data_19275
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19275
_Entry.PDB_ID 2M8V
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 19275
_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 ASP HA H 2 4.653 4.653 4.822 -0.169 19275
2 1 1 . 1 1 2 2 ASP CA C 2 54.278 54.278 53.866 0.412 19275
3 1 1 . 1 1 2 2 ASP CB C 2 41.637 41.637 42.001 -0.364 19275
4 1 1 . 1 1 2 2 ASP H H 2 8.656 8.656 8.350 0.306 19275
5 1 1 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.539 -0.293 19275
6 1 1 . 1 1 3 3 ARG CA C 3 56.300 56.300 56.259 0.041 19275
7 1 1 . 1 1 3 3 ARG CB C 3 30.487 30.487 30.991 -0.504 19275
8 1 1 . 1 1 3 3 ARG H H 3 8.540 8.540 8.636 -0.096 19275
9 1 1 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.329 1.044 19275
10 1 1 . 1 1 4 4 GLY H H 4 8.504 8.504 8.546 -0.042 19275
11 1 1 . 1 1 5 5 TRP HA H 5 4.657 4.657 5.045 -0.388 19275
12 1 1 . 1 1 5 5 TRP CA C 5 57.200 57.200 56.059 1.141 19275
13 1 1 . 1 1 5 5 TRP CB C 5 29.618 29.618 31.600 -1.982 19275
14 1 1 . 1 1 5 5 TRP H H 5 7.943 7.943 8.298 -0.355 19275
15 1 1 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.331 -0.322 19275
16 1 1 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.522 -0.954 19275
17 1 1 . 1 1 6 6 ILE CB C 6 39.279 39.279 38.574 0.705 19275
18 1 1 . 1 1 6 6 ILE H H 6 7.996 7.996 8.680 -0.684 19275
19 1 1 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.772 -0.252 19275
20 1 1 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.243 1.446 19275
21 1 1 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.760 -3.360 19275
22 1 1 . 1 1 12 12 ASP H H 12 8.462 8.462 8.186 0.276 19275
23 1 1 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.814 0.074 19275
24 1 1 . 1 1 13 13 CYS CA C 13 54.210 54.210 55.078 -0.868 19275
25 1 1 . 1 1 13 13 CYS CB C 13 38.039 38.039 27.148 10.891 19275
26 1 1 . 1 1 13 13 CYS H H 13 7.379 7.379 7.726 -0.347 19275
27 1 1 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.366 0.010 19275
28 1 1 . 1 1 14 14 PRO CA C 14 64.055 64.055 63.513 0.542 19275
29 1 1 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.189 -0.047 19275
30 1 1 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.715 -0.030 19275
31 1 1 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.797 -0.152 19275
32 1 1 . 1 1 15 15 ASN CB C 15 38.632 38.632 39.140 -0.508 19275
33 1 1 . 1 1 15 15 ASN H H 15 8.574 8.574 7.978 0.596 19275
34 1 1 . 1 1 16 16 VAL HA H 16 4.136 4.136 3.806 0.330 19275
35 1 1 . 1 1 16 16 VAL CA C 16 62.669 62.669 63.797 -1.128 19275
36 1 1 . 1 1 16 16 VAL CB C 16 32.555 32.555 32.118 0.437 19275
37 1 1 . 1 1 16 16 VAL H H 16 7.763 7.763 7.982 -0.219 19275
38 1 1 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.534 -0.348 19275
39 1 1 . 1 1 17 17 ILE CA C 17 61.580 61.580 58.734 2.846 19275
40 1 1 . 1 1 17 17 ILE CB C 17 38.480 38.480 39.217 -0.737 19275
41 1 1 . 1 1 17 17 ILE H H 17 8.210 8.210 8.470 -0.260 19275
42 1 1 . 1 1 18 18 SER HA H 18 4.486 4.486 4.404 0.082 19275
43 1 1 . 1 1 18 18 SER CA C 18 58.520 58.520 59.931 -1.411 19275
44 1 1 . 1 1 18 18 SER CB C 18 63.880 63.880 62.727 1.153 19275
45 1 1 . 1 1 18 18 SER H H 18 8.318 8.318 8.514 -0.196 19275
46 1 1 . 1 1 19 19 SER HA H 19 4.483 4.483 4.513 -0.030 19275
47 1 1 . 1 1 19 19 SER CA C 19 59.080 59.080 58.693 0.387 19275
48 1 1 . 1 1 19 19 SER CB C 19 63.710 63.710 64.046 -0.336 19275
49 1 1 . 1 1 19 19 SER H H 19 8.335 8.335 8.568 -0.233 19275
50 1 1 . 1 1 20 20 ILE HA H 20 4.233 4.233 4.265 -0.032 19275
51 1 1 . 1 1 20 20 ILE CA C 20 61.890 61.890 62.498 -0.608 19275
52 1 1 . 1 1 20 20 ILE CB C 20 38.500 38.500 38.978 -0.478 19275
53 1 1 . 1 1 20 20 ILE H H 20 8.002 8.002 7.787 0.215 19275
54 1 1 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.663 0.071 19275
55 1 1 . 1 1 21 21 CYS CA C 21 55.230 55.230 58.535 -3.305 19275
56 1 1 . 1 1 21 21 CYS CB C 21 40.945 40.945 27.514 13.431 19275
57 1 1 . 1 1 21 21 CYS H H 21 8.282 8.282 8.343 -0.061 19275
58 1 1 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.119 0.272 19275
59 1 1 . 1 1 22 22 ALA CA C 22 52.899 52.899 52.569 0.330 19275
60 1 1 . 1 1 22 22 ALA CB C 22 19.346 19.346 17.425 1.921 19275
61 1 1 . 1 1 22 22 ALA H H 22 8.119 8.119 8.027 0.092 19275
62 1 1 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.610 -0.070 19275
63 1 1 . 1 1 23 23 GLY H H 23 8.417 8.417 8.278 0.139 19275
64 1 1 . 1 1 24 24 THR HA H 24 4.398 4.398 4.530 -0.132 19275
65 1 1 . 1 1 24 24 THR CA C 24 61.740 61.740 60.079 1.661 19275
66 1 1 . 1 1 24 24 THR CB C 24 69.900 69.900 69.980 -0.080 19275
67 1 1 . 1 1 24 24 THR H H 24 8.081 8.081 7.740 0.341 19275
68 1 1 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.301 -0.023 19275
69 1 1 . 1 1 25 25 ILE CA C 25 61.386 61.386 59.635 1.751 19275
70 1 1 . 1 1 25 25 ILE CB C 25 38.489 38.489 35.672 2.817 19275
71 1 1 . 1 1 25 25 ILE H H 25 8.073 8.073 8.509 -0.436 19275
72 1 1 . 1 1 26 26 ILE HA H 26 4.240 4.240 3.726 0.514 19275
73 1 1 . 1 1 26 26 ILE CA C 26 61.550 61.550 61.668 -0.118 19275
74 1 1 . 1 1 26 26 ILE CB C 26 38.379 38.379 37.937 0.443 19275
75 1 1 . 1 1 26 26 ILE H H 26 8.114 8.114 8.105 0.009 19275
76 1 1 . 1 1 27 27 THR HA H 27 4.186 4.186 4.415 -0.229 19275
77 1 1 . 1 1 27 27 THR CA C 27 62.850 62.850 62.548 0.302 19275
78 1 1 . 1 1 27 27 THR CB C 27 69.160 69.160 70.050 -0.890 19275
79 1 1 . 1 1 27 27 THR H H 27 7.873 7.873 8.183 -0.310 19275
80 1 1 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.774 -0.410 19275
81 1 1 . 1 1 28 28 ALA CA C 28 52.828 52.828 51.594 1.234 19275
82 1 1 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.511 -0.555 19275
83 1 1 . 1 1 28 28 ALA H H 28 8.114 8.114 8.378 -0.264 19275
84 1 1 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.435 0.200 19275
85 1 1 . 1 1 29 29 CYS CA C 29 56.230 56.230 57.473 -1.243 19275
86 1 1 . 1 1 29 29 CYS CB C 29 41.976 41.976 24.476 17.500 19275
87 1 1 . 1 1 29 29 CYS H H 29 8.008 8.008 8.454 -0.446 19275
88 1 1 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.299 0.072 19275
89 1 1 . 1 1 30 30 LYS CA C 30 56.500 56.500 56.426 0.074 19275
90 1 1 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.460 0.510 19275
91 1 1 . 1 1 30 30 LYS H H 30 8.311 8.311 8.582 -0.271 19275
92 1 1 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.781 -0.020 19275
93 1 1 . 1 1 31 31 ASN CA C 31 53.583 53.583 52.700 0.883 19275
94 1 1 . 1 1 31 31 ASN CB C 31 39.178 39.178 38.938 0.240 19275
95 1 1 . 1 1 31 31 ASN H H 31 8.351 8.351 7.649 0.702 19275
96 1 1 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.708 -0.193 19275
97 1 1 . 1 1 32 32 CYS CA C 32 55.690 55.690 59.542 -3.852 19275
98 1 1 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.310 6.880 19275
99 1 1 . 1 1 32 32 CYS H H 32 8.285 8.285 8.826 -0.541 19275
100 1 2 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.479 0.174 19275
101 1 2 . 1 1 2 2 ASP CA C 2 54.278 54.278 53.984 0.294 19275
102 1 2 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.312 0.325 19275
103 1 2 . 1 1 2 2 ASP H H 2 8.656 8.656 8.107 0.549 19275
104 1 2 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.218 0.028 19275
105 1 2 . 1 1 3 3 ARG CA C 3 56.300 56.300 55.726 0.574 19275
106 1 2 . 1 1 3 3 ARG CB C 3 30.487 30.487 30.874 -0.387 19275
107 1 2 . 1 1 3 3 ARG H H 3 8.540 8.540 8.045 0.495 19275
108 1 2 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.787 0.586 19275
109 1 2 . 1 1 4 4 GLY H H 4 8.504 8.504 8.368 0.136 19275
110 1 2 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.999 -0.342 19275
111 1 2 . 1 1 5 5 TRP CA C 5 57.200 57.200 55.745 1.455 19275
112 1 2 . 1 1 5 5 TRP CB C 5 29.618 29.618 30.181 -0.563 19275
113 1 2 . 1 1 5 5 TRP H H 5 7.943 7.943 6.990 0.953 19275
114 1 2 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.128 -0.119 19275
115 1 2 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.940 -1.372 19275
116 1 2 . 1 1 6 6 ILE CB C 6 39.279 39.279 37.975 1.304 19275
117 1 2 . 1 1 6 6 ILE H H 6 7.996 7.996 8.474 -0.478 19275
118 1 2 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.599 -0.079 19275
119 1 2 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.178 1.512 19275
120 1 2 . 1 1 12 12 ASP CB C 12 38.400 38.400 40.938 -2.538 19275
121 1 2 . 1 1 12 12 ASP H H 12 8.462 8.462 8.314 0.148 19275
122 1 2 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.534 0.354 19275
123 1 2 . 1 1 13 13 CYS CA C 13 54.210 54.210 56.547 -2.337 19275
124 1 2 . 1 1 13 13 CYS CB C 13 38.039 38.039 27.195 10.844 19275
125 1 2 . 1 1 13 13 CYS H H 13 7.379 7.379 7.840 -0.461 19275
126 1 2 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.206 0.170 19275
127 1 2 . 1 1 14 14 PRO CA C 14 64.055 64.055 65.168 -1.113 19275
128 1 2 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.051 0.091 19275
129 1 2 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.704 -0.019 19275
130 1 2 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.310 0.335 19275
131 1 2 . 1 1 15 15 ASN CB C 15 38.632 38.632 39.154 -0.522 19275
132 1 2 . 1 1 15 15 ASN H H 15 8.574 8.574 8.036 0.538 19275
133 1 2 . 1 1 16 16 VAL HA H 16 4.136 4.136 3.903 0.233 19275
134 1 2 . 1 1 16 16 VAL CA C 16 62.669 62.669 62.815 -0.146 19275
135 1 2 . 1 1 16 16 VAL CB C 16 32.555 32.555 31.427 1.128 19275
136 1 2 . 1 1 16 16 VAL H H 16 7.763 7.763 8.170 -0.407 19275
137 1 2 . 1 1 17 17 ILE HA H 17 4.186 4.186 3.876 0.310 19275
138 1 2 . 1 1 17 17 ILE CA C 17 61.580 61.580 62.360 -0.780 19275
139 1 2 . 1 1 17 17 ILE CB C 17 38.480 38.480 37.676 0.804 19275
140 1 2 . 1 1 17 17 ILE H H 17 8.210 8.210 8.021 0.189 19275
141 1 2 . 1 1 18 18 SER HA H 18 4.486 4.486 4.595 -0.109 19275
142 1 2 . 1 1 18 18 SER CA C 18 58.520 58.520 58.164 0.356 19275
143 1 2 . 1 1 18 18 SER CB C 18 63.880 63.880 63.690 0.190 19275
144 1 2 . 1 1 18 18 SER H H 18 8.318 8.318 8.349 -0.031 19275
145 1 2 . 1 1 19 19 SER HA H 19 4.483 4.483 4.570 -0.087 19275
146 1 2 . 1 1 19 19 SER CA C 19 59.080 59.080 58.524 0.556 19275
147 1 2 . 1 1 19 19 SER CB C 19 63.710 63.710 63.746 -0.036 19275
148 1 2 . 1 1 19 19 SER H H 19 8.335 8.335 7.651 0.684 19275
149 1 2 . 1 1 20 20 ILE HA H 20 4.233 4.233 3.749 0.484 19275
150 1 2 . 1 1 20 20 ILE CA C 20 61.890 61.890 62.088 -0.198 19275
151 1 2 . 1 1 20 20 ILE CB C 20 38.500 38.500 38.238 0.262 19275
152 1 2 . 1 1 20 20 ILE H H 20 8.002 8.002 8.279 -0.277 19275
153 1 2 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.317 0.417 19275
154 1 2 . 1 1 21 21 CYS CA C 21 55.230 55.230 59.569 -4.339 19275
155 1 2 . 1 1 21 21 CYS CB C 21 40.945 40.945 28.053 12.892 19275
156 1 2 . 1 1 21 21 CYS H H 21 8.282 8.282 8.781 -0.499 19275
157 1 2 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.440 -0.049 19275
158 1 2 . 1 1 22 22 ALA CA C 22 52.899 52.899 52.058 0.841 19275
159 1 2 . 1 1 22 22 ALA CB C 22 19.346 19.346 20.445 -1.099 19275
160 1 2 . 1 1 22 22 ALA H H 22 8.119 8.119 7.839 0.280 19275
161 1 2 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.216 0.324 19275
162 1 2 . 1 1 23 23 GLY H H 23 8.417 8.417 8.769 -0.352 19275
163 1 2 . 1 1 24 24 THR HA H 24 4.398 4.398 4.548 -0.150 19275
164 1 2 . 1 1 24 24 THR CA C 24 61.740 61.740 62.541 -0.801 19275
165 1 2 . 1 1 24 24 THR CB C 24 69.900 69.900 69.465 0.435 19275
166 1 2 . 1 1 24 24 THR H H 24 8.081 8.081 7.702 0.379 19275
167 1 2 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.317 -0.039 19275
168 1 2 . 1 1 25 25 ILE CA C 25 61.386 61.386 62.224 -0.838 19275
169 1 2 . 1 1 25 25 ILE CB C 25 38.489 38.489 39.514 -1.025 19275
170 1 2 . 1 1 25 25 ILE H H 25 8.073 8.073 8.167 -0.094 19275
171 1 2 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.285 -0.045 19275
172 1 2 . 1 1 26 26 ILE CA C 26 61.550 61.550 61.565 -0.014 19275
173 1 2 . 1 1 26 26 ILE CB C 26 38.379 38.379 38.641 -0.262 19275
174 1 2 . 1 1 26 26 ILE H H 26 8.114 8.114 8.031 0.083 19275
175 1 2 . 1 1 27 27 THR HA H 27 4.186 4.186 4.382 -0.196 19275
176 1 2 . 1 1 27 27 THR CA C 27 62.850 62.850 61.561 1.289 19275
177 1 2 . 1 1 27 27 THR CB C 27 69.160 69.160 70.960 -1.800 19275
178 1 2 . 1 1 27 27 THR H H 27 7.873 7.873 7.806 0.067 19275
179 1 2 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.283 0.081 19275
180 1 2 . 1 1 28 28 ALA CA C 28 52.828 52.828 52.732 0.096 19275
181 1 2 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.045 -0.089 19275
182 1 2 . 1 1 28 28 ALA H H 28 8.114 8.114 8.460 -0.346 19275
183 1 2 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.242 0.393 19275
184 1 2 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.729 -2.499 19275
185 1 2 . 1 1 29 29 CYS CB C 29 41.976 41.976 26.683 15.293 19275
186 1 2 . 1 1 29 29 CYS H H 29 8.008 8.008 8.108 -0.100 19275
187 1 2 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.176 0.195 19275
188 1 2 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.969 -1.469 19275
189 1 2 . 1 1 30 30 LYS CB C 30 32.970 32.970 33.079 -0.109 19275
190 1 2 . 1 1 30 30 LYS H H 30 8.311 8.311 8.511 -0.200 19275
191 1 2 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.825 -0.064 19275
192 1 2 . 1 1 31 31 ASN CA C 31 53.583 53.583 52.748 0.835 19275
193 1 2 . 1 1 31 31 ASN CB C 31 39.178 39.178 38.807 0.371 19275
194 1 2 . 1 1 31 31 ASN H H 31 8.351 8.351 8.074 0.277 19275
195 1 2 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.694 -0.179 19275
196 1 2 . 1 1 32 32 CYS CA C 32 55.690 55.690 59.450 -3.760 19275
197 1 2 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.396 6.794 19275
198 1 2 . 1 1 32 32 CYS H H 32 8.285 8.285 8.535 -0.250 19275
199 1 3 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.873 -0.220 19275
200 1 3 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.385 -0.107 19275
201 1 3 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.001 0.636 19275
202 1 3 . 1 1 2 2 ASP H H 2 8.656 8.656 8.468 0.188 19275
203 1 3 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.439 -0.193 19275
204 1 3 . 1 1 3 3 ARG CA C 3 56.300 56.300 55.873 0.427 19275
205 1 3 . 1 1 3 3 ARG CB C 3 30.487 30.487 31.716 -1.230 19275
206 1 3 . 1 1 3 3 ARG H H 3 8.540 8.540 8.513 0.027 19275
207 1 3 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.671 0.702 19275
208 1 3 . 1 1 4 4 GLY H H 4 8.504 8.504 8.599 -0.095 19275
209 1 3 . 1 1 5 5 TRP HA H 5 4.657 4.657 5.038 -0.381 19275
210 1 3 . 1 1 5 5 TRP CA C 5 57.200 57.200 57.085 0.115 19275
211 1 3 . 1 1 5 5 TRP CB C 5 29.618 29.618 31.465 -1.847 19275
212 1 3 . 1 1 5 5 TRP H H 5 7.943 7.943 8.417 -0.474 19275
213 1 3 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.449 -0.440 19275
214 1 3 . 1 1 6 6 ILE CA C 6 60.568 60.568 60.597 -0.029 19275
215 1 3 . 1 1 6 6 ILE CB C 6 39.279 39.279 40.005 -0.726 19275
216 1 3 . 1 1 6 6 ILE H H 6 7.996 7.996 8.582 -0.586 19275
217 1 3 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.746 -0.226 19275
218 1 3 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.307 1.383 19275
219 1 3 . 1 1 12 12 ASP CB C 12 38.400 38.400 40.906 -2.506 19275
220 1 3 . 1 1 12 12 ASP H H 12 8.462 8.462 8.259 0.203 19275
221 1 3 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.710 0.178 19275
222 1 3 . 1 1 13 13 CYS CA C 13 54.210 54.210 55.830 -1.620 19275
223 1 3 . 1 1 13 13 CYS CB C 13 38.039 38.039 26.425 11.614 19275
224 1 3 . 1 1 13 13 CYS H H 13 7.379 7.379 7.879 -0.500 19275
225 1 3 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.458 -0.082 19275
226 1 3 . 1 1 14 14 PRO CA C 14 64.055 64.055 63.233 0.821 19275
227 1 3 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.096 0.046 19275
228 1 3 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.573 0.112 19275
229 1 3 . 1 1 15 15 ASN CA C 15 53.645 53.645 54.345 -0.700 19275
230 1 3 . 1 1 15 15 ASN CB C 15 38.632 38.632 38.977 -0.345 19275
231 1 3 . 1 1 15 15 ASN H H 15 8.574 8.574 8.530 0.044 19275
232 1 3 . 1 1 16 16 VAL HA H 16 4.136 4.136 4.320 -0.184 19275
233 1 3 . 1 1 16 16 VAL CA C 16 62.669 62.669 61.739 0.930 19275
234 1 3 . 1 1 16 16 VAL CB C 16 32.555 32.555 32.026 0.529 19275
235 1 3 . 1 1 16 16 VAL H H 16 7.763 7.763 7.703 0.060 19275
236 1 3 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.458 -0.272 19275
237 1 3 . 1 1 17 17 ILE CA C 17 61.580 61.580 61.628 -0.048 19275
238 1 3 . 1 1 17 17 ILE CB C 17 38.480 38.480 40.455 -1.975 19275
239 1 3 . 1 1 17 17 ILE H H 17 8.210 8.210 8.400 -0.190 19275
240 1 3 . 1 1 18 18 SER HA H 18 4.486 4.486 4.397 0.089 19275
241 1 3 . 1 1 18 18 SER CA C 18 58.520 58.520 59.234 -0.714 19275
242 1 3 . 1 1 18 18 SER CB C 18 63.880 63.880 62.878 1.002 19275
243 1 3 . 1 1 18 18 SER H H 18 8.318 8.318 8.972 -0.654 19275
244 1 3 . 1 1 19 19 SER HA H 19 4.483 4.483 4.431 0.052 19275
245 1 3 . 1 1 19 19 SER CA C 19 59.080 59.080 58.736 0.344 19275
246 1 3 . 1 1 19 19 SER CB C 19 63.710 63.710 63.946 -0.236 19275
247 1 3 . 1 1 19 19 SER H H 19 8.335 8.335 8.279 0.056 19275
248 1 3 . 1 1 20 20 ILE HA H 20 4.233 4.233 4.368 -0.135 19275
249 1 3 . 1 1 20 20 ILE CA C 20 61.890 61.890 59.985 1.905 19275
250 1 3 . 1 1 20 20 ILE CB C 20 38.500 38.500 41.127 -2.627 19275
251 1 3 . 1 1 20 20 ILE H H 20 8.002 8.002 7.743 0.259 19275
252 1 3 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.703 0.031 19275
253 1 3 . 1 1 21 21 CYS CA C 21 55.230 55.230 57.755 -2.525 19275
254 1 3 . 1 1 21 21 CYS CB C 21 40.945 40.945 28.369 12.576 19275
255 1 3 . 1 1 21 21 CYS H H 21 8.282 8.282 9.058 -0.776 19275
256 1 3 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.069 0.322 19275
257 1 3 . 1 1 22 22 ALA CA C 22 52.899 52.899 52.601 0.298 19275
258 1 3 . 1 1 22 22 ALA CB C 22 19.346 19.346 18.636 0.710 19275
259 1 3 . 1 1 22 22 ALA H H 22 8.119 8.119 7.738 0.381 19275
260 1 3 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.415 0.125 19275
261 1 3 . 1 1 23 23 GLY H H 23 8.417 8.417 8.702 -0.285 19275
262 1 3 . 1 1 24 24 THR HA H 24 4.398 4.398 4.614 -0.216 19275
263 1 3 . 1 1 24 24 THR CA C 24 61.740 61.740 62.480 -0.739 19275
264 1 3 . 1 1 24 24 THR CB C 24 69.900 69.900 69.778 0.122 19275
265 1 3 . 1 1 24 24 THR H H 24 8.081 8.081 8.373 -0.292 19275
