data_19998
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19998
_Entry.PDB_ID 2MPQ
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 19998
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 ALA N N 2 123.910 123.910 125.822 -1.912 19998
2 1 1 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.932 -0.468 19998
3 1 1 . 1 1 2 2 ALA C C 2 174.673 174.673 176.556 -1.883 19998
4 1 1 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.251 -0.083 19998
5 1 1 . 1 1 2 2 ALA CB C 2 19.690 19.690 19.040 0.650 19998
6 1 1 . 1 1 2 2 ALA H H 2 8.561 8.561 8.162 0.399 19998
7 1 1 . 1 1 3 3 CYS N N 3 117.207 117.207 118.675 -1.468 19998
8 1 1 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.651 0.314 19998
9 1 1 . 1 1 3 3 CYS C C 3 170.808 170.808 172.454 -1.646 19998
10 1 1 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.431 -2.677 19998
11 1 1 . 1 1 3 3 CYS CB C 3 44.067 44.067 28.824 15.243 19998
12 1 1 . 1 1 3 3 CYS H H 3 8.335 8.335 8.293 0.042 19998
13 1 1 . 1 1 4 4 LEU N N 4 121.828 121.828 122.778 -0.950 19998
14 1 1 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.610 -0.265 19998
15 1 1 . 1 1 4 4 LEU C C 4 172.234 172.234 177.233 -4.999 19998
16 1 1 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.035 0.188 19998
17 1 1 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.878 0.700 19998
18 1 1 . 1 1 4 4 LEU H H 4 8.815 8.815 8.370 0.445 19998
19 1 1 . 1 1 5 5 GLY N N 5 107.508 107.508 110.463 -2.955 19998
20 1 1 . 1 1 5 5 GLY C C 5 169.768 169.768 173.412 -3.644 19998
21 1 1 . 1 1 5 5 GLY CA C 5 43.052 43.052 44.018 -0.966 19998
22 1 1 . 1 1 5 5 GLY H H 5 7.999 7.999 8.332 -0.333 19998
23 1 1 . 1 1 6 6 PHE N N 6 116.953 116.953 120.412 -3.459 19998
24 1 1 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.938 -0.319 19998
25 1 1 . 1 1 6 6 PHE C C 6 174.967 174.967 177.359 -2.392 19998
26 1 1 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.683 1.418 19998
27 1 1 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.033 0.472 19998
28 1 1 . 1 1 6 6 PHE H H 6 8.392 8.392 8.265 0.127 19998
29 1 1 . 1 1 7 7 GLY N N 7 115.074 115.074 114.544 0.530 19998
30 1 1 . 1 1 7 7 GLY C C 7 171.017 171.017 173.454 -2.437 19998
31 1 1 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.714 0.130 19998
32 1 1 . 1 1 7 7 GLY H H 7 8.645 8.645 7.552 1.093 19998
33 1 1 . 1 1 8 8 LYS N N 8 120.051 120.051 120.778 -0.727 19998
34 1 1 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.664 -0.351 19998
35 1 1 . 1 1 8 8 LYS C C 8 173.878 173.878 176.101 -2.223 19998
36 1 1 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.063 0.507 19998
37 1 1 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.198 -1.807 19998
38 1 1 . 1 1 8 8 LYS H H 8 7.429 7.429 7.381 0.048 19998
39 1 1 . 1 1 9 9 SER N N 9 117.004 117.004 117.559 -0.555 19998
40 1 1 . 1 1 9 9 SER HA H 9 4.315 4.315 4.666 -0.351 19998
41 1 1 . 1 1 9 9 SER C C 9 170.486 170.486 174.385 -3.899 19998
42 1 1 . 1 1 9 9 SER CB C 9 63.355 63.355 62.200 1.155 19998
43 1 1 . 1 1 9 9 SER H H 9 8.542 8.542 8.525 0.017 19998
44 1 1 . 1 1 10 10 CYS N N 10 119.238 119.238 120.709 -1.471 19998
45 1 1 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.746 0.087 19998
46 1 1 . 1 1 10 10 CYS C C 10 168.106 168.106 173.155 -5.049 19998
47 1 1 . 1 1 10 10 CYS CA C 10 53.907 53.907 56.436 -2.529 19998
48 1 1 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.287 15.554 19998
49 1 1 . 1 1 10 10 CYS H H 10 8.188 8.188 8.240 -0.052 19998
50 1 1 . 1 1 11 11 ASN N N 11 119.594 119.594 119.192 0.402 19998
51 1 1 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.190 -0.066 19998
52 1 1 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.758 -1.282 19998
53 1 1 . 1 1 11 11 ASN CB C 11 40.000 40.000 41.077 -1.077 19998
54 1 1 . 1 1 11 11 ASN H H 11 9.129 9.129 8.629 0.500 19998
55 1 1 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.432 -0.584 19998
56 1 1 . 1 1 12 12 PRO C C 12 174.197 174.197 178.078 -3.881 19998
57 1 1 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.699 -0.010 19998
58 1 1 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.135 -0.252 19998
59 1 1 . 1 1 13 13 SER N N 13 110.351 110.351 112.516 -2.165 19998
60 1 1 . 1 1 13 13 SER HA H 13 4.394 4.394 4.251 0.143 19998
61 1 1 . 1 1 13 13 SER C C 13 170.980 170.980 174.147 -3.167 19998
62 1 1 . 1 1 13 13 SER CA C 13 59.326 59.326 60.313 -0.987 19998
63 1 1 . 1 1 13 13 SER CB C 13 63.380 63.380 62.900 0.480 19998
64 1 1 . 1 1 13 13 SER H H 13 7.785 7.785 8.428 -0.643 19998
65 1 1 . 1 1 14 14 ASN N N 14 120.660 120.660 118.712 1.948 19998
66 1 1 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.883 -0.245 19998
67 1 1 . 1 1 14 14 ASN C C 14 171.412 171.412 173.453 -2.041 19998
68 1 1 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.725 1.081 19998
69 1 1 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.105 -1.295 19998
70 1 1 . 1 1 14 14 ASN H H 14 7.613 7.613 7.805 -0.192 19998
71 1 1 . 1 1 15 15 ASP N N 15 124.062 124.062 120.962 3.100 19998
72 1 1 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.530 -0.420 19998
73 1 1 . 1 1 15 15 ASP C C 15 174.918 174.918 175.717 -0.799 19998
74 1 1 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.881 0.893 19998
75 1 1 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.595 0.765 19998
76 1 1 . 1 1 15 15 ASP H H 15 8.695 8.695 8.026 0.669 19998
77 1 1 . 1 1 16 16 GLN N N 16 127.008 127.008 122.848 4.160 19998
78 1 1 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.551 0.062 19998
79 1 1 . 1 1 16 16 GLN C C 16 173.874 173.874 174.021 -0.147 19998
80 1 1 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.911 -0.389 19998
81 1 1 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.016 -0.689 19998
82 1 1 . 1 1 16 16 GLN H H 16 8.041 8.041 8.531 -0.490 19998
83 1 1 . 1 1 17 17 CYS N N 17 122.234 122.234 119.005 3.229 19998
84 1 1 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.809 0.174 19998
85 1 1 . 1 1 17 17 CYS C C 17 173.908 173.908 174.764 -0.856 19998
86 1 1 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.728 -1.242 19998
87 1 1 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.522 8.384 19998
88 1 1 . 1 1 17 17 CYS H H 17 9.314 9.314 8.217 1.097 19998
89 1 1 . 1 1 18 18 CYS N N 18 118.883 118.883 122.644 -3.761 19998
90 1 1 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.525 0.083 19998
91 1 1 . 1 1 18 18 CYS C C 18 172.722 172.722 176.025 -3.303 19998
92 1 1 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.087 -3.566 19998
93 1 1 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.199 15.168 19998
94 1 1 . 1 1 18 18 CYS H H 18 9.192 9.192 8.553 0.639 19998
95 1 1 . 1 1 19 19 LYS N N 19 131.730 131.730 126.364 5.366 19998
96 1 1 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.108 0.224 19998
97 1 1 . 1 1 19 19 LYS C C 19 177.997 177.997 178.900 -0.903 19998
98 1 1 . 1 1 19 19 LYS CA C 19 58.426 58.426 59.131 -0.705 19998
99 1 1 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.313 -0.994 19998
100 1 1 . 1 1 19 19 LYS H H 19 8.890 8.890 8.550 0.340 19998
101 1 1 . 1 1 20 20 SER N N 20 115.887 115.887 114.530 1.357 19998
102 1 1 . 1 1 20 20 SER HA H 20 4.334 4.334 4.283 0.051 19998
103 1 1 . 1 1 20 20 SER C C 20 172.946 172.946 175.475 -2.529 19998
104 1 1 . 1 1 20 20 SER CA C 20 60.311 60.311 60.789 -0.478 19998
105 1 1 . 1 1 20 20 SER CB C 20 62.327 62.327 62.975 -0.648 19998
106 1 1 . 1 1 20 20 SER H H 20 8.856 8.856 8.559 0.297 19998
107 1 1 . 1 1 21 21 SER N N 21 116.191 116.191 114.746 1.445 19998
108 1 1 . 1 1 21 21 SER HA H 21 4.833 4.833 4.594 0.239 19998
109 1 1 . 1 1 21 21 SER C C 21 170.505 170.505 173.154 -2.649 19998
110 1 1 . 1 1 21 21 SER CA C 21 57.500 57.500 58.222 -0.722 19998
111 1 1 . 1 1 21 21 SER CB C 21 63.852 63.852 63.506 0.346 19998
112 1 1 . 1 1 21 21 SER H H 21 7.068 7.068 7.603 -0.535 19998
113 1 1 . 1 1 22 22 SER N N 22 111.723 111.723 115.716 -3.993 19998
114 1 1 . 1 1 22 22 SER HA H 22 4.099 4.099 4.141 -0.042 19998
115 1 1 . 1 1 22 22 SER C C 22 170.369 170.369 172.945 -2.576 19998
116 1 1 . 1 1 22 22 SER CA C 22 59.140 59.140 59.785 -0.645 19998
117 1 1 . 1 1 22 22 SER CB C 22 61.339 61.339 61.259 0.080 19998
118 1 1 . 1 1 22 22 SER H H 22 8.113 8.113 8.248 -0.135 19998
119 1 1 . 1 1 23 23 LEU N N 23 115.988 115.988 118.814 -2.826 19998
120 1 1 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.787 0.111 19998
121 1 1 . 1 1 23 23 LEU C C 23 173.712 173.712 175.587 -1.875 19998
122 1 1 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.343 -0.260 19998
123 1 1 . 1 1 23 23 LEU CB C 23 46.062 46.062 44.962 1.100 19998
124 1 1 . 1 1 23 23 LEU H H 23 7.111 7.111 7.617 -0.506 19998
125 1 1 . 1 1 24 24 ALA N N 24 119.898 119.898 120.809 -0.911 19998
126 1 1 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.631 -0.165 19998
127 1 1 . 1 1 24 24 ALA C C 24 173.491 173.491 174.700 -1.209 19998
128 1 1 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.762 -0.595 19998
129 1 1 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.645 1.592 19998
130 1 1 . 1 1 24 24 ALA H H 24 8.904 8.904 7.764 1.140 19998
131 1 1 . 1 1 25 25 CYS N N 25 122.945 122.945 121.151 1.794 19998
132 1 1 . 1 1 25 25 CYS HA H 25 4.452 4.452 4.989 -0.537 19998
133 1 1 . 1 1 25 25 CYS C C 25 171.574 171.574 175.210 -3.636 19998
134 1 1 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.645 -1.513 19998
135 1 1 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.635 12.544 19998
136 1 1 . 1 1 25 25 CYS H H 25 9.847 9.847 8.678 1.169 19998
137 1 1 . 1 1 26 26 SER N N 26 122.285 122.285 123.392 -1.107 19998
138 1 1 . 1 1 26 26 SER HA H 26 4.543 4.543 4.723 -0.180 19998
139 1 1 . 1 1 26 26 SER CA C 26 57.773 57.773 57.174 0.599 19998
140 1 1 . 1 1 26 26 SER CB C 26 63.789 63.789 65.964 -2.175 19998
141 1 1 . 1 1 26 26 SER H H 26 7.791 7.791 8.394 -0.603 19998
142 1 1 . 1 1 27 27 THR N N 27 122.390 122.390 121.650 0.740 19998
143 1 1 . 1 1 27 27 THR HA H 27 3.778 3.778 4.266 -0.488 19998
144 1 1 . 1 1 27 27 THR C C 27 172.781 172.781 175.125 -2.344 19998
145 1 1 . 1 1 27 27 THR CA C 27 65.390 65.390 64.547 0.843 19998
146 1 1 . 1 1 27 27 THR CB C 27 68.458 68.458 68.673 -0.215 19998
147 1 1 . 1 1 27 27 THR H H 27 8.874 8.874 8.651 0.223 19998
148 1 1 . 1 1 28 28 LYS N N 28 118.883 118.883 121.398 -2.515 19998
149 1 1 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.161 -0.130 19998
150 1 1 . 1 1 28 28 LYS C C 28 174.613 174.613 177.021 -2.408 19998
151 1 1 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.282 -0.483 19998
152 1 1 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.361 0.804 19998
153 1 1 . 1 1 28 28 LYS H H 28 7.609 7.609 7.990 -0.381 19998
154 1 1 . 1 1 29 29 HIS N N 29 113.398 113.398 115.193 -1.795 19998
155 1 1 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.603 -0.319 19998
156 1 1 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.545 0.040 19998
157 1 1 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.404 -1.342 19998
158 1 1 . 1 1 29 29 HIS H H 29 7.450 7.450 7.970 -0.520 19998
159 1 1 . 1 1 30 30 LYS N N 30 116.344 116.344 118.939 -2.595 19998
160 1 1 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.218 -0.330 19998
161 1 1 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.328 0.172 19998
162 1 1 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.678 -1.069 19998
163 1 1 . 1 1 30 30 LYS H H 30 8.261 8.261 8.428 -0.167 19998
164 1 1 . 1 1 31 31 TRP N N 31 117.766 117.766 114.878 2.888 19998
165 1 1 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.013 0.464 19998
166 1 1 . 1 1 31 31 TRP C C 31 174.754 174.754 174.375 0.379 19998
167 1 1 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.259 1.497 19998
168 1 1 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.786 1.190 19998
169 1 1 . 1 1 31 31 TRP H H 31 8.483 8.483 7.706 0.777 19998
170 1 1 . 1 1 32 32 CYS N N 32 118.984 118.984 123.080 -4.096 19998
171 1 1 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.296 0.451 19998
172 1 1 . 1 1 32 32 CYS C C 32 171.472 171.472 174.730 -3.258 19998
173 1 1 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.166 -4.433 19998
174 1 1 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.561 14.963 19998
175 1 1 . 1 1 32 32 CYS H H 32 8.474 8.474 8.407 0.067 19998
176 1 1 . 1 1 33 33 LYS N N 33 124.672 124.672 123.854 0.818 19998
177 1 1 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.146 0.571 19998
178 1 1 . 1 1 33 33 LYS C C 33 172.236 172.236 175.495 -3.259 19998
179 1 1 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.103 0.627 19998
180 1 1 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.842 1.587 19998
181 1 1 . 1 1 33 33 LYS H H 33 9.027 9.027 8.346 0.681 19998
182 1 1 . 1 1 34 34 TYR N N 34 120.102 120.102 123.677 -3.575 19998
183 1 1 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.555 0.323 19998
184 1 1 . 1 1 34 34 TYR C C 34 174.034 174.034 176.843 -2.809 19998
185 1 1 . 1 1 34 34 TYR CA C 34 59.262 59.262 59.194 0.068 19998
186 1 1 . 1 1 34 34 TYR CB C 34 38.633 38.633 38.072 0.561 19998
187 1 1 . 1 1 34 34 TYR H H 34 8.092 8.092 8.807 -0.715 19998
188 1 1 . 1 1 35 35 GLU N N 35 124.362 124.362 126.535 -2.173 19998
189 1 1 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.270 0.192 19998
190 1 1 . 1 1 35 35 GLU C C 35 172.127 172.127 175.589 -3.462 19998
191 1 1 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.621 -0.354 19998
192 1 1 . 1 1 35 35 GLU CB C 35 30.852 30.852 29.976 0.876 19998
193 1 1 . 1 1 35 35 GLU H H 35 8.754 8.754 8.696 0.058 19998
194 1 2 . 1 1 2 2 ALA N N 2 123.910 123.910 122.495 1.415 19998
195 1 2 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.756 -0.292 19998
196 1 2 . 1 1 2 2 ALA C C 2 174.673 174.673 176.338 -1.665 19998
197 1 2 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.175 -0.007 19998
198 1 2 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.931 0.759 19998
199 1 2 . 1 1 2 2 ALA H H 2 8.561 8.561 8.375 0.186 19998
200 1 2 . 1 1 3 3 CYS N N 3 117.207 117.207 118.952 -1.745 19998
201 1 2 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.687 0.278 19998
202 1 2 . 1 1 3 3 CYS C C 3 170.808 170.808 172.584 -1.776 19998
203 1 2 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.147 -2.393 19998
204 1 2 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.043 15.024 19998
205 1 2 . 1 1 3 3 CYS H H 3 8.335 8.335 8.236 0.099 19998
206 1 2 . 1 1 4 4 LEU N N 4 121.828 121.828 122.655 -0.827 19998
207 1 2 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.604 -0.259 19998
208 1 2 . 1 1 4 4 LEU C C 4 172.234 172.234 177.204 -4.970 19998
209 1 2 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.041 0.182 19998
210 1 2 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.998 0.580 19998
211 1 2 . 1 1 4 4 LEU H H 4 8.815 8.815 8.353 0.462 19998
212 1 2 . 1 1 5 5 GLY N N 5 107.508 107.508 110.365 -2.857 19998
213 1 2 . 1 1 5 5 GLY C C 5 169.768 169.768 173.419 -3.651 19998
214 1 2 . 1 1 5 5 GLY CA C 5 43.052 43.052 43.986 -0.934 19998
215 1 2 . 1 1 5 5 GLY H H 5 7.999 7.999 8.326 -0.327 19998
216 1 2 . 1 1 6 6 PHE N N 6 116.953 116.953 120.453 -3.500 19998
217 1 2 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.962 -0.343 19998
218 1 2 . 1 1 6 6 PHE C C 6 174.967 174.967 177.333 -2.366 19998
219 1 2 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.623 1.478 19998
220 1 2 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.001 0.505 19998
221 1 2 . 1 1 6 6 PHE H H 6 8.392 8.392 8.250 0.142 19998
222 1 2 . 1 1 7 7 GLY N N 7 115.074 115.074 114.626 0.448 19998
223 1 2 . 1 1 7 7 GLY C C 7 171.017 171.017 173.457 -2.440 19998
224 1 2 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.687 0.157 19998
225 1 2 . 1 1 7 7 GLY H H 7 8.645 8.645 7.568 1.077 19998
226 1 2 . 1 1 8 8 LYS N N 8 120.051 120.051 120.554 -0.503 19998
227 1 2 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.604 -0.291 19998
228 1 2 . 1 1 8 8 LYS C C 8 173.878 173.878 176.127 -2.249 19998
229 1 2 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.126 0.444 19998
230 1 2 . 1 1 8 8 LYS CB C 8 32.391 32.391 33.968 -1.577 19998
231 1 2 . 1 1 8 8 LYS H H 8 7.429 7.429 7.368 0.061 19998
232 1 2 . 1 1 9 9 SER N N 9 117.004 117.004 118.068 -1.064 19998
233 1 2 . 1 1 9 9 SER HA H 9 4.315 4.315 4.613 -0.298 19998
234 1 2 . 1 1 9 9 SER C C 9 170.486 170.486 174.353 -3.867 19998
235 1 2 . 1 1 9 9 SER CB C 9 63.355 63.355 62.662 0.693 19998
236 1 2 . 1 1 9 9 SER H H 9 8.542 8.542 8.544 -0.002 19998
237 1 2 . 1 1 10 10 CYS N N 10 119.238 119.238 120.647 -1.409 19998
238 1 2 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.768 0.065 19998
239 1 2 . 1 1 10 10 CYS C C 10 168.106 168.106 172.973 -4.867 19998
240 1 2 . 1 1 10 10 CYS CA C 10 53.907 53.907 55.973 -2.066 19998
241 1 2 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.385 15.456 19998
242 1 2 . 1 1 10 10 CYS H H 10 8.188 8.188 8.312 -0.124 19998
243 1 2 . 1 1 11 11 ASN N N 11 119.594 119.594 118.793 0.801 19998
244 1 2 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.199 -0.075 19998
245 1 2 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.733 -1.257 19998
246 1 2 . 1 1 11 11 ASN CB C 11 40.000 40.000 41.047 -1.047 19998
247 1 2 . 1 1 11 11 ASN H H 11 9.129 9.129 8.612 0.517 19998
248 1 2 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.462 -0.614 19998
249 1 2 . 1 1 12 12 PRO C C 12 174.197 174.197 178.465 -4.268 19998
250 1 2 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.957 -0.268 19998
251 1 2 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.257 -0.374 19998
252 1 2 . 1 1 13 13 SER N N 13 110.351 110.351 112.428 -2.077 19998
253 1 2 . 1 1 13 13 SER HA H 13 4.394 4.394 4.238 0.156 19998
254 1 2 . 1 1 13 13 SER C C 13 170.980 170.980 173.975 -2.995 19998
255 1 2 . 1 1 13 13 SER CA C 13 59.326 59.326 59.889 -0.563 19998
256 1 2 . 1 1 13 13 SER CB C 13 63.380 63.380 63.053 0.327 19998
257 1 2 . 1 1 13 13 SER H H 13 7.785 7.785 8.402 -0.617 19998
258 1 2 . 1 1 14 14 ASN N N 14 120.660 120.660 118.112 2.548 19998
259 1 2 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.895 -0.257 19998
260 1 2 . 1 1 14 14 ASN C C 14 171.412 171.412 173.489 -2.077 19998
261 1 2 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.722 1.084 19998
262 1 2 . 1 1 14 14 ASN CB C 14 37.810 37.810 38.949 -1.139 19998
263 1 2 . 1 1 14 14 ASN H H 14 7.613 7.613 7.780 -0.167 19998
264 1 2 . 1 1 15 15 ASP N N 15 124.062 124.062 121.430 2.632 19998
265 1 2 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.490 -0.380 19998
266 1 2 . 1 1 15 15 ASP C C 15 174.918 174.918 175.699 -0.781 19998
267 1 2 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.805 0.969 19998
268 1 2 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.632 0.729 19998
269 1 2 . 1 1 15 15 ASP H H 15 8.695 8.695 7.997 0.698 19998
270 1 2 . 1 1 16 16 GLN N N 16 127.008 127.008 122.267 4.741 19998
271 1 2 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.582 0.031 19998
272 1 2 . 1 1 16 16 GLN C C 16 173.874 173.874 174.059 -0.185 19998
273 1 2 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.776 -0.254 19998
274 1 2 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.120 -0.793 19998
275 1 2 . 1 1 16 16 GLN H H 16 8.041 8.041 8.580 -0.539 19998
276 1 2 . 1 1 17 17 CYS N N 17 122.234 122.234 119.010 3.224 19998
277 1 2 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.813 0.170 19998
278 1 2 . 1 1 17 17 CYS C C 17 173.908 173.908 174.775 -0.867 19998
279 1 2 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.718 -1.232 19998
280 1 2 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.543 8.363 19998
281 1 2 . 1 1 17 17 CYS H H 17 9.314 9.314 8.185 1.129 19998
282 1 2 . 1 1 18 18 CYS N N 18 118.883 118.883 122.612 -3.729 19998
283 1 2 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.526 0.083 19998
284 1 2 . 1 1 18 18 CYS C C 18 172.722 172.722 176.017 -3.295 19998
285 1 2 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.115 -3.595 19998
286 1 2 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.172 15.195 19998
287 1 2 . 1 1 18 18 CYS H H 18 9.192 9.192 8.578 0.614 19998
288 1 2 . 1 1 19 19 LYS N N 19 131.730 131.730 126.928 4.802 19998
289 1 2 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.092 0.240 19998
290 1 2 . 1 1 19 19 LYS C C 19 177.997 177.997 179.021 -1.024 19998
291 1 2 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.764 -0.338 19998
292 1 2 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.166 -0.847 19998
293 1 2 . 1 1 19 19 LYS H H 19 8.890 8.890 8.579 0.311 19998
294 1 2 . 1 1 20 20 SER N N 20 115.887 115.887 115.179 0.708 19998
295 1 2 . 1 1 20 20 SER HA H 20 4.334 4.334 4.301 0.033 19998
296 1 2 . 1 1 20 20 SER C C 20 172.946 172.946 175.375 -2.429 19998
297 1 2 . 1 1 20 20 SER CA C 20 60.311 60.311 60.586 -0.275 19998
298 1 2 . 1 1 20 20 SER CB C 20 62.327 62.327 62.843 -0.515 19998
299 1 2 . 1 1 20 20 SER H H 20 8.856 8.856 8.497 0.359 19998
300 1 2 . 1 1 21 21 SER N N 21 116.191 116.191 115.395 0.796 19998
301 1 2 . 1 1 21 21 SER HA H 21 4.833 4.833 4.599 0.234 19998
302 1 2 . 1 1 21 21 SER C C 21 170.505 170.505 173.103 -2.598 19998
303 1 2 . 1 1 21 21 SER CA C 21 57.500 57.500 57.808 -0.308 19998
304 1 2 . 1 1 21 21 SER CB C 21 63.852 63.852 63.695 0.157 19998
305 1 2 . 1 1 21 21 SER H H 21 7.068 7.068 7.456 -0.388 19998
306 1 2 . 1 1 22 22 SER N N 22 111.723 111.723 117.098 -5.375 19998
307 1 2 . 1 1 22 22 SER HA H 22 4.099 4.099 4.092 0.007 19998
308 1 2 . 1 1 22 22 SER C C 22 170.369 170.369 173.005 -2.636 19998
309 1 2 . 1 1 22 22 SER CA C 22 59.140 59.140 58.976 0.164 19998
310 1 2 . 1 1 22 22 SER CB C 22 61.339 61.339 62.093 -0.754 19998
311 1 2 . 1 1 22 22 SER H H 22 8.113 8.113 8.088 0.025 19998
312 1 2 . 1 1 23 23 LEU N N 23 115.988 115.988 119.695 -3.707 19998
313 1 2 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.907 -0.009 19998
314 1 2 . 1 1 23 23 LEU C C 23 173.712 173.712 175.232 -1.520 19998
315 1 2 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.382 -0.299 19998
316 1 2 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.637 0.425 19998
317 1 2 . 1 1 23 23 LEU H H 23 7.111 7.111 7.582 -0.471 19998
318 1 2 . 1 1 24 24 ALA N N 24 119.898 119.898 120.465 -0.567 19998
319 1 2 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.647 -0.181 19998
320 1 2 . 1 1 24 24 ALA C C 24 173.491 173.491 174.713 -1.222 19998
321 1 2 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.726 -0.559 19998
322 1 2 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.725 1.512 19998
323 1 2 . 1 1 24 24 ALA H H 24 8.904 8.904 7.717 1.187 19998
324 1 2 . 1 1 25 25 CYS N N 25 122.945 122.945 121.391 1.554 19998
325 1 2 . 1 1 25 25 CYS HA H 25 4.452 4.452 4.984 -0.532 19998
326 1 2 . 1 1 25 25 CYS C C 25 171.574 171.574 175.035 -3.461 19998
327 1 2 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.824 -1.692 19998
328 1 2 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.571 12.608 19998
329 1 2 . 1 1 25 25 CYS H H 25 9.847 9.847 8.643 1.204 19998
330 1 2 . 1 1 26 26 SER N N 26 122.285 122.285 123.472 -1.187 19998
331 1 2 . 1 1 26 26 SER HA H 26 4.543 4.543 4.768 -0.225 19998
332 1 2 . 1 1 26 26 SER CA C 26 57.773 57.773 57.608 0.165 19998
333 1 2 . 1 1 26 26 SER CB C 26 63.789 63.789 65.378 -1.589 19998
334 1 2 . 1 1 26 26 SER H H 26 7.791 7.791 8.367 -0.576 19998
335 1 2 . 1 1 27 27 THR N N 27 122.390 122.390 120.037 2.353 19998
336 1 2 . 1 1 27 27 THR HA H 27 3.778 3.778 4.281 -0.503 19998
337 1 2 . 1 1 27 27 THR C C 27 172.781 172.781 175.165 -2.384 19998
338 1 2 . 1 1 27 27 THR CA C 27 65.390 65.390 64.390 1.000 19998
339 1 2 . 1 1 27 27 THR CB C 27 68.458 68.458 68.779 -0.321 19998
340 1 2 . 1 1 27 27 THR H H 27 8.874 8.874 8.665 0.209 19998
341 1 2 . 1 1 28 28 LYS N N 28 118.883 118.883 120.928 -2.045 19998
342 1 2 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.169 -0.138 19998
343 1 2 . 1 1 28 28 LYS C C 28 174.613 174.613 176.916 -2.303 19998
344 1 2 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.568 -0.769 19998
345 1 2 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.548 0.616 19998
346 1 2 . 1 1 28 28 LYS H H 28 7.609 7.609 7.976 -0.367 19998
347 1 2 . 1 1 29 29 HIS N N 29 113.398 113.398 114.876 -1.478 19998
348 1 2 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.627 -0.343 19998
349 1 2 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.380 0.206 19998
350 1 2 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.595 -1.533 19998
351 1 2 . 1 1 29 29 HIS H H 29 7.450 7.450 7.999 -0.549 19998
352 1 2 . 1 1 30 30 LYS N N 30 116.344 116.344 119.034 -2.690 19998
353 1 2 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.218 -0.330 19998
354 1 2 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.344 0.156 19998
355 1 2 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.658 -1.049 19998
356 1 2 . 1 1 30 30 LYS H H 30 8.261 8.261 8.429 -0.168 19998
357 1 2 . 1 1 31 31 TRP N N 31 117.766 117.766 114.879 2.887 19998
358 1 2 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.028 0.449 19998
359 1 2 . 1 1 31 31 TRP C C 31 174.754 174.754 174.428 0.326 19998
360 1 2 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.198 1.558 19998
361 1 2 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.799 1.177 19998
362 1 2 . 1 1 31 31 TRP H H 31 8.483 8.483 7.739 0.744 19998
363 1 2 . 1 1 32 32 CYS N N 32 118.984 118.984 123.031 -4.047 19998
364 1 2 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.315 0.432 19998
365 1 2 . 1 1 32 32 CYS C C 32 171.472 171.472 174.765 -3.293 19998
366 1 2 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.177 -4.444 19998
367 1 2 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.550 14.974 19998
368 1 2 . 1 1 32 32 CYS H H 32 8.474 8.474 8.421 0.053 19998
369 1 2 . 1 1 33 33 LYS N N 33 124.672 124.672 123.831 0.841 19998
370 1 2 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.115 0.602 19998
371 1 2 . 1 1 33 33 LYS C C 33 172.236 172.236 175.470 -3.234 19998
372 1 2 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.139 0.591 19998
373 1 2 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.870 1.558 19998
374 1 2 . 1 1 33 33 LYS H H 33 9.027 9.027 8.358 0.669 19998
375 1 2 . 1 1 34 34 TYR N N 34 120.102 120.102 123.081 -2.979 19998
376 1 2 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.569 0.309 19998
377 1 2 . 1 1 34 34 TYR C C 34 174.034 174.034 176.801 -2.767 19998
378 1 2 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.888 0.374 19998
379 1 2 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.945 0.688 19998
380 1 2 . 1 1 34 34 TYR H H 34 8.092 8.092 8.741 -0.649 19998
381 1 2 . 1 1 35 35 GLU N N 35 124.362 124.362 126.242 -1.880 19998
382 1 2 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.341 0.121 19998
383 1 2 . 1 1 35 35 GLU C C 35 172.127 172.127 175.168 -3.041 19998
384 1 2 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.221 0.045 19998
385 1 2 . 1 1 35 35 GLU CB C 35 30.852 30.852 29.846 1.006 19998
386 1 2 . 1 1 35 35 GLU H H 35 8.754 8.754 8.576 0.178 19998
387 1 3 . 1 1 2 2 ALA N N 2 123.910 123.910 122.444 1.466 19998
388 1 3 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.710 -0.246 19998
389 1 3 . 1 1 2 2 ALA C C 2 174.673 174.673 176.233 -1.560 19998
390 1 3 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.208 -0.040 19998
391 1 3 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.773 0.917 19998
392 1 3 . 1 1 2 2 ALA H H 2 8.561 8.561 8.274 0.287 19998
393 1 3 . 1 1 3 3 CYS N N 3 117.207 117.207 118.904 -1.697 19998
394 1 3 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.689 0.276 19998
395 1 3 . 1 1 3 3 CYS C C 3 170.808 170.808 172.638 -1.830 19998
396 1 3 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.084 -2.329 19998
397 1 3 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.124 14.943 19998
398 1 3 . 1 1 3 3 CYS H H 3 8.335 8.335 8.203 0.132 19998
399 1 3 . 1 1 4 4 LEU N N 4 121.828 121.828 122.686 -0.858 19998
400 1 3 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.602 -0.257 19998
401 1 3 . 1 1 4 4 LEU C C 4 172.234 172.234 177.241 -5.007 19998
402 1 3 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.041 0.182 19998
403 1 3 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.839 0.739 19998
404 1 3 . 1 1 4 4 LEU H H 4 8.815 8.815 8.368 0.447 19998
405 1 3 . 1 1 5 5 GLY N N 5 107.508 107.508 110.451 -2.943 19998
406 1 3 . 1 1 5 5 GLY C C 5 169.768 169.768 173.425 -3.657 19998
407 1 3 . 1 1 5 5 GLY CA C 5 43.052 43.052 44.042 -0.990 19998
408 1 3 . 1 1 5 5 GLY H H 5 7.999 7.999 8.305 -0.306 19998
409 1 3 . 1 1 6 6 PHE N N 6 116.953 116.953 120.426 -3.473 19998
410 1 3 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.978 -0.359 19998
411 1 3 . 1 1 6 6 PHE C C 6 174.967 174.967 177.332 -2.365 19998
412 1 3 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.644 1.457 19998
413 1 3 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.067 0.439 19998
414 1 3 . 1 1 6 6 PHE H H 6 8.392 8.392 8.224 0.168 19998
415 1 3 . 1 1 7 7 GLY N N 7 115.074 115.074 114.615 0.459 19998
416 1 3 . 1 1 7 7 GLY C C 7 171.017 171.017 173.494 -2.477 19998
417 1 3 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.787 0.057 19998
418 1 3 . 1 1 7 7 GLY H H 7 8.645 8.645 7.553 1.092 19998
419 1 3 . 1 1 8 8 LYS N N 8 120.051 120.051 120.717 -0.666 19998
420 1 3 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.611 -0.298 19998
421 1 3 . 1 1 8 8 LYS C C 8 173.878 173.878 175.970 -2.092 19998
422 1 3 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.239 0.331 19998
423 1 3 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.181 -1.790 19998
424 1 3 . 1 1 8 8 LYS H H 8 7.429 7.429 7.369 0.060 19998
425 1 3 . 1 1 9 9 SER N N 9 117.004 117.004 117.334 -0.330 19998
426 1 3 . 1 1 9 9 SER HA H 9 4.315 4.315 4.627 -0.312 19998
427 1 3 . 1 1 9 9 SER C C 9 170.486 170.486 174.401 -3.915 19998
428 1 3 . 1 1 9 9 SER CB C 9 63.355 63.355 62.890 0.465 19998
429 1 3 . 1 1 9 9 SER H H 9 8.542 8.542 8.512 0.030 19998
430 1 3 . 1 1 10 10 CYS N N 10 119.238 119.238 121.616 -2.378 19998
431 1 3 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.758 0.075 19998
432 1 3 . 1 1 10 10 CYS C C 10 168.106 168.106 173.623 -5.517 19998
433 1 3 . 1 1 10 10 CYS CA C 10 53.907 53.907 55.949 -2.042 19998
434 1 3 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.297 15.544 19998
435 1 3 . 1 1 10 10 CYS H H 10 8.188 8.188 8.525 -0.337 19998
436 1 3 . 1 1 11 11 ASN N N 11 119.594 119.594 118.870 0.724 19998
437 1 3 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.198 -0.074 19998
438 1 3 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.560 -1.084 19998
439 1 3 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.327 -0.327 19998
440 1 3 . 1 1 11 11 ASN H H 11 9.129 9.129 8.600 0.529 19998
441 1 3 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.465 -0.617 19998
442 1 3 . 1 1 12 12 PRO C C 12 174.197 174.197 178.493 -4.296 19998
443 1 3 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.865 -0.176 19998
444 1 3 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.275 -0.392 19998
445 1 3 . 1 1 13 13 SER N N 13 110.351 110.351 112.541 -2.190 19998
446 1 3 . 1 1 13 13 SER HA H 13 4.394 4.394 4.225 0.169 19998
447 1 3 . 1 1 13 13 SER C C 13 170.980 170.980 173.964 -2.984 19998
448 1 3 . 1 1 13 13 SER CA C 13 59.326 59.326 59.886 -0.560 19998
449 1 3 . 1 1 13 13 SER CB C 13 63.380 63.380 63.084 0.297 19998
450 1 3 . 1 1 13 13 SER H H 13 7.785 7.785 8.393 -0.608 19998
451 1 3 . 1 1 14 14 ASN N N 14 120.660 120.660 117.854 2.806 19998
452 1 3 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.807 -0.169 19998
453 1 3 . 1 1 14 14 ASN C C 14 171.412 171.412 173.758 -2.346 19998
454 1 3 . 1 1 14 14 ASN CA C 14 52.806 52.806 52.196 0.610 19998
455 1 3 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.153 -1.343 19998
456 1 3 . 1 1 14 14 ASN H H 14 7.613 7.613 7.851 -0.238 19998
457 1 3 . 1 1 15 15 ASP N N 15 124.062 124.062 121.584 2.478 19998
458 1 3 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.536 -0.426 19998
459 1 3 . 1 1 15 15 ASP C C 15 174.918 174.918 175.762 -0.844 19998
460 1 3 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.719 1.055 19998
461 1 3 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.472 0.888 19998
462 1 3 . 1 1 15 15 ASP H H 15 8.695 8.695 8.035 0.660 19998
463 1 3 . 1 1 16 16 GLN N N 16 127.008 127.008 123.333 3.675 19998
464 1 3 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.514 0.099 19998
465 1 3 . 1 1 16 16 GLN C C 16 173.874 173.874 174.281 -0.407 19998
466 1 3 . 1 1 16 16 GLN CA C 16 54.522 54.522 55.126 -0.604 19998
467 1 3 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.430 -1.103 19998
468 1 3 . 1 1 16 16 GLN H H 16 8.041 8.041 8.645 -0.604 19998
469 1 3 . 1 1 17 17 CYS N N 17 122.234 122.234 118.537 3.697 19998
470 1 3 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.768 0.215 19998
471 1 3 . 1 1 17 17 CYS C C 17 173.908 173.908 174.853 -0.945 19998
472 1 3 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.626 -1.140 19998
473 1 3 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.562 8.344 19998
474 1 3 . 1 1 17 17 CYS H H 17 9.314 9.314 8.058 1.256 19998
475 1 3 . 1 1 18 18 CYS N N 18 118.883 118.883 122.722 -3.839 19998
476 1 3 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.491 0.117 19998
477 1 3 . 1 1 18 18 CYS C C 18 172.722 172.722 175.890 -3.168 19998
478 1 3 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.290 -3.769 19998
479 1 3 . 1 1 18 18 CYS CB C 18 41.367 41.367 25.878 15.489 19998
480 1 3 . 1 1 18 18 CYS H H 18 9.192 9.192 8.585 0.607 19998
481 1 3 . 1 1 19 19 LYS N N 19 131.730 131.730 126.268 5.462 19998
482 1 3 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.099 0.233 19998
483 1 3 . 1 1 19 19 LYS C C 19 177.997 177.997 178.589 -0.592 19998
484 1 3 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.885 -0.459 19998
485 1 3 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.207 -0.888 19998
486 1 3 . 1 1 19 19 LYS H H 19 8.890 8.890 8.499 0.391 19998
487 1 3 . 1 1 20 20 SER N N 20 115.887 115.887 113.821 2.066 19998
488 1 3 . 1 1 20 20 SER HA H 20 4.334 4.334 4.248 0.086 19998
489 1 3 . 1 1 20 20 SER C C 20 172.946 172.946 175.515 -2.569 19998
490 1 3 . 1 1 20 20 SER CA C 20 60.311 60.311 60.682 -0.371 19998
491 1 3 . 1 1 20 20 SER CB C 20 62.327 62.327 62.298 0.029 19998
492 1 3 . 1 1 20 20 SER H H 20 8.856 8.856 8.671 0.185 19998
493 1 3 . 1 1 21 21 SER N N 21 116.191 116.191 115.576 0.615 19998
494 1 3 . 1 1 21 21 SER HA H 21 4.833 4.833 4.628 0.205 19998
495 1 3 . 1 1 21 21 SER C C 21 170.505 170.505 173.417 -2.912 19998
496 1 3 . 1 1 21 21 SER CA C 21 57.500 57.500 58.150 -0.650 19998
497 1 3 . 1 1 21 21 SER CB C 21 63.852 63.852 63.561 0.291 19998
498 1 3 . 1 1 21 21 SER H H 21 7.068 7.068 7.555 -0.487 19998
499 1 3 . 1 1 22 22 SER N N 22 111.723 111.723 115.581 -3.858 19998
500 1 3 . 1 1 22 22 SER HA H 22 4.099 4.099 4.127 -0.028 19998
501 1 3 . 1 1 22 22 SER C C 22 170.369 170.369 173.012 -2.643 19998
502 1 3 . 1 1 22 22 SER CA C 22 59.140 59.140 59.728 -0.588 19998
503 1 3 . 1 1 22 22 SER CB C 22 61.339 61.339 61.350 -0.011 19998
504 1 3 . 1 1 22 22 SER H H 22 8.113 8.113 8.275 -0.162 19998
505 1 3 . 1 1 23 23 LEU N N 23 115.988 115.988 118.587 -2.599 19998
506 1 3 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.938 -0.040 19998
507 1 3 . 1 1 23 23 LEU C C 23 173.712 173.712 175.607 -1.895 19998
508 1 3 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.355 -0.272 19998
509 1 3 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.624 0.438 19998
510 1 3 . 1 1 23 23 LEU H H 23 7.111 7.111 7.553 -0.442 19998
511 1 3 . 1 1 24 24 ALA N N 24 119.898 119.898 120.943 -1.045 19998
512 1 3 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.647 -0.181 19998
513 1 3 . 1 1 24 24 ALA C C 24 173.491 173.491 174.689 -1.198 19998
514 1 3 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.757 -0.590 19998
515 1 3 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.712 1.525 19998
516 1 3 . 1 1 24 24 ALA H H 24 8.904 8.904 7.793 1.111 19998
517 1 3 . 1 1 25 25 CYS N N 25 122.945 122.945 121.154 1.791 19998
518 1 3 . 1 1 25 25 CYS HA H 25 4.452 4.452 4.960 -0.508 19998
519 1 3 . 1 1 25 25 CYS C C 25 171.574 171.574 175.243 -3.669 19998
520 1 3 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.659 -1.527 19998
521 1 3 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.509 12.670 19998
522 1 3 . 1 1 25 25 CYS H H 25 9.847 9.847 8.702 1.145 19998
523 1 3 . 1 1 26 26 SER N N 26 122.285 122.285 123.434 -1.149 19998
524 1 3 . 1 1 26 26 SER HA H 26 4.543 4.543 4.704 -0.161 19998
525 1 3 . 1 1 26 26 SER CA C 26 57.773 57.773 57.405 0.368 19998
