19880
2042 1 9 . 1 1 10 10 CYS CA C 10 61.378 61.378 60.322 1.056 19880
2043 1 9 . 1 1 10 10 CYS CB C 10 42.589 42.589 25.221 17.368 19880
2044 1 9 . 1 1 10 10 CYS H H 10 9.282 9.282 8.354 0.928 19880
2045 1 9 . 1 1 11 11 VAL N N 11 117.792 117.792 119.605 -1.813 19880
2046 1 9 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.156 -0.385 19880
2047 1 9 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.637 -0.129 19880
2048 1 9 . 1 1 11 11 VAL CB C 11 32.598 32.598 33.038 -0.440 19880
2049 1 9 . 1 1 11 11 VAL H H 11 7.315 7.315 8.273 -0.958 19880
2050 1 9 . 1 1 12 12 THR N N 12 109.816 109.816 111.950 -2.134 19880
2051 1 9 . 1 1 12 12 THR HA H 12 4.044 4.044 4.460 -0.416 19880
2052 1 9 . 1 1 12 12 THR CA C 12 63.575 63.575 64.051 -0.476 19880
2053 1 9 . 1 1 12 12 THR CB C 12 69.400 69.400 69.617 -0.217 19880
2054 1 9 . 1 1 12 12 THR H H 12 8.214 8.214 7.819 0.395 19880
2055 1 9 . 1 1 13 13 SER N N 13 114.455 114.455 114.919 -0.464 19880
2056 1 9 . 1 1 13 13 SER HA H 13 4.607 4.607 4.636 -0.029 19880
2057 1 9 . 1 1 13 13 SER CA C 13 59.460 59.460 58.562 0.898 19880
2058 1 9 . 1 1 13 13 SER CB C 13 64.586 64.586 65.438 -0.852 19880
2059 1 9 . 1 1 13 13 SER H H 13 7.511 7.511 7.709 -0.198 19880
2060 1 9 . 1 1 14 14 GLY N N 14 109.125 109.125 109.481 -0.356 19880
2061 1 9 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.498 -0.174 19880
2062 1 9 . 1 1 14 14 GLY H H 14 8.376 8.376 8.047 0.329 19880
2063 1 9 . 1 1 15 15 LEU N N 15 120.782 120.782 121.223 -0.441 19880
2064 1 9 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.211 -0.275 19880
2065 1 9 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.068 0.918 19880
2066 1 9 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.052 -0.526 19880
2067 1 9 . 1 1 15 15 LEU H H 15 8.469 8.469 8.638 -0.169 19880
2068 1 9 . 1 1 16 16 THR N N 16 115.887 115.887 113.896 1.991 19880
2069 1 9 . 1 1 16 16 THR HA H 16 3.602 3.602 3.961 -0.359 19880
2070 1 9 . 1 1 16 16 THR CA C 16 67.196 67.196 66.282 0.914 19880
2071 1 9 . 1 1 16 16 THR CB C 16 68.003 68.003 68.128 -0.125 19880
2072 1 9 . 1 1 16 16 THR H H 16 8.487 8.487 8.299 0.188 19880
2073 1 9 . 1 1 17 17 ALA N N 17 122.643 122.643 123.507 -0.864 19880
2074 1 9 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.317 -0.303 19880
2075 1 9 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.629 0.212 19880
2076 1 9 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.028 0.903 19880
2077 1 9 . 1 1 17 17 ALA H H 17 7.609 7.609 7.724 -0.115 19880
2078 1 9 . 1 1 18 18 CYS N N 18 118.252 118.252 118.638 -0.386 19880
2079 1 9 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.229 0.024 19880
2080 1 9 . 1 1 18 18 CYS CA C 18 58.453 58.453 61.042 -2.589 19880
2081 1 9 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.242 12.404 19880
2082 1 9 . 1 1 18 18 CYS H H 18 7.644 7.644 7.747 -0.103 19880
2083 1 9 . 1 1 19 19 ARG N N 19 120.422 120.422 119.905 0.517 19880
2084 1 9 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.103 -0.628 19880
2085 1 9 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.542 1.010 19880
2086 1 9 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.382 -0.581 19880
2087 1 9 . 1 1 19 19 ARG H H 19 9.072 9.072 8.314 0.758 19880
2088 1 9 . 1 1 20 20 ASN N N 20 117.466 117.466 116.031 1.435 19880
2089 1 9 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.594 -0.382 19880
2090 1 9 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.120 0.491 19880
2091 1 9 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.282 -1.027 19880
2092 1 9 . 1 1 20 20 ASN H H 20 8.411 8.411 7.842 0.569 19880
2093 1 9 . 1 1 21 21 HIS N N 21 120.420 120.420 118.735 1.685 19880
2094 1 9 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.535 -0.361 19880
2095 1 9 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.115 0.038 19880
2096 1 9 . 1 1 21 21 HIS CB C 21 31.588 31.588 31.035 0.553 19880
2097 1 9 . 1 1 21 21 HIS H H 21 7.827 7.827 7.863 -0.036 19880
2098 1 9 . 1 1 22 22 CYS N N 22 117.510 117.510 117.253 0.257 19880
2099 1 9 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.279 -1.120 19880
2100 1 9 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.807 -3.586 19880
2101 1 9 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.230 10.948 19880
2102 1 9 . 1 1 22 22 CYS H H 22 8.500 8.500 7.896 0.604 19880
2103 1 9 . 1 1 23 23 ARG N N 23 116.564 116.564 117.136 -0.572 19880
2104 1 9 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.730 -0.077 19880
2105 1 9 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.135 0.893 19880
2106 1 9 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.104 0.551 19880
2107 1 9 . 1 1 23 23 ARG H H 23 7.985 7.985 7.543 0.442 19880
2108 1 9 . 1 1 24 24 SER N N 24 116.727 116.727 113.606 3.121 19880
2109 1 9 . 1 1 24 24 SER HA H 24 4.552 4.552 4.622 -0.070 19880
2110 1 9 . 1 1 24 24 SER CA C 24 57.592 57.592 56.025 1.567 19880
2111 1 9 . 1 1 24 24 SER CB C 24 65.284 65.284 66.006 -0.722 19880
2112 1 9 . 1 1 24 24 SER H H 24 7.435 7.435 7.446 -0.011 19880
2113 1 9 . 1 1 25 25 CYS N N 25 121.909 121.909 123.234 -1.325 19880
2114 1 9 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.512 0.124 19880
2115 1 9 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.589 -1.975 19880
2116 1 9 . 1 1 25 25 CYS CB C 25 39.273 39.273 25.334 13.939 19880
2117 1 9 . 1 1 25 25 CYS H H 25 9.000 9.000 8.735 0.265 19880
2118 1 9 . 1 1 26 26 HIS N N 26 126.609 126.609 125.363 1.246 19880
2119 1 9 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.192 -0.240 19880
2120 1 9 . 1 1 26 26 HIS CA C 26 54.722 54.722 53.997 0.725 19880
2121 1 9 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.736 0.364 19880
2122 1 9 . 1 1 26 26 HIS H H 26 9.255 9.255 8.752 0.503 19880
2123 1 9 . 1 1 27 27 ARG N N 27 122.033 122.033 120.879 1.154 19880
2124 1 9 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.329 -0.307 19880
2125 1 9 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.698 1.779 19880
2126 1 9 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.474 -0.594 19880
2127 1 9 . 1 1 27 27 ARG H H 27 8.314 8.314 8.225 0.089 19880
2128 1 9 . 1 1 28 28 GLY N N 28 119.213 119.213 112.839 6.374 19880
2129 1 9 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.630 -0.658 19880
2130 1 9 . 1 1 28 28 GLY H H 28 8.495 8.495 8.193 0.302 19880
2131 1 9 . 1 1 29 29 ASP N N 29 121.258 121.258 117.850 3.408 19880
2132 1 9 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.644 -0.380 19880
2133 1 9 . 1 1 29 29 ASP CA C 29 57.446 57.446 54.912 2.534 19880
2134 1 9 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.185 -0.747 19880
2135 1 9 . 1 1 29 29 ASP H H 29 8.646 8.646 8.592 0.054 19880
2136 1 9 . 1 1 30 30 VAL N N 30 112.703 112.703 116.711 -4.008 19880
2137 1 9 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.558 -0.335 19880
2138 1 9 . 1 1 30 30 VAL CA C 30 61.407 61.407 62.468 -1.062 19880
2139 1 9 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.886 -0.981 19880
2140 1 9 . 1 1 30 30 VAL H H 30 8.026 8.026 7.939 0.087 19880
2141 1 9 . 1 1 31 31 GLY N N 31 109.481 109.481 107.517 1.964 19880
2142 1 9 . 1 1 31 31 GLY CA C 31 44.366 44.366 45.385 -1.019 19880
2143 1 9 . 1 1 31 31 GLY H H 31 7.511 7.511 7.707 -0.196 19880
2144 1 9 . 1 1 32 32 CYS N N 32 121.673 121.673 120.687 0.986 19880
2145 1 9 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.136 -0.190 19880
2146 1 9 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.825 -4.644 19880
2147 1 9 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.577 14.719 19880
2148 1 9 . 1 1 32 32 CYS H H 32 8.554 8.554 8.602 -0.048 19880
2149 1 9 . 1 1 33 33 VAL N N 33 119.401 119.401 118.807 0.594 19880
2150 1 9 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.772 0.023 19880
2151 1 9 . 1 1 33 33 VAL CA C 33 59.311 59.311 60.091 -0.780 19880
2152 1 9 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.598 0.882 19880
2153 1 9 . 1 1 33 33 VAL H H 33 9.025 9.025 9.015 0.010 19880
2154 1 9 . 1 1 34 34 ARG N N 34 120.394 120.394 116.035 4.359 19880
2155 1 9 . 1 1 34 34 ARG HA H 34 4.699 4.699 5.005 -0.306 19880
2156 1 9 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.053 1.139 19880
2157 1 9 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.553 -0.415 19880
2158 1 9 . 1 1 34 34 ARG H H 34 8.350 8.350 8.695 -0.345 19880
2159 1 9 . 1 1 35 35 CYS N N 35 118.098 118.098 118.484 -0.386 19880
2160 1 9 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.454 0.597 19880
2161 1 9 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.709 -2.432 19880
2162 1 9 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.571 12.982 19880
2163 1 9 . 1 1 35 35 CYS H H 35 8.567 8.567 9.166 -0.599 19880
2164 1 9 . 1 1 36 36 SER N N 36 114.009 114.009 115.849 -1.840 19880
2165 1 9 . 1 1 36 36 SER HA H 36 4.326 4.326 4.526 -0.200 19880
2166 1 9 . 1 1 36 36 SER CA C 36 60.945 60.945 59.918 1.027 19880
2167 1 9 . 1 1 36 36 SER CB C 36 64.743 64.743 63.834 0.909 19880
2168 1 9 . 1 1 36 36 SER H H 36 7.669 7.669 8.366 -0.697 19880
2169 1 9 . 1 1 37 37 ASN N N 37 117.050 117.050 116.136 0.914 19880
2170 1 9 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.909 -0.501 19880
2171 1 9 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.414 -0.328 19880
2172 1 9 . 1 1 37 37 ASN CB C 37 41.374 41.374 41.160 0.214 19880
2173 1 9 . 1 1 37 37 ASN H H 37 7.755 7.755 7.491 0.264 19880
2174 1 9 . 1 1 38 38 ALA N N 38 123.735 123.735 120.271 3.464 19880
2175 1 9 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.946 0.216 19880
2176 1 9 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.556 0.578 19880
2177 1 9 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.027 -2.834 19880
2178 1 9 . 1 1 38 38 ALA H H 38 9.323 9.323 8.304 1.019 19880
2179 1 9 . 1 1 39 39 GLN N N 39 116.531 116.531 116.393 0.138 19880
2180 1 9 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.801 -0.488 19880
2181 1 9 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.287 0.462 19880
2182 1 9 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.205 1.612 19880
2183 1 9 . 1 1 39 39 GLN H H 39 8.746 8.746 8.813 -0.067 19880
2184 1 9 . 1 1 40 40 CYS N N 40 122.074 122.074 120.458 1.616 19880
2185 1 9 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.513 0.036 19880
2186 1 9 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.800 -3.387 19880
2187 1 9 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.753 13.149 19880
2188 1 9 . 1 1 40 40 CYS H H 40 8.536 8.536 8.699 -0.163 19880
2189 1 9 . 1 1 41 41 THR N N 41 117.753 117.753 115.775 1.978 19880
2190 1 9 . 1 1 41 41 THR HA H 41 4.641 4.641 4.661 -0.020 19880
2191 1 9 . 1 1 41 41 THR CA C 41 60.550 60.550 60.099 0.451 19880
2192 1 9 . 1 1 41 41 THR CB C 41 71.033 71.033 71.666 -0.633 19880
2193 1 9 . 1 1 41 41 THR H H 41 9.779 9.779 9.056 0.723 19880
2194 1 9 . 1 1 42 42 GLY N N 42 105.809 105.809 108.898 -3.089 19880
2195 1 9 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.959 -0.944 19880
2196 1 9 . 1 1 42 42 GLY H H 42 8.247 8.247 8.109 0.138 19880
2197 1 9 . 1 1 43 43 PHE N N 43 123.293 123.293 121.040 2.253 19880
2198 1 9 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.520 -0.222 19880
2199 1 9 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.818 0.378 19880
2200 1 9 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.644 -0.994 19880
2201 1 9 . 1 1 43 43 PHE H H 43 8.707 8.707 8.945 -0.238 19880
2202 1 9 . 1 1 44 44 LEU N N 44 120.771 120.771 119.285 1.486 19880
2203 1 9 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.389 -0.541 19880
2204 1 9 . 1 1 44 44 LEU CB C 44 40.386 40.386 42.678 -2.292 19880
2205 1 9 . 1 1 44 44 LEU H H 44 8.645 8.645 7.648 0.997 19880
2206 1 9 . 1 1 45 45 GLY N N 45 107.545 107.545 108.124 -0.579 19880
2207 1 9 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.628 1.683 19880
2208 1 9 . 1 1 45 45 GLY H H 45 7.831 7.831 7.787 0.044 19880
2209 1 9 . 1 1 46 46 THR N N 46 104.485 104.485 109.115 -4.630 19880
2210 1 9 . 1 1 46 46 THR HA H 46 3.901 3.901 4.199 -0.298 19880
2211 1 9 . 1 1 46 46 THR CA C 46 62.180 62.180 62.569 -0.389 19880
2212 1 9 . 1 1 46 46 THR CB C 46 70.021 70.021 69.277 0.744 19880
2213 1 9 . 1 1 46 46 THR H H 46 6.823 6.823 7.835 -1.012 19880
2214 1 9 . 1 1 47 47 THR N N 47 123.300 123.300 118.005 5.295 19880
2215 1 9 . 1 1 47 47 THR HA H 47 4.371 4.371 5.032 -0.661 19880
2216 1 9 . 1 1 47 47 THR CA C 47 62.843 62.843 61.714 1.129 19880
2217 1 9 . 1 1 47 47 THR CB C 47 70.176 70.176 72.312 -2.136 19880
2218 1 9 . 1 1 47 47 THR H H 47 8.763 8.763 7.782 0.981 19880
2219 1 9 . 1 1 48 48 CYS N N 48 128.024 128.024 125.262 2.762 19880
2220 1 9 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.975 -0.002 19880
2221 1 9 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.171 -1.187 19880
2222 1 9 . 1 1 48 48 CYS CB C 48 36.282 36.282 28.323 7.960 19880
2223 1 9 . 1 1 48 48 CYS H H 48 9.276 9.276 9.017 0.259 19880
2224 1 9 . 1 1 49 49 THR N N 49 131.810 131.810 121.639 10.171 19880
2225 1 9 . 1 1 49 49 THR HA H 49 4.364 4.364 4.694 -0.330 19880
2226 1 9 . 1 1 49 49 THR CA C 49 61.871 61.871 61.620 0.251 19880
2227 1 9 . 1 1 49 49 THR CB C 49 69.789 69.789 72.656 -2.867 19880
2228 1 9 . 1 1 49 49 THR H H 49 9.194 9.194 8.792 0.402 19880
2229 1 9 . 1 1 50 50 CYS N N 50 123.835 123.835 121.920 1.915 19880
2230 1 9 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.076 -0.041 19880
2231 1 9 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.197 -6.317 19880
2232 1 9 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.331 5.603 19880
2233 1 9 . 1 1 50 50 CYS H H 50 8.879 8.879 8.668 0.211 19880
2234 1 9 . 1 1 51 51 ILE N N 51 123.986 123.986 122.987 0.999 19880
2235 1 9 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.430 -0.287 19880
2236 1 9 . 1 1 51 51 ILE CA C 51 59.619 59.619 58.984 0.635 19880
2237 1 9 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.899 -0.519 19880
2238 1 9 . 1 1 51 51 ILE H H 51 8.098 8.098 8.916 -0.818 19880
2239 1 9 . 1 1 52 52 ASN N N 52 126.122 126.122 125.613 0.509 19880
2240 1 9 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.782 -0.066 19880
2241 1 9 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.886 1.005 19880
2242 1 9 . 1 1 52 52 ASN CB C 52 37.913 37.913 37.659 0.254 19880
2243 1 9 . 1 1 52 52 ASN H H 52 8.323 8.323 8.622 -0.299 19880
2244 1 9 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.445 -0.138 19880
2245 1 9 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.618 0.415 19880
2246 1 9 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.384 3.476 19880
2247 1 9 . 1 1 54 54 CYS N N 54 123.090 123.090 118.107 4.983 19880
2248 1 9 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.041 0.695 19880
2249 1 9 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.749 -2.599 19880
2250 1 9 . 1 1 54 54 CYS CB C 54 46.154 46.154 27.032 19.122 19880
2251 1 9 . 1 1 54 54 CYS H H 54 8.865 8.865 8.424 0.441 19880
2252 1 9 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.482 -0.196 19880
2253 1 9 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.681 -0.423 19880
2254 1 9 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.370 0.080 19880
2255 1 9 . 1 1 56 56 ARG N N 56 117.289 117.289 117.471 -0.182 19880
2256 1 9 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.473 0.012 19880
2257 1 9 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.804 -0.683 19880
2258 1 9 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.236 -0.697 19880
2259 1 9 . 1 1 56 56 ARG H H 56 7.902 7.902 8.439 -0.537 19880
2260 1 10 . 1 1 3 3 CYS N N 3 117.561 117.561 116.024 1.537 19880
2261 1 10 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.293 -0.473 19880
2262 1 10 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.580 -2.880 19880
2263 1 10 . 1 1 3 3 CYS CB C 3 46.651 46.651 27.114 19.537 19880
2264 1 10 . 1 1 3 3 CYS H H 3 7.950 7.950 8.014 -0.064 19880
2265 1 10 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.798 -0.293 19880
2266 1 10 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.897 0.833 19880
2267 1 10 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.631 0.668 19880
2268 1 10 . 1 1 5 5 THR N N 5 118.207 118.207 116.051 2.156 19880
2269 1 10 . 1 1 5 5 THR HA H 5 4.814 4.814 4.663 0.151 19880
2270 1 10 . 1 1 5 5 THR CA C 5 61.618 61.618 61.755 -0.138 19880
2271 1 10 . 1 1 5 5 THR CB C 5 70.257 70.257 69.855 0.402 19880
2272 1 10 . 1 1 5 5 THR H H 5 8.529 8.529 8.303 0.226 19880
2273 1 10 . 1 1 6 6 ARG N N 6 123.211 123.211 127.305 -4.094 19880
2274 1 10 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.551 -0.023 19880
2275 1 10 . 1 1 6 6 ARG CA C 6 54.931 54.931 54.779 0.152 19880
2276 1 10 . 1 1 6 6 ARG CB C 6 32.752 32.752 31.915 0.838 19880
2277 1 10 . 1 1 6 6 ARG H H 6 7.693 7.693 8.268 -0.575 19880
2278 1 10 . 1 1 7 7 ARG N N 7 121.558 121.558 121.941 -0.383 19880
2279 1 10 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.474 0.192 19880
2280 1 10 . 1 1 7 7 ARG CA C 7 54.415 54.415 56.494 -2.079 19880
2281 1 10 . 1 1 7 7 ARG CB C 7 32.673 32.673 31.716 0.957 19880
2282 1 10 . 1 1 7 7 ARG H H 7 8.450 8.450 8.487 -0.037 19880
2283 1 10 . 1 1 8 8 GLY N N 8 111.006 111.006 108.683 2.323 19880
2284 1 10 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.302 1.351 19880
2285 1 10 . 1 1 8 8 GLY H H 8 9.382 9.382 8.247 1.135 19880
2286 1 10 . 1 1 9 9 LEU N N 9 119.202 119.202 120.453 -1.251 19880
2287 1 10 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.061 -0.171 19880
2288 1 10 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.484 1.270 19880
2289 1 10 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.694 1.077 19880
2290 1 10 . 1 1 9 9 LEU H H 9 8.215 8.215 7.893 0.322 19880
2291 1 10 . 1 1 10 10 CYS N N 10 115.050 115.050 114.430 0.620 19880
2292 1 10 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.473 -0.583 19880
2293 1 10 . 1 1 10 10 CYS CA C 10 61.378 61.378 58.956 2.422 19880
2294 1 10 . 1 1 10 10 CYS CB C 10 42.589 42.589 25.583 17.006 19880
2295 1 10 . 1 1 10 10 CYS H H 10 9.282 9.282 7.858 1.424 19880
2296 1 10 . 1 1 11 11 VAL N N 11 117.792 117.792 120.517 -2.725 19880
2297 1 10 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.030 -0.259 19880
2298 1 10 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.969 -0.461 19880
2299 1 10 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.366 0.232 19880
2300 1 10 . 1 1 11 11 VAL H H 11 7.315 7.315 7.982 -0.667 19880
2301 1 10 . 1 1 12 12 THR N N 12 109.816 109.816 111.429 -1.613 19880
2302 1 10 . 1 1 12 12 THR HA H 12 4.044 4.044 4.348 -0.304 19880
2303 1 10 . 1 1 12 12 THR CA C 12 63.575 63.575 63.241 0.334 19880
2304 1 10 . 1 1 12 12 THR CB C 12 69.400 69.400 69.112 0.288 19880
2305 1 10 . 1 1 12 12 THR H H 12 8.214 8.214 7.877 0.337 19880
2306 1 10 . 1 1 13 13 SER N N 13 114.455 114.455 118.088 -3.633 19880
2307 1 10 . 1 1 13 13 SER HA H 13 4.607 4.607 4.494 0.113 19880
2308 1 10 . 1 1 13 13 SER CA C 13 59.460 59.460 59.510 -0.050 19880
2309 1 10 . 1 1 13 13 SER CB C 13 64.586 64.586 64.007 0.579 19880
2310 1 10 . 1 1 13 13 SER H H 13 7.511 7.511 8.589 -1.078 19880
2311 1 10 . 1 1 14 14 GLY N N 14 109.125 109.125 108.673 0.452 19880
2312 1 10 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.465 -0.141 19880
2313 1 10 . 1 1 14 14 GLY H H 14 8.376 8.376 7.454 0.922 19880
2314 1 10 . 1 1 15 15 LEU N N 15 120.782 120.782 120.075 0.707 19880
2315 1 10 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.242 -0.306 19880
2316 1 10 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.264 0.722 19880
2317 1 10 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.082 -0.556 19880
2318 1 10 . 1 1 15 15 LEU H H 15 8.469 8.469 8.557 -0.088 19880
2319 1 10 . 1 1 16 16 THR N N 16 115.887 115.887 114.338 1.549 19880
2320 1 10 . 1 1 16 16 THR HA H 16 3.602 3.602 3.944 -0.342 19880
2321 1 10 . 1 1 16 16 THR CA C 16 67.196 67.196 67.059 0.137 19880
2322 1 10 . 1 1 16 16 THR CB C 16 68.003 68.003 67.926 0.077 19880
2323 1 10 . 1 1 16 16 THR H H 16 8.487 8.487 8.231 0.256 19880
2324 1 10 . 1 1 17 17 ALA N N 17 122.643 122.643 123.379 -0.736 19880
2325 1 10 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.346 -0.332 19880
2326 1 10 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.560 0.281 19880
2327 1 10 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.074 0.857 19880
2328 1 10 . 1 1 17 17 ALA H H 17 7.609 7.609 7.656 -0.047 19880
2329 1 10 . 1 1 18 18 CYS N N 18 118.252 118.252 118.369 -0.117 19880
2330 1 10 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.250 0.003 19880
2331 1 10 . 1 1 18 18 CYS CA C 18 58.453 58.453 60.852 -2.399 19880
2332 1 10 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.268 12.378 19880
2333 1 10 . 1 1 18 18 CYS H H 18 7.644 7.644 7.740 -0.096 19880
2334 1 10 . 1 1 19 19 ARG N N 19 120.422 120.422 120.299 0.123 19880
2335 1 10 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.097 -0.622 19880
2336 1 10 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.590 0.962 19880
2337 1 10 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.362 -0.561 19880
2338 1 10 . 1 1 19 19 ARG H H 19 9.072 9.072 8.375 0.697 19880
2339 1 10 . 1 1 20 20 ASN N N 20 117.466 117.466 115.919 1.547 19880
2340 1 10 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.575 -0.363 19880
2341 1 10 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.205 0.406 19880
2342 1 10 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.205 -0.950 19880
2343 1 10 . 1 1 20 20 ASN H H 20 8.411 8.411 7.917 0.494 19880
2344 1 10 . 1 1 21 21 HIS N N 21 120.420 120.420 118.358 2.062 19880
2345 1 10 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.570 -0.396 19880
2346 1 10 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.041 0.113 19880
2347 1 10 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.991 0.598 19880
2348 1 10 . 1 1 21 21 HIS H H 21 7.827 7.827 7.741 0.086 19880
2349 1 10 . 1 1 22 22 CYS N N 22 117.510 117.510 117.826 -0.316 19880
2350 1 10 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.419 -1.260 19880
2351 1 10 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.504 -3.283 19880
2352 1 10 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.410 10.768 19880
2353 1 10 . 1 1 22 22 CYS H H 22 8.500 8.500 7.863 0.637 19880
2354 1 10 . 1 1 23 23 ARG N N 23 116.564 116.564 117.193 -0.629 19880
2355 1 10 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.679 -0.026 19880
2356 1 10 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.486 0.542 19880
2357 1 10 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.165 0.490 19880
2358 1 10 . 1 1 23 23 ARG H H 23 7.985 7.985 7.876 0.109 19880
2359 1 10 . 1 1 24 24 SER N N 24 116.727 116.727 113.156 3.571 19880
2360 1 10 . 1 1 24 24 SER HA H 24 4.552 4.552 4.569 -0.017 19880
2361 1 10 . 1 1 24 24 SER CA C 24 57.592 57.592 56.204 1.388 19880
2362 1 10 . 1 1 24 24 SER CB C 24 65.284 65.284 65.483 -0.199 19880
2363 1 10 . 1 1 24 24 SER H H 24 7.435 7.435 7.398 0.037 19880
2364 1 10 . 1 1 25 25 CYS N N 25 121.909 121.909 120.474 1.435 19880
2365 1 10 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.816 -0.180 19880
2366 1 10 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.005 -1.391 19880
2367 1 10 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.132 13.141 19880
2368 1 10 . 1 1 25 25 CYS H H 25 9.000 9.000 8.826 0.174 19880
2369 1 10 . 1 1 26 26 HIS N N 26 126.609 126.609 120.458 6.151 19880
2370 1 10 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.252 -0.300 19880
2371 1 10 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.363 0.359 19880
2372 1 10 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.778 0.322 19880
2373 1 10 . 1 1 26 26 HIS H H 26 9.255 9.255 8.795 0.460 19880
2374 1 10 . 1 1 27 27 ARG N N 27 122.033 122.033 121.193 0.840 19880
2375 1 10 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.319 -0.297 19880
2376 1 10 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.746 1.731 19880
2377 1 10 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.729 -0.849 19880
2378 1 10 . 1 1 27 27 ARG H H 27 8.314 8.314 8.185 0.129 19880
2379 1 10 . 1 1 28 28 GLY N N 28 119.213 119.213 112.923 6.290 19880
2380 1 10 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.629 -0.657 19880
2381 1 10 . 1 1 28 28 GLY H H 28 8.495 8.495 7.887 0.608 19880
2382 1 10 . 1 1 29 29 ASP N N 29 121.258 121.258 118.992 2.266 19880
2383 1 10 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.629 -0.365 19880
2384 1 10 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.142 2.304 19880
2385 1 10 . 1 1 29 29 ASP CB C 29 40.438 40.438 42.398 -1.960 19880
2386 1 10 . 1 1 29 29 ASP H H 29 8.646 8.646 8.393 0.253 19880
2387 1 10 . 1 1 30 30 VAL N N 30 112.703 112.703 117.944 -5.241 19880
2388 1 10 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.268 -0.045 19880
2389 1 10 . 1 1 30 30 VAL CA C 30 61.407 61.407 61.719 -0.312 19880
2390 1 10 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.283 -0.379 19880
2391 1 10 . 1 1 30 30 VAL H H 30 8.026 8.026 7.655 0.371 19880
2392 1 10 . 1 1 31 31 GLY N N 31 109.481 109.481 106.517 2.964 19880
2393 1 10 . 1 1 31 31 GLY CA C 31 44.366 44.366 44.806 -0.440 19880
2394 1 10 . 1 1 31 31 GLY H H 31 7.511 7.511 7.487 0.024 19880
2395 1 10 . 1 1 32 32 CYS N N 32 121.673 121.673 119.670 2.003 19880
2396 1 10 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.047 -0.101 19880
2397 1 10 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.370 -4.189 19880
2398 1 10 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.407 14.889 19880
2399 1 10 . 1 1 32 32 CYS H H 32 8.554 8.554 8.464 0.090 19880
2400 1 10 . 1 1 33 33 VAL N N 33 119.401 119.401 117.179 2.222 19880
2401 1 10 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.938 -0.143 19880
2402 1 10 . 1 1 33 33 VAL CA C 33 59.311 59.311 59.576 -0.265 19880
2403 1 10 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.605 0.875 19880
2404 1 10 . 1 1 33 33 VAL H H 33 9.025 9.025 8.970 0.055 19880
2405 1 10 . 1 1 34 34 ARG N N 34 120.394 120.394 115.776 4.618 19880
2406 1 10 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.995 -0.296 19880
2407 1 10 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.061 1.131 19880
2408 1 10 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.543 -0.405 19880
2409 1 10 . 1 1 34 34 ARG H H 34 8.350 8.350 8.711 -0.361 19880
2410 1 10 . 1 1 35 35 CYS N N 35 118.098 118.098 118.783 -0.685 19880
2411 1 10 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.527 0.524 19880
2412 1 10 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.635 -2.358 19880
2413 1 10 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.645 12.908 19880
2414 1 10 . 1 1 35 35 CYS H H 35 8.567 8.567 9.064 -0.497 19880
2415 1 10 . 1 1 36 36 SER N N 36 114.009 114.009 115.499 -1.490 19880
2416 1 10 . 1 1 36 36 SER HA H 36 4.326 4.326 4.602 -0.276 19880
2417 1 10 . 1 1 36 36 SER CA C 36 60.945 60.945 59.667 1.278 19880
2418 1 10 . 1 1 36 36 SER CB C 36 64.743 64.743 63.862 0.881 19880
2419 1 10 . 1 1 36 36 SER H H 36 7.669 7.669 8.323 -0.654 19880
2420 1 10 . 1 1 37 37 ASN N N 37 117.050 117.050 116.517 0.533 19880
2421 1 10 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.975 -0.567 19880
2422 1 10 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.500 -0.414 19880
2423 1 10 . 1 1 37 37 ASN CB C 37 41.374 41.374 42.084 -0.710 19880
2424 1 10 . 1 1 37 37 ASN H H 37 7.755 7.755 7.497 0.258 19880
2425 1 10 . 1 1 38 38 ALA N N 38 123.735 123.735 120.222 3.513 19880
2426 1 10 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.968 0.194 19880
2427 1 10 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.650 0.484 19880
2428 1 10 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.404 -3.211 19880
2429 1 10 . 1 1 38 38 ALA H H 38 9.323 9.323 8.313 1.010 19880
2430 1 10 . 1 1 39 39 GLN N N 39 116.531 116.531 116.410 0.121 19880
2431 1 10 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.722 -0.409 19880
2432 1 10 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.476 0.273 19880
2433 1 10 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.232 1.585 19880
2434 1 10 . 1 1 39 39 GLN H H 39 8.746 8.746 8.793 -0.047 19880
2435 1 10 . 1 1 40 40 CYS N N 40 122.074 122.074 120.396 1.678 19880
2436 1 10 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.447 0.102 19880
2437 1 10 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.824 -3.411 19880
2438 1 10 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.814 13.088 19880
2439 1 10 . 1 1 40 40 CYS H H 40 8.536 8.536 8.699 -0.163 19880
2440 1 10 . 1 1 41 41 THR N N 41 117.753 117.753 115.615 2.138 19880
2441 1 10 . 1 1 41 41 THR HA H 41 4.641 4.641 4.641 -0.000 19880
2442 1 10 . 1 1 41 41 THR CA C 41 60.550 60.550 60.081 0.469 19880
2443 1 10 . 1 1 41 41 THR CB C 41 71.033 71.033 71.631 -0.598 19880
2444 1 10 . 1 1 41 41 THR H H 41 9.779 9.779 8.995 0.784 19880
2445 1 10 . 1 1 42 42 GLY N N 42 105.809 105.809 108.678 -2.869 19880
2446 1 10 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.930 -0.915 19880
2447 1 10 . 1 1 42 42 GLY H H 42 8.247 8.247 8.035 0.212 19880
2448 1 10 . 1 1 43 43 PHE N N 43 123.293 123.293 121.010 2.283 19880
2449 1 10 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.519 -0.221 19880
2450 1 10 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.811 0.385 19880
2451 1 10 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.555 -0.905 19880
2452 1 10 . 1 1 43 43 PHE H H 43 8.707 8.707 8.988 -0.281 19880
2453 1 10 . 1 1 44 44 LEU N N 44 120.771 120.771 118.417 2.354 19880
2454 1 10 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.339 -0.491 19880
2455 1 10 . 1 1 44 44 LEU CB C 44 40.386 40.386 42.838 -2.452 19880