266 1 3 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.368 -0.090 19275
267 1 3 . 1 1 25 25 ILE CA C 25 61.386 61.386 61.078 0.308 19275
268 1 3 . 1 1 25 25 ILE CB C 25 38.489 38.489 39.213 -0.724 19275
269 1 3 . 1 1 25 25 ILE H H 25 8.073 8.073 7.927 0.146 19275
270 1 3 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.400 -0.160 19275
271 1 3 . 1 1 26 26 ILE CA C 26 61.550 61.550 60.572 0.978 19275
272 1 3 . 1 1 26 26 ILE CB C 26 38.379 38.379 38.805 -0.426 19275
273 1 3 . 1 1 26 26 ILE H H 26 8.114 8.114 7.667 0.447 19275
274 1 3 . 1 1 27 27 THR HA H 27 4.186 4.186 4.288 -0.102 19275
275 1 3 . 1 1 27 27 THR CA C 27 62.850 62.850 62.420 0.429 19275
276 1 3 . 1 1 27 27 THR CB C 27 69.160 69.160 69.336 -0.176 19275
277 1 3 . 1 1 27 27 THR H H 27 7.873 7.873 8.324 -0.451 19275
278 1 3 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.421 -0.057 19275
279 1 3 . 1 1 28 28 ALA CA C 28 52.828 52.828 51.618 1.210 19275
280 1 3 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.338 -0.382 19275
281 1 3 . 1 1 28 28 ALA H H 28 8.114 8.114 8.370 -0.256 19275
282 1 3 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.576 0.059 19275
283 1 3 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.792 -2.562 19275
284 1 3 . 1 1 29 29 CYS CB C 29 41.976 41.976 27.627 14.349 19275
285 1 3 . 1 1 29 29 CYS H H 29 8.008 8.008 7.770 0.238 19275
286 1 3 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.386 -0.015 19275
287 1 3 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.164 -0.664 19275
288 1 3 . 1 1 30 30 LYS CB C 30 32.970 32.970 33.396 -0.426 19275
289 1 3 . 1 1 30 30 LYS H H 30 8.311 8.311 8.721 -0.410 19275
290 1 3 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.719 0.042 19275
291 1 3 . 1 1 31 31 ASN CA C 31 53.583 53.583 53.001 0.582 19275
292 1 3 . 1 1 31 31 ASN CB C 31 39.178 39.178 38.242 0.936 19275
293 1 3 . 1 1 31 31 ASN H H 31 8.351 8.351 7.946 0.405 19275
294 1 3 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.642 -0.127 19275
295 1 3 . 1 1 32 32 CYS CA C 32 55.690 55.690 59.152 -3.462 19275
296 1 3 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.701 6.489 19275
297 1 3 . 1 1 32 32 CYS H H 32 8.285 8.285 8.641 -0.356 19275
298 1 4 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.545 0.108 19275
299 1 4 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.678 -0.400 19275
300 1 4 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.254 0.383 19275
301 1 4 . 1 1 2 2 ASP H H 2 8.656 8.656 8.530 0.126 19275
302 1 4 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.446 -0.200 19275
303 1 4 . 1 1 3 3 ARG CA C 3 56.300 56.300 55.845 0.455 19275
304 1 4 . 1 1 3 3 ARG CB C 3 30.487 30.487 30.378 0.109 19275
305 1 4 . 1 1 3 3 ARG H H 3 8.540 8.540 8.054 0.486 19275
306 1 4 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.898 0.475 19275
307 1 4 . 1 1 4 4 GLY H H 4 8.504 8.504 8.435 0.069 19275
308 1 4 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.977 -0.320 19275
309 1 4 . 1 1 5 5 TRP CA C 5 57.200 57.200 55.751 1.449 19275
310 1 4 . 1 1 5 5 TRP CB C 5 29.618 29.618 30.436 -0.818 19275
311 1 4 . 1 1 5 5 TRP H H 5 7.943 7.943 8.170 -0.227 19275
312 1 4 . 1 1 6 6 ILE HA H 6 4.009 4.009 3.834 0.175 19275
313 1 4 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.288 -0.720 19275
314 1 4 . 1 1 6 6 ILE CB C 6 39.279 39.279 37.177 2.102 19275
315 1 4 . 1 1 6 6 ILE H H 6 7.996 7.996 8.381 -0.385 19275
316 1 4 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.714 -0.194 19275
317 1 4 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.282 1.408 19275
318 1 4 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.212 -2.812 19275
319 1 4 . 1 1 12 12 ASP H H 12 8.462 8.462 8.071 0.391 19275
320 1 4 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.727 0.161 19275
321 1 4 . 1 1 13 13 CYS CA C 13 54.210 54.210 55.346 -1.137 19275
322 1 4 . 1 1 13 13 CYS CB C 13 38.039 38.039 27.102 10.937 19275
323 1 4 . 1 1 13 13 CYS H H 13 7.379 7.379 7.814 -0.435 19275
324 1 4 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.657 -0.281 19275
325 1 4 . 1 1 14 14 PRO CA C 14 64.055 64.055 63.535 0.520 19275
326 1 4 . 1 1 14 14 PRO CB C 14 32.142 32.142 31.344 0.798 19275
327 1 4 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.620 0.065 19275
328 1 4 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.109 0.536 19275
329 1 4 . 1 1 15 15 ASN CB C 15 38.632 38.632 39.243 -0.611 19275
330 1 4 . 1 1 15 15 ASN H H 15 8.574 8.574 7.850 0.724 19275
331 1 4 . 1 1 16 16 VAL HA H 16 4.136 4.136 3.808 0.328 19275
332 1 4 . 1 1 16 16 VAL CA C 16 62.669 62.669 63.006 -0.337 19275
333 1 4 . 1 1 16 16 VAL CB C 16 32.555 32.555 31.137 1.418 19275
334 1 4 . 1 1 16 16 VAL H H 16 7.763 7.763 8.220 -0.457 19275
335 1 4 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.502 -0.316 19275
336 1 4 . 1 1 17 17 ILE CA C 17 61.580 61.580 61.682 -0.102 19275
337 1 4 . 1 1 17 17 ILE CB C 17 38.480 38.480 39.682 -1.202 19275
338 1 4 . 1 1 17 17 ILE H H 17 8.210 8.210 8.131 0.079 19275
339 1 4 . 1 1 18 18 SER HA H 18 4.486 4.486 4.480 0.006 19275
340 1 4 . 1 1 18 18 SER CA C 18 58.520 58.520 58.411 0.109 19275
341 1 4 . 1 1 18 18 SER CB C 18 63.880 63.880 63.816 0.064 19275
342 1 4 . 1 1 18 18 SER H H 18 8.318 8.318 8.876 -0.558 19275
343 1 4 . 1 1 19 19 SER HA H 19 4.483 4.483 4.640 -0.157 19275
344 1 4 . 1 1 19 19 SER CA C 19 59.080 59.080 58.238 0.842 19275
345 1 4 . 1 1 19 19 SER CB C 19 63.710 63.710 63.687 0.023 19275
346 1 4 . 1 1 19 19 SER H H 19 8.335 8.335 8.150 0.185 19275
347 1 4 . 1 1 20 20 ILE HA H 20 4.233 4.233 3.676 0.557 19275
348 1 4 . 1 1 20 20 ILE CA C 20 61.890 61.890 62.172 -0.283 19275
349 1 4 . 1 1 20 20 ILE CB C 20 38.500 38.500 36.098 2.402 19275
350 1 4 . 1 1 20 20 ILE H H 20 8.002 8.002 8.487 -0.485 19275
351 1 4 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.266 0.468 19275
352 1 4 . 1 1 21 21 CYS CA C 21 55.230 55.230 58.914 -3.684 19275
353 1 4 . 1 1 21 21 CYS CB C 21 40.945 40.945 24.487 16.458 19275
354 1 4 . 1 1 21 21 CYS H H 21 8.282 8.282 8.482 -0.200 19275
355 1 4 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.092 0.299 19275
356 1 4 . 1 1 22 22 ALA CA C 22 52.899 52.899 53.015 -0.116 19275
357 1 4 . 1 1 22 22 ALA CB C 22 19.346 19.346 19.156 0.190 19275
358 1 4 . 1 1 22 22 ALA H H 22 8.119 8.119 7.574 0.545 19275
359 1 4 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.394 0.146 19275
360 1 4 . 1 1 23 23 GLY H H 23 8.417 8.417 8.405 0.012 19275
361 1 4 . 1 1 24 24 THR HA H 24 4.398 4.398 4.481 -0.083 19275
362 1 4 . 1 1 24 24 THR CA C 24 61.740 61.740 61.006 0.734 19275
363 1 4 . 1 1 24 24 THR CB C 24 69.900 69.900 69.541 0.359 19275
364 1 4 . 1 1 24 24 THR H H 24 8.081 8.081 8.311 -0.230 19275
365 1 4 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.499 -0.221 19275
366 1 4 . 1 1 25 25 ILE CA C 25 61.386 61.386 60.865 0.521 19275
367 1 4 . 1 1 25 25 ILE CB C 25 38.489 38.489 38.953 -0.464 19275
368 1 4 . 1 1 25 25 ILE H H 25 8.073 8.073 8.543 -0.470 19275
369 1 4 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.502 -0.262 19275
370 1 4 . 1 1 26 26 ILE CA C 26 61.550 61.550 61.839 -0.289 19275
371 1 4 . 1 1 26 26 ILE CB C 26 38.379 38.379 39.141 -0.762 19275
372 1 4 . 1 1 26 26 ILE H H 26 8.114 8.114 8.520 -0.406 19275
373 1 4 . 1 1 27 27 THR HA H 27 4.186 4.186 4.394 -0.208 19275
374 1 4 . 1 1 27 27 THR CA C 27 62.850 62.850 62.359 0.491 19275
375 1 4 . 1 1 27 27 THR CB C 27 69.160 69.160 69.625 -0.465 19275
376 1 4 . 1 1 27 27 THR H H 27 7.873 7.873 7.713 0.160 19275
377 1 4 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.511 -0.147 19275
378 1 4 . 1 1 28 28 ALA CA C 28 52.828 52.828 51.760 1.068 19275
379 1 4 . 1 1 28 28 ALA CB C 28 18.956 18.956 18.973 -0.017 19275
380 1 4 . 1 1 28 28 ALA H H 28 8.114 8.114 8.043 0.071 19275
381 1 4 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.235 0.400 19275
382 1 4 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.830 -2.600 19275
383 1 4 . 1 1 29 29 CYS CB C 29 41.976 41.976 27.079 14.897 19275
384 1 4 . 1 1 29 29 CYS H H 29 8.008 8.008 7.850 0.158 19275
385 1 4 . 1 1 30 30 LYS HA H 30 4.371 4.371 3.975 0.396 19275
386 1 4 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.607 -1.107 19275
387 1 4 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.764 0.206 19275
388 1 4 . 1 1 30 30 LYS H H 30 8.311 8.311 8.637 -0.326 19275
389 1 4 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.381 0.380 19275
390 1 4 . 1 1 31 31 ASN CA C 31 53.583 53.583 54.426 -0.843 19275
391 1 4 . 1 1 31 31 ASN CB C 31 39.178 39.178 37.640 1.538 19275
392 1 4 . 1 1 31 31 ASN H H 31 8.351 8.351 8.041 0.310 19275
393 1 4 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.596 -0.081 19275
394 1 4 . 1 1 32 32 CYS CA C 32 55.690 55.690 58.993 -3.303 19275
395 1 4 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.488 6.702 19275
396 1 4 . 1 1 32 32 CYS H H 32 8.285 8.285 8.724 -0.439 19275
397 1 5 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.632 0.021 19275
398 1 5 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.575 -0.297 19275
399 1 5 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.452 0.185 19275
400 1 5 . 1 1 2 2 ASP H H 2 8.656 8.656 8.469 0.187 19275
401 1 5 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.488 -0.242 19275
402 1 5 . 1 1 3 3 ARG CA C 3 56.300 56.300 55.922 0.378 19275
403 1 5 . 1 1 3 3 ARG CB C 3 30.487 30.487 30.528 -0.041 19275
404 1 5 . 1 1 3 3 ARG H H 3 8.540 8.540 8.287 0.253 19275
405 1 5 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.677 0.696 19275
406 1 5 . 1 1 4 4 GLY H H 4 8.504 8.504 8.743 -0.239 19275
407 1 5 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.950 -0.293 19275
408 1 5 . 1 1 5 5 TRP CA C 5 57.200 57.200 56.080 1.120 19275
409 1 5 . 1 1 5 5 TRP CB C 5 29.618 29.618 31.004 -1.386 19275
410 1 5 . 1 1 5 5 TRP H H 5 7.943 7.943 7.656 0.287 19275
411 1 5 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.436 -0.427 19275
412 1 5 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.581 -1.014 19275
413 1 5 . 1 1 6 6 ILE CB C 6 39.279 39.279 37.238 2.041 19275
414 1 5 . 1 1 6 6 ILE H H 6 7.996 7.996 8.588 -0.592 19275
415 1 5 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.713 -0.193 19275
416 1 5 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.343 1.347 19275
417 1 5 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.005 -2.605 19275
418 1 5 . 1 1 12 12 ASP H H 12 8.462 8.462 8.311 0.151 19275
419 1 5 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.690 0.198 19275
420 1 5 . 1 1 13 13 CYS CA C 13 54.210 54.210 55.835 -1.625 19275
421 1 5 . 1 1 13 13 CYS CB C 13 38.039 38.039 26.274 11.765 19275
422 1 5 . 1 1 13 13 CYS H H 13 7.379 7.379 7.792 -0.413 19275
423 1 5 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.520 -0.144 19275
424 1 5 . 1 1 14 14 PRO CA C 14 64.055 64.055 62.977 1.078 19275
425 1 5 . 1 1 14 14 PRO CB C 14 32.142 32.142 31.971 0.171 19275
426 1 5 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.833 -0.148 19275
427 1 5 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.349 0.296 19275
428 1 5 . 1 1 15 15 ASN CB C 15 38.632 38.632 38.464 0.168 19275
429 1 5 . 1 1 15 15 ASN H H 15 8.574 8.574 7.922 0.652 19275
430 1 5 . 1 1 16 16 VAL HA H 16 4.136 4.136 4.269 -0.133 19275
431 1 5 . 1 1 16 16 VAL CA C 16 62.669 62.669 62.943 -0.274 19275
432 1 5 . 1 1 16 16 VAL CB C 16 32.555 32.555 33.084 -0.529 19275
433 1 5 . 1 1 16 16 VAL H H 16 7.763 7.763 8.064 -0.301 19275
434 1 5 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.478 -0.292 19275
435 1 5 . 1 1 17 17 ILE CA C 17 61.580 61.580 61.196 0.384 19275
436 1 5 . 1 1 17 17 ILE CB C 17 38.480 38.480 39.896 -1.416 19275
437 1 5 . 1 1 17 17 ILE H H 17 8.210 8.210 8.337 -0.127 19275
438 1 5 . 1 1 18 18 SER HA H 18 4.486 4.486 4.172 0.314 19275
439 1 5 . 1 1 18 18 SER CA C 18 58.520 58.520 60.419 -1.899 19275
440 1 5 . 1 1 18 18 SER CB C 18 63.880 63.880 62.063 1.817 19275
441 1 5 . 1 1 18 18 SER H H 18 8.318 8.318 9.067 -0.749 19275
442 1 5 . 1 1 19 19 SER HA H 19 4.483 4.483 4.633 -0.150 19275
443 1 5 . 1 1 19 19 SER CA C 19 59.080 59.080 58.633 0.447 19275
444 1 5 . 1 1 19 19 SER CB C 19 63.710 63.710 63.671 0.039 19275
445 1 5 . 1 1 19 19 SER H H 19 8.335 8.335 7.713 0.622 19275
446 1 5 . 1 1 20 20 ILE HA H 20 4.233 4.233 3.725 0.508 19275
447 1 5 . 1 1 20 20 ILE CA C 20 61.890 61.890 62.117 -0.227 19275
448 1 5 . 1 1 20 20 ILE CB C 20 38.500 38.500 37.847 0.652 19275
449 1 5 . 1 1 20 20 ILE H H 20 8.002 8.002 7.498 0.504 19275
450 1 5 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.264 0.470 19275
451 1 5 . 1 1 21 21 CYS CA C 21 55.230 55.230 59.537 -4.307 19275
452 1 5 . 1 1 21 21 CYS CB C 21 40.945 40.945 26.970 13.975 19275
453 1 5 . 1 1 21 21 CYS H H 21 8.282 8.282 8.759 -0.477 19275
454 1 5 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.001 0.390 19275
455 1 5 . 1 1 22 22 ALA CA C 22 52.899 52.899 52.329 0.570 19275
456 1 5 . 1 1 22 22 ALA CB C 22 19.346 19.346 18.666 0.680 19275
457 1 5 . 1 1 22 22 ALA H H 22 8.119 8.119 7.922 0.197 19275
458 1 5 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.424 0.116 19275
459 1 5 . 1 1 23 23 GLY H H 23 8.417 8.417 8.434 -0.017 19275
460 1 5 . 1 1 24 24 THR HA H 24 4.398 4.398 4.531 -0.133 19275
461 1 5 . 1 1 24 24 THR CA C 24 61.740 61.740 60.917 0.823 19275
462 1 5 . 1 1 24 24 THR CB C 24 69.900 69.900 70.416 -0.516 19275
463 1 5 . 1 1 24 24 THR H H 24 8.081 8.081 7.958 0.123 19275
464 1 5 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.377 -0.099 19275
465 1 5 . 1 1 25 25 ILE CA C 25 61.386 61.386 61.577 -0.191 19275
466 1 5 . 1 1 25 25 ILE CB C 25 38.489 38.489 36.080 2.409 19275
467 1 5 . 1 1 25 25 ILE H H 25 8.073 8.073 8.280 -0.207 19275
468 1 5 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.298 -0.058 19275
469 1 5 . 1 1 26 26 ILE CA C 26 61.550 61.550 60.434 1.116 19275
470 1 5 . 1 1 26 26 ILE CB C 26 38.379 38.379 40.291 -1.912 19275
471 1 5 . 1 1 26 26 ILE H H 26 8.114 8.114 8.166 -0.052 19275
472 1 5 . 1 1 27 27 THR HA H 27 4.186 4.186 4.132 0.054 19275
473 1 5 . 1 1 27 27 THR CA C 27 62.850 62.850 64.624 -1.774 19275
474 1 5 . 1 1 27 27 THR CB C 27 69.160 69.160 68.717 0.443 19275
475 1 5 . 1 1 27 27 THR H H 27 7.873 7.873 8.281 -0.408 19275
476 1 5 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.387 -0.023 19275
477 1 5 . 1 1 28 28 ALA CA C 28 52.828 52.828 52.836 -0.008 19275
478 1 5 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.841 -0.885 19275
479 1 5 . 1 1 28 28 ALA H H 28 8.114 8.114 8.126 -0.012 19275
480 1 5 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.594 0.041 19275
481 1 5 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.083 -1.853 19275
482 1 5 . 1 1 29 29 CYS CB C 29 41.976 41.976 28.467 13.509 19275
483 1 5 . 1 1 29 29 CYS H H 29 8.008 8.008 7.897 0.111 19275
484 1 5 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.015 0.356 19275
485 1 5 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.671 -1.171 19275
486 1 5 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.522 0.448 19275
487 1 5 . 1 1 30 30 LYS H H 30 8.311 8.311 8.622 -0.311 19275
488 1 5 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.448 0.313 19275
489 1 5 . 1 1 31 31 ASN CA C 31 53.583 53.583 54.321 -0.738 19275
490 1 5 . 1 1 31 31 ASN CB C 31 39.178 39.178 38.089 1.089 19275
491 1 5 . 1 1 31 31 ASN H H 31 8.351 8.351 8.561 -0.210 19275
492 1 5 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.631 -0.116 19275
493 1 5 . 1 1 32 32 CYS CA C 32 55.690 55.690 58.495 -2.805 19275
494 1 5 . 1 1 32 32 CYS CB C 32 34.190 34.190 24.996 9.194 19275
495 1 5 . 1 1 32 32 CYS H H 32 8.285 8.285 8.726 -0.441 19275
496 1 6 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.497 0.156 19275
497 1 6 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.437 -0.159 19275
498 1 6 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.633 0.004 19275
499 1 6 . 1 1 2 2 ASP H H 2 8.656 8.656 8.226 0.430 19275
500 1 6 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.626 -0.380 19275
501 1 6 . 1 1 3 3 ARG CA C 3 56.300 56.300 56.035 0.265 19275
502 1 6 . 1 1 3 3 ARG CB C 3 30.487 30.487 30.546 -0.059 19275
503 1 6 . 1 1 3 3 ARG H H 3 8.540 8.540 8.537 0.003 19275
504 1 6 . 1 1 4 4 GLY CA C 4 45.373 45.373 45.566 -0.193 19275
505 1 6 . 1 1 4 4 GLY H H 4 8.504 8.504 8.842 -0.338 19275
506 1 6 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.749 -0.092 19275
507 1 6 . 1 1 5 5 TRP CA C 5 57.200 57.200 55.486 1.714 19275
508 1 6 . 1 1 5 5 TRP CB C 5 29.618 29.618 30.145 -0.527 19275
509 1 6 . 1 1 5 5 TRP H H 5 7.943 7.943 7.866 0.077 19275
510 1 6 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.122 -0.113 19275
511 1 6 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.110 -0.542 19275
512 1 6 . 1 1 6 6 ILE CB C 6 39.279 39.279 38.408 0.871 19275
513 1 6 . 1 1 6 6 ILE H H 6 7.996 7.996 8.341 -0.345 19275
514 1 6 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.676 -0.156 19275
515 1 6 . 1 1 12 12 ASP CA C 12 55.690 55.690 53.619 2.071 19275
516 1 6 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.165 -2.765 19275
517 1 6 . 1 1 12 12 ASP H H 12 8.462 8.462 8.119 0.343 19275
518 1 6 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.651 0.237 19275
519 1 6 . 1 1 13 13 CYS CA C 13 54.210 54.210 56.017 -1.807 19275
520 1 6 . 1 1 13 13 CYS CB C 13 38.039 38.039 26.450 11.589 19275
521 1 6 . 1 1 13 13 CYS H H 13 7.379 7.379 7.787 -0.408 19275
522 1 6 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.339 0.037 19275
523 1 6 . 1 1 14 14 PRO CA C 14 64.055 64.055 64.666 -0.611 19275
524 1 6 . 1 1 14 14 PRO CB C 14 32.142 32.142 31.971 0.171 19275
525 1 6 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.742 -0.057 19275
526 1 6 . 1 1 15 15 ASN CA C 15 53.645 53.645 52.390 1.255 19275
527 1 6 . 1 1 15 15 ASN CB C 15 38.632 38.632 39.735 -1.103 19275
528 1 6 . 1 1 15 15 ASN H H 15 8.574 8.574 8.013 0.561 19275
529 1 6 . 1 1 16 16 VAL HA H 16 4.136 4.136 3.779 0.357 19275