526 1 3 . 1 1 26 26 SER CB C 26 63.789 63.789 65.941 -2.152 19998
527 1 3 . 1 1 26 26 SER H H 26 7.791 7.791 8.341 -0.550 19998
528 1 3 . 1 1 27 27 THR N N 27 122.390 122.390 121.109 1.281 19998
529 1 3 . 1 1 27 27 THR HA H 27 3.778 3.778 4.277 -0.499 19998
530 1 3 . 1 1 27 27 THR C C 27 172.781 172.781 175.071 -2.290 19998
531 1 3 . 1 1 27 27 THR CA C 27 65.390 65.390 64.247 1.143 19998
532 1 3 . 1 1 27 27 THR CB C 27 68.458 68.458 68.576 -0.118 19998
533 1 3 . 1 1 27 27 THR H H 27 8.874 8.874 8.669 0.205 19998
534 1 3 . 1 1 28 28 LYS N N 28 118.883 118.883 120.799 -1.916 19998
535 1 3 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.174 -0.143 19998
536 1 3 . 1 1 28 28 LYS C C 28 174.613 174.613 176.887 -2.274 19998
537 1 3 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.592 -0.793 19998
538 1 3 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.455 0.709 19998
539 1 3 . 1 1 28 28 LYS H H 28 7.609 7.609 7.985 -0.376 19998
540 1 3 . 1 1 29 29 HIS N N 29 113.398 113.398 114.902 -1.504 19998
541 1 3 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.621 -0.337 19998
542 1 3 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.368 0.218 19998
543 1 3 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.575 -1.513 19998
544 1 3 . 1 1 29 29 HIS H H 29 7.450 7.450 7.991 -0.541 19998
545 1 3 . 1 1 30 30 LYS N N 30 116.344 116.344 118.999 -2.655 19998
546 1 3 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.212 -0.324 19998
547 1 3 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.353 0.147 19998
548 1 3 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.653 -1.044 19998
549 1 3 . 1 1 30 30 LYS H H 30 8.261 8.261 8.423 -0.162 19998
550 1 3 . 1 1 31 31 TRP N N 31 117.766 117.766 114.856 2.910 19998
551 1 3 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.016 0.461 19998
552 1 3 . 1 1 31 31 TRP C C 31 174.754 174.754 174.392 0.362 19998
553 1 3 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.194 1.562 19998
554 1 3 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.791 1.185 19998
555 1 3 . 1 1 31 31 TRP H H 31 8.483 8.483 7.718 0.765 19998
556 1 3 . 1 1 32 32 CYS N N 32 118.984 118.984 123.013 -4.029 19998
557 1 3 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.285 0.462 19998
558 1 3 . 1 1 32 32 CYS C C 32 171.472 171.472 174.652 -3.180 19998
559 1 3 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.132 -4.399 19998
560 1 3 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.511 15.013 19998
561 1 3 . 1 1 32 32 CYS H H 32 8.474 8.474 8.391 0.083 19998
562 1 3 . 1 1 33 33 LYS N N 33 124.672 124.672 123.752 0.920 19998
563 1 3 . 1 1 33 33 LYS HA H 33 4.717 4.717 3.849 0.868 19998
564 1 3 . 1 1 33 33 LYS C C 33 172.236 172.236 175.407 -3.171 19998
565 1 3 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.026 0.704 19998
566 1 3 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.847 1.581 19998
567 1 3 . 1 1 33 33 LYS H H 33 9.027 9.027 8.255 0.772 19998
568 1 3 . 1 1 34 34 TYR N N 34 120.102 120.102 122.670 -2.568 19998
569 1 3 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.620 0.258 19998
570 1 3 . 1 1 34 34 TYR C C 34 174.034 174.034 176.873 -2.839 19998
571 1 3 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.480 0.783 19998
572 1 3 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.932 0.701 19998
573 1 3 . 1 1 34 34 TYR H H 34 8.092 8.092 8.705 -0.613 19998
574 1 3 . 1 1 35 35 GLU N N 35 124.362 124.362 126.290 -1.928 19998
575 1 3 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.317 0.145 19998
576 1 3 . 1 1 35 35 GLU C C 35 172.127 172.127 175.475 -3.348 19998
577 1 3 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.675 -0.408 19998
578 1 3 . 1 1 35 35 GLU CB C 35 30.852 30.852 29.805 1.047 19998
579 1 3 . 1 1 35 35 GLU H H 35 8.754 8.754 8.518 0.236 19998
580 1 4 . 1 1 2 2 ALA N N 2 123.910 123.910 123.186 0.724 19998
581 1 4 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.693 -0.229 19998
582 1 4 . 1 1 2 2 ALA C C 2 174.673 174.673 175.996 -1.323 19998
583 1 4 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.215 -0.048 19998
584 1 4 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.668 1.022 19998
585 1 4 . 1 1 2 2 ALA H H 2 8.561 8.561 8.149 0.412 19998
586 1 4 . 1 1 3 3 CYS N N 3 117.207 117.207 118.695 -1.488 19998
587 1 4 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.659 0.306 19998
588 1 4 . 1 1 3 3 CYS C C 3 170.808 170.808 172.423 -1.615 19998
589 1 4 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.571 -2.817 19998
590 1 4 . 1 1 3 3 CYS CB C 3 44.067 44.067 28.877 15.190 19998
591 1 4 . 1 1 3 3 CYS H H 3 8.335 8.335 8.206 0.129 19998
592 1 4 . 1 1 4 4 LEU N N 4 121.828 121.828 122.537 -0.709 19998
593 1 4 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.613 -0.268 19998
594 1 4 . 1 1 4 4 LEU C C 4 172.234 172.234 177.287 -5.053 19998
595 1 4 . 1 1 4 4 LEU CA C 4 54.223 54.223 53.902 0.321 19998
596 1 4 . 1 1 4 4 LEU CB C 4 44.578 44.578 44.006 0.572 19998
597 1 4 . 1 1 4 4 LEU H H 4 8.815 8.815 8.355 0.460 19998
598 1 4 . 1 1 5 5 GLY N N 5 107.508 107.508 110.475 -2.967 19998
599 1 4 . 1 1 5 5 GLY C C 5 169.768 169.768 173.433 -3.665 19998
600 1 4 . 1 1 5 5 GLY CA C 5 43.052 43.052 44.065 -1.013 19998
601 1 4 . 1 1 5 5 GLY H H 5 7.999 7.999 8.311 -0.312 19998
602 1 4 . 1 1 6 6 PHE N N 6 116.953 116.953 120.421 -3.468 19998
603 1 4 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.964 -0.345 19998
604 1 4 . 1 1 6 6 PHE C C 6 174.967 174.967 177.316 -2.349 19998
605 1 4 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.625 1.476 19998
606 1 4 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.048 0.458 19998
607 1 4 . 1 1 6 6 PHE H H 6 8.392 8.392 8.227 0.165 19998
608 1 4 . 1 1 7 7 GLY N N 7 115.074 115.074 114.561 0.513 19998
609 1 4 . 1 1 7 7 GLY C C 7 171.017 171.017 173.460 -2.443 19998
610 1 4 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.696 0.148 19998
611 1 4 . 1 1 7 7 GLY H H 7 8.645 8.645 7.547 1.098 19998
612 1 4 . 1 1 8 8 LYS N N 8 120.051 120.051 120.727 -0.676 19998
613 1 4 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.662 -0.349 19998
614 1 4 . 1 1 8 8 LYS C C 8 173.878 173.878 176.105 -2.227 19998
615 1 4 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.084 0.486 19998
616 1 4 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.237 -1.846 19998
617 1 4 . 1 1 8 8 LYS H H 8 7.429 7.429 7.383 0.046 19998
618 1 4 . 1 1 9 9 SER N N 9 117.004 117.004 117.252 -0.248 19998
619 1 4 . 1 1 9 9 SER HA H 9 4.315 4.315 4.706 -0.391 19998
620 1 4 . 1 1 9 9 SER C C 9 170.486 170.486 174.370 -3.884 19998
621 1 4 . 1 1 9 9 SER CB C 9 63.355 63.355 62.293 1.062 19998
622 1 4 . 1 1 9 9 SER H H 9 8.542 8.542 8.519 0.023 19998
623 1 4 . 1 1 10 10 CYS N N 10 119.238 119.238 121.131 -1.893 19998
624 1 4 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.761 0.072 19998
625 1 4 . 1 1 10 10 CYS C C 10 168.106 168.106 173.729 -5.623 19998
626 1 4 . 1 1 10 10 CYS CA C 10 53.907 53.907 56.311 -2.404 19998
627 1 4 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.468 15.373 19998
628 1 4 . 1 1 10 10 CYS H H 10 8.188 8.188 8.433 -0.245 19998
629 1 4 . 1 1 11 11 ASN N N 11 119.594 119.594 119.017 0.577 19998
630 1 4 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.204 -0.080 19998
631 1 4 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.526 -1.050 19998
632 1 4 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.254 -0.254 19998
633 1 4 . 1 1 11 11 ASN H H 11 9.129 9.129 8.624 0.505 19998
634 1 4 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.430 -0.582 19998
635 1 4 . 1 1 12 12 PRO C C 12 174.197 174.197 178.077 -3.880 19998
636 1 4 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.654 0.035 19998
637 1 4 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.139 -0.256 19998
638 1 4 . 1 1 13 13 SER N N 13 110.351 110.351 112.639 -2.288 19998
639 1 4 . 1 1 13 13 SER HA H 13 4.394 4.394 4.252 0.142 19998
640 1 4 . 1 1 13 13 SER C C 13 170.980 170.980 174.106 -3.126 19998
641 1 4 . 1 1 13 13 SER CA C 13 59.326 59.326 60.072 -0.746 19998
642 1 4 . 1 1 13 13 SER CB C 13 63.380 63.380 62.941 0.439 19998
643 1 4 . 1 1 13 13 SER H H 13 7.785 7.785 8.398 -0.613 19998
644 1 4 . 1 1 14 14 ASN N N 14 120.660 120.660 119.144 1.516 19998
645 1 4 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.809 -0.171 19998
646 1 4 . 1 1 14 14 ASN C C 14 171.412 171.412 173.441 -2.029 19998
647 1 4 . 1 1 14 14 ASN CA C 14 52.806 52.806 52.343 0.463 19998
648 1 4 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.462 -1.652 19998
649 1 4 . 1 1 14 14 ASN H H 14 7.613 7.613 7.698 -0.085 19998
650 1 4 . 1 1 15 15 ASP N N 15 124.062 124.062 122.144 1.918 19998
651 1 4 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.505 -0.395 19998
652 1 4 . 1 1 15 15 ASP C C 15 174.918 174.918 175.228 -0.310 19998
653 1 4 . 1 1 15 15 ASP CA C 15 55.774 55.774 55.206 0.568 19998
654 1 4 . 1 1 15 15 ASP CB C 15 41.360 41.360 41.187 0.173 19998
655 1 4 . 1 1 15 15 ASP H H 15 8.695 8.695 8.203 0.492 19998
656 1 4 . 1 1 16 16 GLN N N 16 127.008 127.008 124.022 2.986 19998
657 1 4 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.500 0.113 19998
658 1 4 . 1 1 16 16 GLN C C 16 173.874 173.874 174.324 -0.450 19998
659 1 4 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.766 -0.244 19998
660 1 4 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.414 -1.087 19998
661 1 4 . 1 1 16 16 GLN H H 16 8.041 8.041 8.499 -0.458 19998
662 1 4 . 1 1 17 17 CYS N N 17 122.234 122.234 118.632 3.602 19998
663 1 4 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.807 0.176 19998
664 1 4 . 1 1 17 17 CYS C C 17 173.908 173.908 174.822 -0.914 19998
665 1 4 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.747 -1.261 19998
666 1 4 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.821 8.085 19998
667 1 4 . 1 1 17 17 CYS H H 17 9.314 9.314 8.024 1.290 19998
668 1 4 . 1 1 18 18 CYS N N 18 118.883 118.883 122.632 -3.749 19998
669 1 4 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.536 0.072 19998
670 1 4 . 1 1 18 18 CYS C C 18 172.722 172.722 176.021 -3.299 19998
671 1 4 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.063 -3.542 19998
672 1 4 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.102 15.265 19998
673 1 4 . 1 1 18 18 CYS H H 18 9.192 9.192 8.579 0.613 19998
674 1 4 . 1 1 19 19 LYS N N 19 131.730 131.730 126.984 4.746 19998
675 1 4 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.063 0.269 19998
676 1 4 . 1 1 19 19 LYS C C 19 177.997 177.997 178.785 -0.788 19998
677 1 4 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.920 -0.494 19998
678 1 4 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.102 -0.783 19998
679 1 4 . 1 1 19 19 LYS H H 19 8.890 8.890 8.507 0.383 19998
680 1 4 . 1 1 20 20 SER N N 20 115.887 115.887 113.857 2.030 19998
681 1 4 . 1 1 20 20 SER HA H 20 4.334 4.334 4.231 0.103 19998
682 1 4 . 1 1 20 20 SER C C 20 172.946 172.946 175.347 -2.401 19998
683 1 4 . 1 1 20 20 SER CA C 20 60.311 60.311 60.784 -0.473 19998
684 1 4 . 1 1 20 20 SER CB C 20 62.327 62.327 62.267 0.060 19998
685 1 4 . 1 1 20 20 SER H H 20 8.856 8.856 8.675 0.181 19998
686 1 4 . 1 1 21 21 SER N N 21 116.191 116.191 116.956 -0.765 19998
687 1 4 . 1 1 21 21 SER HA H 21 4.833 4.833 4.594 0.239 19998
688 1 4 . 1 1 21 21 SER C C 21 170.505 170.505 173.482 -2.977 19998
689 1 4 . 1 1 21 21 SER CA C 21 57.500 57.500 58.148 -0.648 19998
690 1 4 . 1 1 21 21 SER CB C 21 63.852 63.852 63.623 0.230 19998
691 1 4 . 1 1 21 21 SER H H 21 7.068 7.068 7.533 -0.465 19998
692 1 4 . 1 1 22 22 SER N N 22 111.723 111.723 115.884 -4.161 19998
693 1 4 . 1 1 22 22 SER HA H 22 4.099 4.099 4.086 0.013 19998
694 1 4 . 1 1 22 22 SER C C 22 170.369 170.369 172.893 -2.524 19998
695 1 4 . 1 1 22 22 SER CA C 22 59.140 59.140 59.577 -0.437 19998
696 1 4 . 1 1 22 22 SER CB C 22 61.339 61.339 61.752 -0.413 19998
697 1 4 . 1 1 22 22 SER H H 22 8.113 8.113 8.278 -0.165 19998
698 1 4 . 1 1 23 23 LEU N N 23 115.988 115.988 118.870 -2.882 19998
699 1 4 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.927 -0.029 19998
700 1 4 . 1 1 23 23 LEU C C 23 173.712 173.712 175.613 -1.901 19998
701 1 4 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.303 -0.220 19998
702 1 4 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.961 0.101 19998
703 1 4 . 1 1 23 23 LEU H H 23 7.111 7.111 7.490 -0.379 19998
704 1 4 . 1 1 24 24 ALA N N 24 119.898 119.898 119.914 -0.016 19998
705 1 4 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.725 -0.259 19998
706 1 4 . 1 1 24 24 ALA C C 24 173.491 173.491 174.717 -1.226 19998
707 1 4 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.506 -0.339 19998
708 1 4 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.841 1.396 19998
709 1 4 . 1 1 24 24 ALA H H 24 8.904 8.904 7.867 1.037 19998
710 1 4 . 1 1 25 25 CYS N N 25 122.945 122.945 121.159 1.786 19998
711 1 4 . 1 1 25 25 CYS HA H 25 4.452 4.452 4.999 -0.547 19998
712 1 4 . 1 1 25 25 CYS C C 25 171.574 171.574 174.903 -3.329 19998
713 1 4 . 1 1 25 25 CYS CA C 25 56.132 56.132 58.368 -2.236 19998
714 1 4 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.458 12.721 19998
715 1 4 . 1 1 25 25 CYS H H 25 9.847 9.847 8.488 1.359 19998
716 1 4 . 1 1 26 26 SER N N 26 122.285 122.285 122.673 -0.388 19998
717 1 4 . 1 1 26 26 SER HA H 26 4.543 4.543 4.723 -0.180 19998
718 1 4 . 1 1 26 26 SER CA C 26 57.773 57.773 57.179 0.594 19998
719 1 4 . 1 1 26 26 SER CB C 26 63.789 63.789 66.082 -2.293 19998
720 1 4 . 1 1 26 26 SER H H 26 7.791 7.791 8.403 -0.612 19998
721 1 4 . 1 1 27 27 THR N N 27 122.390 122.390 120.985 1.405 19998
722 1 4 . 1 1 27 27 THR HA H 27 3.778 3.778 4.249 -0.471 19998
723 1 4 . 1 1 27 27 THR C C 27 172.781 172.781 175.389 -2.608 19998
724 1 4 . 1 1 27 27 THR CA C 27 65.390 65.390 64.409 0.981 19998
725 1 4 . 1 1 27 27 THR CB C 27 68.458 68.458 68.815 -0.357 19998
726 1 4 . 1 1 27 27 THR H H 27 8.874 8.874 8.724 0.150 19998
727 1 4 . 1 1 28 28 LYS N N 28 118.883 118.883 120.860 -1.977 19998
728 1 4 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.193 -0.162 19998
729 1 4 . 1 1 28 28 LYS C C 28 174.613 174.613 176.810 -2.197 19998
730 1 4 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.458 -0.659 19998
731 1 4 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.431 0.733 19998
732 1 4 . 1 1 28 28 LYS H H 28 7.609 7.609 8.170 -0.561 19998
733 1 4 . 1 1 29 29 HIS N N 29 113.398 113.398 114.841 -1.443 19998
734 1 4 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.641 -0.357 19998
735 1 4 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.634 -0.048 19998
736 1 4 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.843 -1.781 19998
737 1 4 . 1 1 29 29 HIS H H 29 7.450 7.450 8.050 -0.600 19998
738 1 4 . 1 1 30 30 LYS N N 30 116.344 116.344 119.098 -2.754 19998
739 1 4 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.215 -0.327 19998
740 1 4 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.352 0.148 19998
741 1 4 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.642 -1.033 19998
742 1 4 . 1 1 30 30 LYS H H 30 8.261 8.261 8.434 -0.173 19998
743 1 4 . 1 1 31 31 TRP N N 31 117.766 117.766 114.919 2.847 19998
744 1 4 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.010 0.467 19998
745 1 4 . 1 1 31 31 TRP C C 31 174.754 174.754 174.398 0.356 19998
746 1 4 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.218 1.538 19998
747 1 4 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.799 1.177 19998
748 1 4 . 1 1 31 31 TRP H H 31 8.483 8.483 7.757 0.726 19998
749 1 4 . 1 1 32 32 CYS N N 32 118.984 118.984 123.047 -4.063 19998
750 1 4 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.317 0.430 19998
751 1 4 . 1 1 32 32 CYS C C 32 171.472 171.472 174.742 -3.270 19998
752 1 4 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.225 -4.492 19998
753 1 4 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.577 14.947 19998
754 1 4 . 1 1 32 32 CYS H H 32 8.474 8.474 8.417 0.057 19998
755 1 4 . 1 1 33 33 LYS N N 33 124.672 124.672 123.926 0.746 19998
756 1 4 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.104 0.613 19998
757 1 4 . 1 1 33 33 LYS C C 33 172.236 172.236 175.458 -3.222 19998
758 1 4 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.096 0.634 19998
759 1 4 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.940 1.489 19998
760 1 4 . 1 1 33 33 LYS H H 33 9.027 9.027 8.303 0.724 19998
761 1 4 . 1 1 34 34 TYR N N 34 120.102 120.102 122.313 -2.211 19998
762 1 4 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.591 0.287 19998
763 1 4 . 1 1 34 34 TYR C C 34 174.034 174.034 176.740 -2.706 19998
764 1 4 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.687 0.575 19998
765 1 4 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.977 0.656 19998
766 1 4 . 1 1 34 34 TYR H H 34 8.092 8.092 8.669 -0.577 19998
767 1 4 . 1 1 35 35 GLU N N 35 124.362 124.362 126.149 -1.787 19998
768 1 4 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.449 0.013 19998
769 1 4 . 1 1 35 35 GLU C C 35 172.127 172.127 175.257 -3.130 19998
770 1 4 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.122 0.145 19998
771 1 4 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.068 0.784 19998
772 1 4 . 1 1 35 35 GLU H H 35 8.754 8.754 8.404 0.350 19998
773 1 5 . 1 1 2 2 ALA N N 2 123.910 123.910 126.493 -2.583 19998
774 1 5 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.935 -0.471 19998
775 1 5 . 1 1 2 2 ALA C C 2 174.673 174.673 176.577 -1.904 19998
776 1 5 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.220 -0.052 19998
777 1 5 . 1 1 2 2 ALA CB C 2 19.690 19.690 19.077 0.613 19998
778 1 5 . 1 1 2 2 ALA H H 2 8.561 8.561 8.308 0.253 19998
779 1 5 . 1 1 3 3 CYS N N 3 117.207 117.207 118.820 -1.613 19998
780 1 5 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.649 0.316 19998
781 1 5 . 1 1 3 3 CYS C C 3 170.808 170.808 172.621 -1.813 19998
782 1 5 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.408 -2.654 19998
783 1 5 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.182 14.885 19998
784 1 5 . 1 1 3 3 CYS H H 3 8.335 8.335 8.236 0.099 19998
785 1 5 . 1 1 4 4 LEU N N 4 121.828 121.828 122.839 -1.011 19998
786 1 5 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.617 -0.272 19998
787 1 5 . 1 1 4 4 LEU C C 4 172.234 172.234 177.209 -4.975 19998
788 1 5 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.041 0.182 19998
789 1 5 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.794 0.784 19998
790 1 5 . 1 1 4 4 LEU H H 4 8.815 8.815 8.398 0.417 19998
791 1 5 . 1 1 5 5 GLY N N 5 107.508 107.508 110.363 -2.855 19998
792 1 5 . 1 1 5 5 GLY C C 5 169.768 169.768 173.416 -3.648 19998
793 1 5 . 1 1 5 5 GLY CA C 5 43.052 43.052 43.981 -0.929 19998
794 1 5 . 1 1 5 5 GLY H H 5 7.999 7.999 8.314 -0.315 19998
795 1 5 . 1 1 6 6 PHE N N 6 116.953 116.953 120.422 -3.469 19998
796 1 5 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.962 -0.343 19998
797 1 5 . 1 1 6 6 PHE C C 6 174.967 174.967 177.349 -2.382 19998
798 1 5 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.660 1.441 19998
799 1 5 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.062 0.444 19998
800 1 5 . 1 1 6 6 PHE H H 6 8.392 8.392 8.237 0.155 19998
801 1 5 . 1 1 7 7 GLY N N 7 115.074 115.074 114.525 0.549 19998
802 1 5 . 1 1 7 7 GLY C C 7 171.017 171.017 173.476 -2.459 19998
803 1 5 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.722 0.122 19998
804 1 5 . 1 1 7 7 GLY H H 7 8.645 8.645 7.549 1.096 19998
805 1 5 . 1 1 8 8 LYS N N 8 120.051 120.051 120.887 -0.836 19998
806 1 5 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.643 -0.330 19998
807 1 5 . 1 1 8 8 LYS C C 8 173.878 173.878 175.913 -2.035 19998
808 1 5 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.128 0.442 19998
809 1 5 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.312 -1.921 19998
810 1 5 . 1 1 8 8 LYS H H 8 7.429 7.429 7.370 0.059 19998
811 1 5 . 1 1 9 9 SER N N 9 117.004 117.004 116.511 0.493 19998
812 1 5 . 1 1 9 9 SER HA H 9 4.315 4.315 4.678 -0.363 19998
813 1 5 . 1 1 9 9 SER C C 9 170.486 170.486 174.616 -4.130 19998
814 1 5 . 1 1 9 9 SER CB C 9 63.355 63.355 62.510 0.845 19998
815 1 5 . 1 1 9 9 SER H H 9 8.542 8.542 8.479 0.063 19998
816 1 5 . 1 1 10 10 CYS N N 10 119.238 119.238 121.220 -1.982 19998
817 1 5 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.737 0.096 19998
818 1 5 . 1 1 10 10 CYS C C 10 168.106 168.106 173.766 -5.660 19998
819 1 5 . 1 1 10 10 CYS CA C 10 53.907 53.907 56.085 -2.178 19998
820 1 5 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.250 15.591 19998
821 1 5 . 1 1 10 10 CYS H H 10 8.188 8.188 8.412 -0.224 19998
822 1 5 . 1 1 11 11 ASN N N 11 119.594 119.594 118.954 0.640 19998
823 1 5 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.203 -0.079 19998
824 1 5 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.531 -1.055 19998
825 1 5 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.255 -0.255 19998
826 1 5 . 1 1 11 11 ASN H H 11 9.129 9.129 8.610 0.519 19998
827 1 5 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.473 -0.625 19998
828 1 5 . 1 1 12 12 PRO C C 12 174.197 174.197 178.348 -4.151 19998
829 1 5 . 1 1 12 12 PRO CA C 12 64.689 64.689 65.033 -0.344 19998
830 1 5 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.239 -0.356 19998
831 1 5 . 1 1 13 13 SER N N 13 110.351 110.351 112.591 -2.240 19998
832 1 5 . 1 1 13 13 SER HA H 13 4.394 4.394 4.250 0.144 19998
833 1 5 . 1 1 13 13 SER C C 13 170.980 170.980 174.197 -3.217 19998
834 1 5 . 1 1 13 13 SER CA C 13 59.326 59.326 59.947 -0.621 19998
835 1 5 . 1 1 13 13 SER CB C 13 63.380 63.380 63.141 0.240 19998
836 1 5 . 1 1 13 13 SER H H 13 7.785 7.785 8.416 -0.631 19998
837 1 5 . 1 1 14 14 ASN N N 14 120.660 120.660 117.889 2.771 19998
838 1 5 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.855 -0.217 19998
839 1 5 . 1 1 14 14 ASN C C 14 171.412 171.412 173.495 -2.083 19998
840 1 5 . 1 1 14 14 ASN CA C 14 52.806 52.806 52.069 0.737 19998
841 1 5 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.282 -1.472 19998
842 1 5 . 1 1 14 14 ASN H H 14 7.613 7.613 7.830 -0.217 19998
843 1 5 . 1 1 15 15 ASP N N 15 124.062 124.062 121.339 2.723 19998
844 1 5 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.549 -0.439 19998
845 1 5 . 1 1 15 15 ASP C C 15 174.918 174.918 175.680 -0.762 19998
846 1 5 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.772 1.002 19998
847 1 5 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.522 0.838 19998
848 1 5 . 1 1 15 15 ASP H H 15 8.695 8.695 8.005 0.690 19998
849 1 5 . 1 1 16 16 GLN N N 16 127.008 127.008 123.417 3.591 19998
850 1 5 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.508 0.105 19998
851 1 5 . 1 1 16 16 GLN C C 16 173.874 173.874 174.279 -0.405 19998
852 1 5 . 1 1 16 16 GLN CA C 16 54.522 54.522 55.133 -0.611 19998
853 1 5 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.509 -1.182 19998
854 1 5 . 1 1 16 16 GLN H H 16 8.041 8.041 8.634 -0.593 19998
855 1 5 . 1 1 17 17 CYS N N 17 122.234 122.234 118.532 3.702 19998
856 1 5 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.766 0.217 19998
857 1 5 . 1 1 17 17 CYS C C 17 173.908 173.908 174.854 -0.946 19998
858 1 5 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.608 -1.122 19998
859 1 5 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.530 8.376 19998
860 1 5 . 1 1 17 17 CYS H H 17 9.314 9.314 8.032 1.282 19998
861 1 5 . 1 1 18 18 CYS N N 18 118.883 118.883 122.626 -3.743 19998
862 1 5 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.533 0.075 19998
863 1 5 . 1 1 18 18 CYS C C 18 172.722 172.722 176.022 -3.300 19998
864 1 5 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.063 -3.542 19998
865 1 5 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.140 15.227 19998
866 1 5 . 1 1 18 18 CYS H H 18 9.192 9.192 8.569 0.623 19998
867 1 5 . 1 1 19 19 LYS N N 19 131.730 131.730 126.843 4.887 19998
868 1 5 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.089 0.243 19998
869 1 5 . 1 1 19 19 LYS C C 19 177.997 177.997 179.022 -1.025 19998
870 1 5 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.797 -0.371 19998
871 1 5 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.144 -0.825 19998
872 1 5 . 1 1 19 19 LYS H H 19 8.890 8.890 8.556 0.334 19998
873 1 5 . 1 1 20 20 SER N N 20 115.887 115.887 114.915 0.972 19998
874 1 5 . 1 1 20 20 SER HA H 20 4.334 4.334 4.278 0.056 19998
875 1 5 . 1 1 20 20 SER C C 20 172.946 172.946 175.757 -2.811 19998
876 1 5 . 1 1 20 20 SER CA C 20 60.311 60.311 60.882 -0.571 19998
877 1 5 . 1 1 20 20 SER CB C 20 62.327 62.327 62.886 -0.559 19998
878 1 5 . 1 1 20 20 SER H H 20 8.856 8.856 8.308 0.548 19998
879 1 5 . 1 1 21 21 SER N N 21 116.191 116.191 115.034 1.157 19998
880 1 5 . 1 1 21 21 SER HA H 21 4.833 4.833 4.572 0.261 19998
881 1 5 . 1 1 21 21 SER C C 21 170.505 170.505 173.408 -2.903 19998
882 1 5 . 1 1 21 21 SER CA C 21 57.500 57.500 57.550 -0.050 19998
883 1 5 . 1 1 21 21 SER CB C 21 63.852 63.852 63.489 0.363 19998
884 1 5 . 1 1 21 21 SER H H 21 7.068 7.068 7.568 -0.500 19998
885 1 5 . 1 1 22 22 SER N N 22 111.723 111.723 116.865 -5.142 19998
886 1 5 . 1 1 22 22 SER HA H 22 4.099 4.099 4.135 -0.036 19998
887 1 5 . 1 1 22 22 SER C C 22 170.369 170.369 172.890 -2.521 19998
888 1 5 . 1 1 22 22 SER CA C 22 59.140 59.140 59.548 -0.409 19998
889 1 5 . 1 1 22 22 SER CB C 22 61.339 61.339 61.688 -0.349 19998
890 1 5 . 1 1 22 22 SER H H 22 8.113 8.113 8.223 -0.110 19998
891 1 5 . 1 1 23 23 LEU N N 23 115.988 115.988 120.232 -4.244 19998
892 1 5 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.928 -0.030 19998
893 1 5 . 1 1 23 23 LEU C C 23 173.712 173.712 175.098 -1.386 19998
894 1 5 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.466 -0.383 19998
895 1 5 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.516 0.547 19998
896 1 5 . 1 1 23 23 LEU H H 23 7.111 7.111 7.650 -0.539 19998
897 1 5 . 1 1 24 24 ALA N N 24 119.898 119.898 120.512 -0.614 19998
898 1 5 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.662 -0.196 19998
899 1 5 . 1 1 24 24 ALA C C 24 173.491 173.491 174.774 -1.283 19998
900 1 5 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.755 -0.588 19998
901 1 5 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.791 1.446 19998
902 1 5 . 1 1 24 24 ALA H H 24 8.904 8.904 7.747 1.157 19998
903 1 5 . 1 1 25 25 CYS N N 25 122.945 122.945 121.215 1.730 19998
904 1 5 . 1 1 25 25 CYS HA H 25 4.452 4.452 5.072 -0.620 19998
905 1 5 . 1 1 25 25 CYS C C 25 171.574 171.574 174.989 -3.415 19998
906 1 5 . 1 1 25 25 CYS CA C 25 56.132 56.132 58.082 -1.950 19998
907 1 5 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.656 12.523 19998
908 1 5 . 1 1 25 25 CYS H H 25 9.847 9.847 8.640 1.207 19998
909 1 5 . 1 1 26 26 SER N N 26 122.285 122.285 122.405 -0.120 19998
910 1 5 . 1 1 26 26 SER HA H 26 4.543 4.543 4.715 -0.172 19998
911 1 5 . 1 1 26 26 SER CA C 26 57.773 57.773 57.112 0.661 19998
912 1 5 . 1 1 26 26 SER CB C 26 63.789 63.789 65.825 -2.035 19998
913 1 5 . 1 1 26 26 SER H H 26 7.791 7.791 8.388 -0.597 19998
914 1 5 . 1 1 27 27 THR N N 27 122.390 122.390 121.151 1.239 19998
915 1 5 . 1 1 27 27 THR HA H 27 3.778 3.778 4.213 -0.435 19998
916 1 5 . 1 1 27 27 THR C C 27 172.781 172.781 175.125 -2.344 19998
917 1 5 . 1 1 27 27 THR CA C 27 65.390 65.390 64.609 0.781 19998
918 1 5 . 1 1 27 27 THR CB C 27 68.458 68.458 68.822 -0.364 19998
919 1 5 . 1 1 27 27 THR H H 27 8.874 8.874 8.709 0.165 19998
920 1 5 . 1 1 28 28 LYS N N 28 118.883 118.883 120.998 -2.115 19998
921 1 5 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.120 -0.089 19998
922 1 5 . 1 1 28 28 LYS C C 28 174.613 174.613 176.855 -2.242 19998
923 1 5 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.630 -0.831 19998
924 1 5 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.497 0.667 19998
925 1 5 . 1 1 28 28 LYS H H 28 7.609 7.609 8.058 -0.449 19998
926 1 5 . 1 1 29 29 HIS N N 29 113.398 113.398 114.739 -1.341 19998
927 1 5 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.609 -0.325 19998
928 1 5 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.420 0.166 19998
929 1 5 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.563 -1.501 19998
930 1 5 . 1 1 29 29 HIS H H 29 7.450 7.450 7.995 -0.545 19998
931 1 5 . 1 1 30 30 LYS N N 30 116.344 116.344 119.051 -2.707 19998
932 1 5 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.216 -0.328 19998
933 1 5 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.342 0.158 19998
934 1 5 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.642 -1.033 19998
935 1 5 . 1 1 30 30 LYS H H 30 8.261 8.261 8.430 -0.169 19998
936 1 5 . 1 1 31 31 TRP N N 31 117.766 117.766 114.884 2.882 19998
937 1 5 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.029 0.448 19998
938 1 5 . 1 1 31 31 TRP C C 31 174.754 174.754 174.440 0.314 19998
939 1 5 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.180 1.576 19998
940 1 5 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.817 1.159 19998
941 1 5 . 1 1 31 31 TRP H H 31 8.483 8.483 7.753 0.730 19998
942 1 5 . 1 1 32 32 CYS N N 32 118.984 118.984 123.006 -4.022 19998
943 1 5 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.304 0.443 19998
944 1 5 . 1 1 32 32 CYS C C 32 171.472 171.472 174.751 -3.279 19998
945 1 5 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.179 -4.446 19998
946 1 5 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.533 14.991 19998
947 1 5 . 1 1 32 32 CYS H H 32 8.474 8.474 8.421 0.053 19998
948 1 5 . 1 1 33 33 LYS N N 33 124.672 124.672 123.814 0.858 19998
949 1 5 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.086 0.631 19998
950 1 5 . 1 1 33 33 LYS C C 33 172.236 172.236 175.475 -3.239 19998
951 1 5 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.132 0.598 19998
952 1 5 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.845 1.584 19998
953 1 5 . 1 1 33 33 LYS H H 33 9.027 9.027 8.423 0.604 19998
954 1 5 . 1 1 34 34 TYR N N 34 120.102 120.102 123.190 -3.088 19998
955 1 5 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.589 0.289 19998
956 1 5 . 1 1 34 34 TYR C C 34 174.034 174.034 176.836 -2.802 19998
957 1 5 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.846 0.416 19998
958 1 5 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.980 0.653 19998
959 1 5 . 1 1 34 34 TYR H H 34 8.092 8.092 8.761 -0.669 19998
960 1 5 . 1 1 35 35 GLU N N 35 124.362 124.362 125.334 -0.972 19998
961 1 5 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.437 0.025 19998
962 1 5 . 1 1 35 35 GLU C C 35 172.127 172.127 175.794 -3.667 19998
963 1 5 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.045 0.222 19998
964 1 5 . 1 1 35 35 GLU CB C 35 30.852 30.852 29.903 0.949 19998
965 1 5 . 1 1 35 35 GLU H H 35 8.754 8.754 8.680 0.074 19998
966 1 6 . 1 1 2 2 ALA N N 2 123.910 123.910 123.010 0.900 19998
967 1 6 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.698 -0.234 19998
968 1 6 . 1 1 2 2 ALA C C 2 174.673 174.673 176.079 -1.406 19998
969 1 6 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.208 -0.040 19998
970 1 6 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.628 1.062 19998
971 1 6 . 1 1 2 2 ALA H H 2 8.561 8.561 8.231 0.330 19998
972 1 6 . 1 1 3 3 CYS N N 3 117.207 117.207 118.692 -1.485 19998
973 1 6 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.654 0.311 19998
974 1 6 . 1 1 3 3 CYS C C 3 170.808 170.808 172.509 -1.701 19998
975 1 6 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.307 -2.553 19998
976 1 6 . 1 1 3 3 CYS CB C 3 44.067 44.067 28.862 15.205 19998
977 1 6 . 1 1 3 3 CYS H H 3 8.335 8.335 8.205 0.130 19998
978 1 6 . 1 1 4 4 LEU N N 4 121.828 121.828 122.743 -0.915 19998
979 1 6 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.610 -0.265 19998
980 1 6 . 1 1 4 4 LEU C C 4 172.234 172.234 177.231 -4.997 19998
981 1 6 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.046 0.177 19998
982 1 6 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.944 0.633 19998
983 1 6 . 1 1 4 4 LEU H H 4 8.815 8.815 8.366 0.449 19998
984 1 6 . 1 1 5 5 GLY N N 5 107.508 107.508 110.429 -2.921 19998
985 1 6 . 1 1 5 5 GLY C C 5 169.768 169.768 173.434 -3.666 19998
986 1 6 . 1 1 5 5 GLY CA C 5 43.052 43.052 44.033 -0.981 19998
987 1 6 . 1 1 5 5 GLY H H 5 7.999 7.999 8.321 -0.322 19998
988 1 6 . 1 1 6 6 PHE N N 6 116.953 116.953 120.445 -3.492 19998
989 1 6 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.969 -0.350 19998
990 1 6 . 1 1 6 6 PHE C C 6 174.967 174.967 177.335 -2.368 19998
991 1 6 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.611 1.490 19998
992 1 6 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.028 0.478 19998
993 1 6 . 1 1 6 6 PHE H H 6 8.392 8.392 8.247 0.145 19998
994 1 6 . 1 1 7 7 GLY N N 7 115.074 115.074 114.590 0.484 19998
995 1 6 . 1 1 7 7 GLY C C 7 171.017 171.017 173.459 -2.442 19998
996 1 6 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.691 0.153 19998
997 1 6 . 1 1 7 7 GLY H H 7 8.645 8.645 7.554 1.091 19998
998 1 6 . 1 1 8 8 LYS N N 8 120.051 120.051 120.843 -0.792 19998
999 1 6 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.656 -0.343 19998
1000 1 6 . 1 1 8 8 LYS C C 8 173.878 173.878 176.132 -2.254 19998
1001 1 6 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.072 0.498 19998
1002 1 6 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.128 -1.737 19998
1003 1 6 . 1 1 8 8 LYS H H 8 7.429 7.429 7.381 0.048 19998
1004 1 6 . 1 1 9 9 SER N N 9 117.004 117.004 117.683 -0.679 19998
1005 1 6 . 1 1 9 9 SER HA H 9 4.315 4.315 4.652 -0.337 19998
1006 1 6 . 1 1 9 9 SER C C 9 170.486 170.486 174.415 -3.929 19998
1007 1 6 . 1 1 9 9 SER CB C 9 63.355 63.355 62.139 1.216 19998
1008 1 6 . 1 1 9 9 SER H H 9 8.542 8.542 8.528 0.014 19998
1009 1 6 . 1 1 10 10 CYS N N 10 119.238 119.238 121.099 -1.861 19998
1010 1 6 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.764 0.069 19998
1011 1 6 . 1 1 10 10 CYS C C 10 168.106 168.106 173.718 -5.612 19998
1012 1 6 . 1 1 10 10 CYS CA C 10 53.907 53.907 56.294 -2.387 19998
1013 1 6 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.535 15.306 19998
1014 1 6 . 1 1 10 10 CYS H H 10 8.188 8.188 8.393 -0.205 19998
1015 1 6 . 1 1 11 11 ASN N N 11 119.594 119.594 118.974 0.620 19998
1016 1 6 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.202 -0.078 19998
1017 1 6 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.536 -1.060 19998
1018 1 6 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.258 -0.258 19998
1019 1 6 . 1 1 11 11 ASN H H 11 9.129 9.129 8.616 0.513 19998
1020 1 6 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.435 -0.587 19998
1021 1 6 . 1 1 12 12 PRO C C 12 174.197 174.197 178.051 -3.854 19998
1022 1 6 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.719 -0.029 19998
1023 1 6 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.119 -0.236 19998
1024 1 6 . 1 1 13 13 SER N N 13 110.351 110.351 112.634 -2.283 19998
1025 1 6 . 1 1 13 13 SER HA H 13 4.394 4.394 4.258 0.136 19998
1026 1 6 . 1 1 13 13 SER C C 13 170.980 170.980 174.233 -3.253 19998
1027 1 6 . 1 1 13 13 SER CA C 13 59.326 59.326 60.295 -0.969 19998
1028 1 6 . 1 1 13 13 SER CB C 13 63.380 63.380 62.928 0.452 19998
1029 1 6 . 1 1 13 13 SER H H 13 7.785 7.785 8.453 -0.668 19998
1030 1 6 . 1 1 14 14 ASN N N 14 120.660 120.660 118.528 2.132 19998
1031 1 6 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.874 -0.236 19998
1032 1 6 . 1 1 14 14 ASN C C 14 171.412 171.412 173.410 -1.998 19998
1033 1 6 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.761 1.045 19998
1034 1 6 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.282 -1.472 19998
1035 1 6 . 1 1 14 14 ASN H H 14 7.613 7.613 7.770 -0.157 19998
1036 1 6 . 1 1 15 15 ASP N N 15 124.062 124.062 121.343 2.719 19998
1037 1 6 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.534 -0.424 19998
1038 1 6 . 1 1 15 15 ASP C C 15 174.918 174.918 175.725 -0.807 19998
1039 1 6 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.877 0.897 19998
1040 1 6 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.613 0.747 19998
1041 1 6 . 1 1 15 15 ASP H H 15 8.695 8.695 8.047 0.648 19998
1042 1 6 . 1 1 16 16 GLN N N 16 127.008 127.008 123.311 3.697 19998
1043 1 6 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.543 0.070 19998
1044 1 6 . 1 1 16 16 GLN C C 16 173.874 173.874 174.381 -0.507 19998
1045 1 6 . 1 1 16 16 GLN CA C 16 54.522 54.522 55.151 -0.629 19998
1046 1 6 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.628 -1.301 19998
1047 1 6 . 1 1 16 16 GLN H H 16 8.041 8.041 8.594 -0.553 19998
1048 1 6 . 1 1 17 17 CYS N N 17 122.234 122.234 118.999 3.235 19998
1049 1 6 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.815 0.168 19998
1050 1 6 . 1 1 17 17 CYS C C 17 173.908 173.908 174.801 -0.893 19998