2456 1 10 . 1 1 44 44 LEU H H 44 8.645 8.645 7.814 0.831 19880
2457 1 10 . 1 1 45 45 GLY N N 45 107.545 107.545 107.650 -0.105 19880
2458 1 10 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.928 1.383 19880
2459 1 10 . 1 1 45 45 GLY H H 45 7.831 7.831 7.490 0.341 19880
2460 1 10 . 1 1 46 46 THR N N 46 104.485 104.485 109.717 -5.232 19880
2461 1 10 . 1 1 46 46 THR HA H 46 3.901 3.901 4.193 -0.292 19880
2462 1 10 . 1 1 46 46 THR CA C 46 62.180 62.180 63.191 -1.011 19880
2463 1 10 . 1 1 46 46 THR CB C 46 70.021 70.021 69.005 1.016 19880
2464 1 10 . 1 1 46 46 THR H H 46 6.823 6.823 7.916 -1.093 19880
2465 1 10 . 1 1 47 47 THR N N 47 123.300 123.300 117.859 5.441 19880
2466 1 10 . 1 1 47 47 THR HA H 47 4.371 4.371 5.088 -0.717 19880
2467 1 10 . 1 1 47 47 THR CA C 47 62.843 62.843 60.979 1.864 19880
2468 1 10 . 1 1 47 47 THR CB C 47 70.176 70.176 72.293 -2.117 19880
2469 1 10 . 1 1 47 47 THR H H 47 8.763 8.763 7.856 0.907 19880
2470 1 10 . 1 1 48 48 CYS N N 48 128.024 128.024 124.743 3.281 19880
2471 1 10 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.875 0.098 19880
2472 1 10 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.301 -1.317 19880
2473 1 10 . 1 1 48 48 CYS CB C 48 36.282 36.282 28.761 7.521 19880
2474 1 10 . 1 1 48 48 CYS H H 48 9.276 9.276 8.622 0.654 19880
2475 1 10 . 1 1 49 49 THR N N 49 131.810 131.810 119.439 12.371 19880
2476 1 10 . 1 1 49 49 THR HA H 49 4.364 4.364 4.731 -0.367 19880
2477 1 10 . 1 1 49 49 THR CA C 49 61.871 61.871 61.465 0.406 19880
2478 1 10 . 1 1 49 49 THR CB C 49 69.789 69.789 72.551 -2.762 19880
2479 1 10 . 1 1 49 49 THR H H 49 9.194 9.194 8.818 0.376 19880
2480 1 10 . 1 1 50 50 CYS N N 50 123.835 123.835 121.452 2.383 19880
2481 1 10 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.109 -0.074 19880
2482 1 10 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.157 -6.277 19880
2483 1 10 . 1 1 50 50 CYS CB C 50 34.934 34.934 30.085 4.849 19880
2484 1 10 . 1 1 50 50 CYS H H 50 8.879 8.879 8.617 0.262 19880
2485 1 10 . 1 1 51 51 ILE N N 51 123.986 123.986 122.248 1.738 19880
2486 1 10 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.369 -0.226 19880
2487 1 10 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.160 0.459 19880
2488 1 10 . 1 1 51 51 ILE CB C 51 39.380 39.380 40.345 -0.965 19880
2489 1 10 . 1 1 51 51 ILE H H 51 8.098 8.098 8.808 -0.710 19880
2490 1 10 . 1 1 52 52 ASN N N 52 126.122 126.122 125.603 0.519 19880
2491 1 10 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.837 -0.121 19880
2492 1 10 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.784 1.107 19880
2493 1 10 . 1 1 52 52 ASN CB C 52 37.913 37.913 37.873 0.040 19880
2494 1 10 . 1 1 52 52 ASN H H 52 8.323 8.323 8.649 -0.326 19880
2495 1 10 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.524 -0.217 19880
2496 1 10 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.500 0.533 19880
2497 1 10 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.719 3.141 19880
2498 1 10 . 1 1 54 54 CYS N N 54 123.090 123.090 117.889 5.201 19880
2499 1 10 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.112 0.624 19880
2500 1 10 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.828 -2.678 19880
2501 1 10 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.872 19.282 19880
2502 1 10 . 1 1 54 54 CYS H H 54 8.865 8.865 8.482 0.383 19880
2503 1 10 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.463 -0.177 19880
2504 1 10 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.715 -0.457 19880
2505 1 10 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.364 0.086 19880
2506 1 10 . 1 1 56 56 ARG N N 56 117.289 117.289 117.836 -0.547 19880
2507 1 10 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.513 -0.028 19880
2508 1 10 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.853 -0.732 19880
2509 1 10 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.389 -0.850 19880
2510 1 10 . 1 1 56 56 ARG H H 56 7.902 7.902 8.448 -0.546 19880
2511 1 11 . 1 1 3 3 CYS N N 3 117.561 117.561 118.191 -0.630 19880
2512 1 11 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.270 -0.450 19880
2513 1 11 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.331 -2.631 19880
2514 1 11 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.396 20.255 19880
2515 1 11 . 1 1 3 3 CYS H H 3 7.950 7.950 8.476 -0.526 19880
2516 1 11 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.533 -0.028 19880
2517 1 11 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.931 0.799 19880
2518 1 11 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.854 0.445 19880
2519 1 11 . 1 1 5 5 THR N N 5 118.207 118.207 115.851 2.356 19880
2520 1 11 . 1 1 5 5 THR HA H 5 4.814 4.814 4.666 0.148 19880
2521 1 11 . 1 1 5 5 THR CA C 5 61.618 61.618 62.153 -0.535 19880
2522 1 11 . 1 1 5 5 THR CB C 5 70.257 70.257 69.900 0.357 19880
2523 1 11 . 1 1 5 5 THR H H 5 8.529 8.529 8.391 0.138 19880
2524 1 11 . 1 1 6 6 ARG N N 6 123.211 123.211 125.708 -2.497 19880
2525 1 11 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.690 -0.162 19880
2526 1 11 . 1 1 6 6 ARG CA C 6 54.931 54.931 54.511 0.420 19880
2527 1 11 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.070 0.682 19880
2528 1 11 . 1 1 6 6 ARG H H 6 7.693 7.693 8.501 -0.808 19880
2529 1 11 . 1 1 7 7 ARG N N 7 121.558 121.558 120.638 0.920 19880
2530 1 11 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.507 0.159 19880
2531 1 11 . 1 1 7 7 ARG CA C 7 54.415 54.415 56.222 -1.807 19880
2532 1 11 . 1 1 7 7 ARG CB C 7 32.673 32.673 31.700 0.973 19880
2533 1 11 . 1 1 7 7 ARG H H 7 8.450 8.450 8.484 -0.034 19880
2534 1 11 . 1 1 8 8 GLY N N 8 111.006 111.006 108.543 2.463 19880
2535 1 11 . 1 1 8 8 GLY CA C 8 46.653 46.653 44.739 1.914 19880
2536 1 11 . 1 1 8 8 GLY H H 8 9.382 9.382 8.226 1.156 19880
2537 1 11 . 1 1 9 9 LEU N N 9 119.202 119.202 120.706 -1.504 19880
2538 1 11 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.148 -0.258 19880
2539 1 11 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.549 1.205 19880
2540 1 11 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.504 1.266 19880
2541 1 11 . 1 1 9 9 LEU H H 9 8.215 8.215 7.937 0.278 19880
2542 1 11 . 1 1 10 10 CYS N N 10 115.050 115.050 115.514 -0.464 19880
2543 1 11 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.418 -0.528 19880
2544 1 11 . 1 1 10 10 CYS CA C 10 61.378 61.378 59.810 1.568 19880
2545 1 11 . 1 1 10 10 CYS CB C 10 42.589 42.589 24.710 17.878 19880
2546 1 11 . 1 1 10 10 CYS H H 10 9.282 9.282 8.477 0.805 19880
2547 1 11 . 1 1 11 11 VAL N N 11 117.792 117.792 120.705 -2.913 19880
2548 1 11 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.228 -0.457 19880
2549 1 11 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.634 -0.126 19880
2550 1 11 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.523 0.075 19880
2551 1 11 . 1 1 11 11 VAL H H 11 7.315 7.315 8.402 -1.087 19880
2552 1 11 . 1 1 12 12 THR N N 12 109.816 109.816 112.298 -2.482 19880
2553 1 11 . 1 1 12 12 THR HA H 12 4.044 4.044 4.349 -0.305 19880
2554 1 11 . 1 1 12 12 THR CA C 12 63.575 63.575 64.190 -0.615 19880
2555 1 11 . 1 1 12 12 THR CB C 12 69.400 69.400 69.318 0.082 19880
2556 1 11 . 1 1 12 12 THR H H 12 8.214 8.214 7.828 0.386 19880
2557 1 11 . 1 1 13 13 SER N N 13 114.455 114.455 115.211 -0.756 19880
2558 1 11 . 1 1 13 13 SER HA H 13 4.607 4.607 4.570 0.037 19880
2559 1 11 . 1 1 13 13 SER CA C 13 59.460 59.460 58.478 0.981 19880
2560 1 11 . 1 1 13 13 SER CB C 13 64.586 64.586 64.242 0.344 19880
2561 1 11 . 1 1 13 13 SER H H 13 7.511 7.511 7.669 -0.158 19880
2562 1 11 . 1 1 14 14 GLY N N 14 109.125 109.125 109.962 -0.837 19880
2563 1 11 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.567 -0.243 19880
2564 1 11 . 1 1 14 14 GLY H H 14 8.376 8.376 8.082 0.294 19880
2565 1 11 . 1 1 15 15 LEU N N 15 120.782 120.782 121.534 -0.752 19880
2566 1 11 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.200 -0.264 19880
2567 1 11 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.287 0.699 19880
2568 1 11 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.100 -0.574 19880
2569 1 11 . 1 1 15 15 LEU H H 15 8.469 8.469 8.732 -0.263 19880
2570 1 11 . 1 1 16 16 THR N N 16 115.887 115.887 114.255 1.632 19880
2571 1 11 . 1 1 16 16 THR HA H 16 3.602 3.602 3.918 -0.316 19880
2572 1 11 . 1 1 16 16 THR CA C 16 67.196 67.196 66.593 0.603 19880
2573 1 11 . 1 1 16 16 THR CB C 16 68.003 68.003 68.290 -0.287 19880
2574 1 11 . 1 1 16 16 THR H H 16 8.487 8.487 8.179 0.308 19880
2575 1 11 . 1 1 17 17 ALA N N 17 122.643 122.643 123.197 -0.554 19880
2576 1 11 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.317 -0.303 19880
2577 1 11 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.521 0.320 19880
2578 1 11 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.035 0.896 19880
2579 1 11 . 1 1 17 17 ALA H H 17 7.609 7.609 7.704 -0.095 19880
2580 1 11 . 1 1 18 18 CYS N N 18 118.252 118.252 118.428 -0.176 19880
2581 1 11 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.211 0.042 19880
2582 1 11 . 1 1 18 18 CYS CA C 18 58.453 58.453 61.029 -2.576 19880
2583 1 11 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.244 12.402 19880
2584 1 11 . 1 1 18 18 CYS H H 18 7.644 7.644 7.761 -0.117 19880
2585 1 11 . 1 1 19 19 ARG N N 19 120.422 120.422 120.367 0.055 19880
2586 1 11 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.086 -0.611 19880
2587 1 11 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.583 0.969 19880
2588 1 11 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.379 -0.578 19880
2589 1 11 . 1 1 19 19 ARG H H 19 9.072 9.072 8.408 0.664 19880
2590 1 11 . 1 1 20 20 ASN N N 20 117.466 117.466 116.259 1.207 19880
2591 1 11 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.544 -0.332 19880
2592 1 11 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.402 0.209 19880
2593 1 11 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.168 -0.913 19880
2594 1 11 . 1 1 20 20 ASN H H 20 8.411 8.411 8.051 0.360 19880
2595 1 11 . 1 1 21 21 HIS N N 21 120.420 120.420 118.045 2.375 19880
2596 1 11 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.715 -0.541 19880
2597 1 11 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.124 0.030 19880
2598 1 11 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.677 0.911 19880
2599 1 11 . 1 1 21 21 HIS H H 21 7.827 7.827 7.647 0.180 19880
2600 1 11 . 1 1 22 22 CYS N N 22 117.510 117.510 117.883 -0.373 19880
2601 1 11 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.296 -1.137 19880
2602 1 11 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.724 -3.503 19880
2603 1 11 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.393 10.785 19880
2604 1 11 . 1 1 22 22 CYS H H 22 8.500 8.500 7.815 0.685 19880
2605 1 11 . 1 1 23 23 ARG N N 23 116.564 116.564 117.105 -0.541 19880
2606 1 11 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.615 0.038 19880
2607 1 11 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.133 0.895 19880
2608 1 11 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.306 0.349 19880
2609 1 11 . 1 1 23 23 ARG H H 23 7.985 7.985 7.859 0.126 19880
2610 1 11 . 1 1 24 24 SER N N 24 116.727 116.727 112.681 4.046 19880
2611 1 11 . 1 1 24 24 SER HA H 24 4.552 4.552 4.624 -0.072 19880
2612 1 11 . 1 1 24 24 SER CA C 24 57.592 57.592 55.920 1.672 19880
2613 1 11 . 1 1 24 24 SER CB C 24 65.284 65.284 66.050 -0.766 19880
2614 1 11 . 1 1 24 24 SER H H 24 7.435 7.435 7.430 0.005 19880
2615 1 11 . 1 1 25 25 CYS N N 25 121.909 121.909 121.088 0.821 19880
2616 1 11 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.812 -0.176 19880
2617 1 11 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.557 -1.944 19880
2618 1 11 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.059 13.214 19880
2619 1 11 . 1 1 25 25 CYS H H 25 9.000 9.000 8.923 0.077 19880
2620 1 11 . 1 1 26 26 HIS N N 26 126.609 126.609 120.694 5.915 19880
2621 1 11 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.143 -0.191 19880
2622 1 11 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.163 0.559 19880
2623 1 11 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.708 0.392 19880
2624 1 11 . 1 1 26 26 HIS H H 26 9.255 9.255 8.831 0.424 19880
2625 1 11 . 1 1 27 27 ARG N N 27 122.033 122.033 121.468 0.565 19880
2626 1 11 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.300 -0.278 19880
2627 1 11 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.511 1.966 19880
2628 1 11 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.174 -0.294 19880
2629 1 11 . 1 1 27 27 ARG H H 27 8.314 8.314 8.258 0.056 19880
2630 1 11 . 1 1 28 28 GLY N N 28 119.213 119.213 114.322 4.891 19880
2631 1 11 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.705 -0.733 19880
2632 1 11 . 1 1 28 28 GLY H H 28 8.495 8.495 8.082 0.412 19880
2633 1 11 . 1 1 29 29 ASP N N 29 121.258 121.258 118.272 2.986 19880
2634 1 11 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.595 -0.331 19880
2635 1 11 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.873 1.573 19880
2636 1 11 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.107 -0.669 19880
2637 1 11 . 1 1 29 29 ASP H H 29 8.646 8.646 8.282 0.364 19880
2638 1 11 . 1 1 30 30 VAL N N 30 112.703 112.703 117.048 -4.345 19880
2639 1 11 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.271 -0.048 19880
2640 1 11 . 1 1 30 30 VAL CA C 30 61.407 61.407 61.495 -0.088 19880
2641 1 11 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.063 -0.158 19880
2642 1 11 . 1 1 30 30 VAL H H 30 8.026 8.026 7.699 0.327 19880
2643 1 11 . 1 1 31 31 GLY N N 31 109.481 109.481 107.271 2.210 19880
2644 1 11 . 1 1 31 31 GLY CA C 31 44.366 44.366 44.993 -0.627 19880
2645 1 11 . 1 1 31 31 GLY H H 31 7.511 7.511 7.501 0.010 19880
2646 1 11 . 1 1 32 32 CYS N N 32 121.673 121.673 120.904 0.769 19880
2647 1 11 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.134 -0.188 19880
2648 1 11 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.764 -4.583 19880
2649 1 11 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.191 15.105 19880
2650 1 11 . 1 1 32 32 CYS H H 32 8.554 8.554 8.592 -0.038 19880
2651 1 11 . 1 1 33 33 VAL N N 33 119.401 119.401 118.319 1.082 19880
2652 1 11 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.961 -0.166 19880
2653 1 11 . 1 1 33 33 VAL CA C 33 59.311 59.311 59.605 -0.294 19880
2654 1 11 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.289 1.191 19880
2655 1 11 . 1 1 33 33 VAL H H 33 9.025 9.025 9.084 -0.059 19880
2656 1 11 . 1 1 34 34 ARG N N 34 120.394 120.394 115.664 4.730 19880
2657 1 11 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.961 -0.262 19880
2658 1 11 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.246 0.946 19880
2659 1 11 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.248 -0.110 19880
2660 1 11 . 1 1 34 34 ARG H H 34 8.350 8.350 8.687 -0.337 19880
2661 1 11 . 1 1 35 35 CYS N N 35 118.098 118.098 118.592 -0.494 19880
2662 1 11 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.506 0.545 19880
2663 1 11 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.650 -2.373 19880
2664 1 11 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.652 12.901 19880
2665 1 11 . 1 1 35 35 CYS H H 35 8.567 8.567 9.044 -0.477 19880
2666 1 11 . 1 1 36 36 SER N N 36 114.009 114.009 115.827 -1.818 19880
2667 1 11 . 1 1 36 36 SER HA H 36 4.326 4.326 4.550 -0.224 19880
2668 1 11 . 1 1 36 36 SER CA C 36 60.945 60.945 59.655 1.290 19880
2669 1 11 . 1 1 36 36 SER CB C 36 64.743 64.743 63.905 0.838 19880
2670 1 11 . 1 1 36 36 SER H H 36 7.669 7.669 8.359 -0.690 19880
2671 1 11 . 1 1 37 37 ASN N N 37 117.050 117.050 115.986 1.064 19880
2672 1 11 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.906 -0.498 19880
2673 1 11 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.333 -0.247 19880
2674 1 11 . 1 1 37 37 ASN CB C 37 41.374 41.374 41.150 0.224 19880
2675 1 11 . 1 1 37 37 ASN H H 37 7.755 7.755 7.475 0.280 19880
2676 1 11 . 1 1 38 38 ALA N N 38 123.735 123.735 120.187 3.548 19880
2677 1 11 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.941 0.221 19880
2678 1 11 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.504 0.630 19880
2679 1 11 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.023 -2.830 19880
2680 1 11 . 1 1 38 38 ALA H H 38 9.323 9.323 8.293 1.030 19880
2681 1 11 . 1 1 39 39 GLN N N 39 116.531 116.531 117.414 -0.883 19880
2682 1 11 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.717 -0.404 19880
2683 1 11 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.167 0.582 19880
2684 1 11 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.084 1.733 19880
2685 1 11 . 1 1 39 39 GLN H H 39 8.746 8.746 8.986 -0.240 19880
2686 1 11 . 1 1 40 40 CYS N N 40 122.074 122.074 120.129 1.945 19880
2687 1 11 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.492 0.057 19880
2688 1 11 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.707 -3.294 19880
2689 1 11 . 1 1 40 40 CYS CB C 40 40.902 40.902 28.538 12.364 19880
2690 1 11 . 1 1 40 40 CYS H H 40 8.536 8.536 8.699 -0.163 19880
2691 1 11 . 1 1 41 41 THR N N 41 117.753 117.753 114.820 2.933 19880
2692 1 11 . 1 1 41 41 THR HA H 41 4.641 4.641 4.601 0.040 19880
2693 1 11 . 1 1 41 41 THR CA C 41 60.550 60.550 60.156 0.395 19880
2694 1 11 . 1 1 41 41 THR CB C 41 71.033 71.033 71.111 -0.077 19880
2695 1 11 . 1 1 41 41 THR H H 41 9.779 9.779 8.988 0.791 19880
2696 1 11 . 1 1 42 42 GLY N N 42 105.809 105.809 108.088 -2.279 19880
2697 1 11 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.921 -0.906 19880
2698 1 11 . 1 1 42 42 GLY H H 42 8.247 8.247 8.179 0.068 19880
2699 1 11 . 1 1 43 43 PHE N N 43 123.293 123.293 120.824 2.469 19880
2700 1 11 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.563 -0.265 19880
2701 1 11 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.434 0.763 19880
2702 1 11 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.483 -0.833 19880
2703 1 11 . 1 1 43 43 PHE H H 43 8.707 8.707 8.877 -0.170 19880
2704 1 11 . 1 1 44 44 LEU N N 44 120.771 120.771 117.468 3.303 19880
2705 1 11 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.363 -0.515 19880
2706 1 11 . 1 1 44 44 LEU CB C 44 40.386 40.386 43.049 -2.663 19880
2707 1 11 . 1 1 44 44 LEU H H 44 8.645 8.645 7.727 0.918 19880
2708 1 11 . 1 1 45 45 GLY N N 45 107.545 107.545 108.131 -0.586 19880
2709 1 11 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.960 1.351 19880
2710 1 11 . 1 1 45 45 GLY H H 45 7.831 7.831 7.531 0.300 19880
2711 1 11 . 1 1 46 46 THR N N 46 104.485 104.485 109.160 -4.675 19880
2712 1 11 . 1 1 46 46 THR HA H 46 3.901 3.901 4.128 -0.227 19880
2713 1 11 . 1 1 46 46 THR CA C 46 62.180 62.180 63.063 -0.883 19880
2714 1 11 . 1 1 46 46 THR CB C 46 70.021 70.021 69.438 0.583 19880
2715 1 11 . 1 1 46 46 THR H H 46 6.823 6.823 7.835 -1.012 19880
2716 1 11 . 1 1 47 47 THR N N 47 123.300 123.300 117.211 6.089 19880
2717 1 11 . 1 1 47 47 THR HA H 47 4.371 4.371 5.190 -0.819 19880
2718 1 11 . 1 1 47 47 THR CA C 47 62.843 62.843 60.850 1.993 19880
2719 1 11 . 1 1 47 47 THR CB C 47 70.176 70.176 72.267 -2.091 19880
2720 1 11 . 1 1 47 47 THR H H 47 8.763 8.763 7.669 1.094 19880
2721 1 11 . 1 1 48 48 CYS N N 48 128.024 128.024 124.130 3.894 19880
2722 1 11 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.968 0.005 19880
2723 1 11 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.066 -1.082 19880
2724 1 11 . 1 1 48 48 CYS CB C 48 36.282 36.282 28.929 7.353 19880
2725 1 11 . 1 1 48 48 CYS H H 48 9.276 9.276 8.621 0.655 19880
2726 1 11 . 1 1 49 49 THR N N 49 131.810 131.810 121.187 10.623 19880
2727 1 11 . 1 1 49 49 THR HA H 49 4.364 4.364 4.751 -0.387 19880
2728 1 11 . 1 1 49 49 THR CA C 49 61.871 61.871 61.728 0.143 19880
2729 1 11 . 1 1 49 49 THR CB C 49 69.789 69.789 72.750 -2.961 19880
2730 1 11 . 1 1 49 49 THR H H 49 9.194 9.194 8.880 0.314 19880
2731 1 11 . 1 1 50 50 CYS N N 50 123.835 123.835 121.468 2.367 19880
2732 1 11 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.106 -0.071 19880
2733 1 11 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.178 -6.298 19880
2734 1 11 . 1 1 50 50 CYS CB C 50 34.934 34.934 30.044 4.890 19880
2735 1 11 . 1 1 50 50 CYS H H 50 8.879 8.879 8.628 0.251 19880
2736 1 11 . 1 1 51 51 ILE N N 51 123.986 123.986 122.299 1.687 19880
2737 1 11 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.366 -0.223 19880
2738 1 11 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.178 0.441 19880
2739 1 11 . 1 1 51 51 ILE CB C 51 39.380 39.380 40.027 -0.647 19880
2740 1 11 . 1 1 51 51 ILE H H 51 8.098 8.098 8.864 -0.766 19880
2741 1 11 . 1 1 52 52 ASN N N 52 126.122 126.122 125.444 0.678 19880
2742 1 11 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.857 -0.141 19880
2743 1 11 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.676 1.215 19880
2744 1 11 . 1 1 52 52 ASN CB C 52 37.913 37.913 37.893 0.020 19880
2745 1 11 . 1 1 52 52 ASN H H 52 8.323 8.323 8.641 -0.318 19880
2746 1 11 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.533 -0.226 19880
2747 1 11 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.461 0.572 19880
2748 1 11 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.727 3.133 19880
2749 1 11 . 1 1 54 54 CYS N N 54 123.090 123.090 117.929 5.161 19880
2750 1 11 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.114 0.622 19880
2751 1 11 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.811 -2.661 19880
2752 1 11 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.847 19.307 19880
2753 1 11 . 1 1 54 54 CYS H H 54 8.865 8.865 8.476 0.389 19880
2754 1 11 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.451 -0.165 19880
2755 1 11 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.737 -0.479 19880
2756 1 11 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.354 0.096 19880
2757 1 11 . 1 1 56 56 ARG N N 56 117.289 117.289 118.131 -0.842 19880
2758 1 11 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.417 0.068 19880
2759 1 11 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.836 -0.715 19880
2760 1 11 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.213 -0.674 19880
2761 1 11 . 1 1 56 56 ARG H H 56 7.902 7.902 8.417 -0.515 19880
2762 1 12 . 1 1 3 3 CYS N N 3 117.561 117.561 116.815 0.746 19880
2763 1 12 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.311 -0.491 19880
2764 1 12 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.053 -2.353 19880
2765 1 12 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.403 20.248 19880
2766 1 12 . 1 1 3 3 CYS H H 3 7.950 7.950 7.979 -0.029 19880
2767 1 12 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.600 -0.095 19880
2768 1 12 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.849 0.881 19880
2769 1 12 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.681 0.618 19880
2770 1 12 . 1 1 5 5 THR N N 5 118.207 118.207 116.104 2.103 19880
2771 1 12 . 1 1 5 5 THR HA H 5 4.814 4.814 4.637 0.177 19880
2772 1 12 . 1 1 5 5 THR CA C 5 61.618 61.618 61.815 -0.197 19880
2773 1 12 . 1 1 5 5 THR CB C 5 70.257 70.257 69.723 0.534 19880
2774 1 12 . 1 1 5 5 THR H H 5 8.529 8.529 8.371 0.158 19880
2775 1 12 . 1 1 6 6 ARG N N 6 123.211 123.211 127.031 -3.820 19880
2776 1 12 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.583 -0.055 19880
2777 1 12 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.129 -0.198 19880
2778 1 12 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.641 0.112 19880
2779 1 12 . 1 1 6 6 ARG H H 6 7.693 7.693 8.645 -0.952 19880
2780 1 12 . 1 1 7 7 ARG N N 7 121.558 121.558 119.989 1.569 19880
2781 1 12 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.496 0.170 19880
2782 1 12 . 1 1 7 7 ARG CA C 7 54.415 54.415 56.286 -1.871 19880
2783 1 12 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.005 0.668 19880
2784 1 12 . 1 1 7 7 ARG H H 7 8.450 8.450 8.551 -0.101 19880
2785 1 12 . 1 1 8 8 GLY N N 8 111.006 111.006 109.088 1.918 19880
2786 1 12 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.132 1.521 19880
2787 1 12 . 1 1 8 8 GLY H H 8 9.382 9.382 8.309 1.073 19880
2788 1 12 . 1 1 9 9 LEU N N 9 119.202 119.202 121.063 -1.861 19880
2789 1 12 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.114 -0.224 19880
2790 1 12 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.596 1.158 19880
2791 1 12 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.421 1.349 19880
2792 1 12 . 1 1 9 9 LEU H H 9 8.215 8.215 7.956 0.259 19880
2793 1 12 . 1 1 10 10 CYS N N 10 115.050 115.050 115.784 -0.734 19880
2794 1 12 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.216 -0.326 19880
2795 1 12 . 1 1 10 10 CYS CA C 10 61.378 61.378 60.895 0.483 19880
2796 1 12 . 1 1 10 10 CYS CB C 10 42.589 42.589 25.515 17.074 19880
2797 1 12 . 1 1 10 10 CYS H H 10 9.282 9.282 8.360 0.922 19880
2798 1 12 . 1 1 11 11 VAL N N 11 117.792 117.792 120.019 -2.227 19880
2799 1 12 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.257 -0.486 19880
2800 1 12 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.338 0.170 19880
2801 1 12 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.318 0.280 19880
2802 1 12 . 1 1 11 11 VAL H H 11 7.315 7.315 8.286 -0.971 19880
2803 1 12 . 1 1 12 12 THR N N 12 109.816 109.816 112.033 -2.217 19880
2804 1 12 . 1 1 12 12 THR HA H 12 4.044 4.044 4.393 -0.349 19880
2805 1 12 . 1 1 12 12 THR CA C 12 63.575 63.575 63.753 -0.178 19880
2806 1 12 . 1 1 12 12 THR CB C 12 69.400 69.400 70.043 -0.643 19880
2807 1 12 . 1 1 12 12 THR H H 12 8.214 8.214 7.847 0.367 19880
2808 1 12 . 1 1 13 13 SER N N 13 114.455 114.455 115.816 -1.361 19880
2809 1 12 . 1 1 13 13 SER HA H 13 4.607 4.607 4.634 -0.027 19880
2810 1 12 . 1 1 13 13 SER CA C 13 59.460 59.460 58.601 0.859 19880
2811 1 12 . 1 1 13 13 SER CB C 13 64.586 64.586 65.733 -1.147 19880
2812 1 12 . 1 1 13 13 SER H H 13 7.511 7.511 7.781 -0.270 19880
2813 1 12 . 1 1 14 14 GLY N N 14 109.125 109.125 109.491 -0.366 19880
2814 1 12 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.489 -0.165 19880
2815 1 12 . 1 1 14 14 GLY H H 14 8.376 8.376 8.074 0.302 19880
2816 1 12 . 1 1 15 15 LEU N N 15 120.782 120.782 121.643 -0.861 19880
2817 1 12 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.192 -0.256 19880
2818 1 12 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.361 0.625 19880
2819 1 12 . 1 1 15 15 LEU CB C 15 41.526 41.526 41.960 -0.434 19880
2820 1 12 . 1 1 15 15 LEU H H 15 8.469 8.469 8.703 -0.234 19880
2821 1 12 . 1 1 16 16 THR N N 16 115.887 115.887 114.316 1.571 19880
2822 1 12 . 1 1 16 16 THR HA H 16 3.602 3.602 3.948 -0.346 19880
2823 1 12 . 1 1 16 16 THR CA C 16 67.196 67.196 67.040 0.156 19880
2824 1 12 . 1 1 16 16 THR CB C 16 68.003 68.003 67.976 0.027 19880
2825 1 12 . 1 1 16 16 THR H H 16 8.487 8.487 8.238 0.249 19880
2826 1 12 . 1 1 17 17 ALA N N 17 122.643 122.643 123.334 -0.691 19880
2827 1 12 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.328 -0.314 19880
2828 1 12 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.505 0.336 19880
2829 1 12 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.077 0.854 19880
2830 1 12 . 1 1 17 17 ALA H H 17 7.609 7.609 7.702 -0.093 19880
2831 1 12 . 1 1 18 18 CYS N N 18 118.252 118.252 118.359 -0.107 19880
2832 1 12 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.225 0.028 19880
2833 1 12 . 1 1 18 18 CYS CA C 18 58.453 58.453 60.850 -2.397 19880
2834 1 12 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.267 12.379 19880
2835 1 12 . 1 1 18 18 CYS H H 18 7.644 7.644 7.710 -0.066 19880
2836 1 12 . 1 1 19 19 ARG N N 19 120.422 120.422 119.923 0.499 19880
2837 1 12 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.116 -0.641 19880
2838 1 12 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.479 1.073 19880
2839 1 12 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.337 -0.536 19880
2840 1 12 . 1 1 19 19 ARG H H 19 9.072 9.072 8.370 0.702 19880
2841 1 12 . 1 1 20 20 ASN N N 20 117.466 117.466 116.090 1.376 19880
2842 1 12 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.616 -0.404 19880
2843 1 12 . 1 1 20 20 ASN CA C 20 55.611 55.611 54.977 0.634 19880
2844 1 12 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.377 -1.122 19880
2845 1 12 . 1 1 20 20 ASN H H 20 8.411 8.411 7.831 0.580 19880
2846 1 12 . 1 1 21 21 HIS N N 21 120.420 120.420 118.182 2.238 19880
2847 1 12 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.524 -0.350 19880
2848 1 12 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.436 -0.282 19880
2849 1 12 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.665 0.923 19880
2850 1 12 . 1 1 21 21 HIS H H 21 7.827 7.827 7.703 0.124 19880
2851 1 12 . 1 1 22 22 CYS N N 22 117.510 117.510 117.445 0.065 19880
2852 1 12 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.295 -1.136 19880
2853 1 12 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.678 -3.457 19880
2854 1 12 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.427 10.751 19880
2855 1 12 . 1 1 22 22 CYS H H 22 8.500 8.500 7.935 0.565 19880
2856 1 12 . 1 1 23 23 ARG N N 23 116.564 116.564 118.792 -2.228 19880
2857 1 12 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.747 -0.094 19880
2858 1 12 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.528 0.500 19880
2859 1 12 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.403 0.252 19880
2860 1 12 . 1 1 23 23 ARG H H 23 7.985 7.985 7.884 0.101 19880
2861 1 12 . 1 1 24 24 SER N N 24 116.727 116.727 113.269 3.458 19880
2862 1 12 . 1 1 24 24 SER HA H 24 4.552 4.552 4.629 -0.077 19880
2863 1 12 . 1 1 24 24 SER CA C 24 57.592 57.592 56.560 1.032 19880
2864 1 12 . 1 1 24 24 SER CB C 24 65.284 65.284 67.278 -1.994 19880
2865 1 12 . 1 1 24 24 SER H H 24 7.435 7.435 7.368 0.067 19880
2866 1 12 . 1 1 25 25 CYS N N 25 121.909 121.909 120.505 1.404 19880
2867 1 12 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.774 -0.138 19880