530 1 6 . 1 1 16 16 VAL CA C 16 62.669 62.669 63.616 -0.947 19275
531 1 6 . 1 1 16 16 VAL CB C 16 32.555 32.555 32.205 0.350 19275
532 1 6 . 1 1 16 16 VAL H H 16 7.763 7.763 7.481 0.282 19275
533 1 6 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.482 -0.296 19275
534 1 6 . 1 1 17 17 ILE CA C 17 61.580 61.580 59.592 1.988 19275
535 1 6 . 1 1 17 17 ILE CB C 17 38.480 38.480 39.641 -1.161 19275
536 1 6 . 1 1 17 17 ILE H H 17 8.210 8.210 8.145 0.065 19275
537 1 6 . 1 1 18 18 SER HA H 18 4.486 4.486 4.207 0.279 19275
538 1 6 . 1 1 18 18 SER CA C 18 58.520 58.520 58.715 -0.195 19275
539 1 6 . 1 1 18 18 SER CB C 18 63.880 63.880 63.445 0.435 19275
540 1 6 . 1 1 18 18 SER H H 18 8.318 8.318 8.293 0.025 19275
541 1 6 . 1 1 19 19 SER HA H 19 4.483 4.483 4.340 0.143 19275
542 1 6 . 1 1 19 19 SER CA C 19 59.080 59.080 60.322 -1.242 19275
543 1 6 . 1 1 19 19 SER CB C 19 63.710 63.710 63.471 0.239 19275
544 1 6 . 1 1 19 19 SER H H 19 8.335 8.335 8.515 -0.180 19275
545 1 6 . 1 1 20 20 ILE HA H 20 4.233 4.233 4.331 -0.098 19275
546 1 6 . 1 1 20 20 ILE CA C 20 61.890 61.890 59.599 2.291 19275
547 1 6 . 1 1 20 20 ILE CB C 20 38.500 38.500 40.478 -1.978 19275
548 1 6 . 1 1 20 20 ILE H H 20 8.002 8.002 7.368 0.634 19275
549 1 6 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.775 -0.041 19275
550 1 6 . 1 1 21 21 CYS CA C 21 55.230 55.230 57.553 -2.323 19275
551 1 6 . 1 1 21 21 CYS CB C 21 40.945 40.945 26.119 14.826 19275
552 1 6 . 1 1 21 21 CYS H H 21 8.282 8.282 8.183 0.099 19275
553 1 6 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.719 -0.328 19275
554 1 6 . 1 1 22 22 ALA CA C 22 52.899 52.899 50.977 1.923 19275
555 1 6 . 1 1 22 22 ALA CB C 22 19.346 19.346 20.526 -1.180 19275
556 1 6 . 1 1 22 22 ALA H H 22 8.119 8.119 7.210 0.909 19275
557 1 6 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.594 -0.054 19275
558 1 6 . 1 1 23 23 GLY H H 23 8.417 8.417 8.590 -0.173 19275
559 1 6 . 1 1 24 24 THR HA H 24 4.398 4.398 4.824 -0.425 19275
560 1 6 . 1 1 24 24 THR CA C 24 61.740 61.740 61.064 0.676 19275
561 1 6 . 1 1 24 24 THR CB C 24 69.900 69.900 69.132 0.768 19275
562 1 6 . 1 1 24 24 THR H H 24 8.081 8.081 7.940 0.141 19275
563 1 6 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.263 0.015 19275
564 1 6 . 1 1 25 25 ILE CA C 25 61.386 61.386 60.910 0.476 19275
565 1 6 . 1 1 25 25 ILE CB C 25 38.489 38.489 38.476 0.013 19275
566 1 6 . 1 1 25 25 ILE H H 25 8.073 8.073 7.811 0.262 19275
567 1 6 . 1 1 26 26 ILE HA H 26 4.240 4.240 3.875 0.365 19275
568 1 6 . 1 1 26 26 ILE CA C 26 61.550 61.550 62.570 -1.020 19275
569 1 6 . 1 1 26 26 ILE CB C 26 38.379 38.379 37.453 0.926 19275
570 1 6 . 1 1 26 26 ILE H H 26 8.114 8.114 7.922 0.192 19275
571 1 6 . 1 1 27 27 THR HA H 27 4.186 4.186 4.437 -0.251 19275
572 1 6 . 1 1 27 27 THR CA C 27 62.850 62.850 62.849 0.001 19275
573 1 6 . 1 1 27 27 THR CB C 27 69.160 69.160 69.708 -0.548 19275
574 1 6 . 1 1 27 27 THR H H 27 7.873 7.873 8.280 -0.407 19275
575 1 6 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.571 -0.207 19275
576 1 6 . 1 1 28 28 ALA CA C 28 52.828 52.828 51.987 0.841 19275
577 1 6 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.612 -0.656 19275
578 1 6 . 1 1 28 28 ALA H H 28 8.114 8.114 8.153 -0.039 19275
579 1 6 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.249 0.386 19275
580 1 6 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.829 -2.599 19275
581 1 6 . 1 1 29 29 CYS CB C 29 41.976 41.976 25.078 16.898 19275
582 1 6 . 1 1 29 29 CYS H H 29 8.008 8.008 8.118 -0.110 19275
583 1 6 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.174 0.197 19275
584 1 6 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.353 -0.853 19275
585 1 6 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.865 0.104 19275
586 1 6 . 1 1 30 30 LYS H H 30 8.311 8.311 8.292 0.019 19275
587 1 6 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.909 -0.148 19275
588 1 6 . 1 1 31 31 ASN CA C 31 53.583 53.583 52.407 1.176 19275
589 1 6 . 1 1 31 31 ASN CB C 31 39.178 39.178 39.649 -0.471 19275
590 1 6 . 1 1 31 31 ASN H H 31 8.351 8.351 8.095 0.256 19275
591 1 6 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.711 -0.196 19275
592 1 6 . 1 1 32 32 CYS CA C 32 55.690 55.690 58.249 -2.559 19275
593 1 6 . 1 1 32 32 CYS CB C 32 34.190 34.190 28.096 6.094 19275
594 1 6 . 1 1 32 32 CYS H H 32 8.285 8.285 8.734 -0.449 19275
595 1 7 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.489 0.164 19275
596 1 7 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.321 -0.043 19275
597 1 7 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.846 -0.208 19275
598 1 7 . 1 1 2 2 ASP H H 2 8.656 8.656 8.316 0.340 19275
599 1 7 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.366 -0.120 19275
600 1 7 . 1 1 3 3 ARG CA C 3 56.300 56.300 56.119 0.181 19275
601 1 7 . 1 1 3 3 ARG CB C 3 30.487 30.487 31.132 -0.645 19275
602 1 7 . 1 1 3 3 ARG H H 3 8.540 8.540 8.475 0.065 19275
603 1 7 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.836 0.537 19275
604 1 7 . 1 1 4 4 GLY H H 4 8.504 8.504 8.615 -0.111 19275
605 1 7 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.850 -0.193 19275
606 1 7 . 1 1 5 5 TRP CA C 5 57.200 57.200 56.660 0.540 19275
607 1 7 . 1 1 5 5 TRP CB C 5 29.618 29.618 31.844 -2.226 19275
608 1 7 . 1 1 5 5 TRP H H 5 7.943 7.943 8.208 -0.265 19275
609 1 7 . 1 1 6 6 ILE HA H 6 4.009 4.009 3.939 0.070 19275
610 1 7 . 1 1 6 6 ILE CA C 6 60.568 60.568 62.522 -1.954 19275
611 1 7 . 1 1 6 6 ILE CB C 6 39.279 39.279 37.951 1.328 19275
612 1 7 . 1 1 6 6 ILE H H 6 7.996 7.996 8.079 -0.083 19275
613 1 7 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.767 -0.247 19275
614 1 7 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.219 1.471 19275
615 1 7 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.004 -2.604 19275
616 1 7 . 1 1 12 12 ASP H H 12 8.462 8.462 8.207 0.255 19275
617 1 7 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.749 0.139 19275
618 1 7 . 1 1 13 13 CYS CA C 13 54.210 54.210 55.140 -0.930 19275
619 1 7 . 1 1 13 13 CYS CB C 13 38.039 38.039 26.965 11.074 19275
620 1 7 . 1 1 13 13 CYS H H 13 7.379 7.379 7.767 -0.388 19275
621 1 7 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.505 -0.129 19275
622 1 7 . 1 1 14 14 PRO CA C 14 64.055 64.055 63.318 0.737 19275
623 1 7 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.231 -0.089 19275
624 1 7 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.739 -0.054 19275
625 1 7 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.151 0.494 19275
626 1 7 . 1 1 15 15 ASN CB C 15 38.632 38.632 37.416 1.216 19275
627 1 7 . 1 1 15 15 ASN H H 15 8.574 8.574 8.366 0.208 19275
628 1 7 . 1 1 16 16 VAL HA H 16 4.136 4.136 4.175 -0.039 19275
629 1 7 . 1 1 16 16 VAL CA C 16 62.669 62.669 62.550 0.119 19275
630 1 7 . 1 1 16 16 VAL CB C 16 32.555 32.555 32.334 0.221 19275
631 1 7 . 1 1 16 16 VAL H H 16 7.763 7.763 7.678 0.085 19275
632 1 7 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.572 -0.386 19275
633 1 7 . 1 1 17 17 ILE CA C 17 61.580 61.580 61.549 0.031 19275
634 1 7 . 1 1 17 17 ILE CB C 17 38.480 38.480 39.516 -1.036 19275
635 1 7 . 1 1 17 17 ILE H H 17 8.210 8.210 8.025 0.185 19275
636 1 7 . 1 1 18 18 SER HA H 18 4.486 4.486 4.463 0.023 19275
637 1 7 . 1 1 18 18 SER CA C 18 58.520 58.520 58.388 0.132 19275
638 1 7 . 1 1 18 18 SER CB C 18 63.880 63.880 63.082 0.798 19275
639 1 7 . 1 1 18 18 SER H H 18 8.318 8.318 8.650 -0.332 19275
640 1 7 . 1 1 19 19 SER HA H 19 4.483 4.483 4.686 -0.203 19275
641 1 7 . 1 1 19 19 SER CA C 19 59.080 59.080 58.367 0.713 19275
642 1 7 . 1 1 19 19 SER CB C 19 63.710 63.710 64.323 -0.613 19275
643 1 7 . 1 1 19 19 SER H H 19 8.335 8.335 8.450 -0.115 19275
644 1 7 . 1 1 20 20 ILE HA H 20 4.233 4.233 4.334 -0.101 19275
645 1 7 . 1 1 20 20 ILE CA C 20 61.890 61.890 61.059 0.830 19275
646 1 7 . 1 1 20 20 ILE CB C 20 38.500 38.500 41.014 -2.514 19275
647 1 7 . 1 1 20 20 ILE H H 20 8.002 8.002 7.566 0.436 19275
648 1 7 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.772 -0.038 19275
649 1 7 . 1 1 21 21 CYS CA C 21 55.230 55.230 56.596 -1.366 19275
650 1 7 . 1 1 21 21 CYS CB C 21 40.945 40.945 24.974 15.971 19275
651 1 7 . 1 1 21 21 CYS H H 21 8.282 8.282 8.957 -0.675 19275
652 1 7 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.063 0.328 19275
653 1 7 . 1 1 22 22 ALA CA C 22 52.899 52.899 53.284 -0.385 19275
654 1 7 . 1 1 22 22 ALA CB C 22 19.346 19.346 18.817 0.529 19275
655 1 7 . 1 1 22 22 ALA H H 22 8.119 8.119 8.341 -0.221 19275
656 1 7 . 1 1 23 23 GLY CA C 23 45.540 45.540 44.812 0.728 19275
657 1 7 . 1 1 23 23 GLY H H 23 8.417 8.417 8.061 0.356 19275
658 1 7 . 1 1 24 24 THR HA H 24 4.398 4.398 3.942 0.456 19275
659 1 7 . 1 1 24 24 THR CA C 24 61.740 61.740 63.016 -1.276 19275
660 1 7 . 1 1 24 24 THR CB C 24 69.900 69.900 68.549 1.351 19275
661 1 7 . 1 1 24 24 THR H H 24 8.081 8.081 8.043 0.038 19275
662 1 7 . 1 1 25 25 ILE HA H 25 4.278 4.278 3.991 0.287 19275
663 1 7 . 1 1 25 25 ILE CA C 25 61.386 61.386 61.686 -0.300 19275
664 1 7 . 1 1 25 25 ILE CB C 25 38.489 38.489 36.616 1.873 19275
665 1 7 . 1 1 25 25 ILE H H 25 8.073 8.073 8.449 -0.376 19275
666 1 7 . 1 1 26 26 ILE HA H 26 4.240 4.240 3.944 0.296 19275
667 1 7 . 1 1 26 26 ILE CA C 26 61.550 61.550 63.495 -1.945 19275
668 1 7 . 1 1 26 26 ILE CB C 26 38.379 38.379 38.829 -0.450 19275
669 1 7 . 1 1 26 26 ILE H H 26 8.114 8.114 8.438 -0.324 19275
670 1 7 . 1 1 27 27 THR HA H 27 4.186 4.186 4.330 -0.144 19275
671 1 7 . 1 1 27 27 THR CA C 27 62.850 62.850 63.188 -0.338 19275
672 1 7 . 1 1 27 27 THR CB C 27 69.160 69.160 69.463 -0.303 19275
673 1 7 . 1 1 27 27 THR H H 27 7.873 7.873 8.408 -0.535 19275
674 1 7 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.577 -0.213 19275
675 1 7 . 1 1 28 28 ALA CA C 28 52.828 52.828 52.300 0.528 19275
676 1 7 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.496 -0.540 19275
677 1 7 . 1 1 28 28 ALA H H 28 8.114 8.114 8.526 -0.412 19275
678 1 7 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.791 -0.156 19275
679 1 7 . 1 1 29 29 CYS CA C 29 56.230 56.230 57.686 -1.456 19275
680 1 7 . 1 1 29 29 CYS CB C 29 41.976 41.976 28.728 13.248 19275
681 1 7 . 1 1 29 29 CYS H H 29 8.008 8.008 7.533 0.475 19275
682 1 7 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.349 0.022 19275
683 1 7 . 1 1 30 30 LYS CA C 30 56.500 56.500 56.287 0.213 19275
684 1 7 . 1 1 30 30 LYS CB C 30 32.970 32.970 31.810 1.160 19275
685 1 7 . 1 1 30 30 LYS H H 30 8.311 8.311 8.191 0.120 19275
686 1 7 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.712 0.049 19275
687 1 7 . 1 1 31 31 ASN CA C 31 53.583 53.583 53.844 -0.261 19275
688 1 7 . 1 1 31 31 ASN CB C 31 39.178 39.178 39.437 -0.259 19275
689 1 7 . 1 1 31 31 ASN H H 31 8.351 8.351 7.470 0.881 19275
690 1 7 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.449 0.066 19275
691 1 7 . 1 1 32 32 CYS CA C 32 55.690 55.690 59.521 -3.831 19275
692 1 7 . 1 1 32 32 CYS CB C 32 34.190 34.190 26.858 7.332 19275
693 1 7 . 1 1 32 32 CYS H H 32 8.285 8.285 8.711 -0.426 19275
694 1 8 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.779 -0.126 19275
695 1 8 . 1 1 2 2 ASP CA C 2 54.278 54.278 53.940 0.338 19275
696 1 8 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.152 0.485 19275
697 1 8 . 1 1 2 2 ASP H H 2 8.656 8.656 8.584 0.072 19275
698 1 8 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.021 0.225 19275
699 1 8 . 1 1 3 3 ARG CA C 3 56.300 56.300 56.612 -0.312 19275
700 1 8 . 1 1 3 3 ARG CB C 3 30.487 30.487 29.897 0.590 19275
701 1 8 . 1 1 3 3 ARG H H 3 8.540 8.540 8.442 0.098 19275
702 1 8 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.460 0.913 19275
703 1 8 . 1 1 4 4 GLY H H 4 8.504 8.504 8.217 0.287 19275
704 1 8 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.963 -0.306 19275
705 1 8 . 1 1 5 5 TRP CA C 5 57.200 57.200 57.451 -0.251 19275
706 1 8 . 1 1 5 5 TRP CB C 5 29.618 29.618 30.425 -0.808 19275
707 1 8 . 1 1 5 5 TRP H H 5 7.943 7.943 8.148 -0.205 19275
708 1 8 . 1 1 6 6 ILE HA H 6 4.009 4.009 3.941 0.068 19275
709 1 8 . 1 1 6 6 ILE CA C 6 60.568 60.568 62.611 -2.043 19275
710 1 8 . 1 1 6 6 ILE CB C 6 39.279 39.279 37.964 1.315 19275
711 1 8 . 1 1 6 6 ILE H H 6 7.996 7.996 7.816 0.180 19275
712 1 8 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.739 -0.219 19275
713 1 8 . 1 1 12 12 ASP CA C 12 55.690 55.690 53.778 1.912 19275
714 1 8 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.004 -2.604 19275
715 1 8 . 1 1 12 12 ASP H H 12 8.462 8.462 8.235 0.227 19275
716 1 8 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.416 0.472 19275
717 1 8 . 1 1 13 13 CYS CA C 13 54.210 54.210 57.141 -2.931 19275
718 1 8 . 1 1 13 13 CYS CB C 13 38.039 38.039 26.448 11.591 19275
719 1 8 . 1 1 13 13 CYS H H 13 7.379 7.379 7.942 -0.563 19275
720 1 8 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.319 0.057 19275
721 1 8 . 1 1 14 14 PRO CA C 14 64.055 64.055 64.397 -0.342 19275
722 1 8 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.003 0.139 19275
723 1 8 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.753 -0.068 19275
724 1 8 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.366 0.279 19275
725 1 8 . 1 1 15 15 ASN CB C 15 38.632 38.632 40.451 -1.819 19275
726 1 8 . 1 1 15 15 ASN H H 15 8.574 8.574 7.765 0.809 19275
727 1 8 . 1 1 16 16 VAL HA H 16 4.136 4.136 4.389 -0.253 19275
728 1 8 . 1 1 16 16 VAL CA C 16 62.669 62.669 61.335 1.334 19275
729 1 8 . 1 1 16 16 VAL CB C 16 32.555 32.555 31.875 0.680 19275
730 1 8 . 1 1 16 16 VAL H H 16 7.763 7.763 8.554 -0.791 19275
731 1 8 . 1 1 17 17 ILE HA H 17 4.186 4.186 3.788 0.398 19275
732 1 8 . 1 1 17 17 ILE CA C 17 61.580 61.580 62.244 -0.664 19275
733 1 8 . 1 1 17 17 ILE CB C 17 38.480 38.480 37.356 1.124 19275
734 1 8 . 1 1 17 17 ILE H H 17 8.210 8.210 7.581 0.629 19275
735 1 8 . 1 1 18 18 SER HA H 18 4.486 4.486 4.231 0.255 19275
736 1 8 . 1 1 18 18 SER CA C 18 58.520 58.520 59.968 -1.448 19275
737 1 8 . 1 1 18 18 SER CB C 18 63.880 63.880 63.700 0.180 19275
738 1 8 . 1 1 18 18 SER H H 18 8.318 8.318 8.818 -0.500 19275
739 1 8 . 1 1 19 19 SER HA H 19 4.483 4.483 4.456 0.027 19275
740 1 8 . 1 1 19 19 SER CA C 19 59.080 59.080 57.976 1.104 19275
741 1 8 . 1 1 19 19 SER CB C 19 63.710 63.710 61.602 2.107 19275
742 1 8 . 1 1 19 19 SER H H 19 8.335 8.335 8.191 0.144 19275
743 1 8 . 1 1 20 20 ILE HA H 20 4.233 4.233 3.734 0.499 19275
744 1 8 . 1 1 20 20 ILE CA C 20 61.890 61.890 62.394 -0.504 19275
745 1 8 . 1 1 20 20 ILE CB C 20 38.500 38.500 37.645 0.855 19275
746 1 8 . 1 1 20 20 ILE H H 20 8.002 8.002 8.246 -0.244 19275
747 1 8 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.703 0.031 19275
748 1 8 . 1 1 21 21 CYS CA C 21 55.230 55.230 59.489 -4.259 19275
749 1 8 . 1 1 21 21 CYS CB C 21 40.945 40.945 25.970 14.975 19275
750 1 8 . 1 1 21 21 CYS H H 21 8.282 8.282 8.701 -0.419 19275
751 1 8 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.385 0.006 19275
752 1 8 . 1 1 22 22 ALA CA C 22 52.899 52.899 51.634 1.265 19275
753 1 8 . 1 1 22 22 ALA CB C 22 19.346 19.346 19.772 -0.426 19275
754 1 8 . 1 1 22 22 ALA H H 22 8.119 8.119 7.300 0.819 19275
755 1 8 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.372 0.168 19275
756 1 8 . 1 1 23 23 GLY H H 23 8.417 8.417 8.420 -0.003 19275
757 1 8 . 1 1 24 24 THR HA H 24 4.398 4.398 4.558 -0.160 19275
758 1 8 . 1 1 24 24 THR CA C 24 61.740 61.740 60.694 1.046 19275
759 1 8 . 1 1 24 24 THR CB C 24 69.900 69.900 70.556 -0.656 19275
760 1 8 . 1 1 24 24 THR H H 24 8.081 8.081 8.027 0.054 19275
761 1 8 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.100 0.178 19275
762 1 8 . 1 1 25 25 ILE CA C 25 61.386 61.386 61.734 -0.348 19275
763 1 8 . 1 1 25 25 ILE CB C 25 38.489 38.489 37.926 0.563 19275
764 1 8 . 1 1 25 25 ILE H H 25 8.073 8.073 8.295 -0.222 19275
765 1 8 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.230 0.010 19275
766 1 8 . 1 1 26 26 ILE CA C 26 61.550 61.550 61.186 0.364 19275
767 1 8 . 1 1 26 26 ILE CB C 26 38.379 38.379 39.142 -0.763 19275
768 1 8 . 1 1 26 26 ILE H H 26 8.114 8.114 7.750 0.364 19275
769 1 8 . 1 1 27 27 THR HA H 27 4.186 4.186 4.325 -0.139 19275
770 1 8 . 1 1 27 27 THR CA C 27 62.850 62.850 63.779 -0.929 19275
771 1 8 . 1 1 27 27 THR CB C 27 69.160 69.160 67.149 2.011 19275
772 1 8 . 1 1 27 27 THR H H 27 7.873 7.873 8.737 -0.864 19275
773 1 8 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.443 -0.079 19275
774 1 8 . 1 1 28 28 ALA CA C 28 52.828 52.828 51.754 1.074 19275
775 1 8 . 1 1 28 28 ALA CB C 28 18.956 18.956 20.018 -1.062 19275
776 1 8 . 1 1 28 28 ALA H H 28 8.114 8.114 8.508 -0.394 19275
777 1 8 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.175 0.460 19275
778 1 8 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.636 -2.406 19275
779 1 8 . 1 1 29 29 CYS CB C 29 41.976 41.976 26.978 14.998 19275
780 1 8 . 1 1 29 29 CYS H H 29 8.008 8.008 8.161 -0.152 19275
781 1 8 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.165 0.206 19275
782 1 8 . 1 1 30 30 LYS CA C 30 56.500 56.500 58.819 -2.319 19275
783 1 8 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.327 0.643 19275
784 1 8 . 1 1 30 30 LYS H H 30 8.311 8.311 8.880 -0.569 19275
785 1 8 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.355 0.406 19275
786 1 8 . 1 1 31 31 ASN CA C 31 53.583 53.583 54.493 -0.910 19275
787 1 8 . 1 1 31 31 ASN CB C 31 39.178 39.178 37.809 1.369 19275
788 1 8 . 1 1 31 31 ASN H H 31 8.351 8.351 8.284 0.067 19275
789 1 8 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.357 0.158 19275
790 1 8 . 1 1 32 32 CYS CA C 32 55.690 55.690 60.386 -4.696 19275
791 1 8 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.246 6.944 19275
792 1 8 . 1 1 32 32 CYS H H 32 8.285 8.285 8.713 -0.428 19275
793 1 9 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.714 -0.061 19275
794 1 9 . 1 1 2 2 ASP CA C 2 54.278 54.278 53.547 0.731 19275
795 1 9 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.397 0.240 19275
796 1 9 . 1 1 2 2 ASP H H 2 8.656 8.656 8.212 0.444 19275