1051 1 6 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.704 -1.218 19998
1052 1 6 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.552 8.354 19998
1053 1 6 . 1 1 17 17 CYS H H 17 9.314 9.314 8.186 1.128 19998
1054 1 6 . 1 1 18 18 CYS N N 18 118.883 118.883 122.636 -3.753 19998
1055 1 6 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.529 0.079 19998
1056 1 6 . 1 1 18 18 CYS C C 18 172.722 172.722 176.003 -3.281 19998
1057 1 6 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.113 -3.592 19998
1058 1 6 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.090 15.277 19998
1059 1 6 . 1 1 18 18 CYS H H 18 9.192 9.192 8.577 0.615 19998
1060 1 6 . 1 1 19 19 LYS N N 19 131.730 131.730 126.566 5.164 19998
1061 1 6 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.090 0.242 19998
1062 1 6 . 1 1 19 19 LYS C C 19 177.997 177.997 178.822 -0.825 19998
1063 1 6 . 1 1 19 19 LYS CA C 19 58.426 58.426 59.078 -0.652 19998
1064 1 6 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.263 -0.944 19998
1065 1 6 . 1 1 19 19 LYS H H 19 8.890 8.890 8.421 0.469 19998
1066 1 6 . 1 1 20 20 SER N N 20 115.887 115.887 114.519 1.368 19998
1067 1 6 . 1 1 20 20 SER HA H 20 4.334 4.334 4.299 0.035 19998
1068 1 6 . 1 1 20 20 SER C C 20 172.946 172.946 175.351 -2.405 19998
1069 1 6 . 1 1 20 20 SER CA C 20 60.311 60.311 60.533 -0.222 19998
1070 1 6 . 1 1 20 20 SER CB C 20 62.327 62.327 62.474 -0.147 19998
1071 1 6 . 1 1 20 20 SER H H 20 8.856 8.856 8.683 0.173 19998
1072 1 6 . 1 1 21 21 SER N N 21 116.191 116.191 116.162 0.029 19998
1073 1 6 . 1 1 21 21 SER HA H 21 4.833 4.833 4.575 0.258 19998
1074 1 6 . 1 1 21 21 SER C C 21 170.505 170.505 173.283 -2.778 19998
1075 1 6 . 1 1 21 21 SER CA C 21 57.500 57.500 58.075 -0.575 19998
1076 1 6 . 1 1 21 21 SER CB C 21 63.852 63.852 63.444 0.408 19998
1077 1 6 . 1 1 21 21 SER H H 21 7.068 7.068 7.441 -0.373 19998
1078 1 6 . 1 1 22 22 SER N N 22 111.723 111.723 116.156 -4.433 19998
1079 1 6 . 1 1 22 22 SER HA H 22 4.099 4.099 4.104 -0.005 19998
1080 1 6 . 1 1 22 22 SER C C 22 170.369 170.369 172.914 -2.545 19998
1081 1 6 . 1 1 22 22 SER CA C 22 59.140 59.140 59.445 -0.305 19998
1082 1 6 . 1 1 22 22 SER CB C 22 61.339 61.339 61.667 -0.328 19998
1083 1 6 . 1 1 22 22 SER H H 22 8.113 8.113 8.204 -0.091 19998
1084 1 6 . 1 1 23 23 LEU N N 23 115.988 115.988 119.308 -3.320 19998
1085 1 6 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.932 -0.034 19998
1086 1 6 . 1 1 23 23 LEU C C 23 173.712 173.712 175.104 -1.392 19998
1087 1 6 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.263 -0.180 19998
1088 1 6 . 1 1 23 23 LEU CB C 23 46.062 46.062 46.019 0.043 19998
1089 1 6 . 1 1 23 23 LEU H H 23 7.111 7.111 7.575 -0.464 19998
1090 1 6 . 1 1 24 24 ALA N N 24 119.898 119.898 120.394 -0.496 19998
1091 1 6 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.635 -0.169 19998
1092 1 6 . 1 1 24 24 ALA C C 24 173.491 173.491 174.618 -1.127 19998
1093 1 6 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.654 -0.487 19998
1094 1 6 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.717 1.520 19998
1095 1 6 . 1 1 24 24 ALA H H 24 8.904 8.904 7.705 1.199 19998
1096 1 6 . 1 1 25 25 CYS N N 25 122.945 122.945 121.189 1.756 19998
1097 1 6 . 1 1 25 25 CYS HA H 25 4.452 4.452 5.072 -0.620 19998
1098 1 6 . 1 1 25 25 CYS C C 25 171.574 171.574 175.000 -3.426 19998
1099 1 6 . 1 1 25 25 CYS CA C 25 56.132 56.132 58.065 -1.933 19998
1100 1 6 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.666 12.512 19998
1101 1 6 . 1 1 25 25 CYS H H 25 9.847 9.847 8.638 1.209 19998
1102 1 6 . 1 1 26 26 SER N N 26 122.285 122.285 122.944 -0.659 19998
1103 1 6 . 1 1 26 26 SER HA H 26 4.543 4.543 4.698 -0.155 19998
1104 1 6 . 1 1 26 26 SER CA C 26 57.773 57.773 57.231 0.541 19998
1105 1 6 . 1 1 26 26 SER CB C 26 63.789 63.789 65.861 -2.072 19998
1106 1 6 . 1 1 26 26 SER H H 26 7.791 7.791 8.399 -0.608 19998
1107 1 6 . 1 1 27 27 THR N N 27 122.390 122.390 121.030 1.360 19998
1108 1 6 . 1 1 27 27 THR HA H 27 3.778 3.778 4.272 -0.494 19998
1109 1 6 . 1 1 27 27 THR C C 27 172.781 172.781 175.267 -2.486 19998
1110 1 6 . 1 1 27 27 THR CA C 27 65.390 65.390 64.111 1.279 19998
1111 1 6 . 1 1 27 27 THR CB C 27 68.458 68.458 68.759 -0.301 19998
1112 1 6 . 1 1 27 27 THR H H 27 8.874 8.874 8.710 0.164 19998
1113 1 6 . 1 1 28 28 LYS N N 28 118.883 118.883 120.367 -1.484 19998
1114 1 6 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.259 -0.228 19998
1115 1 6 . 1 1 28 28 LYS C C 28 174.613 174.613 176.954 -2.341 19998
1116 1 6 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.596 -0.797 19998
1117 1 6 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.540 0.624 19998
1118 1 6 . 1 1 28 28 LYS H H 28 7.609 7.609 8.151 -0.542 19998
1119 1 6 . 1 1 29 29 HIS N N 29 113.398 113.398 115.052 -1.654 19998
1120 1 6 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.623 -0.339 19998
1121 1 6 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.527 0.059 19998
1122 1 6 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.724 -1.662 19998
1123 1 6 . 1 1 29 29 HIS H H 29 7.450 7.450 8.065 -0.615 19998
1124 1 6 . 1 1 30 30 LYS N N 30 116.344 116.344 119.010 -2.666 19998
1125 1 6 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.218 -0.330 19998
1126 1 6 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.333 0.167 19998
1127 1 6 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.666 -1.057 19998
1128 1 6 . 1 1 30 30 LYS H H 30 8.261 8.261 8.423 -0.162 19998
1129 1 6 . 1 1 31 31 TRP N N 31 117.766 117.766 114.874 2.892 19998
1130 1 6 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.028 0.449 19998
1131 1 6 . 1 1 31 31 TRP C C 31 174.754 174.754 174.423 0.331 19998
1132 1 6 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.203 1.553 19998
1133 1 6 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.804 1.172 19998
1134 1 6 . 1 1 31 31 TRP H H 31 8.483 8.483 7.730 0.753 19998
1135 1 6 . 1 1 32 32 CYS N N 32 118.984 118.984 123.004 -4.020 19998
1136 1 6 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.322 0.425 19998
1137 1 6 . 1 1 32 32 CYS C C 32 171.472 171.472 174.756 -3.284 19998
1138 1 6 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.157 -4.424 19998
1139 1 6 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.547 14.977 19998
1140 1 6 . 1 1 32 32 CYS H H 32 8.474 8.474 8.418 0.056 19998
1141 1 6 . 1 1 33 33 LYS N N 33 124.672 124.672 123.821 0.851 19998
1142 1 6 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.081 0.636 19998
1143 1 6 . 1 1 33 33 LYS C C 33 172.236 172.236 175.459 -3.223 19998
1144 1 6 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.186 0.544 19998
1145 1 6 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.852 1.577 19998
1146 1 6 . 1 1 33 33 LYS H H 33 9.027 9.027 8.347 0.680 19998
1147 1 6 . 1 1 34 34 TYR N N 34 120.102 120.102 122.143 -2.041 19998
1148 1 6 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.639 0.239 19998
1149 1 6 . 1 1 34 34 TYR C C 34 174.034 174.034 176.788 -2.754 19998
1150 1 6 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.854 0.408 19998
1151 1 6 . 1 1 34 34 TYR CB C 34 38.633 38.633 38.188 0.445 19998
1152 1 6 . 1 1 34 34 TYR H H 34 8.092 8.092 8.654 -0.562 19998
1153 1 6 . 1 1 35 35 GLU N N 35 124.362 124.362 125.494 -1.132 19998
1154 1 6 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.645 -0.183 19998
1155 1 6 . 1 1 35 35 GLU C C 35 172.127 172.127 174.883 -2.756 19998
1156 1 6 . 1 1 35 35 GLU CA C 35 56.267 56.267 55.797 0.469 19998
1157 1 6 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.161 0.691 19998
1158 1 6 . 1 1 35 35 GLU H H 35 8.754 8.754 8.474 0.280 19998
1159 1 7 . 1 1 2 2 ALA N N 2 123.910 123.910 123.151 0.759 19998
1160 1 7 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.761 -0.297 19998
1161 1 7 . 1 1 2 2 ALA C C 2 174.673 174.673 176.327 -1.654 19998
1162 1 7 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.210 -0.042 19998
1163 1 7 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.970 0.720 19998
1164 1 7 . 1 1 2 2 ALA H H 2 8.561 8.561 8.436 0.125 19998
1165 1 7 . 1 1 3 3 CYS N N 3 117.207 117.207 118.826 -1.619 19998
1166 1 7 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.653 0.312 19998
1167 1 7 . 1 1 3 3 CYS C C 3 170.808 170.808 172.641 -1.833 19998
1168 1 7 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.281 -2.527 19998
1169 1 7 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.223 14.844 19998
1170 1 7 . 1 1 3 3 CYS H H 3 8.335 8.335 8.137 0.198 19998
1171 1 7 . 1 1 4 4 LEU N N 4 121.828 121.828 122.685 -0.857 19998
1172 1 7 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.624 -0.279 19998
1173 1 7 . 1 1 4 4 LEU C C 4 172.234 172.234 177.100 -4.866 19998
1174 1 7 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.054 0.169 19998
1175 1 7 . 1 1 4 4 LEU CB C 4 44.578 44.578 44.174 0.404 19998
1176 1 7 . 1 1 4 4 LEU H H 4 8.815 8.815 8.366 0.449 19998
1177 1 7 . 1 1 5 5 GLY N N 5 107.508 107.508 110.051 -2.543 19998
1178 1 7 . 1 1 5 5 GLY C C 5 169.768 169.768 173.398 -3.630 19998
1179 1 7 . 1 1 5 5 GLY CA C 5 43.052 43.052 43.815 -0.763 19998
1180 1 7 . 1 1 5 5 GLY H H 5 7.999 7.999 8.322 -0.323 19998
1181 1 7 . 1 1 6 6 PHE N N 6 116.953 116.953 120.259 -3.306 19998
1182 1 7 . 1 1 6 6 PHE HA H 6 3.619 3.619 4.057 -0.438 19998
1183 1 7 . 1 1 6 6 PHE C C 6 174.967 174.967 176.766 -1.799 19998
1184 1 7 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.510 1.591 19998
1185 1 7 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.395 0.111 19998
1186 1 7 . 1 1 6 6 PHE H H 6 8.392 8.392 8.404 -0.012 19998
1187 1 7 . 1 1 7 7 GLY N N 7 115.074 115.074 115.160 -0.086 19998
1188 1 7 . 1 1 7 7 GLY C C 7 171.017 171.017 173.845 -2.828 19998
1189 1 7 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.842 0.002 19998
1190 1 7 . 1 1 7 7 GLY H H 7 8.645 8.645 7.408 1.237 19998
1191 1 7 . 1 1 8 8 LYS N N 8 120.051 120.051 120.800 -0.749 19998
1192 1 7 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.652 -0.339 19998
1193 1 7 . 1 1 8 8 LYS C C 8 173.878 173.878 175.959 -2.081 19998
1194 1 7 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.196 0.374 19998
1195 1 7 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.337 -1.946 19998
1196 1 7 . 1 1 8 8 LYS H H 8 7.429 7.429 7.388 0.041 19998
1197 1 7 . 1 1 9 9 SER N N 9 117.004 117.004 116.103 0.901 19998
1198 1 7 . 1 1 9 9 SER HA H 9 4.315 4.315 4.734 -0.419 19998
1199 1 7 . 1 1 9 9 SER C C 9 170.486 170.486 174.537 -4.051 19998
1200 1 7 . 1 1 9 9 SER CB C 9 63.355 63.355 62.684 0.671 19998
1201 1 7 . 1 1 9 9 SER H H 9 8.542 8.542 8.455 0.087 19998
1202 1 7 . 1 1 10 10 CYS N N 10 119.238 119.238 121.387 -2.149 19998
1203 1 7 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.765 0.068 19998
1204 1 7 . 1 1 10 10 CYS C C 10 168.106 168.106 173.792 -5.686 19998
1205 1 7 . 1 1 10 10 CYS CA C 10 53.907 53.907 56.092 -2.185 19998
1206 1 7 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.073 15.768 19998
1207 1 7 . 1 1 10 10 CYS H H 10 8.188 8.188 8.472 -0.284 19998
1208 1 7 . 1 1 11 11 ASN N N 11 119.594 119.594 118.934 0.660 19998
1209 1 7 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.203 -0.079 19998
1210 1 7 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.550 -1.074 19998
1211 1 7 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.286 -0.286 19998
1212 1 7 . 1 1 11 11 ASN H H 11 9.129 9.129 8.611 0.518 19998
1213 1 7 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.431 -0.583 19998
1214 1 7 . 1 1 12 12 PRO C C 12 174.197 174.197 178.157 -3.960 19998
1215 1 7 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.667 0.022 19998
1216 1 7 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.136 -0.253 19998
1217 1 7 . 1 1 13 13 SER N N 13 110.351 110.351 112.668 -2.317 19998
1218 1 7 . 1 1 13 13 SER HA H 13 4.394 4.394 4.248 0.146 19998
1219 1 7 . 1 1 13 13 SER C C 13 170.980 170.980 174.111 -3.131 19998
1220 1 7 . 1 1 13 13 SER CA C 13 59.326 59.326 60.318 -0.992 19998
1221 1 7 . 1 1 13 13 SER CB C 13 63.380 63.380 62.931 0.450 19998
1222 1 7 . 1 1 13 13 SER H H 13 7.785 7.785 8.446 -0.661 19998
1223 1 7 . 1 1 14 14 ASN N N 14 120.660 120.660 118.561 2.099 19998
1224 1 7 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.882 -0.244 19998
1225 1 7 . 1 1 14 14 ASN C C 14 171.412 171.412 173.440 -2.028 19998
1226 1 7 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.791 1.015 19998
1227 1 7 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.264 -1.454 19998
1228 1 7 . 1 1 14 14 ASN H H 14 7.613 7.613 7.772 -0.159 19998
1229 1 7 . 1 1 15 15 ASP N N 15 124.062 124.062 121.378 2.684 19998
1230 1 7 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.535 -0.425 19998
1231 1 7 . 1 1 15 15 ASP C C 15 174.918 174.918 175.777 -0.859 19998
1232 1 7 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.834 0.940 19998
1233 1 7 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.550 0.810 19998
1234 1 7 . 1 1 15 15 ASP H H 15 8.695 8.695 8.018 0.677 19998
1235 1 7 . 1 1 16 16 GLN N N 16 127.008 127.008 123.409 3.599 19998
1236 1 7 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.511 0.102 19998
1237 1 7 . 1 1 16 16 GLN C C 16 173.874 173.874 174.283 -0.409 19998
1238 1 7 . 1 1 16 16 GLN CA C 16 54.522 54.522 55.147 -0.625 19998
1239 1 7 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.499 -1.172 19998
1240 1 7 . 1 1 16 16 GLN H H 16 8.041 8.041 8.643 -0.602 19998
1241 1 7 . 1 1 17 17 CYS N N 17 122.234 122.234 118.577 3.657 19998
1242 1 7 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.767 0.216 19998
1243 1 7 . 1 1 17 17 CYS C C 17 173.908 173.908 174.802 -0.894 19998
1244 1 7 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.630 -1.144 19998
1245 1 7 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.517 8.389 19998
1246 1 7 . 1 1 17 17 CYS H H 17 9.314 9.314 8.036 1.278 19998
1247 1 7 . 1 1 18 18 CYS N N 18 118.883 118.883 122.581 -3.698 19998
1248 1 7 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.536 0.072 19998
1249 1 7 . 1 1 18 18 CYS C C 18 172.722 172.722 176.012 -3.290 19998
1250 1 7 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.123 -3.602 19998
1251 1 7 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.263 15.104 19998
1252 1 7 . 1 1 18 18 CYS H H 18 9.192 9.192 8.618 0.574 19998
1253 1 7 . 1 1 19 19 LYS N N 19 131.730 131.730 126.520 5.210 19998
1254 1 7 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.120 0.212 19998
1255 1 7 . 1 1 19 19 LYS C C 19 177.997 177.997 178.910 -0.913 19998
1256 1 7 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.998 -0.572 19998
1257 1 7 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.296 -0.977 19998
1258 1 7 . 1 1 19 19 LYS H H 19 8.890 8.890 8.605 0.285 19998
1259 1 7 . 1 1 20 20 SER N N 20 115.887 115.887 114.484 1.403 19998
1260 1 7 . 1 1 20 20 SER HA H 20 4.334 4.334 4.279 0.055 19998
1261 1 7 . 1 1 20 20 SER C C 20 172.946 172.946 175.334 -2.388 19998
1262 1 7 . 1 1 20 20 SER CA C 20 60.311 60.311 60.565 -0.254 19998
1263 1 7 . 1 1 20 20 SER CB C 20 62.327 62.327 62.909 -0.582 19998
1264 1 7 . 1 1 20 20 SER H H 20 8.856 8.856 8.607 0.249 19998
1265 1 7 . 1 1 21 21 SER N N 21 116.191 116.191 114.807 1.384 19998
1266 1 7 . 1 1 21 21 SER HA H 21 4.833 4.833 4.599 0.234 19998
1267 1 7 . 1 1 21 21 SER C C 21 170.505 170.505 173.282 -2.777 19998
1268 1 7 . 1 1 21 21 SER CA C 21 57.500 57.500 58.275 -0.775 19998
1269 1 7 . 1 1 21 21 SER CB C 21 63.852 63.852 63.706 0.146 19998
1270 1 7 . 1 1 21 21 SER H H 21 7.068 7.068 7.494 -0.426 19998
1271 1 7 . 1 1 22 22 SER N N 22 111.723 111.723 115.790 -4.067 19998
1272 1 7 . 1 1 22 22 SER HA H 22 4.099 4.099 4.126 -0.027 19998
1273 1 7 . 1 1 22 22 SER C C 22 170.369 170.369 172.900 -2.531 19998
1274 1 7 . 1 1 22 22 SER CA C 22 59.140 59.140 59.806 -0.666 19998
1275 1 7 . 1 1 22 22 SER CB C 22 61.339 61.339 61.348 -0.009 19998
1276 1 7 . 1 1 22 22 SER H H 22 8.113 8.113 8.289 -0.176 19998
1277 1 7 . 1 1 23 23 LEU N N 23 115.988 115.988 119.029 -3.041 19998
1278 1 7 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.916 -0.018 19998
1279 1 7 . 1 1 23 23 LEU C C 23 173.712 173.712 175.557 -1.845 19998
1280 1 7 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.380 -0.297 19998
1281 1 7 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.142 0.920 19998
1282 1 7 . 1 1 23 23 LEU H H 23 7.111 7.111 7.633 -0.522 19998
1283 1 7 . 1 1 24 24 ALA N N 24 119.898 119.898 120.901 -1.003 19998
1284 1 7 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.653 -0.187 19998
1285 1 7 . 1 1 24 24 ALA C C 24 173.491 173.491 174.724 -1.233 19998
1286 1 7 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.751 -0.584 19998
1287 1 7 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.715 1.522 19998
1288 1 7 . 1 1 24 24 ALA H H 24 8.904 8.904 7.815 1.089 19998
1289 1 7 . 1 1 25 25 CYS N N 25 122.945 122.945 121.236 1.709 19998
1290 1 7 . 1 1 25 25 CYS HA H 25 4.452 4.452 5.100 -0.648 19998
1291 1 7 . 1 1 25 25 CYS C C 25 171.574 171.574 175.027 -3.453 19998
1292 1 7 . 1 1 25 25 CYS CA C 25 56.132 56.132 58.111 -1.979 19998
1293 1 7 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.616 12.563 19998
1294 1 7 . 1 1 25 25 CYS H H 25 9.847 9.847 8.655 1.192 19998
1295 1 7 . 1 1 26 26 SER N N 26 122.285 122.285 122.337 -0.052 19998
1296 1 7 . 1 1 26 26 SER HA H 26 4.543 4.543 4.714 -0.171 19998
1297 1 7 . 1 1 26 26 SER CA C 26 57.773 57.773 57.192 0.581 19998
1298 1 7 . 1 1 26 26 SER CB C 26 63.789 63.789 65.933 -2.144 19998
1299 1 7 . 1 1 26 26 SER H H 26 7.791 7.791 8.367 -0.576 19998
1300 1 7 . 1 1 27 27 THR N N 27 122.390 122.390 121.295 1.095 19998
1301 1 7 . 1 1 27 27 THR HA H 27 3.778 3.778 4.208 -0.430 19998
1302 1 7 . 1 1 27 27 THR C C 27 172.781 172.781 175.304 -2.523 19998
1303 1 7 . 1 1 27 27 THR CA C 27 65.390 65.390 64.525 0.866 19998
1304 1 7 . 1 1 27 27 THR CB C 27 68.458 68.458 68.850 -0.392 19998
1305 1 7 . 1 1 27 27 THR H H 27 8.874 8.874 8.731 0.143 19998
1306 1 7 . 1 1 28 28 LYS N N 28 118.883 118.883 120.957 -2.074 19998
1307 1 7 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.174 -0.143 19998
1308 1 7 . 1 1 28 28 LYS C C 28 174.613 174.613 177.012 -2.399 19998
1309 1 7 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.554 -0.756 19998
1310 1 7 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.479 0.685 19998
1311 1 7 . 1 1 28 28 LYS H H 28 7.609 7.609 8.164 -0.555 19998
1312 1 7 . 1 1 29 29 HIS N N 29 113.398 113.398 114.963 -1.565 19998
1313 1 7 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.623 -0.339 19998
1314 1 7 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.507 0.079 19998
1315 1 7 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.699 -1.637 19998
1316 1 7 . 1 1 29 29 HIS H H 29 7.450 7.450 8.074 -0.624 19998
1317 1 7 . 1 1 30 30 LYS N N 30 116.344 116.344 119.076 -2.732 19998
1318 1 7 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.215 -0.327 19998
1319 1 7 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.354 0.146 19998
1320 1 7 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.623 -1.014 19998
1321 1 7 . 1 1 30 30 LYS H H 30 8.261 8.261 8.432 -0.171 19998
1322 1 7 . 1 1 31 31 TRP N N 31 117.766 117.766 114.926 2.840 19998
1323 1 7 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.016 0.461 19998
1324 1 7 . 1 1 31 31 TRP C C 31 174.754 174.754 174.400 0.354 19998
1325 1 7 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.212 1.544 19998
1326 1 7 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.851 1.125 19998
1327 1 7 . 1 1 31 31 TRP H H 31 8.483 8.483 7.768 0.715 19998
1328 1 7 . 1 1 32 32 CYS N N 32 118.984 118.984 122.906 -3.922 19998
1329 1 7 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.336 0.411 19998
1330 1 7 . 1 1 32 32 CYS C C 32 171.472 171.472 174.734 -3.262 19998
1331 1 7 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.166 -4.433 19998
1332 1 7 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.573 14.951 19998
1333 1 7 . 1 1 32 32 CYS H H 32 8.474 8.474 8.413 0.061 19998
1334 1 7 . 1 1 33 33 LYS N N 33 124.672 124.672 123.841 0.831 19998
1335 1 7 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.085 0.632 19998
1336 1 7 . 1 1 33 33 LYS C C 33 172.236 172.236 175.448 -3.212 19998
1337 1 7 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.126 0.604 19998
1338 1 7 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.918 1.511 19998
1339 1 7 . 1 1 33 33 LYS H H 33 9.027 9.027 8.420 0.607 19998
1340 1 7 . 1 1 34 34 TYR N N 34 120.102 120.102 122.756 -2.654 19998
1341 1 7 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.582 0.296 19998
1342 1 7 . 1 1 34 34 TYR C C 34 174.034 174.034 176.868 -2.834 19998
1343 1 7 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.586 0.676 19998
1344 1 7 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.896 0.737 19998
1345 1 7 . 1 1 34 34 TYR H H 34 8.092 8.092 8.701 -0.609 19998
1346 1 7 . 1 1 35 35 GLU N N 35 124.362 124.362 126.310 -1.948 19998
1347 1 7 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.314 0.148 19998
1348 1 7 . 1 1 35 35 GLU C C 35 172.127 172.127 175.481 -3.354 19998
1349 1 7 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.647 -0.380 19998
1350 1 7 . 1 1 35 35 GLU CB C 35 30.852 30.852 29.801 1.051 19998
1351 1 7 . 1 1 35 35 GLU H H 35 8.754 8.754 8.698 0.056 19998
1352 1 8 . 1 1 2 2 ALA N N 2 123.910 123.910 123.838 0.072 19998
1353 1 8 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.749 -0.285 19998
1354 1 8 . 1 1 2 2 ALA C C 2 174.673 174.673 176.158 -1.485 19998
1355 1 8 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.170 -0.002 19998
1356 1 8 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.930 0.760 19998
1357 1 8 . 1 1 2 2 ALA H H 2 8.561 8.561 7.948 0.613 19998
1358 1 8 . 1 1 3 3 CYS N N 3 117.207 117.207 119.059 -1.852 19998
1359 1 8 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.682 0.283 19998
1360 1 8 . 1 1 3 3 CYS C C 3 170.808 170.808 172.785 -1.977 19998
1361 1 8 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.095 -2.341 19998
1362 1 8 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.428 14.639 19998
1363 1 8 . 1 1 3 3 CYS H H 3 8.335 8.335 8.176 0.159 19998
1364 1 8 . 1 1 4 4 LEU N N 4 121.828 121.828 122.696 -0.868 19998
1365 1 8 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.607 -0.262 19998
1366 1 8 . 1 1 4 4 LEU C C 4 172.234 172.234 177.195 -4.961 19998
1367 1 8 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.041 0.181 19998
1368 1 8 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.875 0.703 19998
1369 1 8 . 1 1 4 4 LEU H H 4 8.815 8.815 8.378 0.437 19998
1370 1 8 . 1 1 5 5 GLY N N 5 107.508 107.508 110.370 -2.862 19998
1371 1 8 . 1 1 5 5 GLY C C 5 169.768 169.768 173.420 -3.652 19998
1372 1 8 . 1 1 5 5 GLY CA C 5 43.052 43.052 43.976 -0.924 19998
1373 1 8 . 1 1 5 5 GLY H H 5 7.999 7.999 8.321 -0.322 19998
1374 1 8 . 1 1 6 6 PHE N N 6 116.953 116.953 120.803 -3.850 19998
1375 1 8 . 1 1 6 6 PHE HA H 6 3.619 3.619 4.020 -0.401 19998
1376 1 8 . 1 1 6 6 PHE C C 6 174.967 174.967 176.764 -1.797 19998
1377 1 8 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.963 1.138 19998
1378 1 8 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.120 0.386 19998
1379 1 8 . 1 1 6 6 PHE H H 6 8.392 8.392 8.527 -0.135 19998
1380 1 8 . 1 1 7 7 GLY N N 7 115.074 115.074 115.648 -0.574 19998
1381 1 8 . 1 1 7 7 GLY C C 7 171.017 171.017 173.947 -2.930 19998
1382 1 8 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.856 -0.012 19998
1383 1 8 . 1 1 7 7 GLY H H 7 8.645 8.645 7.392 1.253 19998
1384 1 8 . 1 1 8 8 LYS N N 8 120.051 120.051 120.814 -0.763 19998
1385 1 8 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.606 -0.293 19998
1386 1 8 . 1 1 8 8 LYS C C 8 173.878 173.878 175.926 -2.048 19998
1387 1 8 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.212 0.358 19998
1388 1 8 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.189 -1.798 19998
1389 1 8 . 1 1 8 8 LYS H H 8 7.429 7.429 7.361 0.068 19998
1390 1 8 . 1 1 9 9 SER N N 9 117.004 117.004 117.235 -0.231 19998
1391 1 8 . 1 1 9 9 SER HA H 9 4.315 4.315 4.641 -0.326 19998
1392 1 8 . 1 1 9 9 SER C C 9 170.486 170.486 174.501 -4.015 19998
1393 1 8 . 1 1 9 9 SER CB C 9 63.355 63.355 62.694 0.661 19998
1394 1 8 . 1 1 9 9 SER H H 9 8.542 8.542 8.508 0.034 19998
1395 1 8 . 1 1 10 10 CYS N N 10 119.238 119.238 121.153 -1.915 19998
1396 1 8 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.723 0.110 19998
1397 1 8 . 1 1 10 10 CYS C C 10 168.106 168.106 173.114 -5.008 19998
1398 1 8 . 1 1 10 10 CYS CA C 10 53.907 53.907 55.939 -2.032 19998
1399 1 8 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.339 15.502 19998
1400 1 8 . 1 1 10 10 CYS H H 10 8.188 8.188 8.267 -0.079 19998
1401 1 8 . 1 1 11 11 ASN N N 11 119.594 119.594 118.728 0.866 19998
1402 1 8 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.200 -0.076 19998
1403 1 8 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.736 -1.260 19998
1404 1 8 . 1 1 11 11 ASN CB C 11 40.000 40.000 41.023 -1.023 19998
1405 1 8 . 1 1 11 11 ASN H H 11 9.129 9.129 8.608 0.521 19998
1406 1 8 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.455 -0.607 19998
1407 1 8 . 1 1 12 12 PRO C C 12 174.197 174.197 178.494 -4.297 19998
1408 1 8 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.874 -0.185 19998
1409 1 8 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.243 -0.360 19998
1410 1 8 . 1 1 13 13 SER N N 13 110.351 110.351 112.454 -2.103 19998
1411 1 8 . 1 1 13 13 SER HA H 13 4.394 4.394 4.238 0.156 19998
1412 1 8 . 1 1 13 13 SER C C 13 170.980 170.980 173.951 -2.971 19998
1413 1 8 . 1 1 13 13 SER CA C 13 59.326 59.326 59.811 -0.485 19998
1414 1 8 . 1 1 13 13 SER CB C 13 63.380 63.380 63.016 0.365 19998
1415 1 8 . 1 1 13 13 SER H H 13 7.785 7.785 8.400 -0.615 19998
1416 1 8 . 1 1 14 14 ASN N N 14 120.660 120.660 118.226 2.434 19998
1417 1 8 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.900 -0.262 19998
1418 1 8 . 1 1 14 14 ASN C C 14 171.412 171.412 173.499 -2.087 19998
1419 1 8 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.818 0.988 19998
1420 1 8 . 1 1 14 14 ASN CB C 14 37.810 37.810 38.985 -1.175 19998
1421 1 8 . 1 1 14 14 ASN H H 14 7.613 7.613 7.799 -0.186 19998
1422 1 8 . 1 1 15 15 ASP N N 15 124.062 124.062 121.151 2.911 19998
1423 1 8 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.497 -0.387 19998
1424 1 8 . 1 1 15 15 ASP C C 15 174.918 174.918 175.677 -0.759 19998
1425 1 8 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.808 0.966 19998
1426 1 8 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.676 0.684 19998
1427 1 8 . 1 1 15 15 ASP H H 15 8.695 8.695 7.978 0.717 19998
1428 1 8 . 1 1 16 16 GLN N N 16 127.008 127.008 122.042 4.966 19998
1429 1 8 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.596 0.017 19998
1430 1 8 . 1 1 16 16 GLN C C 16 173.874 173.874 174.042 -0.168 19998
1431 1 8 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.805 -0.283 19998
1432 1 8 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.122 -0.795 19998
1433 1 8 . 1 1 16 16 GLN H H 16 8.041 8.041 8.555 -0.514 19998
1434 1 8 . 1 1 17 17 CYS N N 17 122.234 122.234 119.012 3.222 19998
1435 1 8 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.813 0.170 19998
1436 1 8 . 1 1 17 17 CYS C C 17 173.908 173.908 174.755 -0.847 19998
1437 1 8 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.736 -1.250 19998
1438 1 8 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.535 8.370 19998
1439 1 8 . 1 1 17 17 CYS H H 17 9.314 9.314 8.234 1.080 19998
1440 1 8 . 1 1 18 18 CYS N N 18 118.883 118.883 122.755 -3.872 19998
1441 1 8 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.463 0.145 19998
1442 1 8 . 1 1 18 18 CYS C C 18 172.722 172.722 175.794 -3.072 19998
1443 1 8 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.285 -3.764 19998
1444 1 8 . 1 1 18 18 CYS CB C 18 41.367 41.367 25.842 15.525 19998
1445 1 8 . 1 1 18 18 CYS H H 18 9.192 9.192 8.606 0.586 19998
1446 1 8 . 1 1 19 19 LYS N N 19 131.730 131.730 126.212 5.518 19998
1447 1 8 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.100 0.232 19998
1448 1 8 . 1 1 19 19 LYS C C 19 177.997 177.997 178.672 -0.675 19998
1449 1 8 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.922 -0.496 19998
1450 1 8 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.205 -0.886 19998
1451 1 8 . 1 1 19 19 LYS H H 19 8.890 8.890 8.490 0.400 19998
1452 1 8 . 1 1 20 20 SER N N 20 115.887 115.887 114.804 1.083 19998
1453 1 8 . 1 1 20 20 SER HA H 20 4.334 4.334 4.302 0.032 19998
1454 1 8 . 1 1 20 20 SER C C 20 172.946 172.946 175.406 -2.460 19998
1455 1 8 . 1 1 20 20 SER CA C 20 60.311 60.311 60.679 -0.368 19998
1456 1 8 . 1 1 20 20 SER CB C 20 62.327 62.327 62.415 -0.088 19998
1457 1 8 . 1 1 20 20 SER H H 20 8.856 8.856 8.688 0.168 19998
1458 1 8 . 1 1 21 21 SER N N 21 116.191 116.191 115.087 1.104 19998
1459 1 8 . 1 1 21 21 SER HA H 21 4.833 4.833 4.593 0.240 19998
1460 1 8 . 1 1 21 21 SER C C 21 170.505 170.505 173.247 -2.742 19998
1461 1 8 . 1 1 21 21 SER CA C 21 57.500 57.500 58.272 -0.772 19998
1462 1 8 . 1 1 21 21 SER CB C 21 63.852 63.852 63.549 0.303 19998
1463 1 8 . 1 1 21 21 SER H H 21 7.068 7.068 7.432 -0.364 19998
1464 1 8 . 1 1 22 22 SER N N 22 111.723 111.723 115.961 -4.238 19998
1465 1 8 . 1 1 22 22 SER HA H 22 4.099 4.099 4.108 -0.009 19998
1466 1 8 . 1 1 22 22 SER C C 22 170.369 170.369 172.896 -2.527 19998
1467 1 8 . 1 1 22 22 SER CA C 22 59.140 59.140 59.596 -0.456 19998
1468 1 8 . 1 1 22 22 SER CB C 22 61.339 61.339 61.586 -0.247 19998
1469 1 8 . 1 1 22 22 SER H H 22 8.113 8.113 8.160 -0.047 19998
1470 1 8 . 1 1 23 23 LEU N N 23 115.988 115.988 119.268 -3.280 19998
1471 1 8 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.929 -0.031 19998
1472 1 8 . 1 1 23 23 LEU C C 23 173.712 173.712 175.223 -1.511 19998
1473 1 8 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.321 -0.238 19998
1474 1 8 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.724 0.338 19998
1475 1 8 . 1 1 23 23 LEU H H 23 7.111 7.111 7.608 -0.497 19998
1476 1 8 . 1 1 24 24 ALA N N 24 119.898 119.898 120.580 -0.682 19998
1477 1 8 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.653 -0.187 19998
1478 1 8 . 1 1 24 24 ALA C C 24 173.491 173.491 174.694 -1.203 19998
1479 1 8 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.762 -0.595 19998
1480 1 8 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.753 1.484 19998
1481 1 8 . 1 1 24 24 ALA H H 24 8.904 8.904 7.743 1.161 19998
1482 1 8 . 1 1 25 25 CYS N N 25 122.945 122.945 121.344 1.601 19998
1483 1 8 . 1 1 25 25 CYS HA H 25 4.452 4.452 5.032 -0.580 19998
1484 1 8 . 1 1 25 25 CYS C C 25 171.574 171.574 174.983 -3.409 19998
1485 1 8 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.850 -1.718 19998
1486 1 8 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.687 12.492 19998
1487 1 8 . 1 1 25 25 CYS H H 25 9.847 9.847 8.621 1.226 19998
1488 1 8 . 1 1 26 26 SER N N 26 122.285 122.285 123.246 -0.961 19998
1489 1 8 . 1 1 26 26 SER HA H 26 4.543 4.543 4.731 -0.188 19998
1490 1 8 . 1 1 26 26 SER CA C 26 57.773 57.773 57.319 0.454 19998
1491 1 8 . 1 1 26 26 SER CB C 26 63.789 63.789 65.645 -1.856 19998
1492 1 8 . 1 1 26 26 SER H H 26 7.791 7.791 8.375 -0.584 19998
1493 1 8 . 1 1 27 27 THR N N 27 122.390 122.390 120.804 1.586 19998
1494 1 8 . 1 1 27 27 THR HA H 27 3.778 3.778 4.292 -0.514 19998
1495 1 8 . 1 1 27 27 THR C C 27 172.781 172.781 175.162 -2.381 19998
1496 1 8 . 1 1 27 27 THR CA C 27 65.390 65.390 64.333 1.057 19998
1497 1 8 . 1 1 27 27 THR CB C 27 68.458 68.458 68.588 -0.130 19998
1498 1 8 . 1 1 27 27 THR H H 27 8.874 8.874 8.659 0.215 19998
1499 1 8 . 1 1 28 28 LYS N N 28 118.883 118.883 120.762 -1.879 19998
1500 1 8 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.179 -0.148 19998
1501 1 8 . 1 1 28 28 LYS C C 28 174.613 174.613 176.896 -2.283 19998
1502 1 8 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.569 -0.770 19998
1503 1 8 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.463 0.701 19998
1504 1 8 . 1 1 28 28 LYS H H 28 7.609 7.609 7.982 -0.373 19998
1505 1 8 . 1 1 29 29 HIS N N 29 113.398 113.398 114.963 -1.565 19998
1506 1 8 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.622 -0.338 19998
1507 1 8 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.418 0.168 19998
1508 1 8 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.561 -1.499 19998
1509 1 8 . 1 1 29 29 HIS H H 29 7.450 7.450 7.992 -0.542 19998
1510 1 8 . 1 1 30 30 LYS N N 30 116.344 116.344 118.980 -2.636 19998
1511 1 8 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.218 -0.330 19998
1512 1 8 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.333 0.167 19998
1513 1 8 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.673 -1.064 19998
1514 1 8 . 1 1 30 30 LYS H H 30 8.261 8.261 8.423 -0.162 19998
1515 1 8 . 1 1 31 31 TRP N N 31 117.766 117.766 114.858 2.908 19998
1516 1 8 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.029 0.448 19998
1517 1 8 . 1 1 31 31 TRP C C 31 174.754 174.754 174.430 0.324 19998
1518 1 8 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.194 1.562 19998
1519 1 8 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.793 1.183 19998
1520 1 8 . 1 1 31 31 TRP H H 31 8.483 8.483 7.725 0.758 19998
1521 1 8 . 1 1 32 32 CYS N N 32 118.984 118.984 123.064 -4.080 19998
1522 1 8 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.311 0.436 19998
1523 1 8 . 1 1 32 32 CYS C C 32 171.472 171.472 174.768 -3.296 19998
1524 1 8 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.180 -4.447 19998
1525 1 8 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.536 14.988 19998
1526 1 8 . 1 1 32 32 CYS H H 32 8.474 8.474 8.423 0.051 19998
1527 1 8 . 1 1 33 33 LYS N N 33 124.672 124.672 123.821 0.851 19998
1528 1 8 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.084 0.633 19998
1529 1 8 . 1 1 33 33 LYS C C 33 172.236 172.236 175.464 -3.228 19998
1530 1 8 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.179 0.551 19998
1531 1 8 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.846 1.583 19998
1532 1 8 . 1 1 33 33 LYS H H 33 9.027 9.027 8.369 0.658 19998
1533 1 8 . 1 1 34 34 TYR N N 34 120.102 120.102 122.218 -2.116 19998
1534 1 8 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.620 0.258 19998
1535 1 8 . 1 1 34 34 TYR C C 34 174.034 174.034 176.802 -2.768 19998
1536 1 8 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.922 0.340 19998
1537 1 8 . 1 1 34 34 TYR CB C 34 38.633 38.633 38.173 0.460 19998
1538 1 8 . 1 1 34 34 TYR H H 34 8.092 8.092 8.665 -0.573 19998
1539 1 8 . 1 1 35 35 GLU N N 35 124.362 124.362 125.207 -0.845 19998
1540 1 8 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.594 -0.132 19998
1541 1 8 . 1 1 35 35 GLU C C 35 172.127 172.127 175.117 -2.990 19998
1542 1 8 . 1 1 35 35 GLU CA C 35 56.267 56.267 55.639 0.628 19998
1543 1 8 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.275 0.577 19998
1544 1 8 . 1 1 35 35 GLU H H 35 8.754 8.754 8.537 0.217 19998
1545 1 9 . 1 1 2 2 ALA N N 2 123.910 123.910 124.683 -0.773 19998
1546 1 9 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.921 -0.457 19998
1547 1 9 . 1 1 2 2 ALA C C 2 174.673 174.673 176.534 -1.861 19998
1548 1 9 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.282 -0.114 19998
1549 1 9 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.979 0.711 19998
1550 1 9 . 1 1 2 2 ALA H H 2 8.561 8.561 8.049 0.512 19998
1551 1 9 . 1 1 3 3 CYS N N 3 117.207 117.207 118.728 -1.521 19998
1552 1 9 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.666 0.299 19998
1553 1 9 . 1 1 3 3 CYS C C 3 170.808 170.808 172.505 -1.697 19998
1554 1 9 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.363 -2.609 19998
1555 1 9 . 1 1 3 3 CYS CB C 3 44.067 44.067 28.906 15.161 19998
1556 1 9 . 1 1 3 3 CYS H H 3 8.335 8.335 8.294 0.041 19998
1557 1 9 . 1 1 4 4 LEU N N 4 121.828 121.828 122.804 -0.976 19998
1558 1 9 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.611 -0.266 19998
1559 1 9 . 1 1 4 4 LEU C C 4 172.234 172.234 177.258 -5.024 19998
1560 1 9 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.039 0.184 19998
1561 1 9 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.758 0.820 19998
1562 1 9 . 1 1 4 4 LEU H H 4 8.815 8.815 8.389 0.426 19998
1563 1 9 . 1 1 5 5 GLY N N 5 107.508 107.508 110.507 -2.999 19998
1564 1 9 . 1 1 5 5 GLY C C 5 169.768 169.768 173.437 -3.669 19998
1565 1 9 . 1 1 5 5 GLY CA C 5 43.052 43.052 44.055 -1.003 19998
1566 1 9 . 1 1 5 5 GLY H H 5 7.999 7.999 8.316 -0.317 19998
1567 1 9 . 1 1 6 6 PHE N N 6 116.953 116.953 120.427 -3.474 19998
1568 1 9 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.957 -0.338 19998
1569 1 9 . 1 1 6 6 PHE C C 6 174.967 174.967 177.356 -2.389 19998