2868 1 12 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.531 -1.917 19880
2869 1 12 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.017 13.256 19880
2870 1 12 . 1 1 25 25 CYS H H 25 9.000 9.000 8.848 0.152 19880
2871 1 12 . 1 1 26 26 HIS N N 26 126.609 126.609 120.131 6.478 19880
2872 1 12 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.200 -0.248 19880
2873 1 12 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.312 0.410 19880
2874 1 12 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.794 0.306 19880
2875 1 12 . 1 1 26 26 HIS H H 26 9.255 9.255 8.820 0.435 19880
2876 1 12 . 1 1 27 27 ARG N N 27 122.033 122.033 120.967 1.066 19880
2877 1 12 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.350 -0.328 19880
2878 1 12 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.376 2.101 19880
2879 1 12 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.847 -0.967 19880
2880 1 12 . 1 1 27 27 ARG H H 27 8.314 8.314 8.248 0.066 19880
2881 1 12 . 1 1 28 28 GLY N N 28 119.213 119.213 113.427 5.786 19880
2882 1 12 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.586 -0.614 19880
2883 1 12 . 1 1 28 28 GLY H H 28 8.495 8.495 7.940 0.555 19880
2884 1 12 . 1 1 29 29 ASP N N 29 121.258 121.258 118.347 2.911 19880
2885 1 12 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.668 -0.404 19880
2886 1 12 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.055 2.391 19880
2887 1 12 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.310 -0.872 19880
2888 1 12 . 1 1 29 29 ASP H H 29 8.646 8.646 8.265 0.381 19880
2889 1 12 . 1 1 30 30 VAL N N 30 112.703 112.703 117.802 -5.099 19880
2890 1 12 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.293 -0.070 19880
2891 1 12 . 1 1 30 30 VAL CA C 30 61.407 61.407 61.768 -0.361 19880
2892 1 12 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.171 -0.266 19880
2893 1 12 . 1 1 30 30 VAL H H 30 8.026 8.026 7.579 0.447 19880
2894 1 12 . 1 1 31 31 GLY N N 31 109.481 109.481 106.989 2.492 19880
2895 1 12 . 1 1 31 31 GLY CA C 31 44.366 44.366 45.008 -0.642 19880
2896 1 12 . 1 1 31 31 GLY H H 31 7.511 7.511 7.583 -0.072 19880
2897 1 12 . 1 1 32 32 CYS N N 32 121.673 121.673 120.843 0.830 19880
2898 1 12 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.201 -0.255 19880
2899 1 12 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.495 -4.314 19880
2900 1 12 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.738 14.558 19880
2901 1 12 . 1 1 32 32 CYS H H 32 8.554 8.554 8.565 -0.011 19880
2902 1 12 . 1 1 33 33 VAL N N 33 119.401 119.401 117.970 1.431 19880
2903 1 12 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.910 -0.115 19880
2904 1 12 . 1 1 33 33 VAL CA C 33 59.311 59.311 59.737 -0.426 19880
2905 1 12 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.273 1.207 19880
2906 1 12 . 1 1 33 33 VAL H H 33 9.025 9.025 9.065 -0.040 19880
2907 1 12 . 1 1 34 34 ARG N N 34 120.394 120.394 115.682 4.712 19880
2908 1 12 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.916 -0.217 19880
2909 1 12 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.233 0.959 19880
2910 1 12 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.234 -0.096 19880
2911 1 12 . 1 1 34 34 ARG H H 34 8.350 8.350 8.705 -0.355 19880
2912 1 12 . 1 1 35 35 CYS N N 35 118.098 118.098 118.460 -0.362 19880
2913 1 12 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.416 0.635 19880
2914 1 12 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.503 -2.226 19880
2915 1 12 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.964 12.589 19880
2916 1 12 . 1 1 35 35 CYS H H 35 8.567 8.567 9.041 -0.474 19880
2917 1 12 . 1 1 36 36 SER N N 36 114.009 114.009 116.255 -2.246 19880
2918 1 12 . 1 1 36 36 SER HA H 36 4.326 4.326 4.549 -0.223 19880
2919 1 12 . 1 1 36 36 SER CA C 36 60.945 60.945 59.948 0.997 19880
2920 1 12 . 1 1 36 36 SER CB C 36 64.743 64.743 64.508 0.235 19880
2921 1 12 . 1 1 36 36 SER H H 36 7.669 7.669 8.477 -0.808 19880
2922 1 12 . 1 1 37 37 ASN N N 37 117.050 117.050 116.334 0.716 19880
2923 1 12 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.854 -0.446 19880
2924 1 12 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.681 -0.595 19880
2925 1 12 . 1 1 37 37 ASN CB C 37 41.374 41.374 40.405 0.969 19880
2926 1 12 . 1 1 37 37 ASN H H 37 7.755 7.755 7.459 0.296 19880
2927 1 12 . 1 1 38 38 ALA N N 38 123.735 123.735 120.396 3.339 19880
2928 1 12 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.941 0.221 19880
2929 1 12 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.505 0.628 19880
2930 1 12 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.026 -2.833 19880
2931 1 12 . 1 1 38 38 ALA H H 38 9.323 9.323 8.322 1.001 19880
2932 1 12 . 1 1 39 39 GLN N N 39 116.531 116.531 116.630 -0.099 19880
2933 1 12 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.730 -0.417 19880
2934 1 12 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.403 0.346 19880
2935 1 12 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.408 1.409 19880
2936 1 12 . 1 1 39 39 GLN H H 39 8.746 8.746 9.018 -0.272 19880
2937 1 12 . 1 1 40 40 CYS N N 40 122.074 122.074 121.243 0.831 19880
2938 1 12 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.582 -0.033 19880
2939 1 12 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.202 -2.789 19880
2940 1 12 . 1 1 40 40 CYS CB C 40 40.902 40.902 29.015 11.887 19880
2941 1 12 . 1 1 40 40 CYS H H 40 8.536 8.536 8.624 -0.088 19880
2942 1 12 . 1 1 41 41 THR N N 41 117.753 117.753 120.482 -2.729 19880
2943 1 12 . 1 1 41 41 THR HA H 41 4.641 4.641 4.622 0.019 19880
2944 1 12 . 1 1 41 41 THR CA C 41 60.550 60.550 60.166 0.384 19880
2945 1 12 . 1 1 41 41 THR CB C 41 71.033 71.033 71.344 -0.312 19880
2946 1 12 . 1 1 41 41 THR H H 41 9.779 9.779 9.100 0.679 19880
2947 1 12 . 1 1 42 42 GLY N N 42 105.809 105.809 107.727 -1.918 19880
2948 1 12 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.856 -0.841 19880
2949 1 12 . 1 1 42 42 GLY H H 42 8.247 8.247 8.204 0.043 19880
2950 1 12 . 1 1 43 43 PHE N N 43 123.293 123.293 120.647 2.646 19880
2951 1 12 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.554 -0.256 19880
2952 1 12 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.558 0.638 19880
2953 1 12 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.570 -0.920 19880
2954 1 12 . 1 1 43 43 PHE H H 43 8.707 8.707 8.863 -0.156 19880
2955 1 12 . 1 1 44 44 LEU N N 44 120.771 120.771 119.276 1.495 19880
2956 1 12 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.429 -0.581 19880
2957 1 12 . 1 1 44 44 LEU CB C 44 40.386 40.386 43.369 -2.983 19880
2958 1 12 . 1 1 44 44 LEU H H 44 8.645 8.645 7.449 1.196 19880
2959 1 12 . 1 1 45 45 GLY N N 45 107.545 107.545 109.906 -2.361 19880
2960 1 12 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.400 1.911 19880
2961 1 12 . 1 1 45 45 GLY H H 45 7.831 7.831 7.803 0.028 19880
2962 1 12 . 1 1 46 46 THR N N 46 104.485 104.485 110.636 -6.151 19880
2963 1 12 . 1 1 46 46 THR HA H 46 3.901 3.901 4.533 -0.632 19880
2964 1 12 . 1 1 46 46 THR CA C 46 62.180 62.180 61.819 0.361 19880
2965 1 12 . 1 1 46 46 THR CB C 46 70.021 70.021 71.112 -1.091 19880
2966 1 12 . 1 1 46 46 THR H H 46 6.823 6.823 8.609 -1.786 19880
2967 1 12 . 1 1 47 47 THR N N 47 123.300 123.300 119.059 4.241 19880
2968 1 12 . 1 1 47 47 THR HA H 47 4.371 4.371 5.111 -0.740 19880
2969 1 12 . 1 1 47 47 THR CA C 47 62.843 62.843 61.744 1.099 19880
2970 1 12 . 1 1 47 47 THR CB C 47 70.176 70.176 72.187 -2.011 19880
2971 1 12 . 1 1 47 47 THR H H 47 8.763 8.763 7.989 0.774 19880
2972 1 12 . 1 1 48 48 CYS N N 48 128.024 128.024 125.175 2.849 19880
2973 1 12 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.860 0.113 19880
2974 1 12 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.649 -1.665 19880
2975 1 12 . 1 1 48 48 CYS CB C 48 36.282 36.282 27.525 8.757 19880
2976 1 12 . 1 1 48 48 CYS H H 48 9.276 9.276 8.577 0.699 19880
2977 1 12 . 1 1 49 49 THR N N 49 131.810 131.810 121.767 10.043 19880
2978 1 12 . 1 1 49 49 THR HA H 49 4.364 4.364 4.634 -0.270 19880
2979 1 12 . 1 1 49 49 THR CA C 49 61.871 61.871 61.685 0.186 19880
2980 1 12 . 1 1 49 49 THR CB C 49 69.789 69.789 72.672 -2.883 19880
2981 1 12 . 1 1 49 49 THR H H 49 9.194 9.194 8.983 0.211 19880
2982 1 12 . 1 1 50 50 CYS N N 50 123.835 123.835 121.857 1.978 19880
2983 1 12 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.098 -0.063 19880
2984 1 12 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.205 -6.325 19880
2985 1 12 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.811 5.123 19880
2986 1 12 . 1 1 50 50 CYS H H 50 8.879 8.879 8.595 0.284 19880
2987 1 12 . 1 1 51 51 ILE N N 51 123.986 123.986 121.951 2.035 19880
2988 1 12 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.386 -0.243 19880
2989 1 12 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.085 0.534 19880
2990 1 12 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.873 -0.493 19880
2991 1 12 . 1 1 51 51 ILE H H 51 8.098 8.098 8.828 -0.730 19880
2992 1 12 . 1 1 52 52 ASN N N 52 126.122 126.122 125.738 0.384 19880
2993 1 12 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.853 -0.137 19880
2994 1 12 . 1 1 52 52 ASN CA C 52 52.891 52.891 52.645 0.246 19880
2995 1 12 . 1 1 52 52 ASN CB C 52 37.913 37.913 38.501 -0.588 19880
2996 1 12 . 1 1 52 52 ASN H H 52 8.323 8.323 8.571 -0.248 19880
2997 1 12 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.493 -0.186 19880
2998 1 12 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.408 0.625 19880
2999 1 12 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.773 3.087 19880
3000 1 12 . 1 1 54 54 CYS N N 54 123.090 123.090 117.656 5.434 19880
3001 1 12 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.102 0.634 19880
3002 1 12 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.865 -2.715 19880
3003 1 12 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.922 19.232 19880
3004 1 12 . 1 1 54 54 CYS H H 54 8.865 8.865 8.465 0.400 19880
3005 1 12 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.451 -0.165 19880
3006 1 12 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.772 -0.514 19880
3007 1 12 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.351 0.099 19880
3008 1 12 . 1 1 56 56 ARG N N 56 117.289 117.289 118.233 -0.944 19880
3009 1 12 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.414 0.071 19880
3010 1 12 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.811 -0.690 19880
3011 1 12 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.208 -0.669 19880
3012 1 12 . 1 1 56 56 ARG H H 56 7.902 7.902 8.416 -0.514 19880
3013 1 13 . 1 1 3 3 CYS N N 3 117.561 117.561 117.424 0.137 19880
3014 1 13 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.291 -0.471 19880
3015 1 13 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.020 -2.320 19880
3016 1 13 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.021 20.630 19880
3017 1 13 . 1 1 3 3 CYS H H 3 7.950 7.950 8.099 -0.149 19880
3018 1 13 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.579 -0.074 19880
3019 1 13 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.852 0.878 19880
3020 1 13 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.943 0.356 19880
3021 1 13 . 1 1 5 5 THR N N 5 118.207 118.207 116.363 1.844 19880
3022 1 13 . 1 1 5 5 THR HA H 5 4.814 4.814 4.613 0.201 19880
3023 1 13 . 1 1 5 5 THR CA C 5 61.618 61.618 62.082 -0.464 19880
3024 1 13 . 1 1 5 5 THR CB C 5 70.257 70.257 69.650 0.607 19880
3025 1 13 . 1 1 5 5 THR H H 5 8.529 8.529 8.326 0.203 19880
3026 1 13 . 1 1 6 6 ARG N N 6 123.211 123.211 127.388 -4.177 19880
3027 1 13 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.543 -0.015 19880
3028 1 13 . 1 1 6 6 ARG CA C 6 54.931 54.931 54.757 0.174 19880
3029 1 13 . 1 1 6 6 ARG CB C 6 32.752 32.752 31.797 0.955 19880
3030 1 13 . 1 1 6 6 ARG H H 6 7.693 7.693 8.214 -0.521 19880
3031 1 13 . 1 1 7 7 ARG N N 7 121.558 121.558 121.862 -0.304 19880
3032 1 13 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.503 0.163 19880
3033 1 13 . 1 1 7 7 ARG CA C 7 54.415 54.415 56.576 -2.161 19880
3034 1 13 . 1 1 7 7 ARG CB C 7 32.673 32.673 31.884 0.788 19880
3035 1 13 . 1 1 7 7 ARG H H 7 8.450 8.450 8.490 -0.040 19880
3036 1 13 . 1 1 8 8 GLY N N 8 111.006 111.006 108.782 2.224 19880
3037 1 13 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.199 1.454 19880
3038 1 13 . 1 1 8 8 GLY H H 8 9.382 9.382 8.255 1.127 19880
3039 1 13 . 1 1 9 9 LEU N N 9 119.202 119.202 121.311 -2.109 19880
3040 1 13 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.028 -0.138 19880
3041 1 13 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.964 0.790 19880
3042 1 13 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.586 1.184 19880
3043 1 13 . 1 1 9 9 LEU H H 9 8.215 8.215 7.930 0.285 19880
3044 1 13 . 1 1 10 10 CYS N N 10 115.050 115.050 115.212 -0.162 19880
3045 1 13 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.444 -0.554 19880
3046 1 13 . 1 1 10 10 CYS CA C 10 61.378 61.378 60.179 1.199 19880
3047 1 13 . 1 1 10 10 CYS CB C 10 42.589 42.589 25.138 17.451 19880
3048 1 13 . 1 1 10 10 CYS H H 10 9.282 9.282 8.343 0.939 19880
3049 1 13 . 1 1 11 11 VAL N N 11 117.792 117.792 119.564 -1.772 19880
3050 1 13 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.212 -0.441 19880
3051 1 13 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.461 0.047 19880
3052 1 13 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.633 -0.035 19880
3053 1 13 . 1 1 11 11 VAL H H 11 7.315 7.315 8.115 -0.800 19880
3054 1 13 . 1 1 12 12 THR N N 12 109.816 109.816 114.287 -4.471 19880
3055 1 13 . 1 1 12 12 THR HA H 12 4.044 4.044 4.431 -0.387 19880
3056 1 13 . 1 1 12 12 THR CA C 12 63.575 63.575 64.049 -0.474 19880
3057 1 13 . 1 1 12 12 THR CB C 12 69.400 69.400 69.302 0.098 19880
3058 1 13 . 1 1 12 12 THR H H 12 8.214 8.214 7.696 0.518 19880
3059 1 13 . 1 1 13 13 SER N N 13 114.455 114.455 114.732 -0.277 19880
3060 1 13 . 1 1 13 13 SER HA H 13 4.607 4.607 4.598 0.009 19880
3061 1 13 . 1 1 13 13 SER CA C 13 59.460 59.460 58.253 1.207 19880
3062 1 13 . 1 1 13 13 SER CB C 13 64.586 64.586 64.547 0.039 19880
3063 1 13 . 1 1 13 13 SER H H 13 7.511 7.511 7.680 -0.169 19880
3064 1 13 . 1 1 14 14 GLY N N 14 109.125 109.125 109.710 -0.585 19880
3065 1 13 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.569 -0.245 19880
3066 1 13 . 1 1 14 14 GLY H H 14 8.376 8.376 8.136 0.240 19880
3067 1 13 . 1 1 15 15 LEU N N 15 120.782 120.782 122.200 -1.418 19880
3068 1 13 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.200 -0.264 19880
3069 1 13 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.098 0.888 19880
3070 1 13 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.022 -0.496 19880
3071 1 13 . 1 1 15 15 LEU H H 15 8.469 8.469 8.638 -0.169 19880
3072 1 13 . 1 1 16 16 THR N N 16 115.887 115.887 114.296 1.591 19880
3073 1 13 . 1 1 16 16 THR HA H 16 3.602 3.602 3.930 -0.328 19880
3074 1 13 . 1 1 16 16 THR CA C 16 67.196 67.196 66.620 0.576 19880
3075 1 13 . 1 1 16 16 THR CB C 16 68.003 68.003 68.314 -0.311 19880
3076 1 13 . 1 1 16 16 THR H H 16 8.487 8.487 8.237 0.250 19880
3077 1 13 . 1 1 17 17 ALA N N 17 122.643 122.643 123.292 -0.649 19880
3078 1 13 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.312 -0.298 19880
3079 1 13 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.554 0.287 19880
3080 1 13 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.051 0.880 19880
3081 1 13 . 1 1 17 17 ALA H H 17 7.609 7.609 7.689 -0.080 19880
3082 1 13 . 1 1 18 18 CYS N N 18 118.252 118.252 118.436 -0.184 19880
3083 1 13 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.205 0.048 19880
3084 1 13 . 1 1 18 18 CYS CA C 18 58.453 58.453 61.105 -2.652 19880
3085 1 13 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.234 12.412 19880
3086 1 13 . 1 1 18 18 CYS H H 18 7.644 7.644 7.751 -0.107 19880
3087 1 13 . 1 1 19 19 ARG N N 19 120.422 120.422 120.289 0.133 19880
3088 1 13 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.082 -0.607 19880
3089 1 13 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.609 0.943 19880
3090 1 13 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.371 -0.570 19880
3091 1 13 . 1 1 19 19 ARG H H 19 9.072 9.072 8.494 0.578 19880
3092 1 13 . 1 1 20 20 ASN N N 20 117.466 117.466 115.808 1.658 19880
3093 1 13 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.556 -0.344 19880
3094 1 13 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.317 0.294 19880
3095 1 13 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.288 -1.033 19880
3096 1 13 . 1 1 20 20 ASN H H 20 8.411 8.411 7.863 0.548 19880
3097 1 13 . 1 1 21 21 HIS N N 21 120.420 120.420 117.297 3.123 19880
3098 1 13 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.557 -0.383 19880
3099 1 13 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.269 -0.115 19880
3100 1 13 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.822 0.766 19880
3101 1 13 . 1 1 21 21 HIS H H 21 7.827 7.827 7.708 0.119 19880
3102 1 13 . 1 1 22 22 CYS N N 22 117.510 117.510 118.167 -0.657 19880
3103 1 13 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.366 -1.207 19880
3104 1 13 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.648 -3.427 19880
3105 1 13 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.401 10.777 19880
3106 1 13 . 1 1 22 22 CYS H H 22 8.500 8.500 7.836 0.664 19880
3107 1 13 . 1 1 23 23 ARG N N 23 116.564 116.564 117.067 -0.503 19880
3108 1 13 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.644 0.009 19880
3109 1 13 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.669 0.359 19880
3110 1 13 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.481 0.174 19880
3111 1 13 . 1 1 23 23 ARG H H 23 7.985 7.985 7.864 0.121 19880
3112 1 13 . 1 1 24 24 SER N N 24 116.727 116.727 113.024 3.703 19880
3113 1 13 . 1 1 24 24 SER HA H 24 4.552 4.552 4.617 -0.065 19880
3114 1 13 . 1 1 24 24 SER CA C 24 57.592 57.592 56.521 1.071 19880
3115 1 13 . 1 1 24 24 SER CB C 24 65.284 65.284 66.539 -1.255 19880
3116 1 13 . 1 1 24 24 SER H H 24 7.435 7.435 7.234 0.201 19880
3117 1 13 . 1 1 25 25 CYS N N 25 121.909 121.909 122.388 -0.479 19880
3118 1 13 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.715 -0.079 19880
3119 1 13 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.248 -1.634 19880
3120 1 13 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.516 12.757 19880
3121 1 13 . 1 1 25 25 CYS H H 25 9.000 9.000 8.692 0.308 19880
3122 1 13 . 1 1 26 26 HIS N N 26 126.609 126.609 124.156 2.453 19880
3123 1 13 . 1 1 26 26 HIS HA H 26 4.952 4.952 4.996 -0.044 19880
3124 1 13 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.241 0.481 19880
3125 1 13 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.438 0.662 19880
3126 1 13 . 1 1 26 26 HIS H H 26 9.255 9.255 8.785 0.470 19880
3127 1 13 . 1 1 27 27 ARG N N 27 122.033 122.033 120.802 1.231 19880
3128 1 13 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.325 -0.303 19880
3129 1 13 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.775 1.702 19880
3130 1 13 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.485 -0.605 19880
3131 1 13 . 1 1 27 27 ARG H H 27 8.314 8.314 8.301 0.013 19880
3132 1 13 . 1 1 28 28 GLY N N 28 119.213 119.213 112.007 7.206 19880
3133 1 13 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.066 -0.094 19880
3134 1 13 . 1 1 28 28 GLY H H 28 8.495 8.495 8.324 0.171 19880
3135 1 13 . 1 1 29 29 ASP N N 29 121.258 121.258 117.646 3.612 19880
3136 1 13 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.684 -0.420 19880
3137 1 13 . 1 1 29 29 ASP CA C 29 57.446 57.446 54.914 2.532 19880
3138 1 13 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.292 -0.854 19880
3139 1 13 . 1 1 29 29 ASP H H 29 8.646 8.646 8.382 0.264 19880
3140 1 13 . 1 1 30 30 VAL N N 30 112.703 112.703 116.890 -4.187 19880
3141 1 13 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.322 -0.099 19880
3142 1 13 . 1 1 30 30 VAL CA C 30 61.407 61.407 61.599 -0.192 19880
3143 1 13 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.313 -0.408 19880
3144 1 13 . 1 1 30 30 VAL H H 30 8.026 8.026 7.640 0.386 19880
3145 1 13 . 1 1 31 31 GLY N N 31 109.481 109.481 107.160 2.321 19880
3146 1 13 . 1 1 31 31 GLY CA C 31 44.366 44.366 44.873 -0.507 19880
3147 1 13 . 1 1 31 31 GLY H H 31 7.511 7.511 7.544 -0.033 19880
3148 1 13 . 1 1 32 32 CYS N N 32 121.673 121.673 120.668 1.005 19880
3149 1 13 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.141 -0.195 19880
3150 1 13 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.927 -4.746 19880
3151 1 13 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.635 14.661 19880
3152 1 13 . 1 1 32 32 CYS H H 32 8.554 8.554 8.586 -0.032 19880
3153 1 13 . 1 1 33 33 VAL N N 33 119.401 119.401 118.315 1.086 19880
3154 1 13 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.822 -0.027 19880
3155 1 13 . 1 1 33 33 VAL CA C 33 59.311 59.311 60.179 -0.868 19880
3156 1 13 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.614 0.866 19880
3157 1 13 . 1 1 33 33 VAL H H 33 9.025 9.025 9.021 0.004 19880
3158 1 13 . 1 1 34 34 ARG N N 34 120.394 120.394 116.513 3.881 19880
3159 1 13 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.975 -0.276 19880
3160 1 13 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.014 1.178 19880
3161 1 13 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.162 -0.024 19880
3162 1 13 . 1 1 34 34 ARG H H 34 8.350 8.350 8.815 -0.465 19880
3163 1 13 . 1 1 35 35 CYS N N 35 118.098 118.098 119.543 -1.445 19880
3164 1 13 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.505 0.546 19880
3165 1 13 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.553 -2.276 19880
3166 1 13 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.530 13.023 19880
3167 1 13 . 1 1 35 35 CYS H H 35 8.567 8.567 9.065 -0.498 19880
3168 1 13 . 1 1 36 36 SER N N 36 114.009 114.009 115.755 -1.746 19880
3169 1 13 . 1 1 36 36 SER HA H 36 4.326 4.326 4.541 -0.215 19880
3170 1 13 . 1 1 36 36 SER CA C 36 60.945 60.945 59.598 1.347 19880
3171 1 13 . 1 1 36 36 SER CB C 36 64.743 64.743 63.888 0.855 19880
3172 1 13 . 1 1 36 36 SER H H 36 7.669 7.669 8.368 -0.699 19880
3173 1 13 . 1 1 37 37 ASN N N 37 117.050 117.050 115.905 1.145 19880
3174 1 13 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.902 -0.494 19880
3175 1 13 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.377 -0.291 19880
3176 1 13 . 1 1 37 37 ASN CB C 37 41.374 41.374 41.148 0.226 19880
3177 1 13 . 1 1 37 37 ASN H H 37 7.755 7.755 7.478 0.277 19880
3178 1 13 . 1 1 38 38 ALA N N 38 123.735 123.735 120.267 3.468 19880
3179 1 13 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.923 0.239 19880
3180 1 13 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.542 0.592 19880
3181 1 13 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.026 -2.833 19880
3182 1 13 . 1 1 38 38 ALA H H 38 9.323 9.323 8.292 1.031 19880
3183 1 13 . 1 1 39 39 GLN N N 39 116.531 116.531 116.432 0.099 19880
3184 1 13 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.795 -0.482 19880
3185 1 13 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.265 0.484 19880
3186 1 13 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.262 1.555 19880
3187 1 13 . 1 1 39 39 GLN H H 39 8.746 8.746 8.814 -0.068 19880
3188 1 13 . 1 1 40 40 CYS N N 40 122.074 122.074 120.479 1.595 19880
3189 1 13 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.429 0.120 19880
3190 1 13 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.866 -3.453 19880
3191 1 13 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.591 13.311 19880
3192 1 13 . 1 1 40 40 CYS H H 40 8.536 8.536 8.702 -0.166 19880
3193 1 13 . 1 1 41 41 THR N N 41 117.753 117.753 116.159 1.594 19880
3194 1 13 . 1 1 41 41 THR HA H 41 4.641 4.641 4.590 0.051 19880
3195 1 13 . 1 1 41 41 THR CA C 41 60.550 60.550 60.173 0.377 19880
3196 1 13 . 1 1 41 41 THR CB C 41 71.033 71.033 71.135 -0.102 19880
3197 1 13 . 1 1 41 41 THR H H 41 9.779 9.779 9.012 0.767 19880
3198 1 13 . 1 1 42 42 GLY N N 42 105.809 105.809 108.201 -2.392 19880
3199 1 13 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.797 -0.782 19880
3200 1 13 . 1 1 42 42 GLY H H 42 8.247 8.247 8.230 0.017 19880
3201 1 13 . 1 1 43 43 PHE N N 43 123.293 123.293 121.111 2.182 19880
3202 1 13 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.424 -0.126 19880
3203 1 13 . 1 1 43 43 PHE CA C 43 60.196 60.196 57.412 2.784 19880
3204 1 13 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.554 -0.904 19880
3205 1 13 . 1 1 43 43 PHE H H 43 8.707 8.707 8.612 0.095 19880
3206 1 13 . 1 1 44 44 LEU N N 44 120.771 120.771 125.927 -5.156 19880
3207 1 13 . 1 1 44 44 LEU HA H 44 3.848 3.848 3.648 0.200 19880
3208 1 13 . 1 1 44 44 LEU CB C 44 40.386 40.386 41.062 -0.676 19880
3209 1 13 . 1 1 44 44 LEU H H 44 8.645 8.645 8.153 0.492 19880
3210 1 13 . 1 1 45 45 GLY N N 45 107.545 107.545 104.913 2.632 19880
3211 1 13 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.929 1.382 19880
3212 1 13 . 1 1 45 45 GLY H H 45 7.831 7.831 7.787 0.044 19880
3213 1 13 . 1 1 46 46 THR N N 46 104.485 104.485 111.075 -6.590 19880
3214 1 13 . 1 1 46 46 THR HA H 46 3.901 3.901 4.141 -0.240 19880
3215 1 13 . 1 1 46 46 THR CA C 46 62.180 62.180 63.305 -1.125 19880
3216 1 13 . 1 1 46 46 THR CB C 46 70.021 70.021 69.232 0.789 19880
3217 1 13 . 1 1 46 46 THR H H 46 6.823 6.823 8.118 -1.295 19880
3218 1 13 . 1 1 47 47 THR N N 47 123.300 123.300 116.785 6.515 19880
3219 1 13 . 1 1 47 47 THR HA H 47 4.371 4.371 5.145 -0.774 19880
3220 1 13 . 1 1 47 47 THR CA C 47 62.843 62.843 60.773 2.070 19880
3221 1 13 . 1 1 47 47 THR CB C 47 70.176 70.176 72.530 -2.354 19880
3222 1 13 . 1 1 47 47 THR H H 47 8.763 8.763 7.686 1.077 19880
3223 1 13 . 1 1 48 48 CYS N N 48 128.024 128.024 123.928 4.096 19880
3224 1 13 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.916 0.057 19880
3225 1 13 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.313 -1.329 19880
3226 1 13 . 1 1 48 48 CYS CB C 48 36.282 36.282 28.254 8.028 19880
3227 1 13 . 1 1 48 48 CYS H H 48 9.276 9.276 8.489 0.787 19880
3228 1 13 . 1 1 49 49 THR N N 49 131.810 131.810 120.986 10.824 19880
3229 1 13 . 1 1 49 49 THR HA H 49 4.364 4.364 4.667 -0.303 19880
3230 1 13 . 1 1 49 49 THR CA C 49 61.871 61.871 61.618 0.253 19880
3231 1 13 . 1 1 49 49 THR CB C 49 69.789 69.789 72.897 -3.108 19880
3232 1 13 . 1 1 49 49 THR H H 49 9.194 9.194 8.927 0.267 19880
3233 1 13 . 1 1 50 50 CYS N N 50 123.835 123.835 121.633 2.202 19880
3234 1 13 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.127 -0.092 19880
3235 1 13 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.250 -6.370 19880
3236 1 13 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.757 5.177 19880
3237 1 13 . 1 1 50 50 CYS H H 50 8.879 8.879 8.596 0.283 19880
3238 1 13 . 1 1 51 51 ILE N N 51 123.986 123.986 122.801 1.185 19880
3239 1 13 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.428 -0.285 19880
3240 1 13 . 1 1 51 51 ILE CA C 51 59.619 59.619 58.960 0.659 19880
3241 1 13 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.975 -0.595 19880
3242 1 13 . 1 1 51 51 ILE H H 51 8.098 8.098 8.924 -0.826 19880
3243 1 13 . 1 1 52 52 ASN N N 52 126.122 126.122 124.672 1.450 19880
3244 1 13 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.776 -0.060 19880
3245 1 13 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.903 0.988 19880
3246 1 13 . 1 1 52 52 ASN CB C 52 37.913 37.913 37.896 0.017 19880
3247 1 13 . 1 1 52 52 ASN H H 52 8.323 8.323 8.598 -0.275 19880
3248 1 13 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.503 -0.196 19880
3249 1 13 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.408 0.625 19880
3250 1 13 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.702 3.158 19880
3251 1 13 . 1 1 54 54 CYS N N 54 123.090 123.090 117.604 5.486 19880
3252 1 13 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.105 0.631 19880
3253 1 13 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.878 -2.728 19880
3254 1 13 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.827 19.327 19880
3255 1 13 . 1 1 54 54 CYS H H 54 8.865 8.865 8.473 0.392 19880
3256 1 13 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.493 -0.207 19880
3257 1 13 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.667 -0.409 19880
3258 1 13 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.352 0.097 19880
3259 1 13 . 1 1 56 56 ARG N N 56 117.289 117.289 117.083 0.206 19880
3260 1 13 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.550 -0.065 19880
3261 1 13 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.637 -0.516 19880
3262 1 13 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.289 -0.750 19880
3263 1 13 . 1 1 56 56 ARG H H 56 7.902 7.902 8.481 -0.579 19880
3264 1 14 . 1 1 3 3 CYS N N 3 117.561 117.561 116.959 0.602 19880
3265 1 14 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.343 -0.523 19880
3266 1 14 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.463 -2.763 19880
3267 1 14 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.805 19.846 19880
3268 1 14 . 1 1 3 3 CYS H H 3 7.950 7.950 7.992 -0.042 19880
3269 1 14 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.582 -0.077 19880
3270 1 14 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.727 1.003 19880
3271 1 14 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.988 0.311 19880
3272 1 14 . 1 1 5 5 THR N N 5 118.207 118.207 116.268 1.939 19880
3273 1 14 . 1 1 5 5 THR HA H 5 4.814 4.814 4.674 0.140 19880
3274 1 14 . 1 1 5 5 THR CA C 5 61.618 61.618 61.986 -0.368 19880
3275 1 14 . 1 1 5 5 THR CB C 5 70.257 70.257 69.608 0.649 19880
3276 1 14 . 1 1 5 5 THR H H 5 8.529 8.529 8.356 0.173 19880
3277 1 14 . 1 1 6 6 ARG N N 6 123.211 123.211 126.029 -2.818 19880
3278 1 14 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.613 -0.085 19880