797 1 9 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.181 0.065 19275
798 1 9 . 1 1 3 3 ARG CA C 3 56.300 56.300 56.209 0.091 19275
799 1 9 . 1 1 3 3 ARG CB C 3 30.487 30.487 30.193 0.294 19275
800 1 9 . 1 1 3 3 ARG H H 3 8.540 8.540 8.664 -0.124 19275
801 1 9 . 1 1 4 4 GLY CA C 4 45.373 45.373 45.170 0.203 19275
802 1 9 . 1 1 4 4 GLY H H 4 8.504 8.504 8.483 0.021 19275
803 1 9 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.954 -0.297 19275
804 1 9 . 1 1 5 5 TRP CA C 5 57.200 57.200 56.142 1.058 19275
805 1 9 . 1 1 5 5 TRP CB C 5 29.618 29.618 29.799 -0.181 19275
806 1 9 . 1 1 5 5 TRP H H 5 7.943 7.943 8.051 -0.108 19275
807 1 9 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.668 -0.659 19275
808 1 9 . 1 1 6 6 ILE CA C 6 60.568 60.568 60.755 -0.187 19275
809 1 9 . 1 1 6 6 ILE CB C 6 39.279 39.279 40.395 -1.116 19275
810 1 9 . 1 1 6 6 ILE H H 6 7.996 7.996 8.478 -0.482 19275
811 1 9 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.653 -0.133 19275
812 1 9 . 1 1 12 12 ASP CA C 12 55.690 55.690 53.652 2.038 19275
813 1 9 . 1 1 12 12 ASP CB C 12 38.400 38.400 40.561 -2.161 19275
814 1 9 . 1 1 12 12 ASP H H 12 8.462 8.462 8.210 0.252 19275
815 1 9 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.425 0.463 19275
816 1 9 . 1 1 13 13 CYS CA C 13 54.210 54.210 57.840 -3.630 19275
817 1 9 . 1 1 13 13 CYS CB C 13 38.039 38.039 27.348 10.691 19275
818 1 9 . 1 1 13 13 CYS H H 13 7.379 7.379 7.999 -0.620 19275
819 1 9 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.385 -0.009 19275
820 1 9 . 1 1 14 14 PRO CA C 14 64.055 64.055 62.589 1.466 19275
821 1 9 . 1 1 14 14 PRO CB C 14 32.142 32.142 29.781 2.361 19275
822 1 9 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.425 0.260 19275
823 1 9 . 1 1 15 15 ASN CA C 15 53.645 53.645 54.283 -0.638 19275
824 1 9 . 1 1 15 15 ASN CB C 15 38.632 38.632 38.999 -0.367 19275
825 1 9 . 1 1 15 15 ASN H H 15 8.574 8.574 8.169 0.405 19275
826 1 9 . 1 1 16 16 VAL HA H 16 4.136 4.136 4.265 -0.129 19275
827 1 9 . 1 1 16 16 VAL CA C 16 62.669 62.669 62.648 0.021 19275
828 1 9 . 1 1 16 16 VAL CB C 16 32.555 32.555 32.282 0.273 19275
829 1 9 . 1 1 16 16 VAL H H 16 7.763 7.763 8.481 -0.718 19275
830 1 9 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.218 -0.032 19275
831 1 9 . 1 1 17 17 ILE CA C 17 61.580 61.580 61.229 0.351 19275
832 1 9 . 1 1 17 17 ILE CB C 17 38.480 38.480 38.407 0.073 19275
833 1 9 . 1 1 17 17 ILE H H 17 8.210 8.210 8.166 0.044 19275
834 1 9 . 1 1 18 18 SER HA H 18 4.486 4.486 4.483 0.003 19275
835 1 9 . 1 1 18 18 SER CA C 18 58.520 58.520 59.729 -1.209 19275
836 1 9 . 1 1 18 18 SER CB C 18 63.880 63.880 63.274 0.606 19275
837 1 9 . 1 1 18 18 SER H H 18 8.318 8.318 8.244 0.074 19275
838 1 9 . 1 1 19 19 SER HA H 19 4.483 4.483 4.529 -0.046 19275
839 1 9 . 1 1 19 19 SER CA C 19 59.080 59.080 58.468 0.612 19275
840 1 9 . 1 1 19 19 SER CB C 19 63.710 63.710 63.751 -0.041 19275
841 1 9 . 1 1 19 19 SER H H 19 8.335 8.335 8.060 0.275 19275
842 1 9 . 1 1 20 20 ILE HA H 20 4.233 4.233 3.719 0.514 19275
843 1 9 . 1 1 20 20 ILE CA C 20 61.890 61.890 61.372 0.518 19275
844 1 9 . 1 1 20 20 ILE CB C 20 38.500 38.500 38.575 -0.075 19275
845 1 9 . 1 1 20 20 ILE H H 20 8.002 8.002 7.956 0.046 19275
846 1 9 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.302 0.432 19275
847 1 9 . 1 1 21 21 CYS CA C 21 55.230 55.230 59.638 -4.408 19275
848 1 9 . 1 1 21 21 CYS CB C 21 40.945 40.945 26.525 14.420 19275
849 1 9 . 1 1 21 21 CYS H H 21 8.282 8.282 8.720 -0.438 19275
850 1 9 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.307 0.084 19275
851 1 9 . 1 1 22 22 ALA CA C 22 52.899 52.899 52.330 0.569 19275
852 1 9 . 1 1 22 22 ALA CB C 22 19.346 19.346 19.511 -0.165 19275
853 1 9 . 1 1 22 22 ALA H H 22 8.119 8.119 7.594 0.525 19275
854 1 9 . 1 1 23 23 GLY CA C 23 45.540 45.540 44.789 0.751 19275
855 1 9 . 1 1 23 23 GLY H H 23 8.417 8.417 8.191 0.226 19275
856 1 9 . 1 1 24 24 THR HA H 24 4.398 4.398 4.013 0.385 19275
857 1 9 . 1 1 24 24 THR CA C 24 61.740 61.740 63.130 -1.390 19275
858 1 9 . 1 1 24 24 THR CB C 24 69.900 69.900 68.546 1.354 19275
859 1 9 . 1 1 24 24 THR H H 24 8.081 8.081 7.871 0.210 19275
860 1 9 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.330 -0.052 19275
861 1 9 . 1 1 25 25 ILE CA C 25 61.386 61.386 61.561 -0.175 19275
862 1 9 . 1 1 25 25 ILE CB C 25 38.489 38.489 38.240 0.249 19275
863 1 9 . 1 1 25 25 ILE H H 25 8.073 8.073 8.112 -0.039 19275
864 1 9 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.495 -0.255 19275
865 1 9 . 1 1 26 26 ILE CA C 26 61.550 61.550 61.596 -0.046 19275
866 1 9 . 1 1 26 26 ILE CB C 26 38.379 38.379 38.794 -0.415 19275
867 1 9 . 1 1 26 26 ILE H H 26 8.114 8.114 8.055 0.059 19275
868 1 9 . 1 1 27 27 THR HA H 27 4.186 4.186 4.774 -0.588 19275
869 1 9 . 1 1 27 27 THR CA C 27 62.850 62.850 61.740 1.110 19275
870 1 9 . 1 1 27 27 THR CB C 27 69.160 69.160 71.684 -2.524 19275
871 1 9 . 1 1 27 27 THR H H 27 7.873 7.873 8.161 -0.288 19275
872 1 9 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.473 -0.109 19275
873 1 9 . 1 1 28 28 ALA CA C 28 52.828 52.828 52.680 0.148 19275
874 1 9 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.832 -0.877 19275
875 1 9 . 1 1 28 28 ALA H H 28 8.114 8.114 8.102 0.012 19275
876 1 9 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.782 -0.147 19275
877 1 9 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.327 -2.097 19275
878 1 9 . 1 1 29 29 CYS CB C 29 41.976 41.976 26.934 15.042 19275
879 1 9 . 1 1 29 29 CYS H H 29 8.008 8.008 8.084 -0.076 19275
880 1 9 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.438 -0.067 19275
881 1 9 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.960 -1.460 19275
882 1 9 . 1 1 30 30 LYS CB C 30 32.970 32.970 33.193 -0.223 19275
883 1 9 . 1 1 30 30 LYS H H 30 8.311 8.311 8.195 0.116 19275
884 1 9 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.847 -0.086 19275
885 1 9 . 1 1 31 31 ASN CA C 31 53.583 53.583 52.207 1.376 19275
886 1 9 . 1 1 31 31 ASN CB C 31 39.178 39.178 40.334 -1.156 19275
887 1 9 . 1 1 31 31 ASN H H 31 8.351 8.351 7.762 0.589 19275
888 1 9 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.630 -0.115 19275
889 1 9 . 1 1 32 32 CYS CA C 32 55.690 55.690 58.994 -3.304 19275
890 1 9 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.645 6.545 19275
891 1 9 . 1 1 32 32 CYS H H 32 8.285 8.285 8.511 -0.226 19275
892 1 10 . 1 1 2 2 ASP HA H 2 4.653 4.653 5.359 -0.706 19275
893 1 10 . 1 1 2 2 ASP CA C 2 54.278 54.278 53.821 0.457 19275
894 1 10 . 1 1 2 2 ASP CB C 2 41.637 41.637 42.303 -0.666 19275
895 1 10 . 1 1 2 2 ASP H H 2 8.656 8.656 8.981 -0.325 19275
896 1 10 . 1 1 3 3 ARG HA H 3 4.246 4.246 5.181 -0.935 19275
897 1 10 . 1 1 3 3 ARG CA C 3 56.300 56.300 55.228 1.072 19275
898 1 10 . 1 1 3 3 ARG CB C 3 30.487 30.487 32.931 -2.444 19275
899 1 10 . 1 1 3 3 ARG H H 3 8.540 8.540 8.712 -0.172 19275
900 1 10 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.923 0.450 19275
901 1 10 . 1 1 4 4 GLY H H 4 8.504 8.504 8.533 -0.029 19275
902 1 10 . 1 1 5 5 TRP HA H 5 4.657 4.657 5.017 -0.360 19275
903 1 10 . 1 1 5 5 TRP CA C 5 57.200 57.200 57.508 -0.308 19275
904 1 10 . 1 1 5 5 TRP CB C 5 29.618 29.618 30.435 -0.817 19275
905 1 10 . 1 1 5 5 TRP H H 5 7.943 7.943 8.148 -0.205 19275
906 1 10 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.373 -0.364 19275
907 1 10 . 1 1 6 6 ILE CA C 6 60.568 60.568 60.806 -0.238 19275
908 1 10 . 1 1 6 6 ILE CB C 6 39.279 39.279 40.208 -0.929 19275
909 1 10 . 1 1 6 6 ILE H H 6 7.996 7.996 8.474 -0.478 19275
910 1 10 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.773 -0.253 19275
911 1 10 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.011 1.679 19275
912 1 10 . 1 1 12 12 ASP CB C 12 38.400 38.400 40.921 -2.521 19275
913 1 10 . 1 1 12 12 ASP H H 12 8.462 8.462 8.215 0.247 19275
914 1 10 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.680 0.208 19275
915 1 10 . 1 1 13 13 CYS CA C 13 54.210 54.210 55.724 -1.514 19275
916 1 10 . 1 1 13 13 CYS CB C 13 38.039 38.039 26.676 11.363 19275
917 1 10 . 1 1 13 13 CYS H H 13 7.379 7.379 7.849 -0.470 19275
918 1 10 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.401 -0.025 19275
919 1 10 . 1 1 14 14 PRO CA C 14 64.055 64.055 64.232 -0.177 19275
920 1 10 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.187 -0.045 19275
921 1 10 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.689 -0.004 19275
922 1 10 . 1 1 15 15 ASN CA C 15 53.645 53.645 52.746 0.899 19275
923 1 10 . 1 1 15 15 ASN CB C 15 38.632 38.632 38.937 -0.305 19275
924 1 10 . 1 1 15 15 ASN H H 15 8.574 8.574 7.985 0.589 19275
925 1 10 . 1 1 16 16 VAL HA H 16 4.136 4.136 3.801 0.335 19275
926 1 10 . 1 1 16 16 VAL CA C 16 62.669 62.669 62.552 0.117 19275
927 1 10 . 1 1 16 16 VAL CB C 16 32.555 32.555 31.689 0.866 19275
928 1 10 . 1 1 16 16 VAL H H 16 7.763 7.763 8.206 -0.443 19275
929 1 10 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.540 -0.354 19275
930 1 10 . 1 1 17 17 ILE CA C 17 61.580 61.580 60.981 0.599 19275
931 1 10 . 1 1 17 17 ILE CB C 17 38.480 38.480 38.822 -0.341 19275
932 1 10 . 1 1 17 17 ILE H H 17 8.210 8.210 7.881 0.329 19275
933 1 10 . 1 1 18 18 SER HA H 18 4.486 4.486 4.454 0.032 19275
934 1 10 . 1 1 18 18 SER CA C 18 58.520 58.520 58.160 0.360 19275
935 1 10 . 1 1 18 18 SER CB C 18 63.880 63.880 63.539 0.341 19275
936 1 10 . 1 1 18 18 SER H H 18 8.318 8.318 8.883 -0.565 19275
937 1 10 . 1 1 19 19 SER HA H 19 4.483 4.483 4.768 -0.285 19275
938 1 10 . 1 1 19 19 SER CA C 19 59.080 59.080 57.904 1.176 19275
939 1 10 . 1 1 19 19 SER CB C 19 63.710 63.710 63.321 0.389 19275
940 1 10 . 1 1 19 19 SER H H 19 8.335 8.335 8.014 0.321 19275
941 1 10 . 1 1 20 20 ILE HA H 20 4.233 4.233 3.854 0.379 19275
942 1 10 . 1 1 20 20 ILE CA C 20 61.890 61.890 61.519 0.371 19275
943 1 10 . 1 1 20 20 ILE CB C 20 38.500 38.500 38.541 -0.041 19275
944 1 10 . 1 1 20 20 ILE H H 20 8.002 8.002 8.300 -0.298 19275
945 1 10 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.620 0.114 19275
946 1 10 . 1 1 21 21 CYS CA C 21 55.230 55.230 58.710 -3.480 19275
947 1 10 . 1 1 21 21 CYS CB C 21 40.945 40.945 28.803 12.142 19275
948 1 10 . 1 1 21 21 CYS H H 21 8.282 8.282 8.477 -0.195 19275
949 1 10 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.354 0.037 19275
950 1 10 . 1 1 22 22 ALA CA C 22 52.899 52.899 51.593 1.306 19275
951 1 10 . 1 1 22 22 ALA CB C 22 19.346 19.346 19.436 -0.090 19275
952 1 10 . 1 1 22 22 ALA H H 22 8.119 8.119 7.615 0.504 19275
953 1 10 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.187 0.353 19275
954 1 10 . 1 1 23 23 GLY H H 23 8.417 8.417 8.686 -0.269 19275
955 1 10 . 1 1 24 24 THR HA H 24 4.398 4.398 4.410 -0.012 19275
956 1 10 . 1 1 24 24 THR CA C 24 61.740 61.740 61.640 0.100 19275
957 1 10 . 1 1 24 24 THR CB C 24 69.900 69.900 71.291 -1.391 19275
958 1 10 . 1 1 24 24 THR H H 24 8.081 8.081 7.611 0.470 19275
959 1 10 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.573 -0.295 19275
960 1 10 . 1 1 25 25 ILE CA C 25 61.386 61.386 61.814 -0.428 19275
961 1 10 . 1 1 25 25 ILE CB C 25 38.489 38.489 38.185 0.304 19275
962 1 10 . 1 1 25 25 ILE H H 25 8.073 8.073 8.342 -0.269 19275
963 1 10 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.282 -0.042 19275
964 1 10 . 1 1 26 26 ILE CA C 26 61.550 61.550 61.136 0.414 19275
965 1 10 . 1 1 26 26 ILE CB C 26 38.379 38.379 37.932 0.447 19275
966 1 10 . 1 1 26 26 ILE H H 26 8.114 8.114 7.674 0.440 19275
967 1 10 . 1 1 27 27 THR HA H 27 4.186 4.186 4.576 -0.390 19275
968 1 10 . 1 1 27 27 THR CA C 27 62.850 62.850 61.393 1.457 19275
969 1 10 . 1 1 27 27 THR CB C 27 69.160 69.160 71.029 -1.869 19275
970 1 10 . 1 1 27 27 THR H H 27 7.873 7.873 7.670 0.203 19275
971 1 10 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.651 -0.287 19275
972 1 10 . 1 1 28 28 ALA CA C 28 52.828 52.828 51.460 1.368 19275
973 1 10 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.163 -0.207 19275
974 1 10 . 1 1 28 28 ALA H H 28 8.114 8.114 8.239 -0.125 19275
975 1 10 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.280 0.355 19275
976 1 10 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.106 -1.877 19275
977 1 10 . 1 1 29 29 CYS CB C 29 41.976 41.976 25.354 16.622 19275
978 1 10 . 1 1 29 29 CYS H H 29 8.008 8.008 8.051 -0.043 19275
979 1 10 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.215 0.156 19275
980 1 10 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.796 -1.296 19275
981 1 10 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.601 0.369 19275
982 1 10 . 1 1 30 30 LYS H H 30 8.311 8.311 8.668 -0.357 19275
983 1 10 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.858 -0.097 19275
984 1 10 . 1 1 31 31 ASN CA C 31 53.583 53.583 52.579 1.004 19275
985 1 10 . 1 1 31 31 ASN CB C 31 39.178 39.178 40.312 -1.134 19275
986 1 10 . 1 1 31 31 ASN H H 31 8.351 8.351 7.684 0.667 19275
987 1 10 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.513 0.003 19275
988 1 10 . 1 1 32 32 CYS CA C 32 55.690 55.690 59.211 -3.521 19275
989 1 10 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.026 7.164 19275
990 1 10 . 1 1 32 32 CYS H H 32 8.285 8.285 8.553 -0.268 19275
991 1 11 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.590 0.063 19275
992 1 11 . 1 1 2 2 ASP CA C 2 54.278 54.278 53.966 0.312 19275
993 1 11 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.152 0.485 19275
994 1 11 . 1 1 2 2 ASP H H 2 8.656 8.656 8.420 0.236 19275
995 1 11 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.070 0.176 19275
996 1 11 . 1 1 3 3 ARG CA C 3 56.300 56.300 55.971 0.329 19275
997 1 11 . 1 1 3 3 ARG CB C 3 30.487 30.487 28.429 2.058 19275
998 1 11 . 1 1 3 3 ARG H H 3 8.540 8.540 8.503 0.037 19275
999 1 11 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.827 0.546 19275
1000 1 11 . 1 1 4 4 GLY H H 4 8.504 8.504 7.962 0.542 19275
1001 1 11 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.926 -0.269 19275
1002 1 11 . 1 1 5 5 TRP CA C 5 57.200 57.200 57.194 0.006 19275
1003 1 11 . 1 1 5 5 TRP CB C 5 29.618 29.618 30.739 -1.121 19275
1004 1 11 . 1 1 5 5 TRP H H 5 7.943 7.943 8.403 -0.460 19275
1005 1 11 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.521 -0.512 19275
1006 1 11 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.218 -0.650 19275
1007 1 11 . 1 1 6 6 ILE CB C 6 39.279 39.279 40.023 -0.744 19275
1008 1 11 . 1 1 6 6 ILE H H 6 7.996 7.996 8.061 -0.065 19275
1009 1 11 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.757 -0.237 19275
1010 1 11 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.157 1.533 19275
1011 1 11 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.176 -2.776 19275
1012 1 11 . 1 1 12 12 ASP H H 12 8.462 8.462 8.342 0.120 19275
1013 1 11 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.351 0.537 19275
1014 1 11 . 1 1 13 13 CYS CA C 13 54.210 54.210 56.856 -2.646 19275
1015 1 11 . 1 1 13 13 CYS CB C 13 38.039 38.039 26.873 11.166 19275
1016 1 11 . 1 1 13 13 CYS H H 13 7.379 7.379 7.901 -0.522 19275
1017 1 11 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.388 -0.012 19275
1018 1 11 . 1 1 14 14 PRO CA C 14 64.055 64.055 63.826 0.229 19275
1019 1 11 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.028 0.114 19275
1020 1 11 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.637 0.048 19275
1021 1 11 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.391 0.254 19275
1022 1 11 . 1 1 15 15 ASN CB C 15 38.632 38.632 39.047 -0.415 19275
1023 1 11 . 1 1 15 15 ASN H H 15 8.574 8.574 8.568 0.006 19275
1024 1 11 . 1 1 16 16 VAL HA H 16 4.136 4.136 4.321 -0.185 19275
1025 1 11 . 1 1 16 16 VAL CA C 16 62.669 62.669 61.840 0.829 19275
1026 1 11 . 1 1 16 16 VAL CB C 16 32.555 32.555 31.943 0.612 19275
1027 1 11 . 1 1 16 16 VAL H H 16 7.763 7.763 7.514 0.249 19275
1028 1 11 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.488 -0.302 19275
1029 1 11 . 1 1 17 17 ILE CA C 17 61.580 61.580 59.433 2.147 19275
1030 1 11 . 1 1 17 17 ILE CB C 17 38.480 38.480 39.858 -1.377 19275
1031 1 11 . 1 1 17 17 ILE H H 17 8.210 8.210 8.103 0.107 19275
1032 1 11 . 1 1 18 18 SER HA H 18 4.486 4.486 4.242 0.244 19275
1033 1 11 . 1 1 18 18 SER CA C 18 58.520 58.520 58.335 0.185 19275
1034 1 11 . 1 1 18 18 SER CB C 18 63.880 63.880 63.634 0.246 19275
1035 1 11 . 1 1 18 18 SER H H 18 8.318 8.318 8.231 0.087 19275
1036 1 11 . 1 1 19 19 SER HA H 19 4.483 4.483 4.324 0.159 19275
1037 1 11 . 1 1 19 19 SER CA C 19 59.080 59.080 59.864 -0.784 19275
1038 1 11 . 1 1 19 19 SER CB C 19 63.710 63.710 63.608 0.102 19275
1039 1 11 . 1 1 19 19 SER H H 19 8.335 8.335 8.448 -0.113 19275
1040 1 11 . 1 1 20 20 ILE HA H 20 4.233 4.233 4.388 -0.155 19275
1041 1 11 . 1 1 20 20 ILE CA C 20 61.890 61.890 59.156 2.734 19275
1042 1 11 . 1 1 20 20 ILE CB C 20 38.500 38.500 40.745 -2.245 19275
1043 1 11 . 1 1 20 20 ILE H H 20 8.002 8.002 7.253 0.749 19275
1044 1 11 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.864 -0.130 19275
1045 1 11 . 1 1 21 21 CYS CA C 21 55.230 55.230 58.425 -3.195 19275
1046 1 11 . 1 1 21 21 CYS CB C 21 40.945 40.945 28.960 11.985 19275
1047 1 11 . 1 1 21 21 CYS H H 21 8.282 8.282 8.691 -0.409 19275
1048 1 11 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.474 -0.083 19275
1049 1 11 . 1 1 22 22 ALA CA C 22 52.899 52.899 51.815 1.084 19275
1050 1 11 . 1 1 22 22 ALA CB C 22 19.346 19.346 19.603 -0.257 19275
1051 1 11 . 1 1 22 22 ALA H H 22 8.119 8.119 7.639 0.480 19275
1052 1 11 . 1 1 23 23 GLY CA C 23 45.540 45.540 46.370 -0.830 19275
1053 1 11 . 1 1 23 23 GLY H H 23 8.417 8.417 8.443 -0.026 19275
1054 1 11 . 1 1 24 24 THR HA H 24 4.398 4.398 4.442 -0.044 19275
1055 1 11 . 1 1 24 24 THR CA C 24 61.740 61.740 61.208 0.532 19275
1056 1 11 . 1 1 24 24 THR CB C 24 69.900 69.900 70.361 -0.461 19275
1057 1 11 . 1 1 24 24 THR H H 24 8.081 8.081 7.597 0.484 19275
1058 1 11 . 1 1 25 25 ILE HA H 25 4.278 4.278 3.925 0.353 19275
1059 1 11 . 1 1 25 25 ILE CA C 25 61.386 61.386 63.799 -2.413 19275
1060 1 11 . 1 1 25 25 ILE CB C 25 38.489 38.489 37.853 0.636 19275