1570 1 9 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.623 1.478 19998
1571 1 9 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.048 0.458 19998
1572 1 9 . 1 1 6 6 PHE H H 6 8.392 8.392 8.244 0.148 19998
1573 1 9 . 1 1 7 7 GLY N N 7 115.074 115.074 114.534 0.540 19998
1574 1 9 . 1 1 7 7 GLY C C 7 171.017 171.017 173.467 -2.450 19998
1575 1 9 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.716 0.128 19998
1576 1 9 . 1 1 7 7 GLY H H 7 8.645 8.645 7.546 1.099 19998
1577 1 9 . 1 1 8 8 LYS N N 8 120.051 120.051 120.569 -0.518 19998
1578 1 9 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.611 -0.298 19998
1579 1 9 . 1 1 8 8 LYS C C 8 173.878 173.878 176.043 -2.165 19998
1580 1 9 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.130 0.440 19998
1581 1 9 . 1 1 8 8 LYS CB C 8 32.391 32.391 33.883 -1.492 19998
1582 1 9 . 1 1 8 8 LYS H H 8 7.429 7.429 7.366 0.063 19998
1583 1 9 . 1 1 9 9 SER N N 9 117.004 117.004 117.739 -0.735 19998
1584 1 9 . 1 1 9 9 SER HA H 9 4.315 4.315 4.620 -0.305 19998
1585 1 9 . 1 1 9 9 SER C C 9 170.486 170.486 174.562 -4.076 19998
1586 1 9 . 1 1 9 9 SER CB C 9 63.355 63.355 62.226 1.129 19998
1587 1 9 . 1 1 9 9 SER H H 9 8.542 8.542 8.517 0.025 19998
1588 1 9 . 1 1 10 10 CYS N N 10 119.238 119.238 121.410 -2.172 19998
1589 1 9 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.762 0.071 19998
1590 1 9 . 1 1 10 10 CYS C C 10 168.106 168.106 173.589 -5.483 19998
1591 1 9 . 1 1 10 10 CYS CA C 10 53.907 53.907 56.005 -2.098 19998
1592 1 9 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.922 14.919 19998
1593 1 9 . 1 1 10 10 CYS H H 10 8.188 8.188 8.456 -0.268 19998
1594 1 9 . 1 1 11 11 ASN N N 11 119.594 119.594 118.932 0.662 19998
1595 1 9 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.202 -0.078 19998
1596 1 9 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.542 -1.066 19998
1597 1 9 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.285 -0.285 19998
1598 1 9 . 1 1 11 11 ASN H H 11 9.129 9.129 8.609 0.520 19998
1599 1 9 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.475 -0.627 19998
1600 1 9 . 1 1 12 12 PRO C C 12 174.197 174.197 178.276 -4.079 19998
1601 1 9 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.986 -0.296 19998
1602 1 9 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.232 -0.349 19998
1603 1 9 . 1 1 13 13 SER N N 13 110.351 110.351 112.494 -2.143 19998
1604 1 9 . 1 1 13 13 SER HA H 13 4.394 4.394 4.251 0.143 19998
1605 1 9 . 1 1 13 13 SER C C 13 170.980 170.980 174.099 -3.119 19998
1606 1 9 . 1 1 13 13 SER CA C 13 59.326 59.326 60.169 -0.843 19998
1607 1 9 . 1 1 13 13 SER CB C 13 63.380 63.380 63.068 0.312 19998
1608 1 9 . 1 1 13 13 SER H H 13 7.785 7.785 8.452 -0.667 19998
1609 1 9 . 1 1 14 14 ASN N N 14 120.660 120.660 117.690 2.970 19998
1610 1 9 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.878 -0.240 19998
1611 1 9 . 1 1 14 14 ASN C C 14 171.412 171.412 173.395 -1.983 19998
1612 1 9 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.682 1.124 19998
1613 1 9 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.051 -1.241 19998
1614 1 9 . 1 1 14 14 ASN H H 14 7.613 7.613 7.732 -0.119 19998
1615 1 9 . 1 1 15 15 ASP N N 15 124.062 124.062 121.502 2.560 19998
1616 1 9 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.504 -0.394 19998
1617 1 9 . 1 1 15 15 ASP C C 15 174.918 174.918 175.578 -0.660 19998
1618 1 9 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.777 0.997 19998
1619 1 9 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.757 0.603 19998
1620 1 9 . 1 1 15 15 ASP H H 15 8.695 8.695 8.031 0.664 19998
1621 1 9 . 1 1 16 16 GLN N N 16 127.008 127.008 122.372 4.636 19998
1622 1 9 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.570 0.043 19998
1623 1 9 . 1 1 16 16 GLN C C 16 173.874 173.874 174.359 -0.485 19998
1624 1 9 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.979 -0.457 19998
1625 1 9 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.301 -0.974 19998
1626 1 9 . 1 1 16 16 GLN H H 16 8.041 8.041 8.591 -0.550 19998
1627 1 9 . 1 1 17 17 CYS N N 17 122.234 122.234 118.966 3.268 19998
1628 1 9 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.813 0.170 19998
1629 1 9 . 1 1 17 17 CYS C C 17 173.908 173.908 174.810 -0.902 19998
1630 1 9 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.730 -1.244 19998
1631 1 9 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.525 8.381 19998
1632 1 9 . 1 1 17 17 CYS H H 17 9.314 9.314 8.208 1.106 19998
1633 1 9 . 1 1 18 18 CYS N N 18 118.883 118.883 122.750 -3.867 19998
1634 1 9 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.482 0.126 19998
1635 1 9 . 1 1 18 18 CYS C C 18 172.722 172.722 175.876 -3.154 19998
1636 1 9 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.303 -3.782 19998
1637 1 9 . 1 1 18 18 CYS CB C 18 41.367 41.367 25.891 15.476 19998
1638 1 9 . 1 1 18 18 CYS H H 18 9.192 9.192 8.577 0.615 19998
1639 1 9 . 1 1 19 19 LYS N N 19 131.730 131.730 126.504 5.226 19998
1640 1 9 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.113 0.219 19998
1641 1 9 . 1 1 19 19 LYS C C 19 177.997 177.997 178.756 -0.759 19998
1642 1 9 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.942 -0.516 19998
1643 1 9 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.271 -0.952 19998
1644 1 9 . 1 1 19 19 LYS H H 19 8.890 8.890 8.548 0.342 19998
1645 1 9 . 1 1 20 20 SER N N 20 115.887 115.887 116.117 -0.230 19998
1646 1 9 . 1 1 20 20 SER HA H 20 4.334 4.334 4.279 0.055 19998
1647 1 9 . 1 1 20 20 SER C C 20 172.946 172.946 175.577 -2.631 19998
1648 1 9 . 1 1 20 20 SER CA C 20 60.311 60.311 60.730 -0.419 19998
1649 1 9 . 1 1 20 20 SER CB C 20 62.327 62.327 62.742 -0.415 19998
1650 1 9 . 1 1 20 20 SER H H 20 8.856 8.856 8.559 0.297 19998
1651 1 9 . 1 1 21 21 SER N N 21 116.191 116.191 115.124 1.067 19998
1652 1 9 . 1 1 21 21 SER HA H 21 4.833 4.833 4.623 0.210 19998
1653 1 9 . 1 1 21 21 SER C C 21 170.505 170.505 173.356 -2.851 19998
1654 1 9 . 1 1 21 21 SER CA C 21 57.500 57.500 57.918 -0.418 19998
1655 1 9 . 1 1 21 21 SER CB C 21 63.852 63.852 63.580 0.272 19998
1656 1 9 . 1 1 21 21 SER H H 21 7.068 7.068 7.504 -0.436 19998
1657 1 9 . 1 1 22 22 SER N N 22 111.723 111.723 116.889 -5.166 19998
1658 1 9 . 1 1 22 22 SER HA H 22 4.099 4.099 4.143 -0.044 19998
1659 1 9 . 1 1 22 22 SER C C 22 170.369 170.369 172.904 -2.535 19998
1660 1 9 . 1 1 22 22 SER CA C 22 59.140 59.140 59.684 -0.545 19998
1661 1 9 . 1 1 22 22 SER CB C 22 61.339 61.339 61.755 -0.416 19998
1662 1 9 . 1 1 22 22 SER H H 22 8.113 8.113 8.204 -0.091 19998
1663 1 9 . 1 1 23 23 LEU N N 23 115.988 115.988 119.876 -3.888 19998
1664 1 9 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.920 -0.022 19998
1665 1 9 . 1 1 23 23 LEU C C 23 173.712 173.712 175.267 -1.555 19998
1666 1 9 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.418 -0.335 19998
1667 1 9 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.135 0.927 19998
1668 1 9 . 1 1 23 23 LEU H H 23 7.111 7.111 7.625 -0.514 19998
1669 1 9 . 1 1 24 24 ALA N N 24 119.898 119.898 120.657 -0.759 19998
1670 1 9 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.641 -0.175 19998
1671 1 9 . 1 1 24 24 ALA C C 24 173.491 173.491 174.679 -1.188 19998
1672 1 9 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.748 -0.581 19998
1673 1 9 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.669 1.568 19998
1674 1 9 . 1 1 24 24 ALA H H 24 8.904 8.904 7.751 1.153 19998
1675 1 9 . 1 1 25 25 CYS N N 25 122.945 122.945 121.202 1.743 19998
1676 1 9 . 1 1 25 25 CYS HA H 25 4.452 4.452 4.981 -0.529 19998
1677 1 9 . 1 1 25 25 CYS C C 25 171.574 171.574 175.186 -3.612 19998
1678 1 9 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.629 -1.497 19998
1679 1 9 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.615 12.564 19998
1680 1 9 . 1 1 25 25 CYS H H 25 9.847 9.847 8.670 1.177 19998
1681 1 9 . 1 1 26 26 SER N N 26 122.285 122.285 123.926 -1.641 19998
1682 1 9 . 1 1 26 26 SER HA H 26 4.543 4.543 4.734 -0.191 19998
1683 1 9 . 1 1 26 26 SER CA C 26 57.773 57.773 56.972 0.801 19998
1684 1 9 . 1 1 26 26 SER CB C 26 63.789 63.789 65.837 -2.048 19998
1685 1 9 . 1 1 26 26 SER H H 26 7.791 7.791 8.392 -0.601 19998
1686 1 9 . 1 1 27 27 THR N N 27 122.390 122.390 121.602 0.788 19998
1687 1 9 . 1 1 27 27 THR HA H 27 3.778 3.778 4.273 -0.495 19998
1688 1 9 . 1 1 27 27 THR C C 27 172.781 172.781 175.047 -2.266 19998
1689 1 9 . 1 1 27 27 THR CA C 27 65.390 65.390 64.002 1.387 19998
1690 1 9 . 1 1 27 27 THR CB C 27 68.458 68.458 68.512 -0.054 19998
1691 1 9 . 1 1 27 27 THR H H 27 8.874 8.874 8.606 0.268 19998
1692 1 9 . 1 1 28 28 LYS N N 28 118.883 118.883 121.748 -2.865 19998
1693 1 9 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.158 -0.127 19998
1694 1 9 . 1 1 28 28 LYS C C 28 174.613 174.613 176.836 -2.223 19998
1695 1 9 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.288 -0.488 19998
1696 1 9 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.231 0.933 19998
1697 1 9 . 1 1 28 28 LYS H H 28 7.609 7.609 7.954 -0.345 19998
1698 1 9 . 1 1 29 29 HIS N N 29 113.398 113.398 114.984 -1.586 19998
1699 1 9 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.597 -0.313 19998
1700 1 9 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.516 0.070 19998
1701 1 9 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.745 -1.683 19998
1702 1 9 . 1 1 29 29 HIS H H 29 7.450 7.450 8.001 -0.551 19998
1703 1 9 . 1 1 30 30 LYS N N 30 116.344 116.344 118.823 -2.479 19998
1704 1 9 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.210 -0.322 19998
1705 1 9 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.316 0.184 19998
1706 1 9 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.679 -1.070 19998
1707 1 9 . 1 1 30 30 LYS H H 30 8.261 8.261 8.408 -0.147 19998
1708 1 9 . 1 1 31 31 TRP N N 31 117.766 117.766 114.874 2.892 19998
1709 1 9 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.022 0.455 19998
1710 1 9 . 1 1 31 31 TRP C C 31 174.754 174.754 174.409 0.345 19998
1711 1 9 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.220 1.536 19998
1712 1 9 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.802 1.174 19998
1713 1 9 . 1 1 31 31 TRP H H 31 8.483 8.483 7.731 0.752 19998
1714 1 9 . 1 1 32 32 CYS N N 32 118.984 118.984 123.055 -4.071 19998
1715 1 9 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.310 0.437 19998
1716 1 9 . 1 1 32 32 CYS C C 32 171.472 171.472 174.751 -3.279 19998
1717 1 9 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.177 -4.444 19998
1718 1 9 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.549 14.975 19998
1719 1 9 . 1 1 32 32 CYS H H 32 8.474 8.474 8.415 0.059 19998
1720 1 9 . 1 1 33 33 LYS N N 33 124.672 124.672 123.842 0.830 19998
1721 1 9 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.112 0.605 19998
1722 1 9 . 1 1 33 33 LYS C C 33 172.236 172.236 175.471 -3.235 19998
1723 1 9 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.139 0.591 19998
1724 1 9 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.864 1.565 19998
1725 1 9 . 1 1 33 33 LYS H H 33 9.027 9.027 8.346 0.681 19998
1726 1 9 . 1 1 34 34 TYR N N 34 120.102 120.102 122.562 -2.460 19998
1727 1 9 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.603 0.275 19998
1728 1 9 . 1 1 34 34 TYR C C 34 174.034 174.034 176.765 -2.731 19998
1729 1 9 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.991 0.271 19998
1730 1 9 . 1 1 34 34 TYR CB C 34 38.633 38.633 38.124 0.509 19998
1731 1 9 . 1 1 34 34 TYR H H 34 8.092 8.092 8.710 -0.618 19998
1732 1 9 . 1 1 35 35 GLU N N 35 124.362 124.362 125.374 -1.012 19998
1733 1 9 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.607 -0.145 19998
1734 1 9 . 1 1 35 35 GLU C C 35 172.127 172.127 174.939 -2.812 19998
1735 1 9 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.051 0.216 19998
1736 1 9 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.139 0.713 19998
1737 1 9 . 1 1 35 35 GLU H H 35 8.754 8.754 8.663 0.091 19998
1738 1 10 . 1 1 2 2 ALA N N 2 123.910 123.910 126.275 -2.365 19998
1739 1 10 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.804 -0.340 19998
1740 1 10 . 1 1 2 2 ALA C C 2 174.673 174.673 176.461 -1.788 19998
1741 1 10 . 1 1 2 2 ALA CA C 2 52.168 52.168 51.998 0.169 19998
1742 1 10 . 1 1 2 2 ALA CB C 2 19.690 19.690 19.015 0.675 19998
1743 1 10 . 1 1 2 2 ALA H H 2 8.561 8.561 8.416 0.145 19998
1744 1 10 . 1 1 3 3 CYS N N 3 117.207 117.207 119.334 -2.127 19998
1745 1 10 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.719 0.246 19998
1746 1 10 . 1 1 3 3 CYS C C 3 170.808 170.808 172.886 -2.078 19998
1747 1 10 . 1 1 3 3 CYS CA C 3 54.754 54.754 56.969 -2.215 19998
1748 1 10 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.597 14.470 19998
1749 1 10 . 1 1 3 3 CYS H H 3 8.335 8.335 8.258 0.077 19998
1750 1 10 . 1 1 4 4 LEU N N 4 121.828 121.828 122.634 -0.806 19998
1751 1 10 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.610 -0.265 19998
1752 1 10 . 1 1 4 4 LEU C C 4 172.234 172.234 177.092 -4.858 19998
1753 1 10 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.044 0.179 19998
1754 1 10 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.978 0.600 19998
1755 1 10 . 1 1 4 4 LEU H H 4 8.815 8.815 8.377 0.438 19998
1756 1 10 . 1 1 5 5 GLY N N 5 107.508 107.508 110.087 -2.579 19998
1757 1 10 . 1 1 5 5 GLY C C 5 169.768 169.768 173.383 -3.615 19998
1758 1 10 . 1 1 5 5 GLY CA C 5 43.052 43.052 43.800 -0.748 19998
1759 1 10 . 1 1 5 5 GLY H H 5 7.999 7.999 8.332 -0.333 19998
1760 1 10 . 1 1 6 6 PHE N N 6 116.953 116.953 120.266 -3.313 19998
1761 1 10 . 1 1 6 6 PHE HA H 6 3.619 3.619 4.031 -0.412 19998
1762 1 10 . 1 1 6 6 PHE C C 6 174.967 174.967 176.720 -1.753 19998
1763 1 10 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.549 1.552 19998
1764 1 10 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.308 0.198 19998
1765 1 10 . 1 1 6 6 PHE H H 6 8.392 8.392 8.433 -0.041 19998
1766 1 10 . 1 1 7 7 GLY N N 7 115.074 115.074 115.134 -0.060 19998
1767 1 10 . 1 1 7 7 GLY C C 7 171.017 171.017 173.844 -2.827 19998
1768 1 10 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.837 0.007 19998
1769 1 10 . 1 1 7 7 GLY H H 7 8.645 8.645 7.410 1.235 19998
1770 1 10 . 1 1 8 8 LYS N N 8 120.051 120.051 120.855 -0.804 19998
1771 1 10 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.650 -0.337 19998
1772 1 10 . 1 1 8 8 LYS C C 8 173.878 173.878 175.909 -2.031 19998
1773 1 10 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.169 0.401 19998
1774 1 10 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.325 -1.934 19998
1775 1 10 . 1 1 8 8 LYS H H 8 7.429 7.429 7.388 0.041 19998
1776 1 10 . 1 1 9 9 SER N N 9 117.004 117.004 116.132 0.872 19998
1777 1 10 . 1 1 9 9 SER HA H 9 4.315 4.315 4.712 -0.397 19998
1778 1 10 . 1 1 9 9 SER C C 9 170.486 170.486 174.585 -4.099 19998
1779 1 10 . 1 1 9 9 SER CB C 9 63.355 63.355 62.581 0.774 19998
1780 1 10 . 1 1 9 9 SER H H 9 8.542 8.542 8.459 0.083 19998
1781 1 10 . 1 1 10 10 CYS N N 10 119.238 119.238 120.892 -1.654 19998
1782 1 10 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.711 0.122 19998
1783 1 10 . 1 1 10 10 CYS C C 10 168.106 168.106 173.264 -5.158 19998
1784 1 10 . 1 1 10 10 CYS CA C 10 53.907 53.907 56.181 -2.275 19998
1785 1 10 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.253 15.588 19998
1786 1 10 . 1 1 10 10 CYS H H 10 8.188 8.188 8.227 -0.039 19998
1787 1 10 . 1 1 11 11 ASN N N 11 119.594 119.594 118.992 0.602 19998
1788 1 10 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.196 -0.072 19998
1789 1 10 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.738 -1.262 19998
1790 1 10 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.997 -0.997 19998
1791 1 10 . 1 1 11 11 ASN H H 11 9.129 9.129 8.617 0.512 19998
1792 1 10 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.440 -0.592 19998
1793 1 10 . 1 1 12 12 PRO C C 12 174.197 174.197 178.476 -4.279 19998
1794 1 10 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.856 -0.167 19998
1795 1 10 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.196 -0.313 19998
1796 1 10 . 1 1 13 13 SER N N 13 110.351 110.351 113.107 -2.756 19998
1797 1 10 . 1 1 13 13 SER HA H 13 4.394 4.394 4.265 0.129 19998
1798 1 10 . 1 1 13 13 SER C C 13 170.980 170.980 174.153 -3.173 19998
1799 1 10 . 1 1 13 13 SER CA C 13 59.326 59.326 59.636 -0.310 19998
1800 1 10 . 1 1 13 13 SER CB C 13 63.380 63.380 62.990 0.390 19998
1801 1 10 . 1 1 13 13 SER H H 13 7.785 7.785 8.454 -0.669 19998
1802 1 10 . 1 1 14 14 ASN N N 14 120.660 120.660 118.481 2.179 19998
1803 1 10 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.902 -0.264 19998
1804 1 10 . 1 1 14 14 ASN C C 14 171.412 171.412 173.384 -1.972 19998
1805 1 10 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.679 1.127 19998
1806 1 10 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.584 -1.774 19998
1807 1 10 . 1 1 14 14 ASN H H 14 7.613 7.613 7.807 -0.194 19998
1808 1 10 . 1 1 15 15 ASP N N 15 124.062 124.062 121.589 2.473 19998
1809 1 10 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.512 -0.402 19998
1810 1 10 . 1 1 15 15 ASP C C 15 174.918 174.918 175.705 -0.787 19998
1811 1 10 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.797 0.977 19998
1812 1 10 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.671 0.689 19998
1813 1 10 . 1 1 15 15 ASP H H 15 8.695 8.695 7.997 0.698 19998
1814 1 10 . 1 1 16 16 GLN N N 16 127.008 127.008 122.910 4.098 19998
1815 1 10 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.568 0.045 19998
1816 1 10 . 1 1 16 16 GLN C C 16 173.874 173.874 174.431 -0.557 19998
1817 1 10 . 1 1 16 16 GLN CA C 16 54.522 54.522 55.103 -0.581 19998
1818 1 10 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.572 -1.245 19998
1819 1 10 . 1 1 16 16 GLN H H 16 8.041 8.041 8.645 -0.604 19998
1820 1 10 . 1 1 17 17 CYS N N 17 122.234 122.234 119.025 3.209 19998
1821 1 10 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.808 0.175 19998
1822 1 10 . 1 1 17 17 CYS C C 17 173.908 173.908 174.792 -0.884 19998
1823 1 10 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.724 -1.238 19998
1824 1 10 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.462 8.444 19998
1825 1 10 . 1 1 17 17 CYS H H 17 9.314 9.314 8.154 1.160 19998
1826 1 10 . 1 1 18 18 CYS N N 18 118.883 118.883 122.521 -3.638 19998
1827 1 10 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.528 0.080 19998
1828 1 10 . 1 1 18 18 CYS C C 18 172.722 172.722 175.984 -3.262 19998
1829 1 10 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.138 -3.617 19998
1830 1 10 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.282 15.085 19998
1831 1 10 . 1 1 18 18 CYS H H 18 9.192 9.192 8.593 0.599 19998
1832 1 10 . 1 1 19 19 LYS N N 19 131.730 131.730 126.924 4.806 19998
1833 1 10 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.124 0.208 19998
1834 1 10 . 1 1 19 19 LYS C C 19 177.997 177.997 178.863 -0.866 19998
1835 1 10 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.825 -0.399 19998
1836 1 10 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.238 -0.919 19998
1837 1 10 . 1 1 19 19 LYS H H 19 8.890 8.890 8.587 0.303 19998
1838 1 10 . 1 1 20 20 SER N N 20 115.887 115.887 115.034 0.853 19998
1839 1 10 . 1 1 20 20 SER HA H 20 4.334 4.334 4.282 0.052 19998
1840 1 10 . 1 1 20 20 SER C C 20 172.946 172.946 175.719 -2.773 19998
1841 1 10 . 1 1 20 20 SER CA C 20 60.311 60.311 60.818 -0.507 19998
1842 1 10 . 1 1 20 20 SER CB C 20 62.327 62.327 62.558 -0.231 19998
1843 1 10 . 1 1 20 20 SER H H 20 8.856 8.856 8.480 0.376 19998
1844 1 10 . 1 1 21 21 SER N N 21 116.191 116.191 116.094 0.097 19998
1845 1 10 . 1 1 21 21 SER HA H 21 4.833 4.833 4.585 0.248 19998
1846 1 10 . 1 1 21 21 SER C C 21 170.505 170.505 173.287 -2.782 19998
1847 1 10 . 1 1 21 21 SER CA C 21 57.500 57.500 57.880 -0.380 19998
1848 1 10 . 1 1 21 21 SER CB C 21 63.852 63.852 63.455 0.397 19998
1849 1 10 . 1 1 21 21 SER H H 21 7.068 7.068 7.634 -0.566 19998
1850 1 10 . 1 1 22 22 SER N N 22 111.723 111.723 117.157 -5.434 19998
1851 1 10 . 1 1 22 22 SER HA H 22 4.099 4.099 4.118 -0.019 19998
1852 1 10 . 1 1 22 22 SER C C 22 170.369 170.369 172.841 -2.472 19998
1853 1 10 . 1 1 22 22 SER CA C 22 59.140 59.140 59.369 -0.229 19998
1854 1 10 . 1 1 22 22 SER CB C 22 61.339 61.339 61.990 -0.651 19998
1855 1 10 . 1 1 22 22 SER H H 22 8.113 8.113 8.078 0.035 19998
1856 1 10 . 1 1 23 23 LEU N N 23 115.988 115.988 120.151 -4.163 19998
1857 1 10 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.929 -0.031 19998
1858 1 10 . 1 1 23 23 LEU C C 23 173.712 173.712 175.209 -1.497 19998
1859 1 10 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.424 -0.341 19998
1860 1 10 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.536 0.526 19998
1861 1 10 . 1 1 23 23 LEU H H 23 7.111 7.111 7.651 -0.540 19998
1862 1 10 . 1 1 24 24 ALA N N 24 119.898 119.898 120.665 -0.767 19998
1863 1 10 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.661 -0.195 19998
1864 1 10 . 1 1 24 24 ALA C C 24 173.491 173.491 174.732 -1.241 19998
1865 1 10 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.771 -0.604 19998
1866 1 10 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.737 1.500 19998
1867 1 10 . 1 1 24 24 ALA H H 24 8.904 8.904 7.771 1.133 19998
1868 1 10 . 1 1 25 25 CYS N N 25 122.945 122.945 121.076 1.869 19998
1869 1 10 . 1 1 25 25 CYS HA H 25 4.452 4.452 5.075 -0.623 19998
1870 1 10 . 1 1 25 25 CYS C C 25 171.574 171.574 174.995 -3.421 19998
1871 1 10 . 1 1 25 25 CYS CA C 25 56.132 56.132 58.134 -2.002 19998
1872 1 10 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.775 12.404 19998
1873 1 10 . 1 1 25 25 CYS H H 25 9.847 9.847 8.649 1.198 19998
1874 1 10 . 1 1 26 26 SER N N 26 122.285 122.285 122.922 -0.637 19998
1875 1 10 . 1 1 26 26 SER HA H 26 4.543 4.543 4.701 -0.158 19998
1876 1 10 . 1 1 26 26 SER CA C 26 57.773 57.773 57.249 0.524 19998
1877 1 10 . 1 1 26 26 SER CB C 26 63.789 63.789 65.949 -2.160 19998
1878 1 10 . 1 1 26 26 SER H H 26 7.791 7.791 8.419 -0.628 19998
1879 1 10 . 1 1 27 27 THR N N 27 122.390 122.390 121.113 1.277 19998
1880 1 10 . 1 1 27 27 THR HA H 27 3.778 3.778 4.275 -0.497 19998
1881 1 10 . 1 1 27 27 THR C C 27 172.781 172.781 175.111 -2.330 19998
1882 1 10 . 1 1 27 27 THR CA C 27 65.390 65.390 64.333 1.057 19998
1883 1 10 . 1 1 27 27 THR CB C 27 68.458 68.458 68.600 -0.142 19998
1884 1 10 . 1 1 27 27 THR H H 27 8.874 8.874 8.677 0.197 19998
1885 1 10 . 1 1 28 28 LYS N N 28 118.883 118.883 120.744 -1.861 19998
1886 1 10 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.177 -0.146 19998
1887 1 10 . 1 1 28 28 LYS C C 28 174.613 174.613 176.890 -2.277 19998
1888 1 10 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.575 -0.776 19998
1889 1 10 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.459 0.705 19998
1890 1 10 . 1 1 28 28 LYS H H 28 7.609 7.609 7.994 -0.385 19998
1891 1 10 . 1 1 29 29 HIS N N 29 113.398 113.398 114.952 -1.554 19998
1892 1 10 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.623 -0.339 19998
1893 1 10 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.415 0.171 19998
1894 1 10 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.580 -1.518 19998
1895 1 10 . 1 1 29 29 HIS H H 29 7.450 7.450 7.996 -0.546 19998
1896 1 10 . 1 1 30 30 LYS N N 30 116.344 116.344 119.003 -2.659 19998
1897 1 10 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.220 -0.332 19998
1898 1 10 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.338 0.162 19998
1899 1 10 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.679 -1.070 19998
1900 1 10 . 1 1 30 30 LYS H H 30 8.261 8.261 8.426 -0.165 19998
1901 1 10 . 1 1 31 31 TRP N N 31 117.766 117.766 114.856 2.910 19998
1902 1 10 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.022 0.455 19998
1903 1 10 . 1 1 31 31 TRP C C 31 174.754 174.754 174.414 0.340 19998
1904 1 10 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.197 1.558 19998
1905 1 10 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.780 1.196 19998
1906 1 10 . 1 1 31 31 TRP H H 31 8.483 8.483 7.723 0.760 19998
1907 1 10 . 1 1 32 32 CYS N N 32 118.984 118.984 123.043 -4.059 19998
1908 1 10 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.308 0.439 19998
1909 1 10 . 1 1 32 32 CYS C C 32 171.472 171.472 174.761 -3.289 19998
1910 1 10 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.202 -4.469 19998
1911 1 10 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.553 14.971 19998
1912 1 10 . 1 1 32 32 CYS H H 32 8.474 8.474 8.430 0.044 19998
1913 1 10 . 1 1 33 33 LYS N N 33 124.672 124.672 123.869 0.803 19998
1914 1 10 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.122 0.595 19998
1915 1 10 . 1 1 33 33 LYS C C 33 172.236 172.236 175.472 -3.236 19998
1916 1 10 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.130 0.600 19998
1917 1 10 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.868 1.561 19998
1918 1 10 . 1 1 33 33 LYS H H 33 9.027 9.027 8.413 0.614 19998
1919 1 10 . 1 1 34 34 TYR N N 34 120.102 120.102 123.002 -2.900 19998
1920 1 10 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.600 0.278 19998
1921 1 10 . 1 1 34 34 TYR C C 34 174.034 174.034 176.726 -2.692 19998
1922 1 10 . 1 1 34 34 TYR CA C 34 59.262 59.262 59.107 0.155 19998
1923 1 10 . 1 1 34 34 TYR CB C 34 38.633 38.633 38.017 0.616 19998
1924 1 10 . 1 1 34 34 TYR H H 34 8.092 8.092 8.751 -0.659 19998
1925 1 10 . 1 1 35 35 GLU N N 35 124.362 124.362 126.064 -1.702 19998
1926 1 10 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.557 -0.095 19998
1927 1 10 . 1 1 35 35 GLU C C 35 172.127 172.127 175.381 -3.254 19998
1928 1 10 . 1 1 35 35 GLU CA C 35 56.267 56.267 55.500 0.767 19998
1929 1 10 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.546 0.306 19998
1930 1 10 . 1 1 35 35 GLU H H 35 8.754 8.754 8.676 0.078 19998
1931 1 11 . 1 1 2 2 ALA N N 2 123.910 123.910 125.425 -1.515 19998
1932 1 11 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.928 -0.464 19998
1933 1 11 . 1 1 2 2 ALA C C 2 174.673 174.673 176.539 -1.866 19998
1934 1 11 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.279 -0.111 19998
1935 1 11 . 1 1 2 2 ALA CB C 2 19.690 19.690 19.059 0.631 19998
1936 1 11 . 1 1 2 2 ALA H H 2 8.561 8.561 8.122 0.439 19998
1937 1 11 . 1 1 3 3 CYS N N 3 117.207 117.207 118.543 -1.336 19998
1938 1 11 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.641 0.324 19998
1939 1 11 . 1 1 3 3 CYS C C 3 170.808 170.808 172.496 -1.688 19998
1940 1 11 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.462 -2.708 19998
1941 1 11 . 1 1 3 3 CYS CB C 3 44.067 44.067 28.800 15.267 19998
1942 1 11 . 1 1 3 3 CYS H H 3 8.335 8.335 8.279 0.056 19998
1943 1 11 . 1 1 4 4 LEU N N 4 121.828 121.828 122.933 -1.105 19998
1944 1 11 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.614 -0.269 19998
1945 1 11 . 1 1 4 4 LEU C C 4 172.234 172.234 177.245 -5.011 19998
1946 1 11 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.058 0.165 19998
1947 1 11 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.637 0.941 19998
1948 1 11 . 1 1 4 4 LEU H H 4 8.815 8.815 8.414 0.401 19998
1949 1 11 . 1 1 5 5 GLY N N 5 107.508 107.508 110.483 -2.975 19998
1950 1 11 . 1 1 5 5 GLY C C 5 169.768 169.768 173.436 -3.668 19998
1951 1 11 . 1 1 5 5 GLY CA C 5 43.052 43.052 44.014 -0.962 19998
1952 1 11 . 1 1 5 5 GLY H H 5 7.999 7.999 8.311 -0.312 19998
1953 1 11 . 1 1 6 6 PHE N N 6 116.953 116.953 120.486 -3.533 19998
1954 1 11 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.951 -0.332 19998
1955 1 11 . 1 1 6 6 PHE C C 6 174.967 174.967 177.362 -2.395 19998
1956 1 11 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.561 1.540 19998
1957 1 11 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.013 0.493 19998
1958 1 11 . 1 1 6 6 PHE H H 6 8.392 8.392 8.244 0.148 19998
1959 1 11 . 1 1 7 7 GLY N N 7 115.074 115.074 114.603 0.471 19998
1960 1 11 . 1 1 7 7 GLY C C 7 171.017 171.017 173.476 -2.459 19998
1961 1 11 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.711 0.133 19998
1962 1 11 . 1 1 7 7 GLY H H 7 8.645 8.645 7.570 1.075 19998
1963 1 11 . 1 1 8 8 LYS N N 8 120.051 120.051 120.786 -0.735 19998
1964 1 11 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.654 -0.341 19998
1965 1 11 . 1 1 8 8 LYS C C 8 173.878 173.878 175.870 -1.992 19998
1966 1 11 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.112 0.458 19998
1967 1 11 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.325 -1.934 19998
1968 1 11 . 1 1 8 8 LYS H H 8 7.429 7.429 7.391 0.038 19998
1969 1 11 . 1 1 9 9 SER N N 9 117.004 117.004 116.046 0.958 19998
1970 1 11 . 1 1 9 9 SER HA H 9 4.315 4.315 4.708 -0.393 19998
1971 1 11 . 1 1 9 9 SER C C 9 170.486 170.486 174.588 -4.102 19998
1972 1 11 . 1 1 9 9 SER CB C 9 63.355 63.355 62.432 0.923 19998
1973 1 11 . 1 1 9 9 SER H H 9 8.542 8.542 8.456 0.086 19998
1974 1 11 . 1 1 10 10 CYS N N 10 119.238 119.238 121.164 -1.926 19998
1975 1 11 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.728 0.105 19998
1976 1 11 . 1 1 10 10 CYS C C 10 168.106 168.106 173.744 -5.638 19998
1977 1 11 . 1 1 10 10 CYS CA C 10 53.907 53.907 56.134 -2.227 19998
1978 1 11 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.413 15.428 19998
1979 1 11 . 1 1 10 10 CYS H H 10 8.188 8.188 8.401 -0.213 19998
1980 1 11 . 1 1 11 11 ASN N N 11 119.594 119.594 119.012 0.582 19998
1981 1 11 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.206 -0.082 19998
1982 1 11 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.518 -1.042 19998
1983 1 11 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.249 -0.249 19998
1984 1 11 . 1 1 11 11 ASN H H 11 9.129 9.129 8.625 0.504 19998
1985 1 11 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.429 -0.581 19998
1986 1 11 . 1 1 12 12 PRO C C 12 174.197 174.197 178.050 -3.853 19998
1987 1 11 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.681 0.008 19998
1988 1 11 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.125 -0.242 19998
1989 1 11 . 1 1 13 13 SER N N 13 110.351 110.351 112.548 -2.197 19998
1990 1 11 . 1 1 13 13 SER HA H 13 4.394 4.394 4.260 0.134 19998
1991 1 11 . 1 1 13 13 SER C C 13 170.980 170.980 174.148 -3.168 19998
1992 1 11 . 1 1 13 13 SER CA C 13 59.326 59.326 60.218 -0.892 19998
1993 1 11 . 1 1 13 13 SER CB C 13 63.380 63.380 62.944 0.436 19998
1994 1 11 . 1 1 13 13 SER H H 13 7.785 7.785 8.430 -0.645 19998
1995 1 11 . 1 1 14 14 ASN N N 14 120.660 120.660 118.809 1.851 19998
1996 1 11 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.864 -0.226 19998
1997 1 11 . 1 1 14 14 ASN C C 14 171.412 171.412 173.426 -2.014 19998
1998 1 11 . 1 1 14 14 ASN CA C 14 52.806 52.806 52.111 0.695 19998
1999 1 11 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.381 -1.571 19998
2000 1 11 . 1 1 14 14 ASN H H 14 7.613 7.613 7.637 -0.024 19998
2001 1 11 . 1 1 15 15 ASP N N 15 124.062 124.062 122.399 1.663 19998
2002 1 11 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.553 -0.443 19998
2003 1 11 . 1 1 15 15 ASP C C 15 174.918 174.918 175.786 -0.868 19998
2004 1 11 . 1 1 15 15 ASP CA C 15 55.774 55.774 55.201 0.573 19998
2005 1 11 . 1 1 15 15 ASP CB C 15 41.360 41.360 41.108 0.252 19998
2006 1 11 . 1 1 15 15 ASP H H 15 8.695 8.695 8.202 0.493 19998
2007 1 11 . 1 1 16 16 GLN N N 16 127.008 127.008 125.090 1.918 19998
2008 1 11 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.486 0.127 19998
2009 1 11 . 1 1 16 16 GLN C C 16 173.874 173.874 174.328 -0.454 19998
2010 1 11 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.999 -0.477 19998
2011 1 11 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.485 -1.159 19998
2012 1 11 . 1 1 16 16 GLN H H 16 8.041 8.041 8.578 -0.537 19998
2013 1 11 . 1 1 17 17 CYS N N 17 122.234 122.234 118.662 3.572 19998
2014 1 11 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.812 0.171 19998
2015 1 11 . 1 1 17 17 CYS C C 17 173.908 173.908 174.822 -0.914 19998
2016 1 11 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.740 -1.254 19998
2017 1 11 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.804 8.102 19998
2018 1 11 . 1 1 17 17 CYS H H 17 9.314 9.314 8.016 1.298 19998
2019 1 11 . 1 1 18 18 CYS N N 18 118.883 118.883 122.601 -3.718 19998
2020 1 11 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.541 0.067 19998
2021 1 11 . 1 1 18 18 CYS C C 18 172.722 172.722 175.988 -3.266 19998
2022 1 11 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.000 -3.479 19998
2023 1 11 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.107 15.260 19998
2024 1 11 . 1 1 18 18 CYS H H 18 9.192 9.192 8.565 0.627 19998
2025 1 11 . 1 1 19 19 LYS N N 19 131.730 131.730 126.892 4.838 19998
2026 1 11 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.081 0.251 19998
2027 1 11 . 1 1 19 19 LYS C C 19 177.997 177.997 178.874 -0.877 19998
2028 1 11 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.756 -0.330 19998
2029 1 11 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.120 -0.801 19998
2030 1 11 . 1 1 19 19 LYS H H 19 8.890 8.890 8.525 0.365 19998
2031 1 11 . 1 1 20 20 SER N N 20 115.887 115.887 114.247 1.640 19998
2032 1 11 . 1 1 20 20 SER HA H 20 4.334 4.334 4.260 0.074 19998
2033 1 11 . 1 1 20 20 SER C C 20 172.946 172.946 175.776 -2.830 19998
2034 1 11 . 1 1 20 20 SER CA C 20 60.311 60.311 60.764 -0.453 19998
2035 1 11 . 1 1 20 20 SER CB C 20 62.327 62.327 62.528 -0.201 19998
2036 1 11 . 1 1 20 20 SER H H 20 8.856 8.856 8.298 0.558 19998
2037 1 11 . 1 1 21 21 SER N N 21 116.191 116.191 115.900 0.291 19998
2038 1 11 . 1 1 21 21 SER HA H 21 4.833 4.833 4.556 0.277 19998
2039 1 11 . 1 1 21 21 SER C C 21 170.505 170.505 173.389 -2.884 19998
2040 1 11 . 1 1 21 21 SER CA C 21 57.500 57.500 57.395 0.105 19998
2041 1 11 . 1 1 21 21 SER CB C 21 63.852 63.852 63.556 0.296 19998
2042 1 11 . 1 1 21 21 SER H H 21 7.068 7.068 7.500 -0.432 19998
2043 1 11 . 1 1 22 22 SER N N 22 111.723 111.723 117.107 -5.384 19998
2044 1 11 . 1 1 22 22 SER HA H 22 4.099 4.099 4.155 -0.056 19998
2045 1 11 . 1 1 22 22 SER C C 22 170.369 170.369 172.925 -2.556 19998
2046 1 11 . 1 1 22 22 SER CA C 22 59.140 59.140 59.609 -0.469 19998
2047 1 11 . 1 1 22 22 SER CB C 22 61.339 61.339 61.765 -0.426 19998
2048 1 11 . 1 1 22 22 SER H H 22 8.113 8.113 8.252 -0.139 19998
2049 1 11 . 1 1 23 23 LEU N N 23 115.988 115.988 120.396 -4.408 19998
2050 1 11 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.917 -0.019 19998
2051 1 11 . 1 1 23 23 LEU C C 23 173.712 173.712 175.348 -1.636 19998
2052 1 11 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.387 -0.304 19998
2053 1 11 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.473 0.589 19998
2054 1 11 . 1 1 23 23 LEU H H 23 7.111 7.111 7.534 -0.423 19998
2055 1 11 . 1 1 24 24 ALA N N 24 119.898 119.898 119.949 -0.051 19998
2056 1 11 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.718 -0.252 19998
2057 1 11 . 1 1 24 24 ALA C C 24 173.491 173.491 174.721 -1.230 19998
2058 1 11 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.481 -0.314 19998
2059 1 11 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.846 1.391 19998
2060 1 11 . 1 1 24 24 ALA H H 24 8.904 8.904 7.856 1.048 19998
2061 1 11 . 1 1 25 25 CYS N N 25 122.945 122.945 121.152 1.793 19998
2062 1 11 . 1 1 25 25 CYS HA H 25 4.452 4.452 5.044 -0.592 19998
2063 1 11 . 1 1 25 25 CYS C C 25 171.574 171.574 174.960 -3.386 19998
2064 1 11 . 1 1 25 25 CYS CA C 25 56.132 56.132 58.379 -2.247 19998
2065 1 11 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.481 12.698 19998
2066 1 11 . 1 1 25 25 CYS H H 25 9.847 9.847 8.505 1.342 19998
2067 1 11 . 1 1 26 26 SER N N 26 122.285 122.285 123.118 -0.833 19998
2068 1 11 . 1 1 26 26 SER HA H 26 4.543 4.543 4.709 -0.166 19998
2069 1 11 . 1 1 26 26 SER CA C 26 57.773 57.773 57.145 0.628 19998
2070 1 11 . 1 1 26 26 SER CB C 26 63.789 63.789 65.942 -2.153 19998
2071 1 11 . 1 1 26 26 SER H H 26 7.791 7.791 8.397 -0.606 19998
2072 1 11 . 1 1 27 27 THR N N 27 122.390 122.390 120.780 1.610 19998
2073 1 11 . 1 1 27 27 THR HA H 27 3.778 3.778 4.293 -0.515 19998
2074 1 11 . 1 1 27 27 THR C C 27 172.781 172.781 175.222 -2.441 19998
2075 1 11 . 1 1 27 27 THR CA C 27 65.390 65.390 63.615 1.775 19998
2076 1 11 . 1 1 27 27 THR CB C 27 68.458 68.458 68.727 -0.269 19998
2077 1 11 . 1 1 27 27 THR H H 27 8.874 8.874 8.683 0.191 19998
2078 1 11 . 1 1 28 28 LYS N N 28 118.883 118.883 120.426 -1.543 19998
2079 1 11 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.227 -0.196 19998
2080 1 11 . 1 1 28 28 LYS C C 28 174.613 174.613 176.970 -2.357 19998
2081 1 11 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.488 -0.689 19998
2082 1 11 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.463 0.701 19998
2083 1 11 . 1 1 28 28 LYS H H 28 7.609 7.609 8.135 -0.526 19998
2084 1 11 . 1 1 29 29 HIS N N 29 113.398 113.398 115.066 -1.668 19998