3279 1 14 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.102 -0.171 19880
3280 1 14 . 1 1 6 6 ARG CB C 6 32.752 32.752 33.140 -0.388 19880
3281 1 14 . 1 1 6 6 ARG H H 6 7.693 7.693 8.514 -0.821 19880
3282 1 14 . 1 1 7 7 ARG N N 7 121.558 121.558 123.017 -1.459 19880
3283 1 14 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.578 0.088 19880
3284 1 14 . 1 1 7 7 ARG CA C 7 54.415 54.415 54.294 0.121 19880
3285 1 14 . 1 1 7 7 ARG CB C 7 32.673 32.673 33.047 -0.374 19880
3286 1 14 . 1 1 7 7 ARG H H 7 8.450 8.450 8.025 0.425 19880
3287 1 14 . 1 1 8 8 GLY N N 8 111.006 111.006 108.821 2.185 19880
3288 1 14 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.575 1.078 19880
3289 1 14 . 1 1 8 8 GLY H H 8 9.382 9.382 8.619 0.763 19880
3290 1 14 . 1 1 9 9 LEU N N 9 119.202 119.202 120.439 -1.237 19880
3291 1 14 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.013 -0.123 19880
3292 1 14 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.129 1.625 19880
3293 1 14 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.522 1.248 19880
3294 1 14 . 1 1 9 9 LEU H H 9 8.215 8.215 7.907 0.308 19880
3295 1 14 . 1 1 10 10 CYS N N 10 115.050 115.050 115.581 -0.531 19880
3296 1 14 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.243 -0.353 19880
3297 1 14 . 1 1 10 10 CYS CA C 10 61.378 61.378 60.401 0.977 19880
3298 1 14 . 1 1 10 10 CYS CB C 10 42.589 42.589 24.775 17.814 19880
3299 1 14 . 1 1 10 10 CYS H H 10 9.282 9.282 8.398 0.884 19880
3300 1 14 . 1 1 11 11 VAL N N 11 117.792 117.792 119.649 -1.857 19880
3301 1 14 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.128 -0.357 19880
3302 1 14 . 1 1 11 11 VAL CA C 11 64.508 64.508 63.929 0.579 19880
3303 1 14 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.677 -0.079 19880
3304 1 14 . 1 1 11 11 VAL H H 11 7.315 7.315 8.149 -0.834 19880
3305 1 14 . 1 1 12 12 THR N N 12 109.816 109.816 111.644 -1.828 19880
3306 1 14 . 1 1 12 12 THR HA H 12 4.044 4.044 4.395 -0.351 19880
3307 1 14 . 1 1 12 12 THR CA C 12 63.575 63.575 63.916 -0.341 19880
3308 1 14 . 1 1 12 12 THR CB C 12 69.400 69.400 69.478 -0.078 19880
3309 1 14 . 1 1 12 12 THR H H 12 8.214 8.214 7.880 0.334 19880
3310 1 14 . 1 1 13 13 SER N N 13 114.455 114.455 115.699 -1.244 19880
3311 1 14 . 1 1 13 13 SER HA H 13 4.607 4.607 4.642 -0.035 19880
3312 1 14 . 1 1 13 13 SER CA C 13 59.460 59.460 58.354 1.106 19880
3313 1 14 . 1 1 13 13 SER CB C 13 64.586 64.586 66.094 -1.508 19880
3314 1 14 . 1 1 13 13 SER H H 13 7.511 7.511 7.734 -0.223 19880
3315 1 14 . 1 1 14 14 GLY N N 14 109.125 109.125 109.138 -0.013 19880
3316 1 14 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.535 -0.211 19880
3317 1 14 . 1 1 14 14 GLY H H 14 8.376 8.376 8.046 0.330 19880
3318 1 14 . 1 1 15 15 LEU N N 15 120.782 120.782 121.003 -0.221 19880
3319 1 14 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.174 -0.238 19880
3320 1 14 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.113 0.873 19880
3321 1 14 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.005 -0.479 19880
3322 1 14 . 1 1 15 15 LEU H H 15 8.469 8.469 8.656 -0.187 19880
3323 1 14 . 1 1 16 16 THR N N 16 115.887 115.887 114.040 1.847 19880
3324 1 14 . 1 1 16 16 THR HA H 16 3.602 3.602 3.956 -0.354 19880
3325 1 14 . 1 1 16 16 THR CA C 16 67.196 67.196 66.284 0.912 19880
3326 1 14 . 1 1 16 16 THR CB C 16 68.003 68.003 68.098 -0.095 19880
3327 1 14 . 1 1 16 16 THR H H 16 8.487 8.487 8.269 0.218 19880
3328 1 14 . 1 1 17 17 ALA N N 17 122.643 122.643 123.420 -0.777 19880
3329 1 14 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.303 -0.289 19880
3330 1 14 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.709 0.132 19880
3331 1 14 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.089 0.842 19880
3332 1 14 . 1 1 17 17 ALA H H 17 7.609 7.609 7.694 -0.085 19880
3333 1 14 . 1 1 18 18 CYS N N 18 118.252 118.252 118.487 -0.235 19880
3334 1 14 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.245 0.008 19880
3335 1 14 . 1 1 18 18 CYS CA C 18 58.453 58.453 61.218 -2.765 19880
3336 1 14 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.614 12.032 19880
3337 1 14 . 1 1 18 18 CYS H H 18 7.644 7.644 7.774 -0.130 19880
3338 1 14 . 1 1 19 19 ARG N N 19 120.422 120.422 120.632 -0.210 19880
3339 1 14 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.018 -0.543 19880
3340 1 14 . 1 1 19 19 ARG CA C 19 60.552 60.552 60.012 0.540 19880
3341 1 14 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.165 -0.364 19880
3342 1 14 . 1 1 19 19 ARG H H 19 9.072 9.072 8.605 0.467 19880
3343 1 14 . 1 1 20 20 ASN N N 20 117.466 117.466 116.614 0.852 19880
3344 1 14 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.592 -0.380 19880
3345 1 14 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.628 -0.017 19880
3346 1 14 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.077 -0.822 19880
3347 1 14 . 1 1 20 20 ASN H H 20 8.411 8.411 7.981 0.430 19880
3348 1 14 . 1 1 21 21 HIS N N 21 120.420 120.420 120.796 -0.376 19880
3349 1 14 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.488 -0.314 19880
3350 1 14 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.667 -0.513 19880
3351 1 14 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.007 1.581 19880
3352 1 14 . 1 1 21 21 HIS H H 21 7.827 7.827 7.733 0.094 19880
3353 1 14 . 1 1 22 22 CYS N N 22 117.510 117.510 118.174 -0.664 19880
3354 1 14 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.240 -1.081 19880
3355 1 14 . 1 1 22 22 CYS CA C 22 58.221 58.221 62.385 -4.164 19880
3356 1 14 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.096 11.082 19880
3357 1 14 . 1 1 22 22 CYS H H 22 8.500 8.500 8.649 -0.149 19880
3358 1 14 . 1 1 23 23 ARG N N 23 116.564 116.564 118.618 -2.054 19880
3359 1 14 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.689 -0.036 19880
3360 1 14 . 1 1 23 23 ARG CA C 23 57.028 57.028 57.687 -0.659 19880
3361 1 14 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.757 -0.102 19880
3362 1 14 . 1 1 23 23 ARG H H 23 7.985 7.985 8.123 -0.138 19880
3363 1 14 . 1 1 24 24 SER N N 24 116.727 116.727 113.422 3.305 19880
3364 1 14 . 1 1 24 24 SER HA H 24 4.552 4.552 4.649 -0.097 19880
3365 1 14 . 1 1 24 24 SER CA C 24 57.592 57.592 56.462 1.129 19880
3366 1 14 . 1 1 24 24 SER CB C 24 65.284 65.284 64.917 0.367 19880
3367 1 14 . 1 1 24 24 SER H H 24 7.435 7.435 7.395 0.040 19880
3368 1 14 . 1 1 25 25 CYS N N 25 121.909 121.909 121.498 0.411 19880
3369 1 14 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.714 -0.078 19880
3370 1 14 . 1 1 25 25 CYS CA C 25 56.614 56.614 57.908 -1.294 19880
3371 1 14 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.490 12.783 19880
3372 1 14 . 1 1 25 25 CYS H H 25 9.000 9.000 8.735 0.265 19880
3373 1 14 . 1 1 26 26 HIS N N 26 126.609 126.609 123.727 2.882 19880
3374 1 14 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.238 -0.286 19880
3375 1 14 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.403 0.319 19880
3376 1 14 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.654 0.446 19880
3377 1 14 . 1 1 26 26 HIS H H 26 9.255 9.255 8.763 0.492 19880
3378 1 14 . 1 1 27 27 ARG N N 27 122.033 122.033 121.511 0.522 19880
3379 1 14 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.341 -0.319 19880
3380 1 14 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.268 2.209 19880
3381 1 14 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.242 -0.362 19880
3382 1 14 . 1 1 27 27 ARG H H 27 8.314 8.314 8.200 0.114 19880
3383 1 14 . 1 1 28 28 GLY N N 28 119.213 119.213 114.509 4.704 19880
3384 1 14 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.625 -0.653 19880
3385 1 14 . 1 1 28 28 GLY H H 28 8.495 8.495 8.139 0.356 19880
3386 1 14 . 1 1 29 29 ASP N N 29 121.258 121.258 118.237 3.021 19880
3387 1 14 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.615 -0.351 19880
3388 1 14 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.447 1.999 19880
3389 1 14 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.109 -0.671 19880
3390 1 14 . 1 1 29 29 ASP H H 29 8.646 8.646 8.259 0.387 19880
3391 1 14 . 1 1 30 30 VAL N N 30 112.703 112.703 117.676 -4.973 19880
3392 1 14 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.416 -0.193 19880
3393 1 14 . 1 1 30 30 VAL CA C 30 61.407 61.407 62.300 -0.893 19880
3394 1 14 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.274 -0.369 19880
3395 1 14 . 1 1 30 30 VAL H H 30 8.026 8.026 7.712 0.314 19880
3396 1 14 . 1 1 31 31 GLY N N 31 109.481 109.481 108.050 1.431 19880
3397 1 14 . 1 1 31 31 GLY CA C 31 44.366 44.366 45.434 -1.068 19880
3398 1 14 . 1 1 31 31 GLY H H 31 7.511 7.511 7.756 -0.245 19880
3399 1 14 . 1 1 32 32 CYS N N 32 121.673 121.673 120.902 0.771 19880
3400 1 14 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.248 -0.302 19880
3401 1 14 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.713 -4.532 19880
3402 1 14 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.552 14.744 19880
3403 1 14 . 1 1 32 32 CYS H H 32 8.554 8.554 8.570 -0.016 19880
3404 1 14 . 1 1 33 33 VAL N N 33 119.401 119.401 119.188 0.213 19880
3405 1 14 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.784 0.011 19880
3406 1 14 . 1 1 33 33 VAL CA C 33 59.311 59.311 60.242 -0.931 19880
3407 1 14 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.576 0.904 19880
3408 1 14 . 1 1 33 33 VAL H H 33 9.025 9.025 8.815 0.210 19880
3409 1 14 . 1 1 34 34 ARG N N 34 120.394 120.394 116.743 3.651 19880
3410 1 14 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.932 -0.233 19880
3411 1 14 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.126 1.066 19880
3412 1 14 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.531 -0.393 19880
3413 1 14 . 1 1 34 34 ARG H H 34 8.350 8.350 8.737 -0.387 19880
3414 1 14 . 1 1 35 35 CYS N N 35 118.098 118.098 119.023 -0.925 19880
3415 1 14 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.540 0.511 19880
3416 1 14 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.497 -2.220 19880
3417 1 14 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.482 13.072 19880
3418 1 14 . 1 1 35 35 CYS H H 35 8.567 8.567 9.233 -0.666 19880
3419 1 14 . 1 1 36 36 SER N N 36 114.009 114.009 115.364 -1.355 19880
3420 1 14 . 1 1 36 36 SER HA H 36 4.326 4.326 4.467 -0.141 19880
3421 1 14 . 1 1 36 36 SER CA C 36 60.945 60.945 59.839 1.106 19880
3422 1 14 . 1 1 36 36 SER CB C 36 64.743 64.743 63.864 0.879 19880
3423 1 14 . 1 1 36 36 SER H H 36 7.669 7.669 8.382 -0.713 19880
3424 1 14 . 1 1 37 37 ASN N N 37 117.050 117.050 116.039 1.011 19880
3425 1 14 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.904 -0.496 19880
3426 1 14 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.396 -0.310 19880
3427 1 14 . 1 1 37 37 ASN CB C 37 41.374 41.374 41.148 0.227 19880
3428 1 14 . 1 1 37 37 ASN H H 37 7.755 7.755 7.467 0.288 19880
3429 1 14 . 1 1 38 38 ALA N N 38 123.735 123.735 120.403 3.332 19880
3430 1 14 . 1 1 38 38 ALA HA H 38 5.162 5.162 5.041 0.121 19880
3431 1 14 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.556 0.578 19880
3432 1 14 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.053 -2.860 19880
3433 1 14 . 1 1 38 38 ALA H H 38 9.323 9.323 8.292 1.031 19880
3434 1 14 . 1 1 39 39 GLN N N 39 116.531 116.531 116.857 -0.326 19880
3435 1 14 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.811 -0.498 19880
3436 1 14 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.135 0.614 19880
3437 1 14 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.447 1.370 19880
3438 1 14 . 1 1 39 39 GLN H H 39 8.746 8.746 8.839 -0.093 19880
3439 1 14 . 1 1 40 40 CYS N N 40 122.074 122.074 120.951 1.123 19880
3440 1 14 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.092 0.457 19880
3441 1 14 . 1 1 40 40 CYS CA C 40 54.413 54.413 58.123 -3.710 19880
3442 1 14 . 1 1 40 40 CYS CB C 40 40.902 40.902 26.822 14.080 19880
3443 1 14 . 1 1 40 40 CYS H H 40 8.536 8.536 8.752 -0.216 19880
3444 1 14 . 1 1 41 41 THR N N 41 117.753 117.753 116.415 1.338 19880
3445 1 14 . 1 1 41 41 THR HA H 41 4.641 4.641 4.603 0.038 19880
3446 1 14 . 1 1 41 41 THR CA C 41 60.550 60.550 60.155 0.395 19880
3447 1 14 . 1 1 41 41 THR CB C 41 71.033 71.033 71.169 -0.136 19880
3448 1 14 . 1 1 41 41 THR H H 41 9.779 9.779 8.934 0.845 19880
3449 1 14 . 1 1 42 42 GLY N N 42 105.809 105.809 108.230 -2.421 19880
3450 1 14 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.896 -0.881 19880
3451 1 14 . 1 1 42 42 GLY H H 42 8.247 8.247 8.165 0.082 19880
3452 1 14 . 1 1 43 43 PHE N N 43 123.293 123.293 120.663 2.630 19880
3453 1 14 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.606 -0.308 19880
3454 1 14 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.341 0.855 19880
3455 1 14 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.535 -0.885 19880
3456 1 14 . 1 1 43 43 PHE H H 43 8.707 8.707 8.882 -0.175 19880
3457 1 14 . 1 1 44 44 LEU N N 44 120.771 120.771 117.744 3.027 19880
3458 1 14 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.352 -0.504 19880
3459 1 14 . 1 1 44 44 LEU CB C 44 40.386 40.386 42.971 -2.585 19880
3460 1 14 . 1 1 44 44 LEU H H 44 8.645 8.645 7.722 0.923 19880
3461 1 14 . 1 1 45 45 GLY N N 45 107.545 107.545 108.192 -0.647 19880
3462 1 14 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.932 1.379 19880
3463 1 14 . 1 1 45 45 GLY H H 45 7.831 7.831 7.628 0.203 19880
3464 1 14 . 1 1 46 46 THR N N 46 104.485 104.485 109.845 -5.360 19880
3465 1 14 . 1 1 46 46 THR HA H 46 3.901 3.901 4.130 -0.229 19880
3466 1 14 . 1 1 46 46 THR CA C 46 62.180 62.180 63.552 -1.372 19880
3467 1 14 . 1 1 46 46 THR CB C 46 70.021 70.021 69.276 0.745 19880
3468 1 14 . 1 1 46 46 THR H H 46 6.823 6.823 7.925 -1.102 19880
3469 1 14 . 1 1 47 47 THR N N 47 123.300 123.300 115.763 7.537 19880
3470 1 14 . 1 1 47 47 THR HA H 47 4.371 4.371 4.582 -0.211 19880
3471 1 14 . 1 1 47 47 THR CA C 47 62.843 62.843 60.567 2.276 19880
3472 1 14 . 1 1 47 47 THR CB C 47 70.176 70.176 72.376 -2.200 19880
3473 1 14 . 1 1 47 47 THR H H 47 8.763 8.763 7.569 1.194 19880
3474 1 14 . 1 1 48 48 CYS N N 48 128.024 128.024 121.170 6.854 19880
3475 1 14 . 1 1 48 48 CYS HA H 48 4.973 4.973 5.230 -0.257 19880
3476 1 14 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.175 -1.191 19880
3477 1 14 . 1 1 48 48 CYS CB C 48 36.282 36.282 30.582 5.700 19880
3478 1 14 . 1 1 48 48 CYS H H 48 9.276 9.276 8.719 0.557 19880
3479 1 14 . 1 1 49 49 THR N N 49 131.810 131.810 118.784 13.026 19880
3480 1 14 . 1 1 49 49 THR HA H 49 4.364 4.364 4.658 -0.294 19880
3481 1 14 . 1 1 49 49 THR CA C 49 61.871 61.871 61.551 0.320 19880
3482 1 14 . 1 1 49 49 THR CB C 49 69.789 69.789 72.224 -2.435 19880
3483 1 14 . 1 1 49 49 THR H H 49 9.194 9.194 8.944 0.250 19880
3484 1 14 . 1 1 50 50 CYS N N 50 123.835 123.835 123.535 0.300 19880
3485 1 14 . 1 1 50 50 CYS HA H 50 5.035 5.035 4.910 0.125 19880
3486 1 14 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.585 -6.705 19880
3487 1 14 . 1 1 50 50 CYS CB C 50 34.934 34.934 28.403 6.531 19880
3488 1 14 . 1 1 50 50 CYS H H 50 8.879 8.879 8.696 0.183 19880
3489 1 14 . 1 1 51 51 ILE N N 51 123.986 123.986 122.281 1.705 19880
3490 1 14 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.365 -0.222 19880
3491 1 14 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.113 0.506 19880
3492 1 14 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.497 -0.117 19880
3493 1 14 . 1 1 51 51 ILE H H 51 8.098 8.098 8.894 -0.796 19880
3494 1 14 . 1 1 52 52 ASN N N 52 126.122 126.122 126.447 -0.325 19880
3495 1 14 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.829 -0.113 19880
3496 1 14 . 1 1 52 52 ASN CA C 52 52.891 52.891 52.947 -0.056 19880
3497 1 14 . 1 1 52 52 ASN CB C 52 37.913 37.913 38.409 -0.496 19880
3498 1 14 . 1 1 52 52 ASN H H 52 8.323 8.323 8.626 -0.303 19880
3499 1 14 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.511 -0.204 19880
3500 1 14 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.392 0.641 19880
3501 1 14 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.820 3.040 19880
3502 1 14 . 1 1 54 54 CYS N N 54 123.090 123.090 117.515 5.575 19880
3503 1 14 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.105 0.631 19880
3504 1 14 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.872 -2.722 19880
3505 1 14 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.791 19.363 19880
3506 1 14 . 1 1 54 54 CYS H H 54 8.865 8.865 8.470 0.395 19880
3507 1 14 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.500 -0.214 19880
3508 1 14 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.623 -0.365 19880
3509 1 14 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.345 0.105 19880
3510 1 14 . 1 1 56 56 ARG N N 56 117.289 117.289 117.730 -0.441 19880
3511 1 14 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.466 0.019 19880
3512 1 14 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.647 -0.526 19880
3513 1 14 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.325 -0.786 19880
3514 1 14 . 1 1 56 56 ARG H H 56 7.902 7.902 8.388 -0.486 19880
3515 1 15 . 1 1 3 3 CYS N N 3 117.561 117.561 117.066 0.495 19880
3516 1 15 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.339 -0.519 19880
3517 1 15 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.182 -2.482 19880
3518 1 15 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.588 20.062 19880
3519 1 15 . 1 1 3 3 CYS H H 3 7.950 7.950 8.087 -0.137 19880
3520 1 15 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.622 -0.117 19880
3521 1 15 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.809 0.921 19880
3522 1 15 . 1 1 4 4 PRO CB C 4 33.299 33.299 33.350 -0.051 19880
3523 1 15 . 1 1 5 5 THR N N 5 118.207 118.207 115.150 3.057 19880
3524 1 15 . 1 1 5 5 THR HA H 5 4.814 4.814 4.639 0.175 19880
3525 1 15 . 1 1 5 5 THR CA C 5 61.618 61.618 61.666 -0.049 19880
3526 1 15 . 1 1 5 5 THR CB C 5 70.257 70.257 70.047 0.210 19880
3527 1 15 . 1 1 5 5 THR H H 5 8.529 8.529 8.329 0.200 19880
3528 1 15 . 1 1 6 6 ARG N N 6 123.211 123.211 124.808 -1.597 19880
3529 1 15 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.707 -0.179 19880
3530 1 15 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.070 -0.139 19880
3531 1 15 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.880 -0.128 19880
3532 1 15 . 1 1 6 6 ARG H H 6 7.693 7.693 8.781 -1.088 19880
3533 1 15 . 1 1 7 7 ARG N N 7 121.558 121.558 121.511 0.047 19880
3534 1 15 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.549 0.117 19880
3535 1 15 . 1 1 7 7 ARG CA C 7 54.415 54.415 54.586 -0.171 19880
3536 1 15 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.961 -0.288 19880
3537 1 15 . 1 1 7 7 ARG H H 7 8.450 8.450 8.131 0.319 19880
3538 1 15 . 1 1 8 8 GLY N N 8 111.006 111.006 108.377 2.629 19880
3539 1 15 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.911 0.742 19880
3540 1 15 . 1 1 8 8 GLY H H 8 9.382 9.382 8.692 0.690 19880
3541 1 15 . 1 1 9 9 LEU N N 9 119.202 119.202 120.023 -0.821 19880
3542 1 15 . 1 1 9 9 LEU HA H 9 3.890 3.890 3.996 -0.106 19880
3543 1 15 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.528 1.226 19880
3544 1 15 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.352 1.418 19880
3545 1 15 . 1 1 9 9 LEU H H 9 8.215 8.215 8.016 0.199 19880
3546 1 15 . 1 1 10 10 CYS N N 10 115.050 115.050 116.607 -1.557 19880
3547 1 15 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.351 -0.461 19880
3548 1 15 . 1 1 10 10 CYS CA C 10 61.378 61.378 60.862 0.516 19880
3549 1 15 . 1 1 10 10 CYS CB C 10 42.589 42.589 25.431 17.158 19880
3550 1 15 . 1 1 10 10 CYS H H 10 9.282 9.282 8.422 0.860 19880
3551 1 15 . 1 1 11 11 VAL N N 11 117.792 117.792 119.919 -2.127 19880
3552 1 15 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.139 -0.368 19880
3553 1 15 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.345 0.163 19880
3554 1 15 . 1 1 11 11 VAL CB C 11 32.598 32.598 33.144 -0.546 19880
3555 1 15 . 1 1 11 11 VAL H H 11 7.315 7.315 8.357 -1.042 19880
3556 1 15 . 1 1 12 12 THR N N 12 109.816 109.816 111.809 -1.993 19880
3557 1 15 . 1 1 12 12 THR HA H 12 4.044 4.044 4.382 -0.338 19880
3558 1 15 . 1 1 12 12 THR CA C 12 63.575 63.575 64.376 -0.802 19880
3559 1 15 . 1 1 12 12 THR CB C 12 69.400 69.400 69.466 -0.066 19880
3560 1 15 . 1 1 12 12 THR H H 12 8.214 8.214 7.941 0.273 19880
3561 1 15 . 1 1 13 13 SER N N 13 114.455 114.455 114.773 -0.318 19880
3562 1 15 . 1 1 13 13 SER HA H 13 4.607 4.607 4.628 -0.021 19880
3563 1 15 . 1 1 13 13 SER CA C 13 59.460 59.460 58.539 0.921 19880
3564 1 15 . 1 1 13 13 SER CB C 13 64.586 64.586 65.450 -0.864 19880
3565 1 15 . 1 1 13 13 SER H H 13 7.511 7.511 7.682 -0.171 19880
3566 1 15 . 1 1 14 14 GLY N N 14 109.125 109.125 109.527 -0.402 19880
3567 1 15 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.504 -0.180 19880
3568 1 15 . 1 1 14 14 GLY H H 14 8.376 8.376 8.035 0.341 19880
3569 1 15 . 1 1 15 15 LEU N N 15 120.782 120.782 121.685 -0.903 19880
3570 1 15 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.169 -0.233 19880
3571 1 15 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.436 0.550 19880
3572 1 15 . 1 1 15 15 LEU CB C 15 41.526 41.526 41.952 -0.426 19880
3573 1 15 . 1 1 15 15 LEU H H 15 8.469 8.469 8.739 -0.270 19880
3574 1 15 . 1 1 16 16 THR N N 16 115.887 115.887 114.300 1.587 19880
3575 1 15 . 1 1 16 16 THR HA H 16 3.602 3.602 3.948 -0.346 19880
3576 1 15 . 1 1 16 16 THR CA C 16 67.196 67.196 67.056 0.140 19880
3577 1 15 . 1 1 16 16 THR CB C 16 68.003 68.003 68.005 -0.002 19880
3578 1 15 . 1 1 16 16 THR H H 16 8.487 8.487 8.231 0.256 19880
3579 1 15 . 1 1 17 17 ALA N N 17 122.643 122.643 123.330 -0.687 19880
3580 1 15 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.360 -0.346 19880
3581 1 15 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.500 0.341 19880
3582 1 15 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.076 0.855 19880
3583 1 15 . 1 1 17 17 ALA H H 17 7.609 7.609 7.693 -0.084 19880
3584 1 15 . 1 1 18 18 CYS N N 18 118.252 118.252 118.587 -0.335 19880
3585 1 15 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.241 0.012 19880
3586 1 15 . 1 1 18 18 CYS CA C 18 58.453 58.453 60.975 -2.522 19880
3587 1 15 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.274 12.372 19880
3588 1 15 . 1 1 18 18 CYS H H 18 7.644 7.644 7.722 -0.078 19880
3589 1 15 . 1 1 19 19 ARG N N 19 120.422 120.422 119.897 0.525 19880
3590 1 15 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.107 -0.632 19880
3591 1 15 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.515 1.037 19880
3592 1 15 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.357 -0.556 19880
3593 1 15 . 1 1 19 19 ARG H H 19 9.072 9.072 8.287 0.785 19880
3594 1 15 . 1 1 20 20 ASN N N 20 117.466 117.466 115.898 1.568 19880
3595 1 15 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.608 -0.396 19880
3596 1 15 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.027 0.584 19880
3597 1 15 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.298 -1.043 19880
3598 1 15 . 1 1 20 20 ASN H H 20 8.411 8.411 7.867 0.544 19880
3599 1 15 . 1 1 21 21 HIS N N 21 120.420 120.420 118.833 1.587 19880
3600 1 15 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.712 -0.538 19880
3601 1 15 . 1 1 21 21 HIS CA C 21 59.154 59.154 58.969 0.185 19880
3602 1 15 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.802 0.786 19880
3603 1 15 . 1 1 21 21 HIS H H 21 7.827 7.827 7.702 0.125 19880
3604 1 15 . 1 1 22 22 CYS N N 22 117.510 117.510 117.328 0.182 19880
3605 1 15 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.355 -1.196 19880
3606 1 15 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.797 -3.575 19880
3607 1 15 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.223 10.955 19880
3608 1 15 . 1 1 22 22 CYS H H 22 8.500 8.500 7.918 0.582 19880
3609 1 15 . 1 1 23 23 ARG N N 23 116.564 116.564 117.030 -0.466 19880
3610 1 15 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.615 0.038 19880
3611 1 15 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.145 0.882 19880
3612 1 15 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.440 0.215 19880
3613 1 15 . 1 1 23 23 ARG H H 23 7.985 7.985 7.576 0.409 19880
3614 1 15 . 1 1 24 24 SER N N 24 116.727 116.727 112.751 3.976 19880
3615 1 15 . 1 1 24 24 SER HA H 24 4.552 4.552 4.616 -0.064 19880
3616 1 15 . 1 1 24 24 SER CA C 24 57.592 57.592 55.931 1.661 19880
3617 1 15 . 1 1 24 24 SER CB C 24 65.284 65.284 66.096 -0.812 19880
3618 1 15 . 1 1 24 24 SER H H 24 7.435 7.435 7.452 -0.017 19880
3619 1 15 . 1 1 25 25 CYS N N 25 121.909 121.909 120.952 0.957 19880
3620 1 15 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.720 -0.084 19880
3621 1 15 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.571 -1.957 19880
3622 1 15 . 1 1 25 25 CYS CB C 25 39.273 39.273 25.992 13.280 19880
3623 1 15 . 1 1 25 25 CYS H H 25 9.000 9.000 8.920 0.080 19880
3624 1 15 . 1 1 26 26 HIS N N 26 126.609 126.609 120.532 6.077 19880
3625 1 15 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.302 -0.350 19880
3626 1 15 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.237 0.485 19880
3627 1 15 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.890 0.210 19880
3628 1 15 . 1 1 26 26 HIS H H 26 9.255 9.255 8.828 0.427 19880
3629 1 15 . 1 1 27 27 ARG N N 27 122.033 122.033 121.185 0.848 19880
3630 1 15 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.327 -0.305 19880
3631 1 15 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.756 1.721 19880
3632 1 15 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.720 -0.840 19880
3633 1 15 . 1 1 27 27 ARG H H 27 8.314 8.314 8.168 0.146 19880
3634 1 15 . 1 1 28 28 GLY N N 28 119.213 119.213 112.864 6.349 19880
3635 1 15 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.637 -0.665 19880
3636 1 15 . 1 1 28 28 GLY H H 28 8.495 8.495 7.844 0.651 19880
3637 1 15 . 1 1 29 29 ASP N N 29 121.258 121.258 117.926 3.332 19880
3638 1 15 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.644 -0.380 19880
3639 1 15 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.083 2.363 19880
3640 1 15 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.436 -0.998 19880
3641 1 15 . 1 1 29 29 ASP H H 29 8.646 8.646 8.438 0.208 19880
3642 1 15 . 1 1 30 30 VAL N N 30 112.703 112.703 116.928 -4.225 19880
3643 1 15 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.557 -0.334 19880
3644 1 15 . 1 1 30 30 VAL CA C 30 61.407 61.407 62.531 -1.124 19880
3645 1 15 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.800 -0.895 19880
3646 1 15 . 1 1 30 30 VAL H H 30 8.026 8.026 7.969 0.057 19880
3647 1 15 . 1 1 31 31 GLY N N 31 109.481 109.481 107.175 2.306 19880
3648 1 15 . 1 1 31 31 GLY CA C 31 44.366 44.366 45.348 -0.982 19880
3649 1 15 . 1 1 31 31 GLY H H 31 7.511 7.511 7.585 -0.074 19880
3650 1 15 . 1 1 32 32 CYS N N 32 121.673 121.673 119.549 2.124 19880
3651 1 15 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.119 -0.173 19880
3652 1 15 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.601 -4.420 19880
3653 1 15 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.660 14.636 19880
3654 1 15 . 1 1 32 32 CYS H H 32 8.554 8.554 8.492 0.062 19880
3655 1 15 . 1 1 33 33 VAL N N 33 119.401 119.401 118.547 0.854 19880
3656 1 15 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.907 -0.112 19880
3657 1 15 . 1 1 33 33 VAL CA C 33 59.311 59.311 60.096 -0.785 19880
3658 1 15 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.691 0.789 19880
3659 1 15 . 1 1 33 33 VAL H H 33 9.025 9.025 8.984 0.041 19880
3660 1 15 . 1 1 34 34 ARG N N 34 120.394 120.394 115.977 4.417 19880
3661 1 15 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.777 -0.078 19880
3662 1 15 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.097 1.095 19880
3663 1 15 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.525 -0.387 19880
3664 1 15 . 1 1 34 34 ARG H H 34 8.350 8.350 8.677 -0.327 19880
3665 1 15 . 1 1 35 35 CYS N N 35 118.098 118.098 118.395 -0.297 19880
3666 1 15 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.432 0.619 19880
3667 1 15 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.374 -2.097 19880
3668 1 15 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.951 12.602 19880
3669 1 15 . 1 1 35 35 CYS H H 35 8.567 8.567 9.035 -0.468 19880
3670 1 15 . 1 1 36 36 SER N N 36 114.009 114.009 115.889 -1.880 19880
3671 1 15 . 1 1 36 36 SER HA H 36 4.326 4.326 4.643 -0.317 19880
3672 1 15 . 1 1 36 36 SER CA C 36 60.945 60.945 60.661 0.284 19880
3673 1 15 . 1 1 36 36 SER CB C 36 64.743 64.743 64.770 -0.027 19880
3674 1 15 . 1 1 36 36 SER H H 36 7.669 7.669 8.573 -0.904 19880
3675 1 15 . 1 1 37 37 ASN N N 37 117.050 117.050 116.165 0.885 19880
3676 1 15 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.858 -0.450 19880
3677 1 15 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.310 -0.224 19880
3678 1 15 . 1 1 37 37 ASN CB C 37 41.374 41.374 40.811 0.563 19880
3679 1 15 . 1 1 37 37 ASN H H 37 7.755 7.755 7.495 0.260 19880
3680 1 15 . 1 1 38 38 ALA N N 38 123.735 123.735 120.352 3.383 19880
3681 1 15 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.941 0.221 19880
3682 1 15 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.489 0.645 19880
3683 1 15 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.036 -2.843 19880
3684 1 15 . 1 1 38 38 ALA H H 38 9.323 9.323 8.311 1.012 19880
3685 1 15 . 1 1 39 39 GLN N N 39 116.531 116.531 116.611 -0.080 19880
3686 1 15 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.737 -0.424 19880
3687 1 15 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.268 0.481 19880
3688 1 15 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.486 1.331 19880
3689 1 15 . 1 1 39 39 GLN H H 39 8.746 8.746 9.018 -0.272 19880
3690 1 15 . 1 1 40 40 CYS N N 40 122.074 122.074 121.455 0.619 19880