1061 1 11 . 1 1 25 25 ILE H H 25 8.073 8.073 8.091 -0.018 19275
1062 1 11 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.337 -0.097 19275
1063 1 11 . 1 1 26 26 ILE CA C 26 61.550 61.550 61.649 -0.099 19275
1064 1 11 . 1 1 26 26 ILE CB C 26 38.379 38.379 38.218 0.161 19275
1065 1 11 . 1 1 26 26 ILE H H 26 8.114 8.114 7.551 0.563 19275
1066 1 11 . 1 1 27 27 THR HA H 27 4.186 4.186 4.583 -0.397 19275
1067 1 11 . 1 1 27 27 THR CA C 27 62.850 62.850 62.953 -0.103 19275
1068 1 11 . 1 1 27 27 THR CB C 27 69.160 69.160 69.589 -0.429 19275
1069 1 11 . 1 1 27 27 THR H H 27 7.873 7.873 8.001 -0.128 19275
1070 1 11 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.113 0.251 19275
1071 1 11 . 1 1 28 28 ALA CA C 28 52.828 52.828 54.084 -1.256 19275
1072 1 11 . 1 1 28 28 ALA CB C 28 18.956 18.956 18.446 0.510 19275
1073 1 11 . 1 1 28 28 ALA H H 28 8.114 8.114 7.989 0.125 19275
1074 1 11 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.233 0.402 19275
1075 1 11 . 1 1 29 29 CYS CA C 29 56.230 56.230 57.881 -1.651 19275
1076 1 11 . 1 1 29 29 CYS CB C 29 41.976 41.976 26.348 15.629 19275
1077 1 11 . 1 1 29 29 CYS H H 29 8.008 8.008 7.850 0.158 19275
1078 1 11 . 1 1 30 30 LYS HA H 30 4.371 4.371 3.900 0.471 19275
1079 1 11 . 1 1 30 30 LYS CA C 30 56.500 56.500 58.616 -2.116 19275
1080 1 11 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.581 0.389 19275
1081 1 11 . 1 1 30 30 LYS H H 30 8.311 8.311 8.547 -0.236 19275
1082 1 11 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.713 0.048 19275
1083 1 11 . 1 1 31 31 ASN CA C 31 53.583 53.583 53.269 0.314 19275
1084 1 11 . 1 1 31 31 ASN CB C 31 39.178 39.178 39.023 0.156 19275
1085 1 11 . 1 1 31 31 ASN H H 31 8.351 8.351 7.562 0.789 19275
1086 1 11 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.119 0.396 19275
1087 1 11 . 1 1 32 32 CYS CA C 32 55.690 55.690 61.257 -5.567 19275
1088 1 11 . 1 1 32 32 CYS CB C 32 34.190 34.190 26.332 7.858 19275
1089 1 11 . 1 1 32 32 CYS H H 32 8.285 8.285 8.956 -0.671 19275
1090 1 12 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.739 -0.086 19275
1091 1 12 . 1 1 2 2 ASP CA C 2 54.278 54.278 53.656 0.622 19275
1092 1 12 . 1 1 2 2 ASP CB C 2 41.637 41.637 42.124 -0.487 19275
1093 1 12 . 1 1 2 2 ASP H H 2 8.656 8.656 8.336 0.320 19275
1094 1 12 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.330 -0.084 19275
1095 1 12 . 1 1 3 3 ARG CA C 3 56.300 56.300 56.690 -0.390 19275
1096 1 12 . 1 1 3 3 ARG CB C 3 30.487 30.487 30.615 -0.128 19275
1097 1 12 . 1 1 3 3 ARG H H 3 8.540 8.540 8.674 -0.134 19275
1098 1 12 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.990 0.383 19275
1099 1 12 . 1 1 4 4 GLY H H 4 8.504 8.504 8.674 -0.170 19275
1100 1 12 . 1 1 5 5 TRP HA H 5 4.657 4.657 5.041 -0.384 19275
1101 1 12 . 1 1 5 5 TRP CA C 5 57.200 57.200 56.994 0.206 19275
1102 1 12 . 1 1 5 5 TRP CB C 5 29.618 29.618 31.658 -2.040 19275
1103 1 12 . 1 1 5 5 TRP H H 5 7.943 7.943 8.258 -0.315 19275
1104 1 12 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.483 -0.474 19275
1105 1 12 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.206 -0.638 19275
1106 1 12 . 1 1 6 6 ILE CB C 6 39.279 39.279 39.342 -0.063 19275
1107 1 12 . 1 1 6 6 ILE H H 6 7.996 7.996 8.156 -0.160 19275
1108 1 12 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.730 -0.210 19275
1109 1 12 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.359 1.331 19275
1110 1 12 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.076 -2.676 19275
1111 1 12 . 1 1 12 12 ASP H H 12 8.462 8.462 8.244 0.218 19275
1112 1 12 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.865 0.023 19275
1113 1 12 . 1 1 13 13 CYS CA C 13 54.210 54.210 55.843 -1.633 19275
1114 1 12 . 1 1 13 13 CYS CB C 13 38.039 38.039 28.840 9.199 19275
1115 1 12 . 1 1 13 13 CYS H H 13 7.379 7.379 7.748 -0.369 19275
1116 1 12 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.322 0.054 19275
1117 1 12 . 1 1 14 14 PRO CA C 14 64.055 64.055 63.822 0.233 19275
1118 1 12 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.021 0.121 19275
1119 1 12 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.722 -0.037 19275
1120 1 12 . 1 1 15 15 ASN CA C 15 53.645 53.645 52.323 1.322 19275
1121 1 12 . 1 1 15 15 ASN CB C 15 38.632 38.632 39.518 -0.886 19275
1122 1 12 . 1 1 15 15 ASN H H 15 8.574 8.574 7.666 0.908 19275
1123 1 12 . 1 1 16 16 VAL HA H 16 4.136 4.136 3.747 0.389 19275
1124 1 12 . 1 1 16 16 VAL CA C 16 62.669 62.669 63.296 -0.627 19275
1125 1 12 . 1 1 16 16 VAL CB C 16 32.555 32.555 30.295 2.260 19275
1126 1 12 . 1 1 16 16 VAL H H 16 7.763 7.763 8.319 -0.556 19275
1127 1 12 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.511 -0.325 19275
1128 1 12 . 1 1 17 17 ILE CA C 17 61.580 61.580 60.125 1.455 19275
1129 1 12 . 1 1 17 17 ILE CB C 17 38.480 38.480 39.894 -1.414 19275
1130 1 12 . 1 1 17 17 ILE H H 17 8.210 8.210 7.847 0.363 19275
1131 1 12 . 1 1 18 18 SER HA H 18 4.486 4.486 4.209 0.277 19275
1132 1 12 . 1 1 18 18 SER CA C 18 58.520 58.520 59.254 -0.734 19275
1133 1 12 . 1 1 18 18 SER CB C 18 63.880 63.880 62.921 0.959 19275
1134 1 12 . 1 1 18 18 SER H H 18 8.318 8.318 8.944 -0.626 19275
1135 1 12 . 1 1 19 19 SER HA H 19 4.483 4.483 4.801 -0.318 19275
1136 1 12 . 1 1 19 19 SER CA C 19 59.080 59.080 57.435 1.645 19275
1137 1 12 . 1 1 19 19 SER CB C 19 63.710 63.710 64.075 -0.365 19275
1138 1 12 . 1 1 19 19 SER H H 19 8.335 8.335 8.204 0.131 19275
1139 1 12 . 1 1 20 20 ILE HA H 20 4.233 4.233 3.785 0.448 19275
1140 1 12 . 1 1 20 20 ILE CA C 20 61.890 61.890 62.109 -0.219 19275
1141 1 12 . 1 1 20 20 ILE CB C 20 38.500 38.500 38.406 0.094 19275
1142 1 12 . 1 1 20 20 ILE H H 20 8.002 8.002 7.684 0.318 19275
1143 1 12 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.364 0.370 19275
1144 1 12 . 1 1 21 21 CYS CA C 21 55.230 55.230 58.320 -3.090 19275
1145 1 12 . 1 1 21 21 CYS CB C 21 40.945 40.945 27.060 13.885 19275
1146 1 12 . 1 1 21 21 CYS H H 21 8.282 8.282 8.640 -0.358 19275
1147 1 12 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.063 0.328 19275
1148 1 12 . 1 1 22 22 ALA CA C 22 52.899 52.899 52.812 0.087 19275
1149 1 12 . 1 1 22 22 ALA CB C 22 19.346 19.346 18.014 1.332 19275
1150 1 12 . 1 1 22 22 ALA H H 22 8.119 8.119 8.116 0.003 19275
1151 1 12 . 1 1 23 23 GLY CA C 23 45.540 45.540 44.695 0.845 19275
1152 1 12 . 1 1 23 23 GLY H H 23 8.417 8.417 8.156 0.261 19275
1153 1 12 . 1 1 24 24 THR HA H 24 4.398 4.398 3.961 0.437 19275
1154 1 12 . 1 1 24 24 THR CA C 24 61.740 61.740 63.154 -1.413 19275
1155 1 12 . 1 1 24 24 THR CB C 24 69.900 69.900 68.962 0.938 19275
1156 1 12 . 1 1 24 24 THR H H 24 8.081 8.081 8.085 -0.004 19275
1157 1 12 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.359 -0.081 19275
1158 1 12 . 1 1 25 25 ILE CA C 25 61.386 61.386 59.086 2.300 19275
1159 1 12 . 1 1 25 25 ILE CB C 25 38.489 38.489 35.984 2.505 19275
1160 1 12 . 1 1 25 25 ILE H H 25 8.073 8.073 8.536 -0.463 19275
1161 1 12 . 1 1 26 26 ILE HA H 26 4.240 4.240 3.970 0.270 19275
1162 1 12 . 1 1 26 26 ILE CA C 26 61.550 61.550 63.478 -1.929 19275
1163 1 12 . 1 1 26 26 ILE CB C 26 38.379 38.379 39.004 -0.625 19275
1164 1 12 . 1 1 26 26 ILE H H 26 8.114 8.114 8.342 -0.228 19275
1165 1 12 . 1 1 27 27 THR HA H 27 4.186 4.186 4.356 -0.170 19275
1166 1 12 . 1 1 27 27 THR CA C 27 62.850 62.850 62.948 -0.098 19275
1167 1 12 . 1 1 27 27 THR CB C 27 69.160 69.160 69.323 -0.163 19275
1168 1 12 . 1 1 27 27 THR H H 27 7.873 7.873 8.296 -0.423 19275
1169 1 12 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.640 -0.276 19275
1170 1 12 . 1 1 28 28 ALA CA C 28 52.828 52.828 52.078 0.750 19275
1171 1 12 . 1 1 28 28 ALA CB C 28 18.956 18.956 20.453 -1.497 19275
1172 1 12 . 1 1 28 28 ALA H H 28 8.114 8.114 8.234 -0.120 19275
1173 1 12 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.925 -0.290 19275
1174 1 12 . 1 1 29 29 CYS CA C 29 56.230 56.230 57.656 -1.426 19275
1175 1 12 . 1 1 29 29 CYS CB C 29 41.976 41.976 28.178 13.798 19275
1176 1 12 . 1 1 29 29 CYS H H 29 8.008 8.008 7.817 0.191 19275
1177 1 12 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.056 0.315 19275
1178 1 12 . 1 1 30 30 LYS CA C 30 56.500 56.500 58.403 -1.903 19275
1179 1 12 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.855 0.115 19275
1180 1 12 . 1 1 30 30 LYS H H 30 8.311 8.311 8.824 -0.513 19275
1181 1 12 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.759 0.002 19275
1182 1 12 . 1 1 31 31 ASN CA C 31 53.583 53.583 51.521 2.062 19275
1183 1 12 . 1 1 31 31 ASN CB C 31 39.178 39.178 38.665 0.513 19275
1184 1 12 . 1 1 31 31 ASN H H 31 8.351 8.351 7.523 0.828 19275
1185 1 12 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.577 -0.062 19275
1186 1 12 . 1 1 32 32 CYS CA C 32 55.690 55.690 60.984 -5.294 19275
1187 1 12 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.217 6.973 19275
1188 1 12 . 1 1 32 32 CYS H H 32 8.285 8.285 8.875 -0.590 19275
1189 1 13 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.726 -0.073 19275
1190 1 13 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.091 0.187 19275
1191 1 13 . 1 1 2 2 ASP CB C 2 41.637 41.637 40.355 1.282 19275
1192 1 13 . 1 1 2 2 ASP H H 2 8.656 8.656 8.701 -0.045 19275
1193 1 13 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.443 -0.197 19275
1194 1 13 . 1 1 3 3 ARG CA C 3 56.300 56.300 56.108 0.192 19275
1195 1 13 . 1 1 3 3 ARG CB C 3 30.487 30.487 31.400 -0.913 19275
1196 1 13 . 1 1 3 3 ARG H H 3 8.540 8.540 8.459 0.081 19275
1197 1 13 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.314 1.059 19275
1198 1 13 . 1 1 4 4 GLY H H 4 8.504 8.504 7.866 0.638 19275
1199 1 13 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.499 0.158 19275
1200 1 13 . 1 1 5 5 TRP CA C 5 57.200 57.200 55.509 1.691 19275
1201 1 13 . 1 1 5 5 TRP CB C 5 29.618 29.618 29.393 0.225 19275
1202 1 13 . 1 1 5 5 TRP H H 5 7.943 7.943 7.565 0.378 19275
1203 1 13 . 1 1 6 6 ILE HA H 6 4.009 4.009 3.922 0.087 19275
1204 1 13 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.275 -0.707 19275
1205 1 13 . 1 1 6 6 ILE CB C 6 39.279 39.279 37.178 2.101 19275
1206 1 13 . 1 1 6 6 ILE H H 6 7.996 7.996 7.568 0.428 19275
1207 1 13 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.732 -0.212 19275
1208 1 13 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.204 1.486 19275
1209 1 13 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.017 -2.617 19275
1210 1 13 . 1 1 12 12 ASP H H 12 8.462 8.462 8.173 0.289 19275
1211 1 13 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.724 0.164 19275
1212 1 13 . 1 1 13 13 CYS CA C 13 54.210 54.210 56.197 -1.986 19275
1213 1 13 . 1 1 13 13 CYS CB C 13 38.039 38.039 27.905 10.134 19275
1214 1 13 . 1 1 13 13 CYS H H 13 7.379 7.379 7.995 -0.616 19275
1215 1 13 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.545 -0.169 19275
1216 1 13 . 1 1 14 14 PRO CA C 14 64.055 64.055 63.255 0.800 19275
1217 1 13 . 1 1 14 14 PRO CB C 14 32.142 32.142 30.030 2.112 19275
1218 1 13 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.880 -0.195 19275
1219 1 13 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.568 0.077 19275
1220 1 13 . 1 1 15 15 ASN CB C 15 38.632 38.632 40.688 -2.056 19275
1221 1 13 . 1 1 15 15 ASN H H 15 8.574 8.574 8.409 0.165 19275
1222 1 13 . 1 1 16 16 VAL HA H 16 4.136 4.136 4.210 -0.074 19275
1223 1 13 . 1 1 16 16 VAL CA C 16 62.669 62.669 62.529 0.140 19275
1224 1 13 . 1 1 16 16 VAL CB C 16 32.555 32.555 32.908 -0.353 19275
1225 1 13 . 1 1 16 16 VAL H H 16 7.763 7.763 7.850 -0.087 19275
1226 1 13 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.514 -0.328 19275
1227 1 13 . 1 1 17 17 ILE CA C 17 61.580 61.580 61.016 0.564 19275
1228 1 13 . 1 1 17 17 ILE CB C 17 38.480 38.480 38.735 -0.255 19275
1229 1 13 . 1 1 17 17 ILE H H 17 8.210 8.210 8.213 -0.003 19275
1230 1 13 . 1 1 18 18 SER HA H 18 4.486 4.486 4.486 0.000 19275
1231 1 13 . 1 1 18 18 SER CA C 18 58.520 58.520 57.835 0.685 19275
1232 1 13 . 1 1 18 18 SER CB C 18 63.880 63.880 63.513 0.367 19275
1233 1 13 . 1 1 18 18 SER H H 18 8.318 8.318 8.089 0.229 19275
1234 1 13 . 1 1 19 19 SER HA H 19 4.483 4.483 4.299 0.184 19275
1235 1 13 . 1 1 19 19 SER CA C 19 59.080 59.080 59.692 -0.612 19275
1236 1 13 . 1 1 19 19 SER CB C 19 63.710 63.710 63.291 0.419 19275
1237 1 13 . 1 1 19 19 SER H H 19 8.335 8.335 8.443 -0.108 19275
1238 1 13 . 1 1 20 20 ILE HA H 20 4.233 4.233 4.018 0.215 19275
1239 1 13 . 1 1 20 20 ILE CA C 20 61.890 61.890 61.433 0.457 19275
1240 1 13 . 1 1 20 20 ILE CB C 20 38.500 38.500 39.000 -0.500 19275
1241 1 13 . 1 1 20 20 ILE H H 20 8.002 8.002 7.957 0.045 19275
1242 1 13 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.700 0.034 19275
1243 1 13 . 1 1 21 21 CYS CA C 21 55.230 55.230 57.601 -2.371 19275
1244 1 13 . 1 1 21 21 CYS CB C 21 40.945 40.945 29.137 11.808 19275
1245 1 13 . 1 1 21 21 CYS H H 21 8.282 8.282 8.696 -0.414 19275
1246 1 13 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.747 -0.356 19275
1247 1 13 . 1 1 22 22 ALA CA C 22 52.899 52.899 51.444 1.455 19275
1248 1 13 . 1 1 22 22 ALA CB C 22 19.346 19.346 21.068 -1.722 19275
1249 1 13 . 1 1 22 22 ALA H H 22 8.119 8.119 7.459 0.660 19275
1250 1 13 . 1 1 23 23 GLY CA C 23 45.540 45.540 46.079 -0.539 19275
1251 1 13 . 1 1 23 23 GLY H H 23 8.417 8.417 8.480 -0.063 19275
1252 1 13 . 1 1 24 24 THR HA H 24 4.398 4.398 4.250 0.148 19275
1253 1 13 . 1 1 24 24 THR CA C 24 61.740 61.740 62.930 -1.190 19275
1254 1 13 . 1 1 24 24 THR CB C 24 69.900 69.900 70.128 -0.228 19275
1255 1 13 . 1 1 24 24 THR H H 24 8.081 8.081 7.731 0.350 19275
1256 1 13 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.394 -0.116 19275
1257 1 13 . 1 1 25 25 ILE CA C 25 61.386 61.386 60.435 0.951 19275
1258 1 13 . 1 1 25 25 ILE CB C 25 38.489 38.489 38.942 -0.453 19275
1259 1 13 . 1 1 25 25 ILE H H 25 8.073 8.073 8.444 -0.371 19275
1260 1 13 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.205 0.035 19275
1261 1 13 . 1 1 26 26 ILE CA C 26 61.550 61.550 62.794 -1.244 19275
1262 1 13 . 1 1 26 26 ILE CB C 26 38.379 38.379 39.131 -0.752 19275
1263 1 13 . 1 1 26 26 ILE H H 26 8.114 8.114 8.635 -0.521 19275
1264 1 13 . 1 1 27 27 THR HA H 27 4.186 4.186 4.428 -0.242 19275
1265 1 13 . 1 1 27 27 THR CA C 27 62.850 62.850 62.872 -0.022 19275
1266 1 13 . 1 1 27 27 THR CB C 27 69.160 69.160 69.023 0.137 19275
1267 1 13 . 1 1 27 27 THR H H 27 7.873 7.873 7.713 0.160 19275
1268 1 13 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.523 -0.159 19275
1269 1 13 . 1 1 28 28 ALA CA C 28 52.828 52.828 52.727 0.100 19275
1270 1 13 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.438 -0.482 19275
1271 1 13 . 1 1 28 28 ALA H H 28 8.114 8.114 8.339 -0.225 19275
1272 1 13 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.741 -0.106 19275
1273 1 13 . 1 1 29 29 CYS CA C 29 56.230 56.230 57.483 -1.254 19275
1274 1 13 . 1 1 29 29 CYS CB C 29 41.976 41.976 27.516 14.460 19275
1275 1 13 . 1 1 29 29 CYS H H 29 8.008 8.008 7.780 0.228 19275
1276 1 13 . 1 1 30 30 LYS HA H 30 4.371 4.371 3.932 0.439 19275
1277 1 13 . 1 1 30 30 LYS CA C 30 56.500 56.500 58.160 -1.660 19275
1278 1 13 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.598 0.372 19275
1279 1 13 . 1 1 30 30 LYS H H 30 8.311 8.311 8.782 -0.471 19275
1280 1 13 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.687 0.074 19275
1281 1 13 . 1 1 31 31 ASN CA C 31 53.583 53.583 53.589 -0.006 19275
1282 1 13 . 1 1 31 31 ASN CB C 31 39.178 39.178 39.390 -0.212 19275
1283 1 13 . 1 1 31 31 ASN H H 31 8.351 8.351 7.936 0.415 19275
1284 1 13 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.315 0.200 19275
1285 1 13 . 1 1 32 32 CYS CA C 32 55.690 55.690 59.788 -4.098 19275
1286 1 13 . 1 1 32 32 CYS CB C 32 34.190 34.190 26.877 7.314 19275
1287 1 13 . 1 1 32 32 CYS H H 32 8.285 8.285 8.674 -0.389 19275
1288 1 14 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.840 -0.187 19275
1289 1 14 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.300 -0.022 19275
1290 1 14 . 1 1 2 2 ASP CB C 2 41.637 41.637 40.980 0.657 19275
1291 1 14 . 1 1 2 2 ASP H H 2 8.656 8.656 8.589 0.067 19275
1292 1 14 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.579 -0.333 19275
1293 1 14 . 1 1 3 3 ARG CA C 3 56.300 56.300 55.281 1.019 19275
1294 1 14 . 1 1 3 3 ARG CB C 3 30.487 30.487 32.690 -2.203 19275
1295 1 14 . 1 1 3 3 ARG H H 3 8.540 8.540 8.213 0.327 19275
1296 1 14 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.686 0.687 19275
1297 1 14 . 1 1 4 4 GLY H H 4 8.504 8.504 8.394 0.110 19275
1298 1 14 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.846 -0.189 19275
1299 1 14 . 1 1 5 5 TRP CA C 5 57.200 57.200 54.926 2.274 19275
1300 1 14 . 1 1 5 5 TRP CB C 5 29.618 29.618 30.003 -0.385 19275
1301 1 14 . 1 1 5 5 TRP H H 5 7.943 7.943 7.674 0.269 19275
1302 1 14 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.266 -0.257 19275
1303 1 14 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.934 -1.366 19275
1304 1 14 . 1 1 6 6 ILE CB C 6 39.279 39.279 37.519 1.760 19275
1305 1 14 . 1 1 6 6 ILE H H 6 7.996 7.996 8.232 -0.236 19275
1306 1 14 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.803 -0.283 19275
1307 1 14 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.109 1.581 19275
1308 1 14 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.047 -2.647 19275
1309 1 14 . 1 1 12 12 ASP H H 12 8.462 8.462 8.111 0.351 19275
1310 1 14 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.913 -0.025 19275
1311 1 14 . 1 1 13 13 CYS CA C 13 54.210 54.210 55.977 -1.767 19275
1312 1 14 . 1 1 13 13 CYS CB C 13 38.039 38.039 27.284 10.755 19275
1313 1 14 . 1 1 13 13 CYS H H 13 7.379 7.379 8.244 -0.865 19275
1314 1 14 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.246 0.130 19275
1315 1 14 . 1 1 14 14 PRO CA C 14 64.055 64.055 64.498 -0.443 19275
1316 1 14 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.098 0.044 19275
1317 1 14 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.591 0.094 19275
1318 1 14 . 1 1 15 15 ASN CA C 15 53.645 53.645 54.490 -0.845 19275
1319 1 14 . 1 1 15 15 ASN CB C 15 38.632 38.632 38.916 -0.284 19275