2085 1 11 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.638 -0.354 19998
2086 1 11 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.505 0.081 19998
2087 1 11 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.765 -1.703 19998
2088 1 11 . 1 1 29 29 HIS H H 29 7.450 7.450 8.082 -0.632 19998
2089 1 11 . 1 1 30 30 LYS N N 30 116.344 116.344 119.087 -2.743 19998
2090 1 11 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.218 -0.330 19998
2091 1 11 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.356 0.144 19998
2092 1 11 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.638 -1.029 19998
2093 1 11 . 1 1 30 30 LYS H H 30 8.261 8.261 8.435 -0.174 19998
2094 1 11 . 1 1 31 31 TRP N N 31 117.766 117.766 114.924 2.842 19998
2095 1 11 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.019 0.458 19998
2096 1 11 . 1 1 31 31 TRP C C 31 174.754 174.754 174.398 0.356 19998
2097 1 11 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.230 1.526 19998
2098 1 11 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.851 1.125 19998
2099 1 11 . 1 1 31 31 TRP H H 31 8.483 8.483 7.761 0.722 19998
2100 1 11 . 1 1 32 32 CYS N N 32 118.984 118.984 122.919 -3.935 19998
2101 1 11 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.332 0.415 19998
2102 1 11 . 1 1 32 32 CYS C C 32 171.472 171.472 174.736 -3.264 19998
2103 1 11 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.179 -4.446 19998
2104 1 11 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.598 14.926 19998
2105 1 11 . 1 1 32 32 CYS H H 32 8.474 8.474 8.420 0.054 19998
2106 1 11 . 1 1 33 33 LYS N N 33 124.672 124.672 123.880 0.792 19998
2107 1 11 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.158 0.559 19998
2108 1 11 . 1 1 33 33 LYS C C 33 172.236 172.236 175.473 -3.237 19998
2109 1 11 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.122 0.608 19998
2110 1 11 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.893 1.536 19998
2111 1 11 . 1 1 33 33 LYS H H 33 9.027 9.027 8.367 0.660 19998
2112 1 11 . 1 1 34 34 TYR N N 34 120.102 120.102 122.962 -2.860 19998
2113 1 11 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.607 0.271 19998
2114 1 11 . 1 1 34 34 TYR C C 34 174.034 174.034 176.702 -2.668 19998
2115 1 11 . 1 1 34 34 TYR CA C 34 59.262 59.262 59.142 0.120 19998
2116 1 11 . 1 1 34 34 TYR CB C 34 38.633 38.633 38.049 0.584 19998
2117 1 11 . 1 1 34 34 TYR H H 34 8.092 8.092 8.729 -0.637 19998
2118 1 11 . 1 1 35 35 GLU N N 35 124.362 124.362 126.051 -1.689 19998
2119 1 11 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.633 -0.171 19998
2120 1 11 . 1 1 35 35 GLU C C 35 172.127 172.127 175.042 -2.915 19998
2121 1 11 . 1 1 35 35 GLU CA C 35 56.267 56.267 55.795 0.472 19998
2122 1 11 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.570 0.281 19998
2123 1 11 . 1 1 35 35 GLU H H 35 8.754 8.754 8.547 0.207 19998
2124 1 12 . 1 1 2 2 ALA N N 2 123.910 123.910 123.193 0.717 19998
2125 1 12 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.688 -0.224 19998
2126 1 12 . 1 1 2 2 ALA C C 2 174.673 174.673 176.007 -1.334 19998
2127 1 12 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.217 -0.049 19998
2128 1 12 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.710 0.980 19998
2129 1 12 . 1 1 2 2 ALA H H 2 8.561 8.561 8.139 0.422 19998
2130 1 12 . 1 1 3 3 CYS N N 3 117.207 117.207 118.887 -1.680 19998
2131 1 12 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.663 0.302 19998
2132 1 12 . 1 1 3 3 CYS C C 3 170.808 170.808 172.690 -1.882 19998
2133 1 12 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.191 -2.437 19998
2134 1 12 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.318 14.749 19998
2135 1 12 . 1 1 3 3 CYS H H 3 8.335 8.335 8.143 0.192 19998
2136 1 12 . 1 1 4 4 LEU N N 4 121.828 121.828 122.646 -0.818 19998
2137 1 12 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.625 -0.280 19998
2138 1 12 . 1 1 4 4 LEU C C 4 172.234 172.234 177.084 -4.850 19998
2139 1 12 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.054 0.169 19998
2140 1 12 . 1 1 4 4 LEU CB C 4 44.578 44.578 44.157 0.421 19998
2141 1 12 . 1 1 4 4 LEU H H 4 8.815 8.815 8.372 0.443 19998
2142 1 12 . 1 1 5 5 GLY N N 5 107.508 107.508 110.059 -2.551 19998
2143 1 12 . 1 1 5 5 GLY C C 5 169.768 169.768 173.359 -3.591 19998
2144 1 12 . 1 1 5 5 GLY CA C 5 43.052 43.052 43.770 -0.719 19998
2145 1 12 . 1 1 5 5 GLY H H 5 7.999 7.999 8.324 -0.325 19998
2146 1 12 . 1 1 6 6 PHE N N 6 116.953 116.953 120.640 -3.687 19998
2147 1 12 . 1 1 6 6 PHE HA H 6 3.619 3.619 4.016 -0.397 19998
2148 1 12 . 1 1 6 6 PHE C C 6 174.967 174.967 176.737 -1.770 19998
2149 1 12 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.765 1.336 19998
2150 1 12 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.086 0.420 19998
2151 1 12 . 1 1 6 6 PHE H H 6 8.392 8.392 8.504 -0.112 19998
2152 1 12 . 1 1 7 7 GLY N N 7 115.074 115.074 115.310 -0.236 19998
2153 1 12 . 1 1 7 7 GLY C C 7 171.017 171.017 173.901 -2.884 19998
2154 1 12 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.778 0.066 19998
2155 1 12 . 1 1 7 7 GLY H H 7 8.645 8.645 7.408 1.237 19998
2156 1 12 . 1 1 8 8 LYS N N 8 120.051 120.051 120.703 -0.652 19998
2157 1 12 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.669 -0.356 19998
2158 1 12 . 1 1 8 8 LYS C C 8 173.878 173.878 175.906 -2.028 19998
2159 1 12 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.184 0.386 19998
2160 1 12 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.524 -2.133 19998
2161 1 12 . 1 1 8 8 LYS H H 8 7.429 7.429 7.402 0.027 19998
2162 1 12 . 1 1 9 9 SER N N 9 117.004 117.004 116.118 0.886 19998
2163 1 12 . 1 1 9 9 SER HA H 9 4.315 4.315 4.762 -0.447 19998
2164 1 12 . 1 1 9 9 SER C C 9 170.486 170.486 174.524 -4.038 19998
2165 1 12 . 1 1 9 9 SER CB C 9 63.355 63.355 62.694 0.661 19998
2166 1 12 . 1 1 9 9 SER H H 9 8.542 8.542 8.460 0.082 19998
2167 1 12 . 1 1 10 10 CYS N N 10 119.238 119.238 121.405 -2.167 19998
2168 1 12 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.769 0.064 19998
2169 1 12 . 1 1 10 10 CYS C C 10 168.106 168.106 173.787 -5.681 19998
2170 1 12 . 1 1 10 10 CYS CA C 10 53.907 53.907 56.107 -2.200 19998
2171 1 12 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.023 15.818 19998
2172 1 12 . 1 1 10 10 CYS H H 10 8.188 8.188 8.495 -0.307 19998
2173 1 12 . 1 1 11 11 ASN N N 11 119.594 119.594 118.922 0.672 19998
2174 1 12 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.200 -0.076 19998
2175 1 12 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.565 -1.089 19998
2176 1 12 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.280 -0.280 19998
2177 1 12 . 1 1 11 11 ASN H H 11 9.129 9.129 8.606 0.523 19998
2178 1 12 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.466 -0.618 19998
2179 1 12 . 1 1 12 12 PRO C C 12 174.197 174.197 178.529 -4.332 19998
2180 1 12 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.824 -0.135 19998
2181 1 12 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.270 -0.387 19998
2182 1 12 . 1 1 13 13 SER N N 13 110.351 110.351 112.603 -2.252 19998
2183 1 12 . 1 1 13 13 SER HA H 13 4.394 4.394 4.233 0.161 19998
2184 1 12 . 1 1 13 13 SER C C 13 170.980 170.980 173.965 -2.985 19998
2185 1 12 . 1 1 13 13 SER CA C 13 59.326 59.326 59.845 -0.519 19998
2186 1 12 . 1 1 13 13 SER CB C 13 63.380 63.380 63.086 0.294 19998
2187 1 12 . 1 1 13 13 SER H H 13 7.785 7.785 8.412 -0.627 19998
2188 1 12 . 1 1 14 14 ASN N N 14 120.660 120.660 117.930 2.730 19998
2189 1 12 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.914 -0.276 19998
2190 1 12 . 1 1 14 14 ASN C C 14 171.412 171.412 173.491 -2.079 19998
2191 1 12 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.734 1.072 19998
2192 1 12 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.012 -1.202 19998
2193 1 12 . 1 1 14 14 ASN H H 14 7.613 7.613 7.760 -0.147 19998
2194 1 12 . 1 1 15 15 ASP N N 15 124.062 124.062 121.272 2.790 19998
2195 1 12 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.507 -0.397 19998
2196 1 12 . 1 1 15 15 ASP C C 15 174.918 174.918 175.556 -0.638 19998
2197 1 12 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.691 1.083 19998
2198 1 12 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.702 0.658 19998
2199 1 12 . 1 1 15 15 ASP H H 15 8.695 8.695 7.999 0.696 19998
2200 1 12 . 1 1 16 16 GLN N N 16 127.008 127.008 122.062 4.946 19998
2201 1 12 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.581 0.032 19998
2202 1 12 . 1 1 16 16 GLN C C 16 173.874 173.874 173.943 -0.069 19998
2203 1 12 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.717 -0.195 19998
2204 1 12 . 1 1 16 16 GLN CB C 16 28.327 28.327 28.741 -0.414 19998
2205 1 12 . 1 1 16 16 GLN H H 16 8.041 8.041 8.591 -0.550 19998
2206 1 12 . 1 1 17 17 CYS N N 17 122.234 122.234 118.582 3.652 19998
2207 1 12 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.762 0.221 19998
2208 1 12 . 1 1 17 17 CYS C C 17 173.908 173.908 174.812 -0.904 19998
2209 1 12 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.645 -1.159 19998
2210 1 12 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.539 8.367 19998
2211 1 12 . 1 1 17 17 CYS H H 17 9.314 9.314 8.040 1.274 19998
2212 1 12 . 1 1 18 18 CYS N N 18 118.883 118.883 122.557 -3.674 19998
2213 1 12 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.527 0.081 19998
2214 1 12 . 1 1 18 18 CYS C C 18 172.722 172.722 175.984 -3.262 19998
2215 1 12 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.155 -3.634 19998
2216 1 12 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.233 15.134 19998
2217 1 12 . 1 1 18 18 CYS H H 18 9.192 9.192 8.632 0.560 19998
2218 1 12 . 1 1 19 19 LYS N N 19 131.730 131.730 126.925 4.805 19998
2219 1 12 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.119 0.213 19998
2220 1 12 . 1 1 19 19 LYS C C 19 177.997 177.997 178.874 -0.877 19998
2221 1 12 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.888 -0.462 19998
2222 1 12 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.260 -0.941 19998
2223 1 12 . 1 1 19 19 LYS H H 19 8.890 8.890 8.537 0.352 19998
2224 1 12 . 1 1 20 20 SER N N 20 115.887 115.887 113.417 2.470 19998
2225 1 12 . 1 1 20 20 SER HA H 20 4.334 4.334 4.227 0.107 19998
2226 1 12 . 1 1 20 20 SER C C 20 172.946 172.946 175.425 -2.479 19998
2227 1 12 . 1 1 20 20 SER CA C 20 60.311 60.311 60.570 -0.259 19998
2228 1 12 . 1 1 20 20 SER CB C 20 62.327 62.327 62.697 -0.370 19998
2229 1 12 . 1 1 20 20 SER H H 20 8.856 8.856 8.659 0.197 19998
2230 1 12 . 1 1 21 21 SER N N 21 116.191 116.191 116.195 -0.004 19998
2231 1 12 . 1 1 21 21 SER HA H 21 4.833 4.833 4.598 0.235 19998
2232 1 12 . 1 1 21 21 SER C C 21 170.505 170.505 173.762 -3.257 19998
2233 1 12 . 1 1 21 21 SER CA C 21 57.500 57.500 58.166 -0.666 19998
2234 1 12 . 1 1 21 21 SER CB C 21 63.852 63.852 63.355 0.497 19998
2235 1 12 . 1 1 21 21 SER H H 21 7.068 7.068 7.630 -0.562 19998
2236 1 12 . 1 1 22 22 SER N N 22 111.723 111.723 115.806 -4.083 19998
2237 1 12 . 1 1 22 22 SER HA H 22 4.099 4.099 4.076 0.023 19998
2238 1 12 . 1 1 22 22 SER C C 22 170.369 170.369 172.886 -2.517 19998
2239 1 12 . 1 1 22 22 SER CA C 22 59.140 59.140 59.562 -0.423 19998
2240 1 12 . 1 1 22 22 SER CB C 22 61.339 61.339 61.727 -0.388 19998
2241 1 12 . 1 1 22 22 SER H H 22 8.113 8.113 8.220 -0.107 19998
2242 1 12 . 1 1 23 23 LEU N N 23 115.988 115.988 118.682 -2.694 19998
2243 1 12 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.960 -0.062 19998
2244 1 12 . 1 1 23 23 LEU C C 23 173.712 173.712 175.634 -1.922 19998
2245 1 12 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.273 -0.190 19998
2246 1 12 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.896 0.166 19998
2247 1 12 . 1 1 23 23 LEU H H 23 7.111 7.111 7.544 -0.433 19998
2248 1 12 . 1 1 24 24 ALA N N 24 119.898 119.898 121.414 -1.516 19998
2249 1 12 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.586 -0.120 19998
2250 1 12 . 1 1 24 24 ALA C C 24 173.491 173.491 174.724 -1.233 19998
2251 1 12 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.775 -0.608 19998
2252 1 12 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.727 1.510 19998
2253 1 12 . 1 1 24 24 ALA H H 24 8.904 8.904 7.913 0.991 19998
2254 1 12 . 1 1 25 25 CYS N N 25 122.945 122.945 121.284 1.661 19998
2255 1 12 . 1 1 25 25 CYS HA H 25 4.452 4.452 4.954 -0.502 19998
2256 1 12 . 1 1 25 25 CYS C C 25 171.574 171.574 175.172 -3.598 19998
2257 1 12 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.628 -1.496 19998
2258 1 12 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.566 12.613 19998
2259 1 12 . 1 1 25 25 CYS H H 25 9.847 9.847 8.677 1.170 19998
2260 1 12 . 1 1 26 26 SER N N 26 122.285 122.285 124.037 -1.752 19998
2261 1 12 . 1 1 26 26 SER HA H 26 4.543 4.543 4.707 -0.164 19998
2262 1 12 . 1 1 26 26 SER CA C 26 57.773 57.773 56.914 0.859 19998
2263 1 12 . 1 1 26 26 SER CB C 26 63.789 63.789 65.583 -1.794 19998
2264 1 12 . 1 1 26 26 SER H H 26 7.791 7.791 8.415 -0.624 19998
2265 1 12 . 1 1 27 27 THR N N 27 122.390 122.390 121.566 0.824 19998
2266 1 12 . 1 1 27 27 THR HA H 27 3.778 3.778 4.218 -0.440 19998
2267 1 12 . 1 1 27 27 THR C C 27 172.781 172.781 175.038 -2.257 19998
2268 1 12 . 1 1 27 27 THR CA C 27 65.390 65.390 63.976 1.414 19998
2269 1 12 . 1 1 27 27 THR CB C 27 68.458 68.458 68.712 -0.254 19998
2270 1 12 . 1 1 27 27 THR H H 27 8.874 8.874 8.679 0.195 19998
2271 1 12 . 1 1 28 28 LYS N N 28 118.883 118.883 121.252 -2.369 19998
2272 1 12 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.279 -0.248 19998
2273 1 12 . 1 1 28 28 LYS C C 28 174.613 174.613 177.219 -2.606 19998
2274 1 12 . 1 1 28 28 LYS CA C 28 57.799 57.799 57.971 -0.172 19998
2275 1 12 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.261 0.903 19998
2276 1 12 . 1 1 28 28 LYS H H 28 7.609 7.609 8.163 -0.554 19998
2277 1 12 . 1 1 29 29 HIS N N 29 113.398 113.398 115.363 -1.965 19998
2278 1 12 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.639 -0.355 19998
2279 1 12 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.635 -0.049 19998
2280 1 12 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.848 -1.786 19998
2281 1 12 . 1 1 29 29 HIS H H 29 7.450 7.450 8.076 -0.626 19998
2282 1 12 . 1 1 30 30 LYS N N 30 116.344 116.344 118.961 -2.617 19998
2283 1 12 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.219 -0.331 19998
2284 1 12 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.356 0.144 19998
2285 1 12 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.672 -1.063 19998
2286 1 12 . 1 1 30 30 LYS H H 30 8.261 8.261 8.430 -0.169 19998
2287 1 12 . 1 1 31 31 TRP N N 31 117.766 117.766 114.901 2.865 19998
2288 1 12 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.004 0.473 19998
2289 1 12 . 1 1 31 31 TRP C C 31 174.754 174.754 174.350 0.404 19998
2290 1 12 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.282 1.474 19998
2291 1 12 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.770 1.206 19998
2292 1 12 . 1 1 31 31 TRP H H 31 8.483 8.483 7.705 0.778 19998
2293 1 12 . 1 1 32 32 CYS N N 32 118.984 118.984 123.133 -4.149 19998
2294 1 12 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.420 0.327 19998
2295 1 12 . 1 1 32 32 CYS C C 32 171.472 171.472 174.742 -3.270 19998
2296 1 12 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.213 -4.480 19998
2297 1 12 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.585 14.939 19998
2298 1 12 . 1 1 32 32 CYS H H 32 8.474 8.474 8.415 0.059 19998
2299 1 12 . 1 1 33 33 LYS N N 33 124.672 124.672 123.912 0.760 19998
2300 1 12 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.116 0.601 19998
2301 1 12 . 1 1 33 33 LYS C C 33 172.236 172.236 175.455 -3.219 19998
2302 1 12 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.086 0.644 19998
2303 1 12 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.970 1.459 19998
2304 1 12 . 1 1 33 33 LYS H H 33 9.027 9.027 8.268 0.759 19998
2305 1 12 . 1 1 34 34 TYR N N 34 120.102 120.102 122.724 -2.622 19998
2306 1 12 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.566 0.312 19998
2307 1 12 . 1 1 34 34 TYR C C 34 174.034 174.034 176.854 -2.820 19998
2308 1 12 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.491 0.771 19998
2309 1 12 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.862 0.771 19998
2310 1 12 . 1 1 34 34 TYR H H 34 8.092 8.092 8.689 -0.597 19998
2311 1 12 . 1 1 35 35 GLU N N 35 124.362 124.362 126.435 -2.073 19998
2312 1 12 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.332 0.130 19998
2313 1 12 . 1 1 35 35 GLU C C 35 172.127 172.127 175.370 -3.243 19998
2314 1 12 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.707 -0.440 19998
2315 1 12 . 1 1 35 35 GLU CB C 35 30.852 30.852 29.857 0.995 19998
2316 1 12 . 1 1 35 35 GLU H H 35 8.754 8.754 8.521 0.233 19998
2317 1 13 . 1 1 2 2 ALA N N 2 123.910 123.910 126.325 -2.415 19998
2318 1 13 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.927 -0.463 19998
2319 1 13 . 1 1 2 2 ALA C C 2 174.673 174.673 176.564 -1.891 19998
2320 1 13 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.271 -0.103 19998
2321 1 13 . 1 1 2 2 ALA CB C 2 19.690 19.690 19.143 0.547 19998
2322 1 13 . 1 1 2 2 ALA H H 2 8.561 8.561 8.230 0.331 19998
2323 1 13 . 1 1 3 3 CYS N N 3 117.207 117.207 118.850 -1.643 19998
2324 1 13 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.657 0.308 19998
2325 1 13 . 1 1 3 3 CYS C C 3 170.808 170.808 172.627 -1.819 19998
2326 1 13 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.349 -2.595 19998
2327 1 13 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.219 14.848 19998
2328 1 13 . 1 1 3 3 CYS H H 3 8.335 8.335 8.219 0.116 19998
2329 1 13 . 1 1 4 4 LEU N N 4 121.828 121.828 122.769 -0.941 19998
2330 1 13 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.625 -0.280 19998
2331 1 13 . 1 1 4 4 LEU C C 4 172.234 172.234 177.118 -4.884 19998
2332 1 13 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.057 0.166 19998
2333 1 13 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.999 0.579 19998
2334 1 13 . 1 1 4 4 LEU H H 4 8.815 8.815 8.389 0.426 19998
2335 1 13 . 1 1 5 5 GLY N N 5 107.508 107.508 110.172 -2.664 19998
2336 1 13 . 1 1 5 5 GLY C C 5 169.768 169.768 173.385 -3.617 19998
2337 1 13 . 1 1 5 5 GLY CA C 5 43.052 43.052 43.831 -0.779 19998
2338 1 13 . 1 1 5 5 GLY H H 5 7.999 7.999 8.331 -0.332 19998
2339 1 13 . 1 1 6 6 PHE N N 6 116.953 116.953 120.230 -3.277 19998
2340 1 13 . 1 1 6 6 PHE HA H 6 3.619 3.619 4.021 -0.402 19998
2341 1 13 . 1 1 6 6 PHE C C 6 174.967 174.967 176.737 -1.770 19998
2342 1 13 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.518 1.583 19998
2343 1 13 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.327 0.179 19998
2344 1 13 . 1 1 6 6 PHE H H 6 8.392 8.392 8.426 -0.034 19998
2345 1 13 . 1 1 7 7 GLY N N 7 115.074 115.074 115.167 -0.093 19998
2346 1 13 . 1 1 7 7 GLY C C 7 171.017 171.017 173.824 -2.807 19998
2347 1 13 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.843 0.001 19998
2348 1 13 . 1 1 7 7 GLY H H 7 8.645 8.645 7.410 1.235 19998
2349 1 13 . 1 1 8 8 LYS N N 8 120.051 120.051 120.470 -0.419 19998
2350 1 13 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.609 -0.296 19998
2351 1 13 . 1 1 8 8 LYS C C 8 173.878 173.878 176.022 -2.144 19998
2352 1 13 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.190 0.380 19998
2353 1 13 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.123 -1.732 19998
2354 1 13 . 1 1 8 8 LYS H H 8 7.429 7.429 7.381 0.048 19998
2355 1 13 . 1 1 9 9 SER N N 9 117.004 117.004 117.093 -0.089 19998
2356 1 13 . 1 1 9 9 SER HA H 9 4.315 4.315 4.682 -0.367 19998
2357 1 13 . 1 1 9 9 SER C C 9 170.486 170.486 174.272 -3.786 19998
2358 1 13 . 1 1 9 9 SER CB C 9 63.355 63.355 62.986 0.369 19998
2359 1 13 . 1 1 9 9 SER H H 9 8.542 8.542 8.508 0.034 19998
2360 1 13 . 1 1 10 10 CYS N N 10 119.238 119.238 121.469 -2.231 19998
2361 1 13 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.764 0.069 19998
2362 1 13 . 1 1 10 10 CYS C C 10 168.106 168.106 173.070 -4.964 19998
2363 1 13 . 1 1 10 10 CYS CA C 10 53.907 53.907 55.845 -1.938 19998
2364 1 13 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.147 15.694 19998
2365 1 13 . 1 1 10 10 CYS H H 10 8.188 8.188 8.382 -0.194 19998
2366 1 13 . 1 1 11 11 ASN N N 11 119.594 119.594 119.004 0.590 19998
2367 1 13 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.186 -0.062 19998
2368 1 13 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.791 -1.315 19998
2369 1 13 . 1 1 11 11 ASN CB C 11 40.000 40.000 41.165 -1.165 19998
2370 1 13 . 1 1 11 11 ASN H H 11 9.129 9.129 8.626 0.503 19998
2371 1 13 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.469 -0.621 19998
2372 1 13 . 1 1 12 12 PRO C C 12 174.197 174.197 178.151 -3.954 19998
2373 1 13 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.912 -0.223 19998
2374 1 13 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.170 -0.287 19998
2375 1 13 . 1 1 13 13 SER N N 13 110.351 110.351 112.602 -2.251 19998
2376 1 13 . 1 1 13 13 SER HA H 13 4.394 4.394 4.244 0.150 19998
2377 1 13 . 1 1 13 13 SER C C 13 170.980 170.980 174.117 -3.137 19998
2378 1 13 . 1 1 13 13 SER CA C 13 59.326 59.326 60.169 -0.843 19998
2379 1 13 . 1 1 13 13 SER CB C 13 63.380 63.380 63.064 0.316 19998
2380 1 13 . 1 1 13 13 SER H H 13 7.785 7.785 8.408 -0.623 19998
2381 1 13 . 1 1 14 14 ASN N N 14 120.660 120.660 117.660 3.000 19998
2382 1 13 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.792 -0.154 19998
2383 1 13 . 1 1 14 14 ASN C C 14 171.412 171.412 173.720 -2.308 19998
2384 1 13 . 1 1 14 14 ASN CA C 14 52.806 52.806 52.139 0.667 19998
2385 1 13 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.005 -1.196 19998
2386 1 13 . 1 1 14 14 ASN H H 14 7.613 7.613 7.896 -0.283 19998
2387 1 13 . 1 1 15 15 ASP N N 15 124.062 124.062 121.633 2.429 19998
2388 1 13 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.502 -0.392 19998
2389 1 13 . 1 1 15 15 ASP C C 15 174.918 174.918 175.620 -0.702 19998
2390 1 13 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.684 1.091 19998
2391 1 13 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.608 0.751 19998
2392 1 13 . 1 1 15 15 ASP H H 15 8.695 8.695 8.014 0.681 19998
2393 1 13 . 1 1 16 16 GLN N N 16 127.008 127.008 121.837 5.171 19998
2394 1 13 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.573 0.040 19998
2395 1 13 . 1 1 16 16 GLN C C 16 173.874 173.874 174.047 -0.173 19998
2396 1 13 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.737 -0.215 19998
2397 1 13 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.128 -0.801 19998
2398 1 13 . 1 1 16 16 GLN H H 16 8.041 8.041 8.622 -0.581 19998
2399 1 13 . 1 1 17 17 CYS N N 17 122.234 122.234 118.571 3.663 19998
2400 1 13 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.766 0.217 19998
2401 1 13 . 1 1 17 17 CYS C C 17 173.908 173.908 174.792 -0.884 19998
2402 1 13 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.636 -1.150 19998
2403 1 13 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.539 8.367 19998
2404 1 13 . 1 1 17 17 CYS H H 17 9.314 9.314 8.021 1.293 19998
2405 1 13 . 1 1 18 18 CYS N N 18 118.883 118.883 122.518 -3.635 19998
2406 1 13 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.533 0.075 19998
2407 1 13 . 1 1 18 18 CYS C C 18 172.722 172.722 175.973 -3.251 19998
2408 1 13 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.146 -3.625 19998
2409 1 13 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.332 15.035 19998
2410 1 13 . 1 1 18 18 CYS H H 18 9.192 9.192 8.607 0.585 19998
2411 1 13 . 1 1 19 19 LYS N N 19 131.730 131.730 127.181 4.549 19998
2412 1 13 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.098 0.234 19998
2413 1 13 . 1 1 19 19 LYS C C 19 177.997 177.997 179.094 -1.097 19998
2414 1 13 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.829 -0.403 19998
2415 1 13 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.244 -0.925 19998
2416 1 13 . 1 1 19 19 LYS H H 19 8.890 8.890 8.621 0.269 19998
2417 1 13 . 1 1 20 20 SER N N 20 115.887 115.887 114.932 0.955 19998
2418 1 13 . 1 1 20 20 SER HA H 20 4.334 4.334 4.287 0.047 19998
2419 1 13 . 1 1 20 20 SER C C 20 172.946 172.946 175.391 -2.445 19998
2420 1 13 . 1 1 20 20 SER CA C 20 60.311 60.311 60.579 -0.268 19998
2421 1 13 . 1 1 20 20 SER CB C 20 62.327 62.327 62.736 -0.409 19998
2422 1 13 . 1 1 20 20 SER H H 20 8.856 8.856 8.672 0.184 19998
2423 1 13 . 1 1 21 21 SER N N 21 116.191 116.191 115.569 0.622 19998
2424 1 13 . 1 1 21 21 SER HA H 21 4.833 4.833 4.597 0.236 19998
2425 1 13 . 1 1 21 21 SER C C 21 170.505 170.505 172.927 -2.422 19998
2426 1 13 . 1 1 21 21 SER CA C 21 57.500 57.500 58.320 -0.820 19998
2427 1 13 . 1 1 21 21 SER CB C 21 63.852 63.852 63.670 0.182 19998
2428 1 13 . 1 1 21 21 SER H H 21 7.068 7.068 7.595 -0.527 19998
2429 1 13 . 1 1 22 22 SER N N 22 111.723 111.723 115.792 -4.069 19998
2430 1 13 . 1 1 22 22 SER HA H 22 4.099 4.099 4.123 -0.024 19998
2431 1 13 . 1 1 22 22 SER C C 22 170.369 170.369 172.978 -2.609 19998
2432 1 13 . 1 1 22 22 SER CA C 22 59.140 59.140 59.854 -0.714 19998
2433 1 13 . 1 1 22 22 SER CB C 22 61.339 61.339 61.340 -0.001 19998
2434 1 13 . 1 1 22 22 SER H H 22 8.113 8.113 8.235 -0.122 19998
2435 1 13 . 1 1 23 23 LEU N N 23 115.988 115.988 119.466 -3.478 19998
2436 1 13 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.935 -0.037 19998
2437 1 13 . 1 1 23 23 LEU C C 23 173.712 173.712 175.489 -1.777 19998
2438 1 13 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.313 -0.230 19998
2439 1 13 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.495 0.567 19998
2440 1 13 . 1 1 23 23 LEU H H 23 7.111 7.111 7.618 -0.507 19998
2441 1 13 . 1 1 24 24 ALA N N 24 119.898 119.898 120.988 -1.090 19998
2442 1 13 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.657 -0.191 19998
2443 1 13 . 1 1 24 24 ALA C C 24 173.491 173.491 174.727 -1.236 19998
2444 1 13 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.756 -0.589 19998
2445 1 13 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.683 1.554 19998
2446 1 13 . 1 1 24 24 ALA H H 24 8.904 8.904 7.800 1.104 19998
2447 1 13 . 1 1 25 25 CYS N N 25 122.945 122.945 121.526 1.419 19998
2448 1 13 . 1 1 25 25 CYS HA H 25 4.452 4.452 5.057 -0.605 19998
2449 1 13 . 1 1 25 25 CYS C C 25 171.574 171.574 175.115 -3.541 19998
2450 1 13 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.758 -1.626 19998
2451 1 13 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.512 12.667 19998
2452 1 13 . 1 1 25 25 CYS H H 25 9.847 9.847 8.639 1.208 19998
2453 1 13 . 1 1 26 26 SER N N 26 122.285 122.285 122.923 -0.638 19998
2454 1 13 . 1 1 26 26 SER HA H 26 4.543 4.543 4.779 -0.236 19998
2455 1 13 . 1 1 26 26 SER CA C 26 57.773 57.773 57.731 0.042 19998
2456 1 13 . 1 1 26 26 SER CB C 26 63.789 63.789 65.418 -1.629 19998
2457 1 13 . 1 1 26 26 SER H H 26 7.791 7.791 8.312 -0.521 19998
2458 1 13 . 1 1 27 27 THR N N 27 122.390 122.390 120.884 1.506 19998
2459 1 13 . 1 1 27 27 THR HA H 27 3.778 3.778 4.236 -0.458 19998
2460 1 13 . 1 1 27 27 THR C C 27 172.781 172.781 175.010 -2.229 19998
2461 1 13 . 1 1 27 27 THR CA C 27 65.390 65.390 64.397 0.993 19998
2462 1 13 . 1 1 27 27 THR CB C 27 68.458 68.458 68.823 -0.365 19998
2463 1 13 . 1 1 27 27 THR H H 27 8.874 8.874 8.673 0.201 19998
2464 1 13 . 1 1 28 28 LYS N N 28 118.883 118.883 121.559 -2.676 19998
2465 1 13 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.135 -0.104 19998
2466 1 13 . 1 1 28 28 LYS C C 28 174.613 174.613 176.731 -2.118 19998
2467 1 13 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.416 -0.617 19998
2468 1 13 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.219 0.945 19998
2469 1 13 . 1 1 28 28 LYS H H 28 7.609 7.609 8.007 -0.398 19998
2470 1 13 . 1 1 29 29 HIS N N 29 113.398 113.398 114.957 -1.559 19998
2471 1 13 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.599 -0.315 19998
2472 1 13 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.692 -0.106 19998
2473 1 13 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.729 -1.667 19998
2474 1 13 . 1 1 29 29 HIS H H 29 7.450 7.450 8.021 -0.571 19998
2475 1 13 . 1 1 30 30 LYS N N 30 116.344 116.344 118.994 -2.650 19998
2476 1 13 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.215 -0.327 19998
2477 1 13 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.334 0.166 19998
2478 1 13 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.651 -1.042 19998
2479 1 13 . 1 1 30 30 LYS H H 30 8.261 8.261 8.421 -0.161 19998
2480 1 13 . 1 1 31 31 TRP N N 31 117.766 117.766 114.958 2.808 19998
2481 1 13 . 1 1 31 31 TRP HA H 31 5.477 5.477 4.934 0.543 19998
2482 1 13 . 1 1 31 31 TRP C C 31 174.754 174.754 174.182 0.572 19998
2483 1 13 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.321 1.435 19998
2484 1 13 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.847 1.129 19998
2485 1 13 . 1 1 31 31 TRP H H 31 8.483 8.483 7.746 0.737 19998
2486 1 13 . 1 1 32 32 CYS N N 32 118.984 118.984 122.751 -3.767 19998
2487 1 13 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.365 0.382 19998
2488 1 13 . 1 1 32 32 CYS C C 32 171.472 171.472 174.651 -3.179 19998
2489 1 13 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.057 -4.324 19998
2490 1 13 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.638 14.886 19998
2491 1 13 . 1 1 32 32 CYS H H 32 8.474 8.474 8.388 0.086 19998
2492 1 13 . 1 1 33 33 LYS N N 33 124.672 124.672 123.834 0.838 19998
2493 1 13 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.102 0.615 19998
2494 1 13 . 1 1 33 33 LYS C C 33 172.236 172.236 175.443 -3.207 19998
2495 1 13 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.115 0.614 19998
2496 1 13 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.908 1.521 19998
2497 1 13 . 1 1 33 33 LYS H H 33 9.027 9.027 8.334 0.693 19998
2498 1 13 . 1 1 34 34 TYR N N 34 120.102 120.102 122.327 -2.225 19998
2499 1 13 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.622 0.256 19998
2500 1 13 . 1 1 34 34 TYR C C 34 174.034 174.034 176.781 -2.747 19998
2501 1 13 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.804 0.458 19998
2502 1 13 . 1 1 34 34 TYR CB C 34 38.633 38.633 38.096 0.536 19998
2503 1 13 . 1 1 34 34 TYR H H 34 8.092 8.092 8.666 -0.574 19998
2504 1 13 . 1 1 35 35 GLU N N 35 124.362 124.362 125.663 -1.301 19998
2505 1 13 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.471 -0.009 19998
2506 1 13 . 1 1 35 35 GLU C C 35 172.127 172.127 175.116 -2.989 19998
2507 1 13 . 1 1 35 35 GLU CA C 35 56.267 56.267 55.852 0.415 19998
2508 1 13 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.166 0.686 19998
2509 1 13 . 1 1 35 35 GLU H H 35 8.754 8.754 8.454 0.300 19998
2510 1 14 . 1 1 2 2 ALA N N 2 123.910 123.910 123.815 0.095 19998
2511 1 14 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.723 -0.259 19998
2512 1 14 . 1 1 2 2 ALA C C 2 174.673 174.673 176.116 -1.443 19998
2513 1 14 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.071 0.097 19998
2514 1 14 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.242 1.448 19998
2515 1 14 . 1 1 2 2 ALA H H 2 8.561 8.561 8.191 0.370 19998
2516 1 14 . 1 1 3 3 CYS N N 3 117.207 117.207 118.865 -1.658 19998
2517 1 14 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.685 0.280 19998
2518 1 14 . 1 1 3 3 CYS C C 3 170.808 170.808 172.422 -1.614 19998
2519 1 14 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.537 -2.783 19998
2520 1 14 . 1 1 3 3 CYS CB C 3 44.067 44.067 28.977 15.090 19998
2521 1 14 . 1 1 3 3 CYS H H 3 8.335 8.335 8.283 0.052 19998
2522 1 14 . 1 1 4 4 LEU N N 4 121.828 121.828 122.500 -0.672 19998
2523 1 14 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.609 -0.264 19998
2524 1 14 . 1 1 4 4 LEU C C 4 172.234 172.234 177.280 -5.046 19998
2525 1 14 . 1 1 4 4 LEU CA C 4 54.223 54.223 53.883 0.340 19998
2526 1 14 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.999 0.579 19998
2527 1 14 . 1 1 4 4 LEU H H 4 8.815 8.815 8.296 0.519 19998
2528 1 14 . 1 1 5 5 GLY N N 5 107.508 107.508 110.448 -2.940 19998
2529 1 14 . 1 1 5 5 GLY C C 5 169.768 169.768 173.432 -3.664 19998
2530 1 14 . 1 1 5 5 GLY CA C 5 43.052 43.052 44.050 -0.998 19998
2531 1 14 . 1 1 5 5 GLY H H 5 7.999 7.999 8.316 -0.318 19998
2532 1 14 . 1 1 6 6 PHE N N 6 116.953 116.953 120.573 -3.620 19998
2533 1 14 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.981 -0.362 19998
2534 1 14 . 1 1 6 6 PHE C C 6 174.967 174.967 176.786 -1.819 19998
2535 1 14 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.909 1.192 19998
2536 1 14 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.076 0.430 19998
2537 1 14 . 1 1 6 6 PHE H H 6 8.392 8.392 8.478 -0.086 19998
2538 1 14 . 1 1 7 7 GLY N N 7 115.074 115.074 115.088 -0.014 19998
2539 1 14 . 1 1 7 7 GLY C C 7 171.017 171.017 173.874 -2.857 19998
2540 1 14 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.821 0.023 19998
2541 1 14 . 1 1 7 7 GLY H H 7 8.645 8.645 7.388 1.257 19998
2542 1 14 . 1 1 8 8 LYS N N 8 120.051 120.051 120.599 -0.548 19998
2543 1 14 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.593 -0.280 19998
2544 1 14 . 1 1 8 8 LYS C C 8 173.878 173.878 175.962 -2.084 19998
2545 1 14 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.228 0.342 19998
2546 1 14 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.113 -1.722 19998
2547 1 14 . 1 1 8 8 LYS H H 8 7.429 7.429 7.355 0.074 19998
2548 1 14 . 1 1 9 9 SER N N 9 117.004 117.004 117.103 -0.099 19998
2549 1 14 . 1 1 9 9 SER HA H 9 4.315 4.315 4.610 -0.295 19998
2550 1 14 . 1 1 9 9 SER C C 9 170.486 170.486 174.395 -3.909 19998
2551 1 14 . 1 1 9 9 SER CB C 9 63.355 63.355 62.998 0.357 19998
2552 1 14 . 1 1 9 9 SER H H 9 8.542 8.542 8.504 0.038 19998
2553 1 14 . 1 1 10 10 CYS N N 10 119.238 119.238 121.689 -2.451 19998
2554 1 14 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.728 0.105 19998
2555 1 14 . 1 1 10 10 CYS C C 10 168.106 168.106 173.080 -4.974 19998
2556 1 14 . 1 1 10 10 CYS CA C 10 53.907 53.907 55.836 -1.929 19998
2557 1 14 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.264 15.577 19998
2558 1 14 . 1 1 10 10 CYS H H 10 8.188 8.188 8.273 -0.085 19998
2559 1 14 . 1 1 11 11 ASN N N 11 119.594 119.594 119.056 0.538 19998
2560 1 14 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.194 -0.070 19998
2561 1 14 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.752 -1.276 19998
2562 1 14 . 1 1 11 11 ASN CB C 11 40.000 40.000 41.095 -1.095 19998
2563 1 14 . 1 1 11 11 ASN H H 11 9.129 9.129 8.624 0.505 19998
2564 1 14 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.432 -0.584 19998
2565 1 14 . 1 1 12 12 PRO C C 12 174.197 174.197 178.207 -4.010 19998
2566 1 14 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.660 0.029 19998
2567 1 14 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.166 -0.283 19998
2568 1 14 . 1 1 13 13 SER N N 13 110.351 110.351 113.043 -2.692 19998
2569 1 14 . 1 1 13 13 SER HA H 13 4.394 4.394 4.263 0.131 19998
2570 1 14 . 1 1 13 13 SER C C 13 170.980 170.980 174.139 -3.159 19998
2571 1 14 . 1 1 13 13 SER CA C 13 59.326 59.326 59.941 -0.615 19998
2572 1 14 . 1 1 13 13 SER CB C 13 63.380 63.380 62.980 0.400 19998
2573 1 14 . 1 1 13 13 SER H H 13 7.785 7.785 8.454 -0.669 19998
2574 1 14 . 1 1 14 14 ASN N N 14 120.660 120.660 118.920 1.740 19998
2575 1 14 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.863 -0.225 19998
2576 1 14 . 1 1 14 14 ASN C C 14 171.412 171.412 173.292 -1.880 19998
2577 1 14 . 1 1 14 14 ASN CA C 14 52.806 52.806 52.195 0.611 19998
2578 1 14 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.757 -1.947 19998
2579 1 14 . 1 1 14 14 ASN H H 14 7.613 7.613 7.650 -0.037 19998
2580 1 14 . 1 1 15 15 ASP N N 15 124.062 124.062 122.216 1.846 19998
2581 1 14 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.518 -0.408 19998
2582 1 14 . 1 1 15 15 ASP C C 15 174.918 174.918 175.402 -0.484 19998
2583 1 14 . 1 1 15 15 ASP CA C 15 55.774 55.774 55.164 0.610 19998
2584 1 14 . 1 1 15 15 ASP CB C 15 41.360 41.360 41.238 0.122 19998
2585 1 14 . 1 1 15 15 ASP H H 15 8.695 8.695 8.214 0.481 19998
2586 1 14 . 1 1 16 16 GLN N N 16 127.008 127.008 124.342 2.666 19998
2587 1 14 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.502 0.111 19998
2588 1 14 . 1 1 16 16 GLN C C 16 173.874 173.874 174.294 -0.420 19998
2589 1 14 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.815 -0.293 19998
2590 1 14 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.462 -1.135 19998
2591 1 14 . 1 1 16 16 GLN H H 16 8.041 8.041 8.523 -0.482 19998
2592 1 14 . 1 1 17 17 CYS N N 17 122.234 122.234 118.598 3.636 19998
2593 1 14 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.805 0.178 19998
2594 1 14 . 1 1 17 17 CYS C C 17 173.908 173.908 174.803 -0.895 19998
2595 1 14 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.728 -1.242 19998