3691 1 15 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.374 0.175 19880
3692 1 15 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.458 -3.045 19880
3693 1 15 . 1 1 40 40 CYS CB C 40 40.902 40.902 28.197 12.705 19880
3694 1 15 . 1 1 40 40 CYS H H 40 8.536 8.536 8.644 -0.108 19880
3695 1 15 . 1 1 41 41 THR N N 41 117.753 117.753 120.948 -3.195 19880
3696 1 15 . 1 1 41 41 THR HA H 41 4.641 4.641 4.569 0.072 19880
3697 1 15 . 1 1 41 41 THR CA C 41 60.550 60.550 60.170 0.380 19880
3698 1 15 . 1 1 41 41 THR CB C 41 71.033 71.033 71.102 -0.069 19880
3699 1 15 . 1 1 41 41 THR H H 41 9.779 9.779 8.931 0.848 19880
3700 1 15 . 1 1 42 42 GLY N N 42 105.809 105.809 107.405 -1.596 19880
3701 1 15 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.887 -0.872 19880
3702 1 15 . 1 1 42 42 GLY H H 42 8.247 8.247 8.106 0.141 19880
3703 1 15 . 1 1 43 43 PHE N N 43 123.293 123.293 121.398 1.895 19880
3704 1 15 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.530 -0.232 19880
3705 1 15 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.690 0.506 19880
3706 1 15 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.687 -1.037 19880
3707 1 15 . 1 1 43 43 PHE H H 43 8.707 8.707 9.029 -0.322 19880
3708 1 15 . 1 1 44 44 LEU N N 44 120.771 120.771 119.737 1.034 19880
3709 1 15 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.417 -0.569 19880
3710 1 15 . 1 1 44 44 LEU CB C 44 40.386 40.386 42.973 -2.587 19880
3711 1 15 . 1 1 44 44 LEU H H 44 8.645 8.645 7.619 1.026 19880
3712 1 15 . 1 1 45 45 GLY N N 45 107.545 107.545 108.405 -0.860 19880
3713 1 15 . 1 1 45 45 GLY CA C 45 47.311 47.311 46.179 1.132 19880
3714 1 15 . 1 1 45 45 GLY H H 45 7.831 7.831 7.695 0.136 19880
3715 1 15 . 1 1 46 46 THR N N 46 104.485 104.485 107.753 -3.268 19880
3716 1 15 . 1 1 46 46 THR HA H 46 3.901 3.901 4.321 -0.420 19880
3717 1 15 . 1 1 46 46 THR CA C 46 62.180 62.180 62.058 0.122 19880
3718 1 15 . 1 1 46 46 THR CB C 46 70.021 70.021 69.360 0.661 19880
3719 1 15 . 1 1 46 46 THR H H 46 6.823 6.823 7.798 -0.975 19880
3720 1 15 . 1 1 47 47 THR N N 47 123.300 123.300 118.534 4.766 19880
3721 1 15 . 1 1 47 47 THR HA H 47 4.371 4.371 4.604 -0.233 19880
3722 1 15 . 1 1 47 47 THR CA C 47 62.843 62.843 61.790 1.053 19880
3723 1 15 . 1 1 47 47 THR CB C 47 70.176 70.176 72.664 -2.488 19880
3724 1 15 . 1 1 47 47 THR H H 47 8.763 8.763 7.955 0.808 19880
3725 1 15 . 1 1 48 48 CYS N N 48 128.024 128.024 123.925 4.099 19880
3726 1 15 . 1 1 48 48 CYS HA H 48 4.973 4.973 5.053 -0.080 19880
3727 1 15 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.391 -1.407 19880
3728 1 15 . 1 1 48 48 CYS CB C 48 36.282 36.282 29.470 6.812 19880
3729 1 15 . 1 1 48 48 CYS H H 48 9.276 9.276 8.919 0.357 19880
3730 1 15 . 1 1 49 49 THR N N 49 131.810 131.810 122.114 9.696 19880
3731 1 15 . 1 1 49 49 THR HA H 49 4.364 4.364 4.744 -0.380 19880
3732 1 15 . 1 1 49 49 THR CA C 49 61.871 61.871 62.075 -0.204 19880
3733 1 15 . 1 1 49 49 THR CB C 49 69.789 69.789 72.897 -3.108 19880
3734 1 15 . 1 1 49 49 THR H H 49 9.194 9.194 8.821 0.373 19880
3735 1 15 . 1 1 50 50 CYS N N 50 123.835 123.835 121.968 1.867 19880
3736 1 15 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.126 -0.091 19880
3737 1 15 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.227 -6.347 19880
3738 1 15 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.797 5.137 19880
3739 1 15 . 1 1 50 50 CYS H H 50 8.879 8.879 8.594 0.285 19880
3740 1 15 . 1 1 51 51 ILE N N 51 123.986 123.986 122.652 1.334 19880
3741 1 15 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.432 -0.289 19880
3742 1 15 . 1 1 51 51 ILE CA C 51 59.619 59.619 58.934 0.685 19880
3743 1 15 . 1 1 51 51 ILE CB C 51 39.380 39.380 40.084 -0.704 19880
3744 1 15 . 1 1 51 51 ILE H H 51 8.098 8.098 8.889 -0.791 19880
3745 1 15 . 1 1 52 52 ASN N N 52 126.122 126.122 124.127 1.995 19880
3746 1 15 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.825 -0.109 19880
3747 1 15 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.796 1.095 19880
3748 1 15 . 1 1 52 52 ASN CB C 52 37.913 37.913 38.115 -0.202 19880
3749 1 15 . 1 1 52 52 ASN H H 52 8.323 8.323 8.636 -0.313 19880
3750 1 15 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.589 -0.282 19880
3751 1 15 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.524 0.509 19880
3752 1 15 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.871 2.989 19880
3753 1 15 . 1 1 54 54 CYS N N 54 123.090 123.090 117.951 5.139 19880
3754 1 15 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.096 0.640 19880
3755 1 15 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.817 -2.667 19880
3756 1 15 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.830 19.324 19880
3757 1 15 . 1 1 54 54 CYS H H 54 8.865 8.865 8.472 0.393 19880
3758 1 15 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.456 -0.170 19880
3759 1 15 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.718 -0.460 19880
3760 1 15 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.355 0.095 19880
3761 1 15 . 1 1 56 56 ARG N N 56 117.289 117.289 118.147 -0.858 19880
3762 1 15 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.454 0.031 19880
3763 1 15 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.831 -0.710 19880
3764 1 15 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.211 -0.672 19880
3765 1 15 . 1 1 56 56 ARG H H 56 7.902 7.902 8.417 -0.515 19880
3766 1 16 . 1 1 3 3 CYS N N 3 117.561 117.561 117.259 0.302 19880
3767 1 16 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.300 -0.480 19880
3768 1 16 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.325 -2.625 19880
3769 1 16 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.681 19.970 19880
3770 1 16 . 1 1 3 3 CYS H H 3 7.950 7.950 8.017 -0.067 19880
3771 1 16 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.581 -0.076 19880
3772 1 16 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.805 0.925 19880
3773 1 16 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.937 0.362 19880
3774 1 16 . 1 1 5 5 THR N N 5 118.207 118.207 115.520 2.687 19880
3775 1 16 . 1 1 5 5 THR HA H 5 4.814 4.814 4.723 0.091 19880
3776 1 16 . 1 1 5 5 THR CA C 5 61.618 61.618 62.145 -0.527 19880
3777 1 16 . 1 1 5 5 THR CB C 5 70.257 70.257 69.902 0.355 19880
3778 1 16 . 1 1 5 5 THR H H 5 8.529 8.529 8.384 0.145 19880
3779 1 16 . 1 1 6 6 ARG N N 6 123.211 123.211 125.434 -2.223 19880
3780 1 16 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.704 -0.176 19880
3781 1 16 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.252 -0.320 19880
3782 1 16 . 1 1 6 6 ARG CB C 6 32.752 32.752 33.026 -0.274 19880
3783 1 16 . 1 1 6 6 ARG H H 6 7.693 7.693 8.662 -0.969 19880
3784 1 16 . 1 1 7 7 ARG N N 7 121.558 121.558 121.974 -0.416 19880
3785 1 16 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.599 0.067 19880
3786 1 16 . 1 1 7 7 ARG CA C 7 54.415 54.415 54.616 -0.201 19880
3787 1 16 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.897 -0.224 19880
3788 1 16 . 1 1 7 7 ARG H H 7 8.450 8.450 8.143 0.307 19880
3789 1 16 . 1 1 8 8 GLY N N 8 111.006 111.006 108.270 2.736 19880
3790 1 16 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.804 0.849 19880
3791 1 16 . 1 1 8 8 GLY H H 8 9.382 9.382 8.704 0.678 19880
3792 1 16 . 1 1 9 9 LEU N N 9 119.202 119.202 118.421 0.781 19880
3793 1 16 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.002 -0.112 19880
3794 1 16 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.982 0.772 19880
3795 1 16 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.623 1.147 19880
3796 1 16 . 1 1 9 9 LEU H H 9 8.215 8.215 8.040 0.175 19880
3797 1 16 . 1 1 10 10 CYS N N 10 115.050 115.050 113.676 1.374 19880
3798 1 16 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.284 -0.394 19880
3799 1 16 . 1 1 10 10 CYS CA C 10 61.378 61.378 59.310 2.068 19880
3800 1 16 . 1 1 10 10 CYS CB C 10 42.589 42.589 24.903 17.686 19880
3801 1 16 . 1 1 10 10 CYS H H 10 9.282 9.282 8.280 1.002 19880
3802 1 16 . 1 1 11 11 VAL N N 11 117.792 117.792 118.793 -1.001 19880
3803 1 16 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.263 -0.492 19880
3804 1 16 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.023 0.485 19880
3805 1 16 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.241 0.357 19880
3806 1 16 . 1 1 11 11 VAL H H 11 7.315 7.315 8.191 -0.876 19880
3807 1 16 . 1 1 12 12 THR N N 12 109.816 109.816 113.321 -3.505 19880
3808 1 16 . 1 1 12 12 THR HA H 12 4.044 4.044 4.449 -0.405 19880
3809 1 16 . 1 1 12 12 THR CA C 12 63.575 63.575 62.752 0.824 19880
3810 1 16 . 1 1 12 12 THR CB C 12 69.400 69.400 69.398 0.002 19880
3811 1 16 . 1 1 12 12 THR H H 12 8.214 8.214 7.810 0.404 19880
3812 1 16 . 1 1 13 13 SER N N 13 114.455 114.455 115.308 -0.853 19880
3813 1 16 . 1 1 13 13 SER HA H 13 4.607 4.607 4.673 -0.066 19880
3814 1 16 . 1 1 13 13 SER CA C 13 59.460 59.460 58.330 1.130 19880
3815 1 16 . 1 1 13 13 SER CB C 13 64.586 64.586 65.768 -1.182 19880
3816 1 16 . 1 1 13 13 SER H H 13 7.511 7.511 7.691 -0.180 19880
3817 1 16 . 1 1 14 14 GLY N N 14 109.125 109.125 109.498 -0.373 19880
3818 1 16 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.551 -0.227 19880
3819 1 16 . 1 1 14 14 GLY H H 14 8.376 8.376 7.864 0.512 19880
3820 1 16 . 1 1 15 15 LEU N N 15 120.782 120.782 121.580 -0.798 19880
3821 1 16 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.201 -0.265 19880
3822 1 16 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.104 0.882 19880
3823 1 16 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.010 -0.484 19880
3824 1 16 . 1 1 15 15 LEU H H 15 8.469 8.469 8.643 -0.174 19880
3825 1 16 . 1 1 16 16 THR N N 16 115.887 115.887 114.529 1.358 19880
3826 1 16 . 1 1 16 16 THR HA H 16 3.602 3.602 3.943 -0.341 19880
3827 1 16 . 1 1 16 16 THR CA C 16 67.196 67.196 67.068 0.128 19880
3828 1 16 . 1 1 16 16 THR CB C 16 68.003 68.003 68.002 0.000 19880
3829 1 16 . 1 1 16 16 THR H H 16 8.487 8.487 8.294 0.193 19880
3830 1 16 . 1 1 17 17 ALA N N 17 122.643 122.643 123.164 -0.521 19880
3831 1 16 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.380 -0.366 19880
3832 1 16 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.408 0.433 19880
3833 1 16 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.102 0.829 19880
3834 1 16 . 1 1 17 17 ALA H H 17 7.609 7.609 7.734 -0.125 19880
3835 1 16 . 1 1 18 18 CYS N N 18 118.252 118.252 118.572 -0.320 19880
3836 1 16 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.244 0.009 19880
3837 1 16 . 1 1 18 18 CYS CA C 18 58.453 58.453 60.941 -2.489 19880
3838 1 16 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.288 12.358 19880
3839 1 16 . 1 1 18 18 CYS H H 18 7.644 7.644 7.712 -0.068 19880
3840 1 16 . 1 1 19 19 ARG N N 19 120.422 120.422 120.030 0.392 19880
3841 1 16 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.098 -0.623 19880
3842 1 16 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.560 0.992 19880
3843 1 16 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.385 -0.584 19880
3844 1 16 . 1 1 19 19 ARG H H 19 9.072 9.072 8.381 0.691 19880
3845 1 16 . 1 1 20 20 ASN N N 20 117.466 117.466 115.759 1.707 19880
3846 1 16 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.590 -0.378 19880
3847 1 16 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.057 0.554 19880
3848 1 16 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.278 -1.023 19880
3849 1 16 . 1 1 20 20 ASN H H 20 8.411 8.411 7.829 0.582 19880
3850 1 16 . 1 1 21 21 HIS N N 21 120.420 120.420 118.630 1.790 19880
3851 1 16 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.700 -0.526 19880
3852 1 16 . 1 1 21 21 HIS CA C 21 59.154 59.154 58.902 0.252 19880
3853 1 16 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.859 0.729 19880
3854 1 16 . 1 1 21 21 HIS H H 21 7.827 7.827 7.672 0.155 19880
3855 1 16 . 1 1 22 22 CYS N N 22 117.510 117.510 117.164 0.346 19880
3856 1 16 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.288 -1.129 19880
3857 1 16 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.673 -3.452 19880
3858 1 16 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.259 10.919 19880
3859 1 16 . 1 1 22 22 CYS H H 22 8.500 8.500 7.858 0.642 19880
3860 1 16 . 1 1 23 23 ARG N N 23 116.564 116.564 119.028 -2.464 19880
3861 1 16 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.656 -0.003 19880
3862 1 16 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.389 0.639 19880
3863 1 16 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.553 0.102 19880
3864 1 16 . 1 1 23 23 ARG H H 23 7.985 7.985 8.013 -0.028 19880
3865 1 16 . 1 1 24 24 SER N N 24 116.727 116.727 112.183 4.544 19880
3866 1 16 . 1 1 24 24 SER HA H 24 4.552 4.552 4.693 -0.141 19880
3867 1 16 . 1 1 24 24 SER CA C 24 57.592 57.592 56.107 1.485 19880
3868 1 16 . 1 1 24 24 SER CB C 24 65.284 65.284 66.559 -1.275 19880
3869 1 16 . 1 1 24 24 SER H H 24 7.435 7.435 7.398 0.037 19880
3870 1 16 . 1 1 25 25 CYS N N 25 121.909 121.909 121.369 0.540 19880
3871 1 16 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.799 -0.163 19880
3872 1 16 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.659 -2.045 19880
3873 1 16 . 1 1 25 25 CYS CB C 25 39.273 39.273 25.964 13.309 19880
3874 1 16 . 1 1 25 25 CYS H H 25 9.000 9.000 8.958 0.042 19880
3875 1 16 . 1 1 26 26 HIS N N 26 126.609 126.609 120.930 5.679 19880
3876 1 16 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.260 -0.308 19880
3877 1 16 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.077 0.645 19880
3878 1 16 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.822 0.278 19880
3879 1 16 . 1 1 26 26 HIS H H 26 9.255 9.255 8.803 0.452 19880
3880 1 16 . 1 1 27 27 ARG N N 27 122.033 122.033 121.268 0.765 19880
3881 1 16 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.309 -0.287 19880
3882 1 16 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.389 2.088 19880
3883 1 16 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.253 -0.373 19880
3884 1 16 . 1 1 27 27 ARG H H 27 8.314 8.314 8.229 0.085 19880
3885 1 16 . 1 1 28 28 GLY N N 28 119.213 119.213 114.491 4.722 19880
3886 1 16 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.607 -0.635 19880
3887 1 16 . 1 1 28 28 GLY H H 28 8.495 8.495 8.199 0.296 19880
3888 1 16 . 1 1 29 29 ASP N N 29 121.258 121.258 119.296 1.962 19880
3889 1 16 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.595 -0.331 19880
3890 1 16 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.604 1.842 19880
3891 1 16 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.351 -0.913 19880
3892 1 16 . 1 1 29 29 ASP H H 29 8.646 8.646 8.444 0.202 19880
3893 1 16 . 1 1 30 30 VAL N N 30 112.703 112.703 117.943 -5.240 19880
3894 1 16 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.205 0.018 19880
3895 1 16 . 1 1 30 30 VAL CA C 30 61.407 61.407 61.500 -0.093 19880
3896 1 16 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.297 -0.392 19880
3897 1 16 . 1 1 30 30 VAL H H 30 8.026 8.026 7.667 0.359 19880
3898 1 16 . 1 1 31 31 GLY N N 31 109.481 109.481 107.293 2.188 19880
3899 1 16 . 1 1 31 31 GLY CA C 31 44.366 44.366 45.016 -0.650 19880
3900 1 16 . 1 1 31 31 GLY H H 31 7.511 7.511 7.500 0.011 19880
3901 1 16 . 1 1 32 32 CYS N N 32 121.673 121.673 120.495 1.178 19880
3902 1 16 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.147 -0.201 19880
3903 1 16 . 1 1 32 32 CYS CA C 32 54.181 54.181 59.038 -4.857 19880
3904 1 16 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.314 14.982 19880
3905 1 16 . 1 1 32 32 CYS H H 32 8.554 8.554 8.585 -0.031 19880
3906 1 16 . 1 1 33 33 VAL N N 33 119.401 119.401 118.981 0.420 19880
3907 1 16 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.942 -0.147 19880
3908 1 16 . 1 1 33 33 VAL CA C 33 59.311 59.311 60.026 -0.715 19880
3909 1 16 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.664 0.816 19880
3910 1 16 . 1 1 33 33 VAL H H 33 9.025 9.025 9.025 0.000 19880
3911 1 16 . 1 1 34 34 ARG N N 34 120.394 120.394 115.863 4.531 19880
3912 1 16 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.863 -0.164 19880
3913 1 16 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.143 1.049 19880
3914 1 16 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.514 -0.376 19880
3915 1 16 . 1 1 34 34 ARG H H 34 8.350 8.350 8.664 -0.314 19880
3916 1 16 . 1 1 35 35 CYS N N 35 118.098 118.098 118.416 -0.318 19880
3917 1 16 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.489 0.562 19880
3918 1 16 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.684 -2.407 19880
3919 1 16 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.633 12.920 19880
3920 1 16 . 1 1 35 35 CYS H H 35 8.567 8.567 9.009 -0.442 19880
3921 1 16 . 1 1 36 36 SER N N 36 114.009 114.009 115.879 -1.870 19880
3922 1 16 . 1 1 36 36 SER HA H 36 4.326 4.326 4.545 -0.219 19880
3923 1 16 . 1 1 36 36 SER CA C 36 60.945 60.945 59.663 1.282 19880
3924 1 16 . 1 1 36 36 SER CB C 36 64.743 64.743 63.879 0.864 19880
3925 1 16 . 1 1 36 36 SER H H 36 7.669 7.669 8.364 -0.695 19880
3926 1 16 . 1 1 37 37 ASN N N 37 117.050 117.050 116.079 0.971 19880
3927 1 16 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.900 -0.492 19880
3928 1 16 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.472 -0.386 19880
3929 1 16 . 1 1 37 37 ASN CB C 37 41.374 41.374 41.065 0.309 19880
3930 1 16 . 1 1 37 37 ASN H H 37 7.755 7.755 7.478 0.277 19880
3931 1 16 . 1 1 38 38 ALA N N 38 123.735 123.735 120.343 3.392 19880
3932 1 16 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.964 0.198 19880
3933 1 16 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.527 0.607 19880
3934 1 16 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.044 -2.851 19880
3935 1 16 . 1 1 38 38 ALA H H 38 9.323 9.323 8.303 1.020 19880
3936 1 16 . 1 1 39 39 GLN N N 39 116.531 116.531 116.411 0.120 19880
3937 1 16 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.801 -0.488 19880
3938 1 16 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.227 0.522 19880
3939 1 16 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.222 1.595 19880
3940 1 16 . 1 1 39 39 GLN H H 39 8.746 8.746 8.774 -0.028 19880
3941 1 16 . 1 1 40 40 CYS N N 40 122.074 122.074 120.938 1.136 19880
3942 1 16 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.402 0.147 19880
3943 1 16 . 1 1 40 40 CYS CA C 40 54.413 54.413 58.013 -3.600 19880
3944 1 16 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.307 13.595 19880
3945 1 16 . 1 1 40 40 CYS H H 40 8.536 8.536 8.715 -0.179 19880
3946 1 16 . 1 1 41 41 THR N N 41 117.753 117.753 116.169 1.584 19880
3947 1 16 . 1 1 41 41 THR HA H 41 4.641 4.641 4.661 -0.020 19880
3948 1 16 . 1 1 41 41 THR CA C 41 60.550 60.550 60.112 0.438 19880
3949 1 16 . 1 1 41 41 THR CB C 41 71.033 71.033 71.471 -0.438 19880
3950 1 16 . 1 1 41 41 THR H H 41 9.779 9.779 8.856 0.923 19880
3951 1 16 . 1 1 42 42 GLY N N 42 105.809 105.809 108.504 -2.695 19880
3952 1 16 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.870 -0.855 19880
3953 1 16 . 1 1 42 42 GLY H H 42 8.247 8.247 8.345 -0.098 19880
3954 1 16 . 1 1 43 43 PHE N N 43 123.293 123.293 121.246 2.047 19880
3955 1 16 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.419 -0.121 19880
3956 1 16 . 1 1 43 43 PHE CA C 43 60.196 60.196 56.534 3.662 19880
3957 1 16 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.356 -0.706 19880
3958 1 16 . 1 1 43 43 PHE H H 43 8.707 8.707 8.659 0.048 19880
3959 1 16 . 1 1 44 44 LEU N N 44 120.771 120.771 123.332 -2.561 19880
3960 1 16 . 1 1 44 44 LEU HA H 44 3.848 3.848 3.600 0.248 19880
3961 1 16 . 1 1 44 44 LEU CB C 44 40.386 40.386 39.213 1.173 19880
3962 1 16 . 1 1 44 44 LEU H H 44 8.645 8.645 8.446 0.199 19880
3963 1 16 . 1 1 45 45 GLY N N 45 107.545 107.545 104.841 2.704 19880
3964 1 16 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.877 1.434 19880
3965 1 16 . 1 1 45 45 GLY H H 45 7.831 7.831 7.925 -0.094 19880
3966 1 16 . 1 1 46 46 THR N N 46 104.485 104.485 111.505 -7.020 19880
3967 1 16 . 1 1 46 46 THR HA H 46 3.901 3.901 4.110 -0.209 19880
3968 1 16 . 1 1 46 46 THR CA C 46 62.180 62.180 63.445 -1.265 19880
3969 1 16 . 1 1 46 46 THR CB C 46 70.021 70.021 68.832 1.189 19880
3970 1 16 . 1 1 46 46 THR H H 46 6.823 6.823 8.096 -1.273 19880
3971 1 16 . 1 1 47 47 THR N N 47 123.300 123.300 117.259 6.041 19880
3972 1 16 . 1 1 47 47 THR HA H 47 4.371 4.371 4.615 -0.244 19880
3973 1 16 . 1 1 47 47 THR CA C 47 62.843 62.843 61.385 1.458 19880
3974 1 16 . 1 1 47 47 THR CB C 47 70.176 70.176 72.209 -2.033 19880
3975 1 16 . 1 1 47 47 THR H H 47 8.763 8.763 7.850 0.913 19880
3976 1 16 . 1 1 48 48 CYS N N 48 128.024 128.024 123.440 4.584 19880
3977 1 16 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.978 -0.005 19880
3978 1 16 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.310 -1.326 19880
3979 1 16 . 1 1 48 48 CYS CB C 48 36.282 36.282 29.765 6.517 19880
3980 1 16 . 1 1 48 48 CYS H H 48 9.276 9.276 8.634 0.642 19880
3981 1 16 . 1 1 49 49 THR N N 49 131.810 131.810 120.890 10.920 19880
3982 1 16 . 1 1 49 49 THR HA H 49 4.364 4.364 4.739 -0.375 19880
3983 1 16 . 1 1 49 49 THR CA C 49 61.871 61.871 61.879 -0.008 19880
3984 1 16 . 1 1 49 49 THR CB C 49 69.789 69.789 72.764 -2.975 19880
3985 1 16 . 1 1 49 49 THR H H 49 9.194 9.194 8.720 0.474 19880
3986 1 16 . 1 1 50 50 CYS N N 50 123.835 123.835 121.801 2.034 19880
3987 1 16 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.126 -0.091 19880
3988 1 16 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.293 -6.413 19880
3989 1 16 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.594 5.340 19880
3990 1 16 . 1 1 50 50 CYS H H 50 8.879 8.879 8.606 0.273 19880
3991 1 16 . 1 1 51 51 ILE N N 51 123.986 123.986 122.347 1.639 19880
3992 1 16 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.362 -0.219 19880
3993 1 16 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.165 0.454 19880
3994 1 16 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.937 -0.557 19880
3995 1 16 . 1 1 51 51 ILE H H 51 8.098 8.098 8.856 -0.758 19880
3996 1 16 . 1 1 52 52 ASN N N 52 126.122 126.122 125.463 0.659 19880
3997 1 16 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.862 -0.146 19880
3998 1 16 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.641 1.250 19880
3999 1 16 . 1 1 52 52 ASN CB C 52 37.913 37.913 37.890 0.023 19880
4000 1 16 . 1 1 52 52 ASN H H 52 8.323 8.323 8.638 -0.315 19880
4001 1 16 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.534 -0.227 19880
4002 1 16 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.453 0.580 19880
4003 1 16 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.726 3.134 19880
4004 1 16 . 1 1 54 54 CYS N N 54 123.090 123.090 118.003 5.087 19880
4005 1 16 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.117 0.619 19880
4006 1 16 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.798 -2.648 19880
4007 1 16 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.825 19.329 19880
4008 1 16 . 1 1 54 54 CYS H H 54 8.865 8.865 8.472 0.393 19880
4009 1 16 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.459 -0.173 19880
4010 1 16 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.743 -0.485 19880
4011 1 16 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.352 0.098 19880
4012 1 16 . 1 1 56 56 ARG N N 56 117.289 117.289 118.240 -0.951 19880
4013 1 16 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.442 0.043 19880
4014 1 16 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.744 -0.623 19880
4015 1 16 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.237 -0.698 19880
4016 1 16 . 1 1 56 56 ARG H H 56 7.902 7.902 8.417 -0.515 19880
4017 1 17 . 1 1 3 3 CYS N N 3 117.561 117.561 117.624 -0.063 19880
4018 1 17 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.261 -0.441 19880
4019 1 17 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.502 -2.802 19880
4020 1 17 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.795 19.856 19880
4021 1 17 . 1 1 3 3 CYS H H 3 7.950 7.950 8.621 -0.671 19880
4022 1 17 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.588 -0.083 19880
4023 1 17 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.997 0.733 19880
4024 1 17 . 1 1 4 4 PRO CB C 4 33.299 33.299 33.083 0.216 19880
4025 1 17 . 1 1 5 5 THR N N 5 118.207 118.207 114.806 3.401 19880
4026 1 17 . 1 1 5 5 THR HA H 5 4.814 4.814 4.709 0.105 19880
4027 1 17 . 1 1 5 5 THR CA C 5 61.618 61.618 61.707 -0.089 19880
4028 1 17 . 1 1 5 5 THR CB C 5 70.257 70.257 69.847 0.410 19880
4029 1 17 . 1 1 5 5 THR H H 5 8.529 8.529 8.327 0.202 19880
4030 1 17 . 1 1 6 6 ARG N N 6 123.211 123.211 125.415 -2.204 19880
4031 1 17 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.646 -0.118 19880
4032 1 17 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.168 -0.237 19880
4033 1 17 . 1 1 6 6 ARG CB C 6 32.752 32.752 33.171 -0.419 19880
4034 1 17 . 1 1 6 6 ARG H H 6 7.693 7.693 8.664 -0.971 19880
4035 1 17 . 1 1 7 7 ARG N N 7 121.558 121.558 122.635 -1.077 19880
4036 1 17 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.591 0.075 19880
4037 1 17 . 1 1 7 7 ARG CA C 7 54.415 54.415 54.588 -0.173 19880
4038 1 17 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.904 -0.231 19880
4039 1 17 . 1 1 7 7 ARG H H 7 8.450 8.450 8.033 0.417 19880
4040 1 17 . 1 1 8 8 GLY N N 8 111.006 111.006 108.082 2.924 19880
4041 1 17 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.532 1.121 19880
4042 1 17 . 1 1 8 8 GLY H H 8 9.382 9.382 8.606 0.776 19880
4043 1 17 . 1 1 9 9 LEU N N 9 119.202 119.202 118.324 0.878 19880
4044 1 17 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.081 -0.191 19880
4045 1 17 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.315 1.439 19880
4046 1 17 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.629 1.141 19880
4047 1 17 . 1 1 9 9 LEU H H 9 8.215 8.215 8.084 0.131 19880
4048 1 17 . 1 1 10 10 CYS N N 10 115.050 115.050 115.730 -0.680 19880
4049 1 17 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.481 -0.591 19880
4050 1 17 . 1 1 10 10 CYS CA C 10 61.378 61.378 58.936 2.442 19880
4051 1 17 . 1 1 10 10 CYS CB C 10 42.589 42.589 25.350 17.239 19880
4052 1 17 . 1 1 10 10 CYS H H 10 9.282 9.282 7.946 1.336 19880
4053 1 17 . 1 1 11 11 VAL N N 11 117.792 117.792 120.891 -3.099 19880
4054 1 17 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.000 -0.229 19880
4055 1 17 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.769 -0.261 19880
4056 1 17 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.402 0.196 19880
4057 1 17 . 1 1 11 11 VAL H H 11 7.315 7.315 7.990 -0.675 19880
4058 1 17 . 1 1 12 12 THR N N 12 109.816 109.816 111.806 -1.990 19880
4059 1 17 . 1 1 12 12 THR HA H 12 4.044 4.044 4.343 -0.299 19880
4060 1 17 . 1 1 12 12 THR CA C 12 63.575 63.575 63.168 0.407 19880
4061 1 17 . 1 1 12 12 THR CB C 12 69.400 69.400 69.066 0.334 19880
4062 1 17 . 1 1 12 12 THR H H 12 8.214 8.214 7.944 0.270 19880
4063 1 17 . 1 1 13 13 SER N N 13 114.455 114.455 117.780 -3.325 19880
4064 1 17 . 1 1 13 13 SER HA H 13 4.607 4.607 4.532 0.075 19880
4065 1 17 . 1 1 13 13 SER CA C 13 59.460 59.460 58.961 0.499 19880
4066 1 17 . 1 1 13 13 SER CB C 13 64.586 64.586 63.712 0.874 19880
4067 1 17 . 1 1 13 13 SER H H 13 7.511 7.511 8.297 -0.786 19880
4068 1 17 . 1 1 14 14 GLY N N 14 109.125 109.125 108.455 0.670 19880
4069 1 17 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.436 -0.112 19880
4070 1 17 . 1 1 14 14 GLY H H 14 8.376 8.376 7.528 0.848 19880
4071 1 17 . 1 1 15 15 LEU N N 15 120.782 120.782 121.332 -0.550 19880
4072 1 17 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.168 -0.232 19880
4073 1 17 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.413 0.573 19880
4074 1 17 . 1 1 15 15 LEU CB C 15 41.526 41.526 41.895 -0.369 19880
4075 1 17 . 1 1 15 15 LEU H H 15 8.469 8.469 8.687 -0.218 19880
4076 1 17 . 1 1 16 16 THR N N 16 115.887 115.887 114.256 1.631 19880
4077 1 17 . 1 1 16 16 THR HA H 16 3.602 3.602 3.945 -0.343 19880
4078 1 17 . 1 1 16 16 THR CA C 16 67.196 67.196 66.996 0.200 19880
4079 1 17 . 1 1 16 16 THR CB C 16 68.003 68.003 67.924 0.079 19880
4080 1 17 . 1 1 16 16 THR H H 16 8.487 8.487 8.212 0.275 19880
4081 1 17 . 1 1 17 17 ALA N N 17 122.643 122.643 123.360 -0.717 19880
4082 1 17 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.335 -0.321 19880
4083 1 17 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.587 0.254 19880
4084 1 17 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.038 0.893 19880
4085 1 17 . 1 1 17 17 ALA H H 17 7.609 7.609 7.667 -0.058 19880
4086 1 17 . 1 1 18 18 CYS N N 18 118.252 118.252 118.511 -0.259 19880
4087 1 17 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.279 -0.026 19880
4088 1 17 . 1 1 18 18 CYS CA C 18 58.453 58.453 60.718 -2.265 19880
4089 1 17 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.331 12.315 19880
4090 1 17 . 1 1 18 18 CYS H H 18 7.644 7.644 7.731 -0.087 19880
4091 1 17 . 1 1 19 19 ARG N N 19 120.422 120.422 120.020 0.402 19880
4092 1 17 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.100 -0.625 19880
4093 1 17 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.550 1.002 19880
4094 1 17 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.324 -0.523 19880
4095 1 17 . 1 1 19 19 ARG H H 19 9.072 9.072 8.374 0.698 19880
4096 1 17 . 1 1 20 20 ASN N N 20 117.466 117.466 117.493 -0.027 19880
4097 1 17 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.644 -0.432 19880
4098 1 17 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.638 -0.027 19880
4099 1 17 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.146 -0.891 19880
4100 1 17 . 1 1 20 20 ASN H H 20 8.411 8.411 7.906 0.505 19880
4101 1 17 . 1 1 21 21 HIS N N 21 120.420 120.420 121.962 -1.542 19880
4102 1 17 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.744 -0.570 19880
4103 1 17 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.936 -0.782 19880