1320 1 14 . 1 1 15 15 ASN H H 15 8.574 8.574 8.224 0.350 19275
1321 1 14 . 1 1 16 16 VAL HA H 16 4.136 4.136 4.216 -0.080 19275
1322 1 14 . 1 1 16 16 VAL CA C 16 62.669 62.669 61.412 1.257 19275
1323 1 14 . 1 1 16 16 VAL CB C 16 32.555 32.555 32.014 0.541 19275
1324 1 14 . 1 1 16 16 VAL H H 16 7.763 7.763 7.669 0.094 19275
1325 1 14 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.503 -0.317 19275
1326 1 14 . 1 1 17 17 ILE CA C 17 61.580 61.580 59.436 2.144 19275
1327 1 14 . 1 1 17 17 ILE CB C 17 38.480 38.480 39.227 -0.747 19275
1328 1 14 . 1 1 17 17 ILE H H 17 8.210 8.210 8.061 0.149 19275
1329 1 14 . 1 1 18 18 SER HA H 18 4.486 4.486 4.483 0.003 19275
1330 1 14 . 1 1 18 18 SER CA C 18 58.520 58.520 60.421 -1.901 19275
1331 1 14 . 1 1 18 18 SER CB C 18 63.880 63.880 62.882 0.998 19275
1332 1 14 . 1 1 18 18 SER H H 18 8.318 8.318 8.538 -0.220 19275
1333 1 14 . 1 1 19 19 SER HA H 19 4.483 4.483 4.552 -0.069 19275
1334 1 14 . 1 1 19 19 SER CA C 19 59.080 59.080 57.636 1.444 19275
1335 1 14 . 1 1 19 19 SER CB C 19 63.710 63.710 63.237 0.473 19275
1336 1 14 . 1 1 19 19 SER H H 19 8.335 8.335 7.965 0.370 19275
1337 1 14 . 1 1 20 20 ILE HA H 20 4.233 4.233 3.752 0.481 19275
1338 1 14 . 1 1 20 20 ILE CA C 20 61.890 61.890 62.906 -1.016 19275
1339 1 14 . 1 1 20 20 ILE CB C 20 38.500 38.500 36.414 2.086 19275
1340 1 14 . 1 1 20 20 ILE H H 20 8.002 8.002 7.535 0.467 19275
1341 1 14 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.514 0.220 19275
1342 1 14 . 1 1 21 21 CYS CA C 21 55.230 55.230 58.852 -3.622 19275
1343 1 14 . 1 1 21 21 CYS CB C 21 40.945 40.945 28.875 12.070 19275
1344 1 14 . 1 1 21 21 CYS H H 21 8.282 8.282 8.481 -0.199 19275
1345 1 14 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.069 0.322 19275
1346 1 14 . 1 1 22 22 ALA CA C 22 52.899 52.899 52.068 0.831 19275
1347 1 14 . 1 1 22 22 ALA CB C 22 19.346 19.346 16.885 2.461 19275
1348 1 14 . 1 1 22 22 ALA H H 22 8.119 8.119 8.280 -0.161 19275
1349 1 14 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.703 -0.163 19275
1350 1 14 . 1 1 23 23 GLY H H 23 8.417 8.417 7.997 0.420 19275
1351 1 14 . 1 1 24 24 THR HA H 24 4.398 4.398 4.655 -0.258 19275
1352 1 14 . 1 1 24 24 THR CA C 24 61.740 61.740 60.580 1.161 19275
1353 1 14 . 1 1 24 24 THR CB C 24 69.900 69.900 69.354 0.546 19275
1354 1 14 . 1 1 24 24 THR H H 24 8.081 8.081 7.832 0.249 19275
1355 1 14 . 1 1 25 25 ILE HA H 25 4.278 4.278 3.657 0.621 19275
1356 1 14 . 1 1 25 25 ILE CA C 25 61.386 61.386 63.695 -2.309 19275
1357 1 14 . 1 1 25 25 ILE CB C 25 38.489 38.489 37.629 0.860 19275
1358 1 14 . 1 1 25 25 ILE H H 25 8.073 8.073 8.840 -0.767 19275
1359 1 14 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.412 -0.172 19275
1360 1 14 . 1 1 26 26 ILE CA C 26 61.550 61.550 61.769 -0.219 19275
1361 1 14 . 1 1 26 26 ILE CB C 26 38.379 38.379 38.705 -0.326 19275
1362 1 14 . 1 1 26 26 ILE H H 26 8.114 8.114 8.074 0.040 19275
1363 1 14 . 1 1 27 27 THR HA H 27 4.186 4.186 4.689 -0.503 19275
1364 1 14 . 1 1 27 27 THR CA C 27 62.850 62.850 60.708 2.142 19275
1365 1 14 . 1 1 27 27 THR CB C 27 69.160 69.160 71.573 -2.413 19275
1366 1 14 . 1 1 27 27 THR H H 27 7.873 7.873 7.495 0.378 19275
1367 1 14 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.403 -0.039 19275
1368 1 14 . 1 1 28 28 ALA CA C 28 52.828 52.828 52.374 0.454 19275
1369 1 14 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.137 -0.180 19275
1370 1 14 . 1 1 28 28 ALA H H 28 8.114 8.114 8.489 -0.375 19275
1371 1 14 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.202 0.433 19275
1372 1 14 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.191 -1.960 19275
1373 1 14 . 1 1 29 29 CYS CB C 29 41.976 41.976 25.090 16.886 19275
1374 1 14 . 1 1 29 29 CYS H H 29 8.008 8.008 8.079 -0.071 19275
1375 1 14 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.249 0.122 19275
1376 1 14 . 1 1 30 30 LYS CA C 30 56.500 56.500 56.980 -0.480 19275
1377 1 14 . 1 1 30 30 LYS CB C 30 32.970 32.970 33.379 -0.409 19275
1378 1 14 . 1 1 30 30 LYS H H 30 8.311 8.311 8.102 0.209 19275
1379 1 14 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.806 -0.045 19275
1380 1 14 . 1 1 31 31 ASN CA C 31 53.583 53.583 52.479 1.104 19275
1381 1 14 . 1 1 31 31 ASN CB C 31 39.178 39.178 38.471 0.707 19275
1382 1 14 . 1 1 31 31 ASN H H 31 8.351 8.351 8.200 0.151 19275
1383 1 14 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.272 0.243 19275
1384 1 14 . 1 1 32 32 CYS CA C 32 55.690 55.690 59.354 -3.664 19275
1385 1 14 . 1 1 32 32 CYS CB C 32 34.190 34.190 26.455 7.735 19275
1386 1 14 . 1 1 32 32 CYS H H 32 8.285 8.285 8.844 -0.559 19275
1387 1 15 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.800 -0.147 19275
1388 1 15 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.467 -0.189 19275
1389 1 15 . 1 1 2 2 ASP CB C 2 41.637 41.637 40.656 0.981 19275
1390 1 15 . 1 1 2 2 ASP H H 2 8.656 8.656 8.592 0.064 19275
1391 1 15 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.491 -0.245 19275
1392 1 15 . 1 1 3 3 ARG CA C 3 56.300 56.300 55.552 0.748 19275
1393 1 15 . 1 1 3 3 ARG CB C 3 30.487 30.487 29.125 1.362 19275
1394 1 15 . 1 1 3 3 ARG H H 3 8.540 8.540 8.093 0.447 19275
1395 1 15 . 1 1 4 4 GLY CA C 4 45.373 45.373 45.294 0.079 19275
1396 1 15 . 1 1 4 4 GLY H H 4 8.504 8.504 7.966 0.538 19275
1397 1 15 . 1 1 5 5 TRP HA H 5 4.657 4.657 5.198 -0.541 19275
1398 1 15 . 1 1 5 5 TRP CA C 5 57.200 57.200 56.705 0.495 19275
1399 1 15 . 1 1 5 5 TRP CB C 5 29.618 29.618 31.473 -1.855 19275
1400 1 15 . 1 1 5 5 TRP H H 5 7.943 7.943 7.902 0.041 19275
1401 1 15 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.265 -0.256 19275
1402 1 15 . 1 1 6 6 ILE CA C 6 60.568 60.568 60.816 -0.248 19275
1403 1 15 . 1 1 6 6 ILE CB C 6 39.279 39.279 38.704 0.575 19275
1404 1 15 . 1 1 6 6 ILE H H 6 7.996 7.996 8.418 -0.422 19275
1405 1 15 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.715 -0.195 19275
1406 1 15 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.318 1.372 19275
1407 1 15 . 1 1 12 12 ASP CB C 12 38.400 38.400 40.980 -2.580 19275
1408 1 15 . 1 1 12 12 ASP H H 12 8.462 8.462 8.111 0.351 19275
1409 1 15 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.788 0.100 19275
1410 1 15 . 1 1 13 13 CYS CA C 13 54.210 54.210 55.935 -1.725 19275
1411 1 15 . 1 1 13 13 CYS CB C 13 38.039 38.039 25.888 12.151 19275
1412 1 15 . 1 1 13 13 CYS H H 13 7.379 7.379 8.190 -0.811 19275
1413 1 15 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.429 -0.053 19275
1414 1 15 . 1 1 14 14 PRO CA C 14 64.055 64.055 63.517 0.538 19275
1415 1 15 . 1 1 14 14 PRO CB C 14 32.142 32.142 31.949 0.193 19275
1416 1 15 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.718 -0.033 19275
1417 1 15 . 1 1 15 15 ASN CA C 15 53.645 53.645 52.456 1.188 19275
1418 1 15 . 1 1 15 15 ASN CB C 15 38.632 38.632 39.372 -0.740 19275
1419 1 15 . 1 1 15 15 ASN H H 15 8.574 8.574 7.688 0.886 19275
1420 1 15 . 1 1 16 16 VAL HA H 16 4.136 4.136 3.809 0.327 19275
1421 1 15 . 1 1 16 16 VAL CA C 16 62.669 62.669 63.040 -0.371 19275
1422 1 15 . 1 1 16 16 VAL CB C 16 32.555 32.555 29.928 2.627 19275
1423 1 15 . 1 1 16 16 VAL H H 16 7.763 7.763 8.424 -0.661 19275
1424 1 15 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.032 0.154 19275
1425 1 15 . 1 1 17 17 ILE CA C 17 61.580 61.580 60.873 0.708 19275
1426 1 15 . 1 1 17 17 ILE CB C 17 38.480 38.480 37.034 1.446 19275
1427 1 15 . 1 1 17 17 ILE H H 17 8.210 8.210 8.039 0.171 19275
1428 1 15 . 1 1 18 18 SER HA H 18 4.486 4.486 4.466 0.020 19275
1429 1 15 . 1 1 18 18 SER CA C 18 58.520 58.520 57.530 0.990 19275
1430 1 15 . 1 1 18 18 SER CB C 18 63.880 63.880 64.515 -0.635 19275
1431 1 15 . 1 1 18 18 SER H H 18 8.318 8.318 7.494 0.824 19275
1432 1 15 . 1 1 19 19 SER HA H 19 4.483 4.483 4.352 0.131 19275
1433 1 15 . 1 1 19 19 SER CA C 19 59.080 59.080 60.355 -1.275 19275
1434 1 15 . 1 1 19 19 SER CB C 19 63.710 63.710 63.290 0.420 19275
1435 1 15 . 1 1 19 19 SER H H 19 8.335 8.335 8.436 -0.101 19275
1436 1 15 . 1 1 20 20 ILE HA H 20 4.233 4.233 4.342 -0.109 19275
1437 1 15 . 1 1 20 20 ILE CA C 20 61.890 61.890 59.806 2.084 19275
1438 1 15 . 1 1 20 20 ILE CB C 20 38.500 38.500 41.162 -2.662 19275
1439 1 15 . 1 1 20 20 ILE H H 20 8.002 8.002 7.320 0.682 19275
1440 1 15 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.180 0.554 19275
1441 1 15 . 1 1 21 21 CYS CA C 21 55.230 55.230 61.186 -5.956 19275
1442 1 15 . 1 1 21 21 CYS CB C 21 40.945 40.945 26.374 14.571 19275
1443 1 15 . 1 1 21 21 CYS H H 21 8.282 8.282 8.506 -0.224 19275
1444 1 15 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.115 0.276 19275
1445 1 15 . 1 1 22 22 ALA CA C 22 52.899 52.899 52.361 0.538 19275
1446 1 15 . 1 1 22 22 ALA CB C 22 19.346 19.346 18.152 1.194 19275
1447 1 15 . 1 1 22 22 ALA H H 22 8.119 8.119 8.092 0.027 19275
1448 1 15 . 1 1 23 23 GLY CA C 23 45.540 45.540 44.542 0.998 19275
1449 1 15 . 1 1 23 23 GLY H H 23 8.417 8.417 7.870 0.547 19275
1450 1 15 . 1 1 24 24 THR HA H 24 4.398 4.398 3.984 0.414 19275
1451 1 15 . 1 1 24 24 THR CA C 24 61.740 61.740 62.198 -0.458 19275
1452 1 15 . 1 1 24 24 THR CB C 24 69.900 69.900 68.023 1.877 19275
1453 1 15 . 1 1 24 24 THR H H 24 8.081 8.081 8.072 0.009 19275
1454 1 15 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.035 0.243 19275
1455 1 15 . 1 1 25 25 ILE CA C 25 61.386 61.386 61.445 -0.059 19275
1456 1 15 . 1 1 25 25 ILE CB C 25 38.489 38.489 38.378 0.111 19275
1457 1 15 . 1 1 25 25 ILE H H 25 8.073 8.073 7.639 0.434 19275
1458 1 15 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.323 -0.083 19275
1459 1 15 . 1 1 26 26 ILE CA C 26 61.550 61.550 62.217 -0.667 19275
1460 1 15 . 1 1 26 26 ILE CB C 26 38.379 38.379 38.576 -0.197 19275
1461 1 15 . 1 1 26 26 ILE H H 26 8.114 8.114 8.264 -0.150 19275
1462 1 15 . 1 1 27 27 THR HA H 27 4.186 4.186 4.373 -0.187 19275
1463 1 15 . 1 1 27 27 THR CA C 27 62.850 62.850 63.102 -0.253 19275
1464 1 15 . 1 1 27 27 THR CB C 27 69.160 69.160 68.778 0.382 19275
1465 1 15 . 1 1 27 27 THR H H 27 7.873 7.873 7.995 -0.122 19275
1466 1 15 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.490 -0.126 19275
1467 1 15 . 1 1 28 28 ALA CA C 28 52.828 52.828 51.656 1.172 19275
1468 1 15 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.656 -0.700 19275
1469 1 15 . 1 1 28 28 ALA H H 28 8.114 8.114 7.910 0.204 19275
1470 1 15 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.261 0.374 19275
1471 1 15 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.364 -2.134 19275
1472 1 15 . 1 1 29 29 CYS CB C 29 41.976 41.976 26.631 15.345 19275
1473 1 15 . 1 1 29 29 CYS H H 29 8.008 8.008 8.044 -0.036 19275
1474 1 15 . 1 1 30 30 LYS HA H 30 4.371 4.371 3.981 0.390 19275
1475 1 15 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.707 -1.207 19275
1476 1 15 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.614 0.357 19275
1477 1 15 . 1 1 30 30 LYS H H 30 8.311 8.311 8.638 -0.327 19275
1478 1 15 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.394 0.367 19275
1479 1 15 . 1 1 31 31 ASN CA C 31 53.583 53.583 54.412 -0.829 19275
1480 1 15 . 1 1 31 31 ASN CB C 31 39.178 39.178 37.449 1.729 19275
1481 1 15 . 1 1 31 31 ASN H H 31 8.351 8.351 8.026 0.325 19275
1482 1 15 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.687 -0.172 19275
1483 1 15 . 1 1 32 32 CYS CA C 32 55.690 55.690 58.073 -2.383 19275
1484 1 15 . 1 1 32 32 CYS CB C 32 34.190 34.190 25.081 9.109 19275
1485 1 15 . 1 1 32 32 CYS H H 32 8.285 8.285 8.679 -0.394 19275
1486 1 16 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.655 -0.002 19275
1487 1 16 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.630 -0.352 19275
1488 1 16 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.179 0.458 19275
1489 1 16 . 1 1 2 2 ASP H H 2 8.656 8.656 8.348 0.308 19275
1490 1 16 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.454 -0.208 19275
1491 1 16 . 1 1 3 3 ARG CA C 3 56.300 56.300 57.435 -1.135 19275
1492 1 16 . 1 1 3 3 ARG CB C 3 30.487 30.487 31.270 -0.783 19275
1493 1 16 . 1 1 3 3 ARG H H 3 8.540 8.540 8.220 0.320 19275
1494 1 16 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.777 0.596 19275
1495 1 16 . 1 1 4 4 GLY H H 4 8.504 8.504 7.876 0.628 19275
1496 1 16 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.318 0.339 19275
1497 1 16 . 1 1 5 5 TRP CA C 5 57.200 57.200 56.822 0.378 19275
1498 1 16 . 1 1 5 5 TRP CB C 5 29.618 29.618 29.530 0.088 19275
1499 1 16 . 1 1 5 5 TRP H H 5 7.943 7.943 7.786 0.157 19275
1500 1 16 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.101 -0.092 19275
1501 1 16 . 1 1 6 6 ILE CA C 6 60.568 60.568 62.216 -1.648 19275
1502 1 16 . 1 1 6 6 ILE CB C 6 39.279 39.279 38.301 0.978 19275
1503 1 16 . 1 1 6 6 ILE H H 6 7.996 7.996 8.356 -0.360 19275
1504 1 16 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.787 -0.267 19275
1505 1 16 . 1 1 12 12 ASP CA C 12 55.690 55.690 53.800 1.890 19275
1506 1 16 . 1 1 12 12 ASP CB C 12 38.400 38.400 40.590 -2.190 19275
1507 1 16 . 1 1 12 12 ASP H H 12 8.462 8.462 8.531 -0.069 19275
1508 1 16 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.780 0.108 19275
1509 1 16 . 1 1 13 13 CYS CA C 13 54.210 54.210 55.795 -1.585 19275
1510 1 16 . 1 1 13 13 CYS CB C 13 38.039 38.039 28.686 9.353 19275
1511 1 16 . 1 1 13 13 CYS H H 13 7.379 7.379 7.746 -0.367 19275
1512 1 16 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.471 -0.095 19275
1513 1 16 . 1 1 14 14 PRO CA C 14 64.055 64.055 63.375 0.680 19275
1514 1 16 . 1 1 14 14 PRO CB C 14 32.142 32.142 29.815 2.327 19275
1515 1 16 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.777 -0.092 19275
1516 1 16 . 1 1 15 15 ASN CA C 15 53.645 53.645 51.770 1.875 19275
1517 1 16 . 1 1 15 15 ASN CB C 15 38.632 38.632 40.178 -1.546 19275
1518 1 16 . 1 1 15 15 ASN H H 15 8.574 8.574 8.147 0.427 19275
1519 1 16 . 1 1 16 16 VAL HA H 16 4.136 4.136 3.777 0.359 19275
1520 1 16 . 1 1 16 16 VAL CA C 16 62.669 62.669 63.503 -0.834 19275
1521 1 16 . 1 1 16 16 VAL CB C 16 32.555 32.555 30.081 2.474 19275
1522 1 16 . 1 1 16 16 VAL H H 16 7.763 7.763 8.466 -0.703 19275
1523 1 16 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.094 0.092 19275
1524 1 16 . 1 1 17 17 ILE CA C 17 61.580 61.580 61.830 -0.250 19275
1525 1 16 . 1 1 17 17 ILE CB C 17 38.480 38.480 37.429 1.051 19275
1526 1 16 . 1 1 17 17 ILE H H 17 8.210 8.210 8.204 0.006 19275
1527 1 16 . 1 1 18 18 SER HA H 18 4.486 4.486 4.405 0.081 19275
1528 1 16 . 1 1 18 18 SER CA C 18 58.520 58.520 58.697 -0.177 19275
1529 1 16 . 1 1 18 18 SER CB C 18 63.880 63.880 64.196 -0.316 19275
1530 1 16 . 1 1 18 18 SER H H 18 8.318 8.318 8.107 0.211 19275
1531 1 16 . 1 1 19 19 SER HA H 19 4.483 4.483 4.549 -0.066 19275
1532 1 16 . 1 1 19 19 SER CA C 19 59.080 59.080 59.221 -0.141 19275
1533 1 16 . 1 1 19 19 SER CB C 19 63.710 63.710 63.283 0.427 19275
1534 1 16 . 1 1 19 19 SER H H 19 8.335 8.335 7.825 0.510 19275
1535 1 16 . 1 1 20 20 ILE HA H 20 4.233 4.233 3.871 0.362 19275
1536 1 16 . 1 1 20 20 ILE CA C 20 61.890 61.890 61.732 0.158 19275
1537 1 16 . 1 1 20 20 ILE CB C 20 38.500 38.500 38.819 -0.319 19275
1538 1 16 . 1 1 20 20 ILE H H 20 8.002 8.002 8.377 -0.375 19275
1539 1 16 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.463 0.271 19275
1540 1 16 . 1 1 21 21 CYS CA C 21 55.230 55.230 58.626 -3.396 19275
1541 1 16 . 1 1 21 21 CYS CB C 21 40.945 40.945 24.714 16.231 19275
1542 1 16 . 1 1 21 21 CYS H H 21 8.282 8.282 8.525 -0.243 19275
1543 1 16 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.654 -0.263 19275
1544 1 16 . 1 1 22 22 ALA CA C 22 52.899 52.899 51.258 1.641 19275
1545 1 16 . 1 1 22 22 ALA CB C 22 19.346 19.346 19.039 0.307 19275
1546 1 16 . 1 1 22 22 ALA H H 22 8.119 8.119 8.187 -0.068 19275
1547 1 16 . 1 1 23 23 GLY CA C 23 45.540 45.540 44.541 0.999 19275
1548 1 16 . 1 1 23 23 GLY H H 23 8.417 8.417 7.735 0.682 19275
1549 1 16 . 1 1 24 24 THR HA H 24 4.398 4.398 4.095 0.303 19275
1550 1 16 . 1 1 24 24 THR CA C 24 61.740 61.740 63.685 -1.945 19275
1551 1 16 . 1 1 24 24 THR CB C 24 69.900 69.900 68.107 1.793 19275
1552 1 16 . 1 1 24 24 THR H H 24 8.081 8.081 8.471 -0.390 19275
1553 1 16 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.422 -0.144 19275
1554 1 16 . 1 1 25 25 ILE CA C 25 61.386 61.386 61.114 0.272 19275
1555 1 16 . 1 1 25 25 ILE CB C 25 38.489 38.489 39.399 -0.910 19275
1556 1 16 . 1 1 25 25 ILE H H 25 8.073 8.073 7.755 0.318 19275
1557 1 16 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.425 -0.185 19275
1558 1 16 . 1 1 26 26 ILE CA C 26 61.550 61.550 60.382 1.168 19275
1559 1 16 . 1 1 26 26 ILE CB C 26 38.379 38.379 40.051 -1.672 19275
1560 1 16 . 1 1 26 26 ILE H H 26 8.114 8.114 7.745 0.369 19275
1561 1 16 . 1 1 27 27 THR HA H 27 4.186 4.186 4.113 0.073 19275
1562 1 16 . 1 1 27 27 THR CA C 27 62.850 62.850 64.897 -2.046 19275
1563 1 16 . 1 1 27 27 THR CB C 27 69.160 69.160 68.869 0.291 19275
1564 1 16 . 1 1 27 27 THR H H 27 7.873 7.873 8.580 -0.707 19275
1565 1 16 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.406 -0.042 19275
1566 1 16 . 1 1 28 28 ALA CA C 28 52.828 52.828 51.569 1.260 19275
1567 1 16 . 1 1 28 28 ALA CB C 28 18.956 18.956 20.122 -1.166 19275
1568 1 16 . 1 1 28 28 ALA H H 28 8.114 8.114 7.862 0.252 19275
1569 1 16 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.198 0.437 19275
1570 1 16 . 1 1 29 29 CYS CA C 29 56.230 56.230 59.227 -2.997 19275
1571 1 16 . 1 1 29 29 CYS CB C 29 41.976 41.976 26.469 15.507 19275
1572 1 16 . 1 1 29 29 CYS H H 29 8.008 8.008 8.527 -0.519 19275
1573 1 16 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.348 0.023 19275
1574 1 16 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.519 -1.019 19275
1575 1 16 . 1 1 30 30 LYS CB C 30 32.970 32.970 33.455 -0.485 19275
1576 1 16 . 1 1 30 30 LYS H H 30 8.311 8.311 8.549 -0.238 19275
1577 1 16 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.926 -0.165 19275
1578 1 16 . 1 1 31 31 ASN CA C 31 53.583 53.583 52.480 1.103 19275
1579 1 16 . 1 1 31 31 ASN CB C 31 39.178 39.178 39.872 -0.694 19275