2596 1 14 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.838 8.068 19998
2597 1 14 . 1 1 17 17 CYS H H 17 9.314 9.314 8.009 1.305 19998
2598 1 14 . 1 1 18 18 CYS N N 18 118.883 118.883 122.613 -3.730 19998
2599 1 14 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.533 0.075 19998
2600 1 14 . 1 1 18 18 CYS C C 18 172.722 172.722 176.022 -3.300 19998
2601 1 14 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.060 -3.539 19998
2602 1 14 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.075 15.292 19998
2603 1 14 . 1 1 18 18 CYS H H 18 9.192 9.192 8.569 0.623 19998
2604 1 14 . 1 1 19 19 LYS N N 19 131.730 131.730 126.933 4.797 19998
2605 1 14 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.084 0.248 19998
2606 1 14 . 1 1 19 19 LYS C C 19 177.997 177.997 178.843 -0.846 19998
2607 1 14 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.827 -0.401 19998
2608 1 14 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.173 -0.854 19998
2609 1 14 . 1 1 19 19 LYS H H 19 8.890 8.890 8.507 0.383 19998
2610 1 14 . 1 1 20 20 SER N N 20 115.887 115.887 114.717 1.170 19998
2611 1 14 . 1 1 20 20 SER HA H 20 4.334 4.334 4.273 0.061 19998
2612 1 14 . 1 1 20 20 SER C C 20 172.946 172.946 175.771 -2.825 19998
2613 1 14 . 1 1 20 20 SER CA C 20 60.311 60.311 60.787 -0.476 19998
2614 1 14 . 1 1 20 20 SER CB C 20 62.327 62.327 62.490 -0.163 19998
2615 1 14 . 1 1 20 20 SER H H 20 8.856 8.856 8.467 0.389 19998
2616 1 14 . 1 1 21 21 SER N N 21 116.191 116.191 116.091 0.100 19998
2617 1 14 . 1 1 21 21 SER HA H 21 4.833 4.833 4.608 0.225 19998
2618 1 14 . 1 1 21 21 SER C C 21 170.505 170.505 173.010 -2.505 19998
2619 1 14 . 1 1 21 21 SER CA C 21 57.500 57.500 57.888 -0.388 19998
2620 1 14 . 1 1 21 21 SER CB C 21 63.852 63.852 63.615 0.236 19998
2621 1 14 . 1 1 21 21 SER H H 21 7.068 7.068 7.509 -0.441 19998
2622 1 14 . 1 1 22 22 SER N N 22 111.723 111.723 117.211 -5.488 19998
2623 1 14 . 1 1 22 22 SER HA H 22 4.099 4.099 4.128 -0.029 19998
2624 1 14 . 1 1 22 22 SER C C 22 170.369 170.369 172.848 -2.479 19998
2625 1 14 . 1 1 22 22 SER CA C 22 59.140 59.140 59.446 -0.306 19998
2626 1 14 . 1 1 22 22 SER CB C 22 61.339 61.339 61.945 -0.606 19998
2627 1 14 . 1 1 22 22 SER H H 22 8.113 8.113 8.203 -0.090 19998
2628 1 14 . 1 1 23 23 LEU N N 23 115.988 115.988 120.211 -4.223 19998
2629 1 14 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.922 -0.024 19998
2630 1 14 . 1 1 23 23 LEU C C 23 173.712 173.712 175.400 -1.688 19998
2631 1 14 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.371 -0.288 19998
2632 1 14 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.369 0.693 19998
2633 1 14 . 1 1 23 23 LEU H H 23 7.111 7.111 7.548 -0.437 19998
2634 1 14 . 1 1 24 24 ALA N N 24 119.898 119.898 119.878 0.020 19998
2635 1 14 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.707 -0.241 19998
2636 1 14 . 1 1 24 24 ALA C C 24 173.491 173.491 174.733 -1.242 19998
2637 1 14 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.514 -0.347 19998
2638 1 14 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.788 1.449 19998
2639 1 14 . 1 1 24 24 ALA H H 24 8.904 8.904 7.845 1.059 19998
2640 1 14 . 1 1 25 25 CYS N N 25 122.945 122.945 121.241 1.704 19998
2641 1 14 . 1 1 25 25 CYS HA H 25 4.452 4.452 4.999 -0.547 19998
2642 1 14 . 1 1 25 25 CYS C C 25 171.574 171.574 174.979 -3.405 19998
2643 1 14 . 1 1 25 25 CYS CA C 25 56.132 56.132 58.276 -2.144 19998
2644 1 14 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.525 12.654 19998
2645 1 14 . 1 1 25 25 CYS H H 25 9.847 9.847 8.437 1.410 19998
2646 1 14 . 1 1 26 26 SER N N 26 122.285 122.285 123.211 -0.926 19998
2647 1 14 . 1 1 26 26 SER HA H 26 4.543 4.543 4.741 -0.198 19998
2648 1 14 . 1 1 26 26 SER CA C 26 57.773 57.773 57.139 0.634 19998
2649 1 14 . 1 1 26 26 SER CB C 26 63.789 63.789 65.553 -1.764 19998
2650 1 14 . 1 1 26 26 SER H H 26 7.791 7.791 8.382 -0.591 19998
2651 1 14 . 1 1 27 27 THR N N 27 122.390 122.390 120.063 2.327 19998
2652 1 14 . 1 1 27 27 THR HA H 27 3.778 3.778 4.261 -0.483 19998
2653 1 14 . 1 1 27 27 THR C C 27 172.781 172.781 175.200 -2.419 19998
2654 1 14 . 1 1 27 27 THR CA C 27 65.390 65.390 64.345 1.045 19998
2655 1 14 . 1 1 27 27 THR CB C 27 68.458 68.458 68.773 -0.315 19998
2656 1 14 . 1 1 27 27 THR H H 27 8.874 8.874 8.698 0.176 19998
2657 1 14 . 1 1 28 28 LYS N N 28 118.883 118.883 120.992 -2.109 19998
2658 1 14 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.151 -0.120 19998
2659 1 14 . 1 1 28 28 LYS C C 28 174.613 174.613 176.908 -2.295 19998
2660 1 14 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.596 -0.797 19998
2661 1 14 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.541 0.623 19998
2662 1 14 . 1 1 28 28 LYS H H 28 7.609 7.609 7.993 -0.384 19998
2663 1 14 . 1 1 29 29 HIS N N 29 113.398 113.398 114.778 -1.380 19998
2664 1 14 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.633 -0.349 19998
2665 1 14 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.406 0.180 19998
2666 1 14 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.655 -1.593 19998
2667 1 14 . 1 1 29 29 HIS H H 29 7.450 7.450 8.002 -0.552 19998
2668 1 14 . 1 1 30 30 LYS N N 30 116.344 116.344 119.075 -2.731 19998
2669 1 14 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.218 -0.330 19998
2670 1 14 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.352 0.148 19998
2671 1 14 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.643 -1.034 19998
2672 1 14 . 1 1 30 30 LYS H H 30 8.261 8.261 8.434 -0.173 19998
2673 1 14 . 1 1 31 31 TRP N N 31 117.766 117.766 114.901 2.865 19998
2674 1 14 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.018 0.459 19998
2675 1 14 . 1 1 31 31 TRP C C 31 174.754 174.754 174.406 0.348 19998
2676 1 14 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.222 1.534 19998
2677 1 14 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.811 1.165 19998
2678 1 14 . 1 1 31 31 TRP H H 31 8.483 8.483 7.752 0.731 19998
2679 1 14 . 1 1 32 32 CYS N N 32 118.984 118.984 123.014 -4.030 19998
2680 1 14 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.316 0.431 19998
2681 1 14 . 1 1 32 32 CYS C C 32 171.472 171.472 174.748 -3.276 19998
2682 1 14 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.194 -4.461 19998
2683 1 14 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.575 14.949 19998
2684 1 14 . 1 1 32 32 CYS H H 32 8.474 8.474 8.415 0.059 19998
2685 1 14 . 1 1 33 33 LYS N N 33 124.672 124.672 123.886 0.786 19998
2686 1 14 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.137 0.580 19998
2687 1 14 . 1 1 33 33 LYS C C 33 172.236 172.236 175.488 -3.252 19998
2688 1 14 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.126 0.604 19998
2689 1 14 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.881 1.548 19998
2690 1 14 . 1 1 33 33 LYS H H 33 9.027 9.027 8.312 0.715 19998
2691 1 14 . 1 1 34 34 TYR N N 34 120.102 120.102 123.316 -3.214 19998
2692 1 14 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.568 0.310 19998
2693 1 14 . 1 1 34 34 TYR C C 34 174.034 174.034 176.786 -2.752 19998
2694 1 14 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.924 0.338 19998
2695 1 14 . 1 1 34 34 TYR CB C 34 38.633 38.633 38.026 0.607 19998
2696 1 14 . 1 1 34 34 TYR H H 34 8.092 8.092 8.771 -0.679 19998
2697 1 14 . 1 1 35 35 GLU N N 35 124.362 124.362 125.721 -1.359 19998
2698 1 14 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.439 0.023 19998
2699 1 14 . 1 1 35 35 GLU C C 35 172.127 172.127 175.687 -3.560 19998
2700 1 14 . 1 1 35 35 GLU CA C 35 56.267 56.267 55.892 0.375 19998
2701 1 14 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.120 0.732 19998
2702 1 14 . 1 1 35 35 GLU H H 35 8.754 8.754 8.492 0.262 19998
2703 1 15 . 1 1 2 2 ALA N N 2 123.910 123.910 123.198 0.712 19998
2704 1 15 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.687 -0.223 19998
2705 1 15 . 1 1 2 2 ALA C C 2 174.673 174.673 176.011 -1.338 19998
2706 1 15 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.205 -0.037 19998
2707 1 15 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.766 0.924 19998
2708 1 15 . 1 1 2 2 ALA H H 2 8.561 8.561 8.132 0.429 19998
2709 1 15 . 1 1 3 3 CYS N N 3 117.207 117.207 118.911 -1.704 19998
2710 1 15 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.662 0.303 19998
2711 1 15 . 1 1 3 3 CYS C C 3 170.808 170.808 172.812 -2.004 19998
2712 1 15 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.140 -2.386 19998
2713 1 15 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.380 14.687 19998
2714 1 15 . 1 1 3 3 CYS H H 3 8.335 8.335 8.154 0.181 19998
2715 1 15 . 1 1 4 4 LEU N N 4 121.828 121.828 122.877 -1.049 19998
2716 1 15 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.607 -0.262 19998
2717 1 15 . 1 1 4 4 LEU C C 4 172.234 172.234 177.213 -4.979 19998
2718 1 15 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.054 0.168 19998
2719 1 15 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.510 1.068 19998
2720 1 15 . 1 1 4 4 LEU H H 4 8.815 8.815 8.425 0.390 19998
2721 1 15 . 1 1 5 5 GLY N N 5 107.508 107.508 110.457 -2.949 19998
2722 1 15 . 1 1 5 5 GLY C C 5 169.768 169.768 173.399 -3.631 19998
2723 1 15 . 1 1 5 5 GLY CA C 5 43.052 43.052 43.968 -0.916 19998
2724 1 15 . 1 1 5 5 GLY H H 5 7.999 7.999 8.302 -0.303 19998
2725 1 15 . 1 1 6 6 PHE N N 6 116.953 116.953 120.055 -3.102 19998
2726 1 15 . 1 1 6 6 PHE HA H 6 3.619 3.619 4.002 -0.383 19998
2727 1 15 . 1 1 6 6 PHE C C 6 174.967 174.967 177.062 -2.095 19998
2728 1 15 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.595 1.506 19998
2729 1 15 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.337 0.168 19998
2730 1 15 . 1 1 6 6 PHE H H 6 8.392 8.392 8.364 0.028 19998
2731 1 15 . 1 1 7 7 GLY N N 7 115.074 115.074 115.424 -0.350 19998
2732 1 15 . 1 1 7 7 GLY C C 7 171.017 171.017 173.675 -2.658 19998
2733 1 15 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.876 -0.032 19998
2734 1 15 . 1 1 7 7 GLY H H 7 8.645 8.645 7.501 1.144 19998
2735 1 15 . 1 1 8 8 LYS N N 8 120.051 120.051 120.531 -0.480 19998
2736 1 15 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.614 -0.301 19998
2737 1 15 . 1 1 8 8 LYS C C 8 173.878 173.878 176.012 -2.134 19998
2738 1 15 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.125 0.445 19998
2739 1 15 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.149 -1.758 19998
2740 1 15 . 1 1 8 8 LYS H H 8 7.429 7.429 7.365 0.064 19998
2741 1 15 . 1 1 9 9 SER N N 9 117.004 117.004 117.457 -0.453 19998
2742 1 15 . 1 1 9 9 SER HA H 9 4.315 4.315 4.659 -0.344 19998
2743 1 15 . 1 1 9 9 SER C C 9 170.486 170.486 174.299 -3.813 19998
2744 1 15 . 1 1 9 9 SER CB C 9 63.355 63.355 62.909 0.446 19998
2745 1 15 . 1 1 9 9 SER H H 9 8.542 8.542 8.521 0.021 19998
2746 1 15 . 1 1 10 10 CYS N N 10 119.238 119.238 121.507 -2.269 19998
2747 1 15 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.778 0.055 19998
2748 1 15 . 1 1 10 10 CYS C C 10 168.106 168.106 173.663 -5.557 19998
2749 1 15 . 1 1 10 10 CYS CA C 10 53.907 53.907 55.996 -2.089 19998
2750 1 15 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.275 15.566 19998
2751 1 15 . 1 1 10 10 CYS H H 10 8.188 8.188 8.567 -0.379 19998
2752 1 15 . 1 1 11 11 ASN N N 11 119.594 119.594 119.032 0.562 19998
2753 1 15 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.202 -0.078 19998
2754 1 15 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.526 -1.050 19998
2755 1 15 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.191 -0.192 19998
2756 1 15 . 1 1 11 11 ASN H H 11 9.129 9.129 8.618 0.511 19998
2757 1 15 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.470 -0.622 19998
2758 1 15 . 1 1 12 12 PRO C C 12 174.197 174.197 178.414 -4.217 19998
2759 1 15 . 1 1 12 12 PRO CA C 12 64.689 64.689 65.050 -0.361 19998
2760 1 15 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.245 -0.362 19998
2761 1 15 . 1 1 13 13 SER N N 13 110.351 110.351 112.390 -2.039 19998
2762 1 15 . 1 1 13 13 SER HA H 13 4.394 4.394 4.253 0.141 19998
2763 1 15 . 1 1 13 13 SER C C 13 170.980 170.980 174.037 -3.057 19998
2764 1 15 . 1 1 13 13 SER CA C 13 59.326 59.326 60.093 -0.767 19998
2765 1 15 . 1 1 13 13 SER CB C 13 63.380 63.380 63.110 0.270 19998
2766 1 15 . 1 1 13 13 SER H H 13 7.785 7.785 8.409 -0.624 19998
2767 1 15 . 1 1 14 14 ASN N N 14 120.660 120.660 117.826 2.834 19998
2768 1 15 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.885 -0.247 19998
2769 1 15 . 1 1 14 14 ASN C C 14 171.412 171.412 173.511 -2.099 19998
2770 1 15 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.694 1.112 19998
2771 1 15 . 1 1 14 14 ASN CB C 14 37.810 37.810 38.874 -1.065 19998
2772 1 15 . 1 1 14 14 ASN H H 14 7.613 7.613 7.799 -0.186 19998
2773 1 15 . 1 1 15 15 ASP N N 15 124.062 124.062 121.046 3.016 19998
2774 1 15 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.508 -0.398 19998
2775 1 15 . 1 1 15 15 ASP C C 15 174.918 174.918 175.657 -0.739 19998
2776 1 15 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.697 1.077 19998
2777 1 15 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.744 0.616 19998
2778 1 15 . 1 1 15 15 ASP H H 15 8.695 8.695 7.982 0.713 19998
2779 1 15 . 1 1 16 16 GLN N N 16 127.008 127.008 122.032 4.976 19998
2780 1 15 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.631 -0.018 19998
2781 1 15 . 1 1 16 16 GLN C C 16 173.874 173.874 174.115 -0.241 19998
2782 1 15 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.840 -0.318 19998
2783 1 15 . 1 1 16 16 GLN CB C 16 28.327 28.327 28.902 -0.576 19998
2784 1 15 . 1 1 16 16 GLN H H 16 8.041 8.041 8.626 -0.585 19998
2785 1 15 . 1 1 17 17 CYS N N 17 122.234 122.234 118.142 4.092 19998
2786 1 15 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.855 0.128 19998
2787 1 15 . 1 1 17 17 CYS C C 17 173.908 173.908 174.654 -0.746 19998
2788 1 15 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.878 -1.392 19998
2789 1 15 . 1 1 17 17 CYS CB C 17 38.906 38.906 31.086 7.820 19998
2790 1 15 . 1 1 17 17 CYS H H 17 9.314 9.314 8.091 1.223 19998
2791 1 15 . 1 1 18 18 CYS N N 18 118.883 118.883 122.382 -3.499 19998
2792 1 15 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.555 0.053 19998
2793 1 15 . 1 1 18 18 CYS C C 18 172.722 172.722 176.142 -3.420 19998
2794 1 15 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.136 -3.615 19998
2795 1 15 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.164 15.203 19998
2796 1 15 . 1 1 18 18 CYS H H 18 9.192 9.192 8.516 0.676 19998
2797 1 15 . 1 1 19 19 LYS N N 19 131.730 131.730 127.200 4.530 19998
2798 1 15 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.076 0.256 19998
2799 1 15 . 1 1 19 19 LYS C C 19 177.997 177.997 179.016 -1.019 19998
2800 1 15 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.832 -0.406 19998
2801 1 15 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.136 -0.817 19998
2802 1 15 . 1 1 19 19 LYS H H 19 8.890 8.890 8.575 0.315 19998
2803 1 15 . 1 1 20 20 SER N N 20 115.887 115.887 115.234 0.653 19998
2804 1 15 . 1 1 20 20 SER HA H 20 4.334 4.334 4.264 0.070 19998
2805 1 15 . 1 1 20 20 SER C C 20 172.946 172.946 175.766 -2.820 19998
2806 1 15 . 1 1 20 20 SER CA C 20 60.311 60.311 60.703 -0.392 19998
2807 1 15 . 1 1 20 20 SER CB C 20 62.327 62.327 62.815 -0.488 19998
2808 1 15 . 1 1 20 20 SER H H 20 8.856 8.856 8.311 0.545 19998
2809 1 15 . 1 1 21 21 SER N N 21 116.191 116.191 115.438 0.753 19998
2810 1 15 . 1 1 21 21 SER HA H 21 4.833 4.833 4.540 0.293 19998
2811 1 15 . 1 1 21 21 SER C C 21 170.505 170.505 173.054 -2.549 19998
2812 1 15 . 1 1 21 21 SER CA C 21 57.500 57.500 57.765 -0.265 19998
2813 1 15 . 1 1 21 21 SER CB C 21 63.852 63.852 63.586 0.266 19998
2814 1 15 . 1 1 21 21 SER H H 21 7.068 7.068 7.488 -0.420 19998
2815 1 15 . 1 1 22 22 SER N N 22 111.723 111.723 116.456 -4.733 19998
2816 1 15 . 1 1 22 22 SER HA H 22 4.099 4.099 4.133 -0.034 19998
2817 1 15 . 1 1 22 22 SER C C 22 170.369 170.369 173.230 -2.861 19998
2818 1 15 . 1 1 22 22 SER CA C 22 59.140 59.140 59.434 -0.294 19998
2819 1 15 . 1 1 22 22 SER CB C 22 61.339 61.339 61.949 -0.610 19998
2820 1 15 . 1 1 22 22 SER H H 22 8.113 8.113 8.105 0.008 19998
2821 1 15 . 1 1 23 23 LEU N N 23 115.988 115.988 119.161 -3.173 19998
2822 1 15 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.889 0.009 19998
2823 1 15 . 1 1 23 23 LEU C C 23 173.712 173.712 175.613 -1.901 19998
2824 1 15 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.410 -0.327 19998
2825 1 15 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.299 0.763 19998
2826 1 15 . 1 1 23 23 LEU H H 23 7.111 7.111 7.581 -0.470 19998
2827 1 15 . 1 1 24 24 ALA N N 24 119.898 119.898 120.910 -1.012 19998
2828 1 15 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.648 -0.182 19998
2829 1 15 . 1 1 24 24 ALA C C 24 173.491 173.491 174.731 -1.240 19998
2830 1 15 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.745 -0.578 19998
2831 1 15 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.614 1.623 19998
2832 1 15 . 1 1 24 24 ALA H H 24 8.904 8.904 7.777 1.127 19998
2833 1 15 . 1 1 25 25 CYS N N 25 122.945 122.945 121.388 1.557 19998
2834 1 15 . 1 1 25 25 CYS HA H 25 4.452 4.452 4.992 -0.540 19998
2835 1 15 . 1 1 25 25 CYS C C 25 171.574 171.574 174.957 -3.383 19998
2836 1 15 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.819 -1.687 19998
2837 1 15 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.654 12.525 19998
2838 1 15 . 1 1 25 25 CYS H H 25 9.847 9.847 8.622 1.225 19998
2839 1 15 . 1 1 26 26 SER N N 26 122.285 122.285 123.220 -0.935 19998
2840 1 15 . 1 1 26 26 SER HA H 26 4.543 4.543 4.724 -0.181 19998
2841 1 15 . 1 1 26 26 SER CA C 26 57.773 57.773 57.375 0.398 19998
2842 1 15 . 1 1 26 26 SER CB C 26 63.789 63.789 65.436 -1.647 19998
2843 1 15 . 1 1 26 26 SER H H 26 7.791 7.791 8.395 -0.604 19998
2844 1 15 . 1 1 27 27 THR N N 27 122.390 122.390 120.000 2.390 19998
2845 1 15 . 1 1 27 27 THR HA H 27 3.778 3.778 4.229 -0.451 19998
2846 1 15 . 1 1 27 27 THR C C 27 172.781 172.781 175.151 -2.370 19998
2847 1 15 . 1 1 27 27 THR CA C 27 65.390 65.390 64.125 1.265 19998
2848 1 15 . 1 1 27 27 THR CB C 27 68.458 68.458 68.861 -0.402 19998
2849 1 15 . 1 1 27 27 THR H H 27 8.874 8.874 8.673 0.201 19998
2850 1 15 . 1 1 28 28 LYS N N 28 118.883 118.883 120.472 -1.589 19998
2851 1 15 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.256 -0.225 19998
2852 1 15 . 1 1 28 28 LYS C C 28 174.613 174.613 177.225 -2.612 19998
2853 1 15 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.538 -0.739 19998
2854 1 15 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.565 0.599 19998
2855 1 15 . 1 1 28 28 LYS H H 28 7.609 7.609 8.105 -0.496 19998
2856 1 15 . 1 1 29 29 HIS N N 29 113.398 113.398 115.209 -1.811 19998
2857 1 15 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.627 -0.343 19998
2858 1 15 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.458 0.128 19998
2859 1 15 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.638 -1.576 19998
2860 1 15 . 1 1 29 29 HIS H H 29 7.450 7.450 8.055 -0.605 19998
2861 1 15 . 1 1 30 30 LYS N N 30 116.344 116.344 118.939 -2.595 19998
2862 1 15 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.218 -0.330 19998
2863 1 15 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.329 0.171 19998
2864 1 15 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.684 -1.075 19998
2865 1 15 . 1 1 30 30 LYS H H 30 8.261 8.261 8.423 -0.162 19998
2866 1 15 . 1 1 31 31 TRP N N 31 117.766 117.766 114.887 2.879 19998
2867 1 15 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.001 0.476 19998
2868 1 15 . 1 1 31 31 TRP C C 31 174.754 174.754 174.337 0.417 19998
2869 1 15 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.286 1.470 19998
2870 1 15 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.770 1.206 19998
2871 1 15 . 1 1 31 31 TRP H H 31 8.483 8.483 7.695 0.788 19998
2872 1 15 . 1 1 32 32 CYS N N 32 118.984 118.984 123.083 -4.099 19998
2873 1 15 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.295 0.452 19998
2874 1 15 . 1 1 32 32 CYS C C 32 171.472 171.472 174.681 -3.209 19998
2875 1 15 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.211 -4.478 19998
2876 1 15 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.587 14.937 19998
2877 1 15 . 1 1 32 32 CYS H H 32 8.474 8.474 8.396 0.078 19998
2878 1 15 . 1 1 33 33 LYS N N 33 124.672 124.672 123.917 0.755 19998
2879 1 15 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.155 0.562 19998
2880 1 15 . 1 1 33 33 LYS C C 33 172.236 172.236 175.464 -3.228 19998
2881 1 15 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.014 0.716 19998
2882 1 15 . 1 1 33 33 LYS CB C 33 35.429 35.429 34.014 1.415 19998
2883 1 15 . 1 1 33 33 LYS H H 33 9.027 9.027 8.353 0.674 19998
2884 1 15 . 1 1 34 34 TYR N N 34 120.102 120.102 122.730 -2.628 19998
2885 1 15 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.583 0.295 19998
2886 1 15 . 1 1 34 34 TYR C C 34 174.034 174.034 176.757 -2.723 19998
2887 1 15 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.967 0.295 19998
2888 1 15 . 1 1 34 34 TYR CB C 34 38.633 38.633 38.073 0.560 19998
2889 1 15 . 1 1 34 34 TYR H H 34 8.092 8.092 8.743 -0.651 19998
2890 1 15 . 1 1 35 35 GLU N N 35 124.362 124.362 126.054 -1.692 19998
2891 1 15 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.464 -0.002 19998
2892 1 15 . 1 1 35 35 GLU C C 35 172.127 172.127 175.220 -3.093 19998
2893 1 15 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.036 0.231 19998
2894 1 15 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.279 0.574 19998
2895 1 15 . 1 1 35 35 GLU H H 35 8.754 8.754 8.648 0.106 19998
2896 1 16 . 1 1 2 2 ALA N N 2 123.910 123.910 124.671 -0.761 19998
2897 1 16 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.761 -0.297 19998
2898 1 16 . 1 1 2 2 ALA C C 2 174.673 174.673 176.246 -1.573 19998
2899 1 16 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.210 -0.042 19998
2900 1 16 . 1 1 2 2 ALA CB C 2 19.690 19.690 19.203 0.487 19998
2901 1 16 . 1 1 2 2 ALA H H 2 8.561 8.561 8.199 0.362 19998
2902 1 16 . 1 1 3 3 CYS N N 3 117.207 117.207 118.809 -1.602 19998
2903 1 16 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.648 0.317 19998
2904 1 16 . 1 1 3 3 CYS C C 3 170.808 170.808 172.671 -1.863 19998
2905 1 16 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.286 -2.532 19998
2906 1 16 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.213 14.854 19998
2907 1 16 . 1 1 3 3 CYS H H 3 8.335 8.335 8.132 0.203 19998
2908 1 16 . 1 1 4 4 LEU N N 4 121.828 121.828 122.758 -0.930 19998
2909 1 16 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.607 -0.262 19998
2910 1 16 . 1 1 4 4 LEU C C 4 172.234 172.234 177.240 -5.006 19998
2911 1 16 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.045 0.178 19998
2912 1 16 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.844 0.734 19998
2913 1 16 . 1 1 4 4 LEU H H 4 8.815 8.815 8.377 0.438 19998
2914 1 16 . 1 1 5 5 GLY N N 5 107.508 107.508 110.490 -2.982 19998
2915 1 16 . 1 1 5 5 GLY C C 5 169.768 169.768 173.418 -3.650 19998
2916 1 16 . 1 1 5 5 GLY CA C 5 43.052 43.052 44.028 -0.976 19998
2917 1 16 . 1 1 5 5 GLY H H 5 7.999 7.999 8.323 -0.324 19998
2918 1 16 . 1 1 6 6 PHE N N 6 116.953 116.953 120.818 -3.865 19998
2919 1 16 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.991 -0.372 19998
2920 1 16 . 1 1 6 6 PHE C C 6 174.967 174.967 176.747 -1.780 19998
2921 1 16 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.968 1.133 19998
2922 1 16 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.053 0.453 19998
2923 1 16 . 1 1 6 6 PHE H H 6 8.392 8.392 8.532 -0.140 19998
2924 1 16 . 1 1 7 7 GLY N N 7 115.074 115.074 115.668 -0.594 19998
2925 1 16 . 1 1 7 7 GLY C C 7 171.017 171.017 173.923 -2.906 19998
2926 1 16 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.836 0.009 19998
2927 1 16 . 1 1 7 7 GLY H H 7 8.645 8.645 7.404 1.241 19998
2928 1 16 . 1 1 8 8 LYS N N 8 120.051 120.051 120.521 -0.470 19998
2929 1 16 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.602 -0.289 19998
2930 1 16 . 1 1 8 8 LYS C C 8 173.878 173.878 175.936 -2.058 19998
2931 1 16 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.212 0.359 19998
2932 1 16 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.163 -1.772 19998
2933 1 16 . 1 1 8 8 LYS H H 8 7.429 7.429 7.365 0.064 19998
2934 1 16 . 1 1 9 9 SER N N 9 117.004 117.004 117.090 -0.086 19998
2935 1 16 . 1 1 9 9 SER HA H 9 4.315 4.315 4.628 -0.313 19998
2936 1 16 . 1 1 9 9 SER C C 9 170.486 170.486 174.351 -3.865 19998
2937 1 16 . 1 1 9 9 SER CB C 9 63.355 63.355 63.075 0.280 19998
2938 1 16 . 1 1 9 9 SER H H 9 8.542 8.542 8.507 0.035 19998
2939 1 16 . 1 1 10 10 CYS N N 10 119.238 119.238 121.376 -2.138 19998
2940 1 16 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.770 0.063 19998
2941 1 16 . 1 1 10 10 CYS C C 10 168.106 168.106 172.995 -4.889 19998
2942 1 16 . 1 1 10 10 CYS CA C 10 53.907 53.907 55.696 -1.789 19998
2943 1 16 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.346 15.495 19998
2944 1 16 . 1 1 10 10 CYS H H 10 8.188 8.188 8.356 -0.168 19998
2945 1 16 . 1 1 11 11 ASN N N 11 119.594 119.594 118.583 1.011 19998
2946 1 16 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.198 -0.074 19998
2947 1 16 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.788 -1.312 19998
2948 1 16 . 1 1 11 11 ASN CB C 11 40.000 40.000 41.157 -1.157 19998
2949 1 16 . 1 1 11 11 ASN H H 11 9.129 9.129 8.602 0.527 19998
2950 1 16 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.479 -0.631 19998
2951 1 16 . 1 1 12 12 PRO C C 12 174.197 174.197 178.437 -4.240 19998
2952 1 16 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.897 -0.208 19998
2953 1 16 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.279 -0.396 19998
2954 1 16 . 1 1 13 13 SER N N 13 110.351 110.351 112.833 -2.482 19998
2955 1 16 . 1 1 13 13 SER HA H 13 4.394 4.394 4.244 0.150 19998
2956 1 16 . 1 1 13 13 SER C C 13 170.980 170.980 173.951 -2.971 19998
2957 1 16 . 1 1 13 13 SER CA C 13 59.326 59.326 60.074 -0.748 19998
2958 1 16 . 1 1 13 13 SER CB C 13 63.380 63.380 63.070 0.310 19998
2959 1 16 . 1 1 13 13 SER H H 13 7.785 7.785 8.465 -0.680 19998
2960 1 16 . 1 1 14 14 ASN N N 14 120.660 120.660 117.213 3.447 19998
2961 1 16 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.804 -0.166 19998
2962 1 16 . 1 1 14 14 ASN C C 14 171.412 171.412 173.615 -2.203 19998
2963 1 16 . 1 1 14 14 ASN CA C 14 52.806 52.806 52.139 0.667 19998
2964 1 16 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.013 -1.203 19998
2965 1 16 . 1 1 14 14 ASN H H 14 7.613 7.613 7.740 -0.127 19998
2966 1 16 . 1 1 15 15 ASP N N 15 124.062 124.062 121.582 2.480 19998
2967 1 16 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.536 -0.426 19998
2968 1 16 . 1 1 15 15 ASP C C 15 174.918 174.918 175.708 -0.790 19998
2969 1 16 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.905 0.869 19998
2970 1 16 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.683 0.677 19998
2971 1 16 . 1 1 15 15 ASP H H 15 8.695 8.695 8.008 0.687 19998
2972 1 16 . 1 1 16 16 GLN N N 16 127.008 127.008 123.199 3.809 19998
2973 1 16 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.547 0.066 19998
2974 1 16 . 1 1 16 16 GLN C C 16 173.874 173.874 174.359 -0.485 19998
2975 1 16 . 1 1 16 16 GLN CA C 16 54.522 54.522 55.192 -0.670 19998
2976 1 16 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.566 -1.239 19998
2977 1 16 . 1 1 16 16 GLN H H 16 8.041 8.041 8.595 -0.554 19998
2978 1 16 . 1 1 17 17 CYS N N 17 122.234 122.234 118.975 3.259 19998
2979 1 16 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.807 0.176 19998
2980 1 16 . 1 1 17 17 CYS C C 17 173.908 173.908 174.885 -0.977 19998
2981 1 16 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.717 -1.231 19998
2982 1 16 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.508 8.398 19998
2983 1 16 . 1 1 17 17 CYS H H 17 9.314 9.314 8.184 1.130 19998
2984 1 16 . 1 1 18 18 CYS N N 18 118.883 118.883 122.670 -3.787 19998
2985 1 16 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.523 0.085 19998
2986 1 16 . 1 1 18 18 CYS C C 18 172.722 172.722 176.034 -3.312 19998
2987 1 16 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.080 -3.558 19998
2988 1 16 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.018 15.349 19998
2989 1 16 . 1 1 18 18 CYS H H 18 9.192 9.192 8.581 0.611 19998
2990 1 16 . 1 1 19 19 LYS N N 19 131.730 131.730 126.382 5.348 19998
2991 1 16 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.085 0.247 19998
2992 1 16 . 1 1 19 19 LYS C C 19 177.997 177.997 178.932 -0.935 19998
2993 1 16 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.842 -0.416 19998
2994 1 16 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.111 -0.791 19998
2995 1 16 . 1 1 19 19 LYS H H 19 8.890 8.890 8.449 0.441 19998
2996 1 16 . 1 1 20 20 SER N N 20 115.887 115.887 114.782 1.105 19998
2997 1 16 . 1 1 20 20 SER HA H 20 4.334 4.334 4.278 0.056 19998
2998 1 16 . 1 1 20 20 SER C C 20 172.946 172.946 175.717 -2.771 19998
2999 1 16 . 1 1 20 20 SER CA C 20 60.311 60.311 60.704 -0.393 19998
3000 1 16 . 1 1 20 20 SER CB C 20 62.327 62.327 62.715 -0.389 19998
3001 1 16 . 1 1 20 20 SER H H 20 8.856 8.856 8.181 0.675 19998
3002 1 16 . 1 1 21 21 SER N N 21 116.191 116.191 114.851 1.340 19998
3003 1 16 . 1 1 21 21 SER HA H 21 4.833 4.833 4.552 0.281 19998
3004 1 16 . 1 1 21 21 SER C C 21 170.505 170.505 173.339 -2.834 19998
3005 1 16 . 1 1 21 21 SER CA C 21 57.500 57.500 57.836 -0.336 19998
3006 1 16 . 1 1 21 21 SER CB C 21 63.852 63.852 63.467 0.385 19998
3007 1 16 . 1 1 21 21 SER H H 21 7.068 7.068 7.596 -0.528 19998
3008 1 16 . 1 1 22 22 SER N N 22 111.723 111.723 116.600 -4.877 19998
3009 1 16 . 1 1 22 22 SER HA H 22 4.099 4.099 4.145 -0.046 19998
3010 1 16 . 1 1 22 22 SER C C 22 170.369 170.369 173.082 -2.713 19998
3011 1 16 . 1 1 22 22 SER CA C 22 59.140 59.140 59.562 -0.423 19998
3012 1 16 . 1 1 22 22 SER CB C 22 61.339 61.339 61.779 -0.440 19998
3013 1 16 . 1 1 22 22 SER H H 22 8.113 8.113 8.151 -0.038 19998
3014 1 16 . 1 1 23 23 LEU N N 23 115.988 115.988 119.252 -3.264 19998
3015 1 16 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.944 -0.046 19998
3016 1 16 . 1 1 23 23 LEU C C 23 173.712 173.712 175.610 -1.898 19998
3017 1 16 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.379 -0.296 19998
3018 1 16 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.282 0.780 19998
3019 1 16 . 1 1 23 23 LEU H H 23 7.111 7.111 7.548 -0.438 19998
3020 1 16 . 1 1 24 24 ALA N N 24 119.898 119.898 121.621 -1.723 19998
3021 1 16 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.569 -0.103 19998
3022 1 16 . 1 1 24 24 ALA C C 24 173.491 173.491 174.765 -1.274 19998
3023 1 16 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.746 -0.579 19998
3024 1 16 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.790 1.447 19998
3025 1 16 . 1 1 24 24 ALA H H 24 8.904 8.904 7.881 1.023 19998
3026 1 16 . 1 1 25 25 CYS N N 25 122.945 122.945 121.508 1.437 19998
3027 1 16 . 1 1 25 25 CYS HA H 25 4.452 4.452 4.910 -0.458 19998
3028 1 16 . 1 1 25 25 CYS C C 25 171.574 171.574 175.181 -3.607 19998
3029 1 16 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.401 -1.269 19998
3030 1 16 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.536 12.643 19998
3031 1 16 . 1 1 25 25 CYS H H 25 9.847 9.847 8.661 1.186 19998
3032 1 16 . 1 1 26 26 SER N N 26 122.285 122.285 123.972 -1.687 19998
3033 1 16 . 1 1 26 26 SER HA H 26 4.543 4.543 4.758 -0.215 19998
3034 1 16 . 1 1 26 26 SER CA C 26 57.773 57.773 57.343 0.430 19998
3035 1 16 . 1 1 26 26 SER CB C 26 63.789 63.789 65.659 -1.870 19998
3036 1 16 . 1 1 26 26 SER H H 26 7.791 7.791 8.327 -0.536 19998
3037 1 16 . 1 1 27 27 THR N N 27 122.390 122.390 120.674 1.716 19998
3038 1 16 . 1 1 27 27 THR HA H 27 3.778 3.778 4.304 -0.526 19998
3039 1 16 . 1 1 27 27 THR C C 27 172.781 172.781 175.255 -2.474 19998
3040 1 16 . 1 1 27 27 THR CA C 27 65.390 65.390 64.335 1.055 19998
3041 1 16 . 1 1 27 27 THR CB C 27 68.458 68.458 68.599 -0.141 19998
3042 1 16 . 1 1 27 27 THR H H 27 8.874 8.874 8.629 0.245 19998
3043 1 16 . 1 1 28 28 LYS N N 28 118.883 118.883 121.882 -2.999 19998
3044 1 16 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.214 -0.183 19998
3045 1 16 . 1 1 28 28 LYS C C 28 174.613 174.613 177.184 -2.571 19998
3046 1 16 . 1 1 28 28 LYS CA C 28 57.799 57.799 57.690 0.109 19998
3047 1 16 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.238 0.926 19998
3048 1 16 . 1 1 28 28 LYS H H 28 7.609 7.609 8.073 -0.464 19998
3049 1 16 . 1 1 29 29 HIS N N 29 113.398 113.398 116.107 -2.709 19998
3050 1 16 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.654 -0.370 19998
3051 1 16 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.661 -0.075 19998
3052 1 16 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.640 -1.578 19998
3053 1 16 . 1 1 29 29 HIS H H 29 7.450 7.450 8.018 -0.568 19998
3054 1 16 . 1 1 30 30 LYS N N 30 116.344 116.344 118.933 -2.589 19998
3055 1 16 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.218 -0.330 19998
3056 1 16 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.342 0.158 19998
3057 1 16 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.673 -1.064 19998
3058 1 16 . 1 1 30 30 LYS H H 30 8.261 8.261 8.428 -0.167 19998
3059 1 16 . 1 1 31 31 TRP N N 31 117.766 117.766 114.915 2.851 19998
3060 1 16 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.005 0.472 19998
3061 1 16 . 1 1 31 31 TRP C C 31 174.754 174.754 174.338 0.416 19998
3062 1 16 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.332 1.424 19998
3063 1 16 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.812 1.163 19998
3064 1 16 . 1 1 31 31 TRP H H 31 8.483 8.483 7.703 0.780 19998
3065 1 16 . 1 1 32 32 CYS N N 32 118.984 118.984 123.046 -4.062 19998
3066 1 16 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.425 0.322 19998
3067 1 16 . 1 1 32 32 CYS C C 32 171.472 171.472 174.729 -3.257 19998
3068 1 16 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.127 -4.394 19998
3069 1 16 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.596 14.928 19998
3070 1 16 . 1 1 32 32 CYS H H 32 8.474 8.474 8.385 0.089 19998
3071 1 16 . 1 1 33 33 LYS N N 33 124.672 124.672 123.852 0.820 19998
3072 1 16 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.146 0.571 19998
3073 1 16 . 1 1 33 33 LYS C C 33 172.236 172.236 175.483 -3.247 19998
3074 1 16 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.096 0.634 19998
3075 1 16 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.923 1.506 19998
3076 1 16 . 1 1 33 33 LYS H H 33 9.027 9.027 8.224 0.803 19998
3077 1 16 . 1 1 34 34 TYR N N 34 120.102 120.102 123.213 -3.111 19998
3078 1 16 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.562 0.316 19998
3079 1 16 . 1 1 34 34 TYR C C 34 174.034 174.034 176.839 -2.805 19998
3080 1 16 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.812 0.450 19998
3081 1 16 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.978 0.655 19998
3082 1 16 . 1 1 34 34 TYR H H 34 8.092 8.092 8.736 -0.644 19998
3083 1 16 . 1 1 35 35 GLU N N 35 124.362 124.362 126.290 -1.928 19998
3084 1 16 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.368 0.094 19998
3085 1 16 . 1 1 35 35 GLU C C 35 172.127 172.127 175.307 -3.180 19998
3086 1 16 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.723 -0.456 19998
3087 1 16 . 1 1 35 35 GLU CB C 35 30.852 30.852 29.956 0.896 19998
3088 1 16 . 1 1 35 35 GLU H H 35 8.754 8.754 8.759 -0.005 19998
3089 1 17 . 1 1 2 2 ALA N N 2 123.910 123.910 122.792 1.118 19998
3090 1 17 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.775 -0.311 19998
3091 1 17 . 1 1 2 2 ALA C C 2 174.673 174.673 176.395 -1.722 19998
3092 1 17 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.079 0.089 19998
3093 1 17 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.553 1.137 19998
3094 1 17 . 1 1 2 2 ALA H H 2 8.561 8.561 8.349 0.212 19998
3095 1 17 . 1 1 3 3 CYS N N 3 117.207 117.207 119.053 -1.846 19998
3096 1 17 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.690 0.275 19998
3097 1 17 . 1 1 3 3 CYS C C 3 170.808 170.808 172.721 -1.913 19998
3098 1 17 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.193 -2.439 19998
3099 1 17 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.420 14.647 19998
3100 1 17 . 1 1 3 3 CYS H H 3 8.335 8.335 8.218 0.117 19998
3101 1 17 . 1 1 4 4 LEU N N 4 121.828 121.828 122.672 -0.844 19998
3102 1 17 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.607 -0.262 19998
3103 1 17 . 1 1 4 4 LEU C C 4 172.234 172.234 177.235 -5.001 19998
3104 1 17 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.040 0.183 19998
3105 1 17 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.913 0.664 19998