4104 1 17 . 1 1 21 21 HIS CB C 21 31.588 31.588 29.855 1.733 19880
4105 1 17 . 1 1 21 21 HIS H H 21 7.827 7.827 7.953 -0.126 19880
4106 1 17 . 1 1 22 22 CYS N N 22 117.510 117.510 117.354 0.156 19880
4107 1 17 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.316 -1.157 19880
4108 1 17 . 1 1 22 22 CYS CA C 22 58.221 58.221 62.287 -4.066 19880
4109 1 17 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.106 11.072 19880
4110 1 17 . 1 1 22 22 CYS H H 22 8.500 8.500 8.001 0.499 19880
4111 1 17 . 1 1 23 23 ARG N N 23 116.564 116.564 118.777 -2.213 19880
4112 1 17 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.747 -0.094 19880
4113 1 17 . 1 1 23 23 ARG CA C 23 57.028 57.028 57.605 -0.577 19880
4114 1 17 . 1 1 23 23 ARG CB C 23 30.655 30.655 31.236 -0.581 19880
4115 1 17 . 1 1 23 23 ARG H H 23 7.985 7.985 7.786 0.199 19880
4116 1 17 . 1 1 24 24 SER N N 24 116.727 116.727 113.825 2.902 19880
4117 1 17 . 1 1 24 24 SER HA H 24 4.552 4.552 4.605 -0.053 19880
4118 1 17 . 1 1 24 24 SER CA C 24 57.592 57.592 56.987 0.605 19880
4119 1 17 . 1 1 24 24 SER CB C 24 65.284 65.284 65.353 -0.069 19880
4120 1 17 . 1 1 24 24 SER H H 24 7.435 7.435 7.804 -0.369 19880
4121 1 17 . 1 1 25 25 CYS N N 25 121.909 121.909 120.472 1.437 19880
4122 1 17 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.742 -0.106 19880
4123 1 17 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.518 -1.904 19880
4124 1 17 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.735 12.538 19880
4125 1 17 . 1 1 25 25 CYS H H 25 9.000 9.000 8.872 0.128 19880
4126 1 17 . 1 1 26 26 HIS N N 26 126.609 126.609 119.903 6.706 19880
4127 1 17 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.335 -0.383 19880
4128 1 17 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.300 0.422 19880
4129 1 17 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.824 0.276 19880
4130 1 17 . 1 1 26 26 HIS H H 26 9.255 9.255 8.772 0.483 19880
4131 1 17 . 1 1 27 27 ARG N N 27 122.033 122.033 121.217 0.816 19880
4132 1 17 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.351 -0.329 19880
4133 1 17 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.898 1.579 19880
4134 1 17 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.872 -0.992 19880
4135 1 17 . 1 1 27 27 ARG H H 27 8.314 8.314 8.198 0.116 19880
4136 1 17 . 1 1 28 28 GLY N N 28 119.213 119.213 112.779 6.434 19880
4137 1 17 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.566 -0.594 19880
4138 1 17 . 1 1 28 28 GLY H H 28 8.495 8.495 7.725 0.770 19880
4139 1 17 . 1 1 29 29 ASP N N 29 121.258 121.258 119.123 2.135 19880
4140 1 17 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.622 -0.358 19880
4141 1 17 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.153 2.293 19880
4142 1 17 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.868 -1.430 19880
4143 1 17 . 1 1 29 29 ASP H H 29 8.646 8.646 8.327 0.319 19880
4144 1 17 . 1 1 30 30 VAL N N 30 112.703 112.703 117.348 -4.645 19880
4145 1 17 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.292 -0.069 19880
4146 1 17 . 1 1 30 30 VAL CA C 30 61.407 61.407 62.349 -0.942 19880
4147 1 17 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.680 -0.775 19880
4148 1 17 . 1 1 30 30 VAL H H 30 8.026 8.026 7.737 0.289 19880
4149 1 17 . 1 1 31 31 GLY N N 31 109.481 109.481 107.640 1.841 19880
4150 1 17 . 1 1 31 31 GLY CA C 31 44.366 44.366 44.851 -0.485 19880
4151 1 17 . 1 1 31 31 GLY H H 31 7.511 7.511 7.585 -0.074 19880
4152 1 17 . 1 1 32 32 CYS N N 32 121.673 121.673 119.567 2.106 19880
4153 1 17 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.069 -0.123 19880
4154 1 17 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.770 -4.589 19880
4155 1 17 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.467 14.829 19880
4156 1 17 . 1 1 32 32 CYS H H 32 8.554 8.554 8.507 0.047 19880
4157 1 17 . 1 1 33 33 VAL N N 33 119.401 119.401 117.282 2.119 19880
4158 1 17 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.911 -0.116 19880
4159 1 17 . 1 1 33 33 VAL CA C 33 59.311 59.311 60.073 -0.762 19880
4160 1 17 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.491 0.989 19880
4161 1 17 . 1 1 33 33 VAL H H 33 9.025 9.025 8.905 0.120 19880
4162 1 17 . 1 1 34 34 ARG N N 34 120.394 120.394 115.891 4.503 19880
4163 1 17 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.678 0.021 19880
4164 1 17 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.270 0.922 19880
4165 1 17 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.631 -0.493 19880
4166 1 17 . 1 1 34 34 ARG H H 34 8.350 8.350 8.579 -0.229 19880
4167 1 17 . 1 1 35 35 CYS N N 35 118.098 118.098 118.207 -0.109 19880
4168 1 17 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.404 0.647 19880
4169 1 17 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.309 -2.032 19880
4170 1 17 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.852 12.701 19880
4171 1 17 . 1 1 35 35 CYS H H 35 8.567 8.567 9.166 -0.599 19880
4172 1 17 . 1 1 36 36 SER N N 36 114.009 114.009 115.091 -1.082 19880
4173 1 17 . 1 1 36 36 SER HA H 36 4.326 4.326 4.582 -0.256 19880
4174 1 17 . 1 1 36 36 SER CA C 36 60.945 60.945 60.809 0.136 19880
4175 1 17 . 1 1 36 36 SER CB C 36 64.743 64.743 64.443 0.300 19880
4176 1 17 . 1 1 36 36 SER H H 36 7.669 7.669 8.549 -0.880 19880
4177 1 17 . 1 1 37 37 ASN N N 37 117.050 117.050 116.189 0.861 19880
4178 1 17 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.855 -0.447 19880
4179 1 17 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.341 -0.255 19880
4180 1 17 . 1 1 37 37 ASN CB C 37 41.374 41.374 40.821 0.553 19880
4181 1 17 . 1 1 37 37 ASN H H 37 7.755 7.755 7.491 0.264 19880
4182 1 17 . 1 1 38 38 ALA N N 38 123.735 123.735 120.341 3.394 19880
4183 1 17 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.978 0.184 19880
4184 1 17 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.511 0.623 19880
4185 1 17 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.041 -2.848 19880
4186 1 17 . 1 1 38 38 ALA H H 38 9.323 9.323 8.309 1.014 19880
4187 1 17 . 1 1 39 39 GLN N N 39 116.531 116.531 116.639 -0.108 19880
4188 1 17 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.738 -0.425 19880
4189 1 17 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.356 0.393 19880
4190 1 17 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.554 1.263 19880
4191 1 17 . 1 1 39 39 GLN H H 39 8.746 8.746 9.011 -0.265 19880
4192 1 17 . 1 1 40 40 CYS N N 40 122.074 122.074 121.354 0.720 19880
4193 1 17 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.525 0.024 19880
4194 1 17 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.051 -2.638 19880
4195 1 17 . 1 1 40 40 CYS CB C 40 40.902 40.902 28.425 12.477 19880
4196 1 17 . 1 1 40 40 CYS H H 40 8.536 8.536 8.677 -0.141 19880
4197 1 17 . 1 1 41 41 THR N N 41 117.753 117.753 120.396 -2.643 19880
4198 1 17 . 1 1 41 41 THR HA H 41 4.641 4.641 4.575 0.066 19880
4199 1 17 . 1 1 41 41 THR CA C 41 60.550 60.550 60.542 0.008 19880
4200 1 17 . 1 1 41 41 THR CB C 41 71.033 71.033 71.310 -0.277 19880
4201 1 17 . 1 1 41 41 THR H H 41 9.779 9.779 8.943 0.836 19880
4202 1 17 . 1 1 42 42 GLY N N 42 105.809 105.809 108.048 -2.239 19880
4203 1 17 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.714 -0.699 19880
4204 1 17 . 1 1 42 42 GLY H H 42 8.247 8.247 8.338 -0.091 19880
4205 1 17 . 1 1 43 43 PHE N N 43 123.293 123.293 121.722 1.571 19880
4206 1 17 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.388 -0.090 19880
4207 1 17 . 1 1 43 43 PHE CA C 43 60.196 60.196 57.408 2.788 19880
4208 1 17 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.336 -0.686 19880
4209 1 17 . 1 1 43 43 PHE H H 43 8.707 8.707 8.682 0.025 19880
4210 1 17 . 1 1 44 44 LEU N N 44 120.771 120.771 124.208 -3.437 19880
4211 1 17 . 1 1 44 44 LEU HA H 44 3.848 3.848 3.758 0.090 19880
4212 1 17 . 1 1 44 44 LEU CB C 44 40.386 40.386 39.417 0.969 19880
4213 1 17 . 1 1 44 44 LEU H H 44 8.645 8.645 8.222 0.423 19880
4214 1 17 . 1 1 45 45 GLY N N 45 107.545 107.545 105.781 1.764 19880
4215 1 17 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.073 2.238 19880
4216 1 17 . 1 1 45 45 GLY H H 45 7.831 7.831 7.756 0.075 19880
4217 1 17 . 1 1 46 46 THR N N 46 104.485 104.485 112.679 -8.194 19880
4218 1 17 . 1 1 46 46 THR HA H 46 3.901 3.901 4.553 -0.652 19880
4219 1 17 . 1 1 46 46 THR CA C 46 62.180 62.180 62.044 0.136 19880
4220 1 17 . 1 1 46 46 THR CB C 46 70.021 70.021 70.742 -0.721 19880
4221 1 17 . 1 1 46 46 THR H H 46 6.823 6.823 8.706 -1.883 19880
4222 1 17 . 1 1 47 47 THR N N 47 123.300 123.300 118.010 5.290 19880
4223 1 17 . 1 1 47 47 THR HA H 47 4.371 4.371 4.618 -0.247 19880
4224 1 17 . 1 1 47 47 THR CA C 47 62.843 62.843 61.244 1.599 19880
4225 1 17 . 1 1 47 47 THR CB C 47 70.176 70.176 72.141 -1.964 19880
4226 1 17 . 1 1 47 47 THR H H 47 8.763 8.763 8.120 0.643 19880
4227 1 17 . 1 1 48 48 CYS N N 48 128.024 128.024 124.342 3.682 19880
4228 1 17 . 1 1 48 48 CYS HA H 48 4.973 4.973 5.059 -0.086 19880
4229 1 17 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.494 -1.510 19880
4230 1 17 . 1 1 48 48 CYS CB C 48 36.282 36.282 29.098 7.184 19880
4231 1 17 . 1 1 48 48 CYS H H 48 9.276 9.276 8.963 0.313 19880
4232 1 17 . 1 1 49 49 THR N N 49 131.810 131.810 122.203 9.607 19880
4233 1 17 . 1 1 49 49 THR HA H 49 4.364 4.364 4.747 -0.383 19880
4234 1 17 . 1 1 49 49 THR CA C 49 61.871 61.871 62.090 -0.219 19880
4235 1 17 . 1 1 49 49 THR CB C 49 69.789 69.789 72.787 -2.998 19880
4236 1 17 . 1 1 49 49 THR H H 49 9.194 9.194 8.759 0.435 19880
4237 1 17 . 1 1 50 50 CYS N N 50 123.835 123.835 122.335 1.500 19880
4238 1 17 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.103 -0.068 19880
4239 1 17 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.248 -6.368 19880
4240 1 17 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.737 5.197 19880
4241 1 17 . 1 1 50 50 CYS H H 50 8.879 8.879 8.597 0.282 19880
4242 1 17 . 1 1 51 51 ILE N N 51 123.986 123.986 122.345 1.641 19880
4243 1 17 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.365 -0.222 19880
4244 1 17 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.193 0.426 19880
4245 1 17 . 1 1 51 51 ILE CB C 51 39.380 39.380 40.081 -0.701 19880
4246 1 17 . 1 1 51 51 ILE H H 51 8.098 8.098 8.797 -0.699 19880
4247 1 17 . 1 1 52 52 ASN N N 52 126.122 126.122 124.561 1.561 19880
4248 1 17 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.872 -0.156 19880
4249 1 17 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.384 1.507 19880
4250 1 17 . 1 1 52 52 ASN CB C 52 37.913 37.913 37.911 0.001 19880
4251 1 17 . 1 1 52 52 ASN H H 52 8.323 8.323 8.683 -0.360 19880
4252 1 17 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.617 -0.310 19880
4253 1 17 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.624 0.409 19880
4254 1 17 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.819 3.041 19880
4255 1 17 . 1 1 54 54 CYS N N 54 123.090 123.090 117.916 5.174 19880
4256 1 17 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.093 0.643 19880
4257 1 17 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.846 -2.696 19880
4258 1 17 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.640 19.514 19880
4259 1 17 . 1 1 54 54 CYS H H 54 8.865 8.865 8.467 0.398 19880
4260 1 17 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.425 -0.139 19880
4261 1 17 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.706 -0.448 19880
4262 1 17 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.260 0.190 19880
4263 1 17 . 1 1 56 56 ARG N N 56 117.289 117.289 117.747 -0.458 19880
4264 1 17 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.311 0.174 19880
4265 1 17 . 1 1 56 56 ARG CA C 56 56.121 56.121 55.652 0.469 19880
4266 1 17 . 1 1 56 56 ARG CB C 56 30.539 30.539 30.421 0.118 19880
4267 1 17 . 1 1 56 56 ARG H H 56 7.902 7.902 8.392 -0.490 19880
4268 1 18 . 1 1 3 3 CYS N N 3 117.561 117.561 116.228 1.333 19880
4269 1 18 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.259 -0.439 19880
4270 1 18 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.170 -2.470 19880
4271 1 18 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.751 19.900 19880
4272 1 18 . 1 1 3 3 CYS H H 3 7.950 7.950 7.951 -0.001 19880
4273 1 18 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.841 -0.336 19880
4274 1 18 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.999 0.731 19880
4275 1 18 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.548 0.751 19880
4276 1 18 . 1 1 5 5 THR N N 5 118.207 118.207 115.279 2.928 19880
4277 1 18 . 1 1 5 5 THR HA H 5 4.814 4.814 4.665 0.149 19880
4278 1 18 . 1 1 5 5 THR CA C 5 61.618 61.618 62.117 -0.499 19880
4279 1 18 . 1 1 5 5 THR CB C 5 70.257 70.257 69.735 0.522 19880
4280 1 18 . 1 1 5 5 THR H H 5 8.529 8.529 8.354 0.175 19880
4281 1 18 . 1 1 6 6 ARG N N 6 123.211 123.211 126.917 -3.706 19880
4282 1 18 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.647 -0.119 19880
4283 1 18 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.364 -0.433 19880
4284 1 18 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.714 0.038 19880
4285 1 18 . 1 1 6 6 ARG H H 6 7.693 7.693 8.473 -0.780 19880
4286 1 18 . 1 1 7 7 ARG N N 7 121.558 121.558 119.722 1.836 19880
4287 1 18 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.459 0.207 19880
4288 1 18 . 1 1 7 7 ARG CA C 7 54.415 54.415 56.145 -1.730 19880
4289 1 18 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.063 0.610 19880
4290 1 18 . 1 1 7 7 ARG H H 7 8.450 8.450 8.433 0.017 19880
4291 1 18 . 1 1 8 8 GLY N N 8 111.006 111.006 108.877 2.129 19880
4292 1 18 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.011 1.642 19880
4293 1 18 . 1 1 8 8 GLY H H 8 9.382 9.382 8.269 1.113 19880
4294 1 18 . 1 1 9 9 LEU N N 9 119.202 119.202 120.380 -1.178 19880
4295 1 18 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.084 -0.194 19880
4296 1 18 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.495 1.259 19880
4297 1 18 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.576 1.194 19880
4298 1 18 . 1 1 9 9 LEU H H 9 8.215 8.215 7.921 0.294 19880
4299 1 18 . 1 1 10 10 CYS N N 10 115.050 115.050 115.670 -0.620 19880
4300 1 18 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.421 -0.531 19880
4301 1 18 . 1 1 10 10 CYS CA C 10 61.378 61.378 59.552 1.826 19880
4302 1 18 . 1 1 10 10 CYS CB C 10 42.589 42.589 24.695 17.894 19880
4303 1 18 . 1 1 10 10 CYS H H 10 9.282 9.282 8.390 0.892 19880
4304 1 18 . 1 1 11 11 VAL N N 11 117.792 117.792 120.873 -3.081 19880
4305 1 18 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.258 -0.487 19880
4306 1 18 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.227 0.281 19880
4307 1 18 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.494 0.104 19880
4308 1 18 . 1 1 11 11 VAL H H 11 7.315 7.315 8.098 -0.783 19880
4309 1 18 . 1 1 12 12 THR N N 12 109.816 109.816 110.156 -0.340 19880
4310 1 18 . 1 1 12 12 THR HA H 12 4.044 4.044 4.494 -0.450 19880
4311 1 18 . 1 1 12 12 THR CA C 12 63.575 63.575 63.148 0.427 19880
4312 1 18 . 1 1 12 12 THR CB C 12 69.400 69.400 70.264 -0.864 19880
4313 1 18 . 1 1 12 12 THR H H 12 8.214 8.214 7.711 0.503 19880
4314 1 18 . 1 1 13 13 SER N N 13 114.455 114.455 116.275 -1.820 19880
4315 1 18 . 1 1 13 13 SER HA H 13 4.607 4.607 4.658 -0.051 19880
4316 1 18 . 1 1 13 13 SER CA C 13 59.460 59.460 58.641 0.820 19880
4317 1 18 . 1 1 13 13 SER CB C 13 64.586 64.586 65.529 -0.943 19880
4318 1 18 . 1 1 13 13 SER H H 13 7.511 7.511 7.786 -0.275 19880
4319 1 18 . 1 1 14 14 GLY N N 14 109.125 109.125 109.858 -0.733 19880
4320 1 18 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.604 -0.280 19880
4321 1 18 . 1 1 14 14 GLY H H 14 8.376 8.376 7.840 0.536 19880
4322 1 18 . 1 1 15 15 LEU N N 15 120.782 120.782 121.306 -0.524 19880
4323 1 18 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.297 -0.361 19880
4324 1 18 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.145 0.841 19880
4325 1 18 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.093 -0.567 19880
4326 1 18 . 1 1 15 15 LEU H H 15 8.469 8.469 8.708 -0.239 19880
4327 1 18 . 1 1 16 16 THR N N 16 115.887 115.887 114.704 1.183 19880
4328 1 18 . 1 1 16 16 THR HA H 16 3.602 3.602 3.956 -0.354 19880
4329 1 18 . 1 1 16 16 THR CA C 16 67.196 67.196 67.157 0.039 19880
4330 1 18 . 1 1 16 16 THR CB C 16 68.003 68.003 68.033 -0.030 19880
4331 1 18 . 1 1 16 16 THR H H 16 8.487 8.487 8.333 0.154 19880
4332 1 18 . 1 1 17 17 ALA N N 17 122.643 122.643 123.347 -0.704 19880
4333 1 18 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.356 -0.342 19880
4334 1 18 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.506 0.335 19880
4335 1 18 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.066 0.865 19880
4336 1 18 . 1 1 17 17 ALA H H 17 7.609 7.609 7.664 -0.055 19880
4337 1 18 . 1 1 18 18 CYS N N 18 118.252 118.252 118.462 -0.210 19880
4338 1 18 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.225 0.028 19880
4339 1 18 . 1 1 18 18 CYS CA C 18 58.453 58.453 60.986 -2.533 19880
4340 1 18 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.220 12.426 19880
4341 1 18 . 1 1 18 18 CYS H H 18 7.644 7.644 7.757 -0.113 19880
4342 1 18 . 1 1 19 19 ARG N N 19 120.422 120.422 120.343 0.079 19880
4343 1 18 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.093 -0.618 19880
4344 1 18 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.606 0.946 19880
4345 1 18 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.365 -0.564 19880
4346 1 18 . 1 1 19 19 ARG H H 19 9.072 9.072 8.384 0.688 19880
4347 1 18 . 1 1 20 20 ASN N N 20 117.466 117.466 115.952 1.514 19880
4348 1 18 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.563 -0.351 19880
4349 1 18 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.302 0.309 19880
4350 1 18 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.301 -1.046 19880
4351 1 18 . 1 1 20 20 ASN H H 20 8.411 8.411 7.854 0.557 19880
4352 1 18 . 1 1 21 21 HIS N N 21 120.420 120.420 117.514 2.906 19880
4353 1 18 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.534 -0.360 19880
4354 1 18 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.491 -0.337 19880
4355 1 18 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.761 0.827 19880
4356 1 18 . 1 1 21 21 HIS H H 21 7.827 7.827 7.759 0.068 19880
4357 1 18 . 1 1 22 22 CYS N N 22 117.510 117.510 118.091 -0.581 19880
4358 1 18 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.386 -1.227 19880
4359 1 18 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.773 -3.552 19880
4360 1 18 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.399 10.779 19880
4361 1 18 . 1 1 22 22 CYS H H 22 8.500 8.500 7.836 0.664 19880
4362 1 18 . 1 1 23 23 ARG N N 23 116.564 116.564 117.085 -0.521 19880
4363 1 18 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.718 -0.065 19880
4364 1 18 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.397 0.631 19880
4365 1 18 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.337 0.318 19880
4366 1 18 . 1 1 23 23 ARG H H 23 7.985 7.985 7.855 0.130 19880
4367 1 18 . 1 1 24 24 SER N N 24 116.727 116.727 113.033 3.694 19880
4368 1 18 . 1 1 24 24 SER HA H 24 4.552 4.552 4.577 -0.025 19880
4369 1 18 . 1 1 24 24 SER CA C 24 57.592 57.592 56.498 1.094 19880
4370 1 18 . 1 1 24 24 SER CB C 24 65.284 65.284 66.846 -1.562 19880
4371 1 18 . 1 1 24 24 SER H H 24 7.435 7.435 7.408 0.027 19880
4372 1 18 . 1 1 25 25 CYS N N 25 121.909 121.909 120.182 1.727 19880
4373 1 18 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.708 -0.072 19880
4374 1 18 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.426 -1.812 19880
4375 1 18 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.055 13.218 19880
4376 1 18 . 1 1 25 25 CYS H H 25 9.000 9.000 8.809 0.191 19880
4377 1 18 . 1 1 26 26 HIS N N 26 126.609 126.609 120.244 6.365 19880
4378 1 18 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.154 -0.202 19880
4379 1 18 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.399 0.323 19880
4380 1 18 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.702 0.398 19880
4381 1 18 . 1 1 26 26 HIS H H 26 9.255 9.255 8.812 0.443 19880
4382 1 18 . 1 1 27 27 ARG N N 27 122.033 122.033 121.234 0.799 19880
4383 1 18 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.318 -0.296 19880
4384 1 18 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.779 1.698 19880
4385 1 18 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.719 -0.839 19880
4386 1 18 . 1 1 27 27 ARG H H 27 8.314 8.314 8.214 0.100 19880
4387 1 18 . 1 1 28 28 GLY N N 28 119.213 119.213 112.715 6.498 19880
4388 1 18 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.656 -0.684 19880
4389 1 18 . 1 1 28 28 GLY H H 28 8.495 8.495 7.817 0.678 19880
4390 1 18 . 1 1 29 29 ASP N N 29 121.258 121.258 117.987 3.271 19880
4391 1 18 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.655 -0.391 19880
4392 1 18 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.161 2.285 19880
4393 1 18 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.307 -0.869 19880
4394 1 18 . 1 1 29 29 ASP H H 29 8.646 8.646 8.259 0.387 19880
4395 1 18 . 1 1 30 30 VAL N N 30 112.703 112.703 117.480 -4.777 19880
4396 1 18 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.462 -0.239 19880
4397 1 18 . 1 1 30 30 VAL CA C 30 61.407 61.407 63.105 -1.698 19880
4398 1 18 . 1 1 30 30 VAL CB C 30 32.905 32.905 34.146 -1.241 19880
4399 1 18 . 1 1 30 30 VAL H H 30 8.026 8.026 7.899 0.127 19880
4400 1 18 . 1 1 31 31 GLY N N 31 109.481 109.481 107.878 1.603 19880
4401 1 18 . 1 1 31 31 GLY CA C 31 44.366 44.366 45.295 -0.929 19880
4402 1 18 . 1 1 31 31 GLY H H 31 7.511 7.511 7.587 -0.076 19880
4403 1 18 . 1 1 32 32 CYS N N 32 121.673 121.673 119.606 2.067 19880
4404 1 18 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.053 -0.107 19880
4405 1 18 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.456 -4.276 19880
4406 1 18 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.372 14.924 19880
4407 1 18 . 1 1 32 32 CYS H H 32 8.554 8.554 8.487 0.067 19880
4408 1 18 . 1 1 33 33 VAL N N 33 119.401 119.401 116.998 2.403 19880
4409 1 18 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.928 -0.133 19880
4410 1 18 . 1 1 33 33 VAL CA C 33 59.311 59.311 59.592 -0.281 19880
4411 1 18 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.582 0.898 19880
4412 1 18 . 1 1 33 33 VAL H H 33 9.025 9.025 9.044 -0.019 19880
4413 1 18 . 1 1 34 34 ARG N N 34 120.394 120.394 115.822 4.572 19880
4414 1 18 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.898 -0.199 19880
4415 1 18 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.087 1.105 19880
4416 1 18 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.578 -0.440 19880
4417 1 18 . 1 1 34 34 ARG H H 34 8.350 8.350 8.680 -0.330 19880
4418 1 18 . 1 1 35 35 CYS N N 35 118.098 118.098 118.439 -0.341 19880
4419 1 18 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.426 0.625 19880
4420 1 18 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.443 -2.166 19880
4421 1 18 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.920 12.633 19880
4422 1 18 . 1 1 35 35 CYS H H 35 8.567 8.567 9.050 -0.483 19880
4423 1 18 . 1 1 36 36 SER N N 36 114.009 114.009 115.965 -1.956 19880
4424 1 18 . 1 1 36 36 SER HA H 36 4.326 4.326 4.596 -0.270 19880
4425 1 18 . 1 1 36 36 SER CA C 36 60.945 60.945 60.174 0.771 19880
4426 1 18 . 1 1 36 36 SER CB C 36 64.743 64.743 64.533 0.210 19880
4427 1 18 . 1 1 36 36 SER H H 36 7.669 7.669 8.478 -0.809 19880
4428 1 18 . 1 1 37 37 ASN N N 37 117.050 117.050 116.286 0.764 19880
4429 1 18 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.881 -0.473 19880
4430 1 18 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.446 -0.360 19880
4431 1 18 . 1 1 37 37 ASN CB C 37 41.374 41.374 41.038 0.336 19880
4432 1 18 . 1 1 37 37 ASN H H 37 7.755 7.755 7.513 0.242 19880
4433 1 18 . 1 1 38 38 ALA N N 38 123.735 123.735 120.359 3.376 19880
4434 1 18 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.954 0.208 19880
4435 1 18 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.503 0.631 19880
4436 1 18 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.041 -2.848 19880
4437 1 18 . 1 1 38 38 ALA H H 38 9.323 9.323 8.304 1.019 19880
4438 1 18 . 1 1 39 39 GLN N N 39 116.531 116.531 117.432 -0.901 19880
4439 1 18 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.717 -0.404 19880
4440 1 18 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.186 0.563 19880
4441 1 18 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.167 1.650 19880
4442 1 18 . 1 1 39 39 GLN H H 39 8.746 8.746 8.979 -0.233 19880
4443 1 18 . 1 1 40 40 CYS N N 40 122.074 122.074 120.205 1.869 19880
4444 1 18 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.526 0.023 19880
4445 1 18 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.661 -3.248 19880
4446 1 18 . 1 1 40 40 CYS CB C 40 40.902 40.902 28.547 12.355 19880
4447 1 18 . 1 1 40 40 CYS H H 40 8.536 8.536 8.700 -0.164 19880
4448 1 18 . 1 1 41 41 THR N N 41 117.753 117.753 115.104 2.649 19880
4449 1 18 . 1 1 41 41 THR HA H 41 4.641 4.641 4.609 0.032 19880
4450 1 18 . 1 1 41 41 THR CA C 41 60.550 60.550 60.092 0.458 19880
4451 1 18 . 1 1 41 41 THR CB C 41 71.033 71.033 71.109 -0.076 19880
4452 1 18 . 1 1 41 41 THR H H 41 9.779 9.779 9.040 0.739 19880
4453 1 18 . 1 1 42 42 GLY N N 42 105.809 105.809 108.016 -2.207 19880
4454 1 18 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.893 -0.878 19880
4455 1 18 . 1 1 42 42 GLY H H 42 8.247 8.247 8.181 0.066 19880
4456 1 18 . 1 1 43 43 PHE N N 43 123.293 123.293 120.939 2.354 19880
4457 1 18 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.543 -0.245 19880
4458 1 18 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.431 0.765 19880
4459 1 18 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.441 -0.791 19880
4460 1 18 . 1 1 43 43 PHE H H 43 8.707 8.707 8.903 -0.196 19880
4461 1 18 . 1 1 44 44 LEU N N 44 120.771 120.771 117.344 3.427 19880
4462 1 18 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.367 -0.519 19880
4463 1 18 . 1 1 44 44 LEU CB C 44 40.386 40.386 43.146 -2.760 19880
4464 1 18 . 1 1 44 44 LEU H H 44 8.645 8.645 7.703 0.942 19880
4465 1 18 . 1 1 45 45 GLY N N 45 107.545 107.545 108.488 -0.943 19880
4466 1 18 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.962 1.349 19880
4467 1 18 . 1 1 45 45 GLY H H 45 7.831 7.831 7.527 0.304 19880
4468 1 18 . 1 1 46 46 THR N N 46 104.485 104.485 109.495 -5.010 19880
4469 1 18 . 1 1 46 46 THR HA H 46 3.901 3.901 4.162 -0.261 19880
4470 1 18 . 1 1 46 46 THR CA C 46 62.180 62.180 62.736 -0.556 19880
4471 1 18 . 1 1 46 46 THR CB C 46 70.021 70.021 69.264 0.756 19880
4472 1 18 . 1 1 46 46 THR H H 46 6.823 6.823 7.751 -0.928 19880
4473 1 18 . 1 1 47 47 THR N N 47 123.300 123.300 118.115 5.185 19880
4474 1 18 . 1 1 47 47 THR HA H 47 4.371 4.371 5.063 -0.692 19880
4475 1 18 . 1 1 47 47 THR CA C 47 62.843 62.843 61.618 1.225 19880
4476 1 18 . 1 1 47 47 THR CB C 47 70.176 70.176 72.429 -2.253 19880
4477 1 18 . 1 1 47 47 THR H H 47 8.763 8.763 7.700 1.063 19880
4478 1 18 . 1 1 48 48 CYS N N 48 128.024 128.024 124.626 3.398 19880
4479 1 18 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.934 0.039 19880
4480 1 18 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.117 -1.133 19880
4481 1 18 . 1 1 48 48 CYS CB C 48 36.282 36.282 28.619 7.662 19880
4482 1 18 . 1 1 48 48 CYS H H 48 9.276 9.276 8.835 0.441 19880
4483 1 18 . 1 1 49 49 THR N N 49 131.810 131.810 121.560 10.250 19880
4484 1 18 . 1 1 49 49 THR HA H 49 4.364 4.364 4.700 -0.336 19880
4485 1 18 . 1 1 49 49 THR CA C 49 61.871 61.871 61.624 0.247 19880
4486 1 18 . 1 1 49 49 THR CB C 49 69.789 69.789 72.702 -2.913 19880
4487 1 18 . 1 1 49 49 THR H H 49 9.194 9.194 8.889 0.305 19880
4488 1 18 . 1 1 50 50 CYS N N 50 123.835 123.835 121.592 2.243 19880
4489 1 18 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.100 -0.065 19880
4490 1 18 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.154 -6.274 19880
4491 1 18 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.423 5.511 19880
4492 1 18 . 1 1 50 50 CYS H H 50 8.879 8.879 8.637 0.242 19880
4493 1 18 . 1 1 51 51 ILE N N 51 123.986 123.986 122.356 1.630 19880
4494 1 18 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.356 -0.213 19880
4495 1 18 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.245 0.374 19880
4496 1 18 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.957 -0.577 19880
4497 1 18 . 1 1 51 51 ILE H H 51 8.098 8.098 8.815 -0.717 19880
4498 1 18 . 1 1 52 52 ASN N N 52 126.122 126.122 125.204 0.918 19880
4499 1 18 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.871 -0.155 19880
4500 1 18 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.598 1.293 19880
4501 1 18 . 1 1 52 52 ASN CB C 52 37.913 37.913 37.917 -0.004 19880
4502 1 18 . 1 1 52 52 ASN H H 52 8.323 8.323 8.610 -0.287 19880
4503 1 18 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.532 -0.225 19880
4504 1 18 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.395 0.638 19880
4505 1 18 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.772 3.088 19880
4506 1 18 . 1 1 54 54 CYS N N 54 123.090 123.090 117.641 5.449 19880
4507 1 18 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.090 0.646 19880
4508 1 18 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.859 -2.709 19880
4509 1 18 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.867 19.287 19880
4510 1 18 . 1 1 54 54 CYS H H 54 8.865 8.865 8.466 0.399 19880
4511 1 18 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.451 -0.165 19880
4512 1 18 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.745 -0.486 19880
4513 1 18 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.355 0.095 19880
4514 1 18 . 1 1 56 56 ARG N N 56 117.289 117.289 118.038 -0.749 19880