1580 1 16 . 1 1 31 31 ASN H H 31 8.351 8.351 7.916 0.435 19275
1581 1 16 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.721 -0.206 19275
1582 1 16 . 1 1 32 32 CYS CA C 32 55.690 55.690 58.908 -3.218 19275
1583 1 16 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.275 6.915 19275
1584 1 16 . 1 1 32 32 CYS H H 32 8.285 8.285 8.482 -0.197 19275
1585 1 17 . 1 1 2 2 ASP HA H 2 4.653 4.653 5.291 -0.638 19275
1586 1 17 . 1 1 2 2 ASP CA C 2 54.278 54.278 53.716 0.562 19275
1587 1 17 . 1 1 2 2 ASP CB C 2 41.637 41.637 42.684 -1.047 19275
1588 1 17 . 1 1 2 2 ASP H H 2 8.656 8.656 8.662 -0.006 19275
1589 1 17 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.561 -0.315 19275
1590 1 17 . 1 1 3 3 ARG CA C 3 56.300 56.300 55.430 0.870 19275
1591 1 17 . 1 1 3 3 ARG CB C 3 30.487 30.487 32.652 -2.165 19275
1592 1 17 . 1 1 3 3 ARG H H 3 8.540 8.540 8.375 0.165 19275
1593 1 17 . 1 1 4 4 GLY CA C 4 45.373 45.373 45.073 0.300 19275
1594 1 17 . 1 1 4 4 GLY H H 4 8.504 8.504 8.635 -0.131 19275
1595 1 17 . 1 1 5 5 TRP HA H 5 4.657 4.657 5.193 -0.536 19275
1596 1 17 . 1 1 5 5 TRP CA C 5 57.200 57.200 56.569 0.631 19275
1597 1 17 . 1 1 5 5 TRP CB C 5 29.618 29.618 31.068 -1.450 19275
1598 1 17 . 1 1 5 5 TRP H H 5 7.943 7.943 7.835 0.108 19275
1599 1 17 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.151 -0.141 19275
1600 1 17 . 1 1 6 6 ILE CA C 6 60.568 60.568 60.688 -0.120 19275
1601 1 17 . 1 1 6 6 ILE CB C 6 39.279 39.279 37.247 2.032 19275
1602 1 17 . 1 1 6 6 ILE H H 6 7.996 7.996 8.355 -0.359 19275
1603 1 17 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.757 -0.237 19275
1604 1 17 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.346 1.343 19275
1605 1 17 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.091 -2.691 19275
1606 1 17 . 1 1 12 12 ASP H H 12 8.462 8.462 8.259 0.203 19275
1607 1 17 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.812 0.076 19275
1608 1 17 . 1 1 13 13 CYS CA C 13 54.210 54.210 55.487 -1.278 19275
1609 1 17 . 1 1 13 13 CYS CB C 13 38.039 38.039 26.755 11.284 19275
1610 1 17 . 1 1 13 13 CYS H H 13 7.379 7.379 7.803 -0.424 19275
1611 1 17 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.414 -0.038 19275
1612 1 17 . 1 1 14 14 PRO CA C 14 64.055 64.055 64.787 -0.732 19275
1613 1 17 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.154 -0.012 19275
1614 1 17 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.651 0.034 19275
1615 1 17 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.329 0.316 19275
1616 1 17 . 1 1 15 15 ASN CB C 15 38.632 38.632 39.596 -0.964 19275
1617 1 17 . 1 1 15 15 ASN H H 15 8.574 8.574 8.295 0.279 19275
1618 1 17 . 1 1 16 16 VAL HA H 16 4.136 4.136 3.887 0.249 19275
1619 1 17 . 1 1 16 16 VAL CA C 16 62.669 62.669 63.466 -0.797 19275
1620 1 17 . 1 1 16 16 VAL CB C 16 32.555 32.555 31.827 0.728 19275
1621 1 17 . 1 1 16 16 VAL H H 16 7.763 7.763 7.781 -0.018 19275
1622 1 17 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.494 -0.308 19275
1623 1 17 . 1 1 17 17 ILE CA C 17 61.580 61.580 60.362 1.218 19275
1624 1 17 . 1 1 17 17 ILE CB C 17 38.480 38.480 39.142 -0.662 19275
1625 1 17 . 1 1 17 17 ILE H H 17 8.210 8.210 8.207 0.003 19275
1626 1 17 . 1 1 18 18 SER HA H 18 4.486 4.486 4.123 0.363 19275
1627 1 17 . 1 1 18 18 SER CA C 18 58.520 58.520 60.703 -2.183 19275
1628 1 17 . 1 1 18 18 SER CB C 18 63.880 63.880 63.001 0.879 19275
1629 1 17 . 1 1 18 18 SER H H 18 8.318 8.318 8.728 -0.410 19275
1630 1 17 . 1 1 19 19 SER HA H 19 4.483 4.483 4.559 -0.076 19275
1631 1 17 . 1 1 19 19 SER CA C 19 59.080 59.080 58.503 0.577 19275
1632 1 17 . 1 1 19 19 SER CB C 19 63.710 63.710 63.568 0.142 19275
1633 1 17 . 1 1 19 19 SER H H 19 8.335 8.335 8.187 0.148 19275
1634 1 17 . 1 1 20 20 ILE HA H 20 4.233 4.233 3.789 0.444 19275
1635 1 17 . 1 1 20 20 ILE CA C 20 61.890 61.890 61.998 -0.108 19275
1636 1 17 . 1 1 20 20 ILE CB C 20 38.500 38.500 39.116 -0.616 19275
1637 1 17 . 1 1 20 20 ILE H H 20 8.002 8.002 7.933 0.069 19275
1638 1 17 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.230 0.504 19275
1639 1 17 . 1 1 21 21 CYS CA C 21 55.230 55.230 59.336 -4.106 19275
1640 1 17 . 1 1 21 21 CYS CB C 21 40.945 40.945 27.436 13.509 19275
1641 1 17 . 1 1 21 21 CYS H H 21 8.282 8.282 8.772 -0.490 19275
1642 1 17 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.438 -0.047 19275
1643 1 17 . 1 1 22 22 ALA CA C 22 52.899 52.899 51.828 1.071 19275
1644 1 17 . 1 1 22 22 ALA CB C 22 19.346 19.346 20.166 -0.820 19275
1645 1 17 . 1 1 22 22 ALA H H 22 8.119 8.119 7.346 0.773 19275
1646 1 17 . 1 1 23 23 GLY CA C 23 45.540 45.540 46.610 -1.070 19275
1647 1 17 . 1 1 23 23 GLY H H 23 8.417 8.417 8.784 -0.367 19275
1648 1 17 . 1 1 24 24 THR HA H 24 4.398 4.398 4.462 -0.064 19275
1649 1 17 . 1 1 24 24 THR CA C 24 61.740 61.740 62.128 -0.388 19275
1650 1 17 . 1 1 24 24 THR CB C 24 69.900 69.900 69.743 0.157 19275
1651 1 17 . 1 1 24 24 THR H H 24 8.081 8.081 8.232 -0.151 19275
1652 1 17 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.594 -0.316 19275
1653 1 17 . 1 1 25 25 ILE CA C 25 61.386 61.386 60.709 0.677 19275
1654 1 17 . 1 1 25 25 ILE CB C 25 38.489 38.489 39.476 -0.987 19275
1655 1 17 . 1 1 25 25 ILE H H 25 8.073 8.073 7.601 0.472 19275
1656 1 17 . 1 1 26 26 ILE HA H 26 4.240 4.240 3.678 0.562 19275
1657 1 17 . 1 1 26 26 ILE CA C 26 61.550 61.550 63.534 -1.984 19275
1658 1 17 . 1 1 26 26 ILE CB C 26 38.379 38.379 35.999 2.380 19275
1659 1 17 . 1 1 26 26 ILE H H 26 8.114 8.114 8.816 -0.702 19275
1660 1 17 . 1 1 27 27 THR HA H 27 4.186 4.186 4.487 -0.301 19275
1661 1 17 . 1 1 27 27 THR CA C 27 62.850 62.850 61.100 1.750 19275
1662 1 17 . 1 1 27 27 THR CB C 27 69.160 69.160 70.142 -0.982 19275
1663 1 17 . 1 1 27 27 THR H H 27 7.873 7.873 8.119 -0.246 19275
1664 1 17 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.666 -0.302 19275
1665 1 17 . 1 1 28 28 ALA CA C 28 52.828 52.828 52.029 0.799 19275
1666 1 17 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.687 -0.731 19275
1667 1 17 . 1 1 28 28 ALA H H 28 8.114 8.114 8.517 -0.403 19275
1668 1 17 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.193 0.442 19275
1669 1 17 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.677 -2.447 19275
1670 1 17 . 1 1 29 29 CYS CB C 29 41.976 41.976 24.610 17.366 19275
1671 1 17 . 1 1 29 29 CYS H H 29 8.008 8.008 8.469 -0.461 19275
1672 1 17 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.305 0.066 19275
1673 1 17 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.086 -0.586 19275
1674 1 17 . 1 1 30 30 LYS CB C 30 32.970 32.970 33.489 -0.519 19275
1675 1 17 . 1 1 30 30 LYS H H 30 8.311 8.311 8.317 -0.006 19275
1676 1 17 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.976 -0.215 19275
1677 1 17 . 1 1 31 31 ASN CA C 31 53.583 53.583 52.571 1.012 19275
1678 1 17 . 1 1 31 31 ASN CB C 31 39.178 39.178 39.581 -0.403 19275
1679 1 17 . 1 1 31 31 ASN H H 31 8.351 8.351 7.884 0.467 19275
1680 1 17 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.713 -0.198 19275
1681 1 17 . 1 1 32 32 CYS CA C 32 55.690 55.690 59.610 -3.920 19275
1682 1 17 . 1 1 32 32 CYS CB C 32 34.190 34.190 28.567 5.622 19275
1683 1 17 . 1 1 32 32 CYS H H 32 8.285 8.285 8.581 -0.296 19275
1684 1 18 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.787 -0.134 19275
1685 1 18 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.302 -0.024 19275
1686 1 18 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.279 0.358 19275
1687 1 18 . 1 1 2 2 ASP H H 2 8.656 8.656 8.150 0.506 19275
1688 1 18 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.495 -0.249 19275
1689 1 18 . 1 1 3 3 ARG CA C 3 56.300 56.300 56.031 0.269 19275
1690 1 18 . 1 1 3 3 ARG CB C 3 30.487 30.487 30.362 0.125 19275
1691 1 18 . 1 1 3 3 ARG H H 3 8.540 8.540 7.859 0.681 19275
1692 1 18 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.764 0.609 19275
1693 1 18 . 1 1 4 4 GLY H H 4 8.504 8.504 8.119 0.385 19275
1694 1 18 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.553 0.104 19275
1695 1 18 . 1 1 5 5 TRP CA C 5 57.200 57.200 58.609 -1.409 19275
1696 1 18 . 1 1 5 5 TRP CB C 5 29.618 29.618 29.628 -0.010 19275
1697 1 18 . 1 1 5 5 TRP H H 5 7.943 7.943 8.382 -0.439 19275
1698 1 18 . 1 1 6 6 ILE HA H 6 4.009 4.009 3.901 0.108 19275
1699 1 18 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.823 -1.255 19275
1700 1 18 . 1 1 6 6 ILE CB C 6 39.279 39.279 36.781 2.498 19275
1701 1 18 . 1 1 6 6 ILE H H 6 7.996 7.996 8.109 -0.113 19275
1702 1 18 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.754 -0.234 19275
1703 1 18 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.305 1.385 19275
1704 1 18 . 1 1 12 12 ASP CB C 12 38.400 38.400 40.812 -2.412 19275
1705 1 18 . 1 1 12 12 ASP H H 12 8.462 8.462 8.322 0.140 19275
1706 1 18 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.860 0.028 19275
1707 1 18 . 1 1 13 13 CYS CA C 13 54.210 54.210 56.283 -2.073 19275
1708 1 18 . 1 1 13 13 CYS CB C 13 38.039 38.039 25.976 12.063 19275
1709 1 18 . 1 1 13 13 CYS H H 13 7.379 7.379 8.158 -0.779 19275
1710 1 18 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.255 0.121 19275
1711 1 18 . 1 1 14 14 PRO CA C 14 64.055 64.055 64.233 -0.178 19275
1712 1 18 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.042 0.100 19275
1713 1 18 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.759 -0.074 19275
1714 1 18 . 1 1 15 15 ASN CA C 15 53.645 53.645 52.507 1.138 19275
1715 1 18 . 1 1 15 15 ASN CB C 15 38.632 38.632 40.185 -1.554 19275
1716 1 18 . 1 1 15 15 ASN H H 15 8.574 8.574 7.968 0.606 19275
1717 1 18 . 1 1 16 16 VAL HA H 16 4.136 4.136 4.216 -0.080 19275
1718 1 18 . 1 1 16 16 VAL CA C 16 62.669 62.669 61.350 1.319 19275
1719 1 18 . 1 1 16 16 VAL CB C 16 32.555 32.555 33.631 -1.076 19275
1720 1 18 . 1 1 16 16 VAL H H 16 7.763 7.763 8.253 -0.490 19275
1721 1 18 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.580 -0.394 19275
1722 1 18 . 1 1 17 17 ILE CA C 17 61.580 61.580 59.915 1.665 19275
1723 1 18 . 1 1 17 17 ILE CB C 17 38.480 38.480 39.336 -0.855 19275
1724 1 18 . 1 1 17 17 ILE H H 17 8.210 8.210 8.331 -0.121 19275
1725 1 18 . 1 1 18 18 SER HA H 18 4.486 4.486 4.183 0.303 19275
1726 1 18 . 1 1 18 18 SER CA C 18 58.520 58.520 60.579 -2.059 19275
1727 1 18 . 1 1 18 18 SER CB C 18 63.880 63.880 63.220 0.660 19275
1728 1 18 . 1 1 18 18 SER H H 18 8.318 8.318 8.564 -0.246 19275
1729 1 18 . 1 1 19 19 SER HA H 19 4.483 4.483 4.320 0.163 19275
1730 1 18 . 1 1 19 19 SER CA C 19 59.080 59.080 59.894 -0.813 19275
1731 1 18 . 1 1 19 19 SER CB C 19 63.710 63.710 63.438 0.272 19275
1732 1 18 . 1 1 19 19 SER H H 19 8.335 8.335 7.880 0.455 19275
1733 1 18 . 1 1 20 20 ILE HA H 20 4.233 4.233 4.309 -0.076 19275
1734 1 18 . 1 1 20 20 ILE CA C 20 61.890 61.890 59.564 2.326 19275
1735 1 18 . 1 1 20 20 ILE CB C 20 38.500 38.500 40.447 -1.947 19275
1736 1 18 . 1 1 20 20 ILE H H 20 8.002 8.002 7.531 0.471 19275
1737 1 18 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.345 0.389 19275
1738 1 18 . 1 1 21 21 CYS CA C 21 55.230 55.230 60.483 -5.253 19275
1739 1 18 . 1 1 21 21 CYS CB C 21 40.945 40.945 27.244 13.701 19275
1740 1 18 . 1 1 21 21 CYS H H 21 8.282 8.282 8.793 -0.511 19275
1741 1 18 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.383 0.008 19275
1742 1 18 . 1 1 22 22 ALA CA C 22 52.899 52.899 52.231 0.668 19275
1743 1 18 . 1 1 22 22 ALA CB C 22 19.346 19.346 19.310 0.036 19275
1744 1 18 . 1 1 22 22 ALA H H 22 8.119 8.119 8.197 -0.078 19275
1745 1 18 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.634 -0.094 19275
1746 1 18 . 1 1 23 23 GLY H H 23 8.417 8.417 8.286 0.131 19275
1747 1 18 . 1 1 24 24 THR HA H 24 4.398 4.398 4.723 -0.325 19275
1748 1 18 . 1 1 24 24 THR CA C 24 61.740 61.740 60.254 1.486 19275
1749 1 18 . 1 1 24 24 THR CB C 24 69.900 69.900 70.852 -0.952 19275
1750 1 18 . 1 1 24 24 THR H H 24 8.081 8.081 7.804 0.277 19275
1751 1 18 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.278 -0.000 19275
1752 1 18 . 1 1 25 25 ILE CA C 25 61.386 61.386 61.241 0.145 19275
1753 1 18 . 1 1 25 25 ILE CB C 25 38.489 38.489 36.686 1.803 19275
1754 1 18 . 1 1 25 25 ILE H H 25 8.073 8.073 8.393 -0.320 19275
1755 1 18 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.222 0.018 19275
1756 1 18 . 1 1 26 26 ILE CA C 26 61.550 61.550 60.375 1.175 19275
1757 1 18 . 1 1 26 26 ILE CB C 26 38.379 38.379 40.708 -2.329 19275
1758 1 18 . 1 1 26 26 ILE H H 26 8.114 8.114 7.568 0.546 19275
1759 1 18 . 1 1 27 27 THR HA H 27 4.186 4.186 4.152 0.034 19275
1760 1 18 . 1 1 27 27 THR CA C 27 62.850 62.850 62.970 -0.120 19275
1761 1 18 . 1 1 27 27 THR CB C 27 69.160 69.160 69.295 -0.135 19275
1762 1 18 . 1 1 27 27 THR H H 27 7.873 7.873 8.081 -0.208 19275
1763 1 18 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.094 0.270 19275
1764 1 18 . 1 1 28 28 ALA CA C 28 52.828 52.828 54.112 -1.284 19275
1765 1 18 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.062 -0.106 19275
1766 1 18 . 1 1 28 28 ALA H H 28 8.114 8.114 8.517 -0.403 19275
1767 1 18 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.539 0.096 19275
1768 1 18 . 1 1 29 29 CYS CA C 29 56.230 56.230 56.719 -0.489 19275
1769 1 18 . 1 1 29 29 CYS CB C 29 41.976 41.976 24.741 17.235 19275
1770 1 18 . 1 1 29 29 CYS H H 29 8.008 8.008 8.137 -0.129 19275
1771 1 18 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.805 -0.434 19275
1772 1 18 . 1 1 30 30 LYS CA C 30 56.500 56.500 56.730 -0.230 19275
1773 1 18 . 1 1 30 30 LYS CB C 30 32.970 32.970 33.648 -0.678 19275
1774 1 18 . 1 1 30 30 LYS H H 30 8.311 8.311 8.437 -0.126 19275
1775 1 18 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.729 0.032 19275
1776 1 18 . 1 1 31 31 ASN CA C 31 53.583 53.583 52.421 1.162 19275
1777 1 18 . 1 1 31 31 ASN CB C 31 39.178 39.178 38.534 0.644 19275
1778 1 18 . 1 1 31 31 ASN H H 31 8.351 8.351 7.944 0.407 19275
1779 1 18 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.538 -0.023 19275
1780 1 18 . 1 1 32 32 CYS CA C 32 55.690 55.690 59.401 -3.711 19275
1781 1 18 . 1 1 32 32 CYS CB C 32 34.190 34.190 26.908 7.282 19275
1782 1 18 . 1 1 32 32 CYS H H 32 8.285 8.285 8.543 -0.258 19275
1783 1 19 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.787 -0.134 19275
1784 1 19 . 1 1 2 2 ASP CA C 2 54.278 54.278 53.619 0.659 19275
1785 1 19 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.572 0.065 19275
1786 1 19 . 1 1 2 2 ASP H H 2 8.656 8.656 8.373 0.283 19275
1787 1 19 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.578 -0.332 19275
1788 1 19 . 1 1 3 3 ARG CA C 3 56.300 56.300 55.543 0.757 19275
1789 1 19 . 1 1 3 3 ARG CB C 3 30.487 30.487 30.541 -0.054 19275
1790 1 19 . 1 1 3 3 ARG H H 3 8.540 8.540 8.348 0.192 19275
1791 1 19 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.249 1.124 19275
1792 1 19 . 1 1 4 4 GLY H H 4 8.504 8.504 8.385 0.119 19275
1793 1 19 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.618 0.039 19275
1794 1 19 . 1 1 5 5 TRP CA C 5 57.200 57.200 54.824 2.376 19275
1795 1 19 . 1 1 5 5 TRP CB C 5 29.618 29.618 29.634 -0.016 19275
1796 1 19 . 1 1 5 5 TRP H H 5 7.943 7.943 7.322 0.621 19275
1797 1 19 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.432 -0.423 19275
1798 1 19 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.604 -1.036 19275
1799 1 19 . 1 1 6 6 ILE CB C 6 39.279 39.279 37.711 1.568 19275
1800 1 19 . 1 1 6 6 ILE H H 6 7.996 7.996 8.248 -0.252 19275
1801 1 19 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.561 -0.041 19275
1802 1 19 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.712 0.978 19275
1803 1 19 . 1 1 12 12 ASP CB C 12 38.400 38.400 40.990 -2.590 19275
1804 1 19 . 1 1 12 12 ASP H H 12 8.462 8.462 8.348 0.114 19275
1805 1 19 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.468 0.420 19275
1806 1 19 . 1 1 13 13 CYS CA C 13 54.210 54.210 57.304 -3.094 19275
1807 1 19 . 1 1 13 13 CYS CB C 13 38.039 38.039 25.637 12.402 19275
1808 1 19 . 1 1 13 13 CYS H H 13 7.379 7.379 8.297 -0.918 19275
1809 1 19 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.205 0.171 19275
1810 1 19 . 1 1 14 14 PRO CA C 14 64.055 64.055 64.095 -0.040 19275
1811 1 19 . 1 1 14 14 PRO CB C 14 32.142 32.142 32.029 0.113 19275
1812 1 19 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.752 -0.067 19275
1813 1 19 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.023 0.622 19275
1814 1 19 . 1 1 15 15 ASN CB C 15 38.632 38.632 40.330 -1.698 19275
1815 1 19 . 1 1 15 15 ASN H H 15 8.574 8.574 7.757 0.817 19275
1816 1 19 . 1 1 16 16 VAL HA H 16 4.136 4.136 4.293 -0.157 19275
1817 1 19 . 1 1 16 16 VAL CA C 16 62.669 62.669 62.333 0.336 19275
1818 1 19 . 1 1 16 16 VAL CB C 16 32.555 32.555 31.890 0.665 19275
1819 1 19 . 1 1 16 16 VAL H H 16 7.763 7.763 8.677 -0.914 19275
1820 1 19 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.312 -0.126 19275
1821 1 19 . 1 1 17 17 ILE CA C 17 61.580 61.580 61.759 -0.179 19275
1822 1 19 . 1 1 17 17 ILE CB C 17 38.480 38.480 37.895 0.585 19275
1823 1 19 . 1 1 17 17 ILE H H 17 8.210 8.210 8.525 -0.316 19275
1824 1 19 . 1 1 18 18 SER HA H 18 4.486 4.486 4.545 -0.059 19275
1825 1 19 . 1 1 18 18 SER CA C 18 58.520 58.520 59.244 -0.724 19275
1826 1 19 . 1 1 18 18 SER CB C 18 63.880 63.880 63.749 0.131 19275
1827 1 19 . 1 1 18 18 SER H H 18 8.318 8.318 7.852 0.466 19275
1828 1 19 . 1 1 19 19 SER HA H 19 4.483 4.483 4.389 0.094 19275
1829 1 19 . 1 1 19 19 SER CA C 19 59.080 59.080 60.172 -1.092 19275
1830 1 19 . 1 1 19 19 SER CB C 19 63.710 63.710 63.438 0.272 19275
1831 1 19 . 1 1 19 19 SER H H 19 8.335 8.335 8.208 0.127 19275
1832 1 19 . 1 1 20 20 ILE HA H 20 4.233 4.233 4.236 -0.003 19275
1833 1 19 . 1 1 20 20 ILE CA C 20 61.890 61.890 60.582 1.308 19275
1834 1 19 . 1 1 20 20 ILE CB C 20 38.500 38.500 38.074 0.426 19275
1835 1 19 . 1 1 20 20 ILE H H 20 8.002 8.002 7.965 0.037 19275
1836 1 19 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.178 0.556 19275
1837 1 19 . 1 1 21 21 CYS CA C 21 55.230 55.230 59.085 -3.855 19275
1838 1 19 . 1 1 21 21 CYS CB C 21 40.945 40.945 25.723 15.222 19275
1839 1 19 . 1 1 21 21 CYS H H 21 8.282 8.282 8.575 -0.293 19275