3106 1 17 . 1 1 4 4 LEU H H 4 8.815 8.815 8.367 0.448 19998
3107 1 17 . 1 1 5 5 GLY N N 5 107.508 107.508 110.454 -2.946 19998
3108 1 17 . 1 1 5 5 GLY C C 5 169.768 169.768 173.411 -3.643 19998
3109 1 17 . 1 1 5 5 GLY CA C 5 43.052 43.052 44.006 -0.954 19998
3110 1 17 . 1 1 5 5 GLY H H 5 7.999 7.999 8.328 -0.329 19998
3111 1 17 . 1 1 6 6 PHE N N 6 116.953 116.953 120.468 -3.515 19998
3112 1 17 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.961 -0.342 19998
3113 1 17 . 1 1 6 6 PHE C C 6 174.967 174.967 177.285 -2.318 19998
3114 1 17 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.533 1.568 19998
3115 1 17 . 1 1 6 6 PHE CB C 6 39.506 39.506 38.941 0.565 19998
3116 1 17 . 1 1 6 6 PHE H H 6 8.392 8.392 8.251 0.141 19998
3117 1 17 . 1 1 7 7 GLY N N 7 115.074 115.074 114.694 0.380 19998
3118 1 17 . 1 1 7 7 GLY C C 7 171.017 171.017 173.426 -2.409 19998
3119 1 17 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.639 0.205 19998
3120 1 17 . 1 1 7 7 GLY H H 7 8.645 8.645 7.575 1.070 19998
3121 1 17 . 1 1 8 8 LYS N N 8 120.051 120.051 120.624 -0.573 19998
3122 1 17 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.603 -0.290 19998
3123 1 17 . 1 1 8 8 LYS C C 8 173.878 173.878 175.899 -2.021 19998
3124 1 17 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.270 0.300 19998
3125 1 17 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.115 -1.724 19998
3126 1 17 . 1 1 8 8 LYS H H 8 7.429 7.429 7.363 0.066 19998
3127 1 17 . 1 1 9 9 SER N N 9 117.004 117.004 116.965 0.039 19998
3128 1 17 . 1 1 9 9 SER HA H 9 4.315 4.315 4.645 -0.330 19998
3129 1 17 . 1 1 9 9 SER C C 9 170.486 170.486 174.491 -4.005 19998
3130 1 17 . 1 1 9 9 SER CB C 9 63.355 63.355 62.830 0.525 19998
3131 1 17 . 1 1 9 9 SER H H 9 8.542 8.542 8.500 0.042 19998
3132 1 17 . 1 1 10 10 CYS N N 10 119.238 119.238 121.692 -2.454 19998
3133 1 17 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.761 0.072 19998
3134 1 17 . 1 1 10 10 CYS C C 10 168.106 168.106 173.507 -5.401 19998
3135 1 17 . 1 1 10 10 CYS CA C 10 53.907 53.907 55.928 -2.021 19998
3136 1 17 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.626 15.215 19998
3137 1 17 . 1 1 10 10 CYS H H 10 8.188 8.188 8.542 -0.354 19998
3138 1 17 . 1 1 11 11 ASN N N 11 119.594 119.594 118.802 0.792 19998
3139 1 17 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.204 -0.080 19998
3140 1 17 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.575 -1.099 19998
3141 1 17 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.395 -0.395 19998
3142 1 17 . 1 1 11 11 ASN H H 11 9.129 9.129 8.594 0.535 19998
3143 1 17 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.450 -0.602 19998
3144 1 17 . 1 1 12 12 PRO C C 12 174.197 174.197 178.404 -4.207 19998
3145 1 17 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.641 0.048 19998
3146 1 17 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.232 -0.349 19998
3147 1 17 . 1 1 13 13 SER N N 13 110.351 110.351 112.576 -2.225 19998
3148 1 17 . 1 1 13 13 SER HA H 13 4.394 4.394 4.240 0.154 19998
3149 1 17 . 1 1 13 13 SER C C 13 170.980 170.980 173.873 -2.893 19998
3150 1 17 . 1 1 13 13 SER CA C 13 59.326 59.326 60.021 -0.695 19998
3151 1 17 . 1 1 13 13 SER CB C 13 63.380 63.380 63.021 0.359 19998
3152 1 17 . 1 1 13 13 SER H H 13 7.785 7.785 8.406 -0.621 19998
3153 1 17 . 1 1 14 14 ASN N N 14 120.660 120.660 118.204 2.456 19998
3154 1 17 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.825 -0.187 19998
3155 1 17 . 1 1 14 14 ASN C C 14 171.412 171.412 173.712 -2.300 19998
3156 1 17 . 1 1 14 14 ASN CA C 14 52.806 52.806 52.130 0.676 19998
3157 1 17 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.067 -1.257 19998
3158 1 17 . 1 1 14 14 ASN H H 14 7.613 7.613 7.809 -0.197 19998
3159 1 17 . 1 1 15 15 ASP N N 15 124.062 124.062 121.534 2.528 19998
3160 1 17 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.498 -0.388 19998
3161 1 17 . 1 1 15 15 ASP C C 15 174.918 174.918 175.664 -0.746 19998
3162 1 17 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.772 1.002 19998
3163 1 17 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.622 0.738 19998
3164 1 17 . 1 1 15 15 ASP H H 15 8.695 8.695 7.969 0.726 19998
3165 1 17 . 1 1 16 16 GLN N N 16 127.008 127.008 121.702 5.306 19998
3166 1 17 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.573 0.040 19998
3167 1 17 . 1 1 16 16 GLN C C 16 173.874 173.874 174.035 -0.161 19998
3168 1 17 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.824 -0.302 19998
3169 1 17 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.300 -0.973 19998
3170 1 17 . 1 1 16 16 GLN H H 16 8.041 8.041 8.572 -0.531 19998
3171 1 17 . 1 1 17 17 CYS N N 17 122.234 122.234 119.055 3.179 19998
3172 1 17 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.806 0.177 19998
3173 1 17 . 1 1 17 17 CYS C C 17 173.908 173.908 174.873 -0.965 19998
3174 1 17 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.699 -1.213 19998
3175 1 17 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.524 8.382 19998
3176 1 17 . 1 1 17 17 CYS H H 17 9.314 9.314 8.112 1.202 19998
3177 1 17 . 1 1 18 18 CYS N N 18 118.883 118.883 122.649 -3.766 19998
3178 1 17 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.526 0.082 19998
3179 1 17 . 1 1 18 18 CYS C C 18 172.722 172.722 176.010 -3.288 19998
3180 1 17 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.091 -3.570 19998
3181 1 17 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.040 15.327 19998
3182 1 17 . 1 1 18 18 CYS H H 18 9.192 9.192 8.593 0.599 19998
3183 1 17 . 1 1 19 19 LYS N N 19 131.730 131.730 126.388 5.342 19998
3184 1 17 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.089 0.243 19998
3185 1 17 . 1 1 19 19 LYS C C 19 177.997 177.997 179.053 -1.056 19998
3186 1 17 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.942 -0.516 19998
3187 1 17 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.248 -0.930 19998
3188 1 17 . 1 1 19 19 LYS H H 19 8.890 8.890 8.460 0.430 19998
3189 1 17 . 1 1 20 20 SER N N 20 115.887 115.887 114.100 1.787 19998
3190 1 17 . 1 1 20 20 SER HA H 20 4.334 4.334 4.292 0.042 19998
3191 1 17 . 1 1 20 20 SER C C 20 172.946 172.946 175.507 -2.561 19998
3192 1 17 . 1 1 20 20 SER CA C 20 60.311 60.311 60.757 -0.445 19998
3193 1 17 . 1 1 20 20 SER CB C 20 62.327 62.327 62.965 -0.638 19998
3194 1 17 . 1 1 20 20 SER H H 20 8.856 8.856 8.522 0.334 19998
3195 1 17 . 1 1 21 21 SER N N 21 116.191 116.191 114.880 1.311 19998
3196 1 17 . 1 1 21 21 SER HA H 21 4.833 4.833 4.585 0.248 19998
3197 1 17 . 1 1 21 21 SER C C 21 170.505 170.505 173.230 -2.725 19998
3198 1 17 . 1 1 21 21 SER CA C 21 57.500 57.500 57.720 -0.220 19998
3199 1 17 . 1 1 21 21 SER CB C 21 63.852 63.852 63.569 0.284 19998
3200 1 17 . 1 1 21 21 SER H H 21 7.068 7.068 7.471 -0.403 19998
3201 1 17 . 1 1 22 22 SER N N 22 111.723 111.723 115.707 -3.984 19998
3202 1 17 . 1 1 22 22 SER HA H 22 4.099 4.099 4.153 -0.054 19998
3203 1 17 . 1 1 22 22 SER C C 22 170.369 170.369 173.060 -2.691 19998
3204 1 17 . 1 1 22 22 SER CA C 22 59.140 59.140 59.908 -0.768 19998
3205 1 17 . 1 1 22 22 SER CB C 22 61.339 61.339 61.172 0.168 19998
3206 1 17 . 1 1 22 22 SER H H 22 8.113 8.113 8.231 -0.118 19998
3207 1 17 . 1 1 23 23 LEU N N 23 115.988 115.988 119.161 -3.173 19998
3208 1 17 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.949 -0.051 19998
3209 1 17 . 1 1 23 23 LEU C C 23 173.712 173.712 175.355 -1.643 19998
3210 1 17 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.315 -0.232 19998
3211 1 17 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.572 0.490 19998
3212 1 17 . 1 1 23 23 LEU H H 23 7.111 7.111 7.553 -0.442 19998
3213 1 17 . 1 1 24 24 ALA N N 24 119.898 119.898 120.685 -0.787 19998
3214 1 17 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.635 -0.169 19998
3215 1 17 . 1 1 24 24 ALA C C 24 173.491 173.491 174.684 -1.193 19998
3216 1 17 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.816 -0.649 19998
3217 1 17 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.760 1.477 19998
3218 1 17 . 1 1 24 24 ALA H H 24 8.904 8.904 7.796 1.108 19998
3219 1 17 . 1 1 25 25 CYS N N 25 122.945 122.945 121.431 1.514 19998
3220 1 17 . 1 1 25 25 CYS HA H 25 4.452 4.452 4.923 -0.471 19998
3221 1 17 . 1 1 25 25 CYS C C 25 171.574 171.574 175.133 -3.559 19998
3222 1 17 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.484 -1.352 19998
3223 1 17 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.542 12.637 19998
3224 1 17 . 1 1 25 25 CYS H H 25 9.847 9.847 8.659 1.188 19998
3225 1 17 . 1 1 26 26 SER N N 26 122.285 122.285 124.063 -1.778 19998
3226 1 17 . 1 1 26 26 SER HA H 26 4.543 4.543 4.766 -0.223 19998
3227 1 17 . 1 1 26 26 SER CA C 26 57.773 57.773 57.120 0.653 19998
3228 1 17 . 1 1 26 26 SER CB C 26 63.789 63.789 65.773 -1.984 19998
3229 1 17 . 1 1 26 26 SER H H 26 7.791 7.791 8.347 -0.556 19998
3230 1 17 . 1 1 27 27 THR N N 27 122.390 122.390 120.202 2.188 19998
3231 1 17 . 1 1 27 27 THR HA H 27 3.778 3.778 4.302 -0.524 19998
3232 1 17 . 1 1 27 27 THR C C 27 172.781 172.781 175.089 -2.308 19998
3233 1 17 . 1 1 27 27 THR CA C 27 65.390 65.390 63.670 1.720 19998
3234 1 17 . 1 1 27 27 THR CB C 27 68.458 68.458 68.642 -0.184 19998
3235 1 17 . 1 1 27 27 THR H H 27 8.874 8.874 8.632 0.242 19998
3236 1 17 . 1 1 28 28 LYS N N 28 118.883 118.883 120.436 -1.553 19998
3237 1 17 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.215 -0.184 19998
3238 1 17 . 1 1 28 28 LYS C C 28 174.613 174.613 176.900 -2.287 19998
3239 1 17 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.255 -0.456 19998
3240 1 17 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.411 0.753 19998
3241 1 17 . 1 1 28 28 LYS H H 28 7.609 7.609 8.078 -0.469 19998
3242 1 17 . 1 1 29 29 HIS N N 29 113.398 113.398 115.405 -2.007 19998
3243 1 17 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.644 -0.360 19998
3244 1 17 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.410 0.176 19998
3245 1 17 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.676 -1.614 19998
3246 1 17 . 1 1 29 29 HIS H H 29 7.450 7.450 8.054 -0.604 19998
3247 1 17 . 1 1 30 30 LYS N N 30 116.344 116.344 119.051 -2.707 19998
3248 1 17 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.216 -0.328 19998
3249 1 17 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.362 0.138 19998
3250 1 17 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.624 -1.015 19998
3251 1 17 . 1 1 30 30 LYS H H 30 8.261 8.261 8.441 -0.180 19998
3252 1 17 . 1 1 31 31 TRP N N 31 117.766 117.766 114.974 2.792 19998
3253 1 17 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.014 0.463 19998
3254 1 17 . 1 1 31 31 TRP C C 31 174.754 174.754 174.383 0.371 19998
3255 1 17 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.293 1.463 19998
3256 1 17 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.830 1.146 19998
3257 1 17 . 1 1 31 31 TRP H H 31 8.483 8.483 7.755 0.728 19998
3258 1 17 . 1 1 32 32 CYS N N 32 118.984 118.984 123.021 -4.037 19998
3259 1 17 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.450 0.297 19998
3260 1 17 . 1 1 32 32 CYS C C 32 171.472 171.472 174.787 -3.315 19998
3261 1 17 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.119 -4.386 19998
3262 1 17 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.607 14.917 19998
3263 1 17 . 1 1 32 32 CYS H H 32 8.474 8.474 8.406 0.068 19998
3264 1 17 . 1 1 33 33 LYS N N 33 124.672 124.672 123.829 0.843 19998
3265 1 17 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.153 0.564 19998
3266 1 17 . 1 1 33 33 LYS C C 33 172.236 172.236 175.478 -3.242 19998
3267 1 17 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.150 0.580 19998
3268 1 17 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.937 1.492 19998
3269 1 17 . 1 1 33 33 LYS H H 33 9.027 9.027 8.155 0.872 19998
3270 1 17 . 1 1 34 34 TYR N N 34 120.102 120.102 122.904 -2.802 19998
3271 1 17 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.553 0.325 19998
3272 1 17 . 1 1 34 34 TYR C C 34 174.034 174.034 176.840 -2.806 19998
3273 1 17 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.702 0.560 19998
3274 1 17 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.923 0.710 19998
3275 1 17 . 1 1 34 34 TYR H H 34 8.092 8.092 8.689 -0.597 19998
3276 1 17 . 1 1 35 35 GLU N N 35 124.362 124.362 126.225 -1.863 19998
3277 1 17 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.398 0.064 19998
3278 1 17 . 1 1 35 35 GLU C C 35 172.127 172.127 175.254 -3.127 19998
3279 1 17 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.597 -0.330 19998
3280 1 17 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.031 0.821 19998
3281 1 17 . 1 1 35 35 GLU H H 35 8.754 8.754 8.628 0.126 19998
3282 1 18 . 1 1 2 2 ALA N N 2 123.910 123.910 126.162 -2.252 19998
3283 1 18 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.931 -0.467 19998
3284 1 18 . 1 1 2 2 ALA C C 2 174.673 174.673 176.558 -1.885 19998
3285 1 18 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.266 -0.097 19998
3286 1 18 . 1 1 2 2 ALA CB C 2 19.690 19.690 19.107 0.583 19998
3287 1 18 . 1 1 2 2 ALA H H 2 8.561 8.561 8.205 0.356 19998
3288 1 18 . 1 1 3 3 CYS N N 3 117.207 117.207 118.824 -1.617 19998
3289 1 18 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.650 0.315 19998
3290 1 18 . 1 1 3 3 CYS C C 3 170.808 170.808 172.622 -1.814 19998
3291 1 18 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.418 -2.664 19998
3292 1 18 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.179 14.888 19998
3293 1 18 . 1 1 3 3 CYS H H 3 8.335 8.335 8.232 0.103 19998
3294 1 18 . 1 1 4 4 LEU N N 4 121.828 121.828 122.849 -1.021 19998
3295 1 18 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.618 -0.273 19998
3296 1 18 . 1 1 4 4 LEU C C 4 172.234 172.234 177.244 -5.010 19998
3297 1 18 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.041 0.182 19998
3298 1 18 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.748 0.830 19998
3299 1 18 . 1 1 4 4 LEU H H 4 8.815 8.815 8.405 0.410 19998
3300 1 18 . 1 1 5 5 GLY N N 5 107.508 107.508 110.464 -2.956 19998
3301 1 18 . 1 1 5 5 GLY C C 5 169.768 169.768 173.445 -3.677 19998
3302 1 18 . 1 1 5 5 GLY CA C 5 43.052 43.052 44.023 -0.971 19998
3303 1 18 . 1 1 5 5 GLY H H 5 7.999 7.999 8.301 -0.302 19998
3304 1 18 . 1 1 6 6 PHE N N 6 116.953 116.953 120.752 -3.799 19998
3305 1 18 . 1 1 6 6 PHE HA H 6 3.619 3.619 4.016 -0.397 19998
3306 1 18 . 1 1 6 6 PHE C C 6 174.967 174.967 176.805 -1.838 19998
3307 1 18 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.944 1.157 19998
3308 1 18 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.157 0.349 19998
3309 1 18 . 1 1 6 6 PHE H H 6 8.392 8.392 8.515 -0.123 19998
3310 1 18 . 1 1 7 7 GLY N N 7 115.074 115.074 115.566 -0.492 19998
3311 1 18 . 1 1 7 7 GLY C C 7 171.017 171.017 173.971 -2.954 19998
3312 1 18 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.889 -0.045 19998
3313 1 18 . 1 1 7 7 GLY H H 7 8.645 8.645 7.376 1.269 19998
3314 1 18 . 1 1 8 8 LYS N N 8 120.051 120.051 120.518 -0.467 19998
3315 1 18 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.589 -0.276 19998
3316 1 18 . 1 1 8 8 LYS C C 8 173.878 173.878 176.070 -2.192 19998
3317 1 18 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.179 0.391 19998
3318 1 18 . 1 1 8 8 LYS CB C 8 32.391 32.391 33.996 -1.605 19998
3319 1 18 . 1 1 8 8 LYS H H 8 7.429 7.429 7.360 0.069 19998
3320 1 18 . 1 1 9 9 SER N N 9 117.004 117.004 117.712 -0.708 19998
3321 1 18 . 1 1 9 9 SER HA H 9 4.315 4.315 4.609 -0.294 19998
3322 1 18 . 1 1 9 9 SER C C 9 170.486 170.486 174.308 -3.822 19998
3323 1 18 . 1 1 9 9 SER CB C 9 63.355 63.355 62.900 0.455 19998
3324 1 18 . 1 1 9 9 SER H H 9 8.542 8.542 8.537 0.005 19998
3325 1 18 . 1 1 10 10 CYS N N 10 119.238 119.238 121.185 -1.947 19998
3326 1 18 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.764 0.069 19998
3327 1 18 . 1 1 10 10 CYS C C 10 168.106 168.106 173.039 -4.933 19998
3328 1 18 . 1 1 10 10 CYS CA C 10 53.907 53.907 55.850 -1.943 19998
3329 1 18 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.209 15.632 19998
3330 1 18 . 1 1 10 10 CYS H H 10 8.188 8.188 8.313 -0.125 19998
3331 1 18 . 1 1 11 11 ASN N N 11 119.594 119.594 119.000 0.594 19998
3332 1 18 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.191 -0.067 19998
3333 1 18 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.764 -1.288 19998
3334 1 18 . 1 1 11 11 ASN CB C 11 40.000 40.000 41.115 -1.115 19998
3335 1 18 . 1 1 11 11 ASN H H 11 9.129 9.129 8.624 0.505 19998
3336 1 18 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.446 -0.598 19998
3337 1 18 . 1 1 12 12 PRO C C 12 174.197 174.197 178.416 -4.219 19998
3338 1 18 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.711 -0.022 19998
3339 1 18 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.218 -0.335 19998
3340 1 18 . 1 1 13 13 SER N N 13 110.351 110.351 112.454 -2.103 19998
3341 1 18 . 1 1 13 13 SER HA H 13 4.394 4.394 4.230 0.164 19998
3342 1 18 . 1 1 13 13 SER C C 13 170.980 170.980 173.969 -2.989 19998
3343 1 18 . 1 1 13 13 SER CA C 13 59.326 59.326 60.035 -0.709 19998
3344 1 18 . 1 1 13 13 SER CB C 13 63.380 63.380 62.974 0.406 19998
3345 1 18 . 1 1 13 13 SER H H 13 7.785 7.785 8.407 -0.622 19998
3346 1 18 . 1 1 14 14 ASN N N 14 120.660 120.660 118.461 2.199 19998
3347 1 18 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.900 -0.262 19998
3348 1 18 . 1 1 14 14 ASN C C 14 171.412 171.412 173.514 -2.102 19998
3349 1 18 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.861 0.945 19998
3350 1 18 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.082 -1.272 19998
3351 1 18 . 1 1 14 14 ASN H H 14 7.613 7.613 7.816 -0.203 19998
3352 1 18 . 1 1 15 15 ASP N N 15 124.062 124.062 120.875 3.187 19998
3353 1 18 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.505 -0.395 19998
3354 1 18 . 1 1 15 15 ASP C C 15 174.918 174.918 175.364 -0.446 19998
3355 1 18 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.833 0.941 19998
3356 1 18 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.529 0.831 19998
3357 1 18 . 1 1 15 15 ASP H H 15 8.695 8.695 7.999 0.696 19998
3358 1 18 . 1 1 16 16 GLN N N 16 127.008 127.008 121.710 5.298 19998
3359 1 18 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.542 0.071 19998
3360 1 18 . 1 1 16 16 GLN C C 16 173.874 173.874 173.995 -0.121 19998
3361 1 18 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.637 -0.115 19998
3362 1 18 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.051 -0.724 19998
3363 1 18 . 1 1 16 16 GLN H H 16 8.041 8.041 8.465 -0.424 19998
3364 1 18 . 1 1 17 17 CYS N N 17 122.234 122.234 118.844 3.390 19998
3365 1 18 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.835 0.148 19998
3366 1 18 . 1 1 17 17 CYS C C 17 173.908 173.908 174.835 -0.927 19998
3367 1 18 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.768 -1.282 19998
3368 1 18 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.770 8.136 19998
3369 1 18 . 1 1 17 17 CYS H H 17 9.314 9.314 8.200 1.114 19998
3370 1 18 . 1 1 18 18 CYS N N 18 118.883 118.883 122.751 -3.868 19998
3371 1 18 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.588 0.020 19998
3372 1 18 . 1 1 18 18 CYS C C 18 172.722 172.722 175.996 -3.274 19998
3373 1 18 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.336 -3.815 19998
3374 1 18 . 1 1 18 18 CYS CB C 18 41.367 41.367 25.963 15.404 19998
3375 1 18 . 1 1 18 18 CYS H H 18 9.192 9.192 8.586 0.606 19998
3376 1 18 . 1 1 19 19 LYS N N 19 131.730 131.730 126.397 5.333 19998
3377 1 18 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.099 0.233 19998
3378 1 18 . 1 1 19 19 LYS C C 19 177.997 177.997 178.754 -0.757 19998
3379 1 18 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.856 -0.430 19998
3380 1 18 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.184 -0.864 19998
3381 1 18 . 1 1 19 19 LYS H H 19 8.890 8.890 8.520 0.370 19998
3382 1 18 . 1 1 20 20 SER N N 20 115.887 115.887 114.637 1.250 19998
3383 1 18 . 1 1 20 20 SER HA H 20 4.334 4.334 4.284 0.050 19998
3384 1 18 . 1 1 20 20 SER C C 20 172.946 172.946 175.399 -2.453 19998
3385 1 18 . 1 1 20 20 SER CA C 20 60.311 60.311 60.776 -0.466 19998
3386 1 18 . 1 1 20 20 SER CB C 20 62.327 62.327 62.635 -0.308 19998
3387 1 18 . 1 1 20 20 SER H H 20 8.856 8.856 8.573 0.283 19998
3388 1 18 . 1 1 21 21 SER N N 21 116.191 116.191 114.953 1.238 19998
3389 1 18 . 1 1 21 21 SER HA H 21 4.833 4.833 4.591 0.242 19998
3390 1 18 . 1 1 21 21 SER C C 21 170.505 170.505 173.125 -2.620 19998
3391 1 18 . 1 1 21 21 SER CA C 21 57.500 57.500 58.194 -0.694 19998
3392 1 18 . 1 1 21 21 SER CB C 21 63.852 63.852 63.633 0.220 19998
3393 1 18 . 1 1 21 21 SER H H 21 7.068 7.068 7.502 -0.434 19998
3394 1 18 . 1 1 22 22 SER N N 22 111.723 111.723 115.747 -4.024 19998
3395 1 18 . 1 1 22 22 SER HA H 22 4.099 4.099 4.148 -0.049 19998
3396 1 18 . 1 1 22 22 SER C C 22 170.369 170.369 173.008 -2.639 19998
3397 1 18 . 1 1 22 22 SER CA C 22 59.140 59.140 59.764 -0.624 19998
3398 1 18 . 1 1 22 22 SER CB C 22 61.339 61.339 61.274 0.065 19998
3399 1 18 . 1 1 22 22 SER H H 22 8.113 8.113 8.231 -0.118 19998
3400 1 18 . 1 1 23 23 LEU N N 23 115.988 115.988 118.978 -2.990 19998
3401 1 18 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.903 -0.005 19998
3402 1 18 . 1 1 23 23 LEU C C 23 173.712 173.712 175.604 -1.892 19998
3403 1 18 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.378 -0.295 19998
3404 1 18 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.142 0.920 19998
3405 1 18 . 1 1 23 23 LEU H H 23 7.111 7.111 7.598 -0.487 19998
3406 1 18 . 1 1 24 24 ALA N N 24 119.898 119.898 120.800 -0.902 19998
3407 1 18 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.654 -0.188 19998
3408 1 18 . 1 1 24 24 ALA C C 24 173.491 173.491 174.712 -1.221 19998
3409 1 18 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.772 -0.605 19998
3410 1 18 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.683 1.554 19998
3411 1 18 . 1 1 24 24 ALA H H 24 8.904 8.904 7.805 1.099 19998
3412 1 18 . 1 1 25 25 CYS N N 25 122.945 122.945 121.182 1.763 19998
3413 1 18 . 1 1 25 25 CYS HA H 25 4.452 4.452 5.001 -0.549 19998
3414 1 18 . 1 1 25 25 CYS C C 25 171.574 171.574 175.248 -3.674 19998
3415 1 18 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.662 -1.530 19998
3416 1 18 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.547 12.632 19998
3417 1 18 . 1 1 25 25 CYS H H 25 9.847 9.847 8.719 1.128 19998
3418 1 18 . 1 1 26 26 SER N N 26 122.285 122.285 123.305 -1.020 19998
3419 1 18 . 1 1 26 26 SER HA H 26 4.543 4.543 4.729 -0.186 19998
3420 1 18 . 1 1 26 26 SER CA C 26 57.773 57.773 57.448 0.325 19998
3421 1 18 . 1 1 26 26 SER CB C 26 63.789 63.789 66.055 -2.266 19998
3422 1 18 . 1 1 26 26 SER H H 26 7.791 7.791 8.349 -0.558 19998
3423 1 18 . 1 1 27 27 THR N N 27 122.390 122.390 121.553 0.837 19998
3424 1 18 . 1 1 27 27 THR HA H 27 3.778 3.778 4.267 -0.489 19998
3425 1 18 . 1 1 27 27 THR C C 27 172.781 172.781 175.004 -2.223 19998
3426 1 18 . 1 1 27 27 THR CA C 27 65.390 65.390 64.370 1.020 19998
3427 1 18 . 1 1 27 27 THR CB C 27 68.458 68.458 68.584 -0.126 19998
3428 1 18 . 1 1 27 27 THR H H 27 8.874 8.874 8.638 0.236 19998
3429 1 18 . 1 1 28 28 LYS N N 28 118.883 118.883 121.498 -2.615 19998
3430 1 18 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.146 -0.115 19998
3431 1 18 . 1 1 28 28 LYS C C 28 174.613 174.613 176.787 -2.174 19998
3432 1 18 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.377 -0.578 19998
3433 1 18 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.191 0.973 19998
3434 1 18 . 1 1 28 28 LYS H H 28 7.609 7.609 7.996 -0.387 19998
3435 1 18 . 1 1 29 29 HIS N N 29 113.398 113.398 114.740 -1.342 19998
3436 1 18 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.604 -0.320 19998
3437 1 18 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.584 0.002 19998
3438 1 18 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.781 -1.719 19998
3439 1 18 . 1 1 29 29 HIS H H 29 7.450 7.450 8.023 -0.573 19998
3440 1 18 . 1 1 30 30 LYS N N 30 116.344 116.344 119.057 -2.713 19998
3441 1 18 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.215 -0.327 19998
3442 1 18 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.343 0.157 19998
3443 1 18 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.627 -1.018 19998
3444 1 18 . 1 1 30 30 LYS H H 30 8.261 8.261 8.430 -0.169 19998
3445 1 18 . 1 1 31 31 TRP N N 31 117.766 117.766 114.910 2.856 19998
3446 1 18 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.023 0.454 19998
3447 1 18 . 1 1 31 31 TRP C C 31 174.754 174.754 174.411 0.343 19998
3448 1 18 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.223 1.533 19998
3449 1 18 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.837 1.139 19998
3450 1 18 . 1 1 31 31 TRP H H 31 8.483 8.483 7.762 0.721 19998
3451 1 18 . 1 1 32 32 CYS N N 32 118.984 118.984 122.985 -4.001 19998
3452 1 18 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.332 0.415 19998
3453 1 18 . 1 1 32 32 CYS C C 32 171.472 171.472 174.751 -3.279 19998
3454 1 18 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.205 -4.471 19998
3455 1 18 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.581 14.943 19998
3456 1 18 . 1 1 32 32 CYS H H 32 8.474 8.474 8.407 0.067 19998
3457 1 18 . 1 1 33 33 LYS N N 33 124.672 124.672 123.911 0.761 19998
3458 1 18 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.125 0.592 19998
3459 1 18 . 1 1 33 33 LYS C C 33 172.236 172.236 175.457 -3.221 19998
3460 1 18 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.113 0.617 19998
3461 1 18 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.934 1.495 19998
3462 1 18 . 1 1 33 33 LYS H H 33 9.027 9.027 8.384 0.643 19998
3463 1 18 . 1 1 34 34 TYR N N 34 120.102 120.102 122.859 -2.757 19998
3464 1 18 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.548 0.330 19998
3465 1 18 . 1 1 34 34 TYR C C 34 174.034 174.034 176.834 -2.800 19998
3466 1 18 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.562 0.700 19998
3467 1 18 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.842 0.791 19998
3468 1 18 . 1 1 34 34 TYR H H 34 8.092 8.092 8.700 -0.608 19998
3469 1 18 . 1 1 35 35 GLU N N 35 124.362 124.362 126.521 -2.159 19998
3470 1 18 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.334 0.128 19998
3471 1 18 . 1 1 35 35 GLU C C 35 172.127 172.127 175.263 -3.136 19998
3472 1 18 . 1 1 35 35 GLU CA C 35 56.267 56.267 57.293 -1.026 19998
3473 1 18 . 1 1 35 35 GLU CB C 35 30.852 30.852 29.551 1.301 19998
3474 1 18 . 1 1 35 35 GLU H H 35 8.754 8.754 8.554 0.200 19998
3475 1 19 . 1 1 2 2 ALA N N 2 123.910 123.910 122.948 0.962 19998
3476 1 19 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.763 -0.299 19998
3477 1 19 . 1 1 2 2 ALA C C 2 174.673 174.673 176.347 -1.674 19998
3478 1 19 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.049 0.119 19998
3479 1 19 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.307 1.383 19998
3480 1 19 . 1 1 2 2 ALA H H 2 8.561 8.561 8.286 0.275 19998
3481 1 19 . 1 1 3 3 CYS N N 3 117.207 117.207 118.968 -1.761 19998
3482 1 19 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.679 0.286 19998
3483 1 19 . 1 1 3 3 CYS C C 3 170.808 170.808 172.697 -1.889 19998
3484 1 19 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.243 -2.489 19998
3485 1 19 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.366 14.701 19998
3486 1 19 . 1 1 3 3 CYS H H 3 8.335 8.335 8.243 0.092 19998
3487 1 19 . 1 1 4 4 LEU N N 4 121.828 121.828 122.744 -0.916 19998
3488 1 19 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.621 -0.276 19998
3489 1 19 . 1 1 4 4 LEU C C 4 172.234 172.234 177.124 -4.890 19998
3490 1 19 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.054 0.168 19998
3491 1 19 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.950 0.628 19998
3492 1 19 . 1 1 4 4 LEU H H 4 8.815 8.815 8.393 0.422 19998
3493 1 19 . 1 1 5 5 GLY N N 5 107.508 107.508 110.187 -2.679 19998
3494 1 19 . 1 1 5 5 GLY C C 5 169.768 169.768 173.402 -3.634 19998
3495 1 19 . 1 1 5 5 GLY CA C 5 43.052 43.052 43.838 -0.786 19998
3496 1 19 . 1 1 5 5 GLY H H 5 7.999 7.999 8.320 -0.321 19998
3497 1 19 . 1 1 6 6 PHE N N 6 116.953 116.953 120.191 -3.238 19998
3498 1 19 . 1 1 6 6 PHE HA H 6 3.619 3.619 4.019 -0.400 19998
3499 1 19 . 1 1 6 6 PHE C C 6 174.967 174.967 176.724 -1.757 19998
3500 1 19 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.538 1.563 19998
3501 1 19 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.352 0.154 19998
3502 1 19 . 1 1 6 6 PHE H H 6 8.392 8.392 8.400 -0.009 19998
3503 1 19 . 1 1 7 7 GLY N N 7 115.074 115.074 115.002 0.072 19998
3504 1 19 . 1 1 7 7 GLY C C 7 171.017 171.017 173.846 -2.829 19998
3505 1 19 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.882 -0.038 19998
3506 1 19 . 1 1 7 7 GLY H H 7 8.645 8.645 7.386 1.259 19998
3507 1 19 . 1 1 8 8 LYS N N 8 120.051 120.051 120.462 -0.411 19998
3508 1 19 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.609 -0.296 19998
3509 1 19 . 1 1 8 8 LYS C C 8 173.878 173.878 176.062 -2.184 19998
3510 1 19 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.195 0.375 19998
3511 1 19 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.072 -1.681 19998
3512 1 19 . 1 1 8 8 LYS H H 8 7.429 7.429 7.384 0.045 19998
3513 1 19 . 1 1 9 9 SER N N 9 117.004 117.004 117.234 -0.230 19998
3514 1 19 . 1 1 9 9 SER HA H 9 4.315 4.315 4.691 -0.376 19998
3515 1 19 . 1 1 9 9 SER C C 9 170.486 170.486 174.259 -3.773 19998
3516 1 19 . 1 1 9 9 SER CB C 9 63.355 63.355 62.931 0.424 19998
3517 1 19 . 1 1 9 9 SER H H 9 8.542 8.542 8.515 0.027 19998
3518 1 19 . 1 1 10 10 CYS N N 10 119.238 119.238 121.552 -2.314 19998
3519 1 19 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.791 0.042 19998
3520 1 19 . 1 1 10 10 CYS C C 10 168.106 168.106 173.599 -5.493 19998
3521 1 19 . 1 1 10 10 CYS CA C 10 53.907 53.907 56.027 -2.120 19998
3522 1 19 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.425 15.416 19998
3523 1 19 . 1 1 10 10 CYS H H 10 8.188 8.188 8.584 -0.396 19998
3524 1 19 . 1 1 11 11 ASN N N 11 119.594 119.594 118.929 0.665 19998
3525 1 19 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.202 -0.078 19998
3526 1 19 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.566 -1.090 19998
3527 1 19 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.305 -0.305 19998
3528 1 19 . 1 1 11 11 ASN H H 11 9.129 9.129 8.612 0.517 19998
3529 1 19 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.438 -0.590 19998
3530 1 19 . 1 1 12 12 PRO C C 12 174.197 174.197 178.369 -4.172 19998
3531 1 19 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.668 0.021 19998
3532 1 19 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.197 -0.314 19998
3533 1 19 . 1 1 13 13 SER N N 13 110.351 110.351 112.753 -2.402 19998
3534 1 19 . 1 1 13 13 SER HA H 13 4.394 4.394 4.238 0.156 19998
3535 1 19 . 1 1 13 13 SER C C 13 170.980 170.980 173.951 -2.971 19998
3536 1 19 . 1 1 13 13 SER CA C 13 59.326 59.326 60.090 -0.764 19998
3537 1 19 . 1 1 13 13 SER CB C 13 63.380 63.380 62.987 0.393 19998
3538 1 19 . 1 1 13 13 SER H H 13 7.785 7.785 8.426 -0.641 19998
3539 1 19 . 1 1 14 14 ASN N N 14 120.660 120.660 118.336 2.324 19998
3540 1 19 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.903 -0.265 19998
3541 1 19 . 1 1 14 14 ASN C C 14 171.412 171.412 173.445 -2.033 19998
3542 1 19 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.829 0.977 19998
3543 1 19 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.237 -1.427 19998
3544 1 19 . 1 1 14 14 ASN H H 14 7.613 7.613 7.753 -0.140 19998
3545 1 19 . 1 1 15 15 ASP N N 15 124.062 124.062 121.445 2.617 19998
3546 1 19 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.510 -0.400 19998
3547 1 19 . 1 1 15 15 ASP C C 15 174.918 174.918 175.575 -0.657 19998
3548 1 19 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.832 0.942 19998
3549 1 19 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.600 0.760 19998
3550 1 19 . 1 1 15 15 ASP H H 15 8.695 8.695 8.043 0.652 19998
3551 1 19 . 1 1 16 16 GLN N N 16 127.008 127.008 122.681 4.327 19998
3552 1 19 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.551 0.062 19998
3553 1 19 . 1 1 16 16 GLN C C 16 173.874 173.874 174.356 -0.482 19998
3554 1 19 . 1 1 16 16 GLN CA C 16 54.522 54.522 55.009 -0.487 19998
3555 1 19 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.570 -1.243 19998
3556 1 19 . 1 1 16 16 GLN H H 16 8.041 8.041 8.551 -0.510 19998
3557 1 19 . 1 1 17 17 CYS N N 17 122.234 122.234 119.006 3.228 19998
3558 1 19 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.814 0.169 19998
3559 1 19 . 1 1 17 17 CYS C C 17 173.908 173.908 174.896 -0.988 19998
3560 1 19 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.751 -1.265 19998
3561 1 19 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.572 8.334 19998
3562 1 19 . 1 1 17 17 CYS H H 17 9.314 9.314 8.175 1.139 19998
3563 1 19 . 1 1 18 18 CYS N N 18 118.883 118.883 122.717 -3.834 19998
3564 1 19 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.540 0.068 19998
3565 1 19 . 1 1 18 18 CYS C C 18 172.722 172.722 176.063 -3.341 19998
3566 1 19 . 1 1 18 18 CYS CA C 18 55.521 55.521 58.944 -3.423 19998
3567 1 19 . 1 1 18 18 CYS CB C 18 41.367 41.367 25.863 15.504 19998
3568 1 19 . 1 1 18 18 CYS H H 18 9.192 9.192 8.611 0.581 19998
3569 1 19 . 1 1 19 19 LYS N N 19 131.730 131.730 126.734 4.996 19998
3570 1 19 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.060 0.272 19998
3571 1 19 . 1 1 19 19 LYS C C 19 177.997 177.997 178.802 -0.805 19998
3572 1 19 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.786 -0.360 19998
3573 1 19 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.030 -0.711 19998
3574 1 19 . 1 1 19 19 LYS H H 19 8.890 8.890 8.399 0.491 19998
3575 1 19 . 1 1 20 20 SER N N 20 115.887 115.887 114.444 1.443 19998
3576 1 19 . 1 1 20 20 SER HA H 20 4.334 4.334 4.298 0.036 19998
3577 1 19 . 1 1 20 20 SER C C 20 172.946 172.946 175.385 -2.439 19998
3578 1 19 . 1 1 20 20 SER CA C 20 60.311 60.311 60.647 -0.336 19998
3579 1 19 . 1 1 20 20 SER CB C 20 62.327 62.327 62.386 -0.059 19998
3580 1 19 . 1 1 20 20 SER H H 20 8.856 8.856 8.635 0.221 19998
3581 1 19 . 1 1 21 21 SER N N 21 116.191 116.191 115.984 0.207 19998
3582 1 19 . 1 1 21 21 SER HA H 21 4.833 4.833 4.639 0.194 19998
3583 1 19 . 1 1 21 21 SER C C 21 170.505 170.505 172.944 -2.439 19998
3584 1 19 . 1 1 21 21 SER CA C 21 57.500 57.500 58.186 -0.686 19998
3585 1 19 . 1 1 21 21 SER CB C 21 63.852 63.852 63.597 0.255 19998
3586 1 19 . 1 1 21 21 SER H H 21 7.068 7.068 7.515 -0.447 19998
3587 1 19 . 1 1 22 22 SER N N 22 111.723 111.723 115.609 -3.886 19998
3588 1 19 . 1 1 22 22 SER HA H 22 4.099 4.099 4.105 -0.006 19998
3589 1 19 . 1 1 22 22 SER C C 22 170.369 170.369 172.834 -2.465 19998
3590 1 19 . 1 1 22 22 SER CA C 22 59.140 59.140 59.807 -0.667 19998
3591 1 19 . 1 1 22 22 SER CB C 22 61.339 61.339 61.335 0.004 19998
3592 1 19 . 1 1 22 22 SER H H 22 8.113 8.113 8.289 -0.176 19998
3593 1 19 . 1 1 23 23 LEU N N 23 115.988 115.988 118.943 -2.955 19998
3594 1 19 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.948 -0.050 19998
3595 1 19 . 1 1 23 23 LEU C C 23 173.712 173.712 175.570 -1.858 19998
3596 1 19 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.386 -0.303 19998
3597 1 19 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.365 0.697 19998
3598 1 19 . 1 1 23 23 LEU H H 23 7.111 7.111 7.504 -0.393 19998
3599 1 19 . 1 1 24 24 ALA N N 24 119.898 119.898 121.083 -1.185 19998
3600 1 19 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.568 -0.102 19998
3601 1 19 . 1 1 24 24 ALA C C 24 173.491 173.491 174.828 -1.337 19998
3602 1 19 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.722 -0.555 19998
3603 1 19 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.755 1.482 19998
3604 1 19 . 1 1 24 24 ALA H H 24 8.904 8.904 7.935 0.969 19998
3605 1 19 . 1 1 25 25 CYS N N 25 122.945 122.945 121.545 1.400 19998
3606 1 19 . 1 1 25 25 CYS HA H 25 4.452 4.452 5.087 -0.635 19998
3607 1 19 . 1 1 25 25 CYS C C 25 171.574 171.574 175.090 -3.516 19998
3608 1 19 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.756 -1.624 19998
3609 1 19 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.512 12.667 19998
3610 1 19 . 1 1 25 25 CYS H H 25 9.847 9.847 8.641 1.206 19998
3611 1 19 . 1 1 26 26 SER N N 26 122.285 122.285 122.668 -0.383 19998
3612 1 19 . 1 1 26 26 SER HA H 26 4.543 4.543 4.768 -0.225 19998
3613 1 19 . 1 1 26 26 SER CA C 26 57.773 57.773 57.703 0.070 19998
3614 1 19 . 1 1 26 26 SER CB C 26 63.789 63.789 65.621 -1.832 19998
3615 1 19 . 1 1 26 26 SER H H 26 7.791 7.791 8.298 -0.507 19998
3616 1 19 . 1 1 27 27 THR N N 27 122.390 122.390 120.868 1.522 19998
3617 1 19 . 1 1 27 27 THR HA H 27 3.778 3.778 4.242 -0.464 19998
3618 1 19 . 1 1 27 27 THR C C 27 172.781 172.781 175.027 -2.246 19998