4515 1 18 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.447 0.038 19880
4516 1 18 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.828 -0.707 19880
4517 1 18 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.239 -0.701 19880
4518 1 18 . 1 1 56 56 ARG H H 56 7.902 7.902 8.413 -0.511 19880
4519 1 19 . 1 1 3 3 CYS N N 3 117.561 117.561 116.092 1.469 19880
4520 1 19 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.231 -0.411 19880
4521 1 19 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.855 -3.155 19880
4522 1 19 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.378 20.273 19880
4523 1 19 . 1 1 3 3 CYS H H 3 7.950 7.950 8.473 -0.523 19880
4524 1 19 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.577 -0.072 19880
4525 1 19 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.787 0.943 19880
4526 1 19 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.844 0.455 19880
4527 1 19 . 1 1 5 5 THR N N 5 118.207 118.207 115.673 2.534 19880
4528 1 19 . 1 1 5 5 THR HA H 5 4.814 4.814 4.723 0.091 19880
4529 1 19 . 1 1 5 5 THR CA C 5 61.618 61.618 62.014 -0.396 19880
4530 1 19 . 1 1 5 5 THR CB C 5 70.257 70.257 69.700 0.557 19880
4531 1 19 . 1 1 5 5 THR H H 5 8.529 8.529 8.338 0.191 19880
4532 1 19 . 1 1 6 6 ARG N N 6 123.211 123.211 125.300 -2.089 19880
4533 1 19 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.608 -0.080 19880
4534 1 19 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.242 -0.311 19880
4535 1 19 . 1 1 6 6 ARG CB C 6 32.752 32.752 33.328 -0.576 19880
4536 1 19 . 1 1 6 6 ARG H H 6 7.693 7.693 8.549 -0.856 19880
4537 1 19 . 1 1 7 7 ARG N N 7 121.558 121.558 122.423 -0.865 19880
4538 1 19 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.603 0.063 19880
4539 1 19 . 1 1 7 7 ARG CA C 7 54.415 54.415 54.619 -0.204 19880
4540 1 19 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.714 -0.041 19880
4541 1 19 . 1 1 7 7 ARG H H 7 8.450 8.450 8.040 0.410 19880
4542 1 19 . 1 1 8 8 GLY N N 8 111.006 111.006 108.178 2.828 19880
4543 1 19 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.734 0.919 19880
4544 1 19 . 1 1 8 8 GLY H H 8 9.382 9.382 8.700 0.682 19880
4545 1 19 . 1 1 9 9 LEU N N 9 119.202 119.202 118.487 0.715 19880
4546 1 19 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.011 -0.121 19880
4547 1 19 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.936 0.818 19880
4548 1 19 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.614 1.156 19880
4549 1 19 . 1 1 9 9 LEU H H 9 8.215 8.215 8.048 0.167 19880
4550 1 19 . 1 1 10 10 CYS N N 10 115.050 115.050 114.051 0.999 19880
4551 1 19 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.274 -0.384 19880
4552 1 19 . 1 1 10 10 CYS CA C 10 61.378 61.378 59.514 1.864 19880
4553 1 19 . 1 1 10 10 CYS CB C 10 42.589 42.589 24.914 17.675 19880
4554 1 19 . 1 1 10 10 CYS H H 10 9.282 9.282 8.295 0.987 19880
4555 1 19 . 1 1 11 11 VAL N N 11 117.792 117.792 118.638 -0.846 19880
4556 1 19 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.329 -0.558 19880
4557 1 19 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.083 0.425 19880
4558 1 19 . 1 1 11 11 VAL CB C 11 32.598 32.598 31.961 0.637 19880
4559 1 19 . 1 1 11 11 VAL H H 11 7.315 7.315 8.171 -0.856 19880
4560 1 19 . 1 1 12 12 THR N N 12 109.816 109.816 113.430 -3.614 19880
4561 1 19 . 1 1 12 12 THR HA H 12 4.044 4.044 4.467 -0.423 19880
4562 1 19 . 1 1 12 12 THR CA C 12 63.575 63.575 63.329 0.246 19880
4563 1 19 . 1 1 12 12 THR CB C 12 69.400 69.400 69.784 -0.384 19880
4564 1 19 . 1 1 12 12 THR H H 12 8.214 8.214 7.635 0.579 19880
4565 1 19 . 1 1 13 13 SER N N 13 114.455 114.455 114.541 -0.086 19880
4566 1 19 . 1 1 13 13 SER HA H 13 4.607 4.607 4.750 -0.143 19880
4567 1 19 . 1 1 13 13 SER CA C 13 59.460 59.460 58.885 0.575 19880
4568 1 19 . 1 1 13 13 SER CB C 13 64.586 64.586 66.353 -1.767 19880
4569 1 19 . 1 1 13 13 SER H H 13 7.511 7.511 7.878 -0.367 19880
4570 1 19 . 1 1 14 14 GLY N N 14 109.125 109.125 109.541 -0.416 19880
4571 1 19 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.597 -0.273 19880
4572 1 19 . 1 1 14 14 GLY H H 14 8.376 8.376 8.019 0.357 19880
4573 1 19 . 1 1 15 15 LEU N N 15 120.782 120.782 121.545 -0.763 19880
4574 1 19 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.212 -0.276 19880
4575 1 19 . 1 1 15 15 LEU CA C 15 57.986 57.986 56.992 0.994 19880
4576 1 19 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.009 -0.483 19880
4577 1 19 . 1 1 15 15 LEU H H 15 8.469 8.469 8.629 -0.160 19880
4578 1 19 . 1 1 16 16 THR N N 16 115.887 115.887 114.220 1.667 19880
4579 1 19 . 1 1 16 16 THR HA H 16 3.602 3.602 3.957 -0.355 19880
4580 1 19 . 1 1 16 16 THR CA C 16 67.196 67.196 66.356 0.840 19880
4581 1 19 . 1 1 16 16 THR CB C 16 68.003 68.003 68.124 -0.121 19880
4582 1 19 . 1 1 16 16 THR H H 16 8.487 8.487 8.351 0.136 19880
4583 1 19 . 1 1 17 17 ALA N N 17 122.643 122.643 123.372 -0.729 19880
4584 1 19 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.343 -0.330 19880
4585 1 19 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.539 0.302 19880
4586 1 19 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.097 0.834 19880
4587 1 19 . 1 1 17 17 ALA H H 17 7.609 7.609 7.718 -0.109 19880
4588 1 19 . 1 1 18 18 CYS N N 18 118.252 118.252 118.615 -0.363 19880
4589 1 19 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.219 0.034 19880
4590 1 19 . 1 1 18 18 CYS CA C 18 58.453 58.453 61.109 -2.656 19880
4591 1 19 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.232 12.414 19880
4592 1 19 . 1 1 18 18 CYS H H 18 7.644 7.644 7.732 -0.088 19880
4593 1 19 . 1 1 19 19 ARG N N 19 120.422 120.422 120.296 0.126 19880
4594 1 19 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.090 -0.615 19880
4595 1 19 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.628 0.924 19880
4596 1 19 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.390 -0.589 19880
4597 1 19 . 1 1 19 19 ARG H H 19 9.072 9.072 8.520 0.552 19880
4598 1 19 . 1 1 20 20 ASN N N 20 117.466 117.466 115.862 1.604 19880
4599 1 19 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.556 -0.344 19880
4600 1 19 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.297 0.314 19880
4601 1 19 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.315 -1.060 19880
4602 1 19 . 1 1 20 20 ASN H H 20 8.411 8.411 7.858 0.553 19880
4603 1 19 . 1 1 21 21 HIS N N 21 120.420 120.420 117.633 2.787 19880
4604 1 19 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.489 -0.315 19880
4605 1 19 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.207 -0.053 19880
4606 1 19 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.846 0.742 19880
4607 1 19 . 1 1 21 21 HIS H H 21 7.827 7.827 7.711 0.116 19880
4608 1 19 . 1 1 22 22 CYS N N 22 117.510 117.510 117.907 -0.397 19880
4609 1 19 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.239 -1.080 19880
4610 1 19 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.944 -3.723 19880
4611 1 19 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.328 10.850 19880
4612 1 19 . 1 1 22 22 CYS H H 22 8.500 8.500 7.845 0.655 19880
4613 1 19 . 1 1 23 23 ARG N N 23 116.564 116.564 116.819 -0.255 19880
4614 1 19 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.635 0.018 19880
4615 1 19 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.666 0.362 19880
4616 1 19 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.429 0.226 19880
4617 1 19 . 1 1 23 23 ARG H H 23 7.985 7.985 7.840 0.145 19880
4618 1 19 . 1 1 24 24 SER N N 24 116.727 116.727 113.111 3.616 19880
4619 1 19 . 1 1 24 24 SER HA H 24 4.552 4.552 4.596 -0.044 19880
4620 1 19 . 1 1 24 24 SER CA C 24 57.592 57.592 56.554 1.038 19880
4621 1 19 . 1 1 24 24 SER CB C 24 65.284 65.284 66.747 -1.463 19880
4622 1 19 . 1 1 24 24 SER H H 24 7.435 7.435 7.414 0.021 19880
4623 1 19 . 1 1 25 25 CYS N N 25 121.909 121.909 120.709 1.200 19880
4624 1 19 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.825 -0.189 19880
4625 1 19 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.584 -1.970 19880
4626 1 19 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.012 13.261 19880
4627 1 19 . 1 1 25 25 CYS H H 25 9.000 9.000 8.879 0.121 19880
4628 1 19 . 1 1 26 26 HIS N N 26 126.609 126.609 120.622 5.987 19880
4629 1 19 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.227 -0.275 19880
4630 1 19 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.154 0.568 19880
4631 1 19 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.744 0.356 19880
4632 1 19 . 1 1 26 26 HIS H H 26 9.255 9.255 8.864 0.391 19880
4633 1 19 . 1 1 27 27 ARG N N 27 122.033 122.033 121.388 0.645 19880
4634 1 19 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.301 -0.279 19880
4635 1 19 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.479 1.998 19880
4636 1 19 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.235 -0.355 19880
4637 1 19 . 1 1 27 27 ARG H H 27 8.314 8.314 8.226 0.088 19880
4638 1 19 . 1 1 28 28 GLY N N 28 119.213 119.213 114.269 4.944 19880
4639 1 19 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.723 -0.751 19880
4640 1 19 . 1 1 28 28 GLY H H 28 8.495 8.495 8.026 0.469 19880
4641 1 19 . 1 1 29 29 ASP N N 29 121.258 121.258 118.503 2.755 19880
4642 1 19 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.592 -0.328 19880
4643 1 19 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.715 1.731 19880
4644 1 19 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.082 -0.644 19880
4645 1 19 . 1 1 29 29 ASP H H 29 8.646 8.646 8.318 0.328 19880
4646 1 19 . 1 1 30 30 VAL N N 30 112.703 112.703 116.575 -3.872 19880
4647 1 19 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.255 -0.032 19880
4648 1 19 . 1 1 30 30 VAL CA C 30 61.407 61.407 61.272 0.135 19880
4649 1 19 . 1 1 30 30 VAL CB C 30 32.905 32.905 32.687 0.218 19880
4650 1 19 . 1 1 30 30 VAL H H 30 8.026 8.026 7.726 0.300 19880
4651 1 19 . 1 1 31 31 GLY N N 31 109.481 109.481 107.376 2.105 19880
4652 1 19 . 1 1 31 31 GLY CA C 31 44.366 44.366 44.855 -0.489 19880
4653 1 19 . 1 1 31 31 GLY H H 31 7.511 7.511 7.509 0.002 19880
4654 1 19 . 1 1 32 32 CYS N N 32 121.673 121.673 120.770 0.903 19880
4655 1 19 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.036 -0.090 19880
4656 1 19 . 1 1 32 32 CYS CA C 32 54.181 54.181 59.208 -5.027 19880
4657 1 19 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.434 14.862 19880
4658 1 19 . 1 1 32 32 CYS H H 32 8.554 8.554 8.601 -0.047 19880
4659 1 19 . 1 1 33 33 VAL N N 33 119.401 119.401 118.389 1.012 19880
4660 1 19 . 1 1 33 33 VAL HA H 33 4.795 4.795 5.004 -0.209 19880
4661 1 19 . 1 1 33 33 VAL CA C 33 59.311 59.311 59.841 -0.530 19880
4662 1 19 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.678 0.802 19880
4663 1 19 . 1 1 33 33 VAL H H 33 9.025 9.025 9.027 -0.002 19880
4664 1 19 . 1 1 34 34 ARG N N 34 120.394 120.394 115.909 4.485 19880
4665 1 19 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.833 -0.134 19880
4666 1 19 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.249 0.943 19880
4667 1 19 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.211 -0.073 19880
4668 1 19 . 1 1 34 34 ARG H H 34 8.350 8.350 8.613 -0.263 19880
4669 1 19 . 1 1 35 35 CYS N N 35 118.098 118.098 119.492 -1.394 19880
4670 1 19 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.509 0.542 19880
4671 1 19 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.541 -2.264 19880
4672 1 19 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.592 12.961 19880
4673 1 19 . 1 1 35 35 CYS H H 35 8.567 8.567 9.022 -0.455 19880
4674 1 19 . 1 1 36 36 SER N N 36 114.009 114.009 115.833 -1.824 19880
4675 1 19 . 1 1 36 36 SER HA H 36 4.326 4.326 4.536 -0.210 19880
4676 1 19 . 1 1 36 36 SER CA C 36 60.945 60.945 59.550 1.395 19880
4677 1 19 . 1 1 36 36 SER CB C 36 64.743 64.743 63.867 0.876 19880
4678 1 19 . 1 1 36 36 SER H H 36 7.669 7.669 8.405 -0.736 19880
4679 1 19 . 1 1 37 37 ASN N N 37 117.050 117.050 115.878 1.172 19880
4680 1 19 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.895 -0.487 19880
4681 1 19 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.430 -0.344 19880
4682 1 19 . 1 1 37 37 ASN CB C 37 41.374 41.374 41.062 0.312 19880
4683 1 19 . 1 1 37 37 ASN H H 37 7.755 7.755 7.484 0.271 19880
4684 1 19 . 1 1 38 38 ALA N N 38 123.735 123.735 120.332 3.403 19880
4685 1 19 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.945 0.217 19880
4686 1 19 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.544 0.590 19880
4687 1 19 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.020 -2.827 19880
4688 1 19 . 1 1 38 38 ALA H H 38 9.323 9.323 8.296 1.027 19880
4689 1 19 . 1 1 39 39 GLN N N 39 116.531 116.531 116.444 0.087 19880
4690 1 19 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.802 -0.489 19880
4691 1 19 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.228 0.520 19880
4692 1 19 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.317 1.500 19880
4693 1 19 . 1 1 39 39 GLN H H 39 8.746 8.746 8.782 -0.036 19880
4694 1 19 . 1 1 40 40 CYS N N 40 122.074 122.074 120.891 1.183 19880
4695 1 19 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.384 0.165 19880
4696 1 19 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.969 -3.556 19880
4697 1 19 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.371 13.531 19880
4698 1 19 . 1 1 40 40 CYS H H 40 8.536 8.536 8.719 -0.183 19880
4699 1 19 . 1 1 41 41 THR N N 41 117.753 117.753 116.060 1.693 19880
4700 1 19 . 1 1 41 41 THR HA H 41 4.641 4.641 4.674 -0.033 19880
4701 1 19 . 1 1 41 41 THR CA C 41 60.550 60.550 60.128 0.422 19880
4702 1 19 . 1 1 41 41 THR CB C 41 71.033 71.033 71.409 -0.376 19880
4703 1 19 . 1 1 41 41 THR H H 41 9.779 9.779 8.901 0.878 19880
4704 1 19 . 1 1 42 42 GLY N N 42 105.809 105.809 108.469 -2.660 19880
4705 1 19 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.984 -0.969 19880
4706 1 19 . 1 1 42 42 GLY H H 42 8.247 8.247 8.180 0.067 19880
4707 1 19 . 1 1 43 43 PHE N N 43 123.293 123.293 120.908 2.385 19880
4708 1 19 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.564 -0.266 19880
4709 1 19 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.407 0.789 19880
4710 1 19 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.487 -0.837 19880
4711 1 19 . 1 1 43 43 PHE H H 43 8.707 8.707 8.888 -0.181 19880
4712 1 19 . 1 1 44 44 LEU N N 44 120.771 120.771 117.494 3.277 19880
4713 1 19 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.369 -0.521 19880
4714 1 19 . 1 1 44 44 LEU CB C 44 40.386 40.386 43.079 -2.693 19880
4715 1 19 . 1 1 44 44 LEU H H 44 8.645 8.645 7.722 0.923 19880
4716 1 19 . 1 1 45 45 GLY N N 45 107.545 107.545 108.324 -0.779 19880
4717 1 19 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.987 1.324 19880
4718 1 19 . 1 1 45 45 GLY H H 45 7.831 7.831 7.525 0.306 19880
4719 1 19 . 1 1 46 46 THR N N 46 104.485 104.485 109.545 -5.060 19880
4720 1 19 . 1 1 46 46 THR HA H 46 3.901 3.901 4.165 -0.264 19880
4721 1 19 . 1 1 46 46 THR CA C 46 62.180 62.180 63.357 -1.177 19880
4722 1 19 . 1 1 46 46 THR CB C 46 70.021 70.021 69.070 0.951 19880
4723 1 19 . 1 1 46 46 THR H H 46 6.823 6.823 7.796 -0.973 19880
4724 1 19 . 1 1 47 47 THR N N 47 123.300 123.300 117.429 5.871 19880
4725 1 19 . 1 1 47 47 THR HA H 47 4.371 4.371 4.618 -0.247 19880
4726 1 19 . 1 1 47 47 THR CA C 47 62.843 62.843 61.415 1.428 19880
4727 1 19 . 1 1 47 47 THR CB C 47 70.176 70.176 72.132 -1.956 19880
4728 1 19 . 1 1 47 47 THR H H 47 8.763 8.763 7.799 0.964 19880
4729 1 19 . 1 1 48 48 CYS N N 48 128.024 128.024 124.217 3.807 19880
4730 1 19 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.977 -0.004 19880
4731 1 19 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.303 -1.319 19880
4732 1 19 . 1 1 48 48 CYS CB C 48 36.282 36.282 30.166 6.116 19880
4733 1 19 . 1 1 48 48 CYS H H 48 9.276 9.276 8.681 0.595 19880
4734 1 19 . 1 1 49 49 THR N N 49 131.810 131.810 121.385 10.425 19880
4735 1 19 . 1 1 49 49 THR HA H 49 4.364 4.364 4.720 -0.356 19880
4736 1 19 . 1 1 49 49 THR CA C 49 61.871 61.871 62.176 -0.305 19880
4737 1 19 . 1 1 49 49 THR CB C 49 69.789 69.789 72.917 -3.128 19880
4738 1 19 . 1 1 49 49 THR H H 49 9.194 9.194 8.821 0.373 19880
4739 1 19 . 1 1 50 50 CYS N N 50 123.835 123.835 121.931 1.904 19880
4740 1 19 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.026 0.009 19880
4741 1 19 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.357 -6.477 19880
4742 1 19 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.580 5.354 19880
4743 1 19 . 1 1 50 50 CYS H H 50 8.879 8.879 8.631 0.248 19880
4744 1 19 . 1 1 51 51 ILE N N 51 123.986 123.986 123.096 0.890 19880
4745 1 19 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.416 -0.273 19880
4746 1 19 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.115 0.504 19880
4747 1 19 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.695 -0.315 19880
4748 1 19 . 1 1 51 51 ILE H H 51 8.098 8.098 8.952 -0.854 19880
4749 1 19 . 1 1 52 52 ASN N N 52 126.122 126.122 124.738 1.384 19880
4750 1 19 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.797 -0.081 19880
4751 1 19 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.275 1.616 19880
4752 1 19 . 1 1 52 52 ASN CB C 52 37.913 37.913 37.626 0.287 19880
4753 1 19 . 1 1 52 52 ASN H H 52 8.323 8.323 8.552 -0.229 19880
4754 1 19 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.486 -0.179 19880
4755 1 19 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.343 0.690 19880
4756 1 19 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.730 3.131 19880
4757 1 19 . 1 1 54 54 CYS N N 54 123.090 123.090 117.673 5.417 19880
4758 1 19 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.131 0.605 19880
4759 1 19 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.846 -2.696 19880
4760 1 19 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.789 19.365 19880
4761 1 19 . 1 1 54 54 CYS H H 54 8.865 8.865 8.469 0.396 19880
4762 1 19 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.428 -0.142 19880
4763 1 19 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.693 -0.435 19880
4764 1 19 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.269 0.181 19880
4765 1 19 . 1 1 56 56 ARG N N 56 117.289 117.289 117.312 -0.023 19880
4766 1 19 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.557 -0.072 19880
4767 1 19 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.051 0.070 19880
4768 1 19 . 1 1 56 56 ARG CB C 56 30.539 30.539 30.674 -0.135 19880
4769 1 19 . 1 1 56 56 ARG H H 56 7.902 7.902 8.461 -0.559 19880
4770 1 20 . 1 1 3 3 CYS N N 3 117.561 117.561 116.843 0.718 19880
4771 1 20 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.299 -0.479 19880
4772 1 20 . 1 1 3 3 CYS CA C 3 52.700 52.700 54.971 -2.271 19880
4773 1 20 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.619 20.032 19880
4774 1 20 . 1 1 3 3 CYS H H 3 7.950 7.950 7.983 -0.033 19880
4775 1 20 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.603 -0.098 19880
4776 1 20 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.773 0.957 19880
4777 1 20 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.928 0.371 19880
4778 1 20 . 1 1 5 5 THR N N 5 118.207 118.207 115.995 2.212 19880
4779 1 20 . 1 1 5 5 THR HA H 5 4.814 4.814 4.672 0.142 19880
4780 1 20 . 1 1 5 5 THR CA C 5 61.618 61.618 62.075 -0.457 19880
4781 1 20 . 1 1 5 5 THR CB C 5 70.257 70.257 69.793 0.464 19880
4782 1 20 . 1 1 5 5 THR H H 5 8.529 8.529 8.374 0.155 19880
4783 1 20 . 1 1 6 6 ARG N N 6 123.211 123.211 125.955 -2.744 19880
4784 1 20 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.723 -0.195 19880
4785 1 20 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.156 -0.225 19880
4786 1 20 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.877 -0.125 19880
4787 1 20 . 1 1 6 6 ARG H H 6 7.693 7.693 8.646 -0.953 19880
4788 1 20 . 1 1 7 7 ARG N N 7 121.558 121.558 121.776 -0.218 19880
4789 1 20 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.577 0.089 19880
4790 1 20 . 1 1 7 7 ARG CA C 7 54.415 54.415 54.338 0.077 19880
4791 1 20 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.772 -0.099 19880
4792 1 20 . 1 1 7 7 ARG H H 7 8.450 8.450 8.035 0.415 19880
4793 1 20 . 1 1 8 8 GLY N N 8 111.006 111.006 107.972 3.034 19880
4794 1 20 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.804 0.849 19880
4795 1 20 . 1 1 8 8 GLY H H 8 9.382 9.382 8.705 0.677 19880
4796 1 20 . 1 1 9 9 LEU N N 9 119.202 119.202 118.524 0.678 19880
4797 1 20 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.095 -0.205 19880
4798 1 20 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.660 1.094 19880
4799 1 20 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.606 1.164 19880
4800 1 20 . 1 1 9 9 LEU H H 9 8.215 8.215 8.069 0.146 19880
4801 1 20 . 1 1 10 10 CYS N N 10 115.050 115.050 114.721 0.329 19880
4802 1 20 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.422 -0.532 19880
4803 1 20 . 1 1 10 10 CYS CA C 10 61.378 61.378 59.994 1.384 19880
4804 1 20 . 1 1 10 10 CYS CB C 10 42.589 42.589 24.891 17.698 19880
4805 1 20 . 1 1 10 10 CYS H H 10 9.282 9.282 8.364 0.918 19880
4806 1 20 . 1 1 11 11 VAL N N 11 117.792 117.792 119.960 -2.168 19880
4807 1 20 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.190 -0.419 19880
4808 1 20 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.717 -0.209 19880
4809 1 20 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.233 0.365 19880
4810 1 20 . 1 1 11 11 VAL H H 11 7.315 7.315 8.343 -1.028 19880
4811 1 20 . 1 1 12 12 THR N N 12 109.816 109.816 112.681 -2.865 19880
4812 1 20 . 1 1 12 12 THR HA H 12 4.044 4.044 4.313 -0.269 19880
4813 1 20 . 1 1 12 12 THR CA C 12 63.575 63.575 64.230 -0.655 19880
4814 1 20 . 1 1 12 12 THR CB C 12 69.400 69.400 69.570 -0.170 19880
4815 1 20 . 1 1 12 12 THR H H 12 8.214 8.214 7.830 0.384 19880
4816 1 20 . 1 1 13 13 SER N N 13 114.455 114.455 116.111 -1.656 19880
4817 1 20 . 1 1 13 13 SER HA H 13 4.607 4.607 4.551 0.056 19880
4818 1 20 . 1 1 13 13 SER CA C 13 59.460 59.460 58.496 0.964 19880
4819 1 20 . 1 1 13 13 SER CB C 13 64.586 64.586 64.431 0.155 19880
4820 1 20 . 1 1 13 13 SER H H 13 7.511 7.511 7.656 -0.145 19880
4821 1 20 . 1 1 14 14 GLY N N 14 109.125 109.125 109.645 -0.520 19880
4822 1 20 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.575 -0.251 19880
4823 1 20 . 1 1 14 14 GLY H H 14 8.376 8.376 8.141 0.235 19880
4824 1 20 . 1 1 15 15 LEU N N 15 120.782 120.782 121.986 -1.204 19880
4825 1 20 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.227 -0.291 19880
4826 1 20 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.277 0.709 19880
4827 1 20 . 1 1 15 15 LEU CB C 15 41.526 41.526 41.990 -0.464 19880
4828 1 20 . 1 1 15 15 LEU H H 15 8.469 8.469 8.669 -0.200 19880
4829 1 20 . 1 1 16 16 THR N N 16 115.887 115.887 114.455 1.432 19880
4830 1 20 . 1 1 16 16 THR HA H 16 3.602 3.602 3.931 -0.329 19880
4831 1 20 . 1 1 16 16 THR CA C 16 67.196 67.196 67.378 -0.182 19880
4832 1 20 . 1 1 16 16 THR CB C 16 68.003 68.003 68.014 -0.012 19880
4833 1 20 . 1 1 16 16 THR H H 16 8.487 8.487 8.171 0.316 19880
4834 1 20 . 1 1 17 17 ALA N N 17 122.643 122.643 123.193 -0.550 19880
4835 1 20 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.350 -0.336 19880
4836 1 20 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.473 0.368 19880
4837 1 20 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.014 0.917 19880
4838 1 20 . 1 1 17 17 ALA H H 17 7.609 7.609 7.688 -0.079 19880
4839 1 20 . 1 1 18 18 CYS N N 18 118.252 118.252 118.510 -0.258 19880
4840 1 20 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.240 0.013 19880
4841 1 20 . 1 1 18 18 CYS CA C 18 58.453 58.453 61.065 -2.612 19880
4842 1 20 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.278 12.368 19880
4843 1 20 . 1 1 18 18 CYS H H 18 7.644 7.644 7.762 -0.118 19880
4844 1 20 . 1 1 19 19 ARG N N 19 120.422 120.422 120.373 0.049 19880
4845 1 20 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.091 -0.616 19880
4846 1 20 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.609 0.943 19880
4847 1 20 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.386 -0.585 19880
4848 1 20 . 1 1 19 19 ARG H H 19 9.072 9.072 8.373 0.699 19880
4849 1 20 . 1 1 20 20 ASN N N 20 117.466 117.466 116.535 0.931 19880
4850 1 20 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.574 -0.362 19880
4851 1 20 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.549 0.062 19880
4852 1 20 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.128 -0.873 19880
4853 1 20 . 1 1 20 20 ASN H H 20 8.411 8.411 8.096 0.315 19880
4854 1 20 . 1 1 21 21 HIS N N 21 120.420 120.420 119.922 0.498 19880
4855 1 20 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.771 -0.597 19880
4856 1 20 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.233 -0.079 19880
4857 1 20 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.313 1.275 19880
4858 1 20 . 1 1 21 21 HIS H H 21 7.827 7.827 7.733 0.094 19880
4859 1 20 . 1 1 22 22 CYS N N 22 117.510 117.510 118.470 -0.960 19880
4860 1 20 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.340 -1.181 19880
4861 1 20 . 1 1 22 22 CYS CA C 22 58.221 58.221 62.134 -3.913 19880
4862 1 20 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.196 10.982 19880
4863 1 20 . 1 1 22 22 CYS H H 22 8.500 8.500 7.856 0.644 19880
4864 1 20 . 1 1 23 23 ARG N N 23 116.564 116.564 118.574 -2.010 19880
4865 1 20 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.655 -0.002 19880
4866 1 20 . 1 1 23 23 ARG CA C 23 57.028 57.028 57.534 -0.506 19880
4867 1 20 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.987 -0.332 19880
4868 1 20 . 1 1 23 23 ARG H H 23 7.985 7.985 8.213 -0.228 19880
4869 1 20 . 1 1 24 24 SER N N 24 116.727 116.727 113.126 3.601 19880
4870 1 20 . 1 1 24 24 SER HA H 24 4.552 4.552 4.705 -0.153 19880
4871 1 20 . 1 1 24 24 SER CA C 24 57.592 57.592 56.396 1.196 19880
4872 1 20 . 1 1 24 24 SER CB C 24 65.284 65.284 65.409 -0.125 19880
4873 1 20 . 1 1 24 24 SER H H 24 7.435 7.435 7.307 0.128 19880
4874 1 20 . 1 1 25 25 CYS N N 25 121.909 121.909 121.787 0.122 19880
4875 1 20 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.670 -0.034 19880
4876 1 20 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.267 -1.653 19880
4877 1 20 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.523 12.750 19880
4878 1 20 . 1 1 25 25 CYS H H 25 9.000 9.000 8.752 0.248 19880
4879 1 20 . 1 1 26 26 HIS N N 26 126.609 126.609 123.629 2.980 19880
4880 1 20 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.321 -0.369 19880
4881 1 20 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.382 0.340 19880
4882 1 20 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.697 0.403 19880
4883 1 20 . 1 1 26 26 HIS H H 26 9.255 9.255 8.771 0.484 19880
4884 1 20 . 1 1 27 27 ARG N N 27 122.033 122.033 121.468 0.565 19880
4885 1 20 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.290 -0.268 19880
4886 1 20 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.796 1.681 19880
4887 1 20 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.610 -0.730 19880
4888 1 20 . 1 1 27 27 ARG H H 27 8.314 8.314 8.123 0.191 19880
4889 1 20 . 1 1 28 28 GLY N N 28 119.213 119.213 113.070 6.143 19880
4890 1 20 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.546 -0.574 19880
4891 1 20 . 1 1 28 28 GLY H H 28 8.495 8.495 7.865 0.630 19880
4892 1 20 . 1 1 29 29 ASP N N 29 121.258 121.258 119.303 1.955 19880
4893 1 20 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.614 -0.350 19880
4894 1 20 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.250 2.196 19880
4895 1 20 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.952 -1.514 19880
4896 1 20 . 1 1 29 29 ASP H H 29 8.646 8.646 8.341 0.305 19880
4897 1 20 . 1 1 30 30 VAL N N 30 112.703 112.703 117.142 -4.439 19880
4898 1 20 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.215 0.008 19880
4899 1 20 . 1 1 30 30 VAL CA C 30 61.407 61.407 61.996 -0.589 19880
4900 1 20 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.616 -0.711 19880
4901 1 20 . 1 1 30 30 VAL H H 30 8.026 8.026 7.659 0.367 19880
4902 1 20 . 1 1 31 31 GLY N N 31 109.481 109.481 107.661 1.820 19880
4903 1 20 . 1 1 31 31 GLY CA C 31 44.366 44.366 44.987 -0.621 19880
4904 1 20 . 1 1 31 31 GLY H H 31 7.511 7.511 7.613 -0.102 19880
4905 1 20 . 1 1 32 32 CYS N N 32 121.673 121.673 120.009 1.664 19880
4906 1 20 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.043 -0.097 19880
4907 1 20 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.498 -4.317 19880
4908 1 20 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.485 14.811 19880
4909 1 20 . 1 1 32 32 CYS H H 32 8.554 8.554 8.500 0.054 19880
4910 1 20 . 1 1 33 33 VAL N N 33 119.401 119.401 116.619 2.782 19880
4911 1 20 . 1 1 33 33 VAL HA H 33 4.795 4.795 5.029 -0.234 19880
4912 1 20 . 1 1 33 33 VAL CA C 33 59.311 59.311 59.639 -0.328 19880
4913 1 20 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.609 0.871 19880
4914 1 20 . 1 1 33 33 VAL H H 33 9.025 9.025 8.896 0.129 19880
4915 1 20 . 1 1 34 34 ARG N N 34 120.394 120.394 116.996 3.398 19880
4916 1 20 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.758 -0.059 19880
4917 1 20 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.153 1.040 19880
4918 1 20 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.550 -0.412 19880
4919 1 20 . 1 1 34 34 ARG H H 34 8.350 8.350 8.605 -0.255 19880
4920 1 20 . 1 1 35 35 CYS N N 35 118.098 118.098 119.495 -1.397 19880
4921 1 20 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.446 0.605 19880
4922 1 20 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.263 -1.986 19880
4923 1 20 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.577 12.976 19880
4924 1 20 . 1 1 35 35 CYS H H 35 8.567 8.567 9.130 -0.563 19880
4925 1 20 . 1 1 36 36 SER N N 36 114.009 114.009 115.316 -1.307 19880