3619 1 19 . 1 1 27 27 THR CA C 27 65.390 65.390 64.655 0.735 19998
3620 1 19 . 1 1 27 27 THR CB C 27 68.458 68.458 68.831 -0.373 19998
3621 1 19 . 1 1 27 27 THR H H 27 8.874 8.874 8.660 0.214 19998
3622 1 19 . 1 1 28 28 LYS N N 28 118.883 118.883 121.713 -2.830 19998
3623 1 19 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.127 -0.096 19998
3624 1 19 . 1 1 28 28 LYS C C 28 174.613 174.613 176.659 -2.046 19998
3625 1 19 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.450 -0.651 19998
3626 1 19 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.216 0.948 19998
3627 1 19 . 1 1 28 28 LYS H H 28 7.609 7.609 8.027 -0.418 19998
3628 1 19 . 1 1 29 29 HIS N N 29 113.398 113.398 115.051 -1.653 19998
3629 1 19 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.595 -0.311 19998
3630 1 19 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.605 -0.019 19998
3631 1 19 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.666 -1.603 19998
3632 1 19 . 1 1 29 29 HIS H H 29 7.450 7.450 8.008 -0.558 19998
3633 1 19 . 1 1 30 30 LYS N N 30 116.344 116.344 118.999 -2.655 19998
3634 1 19 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.216 -0.328 19998
3635 1 19 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.336 0.165 19998
3636 1 19 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.634 -1.025 19998
3637 1 19 . 1 1 30 30 LYS H H 30 8.261 8.261 8.429 -0.168 19998
3638 1 19 . 1 1 31 31 TRP N N 31 117.766 117.766 114.955 2.811 19998
3639 1 19 . 1 1 31 31 TRP HA H 31 5.477 5.477 4.930 0.547 19998
3640 1 19 . 1 1 31 31 TRP C C 31 174.754 174.754 174.159 0.595 19998
3641 1 19 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.342 1.414 19998
3642 1 19 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.849 1.127 19998
3643 1 19 . 1 1 31 31 TRP H H 31 8.483 8.483 7.736 0.747 19998
3644 1 19 . 1 1 32 32 CYS N N 32 118.984 118.984 122.746 -3.762 19998
3645 1 19 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.368 0.379 19998
3646 1 19 . 1 1 32 32 CYS C C 32 171.472 171.472 174.638 -3.166 19998
3647 1 19 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.090 -4.357 19998
3648 1 19 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.662 14.862 19998
3649 1 19 . 1 1 32 32 CYS H H 32 8.474 8.474 8.384 0.090 19998
3650 1 19 . 1 1 33 33 LYS N N 33 124.672 124.672 123.892 0.780 19998
3651 1 19 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.135 0.582 19998
3652 1 19 . 1 1 33 33 LYS C C 33 172.236 172.236 175.443 -3.207 19998
3653 1 19 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.081 0.649 19998
3654 1 19 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.968 1.461 19998
3655 1 19 . 1 1 33 33 LYS H H 33 9.027 9.027 8.390 0.637 19998
3656 1 19 . 1 1 34 34 TYR N N 34 120.102 120.102 122.886 -2.784 19998
3657 1 19 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.547 0.331 19998
3658 1 19 . 1 1 34 34 TYR C C 34 174.034 174.034 176.844 -2.810 19998
3659 1 19 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.558 0.704 19998
3660 1 19 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.891 0.742 19998
3661 1 19 . 1 1 34 34 TYR H H 34 8.092 8.092 8.711 -0.619 19998
3662 1 19 . 1 1 35 35 GLU N N 35 124.362 124.362 125.623 -1.261 19998
3663 1 19 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.383 0.079 19998
3664 1 19 . 1 1 35 35 GLU C C 35 172.127 172.127 175.328 -3.201 19998
3665 1 19 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.873 -0.606 19998
3666 1 19 . 1 1 35 35 GLU CB C 35 30.852 30.852 29.372 1.480 19998
3667 1 19 . 1 1 35 35 GLU H H 35 8.754 8.754 8.632 0.122 19998
3668 1 20 . 1 1 2 2 ALA N N 2 123.910 123.910 125.302 -1.392 19998
3669 1 20 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.771 -0.307 19998
3670 1 20 . 1 1 2 2 ALA C C 2 174.673 174.673 176.313 -1.640 19998
3671 1 20 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.208 -0.040 19998
3672 1 20 . 1 1 2 2 ALA CB C 2 19.690 19.690 19.187 0.503 19998
3673 1 20 . 1 1 2 2 ALA H H 2 8.561 8.561 8.449 0.112 19998
3674 1 20 . 1 1 3 3 CYS N N 3 117.207 117.207 118.822 -1.615 19998
3675 1 20 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.646 0.319 19998
3676 1 20 . 1 1 3 3 CYS C C 3 170.808 170.808 172.669 -1.861 19998
3677 1 20 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.321 -2.567 19998
3678 1 20 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.195 14.872 19998
3679 1 20 . 1 1 3 3 CYS H H 3 8.335 8.335 8.140 0.195 19998
3680 1 20 . 1 1 4 4 LEU N N 4 121.828 121.828 122.800 -0.972 19998
3681 1 20 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.613 -0.268 19998
3682 1 20 . 1 1 4 4 LEU C C 4 172.234 172.234 177.216 -4.982 19998
3683 1 20 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.057 0.166 19998
3684 1 20 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.795 0.783 19998
3685 1 20 . 1 1 4 4 LEU H H 4 8.815 8.815 8.393 0.422 19998
3686 1 20 . 1 1 5 5 GLY N N 5 107.508 107.508 110.439 -2.931 19998
3687 1 20 . 1 1 5 5 GLY C C 5 169.768 169.768 173.398 -3.630 19998
3688 1 20 . 1 1 5 5 GLY CA C 5 43.052 43.052 43.948 -0.896 19998
3689 1 20 . 1 1 5 5 GLY H H 5 7.999 7.999 8.307 -0.308 19998
3690 1 20 . 1 1 6 6 PHE N N 6 116.953 116.953 120.412 -3.459 19998
3691 1 20 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.971 -0.352 19998
3692 1 20 . 1 1 6 6 PHE C C 6 174.967 174.967 176.625 -1.658 19998
3693 1 20 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.851 1.250 19998
3694 1 20 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.092 0.414 19998
3695 1 20 . 1 1 6 6 PHE H H 6 8.392 8.392 8.463 -0.071 19998
3696 1 20 . 1 1 7 7 GLY N N 7 115.074 115.074 114.806 0.268 19998
3697 1 20 . 1 1 7 7 GLY C C 7 171.017 171.017 173.860 -2.843 19998
3698 1 20 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.844 -0.000 19998
3699 1 20 . 1 1 7 7 GLY H H 7 8.645 8.645 7.357 1.288 19998
3700 1 20 . 1 1 8 8 LYS N N 8 120.051 120.051 120.465 -0.414 19998
3701 1 20 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.616 -0.303 19998
3702 1 20 . 1 1 8 8 LYS C C 8 173.878 173.878 176.025 -2.147 19998
3703 1 20 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.124 0.446 19998
3704 1 20 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.126 -1.734 19998
3705 1 20 . 1 1 8 8 LYS H H 8 7.429 7.429 7.374 0.055 19998
3706 1 20 . 1 1 9 9 SER N N 9 117.004 117.004 117.549 -0.545 19998
3707 1 20 . 1 1 9 9 SER HA H 9 4.315 4.315 4.662 -0.347 19998
3708 1 20 . 1 1 9 9 SER C C 9 170.486 170.486 174.285 -3.799 19998
3709 1 20 . 1 1 9 9 SER CB C 9 63.355 63.355 62.917 0.438 19998
3710 1 20 . 1 1 9 9 SER H H 9 8.542 8.542 8.529 0.013 19998
3711 1 20 . 1 1 10 10 CYS N N 10 119.238 119.238 121.009 -1.771 19998
3712 1 20 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.768 0.065 19998
3713 1 20 . 1 1 10 10 CYS C C 10 168.106 168.106 173.000 -4.894 19998
3714 1 20 . 1 1 10 10 CYS CA C 10 53.907 53.907 55.903 -1.996 19998
3715 1 20 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.219 15.622 19998
3716 1 20 . 1 1 10 10 CYS H H 10 8.188 8.188 8.373 -0.185 19998
3717 1 20 . 1 1 11 11 ASN N N 11 119.594 119.594 118.932 0.662 19998
3718 1 20 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.191 -0.067 19998
3719 1 20 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.756 -1.280 19998
3720 1 20 . 1 1 11 11 ASN CB C 11 40.000 40.000 41.065 -1.065 19998
3721 1 20 . 1 1 11 11 ASN H H 11 9.129 9.129 8.617 0.512 19998
3722 1 20 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.474 -0.626 19998
3723 1 20 . 1 1 12 12 PRO C C 12 174.197 174.197 178.313 -4.116 19998
3724 1 20 . 1 1 12 12 PRO CA C 12 64.689 64.689 65.000 -0.311 19998
3725 1 20 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.242 -0.360 19998
3726 1 20 . 1 1 13 13 SER N N 13 110.351 110.351 112.572 -2.221 19998
3727 1 20 . 1 1 13 13 SER HA H 13 4.394 4.394 4.249 0.145 19998
3728 1 20 . 1 1 13 13 SER C C 13 170.980 170.980 174.167 -3.187 19998
3729 1 20 . 1 1 13 13 SER CA C 13 59.326 59.326 59.963 -0.637 19998
3730 1 20 . 1 1 13 13 SER CB C 13 63.380 63.380 63.140 0.240 19998
3731 1 20 . 1 1 13 13 SER H H 13 7.785 7.785 8.403 -0.618 19998
3732 1 20 . 1 1 14 14 ASN N N 14 120.660 120.660 117.936 2.724 19998
3733 1 20 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.853 -0.215 19998
3734 1 20 . 1 1 14 14 ASN C C 14 171.412 171.412 173.484 -2.072 19998
3735 1 20 . 1 1 14 14 ASN CA C 14 52.806 52.806 52.082 0.724 19998
3736 1 20 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.305 -1.495 19998
3737 1 20 . 1 1 14 14 ASN H H 14 7.613 7.613 7.822 -0.209 19998
3738 1 20 . 1 1 15 15 ASP N N 15 124.062 124.062 121.443 2.619 19998
3739 1 20 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.546 -0.436 19998
3740 1 20 . 1 1 15 15 ASP C C 15 174.918 174.918 175.670 -0.752 19998
3741 1 20 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.762 1.012 19998
3742 1 20 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.510 0.850 19998
3743 1 20 . 1 1 15 15 ASP H H 15 8.695 8.695 8.045 0.650 19998
3744 1 20 . 1 1 16 16 GLN N N 16 127.008 127.008 123.336 3.672 19998
3745 1 20 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.531 0.082 19998
3746 1 20 . 1 1 16 16 GLN C C 16 173.874 173.874 174.364 -0.490 19998
3747 1 20 . 1 1 16 16 GLN CA C 16 54.522 54.522 55.180 -0.658 19998
3748 1 20 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.700 -1.373 19998
3749 1 20 . 1 1 16 16 GLN H H 16 8.041 8.041 8.610 -0.569 19998
3750 1 20 . 1 1 17 17 CYS N N 17 122.234 122.234 119.058 3.176 19998
3751 1 20 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.810 0.173 19998
3752 1 20 . 1 1 17 17 CYS C C 17 173.908 173.908 174.847 -0.939 19998
3753 1 20 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.731 -1.245 19998
3754 1 20 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.491 8.415 19998
3755 1 20 . 1 1 17 17 CYS H H 17 9.314 9.314 8.128 1.186 19998
3756 1 20 . 1 1 18 18 CYS N N 18 118.883 118.883 122.649 -3.766 19998
3757 1 20 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.525 0.083 19998
3758 1 20 . 1 1 18 18 CYS C C 18 172.722 172.722 176.009 -3.287 19998
3759 1 20 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.143 -3.622 19998
3760 1 20 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.251 15.116 19998
3761 1 20 . 1 1 18 18 CYS H H 18 9.192 9.192 8.576 0.616 19998
3762 1 20 . 1 1 19 19 LYS N N 19 131.730 131.730 126.515 5.215 19998
3763 1 20 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.112 0.220 19998
3764 1 20 . 1 1 19 19 LYS C C 19 177.997 177.997 178.842 -0.845 19998
3765 1 20 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.919 -0.493 19998
3766 1 20 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.248 -0.929 19998
3767 1 20 . 1 1 19 19 LYS H H 19 8.890 8.890 8.592 0.298 19998
3768 1 20 . 1 1 20 20 SER N N 20 115.887 115.887 114.711 1.176 19998
3769 1 20 . 1 1 20 20 SER HA H 20 4.334 4.334 4.238 0.096 19998
3770 1 20 . 1 1 20 20 SER C C 20 172.946 172.946 175.334 -2.388 19998
3771 1 20 . 1 1 20 20 SER CA C 20 60.311 60.311 60.718 -0.407 19998
3772 1 20 . 1 1 20 20 SER CB C 20 62.327 62.327 62.901 -0.574 19998
3773 1 20 . 1 1 20 20 SER H H 20 8.856 8.856 8.742 0.114 19998
3774 1 20 . 1 1 21 21 SER N N 21 116.191 116.191 114.423 1.768 19998
3775 1 20 . 1 1 21 21 SER HA H 21 4.833 4.833 4.654 0.179 19998
3776 1 20 . 1 1 21 21 SER C C 21 170.505 170.505 173.308 -2.803 19998
3777 1 20 . 1 1 21 21 SER CA C 21 57.500 57.500 57.889 -0.389 19998
3778 1 20 . 1 1 21 21 SER CB C 21 63.852 63.852 63.357 0.495 19998
3779 1 20 . 1 1 21 21 SER H H 21 7.068 7.068 7.599 -0.531 19998
3780 1 20 . 1 1 22 22 SER N N 22 111.723 111.723 115.616 -3.893 19998
3781 1 20 . 1 1 22 22 SER HA H 22 4.099 4.099 4.121 -0.022 19998
3782 1 20 . 1 1 22 22 SER C C 22 170.369 170.369 173.110 -2.741 19998
3783 1 20 . 1 1 22 22 SER CA C 22 59.140 59.140 59.758 -0.619 19998
3784 1 20 . 1 1 22 22 SER CB C 22 61.339 61.339 61.425 -0.085 19998
3785 1 20 . 1 1 22 22 SER H H 22 8.113 8.113 8.204 -0.091 19998
3786 1 20 . 1 1 23 23 LEU N N 23 115.988 115.988 118.522 -2.534 19998
3787 1 20 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.913 -0.015 19998
3788 1 20 . 1 1 23 23 LEU C C 23 173.712 173.712 175.662 -1.950 19998
3789 1 20 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.306 -0.223 19998
3790 1 20 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.612 0.450 19998
3791 1 20 . 1 1 23 23 LEU H H 23 7.111 7.111 7.560 -0.449 19998
3792 1 20 . 1 1 24 24 ALA N N 24 119.898 119.898 120.820 -0.922 19998
3793 1 20 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.654 -0.188 19998
3794 1 20 . 1 1 24 24 ALA C C 24 173.491 173.491 174.715 -1.224 19998
3795 1 20 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.761 -0.594 19998
3796 1 20 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.640 1.597 19998
3797 1 20 . 1 1 24 24 ALA H H 24 8.904 8.904 7.798 1.106 19998
3798 1 20 . 1 1 25 25 CYS N N 25 122.945 122.945 121.122 1.823 19998
3799 1 20 . 1 1 25 25 CYS HA H 25 4.452 4.452 4.950 -0.498 19998
3800 1 20 . 1 1 25 25 CYS C C 25 171.574 171.574 175.186 -3.612 19998
3801 1 20 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.665 -1.533 19998
3802 1 20 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.598 12.581 19998
3803 1 20 . 1 1 25 25 CYS H H 25 9.847 9.847 8.684 1.163 19998
3804 1 20 . 1 1 26 26 SER N N 26 122.285 122.285 122.918 -0.633 19998
3805 1 20 . 1 1 26 26 SER HA H 26 4.543 4.543 4.725 -0.182 19998
3806 1 20 . 1 1 26 26 SER CA C 26 57.773 57.773 57.089 0.684 19998
3807 1 20 . 1 1 26 26 SER CB C 26 63.789 63.789 65.762 -1.973 19998
3808 1 20 . 1 1 26 26 SER H H 26 7.791 7.791 8.415 -0.624 19998
3809 1 20 . 1 1 27 27 THR N N 27 122.390 122.390 121.181 1.209 19998
3810 1 20 . 1 1 27 27 THR HA H 27 3.778 3.778 4.198 -0.420 19998
3811 1 20 . 1 1 27 27 THR C C 27 172.781 172.781 174.967 -2.186 19998
3812 1 20 . 1 1 27 27 THR CA C 27 65.390 65.390 64.518 0.872 19998
3813 1 20 . 1 1 27 27 THR CB C 27 68.458 68.458 68.832 -0.374 19998
3814 1 20 . 1 1 27 27 THR H H 27 8.874 8.874 8.711 0.163 19998
3815 1 20 . 1 1 28 28 LYS N N 28 118.883 118.883 121.649 -2.766 19998
3816 1 20 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.126 -0.095 19998
3817 1 20 . 1 1 28 28 LYS C C 28 174.613 174.613 176.802 -2.189 19998
3818 1 20 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.242 -0.443 19998
3819 1 20 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.234 0.930 19998
3820 1 20 . 1 1 28 28 LYS H H 28 7.609 7.609 7.981 -0.372 19998
3821 1 20 . 1 1 29 29 HIS N N 29 113.398 113.398 115.430 -2.032 19998
3822 1 20 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.603 -0.319 19998
3823 1 20 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.653 -0.067 19998
3824 1 20 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.416 -1.354 19998
3825 1 20 . 1 1 29 29 HIS H H 29 7.450 7.450 7.939 -0.489 19998
3826 1 20 . 1 1 30 30 LYS N N 30 116.344 116.344 118.907 -2.563 19998
3827 1 20 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.217 -0.329 19998
3828 1 20 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.327 0.173 19998
3829 1 20 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.695 -1.086 19998
3830 1 20 . 1 1 30 30 LYS H H 30 8.261 8.261 8.420 -0.159 19998
3831 1 20 . 1 1 31 31 TRP N N 31 117.766 117.766 114.903 2.863 19998
3832 1 20 . 1 1 31 31 TRP HA H 31 5.477 5.477 4.994 0.483 19998
3833 1 20 . 1 1 31 31 TRP C C 31 174.754 174.754 174.316 0.438 19998
3834 1 20 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.321 1.435 19998
3835 1 20 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.770 1.206 19998
3836 1 20 . 1 1 31 31 TRP H H 31 8.483 8.483 7.685 0.798 19998
3837 1 20 . 1 1 32 32 CYS N N 32 118.984 118.984 123.149 -4.165 19998
3838 1 20 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.417 0.330 19998
3839 1 20 . 1 1 32 32 CYS C C 32 171.472 171.472 174.689 -3.217 19998
3840 1 20 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.206 -4.473 19998
3841 1 20 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.598 14.926 19998
3842 1 20 . 1 1 32 32 CYS H H 32 8.474 8.474 8.392 0.082 19998
3843 1 20 . 1 1 33 33 LYS N N 33 124.672 124.672 123.911 0.761 19998
3844 1 20 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.119 0.598 19998
3845 1 20 . 1 1 33 33 LYS C C 33 172.236 172.236 175.458 -3.222 19998
3846 1 20 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.062 0.668 19998
3847 1 20 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.987 1.442 19998
3848 1 20 . 1 1 33 33 LYS H H 33 9.027 9.027 8.183 0.844 19998
3849 1 20 . 1 1 34 34 TYR N N 34 120.102 120.102 122.953 -2.851 19998
3850 1 20 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.548 0.330 19998
3851 1 20 . 1 1 34 34 TYR C C 34 174.034 174.034 176.843 -2.809 19998
3852 1 20 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.667 0.595 19998
3853 1 20 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.877 0.756 19998
3854 1 20 . 1 1 34 34 TYR H H 34 8.092 8.092 8.720 -0.628 19998
3855 1 20 . 1 1 35 35 GLU N N 35 124.362 124.362 126.280 -1.918 19998
3856 1 20 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.421 0.041 19998
3857 1 20 . 1 1 35 35 GLU C C 35 172.127 172.127 175.201 -3.074 19998
3858 1 20 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.773 -0.506 19998
3859 1 20 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.098 0.754 19998
3860 1 20 . 1 1 35 35 GLU H H 35 8.754 8.754 8.561 0.193 19998
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 33 2.540 0.522 2.524 19998
2 1 1 "Average Difference" HA 36 0.322 0.056 0.322 19998
3 1 1 "Average Difference" C 30 2.799 2.497 1.286 19998
4 1 1 "Average Difference" CA 33 1.392 0.481 1.327 19998
5 1 1 "Average Difference" CB 32 6.084 -2.583 5.597 19998
6 1 1 "Average Difference" HN 33 0.566 -0.138 0.557 19998
7 1 2 "Average Difference" N 33 2.598 0.422 2.604 19998
8 1 2 "Average Difference" HA 36 0.313 0.058 0.312 19998
9 1 2 "Average Difference" C 30 2.761 2.463 1.268 19998
10 1 2 "Average Difference" CA 33 1.346 0.384 1.310 19998
11 1 2 "Average Difference" CB 32 6.053 -2.525 5.589 19998
12 1 2 "Average Difference" HN 33 0.562 -0.151 0.550 19998
13 1 3 "Average Difference" N 33 2.501 0.342 2.516 19998
14 1 3 "Average Difference" HA 36 0.332 0.048 0.333 19998
15 1 3 "Average Difference" C 30 2.838 2.521 1.326 19998
16 1 3 "Average Difference" CA 33 1.357 0.429 1.308 19998
17 1 3 "Average Difference" CB 32 6.090 -2.580 5.605 19998
18 1 3 "Average Difference" HN 33 0.572 -0.144 0.562 19998
19 1 4 "Average Difference" N 33 2.341 0.441 2.335 19998
20 1 4 "Average Difference" HA 36 0.316 0.056 0.316 19998
21 1 4 "Average Difference" C 30 2.800 2.470 1.340 19998
22 1 4 "Average Difference" CA 33 1.403 0.456 1.348 19998
23 1 4 "Average Difference" CB 32 6.069 -2.506 5.616 19998
24 1 4 "Average Difference" HN 33 0.578 -0.150 0.567 19998
25 1 5 "Average Difference" N 33 2.591 0.500 2.582 19998
26 1 5 "Average Difference" HA 36 0.327 0.062 0.326 19998
27 1 5 "Average Difference" C 30 2.866 2.549 1.333 19998
28 1 5 "Average Difference" CA 33 1.369 0.430 1.320 19998
29 1 5 "Average Difference" CB 32 6.060 -2.527 5.596 19998
30 1 5 "Average Difference" HN 33 0.583 -0.139 0.575 19998
31 1 6 "Average Difference" N 33 2.416 0.390 2.422 19998
32 1 6 "Average Difference" HA 36 0.320 0.070 0.317 19998
33 1 6 "Average Difference" C 30 2.784 2.466 1.314 19998
34 1 6 "Average Difference" CA 33 1.399 0.417 1.357 19998
35 1 6 "Average Difference" CB 32 6.065 -2.537 5.597 19998
36 1 6 "Average Difference" HN 33 0.573 -0.145 0.563 19998
37 1 7 "Average Difference" N 33 2.436 0.350 2.448 19998
38 1 7 "Average Difference" HA 36 0.326 0.065 0.324 19998
39 1 7 "Average Difference" C 30 2.825 2.512 1.313 19998
40 1 7 "Average Difference" CA 33 1.389 0.456 1.332 19998
41 1 7 "Average Difference" CB 32 6.064 -2.519 5.605 19998
42 1 7 "Average Difference" HN 33 0.579 -0.118 0.576 19998
43 1 8 "Average Difference" N 33 2.543 0.365 2.556 19998
44 1 8 "Average Difference" HA 36 0.325 0.075 0.321 19998
45 1 8 "Average Difference" C 30 2.759 2.441 1.308 19998
46 1 8 "Average Difference" CA 33 1.360 0.419 1.314 19998
47 1 8 "Average Difference" CB 32 6.047 -2.524 5.583 19998
48 1 8 "Average Difference" HN 33 0.575 -0.161 0.561 19998
49 1 9 "Average Difference" N 33 2.612 0.550 2.593 19998
50 1 9 "Average Difference" HA 36 0.317 0.068 0.314 19998
51 1 9 "Average Difference" C 30 2.802 2.484 1.318 19998
52 1 9 "Average Difference" CA 33 1.392 0.404 1.352 19998
53 1 9 "Average Difference" CB 32 6.048 -2.569 5.563 19998
54 1 9 "Average Difference" HN 33 0.567 -0.146 0.556 19998
55 1 10 "Average Difference" N 33 2.572 0.600 2.540 19998
56 1 10 "Average Difference" HA 36 0.323 0.077 0.318 19998
57 1 10 "Average Difference" C 30 2.799 2.497 1.286 19998
58 1 10 "Average Difference" CA 33 1.378 0.385 1.344 19998
59 1 10 "Average Difference" CB 32 6.015 -2.442 5.585 19998
60 1 10 "Average Difference" HN 33 0.578 -0.132 0.572 19998
61 1 11 "Average Difference" N 33 2.478 0.586 2.445 19998
62 1 11 "Average Difference" HA 36 0.328 0.076 0.323 19998
63 1 11 "Average Difference" C 30 2.819 2.509 1.305 19998
64 1 11 "Average Difference" CA 33 1.403 0.405 1.364 19998
65 1 11 "Average Difference" CB 32 6.073 -2.504 5.622 19998
66 1 11 "Average Difference" HN 33 0.583 -0.152 0.572 19998
67 1 12 "Average Difference" N 33 2.568 0.418 2.573 19998
68 1 12 "Average Difference" HA 36 0.322 0.071 0.319 19998
69 1 12 "Average Difference" C 30 2.848 2.507 1.374 19998
70 1 12 "Average Difference" CA 33 1.364 0.362 1.336 19998
71 1 12 "Average Difference" CB 32 6.060 -2.548 5.586 19998
72 1 12 "Average Difference" HN 33 0.587 -0.135 0.580 19998
73 1 13 "Average Difference" N 33 2.515 0.472 2.508 19998
74 1 13 "Average Difference" HA 36 0.326 0.070 0.323 19998
75 1 13 "Average Difference" C 30 2.737 2.437 1.268 19998
76 1 13 "Average Difference" CA 33 1.346 0.438 1.293 19998
77 1 13 "Average Difference" CB 32 6.043 -2.504 5.588 19998
78 1 13 "Average Difference" HN 33 0.581 -0.140 0.572 19998
79 1 14 "Average Difference" N 33 2.535 0.594 2.503 19998
80 1 14 "Average Difference" HA 36 0.315 0.061 0.313 19998
81 1 14 "Average Difference" C 30 2.775 2.458 1.309 19998
82 1 14 "Average Difference" CA 33 1.365 0.430 1.316 19998
83 1 14 "Average Difference" CB 32 6.074 -2.485 5.632 19998
84 1 14 "Average Difference" HN 33 0.593 -0.163 0.579 19998
85 1 15 "Average Difference" N 33 2.558 0.377 2.569 19998
86 1 15 "Average Difference" HA 36 0.315 0.066 0.313 19998
87 1 15 "Average Difference" C 30 2.829 2.511 1.327 19998
88 1 15 "Average Difference" CA 33 1.367 0.398 1.328 19998
89 1 15 "Average Difference" CB 32 6.003 -2.521 5.535 19998
90 1 15 "Average Difference" HN 33 0.591 -0.150 0.581 19998
91 1 16 "Average Difference" N 33 2.676 0.607 2.647 19998
92 1 16 "Average Difference" HA 36 0.320 0.067 0.317 19998
93 1 16 "Average Difference" C 30 2.815 2.524 1.267 19998
94 1 16 "Average Difference" CA 33 1.306 0.431 1.252 19998
95 1 16 "Average Difference" CB 32 6.061 -2.510 5.605 19998
96 1 16 "Average Difference" HN 33 0.588 -0.156 0.576 19998
97 1 17 "Average Difference" N 33 2.602 0.342 2.620 19998
98 1 17 "Average Difference" HA 36 0.307 0.065 0.304 19998
99 1 17 "Average Difference" C 30 2.817 2.504 1.311 19998
100 1 17 "Average Difference" CA 33 1.351 0.372 1.319 19998
101 1 17 "Average Difference" CB 32 6.018 -2.543 5.541 19998
102 1 17 "Average Difference" HN 33 0.576 -0.147 0.565 19998
103 1 18 "Average Difference" N 33 2.619 0.517 2.607 19998
104 1 18 "Average Difference" HA 36 0.324 0.069 0.321 19998
105 1 18 "Average Difference" C 30 2.780 2.465 1.307 19998
106 1 18 "Average Difference" CA 33 1.385 0.476 1.321 19998
107 1 18 "Average Difference" CB 32 6.074 -2.569 5.593 19998
108 1 18 "Average Difference" HN 33 0.560 -0.144 0.550 19998
109 1 19 "Average Difference" N 33 2.443 0.418 2.444 19998
110 1 19 "Average Difference" HA 36 0.321 0.065 0.319 19998
111 1 19 "Average Difference" C 30 2.776 2.457 1.314 19998
112 1 19 "Average Difference" CA 33 1.332 0.446 1.275 19998
113 1 19 "Average Difference" CB 32 6.052 -2.589 5.558 19998
114 1 19 "Average Difference" HN 33 0.561 -0.133 0.553 19998
115 1 20 "Average Difference" N 33 2.479 0.467 2.472 19998
116 1 20 "Average Difference" HA 36 0.313 0.064 0.311 19998
117 1 20 "Average Difference" C 30 2.768 2.471 1.269 19998
118 1 20 "Average Difference" CA 33 1.351 0.454 1.292 19998
119 1 20 "Average Difference" CB 32 6.054 -2.500 5.602 19998
120 1 20 "Average Difference" HN 33 0.578 -0.136 0.570 19998
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 19998
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 ALA N N 2 123.910 123.910 124.261 -0.351 19998
2 1 . 1 1 2 2 ALA HA H 2 4.464 4.464 4.796 -0.332 19998
3 1 . 1 1 2 2 ALA C C 2 174.673 174.673 176.318 -1.645 19998
4 1 . 1 1 2 2 ALA CA C 2 52.168 52.168 52.190 -0.022 19998
5 1 . 1 1 2 2 ALA CB C 2 19.690 19.690 18.864 0.826 19998
6 1 . 1 1 2 2 ALA H H 2 8.561 8.561 8.233 0.329 19998
7 1 . 1 1 3 3 CYS N N 3 117.207 117.207 118.861 -1.654 19998
8 1 . 1 1 3 3 CYS HA H 3 4.965 4.965 4.667 0.298 19998
9 1 . 1 1 3 3 CYS C C 3 170.808 170.808 172.624 -1.816 19998
10 1 . 1 1 3 3 CYS CA C 3 54.754 54.754 57.290 -2.536 19998
11 1 . 1 1 3 3 CYS CB C 3 44.067 44.067 29.157 14.910 19998
12 1 . 1 1 3 3 CYS H H 3 8.335 8.335 8.214 0.121 19998
13 1 . 1 1 4 4 LEU N N 4 121.828 121.828 122.730 -0.902 19998
14 1 . 1 1 4 4 LEU HA H 4 4.345 4.345 4.613 -0.268 19998
15 1 . 1 1 4 4 LEU C C 4 172.234 172.234 177.202 -4.968 19998
16 1 . 1 1 4 4 LEU CA C 4 54.223 54.223 54.031 0.191 19998
17 1 . 1 1 4 4 LEU CB C 4 44.578 44.578 43.890 0.688 19998
18 1 . 1 1 4 4 LEU H H 4 8.815 8.815 8.378 0.437 19998
19 1 . 1 1 5 5 GLY N N 5 107.508 107.508 110.361 -2.853 19998
20 1 . 1 1 5 5 GLY C C 5 169.768 169.768 173.413 -3.645 19998
21 1 . 1 1 5 5 GLY CA C 5 43.052 43.052 43.962 -0.910 19998
22 1 . 1 1 5 5 GLY H H 5 7.999 7.999 8.318 -0.319 19998
23 1 . 1 1 6 6 PHE N N 6 116.953 116.953 120.448 -3.495 19998
24 1 . 1 1 6 6 PHE HA H 6 3.619 3.619 3.988 -0.369 19998
25 1 . 1 1 6 6 PHE C C 6 174.967 174.967 177.025 -2.058 19998
26 1 . 1 1 6 6 PHE CA C 6 60.101 60.101 58.684 1.417 19998
27 1 . 1 1 6 6 PHE CB C 6 39.506 39.506 39.127 0.379 19998
28 1 . 1 1 6 6 PHE H H 6 8.392 8.392 8.362 0.030 19998
29 1 . 1 1 7 7 GLY N N 7 115.074 115.074 114.963 0.111 19998
30 1 . 1 1 7 7 GLY C C 7 171.017 171.017 173.684 -2.667 19998
31 1 . 1 1 7 7 GLY CA C 7 44.844 44.844 44.783 0.061 19998
32 1 . 1 1 7 7 GLY H H 7 8.645 8.645 7.473 1.172 19998
33 1 . 1 1 8 8 LYS N N 8 120.051 120.051 120.661 -0.610 19998
34 1 . 1 1 8 8 LYS HA H 8 4.313 4.313 4.626 -0.313 19998
35 1 . 1 1 8 8 LYS C C 8 173.878 173.878 175.997 -2.119 19998
36 1 . 1 1 8 8 LYS CA C 8 54.570 54.570 54.162 0.408 19998
37 1 . 1 1 8 8 LYS CB C 8 32.391 32.391 34.173 -1.782 19998
38 1 . 1 1 8 8 LYS H H 8 7.429 7.429 7.375 0.054 19998
39 1 . 1 1 9 9 SER N N 9 117.004 117.004 117.099 -0.095 19998
40 1 . 1 1 9 9 SER HA H 9 4.315 4.315 4.665 -0.350 19998
41 1 . 1 1 9 9 SER C C 9 170.486 170.486 174.425 -3.939 19998
42 1 . 1 1 9 9 SER CB C 9 63.355 63.355 62.678 0.677 19998
43 1 . 1 1 9 9 SER H H 9 8.542 8.542 8.504 0.038 19998
44 1 . 1 1 10 10 CYS N N 10 119.238 119.238 121.266 -2.028 19998
45 1 . 1 1 10 10 CYS HA H 10 4.833 4.833 4.756 0.077 19998
46 1 . 1 1 10 10 CYS C C 10 168.106 168.106 173.410 -5.304 19998
47 1 . 1 1 10 10 CYS CA C 10 53.907 53.907 56.029 -2.122 19998
48 1 . 1 1 10 10 CYS CB C 10 45.841 45.841 30.338 15.503 19998
49 1 . 1 1 10 10 CYS H H 10 8.188 8.188 8.401 -0.213 19998
50 1 . 1 1 11 11 ASN N N 11 119.594 119.594 118.933 0.661 19998
51 1 . 1 1 11 11 ASN HA H 11 5.124 5.124 5.199 -0.075 19998
52 1 . 1 1 11 11 ASN CA C 11 48.476 48.476 49.641 -1.165 19998
53 1 . 1 1 11 11 ASN CB C 11 40.000 40.000 40.641 -0.641 19998
54 1 . 1 1 11 11 ASN H H 11 9.129 9.129 8.614 0.515 19998
55 1 . 1 1 12 12 PRO HA H 12 3.848 3.848 4.453 -0.605 19998
56 1 . 1 1 12 12 PRO C C 12 174.197 174.197 178.310 -4.113 19998
57 1 . 1 1 12 12 PRO CA C 12 64.689 64.689 64.818 -0.129 19998
58 1 . 1 1 12 12 PRO CB C 12 31.883 31.883 32.206 -0.323 19998
59 1 . 1 1 13 13 SER N N 13 110.351 110.351 112.622 -2.271 19998
60 1 . 1 1 13 13 SER HA H 13 4.394 4.394 4.246 0.148 19998
61 1 . 1 1 13 13 SER C C 13 170.980 170.980 174.063 -3.083 19998
62 1 . 1 1 13 13 SER CA C 13 59.326 59.326 60.039 -0.713 19998
63 1 . 1 1 13 13 SER CB C 13 63.380 63.380 63.021 0.359 19998
64 1 . 1 1 13 13 SER H H 13 7.785 7.785 8.423 -0.638 19998
65 1 . 1 1 14 14 ASN N N 14 120.660 120.660 118.225 2.435 19998
66 1 . 1 1 14 14 ASN HA H 14 4.638 4.638 4.864 -0.226 19998
67 1 . 1 1 14 14 ASN C C 14 171.412 171.412 173.499 -2.087 19998
68 1 . 1 1 14 14 ASN CA C 14 52.806 52.806 51.935 0.871 19998
69 1 . 1 1 14 14 ASN CB C 14 37.810 37.810 39.192 -1.383 19998
70 1 . 1 1 14 14 ASN H H 14 7.613 7.613 7.776 -0.163 19998
71 1 . 1 1 15 15 ASP N N 15 124.062 124.062 121.493 2.569 19998
72 1 . 1 1 15 15 ASP HA H 15 4.110 4.110 4.519 -0.409 19998
73 1 . 1 1 15 15 ASP C C 15 174.918 174.918 175.627 -0.710 19998
74 1 . 1 1 15 15 ASP CA C 15 55.774 55.774 54.851 0.923 19998
75 1 . 1 1 15 15 ASP CB C 15 41.360 41.360 40.701 0.659 19998
76 1 . 1 1 15 15 ASP H H 15 8.695 8.695 8.041 0.654 19998
77 1 . 1 1 16 16 GLN N N 16 127.008 127.008 122.896 4.112 19998
78 1 . 1 1 16 16 GLN HA H 16 4.613 4.613 4.548 0.065 19998
79 1 . 1 1 16 16 GLN C C 16 173.874 173.874 174.215 -0.341 19998
80 1 . 1 1 16 16 GLN CA C 16 54.522 54.522 54.942 -0.420 19998
81 1 . 1 1 16 16 GLN CB C 16 28.327 28.327 29.326 -0.999 19998
82 1 . 1 1 16 16 GLN H H 16 8.041 8.041 8.582 -0.541 19998
83 1 . 1 1 17 17 CYS N N 17 122.234 122.234 118.789 3.445 19998
84 1 . 1 1 17 17 CYS HA H 17 4.983 4.983 4.803 0.180 19998
85 1 . 1 1 17 17 CYS C C 17 173.908 173.908 174.812 -0.904 19998
86 1 . 1 1 17 17 CYS CA C 17 56.486 56.486 57.712 -1.226 19998
87 1 . 1 1 17 17 CYS CB C 17 38.906 38.906 30.612 8.294 19998
88 1 . 1 1 17 17 CYS H H 17 9.314 9.314 8.116 1.198 19998
89 1 . 1 1 18 18 CYS N N 18 118.883 118.883 122.629 -3.746 19998
90 1 . 1 1 18 18 CYS HA H 18 4.608 4.608 4.527 0.081 19998
91 1 . 1 1 18 18 CYS C C 18 172.722 172.722 175.993 -3.271 19998
92 1 . 1 1 18 18 CYS CA C 18 55.521 55.521 59.134 -3.613 19998
93 1 . 1 1 18 18 CYS CB C 18 41.367 41.367 26.095 15.272 19998
94 1 . 1 1 18 18 CYS H H 18 9.192 9.192 8.584 0.608 19998
95 1 . 1 1 19 19 LYS N N 19 131.730 131.730 126.683 5.047 19998
96 1 . 1 1 19 19 LYS HA H 19 4.332 4.332 4.095 0.237 19998
97 1 . 1 1 19 19 LYS C C 19 177.997 177.997 178.871 -0.874 19998
98 1 . 1 1 19 19 LYS CA C 19 58.426 58.426 58.887 -0.461 19998
99 1 . 1 1 19 19 LYS CB C 19 31.319 31.319 32.198 -0.879 19998
100 1 . 1 1 19 19 LYS H H 19 8.890 8.890 8.526 0.364 19998
101 1 . 1 1 20 20 SER N N 20 115.887 115.887 114.624 1.263 19998
102 1 . 1 1 20 20 SER HA H 20 4.334 4.334 4.274 0.060 19998
103 1 . 1 1 20 20 SER C C 20 172.946 172.946 175.516 -2.570 19998
104 1 . 1 1 20 20 SER CA C 20 60.311 60.311 60.703 -0.392 19998
105 1 . 1 1 20 20 SER CB C 20 62.327 62.327 62.662 -0.335 19998
106 1 . 1 1 20 20 SER H H 20 8.856 8.856 8.539 0.317 19998
107 1 . 1 1 21 21 SER N N 21 116.191 116.191 115.463 0.728 19998
108 1 . 1 1 21 21 SER HA H 21 4.833 4.833 4.594 0.239 19998
109 1 . 1 1 21 21 SER C C 21 170.505 170.505 173.255 -2.750 19998
110 1 . 1 1 21 21 SER CA C 21 57.500 57.500 57.983 -0.483 19998
111 1 . 1 1 21 21 SER CB C 21 63.852 63.852 63.551 0.301 19998
112 1 . 1 1 21 21 SER H H 21 7.068 7.068 7.531 -0.463 19998
113 1 . 1 1 22 22 SER N N 22 111.723 111.723 116.237 -4.514 19998
114 1 . 1 1 22 22 SER HA H 22 4.099 4.099 4.123 -0.024 19998
115 1 . 1 1 22 22 SER C C 22 170.369 170.369 172.958 -2.589 19998
116 1 . 1 1 22 22 SER CA C 22 59.140 59.140 59.611 -0.471 19998
117 1 . 1 1 22 22 SER CB C 22 61.339 61.339 61.610 -0.271 19998
118 1 . 1 1 22 22 SER H H 22 8.113 8.113 8.208 -0.095 19998
119 1 . 1 1 23 23 LEU N N 23 115.988 115.988 119.330 -3.342 19998
120 1 . 1 1 23 23 LEU HA H 23 4.898 4.898 4.920 -0.022 19998
121 1 . 1 1 23 23 LEU C C 23 173.712 173.712 175.439 -1.727 19998
122 1 . 1 1 23 23 LEU CA C 23 53.083 53.083 53.359 -0.276 19998
123 1 . 1 1 23 23 LEU CB C 23 46.062 46.062 45.488 0.574 19998
124 1 . 1 1 23 23 LEU H H 23 7.111 7.111 7.579 -0.468 19998
125 1 . 1 1 24 24 ALA N N 24 119.898 119.898 120.699 -0.801 19998
126 1 . 1 1 24 24 ALA HA H 24 4.466 4.466 4.648 -0.182 19998
127 1 . 1 1 24 24 ALA C C 24 173.491 173.491 174.719 -1.228 19998
128 1 . 1 1 24 24 ALA CA C 24 51.167 51.167 51.714 -0.547 19998
129 1 . 1 1 24 24 ALA CB C 24 23.237 23.237 21.730 1.507 19998
130 1 . 1 1 24 24 ALA H H 24 8.904 8.904 7.804 1.100 19998
131 1 . 1 1 25 25 CYS N N 25 122.945 122.945 121.275 1.670 19998
132 1 . 1 1 25 25 CYS HA H 25 4.452 4.452 5.009 -0.557 19998
133 1 . 1 1 25 25 CYS C C 25 171.574 171.574 175.080 -3.506 19998
134 1 . 1 1 25 25 CYS CA C 25 56.132 56.132 57.860 -1.728 19998
135 1 . 1 1 25 25 CYS CB C 25 39.179 39.179 26.583 12.596 19998
136 1 . 1 1 25 25 CYS H H 25 9.847 9.847 8.631 1.216 19998
137 1 . 1 1 26 26 SER N N 26 122.285 122.285 123.209 -0.924 19998
138 1 . 1 1 26 26 SER HA H 26 4.543 4.543 4.731 -0.188 19998
139 1 . 1 1 26 26 SER CA C 26 57.773 57.773 57.272 0.501 19998
140 1 . 1 1 26 26 SER CB C 26 63.789 63.789 65.761 -1.972 19998
141 1 . 1 1 26 26 SER H H 26 7.791 7.791 8.374 -0.583 19998
142 1 . 1 1 27 27 THR N N 27 122.390 122.390 120.927 1.463 19998
143 1 . 1 1 27 27 THR HA H 27 3.778 3.778 4.258 -0.480 19998
144 1 . 1 1 27 27 THR C C 27 172.781 172.781 175.136 -2.355 19998
145 1 . 1 1 27 27 THR CA C 27 65.390 65.390 64.276 1.114 19998
146 1 . 1 1 27 27 THR CB C 27 68.458 68.458 68.718 -0.260 19998
147 1 . 1 1 27 27 THR H H 27 8.874 8.874 8.674 0.200 19998
148 1 . 1 1 28 28 LYS N N 28 118.883 118.883 121.072 -2.189 19998
149 1 . 1 1 28 28 LYS HA H 28 4.031 4.031 4.182 -0.151 19998
150 1 . 1 1 28 28 LYS C C 28 174.613 174.613 176.923 -2.310 19998
151 1 . 1 1 28 28 LYS CA C 28 57.799 57.799 58.407 -0.608 19998
152 1 . 1 1 28 28 LYS CB C 28 33.164 33.164 32.390 0.774 19998
153 1 . 1 1 28 28 LYS H H 28 7.609 7.609 8.049 -0.440 19998
154 1 . 1 1 29 29 HIS N N 29 113.398 113.398 115.079 -1.681 19998
155 1 . 1 1 29 29 HIS HA H 29 4.284 4.284 4.621 -0.337 19998
156 1 . 1 1 29 29 HIS CA C 29 55.586 55.586 55.517 0.069 19998
157 1 . 1 1 29 29 HIS CB C 29 29.062 29.062 30.655 -1.593 19998
158 1 . 1 1 29 29 HIS H H 29 7.450 7.450 8.021 -0.571 19998
159 1 . 1 1 30 30 LYS N N 30 116.344 116.344 119.001 -2.657 19998
160 1 . 1 1 30 30 LYS HA H 30 3.888 3.888 4.216 -0.329 19998
161 1 . 1 1 30 30 LYS CA C 30 57.500 57.500 57.341 0.159 19998
162 1 . 1 1 30 30 LYS CB C 30 29.609 29.609 30.657 -1.048 19998
163 1 . 1 1 30 30 LYS H H 30 8.261 8.261 8.427 -0.166 19998
164 1 . 1 1 31 31 TRP N N 31 117.766 117.766 114.902 2.864 19998
165 1 . 1 1 31 31 TRP HA H 31 5.477 5.477 5.008 0.469 19998
166 1 . 1 1 31 31 TRP C C 31 174.754 174.754 174.369 0.385 19998
167 1 . 1 1 31 31 TRP CA C 31 55.756 55.756 54.246 1.510 19998
168 1 . 1 1 31 31 TRP CB C 31 30.976 30.976 29.808 1.167 19998
169 1 . 1 1 31 31 TRP H H 31 8.483 8.483 7.732 0.750 19998
170 1 . 1 1 32 32 CYS N N 32 118.984 118.984 123.005 -4.021 19998
171 1 . 1 1 32 32 CYS HA H 32 4.747 4.747 4.341 0.406 19998
172 1 . 1 1 32 32 CYS C C 32 171.472 171.472 174.728 -3.256 19998
173 1 . 1 1 32 32 CYS CA C 32 54.733 54.733 59.168 -4.435 19998
174 1 . 1 1 32 32 CYS CB C 32 39.524 39.524 24.576 14.948 19998
175 1 . 1 1 32 32 CYS H H 32 8.474 8.474 8.408 0.066 19998
176 1 . 1 1 33 33 LYS N N 33 124.672 124.672 123.860 0.812 19998
177 1 . 1 1 33 33 LYS HA H 33 4.717 4.717 4.107 0.611 19998
178 1 . 1 1 33 33 LYS C C 33 172.236 172.236 175.463 -3.227 19998
179 1 . 1 1 33 33 LYS CA C 33 54.730 54.730 54.111 0.619 19998
180 1 . 1 1 33 33 LYS CB C 33 35.429 35.429 33.905 1.524 19998
181 1 . 1 1 33 33 LYS H H 33 9.027 9.027 8.327 0.700 19998
182 1 . 1 1 34 34 TYR N N 34 120.102 120.102 122.824 -2.722 19998
183 1 . 1 1 34 34 TYR HA H 34 4.878 4.878 4.584 0.294 19998
184 1 . 1 1 34 34 TYR C C 34 174.034 174.034 176.806 -2.772 19998
185 1 . 1 1 34 34 TYR CA C 34 59.262 59.262 58.809 0.453 19998
186 1 . 1 1 34 34 TYR CB C 34 38.633 38.633 37.996 0.637 19998
187 1 . 1 1 34 34 TYR H H 34 8.092 8.092 8.716 -0.624 19998
188 1 . 1 1 35 35 GLU N N 35 124.362 124.362 125.993 -1.631 19998
189 1 . 1 1 35 35 GLU HA H 35 4.462 4.462 4.439 0.023 19998
190 1 . 1 1 35 35 GLU C C 35 172.127 172.127 175.294 -3.167 19998
191 1 . 1 1 35 35 GLU CA C 35 56.267 56.267 56.293 -0.026 19998
192 1 . 1 1 35 35 GLU CB C 35 30.852 30.852 30.026 0.826 19998
193 1 . 1 1 35 35 GLU H H 35 8.754 8.754 8.586 0.168 19998
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