4926 1 20 . 1 1 36 36 SER HA H 36 4.326 4.326 4.522 -0.196 19880
4927 1 20 . 1 1 36 36 SER CA C 36 60.945 60.945 60.445 0.500 19880
4928 1 20 . 1 1 36 36 SER CB C 36 64.743 64.743 64.210 0.533 19880
4929 1 20 . 1 1 36 36 SER H H 36 7.669 7.669 8.534 -0.865 19880
4930 1 20 . 1 1 37 37 ASN N N 37 117.050 117.050 116.075 0.975 19880
4931 1 20 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.868 -0.460 19880
4932 1 20 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.536 -0.450 19880
4933 1 20 . 1 1 37 37 ASN CB C 37 41.374 41.374 40.921 0.453 19880
4934 1 20 . 1 1 37 37 ASN H H 37 7.755 7.755 7.531 0.224 19880
4935 1 20 . 1 1 38 38 ALA N N 38 123.735 123.735 120.406 3.329 19880
4936 1 20 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.939 0.223 19880
4937 1 20 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.545 0.589 19880
4938 1 20 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.018 -2.825 19880
4939 1 20 . 1 1 38 38 ALA H H 38 9.323 9.323 8.308 1.015 19880
4940 1 20 . 1 1 39 39 GLN N N 39 116.531 116.531 116.382 0.149 19880
4941 1 20 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.808 -0.495 19880
4942 1 20 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.250 0.499 19880
4943 1 20 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.277 1.540 19880
4944 1 20 . 1 1 39 39 GLN H H 39 8.746 8.746 8.823 -0.077 19880
4945 1 20 . 1 1 40 40 CYS N N 40 122.074 122.074 120.605 1.469 19880
4946 1 20 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.438 0.111 19880
4947 1 20 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.867 -3.454 19880
4948 1 20 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.742 13.160 19880
4949 1 20 . 1 1 40 40 CYS H H 40 8.536 8.536 8.708 -0.172 19880
4950 1 20 . 1 1 41 41 THR N N 41 117.753 117.753 116.051 1.702 19880
4951 1 20 . 1 1 41 41 THR HA H 41 4.641 4.641 4.680 -0.039 19880
4952 1 20 . 1 1 41 41 THR CA C 41 60.550 60.550 60.170 0.380 19880
4953 1 20 . 1 1 41 41 THR CB C 41 71.033 71.033 71.409 -0.376 19880
4954 1 20 . 1 1 41 41 THR H H 41 9.779 9.779 8.924 0.855 19880
4955 1 20 . 1 1 42 42 GLY N N 42 105.809 105.809 108.511 -2.702 19880
4956 1 20 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.937 -0.922 19880
4957 1 20 . 1 1 42 42 GLY H H 42 8.247 8.247 8.158 0.089 19880
4958 1 20 . 1 1 43 43 PHE N N 43 123.293 123.293 120.964 2.329 19880
4959 1 20 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.551 -0.253 19880
4960 1 20 . 1 1 43 43 PHE CA C 43 60.196 60.196 59.408 0.788 19880
4961 1 20 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.459 -0.809 19880
4962 1 20 . 1 1 43 43 PHE H H 43 8.707 8.707 8.903 -0.196 19880
4963 1 20 . 1 1 44 44 LEU N N 44 120.771 120.771 118.607 2.164 19880
4964 1 20 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.432 -0.584 19880
4965 1 20 . 1 1 44 44 LEU CB C 44 40.386 40.386 43.073 -2.687 19880
4966 1 20 . 1 1 44 44 LEU H H 44 8.645 8.645 7.722 0.923 19880
4967 1 20 . 1 1 45 45 GLY N N 45 107.545 107.545 109.095 -1.550 19880
4968 1 20 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.840 1.471 19880
4969 1 20 . 1 1 45 45 GLY H H 45 7.831 7.831 7.694 0.137 19880
4970 1 20 . 1 1 46 46 THR N N 46 104.485 104.485 108.931 -4.446 19880
4971 1 20 . 1 1 46 46 THR HA H 46 3.901 3.901 4.168 -0.267 19880
4972 1 20 . 1 1 46 46 THR CA C 46 62.180 62.180 62.516 -0.336 19880
4973 1 20 . 1 1 46 46 THR CB C 46 70.021 70.021 69.324 0.697 19880
4974 1 20 . 1 1 46 46 THR H H 46 6.823 6.823 7.867 -1.044 19880
4975 1 20 . 1 1 47 47 THR N N 47 123.300 123.300 116.583 6.717 19880
4976 1 20 . 1 1 47 47 THR HA H 47 4.371 4.371 4.593 -0.222 19880
4977 1 20 . 1 1 47 47 THR CA C 47 62.843 62.843 60.581 2.262 19880
4978 1 20 . 1 1 47 47 THR CB C 47 70.176 70.176 71.985 -1.809 19880
4979 1 20 . 1 1 47 47 THR H H 47 8.763 8.763 7.751 1.012 19880
4980 1 20 . 1 1 48 48 CYS N N 48 128.024 128.024 123.093 4.931 19880
4981 1 20 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.904 0.069 19880
4982 1 20 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.360 -1.376 19880
4983 1 20 . 1 1 48 48 CYS CB C 48 36.282 36.282 29.317 6.965 19880
4984 1 20 . 1 1 48 48 CYS H H 48 9.276 9.276 8.684 0.592 19880
4985 1 20 . 1 1 49 49 THR N N 49 131.810 131.810 121.811 9.999 19880
4986 1 20 . 1 1 49 49 THR HA H 49 4.364 4.364 4.731 -0.367 19880
4987 1 20 . 1 1 49 49 THR CA C 49 61.871 61.871 62.080 -0.209 19880
4988 1 20 . 1 1 49 49 THR CB C 49 69.789 69.789 72.930 -3.141 19880
4989 1 20 . 1 1 49 49 THR H H 49 9.194 9.194 8.782 0.412 19880
4990 1 20 . 1 1 50 50 CYS N N 50 123.835 123.835 122.062 1.773 19880
4991 1 20 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.043 -0.008 19880
4992 1 20 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.373 -6.493 19880
4993 1 20 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.374 5.560 19880
4994 1 20 . 1 1 50 50 CYS H H 50 8.879 8.879 8.603 0.276 19880
4995 1 20 . 1 1 51 51 ILE N N 51 123.986 123.986 122.762 1.224 19880
4996 1 20 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.423 -0.280 19880
4997 1 20 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.197 0.423 19880
4998 1 20 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.629 -0.249 19880
4999 1 20 . 1 1 51 51 ILE H H 51 8.098 8.098 8.883 -0.785 19880
5000 1 20 . 1 1 52 52 ASN N N 52 126.122 126.122 125.385 0.737 19880
5001 1 20 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.840 -0.124 19880
5002 1 20 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.908 0.983 19880
5003 1 20 . 1 1 52 52 ASN CB C 52 37.913 37.913 38.234 -0.321 19880
5004 1 20 . 1 1 52 52 ASN H H 52 8.323 8.323 8.538 -0.215 19880
5005 1 20 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.463 -0.156 19880
5006 1 20 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.291 0.742 19880
5007 1 20 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.793 3.067 19880
5008 1 20 . 1 1 54 54 CYS N N 54 123.090 123.090 117.125 5.965 19880
5009 1 20 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.157 0.579 19880
5010 1 20 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.904 -2.754 19880
5011 1 20 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.740 19.414 19880
5012 1 20 . 1 1 54 54 CYS H H 54 8.865 8.865 8.493 0.372 19880
5013 1 20 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.487 -0.202 19880
5014 1 20 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.645 -0.388 19880
5015 1 20 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.325 0.125 19880
5016 1 20 . 1 1 56 56 ARG N N 56 117.289 117.289 117.473 -0.184 19880
5017 1 20 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.593 -0.108 19880
5018 1 20 . 1 1 56 56 ARG CA C 56 56.121 56.121 55.995 0.126 19880
5019 1 20 . 1 1 56 56 ARG CB C 56 30.539 30.539 30.849 -0.310 19880
5020 1 20 . 1 1 56 56 ARG H H 56 7.902 7.902 8.430 -0.528 19880
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 51 2.841 -0.893 2.724 19880
2 1 1 "Average Difference" HA 59 0.374 0.132 0.353 19880
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19880
4 1 1 "Average Difference" CA 53 1.726 0.333 1.710 19880
5 1 1 "Average Difference" CB 48 6.839 -3.079 6.171 19880
6 1 1 "Average Difference" HN 51 0.537 -0.131 0.526 19880
7 1 2 "Average Difference" N 51 3.218 -1.127 3.044 19880
8 1 2 "Average Difference" HA 59 0.356 0.129 0.335 19880
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19880
10 1 2 "Average Difference" CA 53 1.762 0.126 1.774 19880
11 1 2 "Average Difference" CB 48 6.774 -2.982 6.147 19880
12 1 2 "Average Difference" HN 51 0.492 -0.097 0.487 19880
13 1 3 "Average Difference" N 51 2.934 -0.768 2.860 19880
14 1 3 "Average Difference" HA 59 0.355 0.119 0.338 19880
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19880
16 1 3 "Average Difference" CA 53 1.767 0.290 1.760 19880
17 1 3 "Average Difference" CB 48 6.817 -2.968 6.202 19880
18 1 3 "Average Difference" HN 51 0.492 -0.107 0.485 19880
19 1 4 "Average Difference" N 51 2.969 -0.926 2.849 19880
20 1 4 "Average Difference" HA 59 0.372 0.167 0.335 19880
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19880
22 1 4 "Average Difference" CA 53 1.694 0.314 1.680 19880
23 1 4 "Average Difference" CB 48 6.768 -2.978 6.142 19880
24 1 4 "Average Difference" HN 51 0.520 -0.122 0.510 19880
25 1 5 "Average Difference" N 51 3.255 -0.881 3.165 19880
26 1 5 "Average Difference" HA 59 0.369 0.137 0.346 19880
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19880
28 1 5 "Average Difference" CA 53 1.727 0.191 1.733 19880
29 1 5 "Average Difference" CB 48 6.735 -2.945 6.121 19880
30 1 5 "Average Difference" HN 51 0.553 -0.132 0.542 19880
31 1 6 "Average Difference" N 51 2.860 -1.098 2.667 19880
32 1 6 "Average Difference" HA 59 0.369 0.158 0.337 19880
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19880
34 1 6 "Average Difference" CA 53 1.634 0.315 1.618 19880
35 1 6 "Average Difference" CB 48 6.629 -2.758 6.092 19880
36 1 6 "Average Difference" HN 51 0.494 -0.091 0.491 19880
37 1 7 "Average Difference" N 51 3.045 -1.083 2.874 19880
38 1 7 "Average Difference" HA 59 0.368 0.153 0.337 19880
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19880
40 1 7 "Average Difference" CA 53 1.704 0.358 1.681 19880
41 1 7 "Average Difference" CB 48 6.782 -2.818 6.234 19880
42 1 7 "Average Difference" HN 51 0.505 -0.104 0.499 19880
43 1 8 "Average Difference" N 51 3.241 -1.011 3.110 19880
44 1 8 "Average Difference" HA 59 0.379 0.158 0.347 19880
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19880
46 1 8 "Average Difference" CA 53 1.675 0.237 1.674 19880
47 1 8 "Average Difference" CB 48 6.774 -2.939 6.168 19880
48 1 8 "Average Difference" HN 51 0.517 -0.116 0.509 19880
49 1 9 "Average Difference" N 51 2.749 -0.849 2.640 19880
50 1 9 "Average Difference" HA 59 0.370 0.148 0.342 19880
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19880
52 1 9 "Average Difference" CA 53 1.726 0.287 1.718 19880
53 1 9 "Average Difference" CB 48 6.849 -2.953 6.244 19880
54 1 9 "Average Difference" HN 51 0.519 -0.081 0.518 19880
55 1 10 "Average Difference" N 51 3.220 -1.124 3.047 19880
56 1 10 "Average Difference" HA 59 0.386 0.166 0.352 19880
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19880
58 1 10 "Average Difference" CA 53 1.690 0.249 1.687 19880
59 1 10 "Average Difference" CB 48 6.743 -2.916 6.145 19880
60 1 10 "Average Difference" HN 51 0.554 -0.148 0.539 19880
61 1 11 "Average Difference" N 51 2.996 -1.066 2.828 19880
62 1 11 "Average Difference" HA 59 0.370 0.168 0.332 19880
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19880
64 1 11 "Average Difference" CA 53 1.715 0.237 1.715 19880
65 1 11 "Average Difference" CB 48 6.810 -2.998 6.179 19880
66 1 11 "Average Difference" HN 51 0.522 -0.103 0.516 19880
67 1 12 "Average Difference" N 51 3.005 -0.789 2.928 19880
68 1 12 "Average Difference" HA 59 0.378 0.162 0.345 19880
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19880
70 1 12 "Average Difference" CA 53 1.642 0.273 1.635 19880
71 1 12 "Average Difference" CB 48 6.756 -2.832 6.199 19880
72 1 12 "Average Difference" HN 51 0.559 -0.095 0.557 19880
73 1 13 "Average Difference" N 51 3.207 -0.836 3.127 19880
74 1 13 "Average Difference" HA 59 0.369 0.133 0.347 19880
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19880
76 1 13 "Average Difference" CA 53 1.759 0.218 1.762 19880
77 1 13 "Average Difference" CB 48 6.830 -3.015 6.194 19880
78 1 13 "Average Difference" HN 51 0.509 -0.117 0.500 19880
79 1 14 "Average Difference" N 51 3.154 -0.853 3.067 19880
80 1 14 "Average Difference" HA 59 0.358 0.132 0.335 19880
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19880
82 1 14 "Average Difference" CA 53 1.770 0.322 1.757 19880
83 1 14 "Average Difference" CB 48 6.815 -2.941 6.213 19880
84 1 14 "Average Difference" HN 51 0.501 -0.093 0.497 19880
85 1 15 "Average Difference" N 51 2.832 -1.023 2.667 19880
86 1 15 "Average Difference" HA 59 0.368 0.162 0.334 19880
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19880
88 1 15 "Average Difference" CA 53 1.638 0.292 1.627 19880
89 1 15 "Average Difference" CB 48 6.741 -2.782 6.206 19880
90 1 15 "Average Difference" HN 51 0.515 -0.097 0.511 19880
91 1 16 "Average Difference" N 51 3.104 -0.976 2.976 19880
92 1 16 "Average Difference" HA 59 0.361 0.127 0.341 19880
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19880
94 1 16 "Average Difference" CA 53 1.798 0.172 1.807 19880
95 1 16 "Average Difference" CB 48 6.816 -2.978 6.196 19880
96 1 16 "Average Difference" HN 51 0.499 -0.096 0.494 19880
97 1 17 "Average Difference" N 51 3.126 -0.729 3.070 19880
98 1 17 "Average Difference" HA 59 0.373 0.144 0.348 19880
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19880
100 1 17 "Average Difference" CA 53 1.732 0.232 1.733 19880
101 1 17 "Average Difference" CB 48 6.719 -2.949 6.101 19880
102 1 17 "Average Difference" HN 51 0.575 -0.068 0.577 19880
103 1 18 "Average Difference" N 51 3.085 -1.167 2.885 19880
104 1 18 "Average Difference" HA 59 0.382 0.165 0.347 19880
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19880
106 1 18 "Average Difference" CA 53 1.679 0.285 1.670 19880
107 1 18 "Average Difference" CB 48 6.794 -2.862 6.227 19880
108 1 18 "Average Difference" HN 51 0.511 -0.129 0.499 19880
109 1 19 "Average Difference" N 51 2.942 -1.162 2.730 19880
110 1 19 "Average Difference" HA 59 0.360 0.144 0.333 19880
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19880
112 1 19 "Average Difference" CA 53 1.749 0.260 1.746 19880
113 1 19 "Average Difference" CB 48 6.832 -2.918 6.243 19880
114 1 19 "Average Difference" HN 51 0.508 -0.114 0.500 19880
115 1 20 "Average Difference" N 51 2.897 -0.925 2.772 19880
116 1 20 "Average Difference" HA 59 0.365 0.164 0.329 19880
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19880
118 1 20 "Average Difference" CA 53 1.670 0.287 1.661 19880
119 1 20 "Average Difference" CB 48 6.801 -2.926 6.205 19880
120 1 20 "Average Difference" HN 51 0.517 -0.115 0.509 19880
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 19880
_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 N N 3 117.561 117.561 116.892 0.669 19880
2 1 . 1 1 3 3 CYS HA H 3 4.820 4.820 5.276 -0.456 19880
3 1 . 1 1 3 3 CYS CA C 3 52.700 52.700 55.308 -2.608 19880
4 1 . 1 1 3 3 CYS CB C 3 46.651 46.651 26.643 20.008 19880
5 1 . 1 1 3 3 CYS H H 3 7.950 7.950 8.090 -0.140 19880
6 1 . 1 1 4 4 PRO HA H 4 4.505 4.505 4.639 -0.134 19880
7 1 . 1 1 4 4 PRO CA C 4 63.730 63.730 62.875 0.855 19880
8 1 . 1 1 4 4 PRO CB C 4 33.299 33.299 32.843 0.456 19880
9 1 . 1 1 5 5 THR N N 5 118.207 118.207 115.735 2.472 19880
10 1 . 1 1 5 5 THR HA H 5 4.814 4.814 4.672 0.142 19880
11 1 . 1 1 5 5 THR CA C 5 61.618 61.618 61.901 -0.283 19880
12 1 . 1 1 5 5 THR CB C 5 70.257 70.257 69.815 0.442 19880
13 1 . 1 1 5 5 THR H H 5 8.529 8.529 8.344 0.185 19880
14 1 . 1 1 6 6 ARG N N 6 123.211 123.211 126.017 -2.806 19880
15 1 . 1 1 6 6 ARG HA H 6 4.528 4.528 4.623 -0.095 19880
16 1 . 1 1 6 6 ARG CA C 6 54.931 54.931 55.018 -0.087 19880
17 1 . 1 1 6 6 ARG CB C 6 32.752 32.752 32.604 0.149 19880
18 1 . 1 1 6 6 ARG H H 6 7.693 7.693 8.548 -0.855 19880
19 1 . 1 1 7 7 ARG N N 7 121.558 121.558 121.478 0.080 19880
20 1 . 1 1 7 7 ARG HA H 7 4.666 4.666 4.527 0.139 19880
21 1 . 1 1 7 7 ARG CA C 7 54.415 54.415 55.389 -0.974 19880
22 1 . 1 1 7 7 ARG CB C 7 32.673 32.673 32.375 0.298 19880
23 1 . 1 1 7 7 ARG H H 7 8.450 8.450 8.296 0.154 19880
24 1 . 1 1 8 8 GLY N N 8 111.006 111.006 108.556 2.450 19880
25 1 . 1 1 8 8 GLY CA C 8 46.653 46.653 45.412 1.241 19880
26 1 . 1 1 8 8 GLY H H 8 9.382 9.382 8.473 0.909 19880
27 1 . 1 1 9 9 LEU N N 9 119.202 119.202 119.784 -0.582 19880
28 1 . 1 1 9 9 LEU HA H 9 3.890 3.890 4.074 -0.184 19880
29 1 . 1 1 9 9 LEU CA C 9 57.754 57.754 56.617 1.137 19880
30 1 . 1 1 9 9 LEU CB C 9 42.770 42.770 41.579 1.191 19880
31 1 . 1 1 9 9 LEU H H 9 8.215 8.215 7.987 0.228 19880
32 1 . 1 1 10 10 CYS N N 10 115.050 115.050 114.987 0.063 19880
33 1 . 1 1 10 10 CYS HA H 10 3.890 3.890 4.367 -0.477 19880
34 1 . 1 1 10 10 CYS CA C 10 61.378 61.378 59.827 1.551 19880
35 1 . 1 1 10 10 CYS CB C 10 42.589 42.589 25.072 17.517 19880
36 1 . 1 1 10 10 CYS H H 10 9.282 9.282 8.286 0.996 19880
37 1 . 1 1 11 11 VAL N N 11 117.792 117.792 120.040 -2.248 19880
38 1 . 1 1 11 11 VAL HA H 11 3.771 3.771 4.164 -0.393 19880
39 1 . 1 1 11 11 VAL CA C 11 64.508 64.508 64.472 0.036 19880
40 1 . 1 1 11 11 VAL CB C 11 32.598 32.598 32.504 0.094 19880
41 1 . 1 1 11 11 VAL H H 11 7.315 7.315 8.182 -0.867 19880
42 1 . 1 1 12 12 THR N N 12 109.816 109.816 112.112 -2.296 19880
43 1 . 1 1 12 12 THR HA H 12 4.044 4.044 4.397 -0.353 19880
44 1 . 1 1 12 12 THR CA C 12 63.575 63.575 63.659 -0.084 19880
45 1 . 1 1 12 12 THR CB C 12 69.400 69.400 69.494 -0.095 19880
46 1 . 1 1 12 12 THR H H 12 8.214 8.214 7.827 0.387 19880
47 1 . 1 1 13 13 SER N N 13 114.455 114.455 115.896 -1.441 19880
48 1 . 1 1 13 13 SER HA H 13 4.607 4.607 4.608 -0.001 19880
49 1 . 1 1 13 13 SER CA C 13 59.460 59.460 58.625 0.835 19880
50 1 . 1 1 13 13 SER CB C 13 64.586 64.586 65.051 -0.465 19880
51 1 . 1 1 13 13 SER H H 13 7.511 7.511 7.858 -0.347 19880
52 1 . 1 1 14 14 GLY N N 14 109.125 109.125 109.375 -0.250 19880
53 1 . 1 1 14 14 GLY CA C 14 44.324 44.324 44.531 -0.207 19880
54 1 . 1 1 14 14 GLY H H 14 8.376 8.376 7.916 0.460 19880
55 1 . 1 1 15 15 LEU N N 15 120.782 120.782 121.330 -0.548 19880
56 1 . 1 1 15 15 LEU HA H 15 3.936 3.936 4.210 -0.274 19880
57 1 . 1 1 15 15 LEU CA C 15 57.986 57.986 57.190 0.796 19880
58 1 . 1 1 15 15 LEU CB C 15 41.526 41.526 42.032 -0.506 19880
59 1 . 1 1 15 15 LEU H H 15 8.469 8.469 8.657 -0.188 19880
60 1 . 1 1 16 16 THR N N 16 115.887 115.887 114.266 1.621 19880
61 1 . 1 1 16 16 THR HA H 16 3.602 3.602 3.944 -0.342 19880
62 1 . 1 1 16 16 THR CA C 16 67.196 67.196 66.771 0.425 19880
63 1 . 1 1 16 16 THR CB C 16 68.003 68.003 68.104 -0.101 19880
64 1 . 1 1 16 16 THR H H 16 8.487 8.487 8.252 0.235 19880
65 1 . 1 1 17 17 ALA N N 17 122.643 122.643 123.350 -0.707 19880
66 1 . 1 1 17 17 ALA HA H 17 4.014 4.014 4.336 -0.322 19880
67 1 . 1 1 17 17 ALA CA C 17 54.841 54.841 54.552 0.289 19880
68 1 . 1 1 17 17 ALA CB C 17 18.931 18.931 18.061 0.870 19880
69 1 . 1 1 17 17 ALA H H 17 7.609 7.609 7.690 -0.081 19880
70 1 . 1 1 18 18 CYS N N 18 118.252 118.252 118.515 -0.263 19880
71 1 . 1 1 18 18 CYS HA H 18 4.253 4.253 4.233 0.020 19880
72 1 . 1 1 18 18 CYS CA C 18 58.453 58.453 60.997 -2.544 19880
73 1 . 1 1 18 18 CYS CB C 18 37.646 37.646 25.276 12.370 19880
74 1 . 1 1 18 18 CYS H H 18 7.644 7.644 7.744 -0.100 19880
75 1 . 1 1 19 19 ARG N N 19 120.422 120.422 120.165 0.257 19880
76 1 . 1 1 19 19 ARG HA H 19 3.475 3.475 4.094 -0.619 19880
77 1 . 1 1 19 19 ARG CA C 19 60.552 60.552 59.589 0.963 19880
78 1 . 1 1 19 19 ARG CB C 19 29.801 29.801 30.354 -0.553 19880
79 1 . 1 1 19 19 ARG H H 19 9.072 9.072 8.407 0.665 19880
80 1 . 1 1 20 20 ASN N N 20 117.466 117.466 116.391 1.075 19880
81 1 . 1 1 20 20 ASN HA H 20 4.212 4.212 4.583 -0.371 19880
82 1 . 1 1 20 20 ASN CA C 20 55.611 55.611 55.356 0.255 19880
83 1 . 1 1 20 20 ASN CB C 20 37.255 37.255 38.225 -0.970 19880
84 1 . 1 1 20 20 ASN H H 20 8.411 8.411 7.911 0.500 19880
85 1 . 1 1 21 21 HIS N N 21 120.420 120.420 119.103 1.317 19880
86 1 . 1 1 21 21 HIS HA H 21 4.174 4.174 4.593 -0.419 19880
87 1 . 1 1 21 21 HIS CA C 21 59.154 59.154 59.432 -0.277 19880
88 1 . 1 1 21 21 HIS CB C 21 31.588 31.588 30.516 1.072 19880
89 1 . 1 1 21 21 HIS H H 21 7.827 7.827 7.797 0.030 19880
90 1 . 1 1 22 22 CYS N N 22 117.510 117.510 117.743 -0.233 19880
91 1 . 1 1 22 22 CYS HA H 22 3.159 3.159 4.322 -1.163 19880
92 1 . 1 1 22 22 CYS CA C 22 58.221 58.221 61.827 -3.606 19880
93 1 . 1 1 22 22 CYS CB C 22 37.178 37.178 26.268 10.911 19880
94 1 . 1 1 22 22 CYS H H 22 8.500 8.500 7.923 0.577 19880
95 1 . 1 1 23 23 ARG N N 23 116.564 116.564 117.909 -1.345 19880
96 1 . 1 1 23 23 ARG HA H 23 4.653 4.653 4.660 -0.007 19880
97 1 . 1 1 23 23 ARG CA C 23 57.028 57.028 56.789 0.239 19880
98 1 . 1 1 23 23 ARG CB C 23 30.655 30.655 30.530 0.126 19880
99 1 . 1 1 23 23 ARG H H 23 7.985 7.985 7.897 0.088 19880
100 1 . 1 1 24 24 SER N N 24 116.727 116.727 113.138 3.589 19880
101 1 . 1 1 24 24 SER HA H 24 4.552 4.552 4.619 -0.067 19880
102 1 . 1 1 24 24 SER CA C 24 57.592 57.592 56.570 1.022 19880
103 1 . 1 1 24 24 SER CB C 24 65.284 65.284 66.079 -0.795 19880
104 1 . 1 1 24 24 SER H H 24 7.435 7.435 7.404 0.031 19880
105 1 . 1 1 25 25 CYS N N 25 121.909 121.909 121.285 0.624 19880
106 1 . 1 1 25 25 CYS HA H 25 4.636 4.636 4.709 -0.073 19880
107 1 . 1 1 25 25 CYS CA C 25 56.614 56.614 58.492 -1.878 19880
108 1 . 1 1 25 25 CYS CB C 25 39.273 39.273 26.122 13.151 19880
109 1 . 1 1 25 25 CYS H H 25 9.000 9.000 8.818 0.182 19880
110 1 . 1 1 26 26 HIS N N 26 126.609 126.609 121.766 4.843 19880
111 1 . 1 1 26 26 HIS HA H 26 4.952 4.952 5.221 -0.269 19880
112 1 . 1 1 26 26 HIS CA C 26 54.722 54.722 54.289 0.433 19880
113 1 . 1 1 26 26 HIS CB C 26 32.100 32.100 31.739 0.361 19880
114 1 . 1 1 26 26 HIS H H 26 9.255 9.255 8.793 0.462 19880
115 1 . 1 1 27 27 ARG N N 27 122.033 122.033 121.212 0.821 19880
116 1 . 1 1 27 27 ARG HA H 27 4.022 4.022 4.327 -0.305 19880
117 1 . 1 1 27 27 ARG CA C 27 57.477 57.477 55.593 1.884 19880
118 1 . 1 1 27 27 ARG CB C 27 29.880 29.880 30.613 -0.733 19880
119 1 . 1 1 27 27 ARG H H 27 8.314 8.314 8.206 0.108 19880
120 1 . 1 1 28 28 GLY N N 28 119.213 119.213 113.321 5.892 19880
121 1 . 1 1 28 28 GLY CA C 28 43.972 43.972 44.574 -0.602 19880
122 1 . 1 1 28 28 GLY H H 28 8.495 8.495 8.017 0.478 19880
123 1 . 1 1 29 29 ASP N N 29 121.258 121.258 118.480 2.778 19880
124 1 . 1 1 29 29 ASP HA H 29 4.264 4.264 4.633 -0.369 19880
125 1 . 1 1 29 29 ASP CA C 29 57.446 57.446 55.221 2.225 19880
126 1 . 1 1 29 29 ASP CB C 29 40.438 40.438 41.480 -1.041 19880
127 1 . 1 1 29 29 ASP H H 29 8.646 8.646 8.387 0.259 19880
128 1 . 1 1 30 30 VAL N N 30 112.703 112.703 117.463 -4.760 19880
129 1 . 1 1 30 30 VAL HA H 30 4.223 4.223 4.345 -0.122 19880
130 1 . 1 1 30 30 VAL CA C 30 61.407 61.407 62.034 -0.627 19880
131 1 . 1 1 30 30 VAL CB C 30 32.905 32.905 33.410 -0.505 19880
132 1 . 1 1 30 30 VAL H H 30 8.026 8.026 7.730 0.296 19880
133 1 . 1 1 31 31 GLY N N 31 109.481 109.481 107.411 2.070 19880
134 1 . 1 1 31 31 GLY CA C 31 44.366 44.366 45.049 -0.683 19880
135 1 . 1 1 31 31 GLY H H 31 7.511 7.511 7.592 -0.081 19880
136 1 . 1 1 32 32 CYS N N 32 121.673 121.673 120.180 1.493 19880
137 1 . 1 1 32 32 CYS HA H 32 4.946 4.946 5.127 -0.181 19880
138 1 . 1 1 32 32 CYS CA C 32 54.181 54.181 58.610 -4.429 19880
139 1 . 1 1 32 32 CYS CB C 32 41.296 41.296 26.688 14.608 19880
140 1 . 1 1 32 32 CYS H H 32 8.554 8.554 8.517 0.037 19880
141 1 . 1 1 33 33 VAL N N 33 119.401 119.401 118.048 1.353 19880
142 1 . 1 1 33 33 VAL HA H 33 4.795 4.795 4.932 -0.138 19880
143 1 . 1 1 33 33 VAL CA C 33 59.311 59.311 59.881 -0.570 19880
144 1 . 1 1 33 33 VAL CB C 33 36.480 36.480 35.582 0.898 19880
145 1 . 1 1 33 33 VAL H H 33 9.025 9.025 8.975 0.050 19880
146 1 . 1 1 34 34 ARG N N 34 120.394 120.394 116.108 4.286 19880
147 1 . 1 1 34 34 ARG HA H 34 4.699 4.699 4.874 -0.175 19880
148 1 . 1 1 34 34 ARG CA C 34 55.192 55.192 54.142 1.050 19880
149 1 . 1 1 34 34 ARG CB C 34 33.138 33.138 33.441 -0.303 19880
150 1 . 1 1 34 34 ARG H H 34 8.350 8.350 8.659 -0.309 19880
151 1 . 1 1 35 35 CYS N N 35 118.098 118.098 118.814 -0.716 19880
152 1 . 1 1 35 35 CYS HA H 35 6.051 6.051 5.476 0.575 19880
153 1 . 1 1 35 35 CYS CA C 35 55.277 55.277 57.487 -2.210 19880
154 1 . 1 1 35 35 CYS CB C 35 44.553 44.553 31.737 12.816 19880
155 1 . 1 1 35 35 CYS H H 35 8.567 8.567 9.087 -0.520 19880
156 1 . 1 1 36 36 SER N N 36 114.009 114.009 115.810 -1.801 19880
157 1 . 1 1 36 36 SER HA H 36 4.326 4.326 4.533 -0.207 19880
158 1 . 1 1 36 36 SER CA C 36 60.945 60.945 60.016 0.929 19880
159 1 . 1 1 36 36 SER CB C 36 64.743 64.743 64.118 0.625 19880
160 1 . 1 1 36 36 SER H H 36 7.669 7.669 8.424 -0.755 19880
161 1 . 1 1 37 37 ASN N N 37 117.050 117.050 116.377 0.673 19880
162 1 . 1 1 37 37 ASN HA H 37 4.408 4.408 4.887 -0.479 19880
163 1 . 1 1 37 37 ASN CA C 37 52.086 52.086 52.489 -0.403 19880
164 1 . 1 1 37 37 ASN CB C 37 41.374 41.374 40.982 0.392 19880
165 1 . 1 1 37 37 ASN H H 37 7.755 7.755 7.486 0.269 19880
166 1 . 1 1 38 38 ALA N N 38 123.735 123.735 120.320 3.415 19880
167 1 . 1 1 38 38 ALA HA H 38 5.162 5.162 4.955 0.207 19880
168 1 . 1 1 38 38 ALA CA C 38 52.134 52.134 51.551 0.583 19880
169 1 . 1 1 38 38 ALA CB C 38 19.193 19.193 22.075 -2.882 19880
170 1 . 1 1 38 38 ALA H H 38 9.323 9.323 8.306 1.017 19880
171 1 . 1 1 39 39 GLN N N 39 116.531 116.531 116.626 -0.095 19880
172 1 . 1 1 39 39 GLN HA H 39 4.313 4.313 4.763 -0.450 19880
173 1 . 1 1 39 39 GLN CA C 39 54.749 54.749 54.283 0.466 19880
174 1 . 1 1 39 39 GLN CB C 39 33.817 33.817 32.252 1.565 19880
175 1 . 1 1 39 39 GLN H H 39 8.746 8.746 8.856 -0.110 19880
176 1 . 1 1 40 40 CYS N N 40 122.074 122.074 120.687 1.387 19880
177 1 . 1 1 40 40 CYS HA H 40 5.549 5.549 5.437 0.112 19880
178 1 . 1 1 40 40 CYS CA C 40 54.413 54.413 57.762 -3.349 19880
179 1 . 1 1 40 40 CYS CB C 40 40.902 40.902 27.903 12.999 19880
180 1 . 1 1 40 40 CYS H H 40 8.536 8.536 8.700 -0.164 19880
181 1 . 1 1 41 41 THR N N 41 117.753 117.753 116.569 1.183 19880
182 1 . 1 1 41 41 THR HA H 41 4.641 4.641 4.628 0.013 19880
183 1 . 1 1 41 41 THR CA C 41 60.550 60.550 60.151 0.399 19880
184 1 . 1 1 41 41 THR CB C 41 71.033 71.033 71.383 -0.351 19880
185 1 . 1 1 41 41 THR H H 41 9.779 9.779 8.965 0.814 19880
186 1 . 1 1 42 42 GLY N N 42 105.809 105.809 108.362 -2.553 19880
187 1 . 1 1 42 42 GLY CA C 42 44.015 44.015 44.899 -0.884 19880
188 1 . 1 1 42 42 GLY H H 42 8.247 8.247 8.198 0.049 19880
189 1 . 1 1 43 43 PHE N N 43 123.293 123.293 121.077 2.216 19880
190 1 . 1 1 43 43 PHE HA H 43 4.298 4.298 4.502 -0.204 19880
191 1 . 1 1 43 43 PHE CA C 43 60.196 60.196 58.824 1.372 19880
192 1 . 1 1 43 43 PHE CB C 43 38.650 38.650 39.514 -0.864 19880
193 1 . 1 1 43 43 PHE H H 43 8.707 8.707 8.849 -0.142 19880
194 1 . 1 1 44 44 LEU N N 44 120.771 120.771 120.196 0.575 19880
195 1 . 1 1 44 44 LEU HA H 44 3.848 3.848 4.157 -0.309 19880
196 1 . 1 1 44 44 LEU CB C 44 40.386 40.386 42.064 -1.678 19880
197 1 . 1 1 44 44 LEU H H 44 8.645 8.645 7.868 0.777 19880
198 1 . 1 1 45 45 GLY N N 45 107.545 107.545 107.288 0.257 19880
199 1 . 1 1 45 45 GLY CA C 45 47.311 47.311 45.806 1.505 19880
200 1 . 1 1 45 45 GLY H H 45 7.831 7.831 7.681 0.150 19880
201 1 . 1 1 46 46 THR N N 46 104.485 104.485 109.973 -5.488 19880
202 1 . 1 1 46 46 THR HA H 46 3.901 3.901 4.205 -0.304 19880
203 1 . 1 1 46 46 THR CA C 46 62.180 62.180 62.877 -0.697 19880
204 1 . 1 1 46 46 THR CB C 46 70.021 70.021 69.365 0.656 19880
205 1 . 1 1 46 46 THR H H 46 6.823 6.823 7.974 -1.151 19880
206 1 . 1 1 47 47 THR N N 47 123.300 123.300 117.545 5.755 19880
207 1 . 1 1 47 47 THR HA H 47 4.371 4.371 4.858 -0.487 19880
208 1 . 1 1 47 47 THR CA C 47 62.843 62.843 61.258 1.585 19880
209 1 . 1 1 47 47 THR CB C 47 70.176 70.176 72.313 -2.137 19880
210 1 . 1 1 47 47 THR H H 47 8.763 8.763 7.810 0.953 19880
211 1 . 1 1 48 48 CYS N N 48 128.024 128.024 124.067 3.957 19880
212 1 . 1 1 48 48 CYS HA H 48 4.973 4.973 4.972 0.001 19880
213 1 . 1 1 48 48 CYS CA C 48 55.984 55.984 57.293 -1.309 19880
214 1 . 1 1 48 48 CYS CB C 48 36.282 36.282 29.023 7.259 19880
215 1 . 1 1 48 48 CYS H H 48 9.276 9.276 8.715 0.561 19880
216 1 . 1 1 49 49 THR N N 49 131.810 131.810 121.034 10.776 19880
217 1 . 1 1 49 49 THR HA H 49 4.364 4.364 4.712 -0.348 19880
218 1 . 1 1 49 49 THR CA C 49 61.871 61.871 61.789 0.082 19880
219 1 . 1 1 49 49 THR CB C 49 69.789 69.789 72.731 -2.942 19880
220 1 . 1 1 49 49 THR H H 49 9.194 9.194 8.856 0.338 19880
221 1 . 1 1 50 50 CYS N N 50 123.835 123.835 121.807 2.028 19880
222 1 . 1 1 50 50 CYS HA H 50 5.035 5.035 5.088 -0.053 19880
223 1 . 1 1 50 50 CYS CA C 50 51.880 51.880 58.246 -6.366 19880
224 1 . 1 1 50 50 CYS CB C 50 34.934 34.934 29.695 5.239 19880
225 1 . 1 1 50 50 CYS H H 50 8.879 8.879 8.619 0.260 19880
226 1 . 1 1 51 51 ILE N N 51 123.986 123.986 122.474 1.512 19880
227 1 . 1 1 51 51 ILE HA H 51 4.143 4.143 4.397 -0.254 19880
228 1 . 1 1 51 51 ILE CA C 51 59.619 59.619 59.087 0.533 19880
229 1 . 1 1 51 51 ILE CB C 51 39.380 39.380 39.948 -0.568 19880
230 1 . 1 1 51 51 ILE H H 51 8.098 8.098 8.870 -0.772 19880
231 1 . 1 1 52 52 ASN N N 52 126.122 126.122 125.088 1.034 19880
232 1 . 1 1 52 52 ASN HA H 52 4.716 4.716 4.836 -0.120 19880
233 1 . 1 1 52 52 ASN CA C 52 52.891 52.891 51.929 0.962 19880
234 1 . 1 1 52 52 ASN CB C 52 37.913 37.913 38.037 -0.125 19880
235 1 . 1 1 52 52 ASN H H 52 8.323 8.323 8.627 -0.304 19880
236 1 . 1 1 53 53 PRO HA H 53 4.307 4.307 4.523 -0.216 19880
237 1 . 1 1 53 53 PRO CA C 53 63.033 63.033 62.457 0.576 19880
238 1 . 1 1 53 53 PRO CB C 53 35.860 35.860 32.726 3.134 19880
239 1 . 1 1 54 54 CYS N N 54 123.090 123.090 117.736 5.354 19880
240 1 . 1 1 54 54 CYS HA H 54 5.736 5.736 5.102 0.634 19880
241 1 . 1 1 54 54 CYS CA C 54 54.150 54.150 56.839 -2.689 19880
242 1 . 1 1 54 54 CYS CB C 54 46.154 46.154 26.849 19.305 19880
243 1 . 1 1 54 54 CYS H H 54 8.865 8.865 8.467 0.398 19880
244 1 . 1 1 55 55 PRO HA H 55 4.286 4.286 4.456 -0.170 19880
245 1 . 1 1 55 55 PRO CA C 55 62.258 62.258 62.709 -0.451 19880
246 1 . 1 1 55 55 PRO CB C 55 32.450 32.450 32.329 0.121 19880
247 1 . 1 1 56 56 ARG N N 56 117.289 117.289 117.851 -0.562 19880
248 1 . 1 1 56 56 ARG HA H 56 4.485 4.485 4.480 0.005 19880
249 1 . 1 1 56 56 ARG CA C 56 56.121 56.121 56.517 -0.396 19880
250 1 . 1 1 56 56 ARG CB C 56 30.539 30.539 31.071 -0.532 19880
251 1 . 1 1 56 56 ARG H H 56 7.902 7.902 8.425 -0.523 19880
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