1840 1 19 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.060 0.331 19275
1841 1 19 . 1 1 22 22 ALA CA C 22 52.899 52.899 53.223 -0.324 19275
1842 1 19 . 1 1 22 22 ALA CB C 22 19.346 19.346 18.017 1.329 19275
1843 1 19 . 1 1 22 22 ALA H H 22 8.119 8.119 8.296 -0.177 19275
1844 1 19 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.643 -0.103 19275
1845 1 19 . 1 1 23 23 GLY H H 23 8.417 8.417 8.357 0.060 19275
1846 1 19 . 1 1 24 24 THR HA H 24 4.398 4.398 4.534 -0.136 19275
1847 1 19 . 1 1 24 24 THR CA C 24 61.740 61.740 60.728 1.012 19275
1848 1 19 . 1 1 24 24 THR CB C 24 69.900 69.900 71.589 -1.689 19275
1849 1 19 . 1 1 24 24 THR H H 24 8.081 8.081 7.852 0.229 19275
1850 1 19 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.721 -0.443 19275
1851 1 19 . 1 1 25 25 ILE CA C 25 61.386 61.386 60.961 0.425 19275
1852 1 19 . 1 1 25 25 ILE CB C 25 38.489 38.489 38.988 -0.499 19275
1853 1 19 . 1 1 25 25 ILE H H 25 8.073 8.073 8.350 -0.277 19275
1854 1 19 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.426 -0.186 19275
1855 1 19 . 1 1 26 26 ILE CA C 26 61.550 61.550 61.326 0.224 19275
1856 1 19 . 1 1 26 26 ILE CB C 26 38.379 38.379 38.668 -0.289 19275
1857 1 19 . 1 1 26 26 ILE H H 26 8.114 8.114 7.865 0.249 19275
1858 1 19 . 1 1 27 27 THR HA H 27 4.186 4.186 4.469 -0.283 19275
1859 1 19 . 1 1 27 27 THR CA C 27 62.850 62.850 62.123 0.727 19275
1860 1 19 . 1 1 27 27 THR CB C 27 69.160 69.160 69.301 -0.141 19275
1861 1 19 . 1 1 27 27 THR H H 27 7.873 7.873 8.776 -0.903 19275
1862 1 19 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.681 -0.317 19275
1863 1 19 . 1 1 28 28 ALA CA C 28 52.828 52.828 51.916 0.912 19275
1864 1 19 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.853 -0.897 19275
1865 1 19 . 1 1 28 28 ALA H H 28 8.114 8.114 8.357 -0.243 19275
1866 1 19 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.804 -0.169 19275
1867 1 19 . 1 1 29 29 CYS CA C 29 56.230 56.230 56.728 -0.498 19275
1868 1 19 . 1 1 29 29 CYS CB C 29 41.976 41.976 24.931 17.045 19275
1869 1 19 . 1 1 29 29 CYS H H 29 8.008 8.008 8.414 -0.406 19275
1870 1 19 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.208 0.163 19275
1871 1 19 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.446 -0.946 19275
1872 1 19 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.752 0.218 19275
1873 1 19 . 1 1 30 30 LYS H H 30 8.311 8.311 7.941 0.370 19275
1874 1 19 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.647 0.114 19275
1875 1 19 . 1 1 31 31 ASN CA C 31 53.583 53.583 53.482 0.101 19275
1876 1 19 . 1 1 31 31 ASN CB C 31 39.178 39.178 37.894 1.284 19275
1877 1 19 . 1 1 31 31 ASN H H 31 8.351 8.351 8.231 0.120 19275
1878 1 19 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.397 0.118 19275
1879 1 19 . 1 1 32 32 CYS CA C 32 55.690 55.690 60.464 -4.774 19275
1880 1 19 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.434 6.756 19275
1881 1 19 . 1 1 32 32 CYS H H 32 8.285 8.285 8.712 -0.427 19275
1882 1 20 . 1 1 2 2 ASP HA H 2 4.653 4.653 4.960 -0.307 19275
1883 1 20 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.743 -0.465 19275
1884 1 20 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.374 0.263 19275
1885 1 20 . 1 1 2 2 ASP H H 2 8.656 8.656 8.498 0.158 19275
1886 1 20 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.670 -0.424 19275
1887 1 20 . 1 1 3 3 ARG CA C 3 56.300 56.300 56.392 -0.092 19275
1888 1 20 . 1 1 3 3 ARG CB C 3 30.487 30.487 31.297 -0.810 19275
1889 1 20 . 1 1 3 3 ARG H H 3 8.540 8.540 8.619 -0.079 19275
1890 1 20 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.568 0.805 19275
1891 1 20 . 1 1 4 4 GLY H H 4 8.504 8.504 8.286 0.218 19275
1892 1 20 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.796 -0.139 19275
1893 1 20 . 1 1 5 5 TRP CA C 5 57.200 57.200 57.256 -0.056 19275
1894 1 20 . 1 1 5 5 TRP CB C 5 29.618 29.618 30.250 -0.632 19275
1895 1 20 . 1 1 5 5 TRP H H 5 7.943 7.943 8.252 -0.309 19275
1896 1 20 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.409 -0.400 19275
1897 1 20 . 1 1 6 6 ILE CA C 6 60.568 60.568 60.946 -0.378 19275
1898 1 20 . 1 1 6 6 ILE CB C 6 39.279 39.279 37.960 1.319 19275
1899 1 20 . 1 1 6 6 ILE H H 6 7.996 7.996 8.163 -0.167 19275
1900 1 20 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.802 -0.282 19275
1901 1 20 . 1 1 12 12 ASP CA C 12 55.690 55.690 53.996 1.694 19275
1902 1 20 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.407 -3.007 19275
1903 1 20 . 1 1 12 12 ASP H H 12 8.462 8.462 8.207 0.255 19275
1904 1 20 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.754 0.134 19275
1905 1 20 . 1 1 13 13 CYS CA C 13 54.210 54.210 56.351 -2.141 19275
1906 1 20 . 1 1 13 13 CYS CB C 13 38.039 38.039 27.968 10.071 19275
1907 1 20 . 1 1 13 13 CYS H H 13 7.379 7.379 7.681 -0.302 19275
1908 1 20 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.645 -0.269 19275
1909 1 20 . 1 1 14 14 PRO CA C 14 64.055 64.055 63.365 0.690 19275
1910 1 20 . 1 1 14 14 PRO CB C 14 32.142 32.142 30.340 1.802 19275
1911 1 20 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.633 0.052 19275
1912 1 20 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.584 0.061 19275
1913 1 20 . 1 1 15 15 ASN CB C 15 38.632 38.632 39.699 -1.067 19275
1914 1 20 . 1 1 15 15 ASN H H 15 8.574 8.574 7.693 0.881 19275
1915 1 20 . 1 1 16 16 VAL HA H 16 4.136 4.136 3.877 0.259 19275
1916 1 20 . 1 1 16 16 VAL CA C 16 62.669 62.669 62.879 -0.210 19275
1917 1 20 . 1 1 16 16 VAL CB C 16 32.555 32.555 31.866 0.689 19275
1918 1 20 . 1 1 16 16 VAL H H 16 7.763 7.763 7.756 0.007 19275
1919 1 20 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.154 0.032 19275
1920 1 20 . 1 1 17 17 ILE CA C 17 61.580 61.580 62.095 -0.515 19275
1921 1 20 . 1 1 17 17 ILE CB C 17 38.480 38.480 37.473 1.007 19275
1922 1 20 . 1 1 17 17 ILE H H 17 8.210 8.210 8.543 -0.333 19275
1923 1 20 . 1 1 18 18 SER HA H 18 4.486 4.486 4.645 -0.159 19275
1924 1 20 . 1 1 18 18 SER CA C 18 58.520 58.520 57.539 0.981 19275
1925 1 20 . 1 1 18 18 SER CB C 18 63.880 63.880 65.726 -1.846 19275
1926 1 20 . 1 1 18 18 SER H H 18 8.318 8.318 7.440 0.878 19275
1927 1 20 . 1 1 19 19 SER HA H 19 4.483 4.483 4.307 0.176 19275
1928 1 20 . 1 1 19 19 SER CA C 19 59.080 59.080 60.241 -1.161 19275
1929 1 20 . 1 1 19 19 SER CB C 19 63.710 63.710 62.829 0.881 19275
1930 1 20 . 1 1 19 19 SER H H 19 8.335 8.335 8.561 -0.226 19275
1931 1 20 . 1 1 20 20 ILE HA H 20 4.233 4.233 4.069 0.164 19275
1932 1 20 . 1 1 20 20 ILE CA C 20 61.890 61.890 60.983 0.907 19275
1933 1 20 . 1 1 20 20 ILE CB C 20 38.500 38.500 40.706 -2.206 19275
1934 1 20 . 1 1 20 20 ILE H H 20 8.002 8.002 7.849 0.153 19275
1935 1 20 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.657 0.077 19275
1936 1 20 . 1 1 21 21 CYS CA C 21 55.230 55.230 59.086 -3.856 19275
1937 1 20 . 1 1 21 21 CYS CB C 21 40.945 40.945 30.285 10.660 19275
1938 1 20 . 1 1 21 21 CYS H H 21 8.282 8.282 8.574 -0.292 19275
1939 1 20 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.781 -0.390 19275
1940 1 20 . 1 1 22 22 ALA CA C 22 52.899 52.899 51.470 1.429 19275
1941 1 20 . 1 1 22 22 ALA CB C 22 19.346 19.346 20.366 -1.020 19275
1942 1 20 . 1 1 22 22 ALA H H 22 8.119 8.119 7.549 0.570 19275
1943 1 20 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.585 -0.045 19275
1944 1 20 . 1 1 23 23 GLY H H 23 8.417 8.417 8.385 0.032 19275
1945 1 20 . 1 1 24 24 THR HA H 24 4.398 4.398 4.023 0.375 19275
1946 1 20 . 1 1 24 24 THR CA C 24 61.740 61.740 62.898 -1.157 19275
1947 1 20 . 1 1 24 24 THR CB C 24 69.900 69.900 69.136 0.764 19275
1948 1 20 . 1 1 24 24 THR H H 24 8.081 8.081 8.099 -0.018 19275
1949 1 20 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.150 0.128 19275
1950 1 20 . 1 1 25 25 ILE CA C 25 61.386 61.386 61.724 -0.338 19275
1951 1 20 . 1 1 25 25 ILE CB C 25 38.489 38.489 38.594 -0.105 19275
1952 1 20 . 1 1 25 25 ILE H H 25 8.073 8.073 8.210 -0.137 19275
1953 1 20 . 1 1 26 26 ILE HA H 26 4.240 4.240 3.891 0.349 19275
1954 1 20 . 1 1 26 26 ILE CA C 26 61.550 61.550 63.095 -1.545 19275
1955 1 20 . 1 1 26 26 ILE CB C 26 38.379 38.379 38.018 0.361 19275
1956 1 20 . 1 1 26 26 ILE H H 26 8.114 8.114 7.938 0.176 19275
1957 1 20 . 1 1 27 27 THR HA H 27 4.186 4.186 4.569 -0.383 19275
1958 1 20 . 1 1 27 27 THR CA C 27 62.850 62.850 60.249 2.601 19275
1959 1 20 . 1 1 27 27 THR CB C 27 69.160 69.160 72.213 -3.053 19275
1960 1 20 . 1 1 27 27 THR H H 27 7.873 7.873 7.512 0.361 19275
1961 1 20 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.443 -0.079 19275
1962 1 20 . 1 1 28 28 ALA CA C 28 52.828 52.828 53.130 -0.302 19275
1963 1 20 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.870 -0.914 19275
1964 1 20 . 1 1 28 28 ALA H H 28 8.114 8.114 8.322 -0.208 19275
1965 1 20 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.743 -0.108 19275
1966 1 20 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.320 -2.090 19275
1967 1 20 . 1 1 29 29 CYS CB C 29 41.976 41.976 26.075 15.901 19275
1968 1 20 . 1 1 29 29 CYS H H 29 8.008 8.008 8.088 -0.080 19275
1969 1 20 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.540 -0.169 19275
1970 1 20 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.036 -0.536 19275
1971 1 20 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.768 0.202 19275
1972 1 20 . 1 1 30 30 LYS H H 30 8.311 8.311 8.619 -0.308 19275
1973 1 20 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.843 -0.082 19275
1974 1 20 . 1 1 31 31 ASN CA C 31 53.583 53.583 52.092 1.491 19275
1975 1 20 . 1 1 31 31 ASN CB C 31 39.178 39.178 40.968 -1.790 19275
1976 1 20 . 1 1 31 31 ASN H H 31 8.351 8.351 7.669 0.682 19275
1977 1 20 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.730 -0.215 19275
1978 1 20 . 1 1 32 32 CYS CA C 32 55.690 55.690 58.382 -2.692 19275
1979 1 20 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.466 6.724 19275
1980 1 20 . 1 1 32 32 CYS H H 32 8.285 8.285 8.376 -0.091 19275
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 0 0.000 0.000 0.000 19275
2 1 1 "Average Difference" HA 28 0.241 0.014 0.245 19275
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19275
4 1 1 "Average Difference" CA 26 1.443 -0.015 1.472 19275
5 1 1 "Average Difference" CB 24 5.341 -1.962 5.074 19275
6 1 1 "Average Difference" HN 25 0.350 0.083 0.347 19275
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19275
8 1 2 "Average Difference" HA 28 0.215 -0.064 0.209 19275
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19275
10 1 2 "Average Difference" CA 26 1.530 0.408 1.504 19275
11 1 2 "Average Difference" CB 24 4.919 -1.763 4.691 19275
12 1 2 "Average Difference" HN 25 0.395 -0.051 0.399 19275
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19275
14 1 3 "Average Difference" HA 28 0.183 0.083 0.166 19275
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19275
16 1 3 "Average Difference" CA 26 1.249 0.100 1.270 19275
17 1 3 "Average Difference" CB 24 4.864 -1.474 4.735 19275
18 1 3 "Average Difference" HN 25 0.367 0.115 0.356 19275
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19275
20 1 4 "Average Difference" HA 28 0.286 -0.064 0.284 19275
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19275
22 1 4 "Average Difference" CA 26 1.293 0.237 1.296 19275
23 1 4 "Average Difference" CB 24 5.340 -2.143 4.996 19275
24 1 4 "Average Difference" HN 25 0.366 0.052 0.370 19275
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19275
26 1 5 "Average Difference" HA 28 0.245 -0.008 0.250 19275
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19275
28 1 5 "Average Difference" CA 26 1.387 0.377 1.361 19275
29 1 5 "Average Difference" CB 24 5.133 -2.054 4.805 19275
30 1 5 "Average Difference" HN 25 0.366 0.059 0.369 19275
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19275
32 1 6 "Average Difference" HA 28 0.224 0.033 0.226 19275
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19275
34 1 6 "Average Difference" CA 26 1.407 0.016 1.435 19275
35 1 6 "Average Difference" CB 24 5.386 -1.785 5.191 19275
36 1 6 "Average Difference" HN 25 0.345 -0.074 0.344 19275
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19275
38 1 7 "Average Difference" HA 28 0.193 -0.003 0.197 19275
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19275
40 1 7 "Average Difference" CA 26 1.157 0.263 1.149 19275
41 1 7 "Average Difference" CB 24 5.158 -1.859 4.915 19275
42 1 7 "Average Difference" HN 25 0.366 0.033 0.372 19275
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19275
44 1 8 "Average Difference" HA 28 0.239 -0.067 0.233 19275
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19275
46 1 8 "Average Difference" CA 26 1.762 0.560 1.703 19275
47 1 8 "Average Difference" CB 24 5.247 -2.185 4.873 19275
48 1 8 "Average Difference" HN 25 0.448 0.064 0.452 19275
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19275
50 1 9 "Average Difference" HA 28 0.263 0.020 0.267 19275
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19275
52 1 9 "Average Difference" CA 26 1.602 0.289 1.607 19275
53 1 9 "Average Difference" CB 24 5.059 -1.785 4.835 19275
54 1 9 "Average Difference" HN 25 0.331 -0.007 0.338 19275
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19275
56 1 10 "Average Difference" HA 28 0.336 0.144 0.309 19275
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19275
58 1 10 "Average Difference" CA 26 1.339 -0.013 1.365 19275
59 1 10 "Average Difference" CB 24 5.111 -1.550 4.975 19275
60 1 10 "Average Difference" HN 25 0.369 0.030 0.375 19275
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19275
62 1 11 "Average Difference" HA 28 0.271 -0.054 0.271 19275
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19275
64 1 11 "Average Difference" CA 26 1.775 0.395 1.764 19275
65 1 11 "Average Difference" CB 24 4.988 -1.762 4.767 19275
66 1 11 "Average Difference" HN 25 0.382 -0.083 0.380 19275
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19275
68 1 12 "Average Difference" HA 28 0.267 -0.008 0.272 19275
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19275
70 1 12 "Average Difference" CA 26 1.675 0.237 1.691 19275
71 1 12 "Average Difference" CB 24 4.782 -1.765 4.540 19275
72 1 12 "Average Difference" HN 25 0.411 0.059 0.415 19275
73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19275
74 1 13 "Average Difference" HA 28 0.213 -0.021 0.216 19275
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19275
76 1 13 "Average Difference" CA 26 1.327 0.225 1.334 19275
77 1 13 "Average Difference" CB 24 4.709 -1.675 4.496 19275
78 1 13 "Average Difference" HN 25 0.353 -0.030 0.359 19275
79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19275
80 1 14 "Average Difference" HA 28 0.294 -0.047 0.296 19275
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19275
82 1 14 "Average Difference" CA 26 1.665 0.142 1.692 19275
83 1 14 "Average Difference" CB 24 5.172 -2.041 4.855 19275
84 1 14 "Average Difference" HN 25 0.360 -0.022 0.367 19275
85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19275
86 1 15 "Average Difference" HA 28 0.259 -0.050 0.259 19275
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19275
88 1 15 "Average Difference" CA 26 1.597 0.263 1.606 19275
89 1 15 "Average Difference" CB 24 5.468 -2.294 5.070 19275
90 1 15 "Average Difference" HN 25 0.440 -0.092 0.439 19275
91 1 16 "Average Difference" N 0 0.000 0.000 0.000 19275
92 1 16 "Average Difference" HA 28 0.200 -0.017 0.203 19275
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19275
94 1 16 "Average Difference" CA 26 1.561 0.336 1.554 19275
95 1 16 "Average Difference" CB 24 5.285 -2.005 4.995 19275
96 1 16 "Average Difference" HN 25 0.402 -0.015 0.410 19275
97 1 17 "Average Difference" N 0 0.000 0.000 0.000 19275
98 1 17 "Average Difference" HA 28 0.325 0.004 0.331 19275
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19275
100 1 17 "Average Difference" CA 26 1.557 0.331 1.551 19275
101 1 17 "Average Difference" CB 24 5.302 -1.669 5.141 19275
102 1 17 "Average Difference" HN 25 0.354 0.071 0.354 19275
103 1 18 "Average Difference" N 0 0.000 0.000 0.000 19275
104 1 18 "Average Difference" HA 28 0.224 -0.030 0.226 19275
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19275
106 1 18 "Average Difference" CA 26 1.700 0.217 1.719 19275
107 1 18 "Average Difference" CB 24 5.457 -1.864 5.239 19275
108 1 18 "Average Difference" HN 25 0.402 -0.015 0.410 19275
109 1 19 "Average Difference" N 0 0.000 0.000 0.000 19275
110 1 19 "Average Difference" HA 28 0.260 -0.009 0.264 19275
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19275
112 1 19 "Average Difference" CA 26 1.581 0.196 1.600 19275
113 1 19 "Average Difference" CB 24 5.561 -2.092 5.264 19275
114 1 19 "Average Difference" HN 25 0.445 0.053 0.451 19275
115 1 20 "Average Difference" N 0 0.000 0.000 0.000 19275
116 1 20 "Average Difference" HA 28 0.232 0.049 0.231 19275
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19275
118 1 20 "Average Difference" CA 26 1.443 0.266 1.446 19275
119 1 20 "Average Difference" CB 24 4.809 -1.425 4.692 19275
120 1 20 "Average Difference" HN 25 0.363 -0.073 0.363 19275
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 19275
_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 ASP HA H 2 4.653 4.653 4.768 -0.115 19275
2 1 . 1 1 2 2 ASP CA C 2 54.278 54.278 54.152 0.126 19275
3 1 . 1 1 2 2 ASP CB C 2 41.637 41.637 41.435 0.202 19275
4 1 . 1 1 2 2 ASP H H 2 8.656 8.656 8.446 0.210 19275
5 1 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.459 -0.213 19275
6 1 . 1 1 3 3 ARG CA C 3 56.300 56.300 56.013 0.287 19275
7 1 . 1 1 3 3 ARG CB C 3 30.487 30.487 30.878 -0.391 19275
8 1 . 1 1 3 3 ARG H H 3 8.540 8.540 8.386 0.154 19275
9 1 . 1 1 4 4 GLY CA C 4 45.373 45.373 44.793 0.580 19275
10 1 . 1 1 4 4 GLY H H 4 8.504 8.504 8.377 0.127 19275
11 1 . 1 1 5 5 TRP HA H 5 4.657 4.657 4.876 -0.220 19275
12 1 . 1 1 5 5 TRP CA C 5 57.200 57.200 56.469 0.731 19275
13 1 . 1 1 5 5 TRP CB C 5 29.618 29.618 30.536 -0.918 19275
14 1 . 1 1 5 5 TRP H H 5 7.943 7.943 7.967 -0.024 19275
15 1 . 1 1 6 6 ILE HA H 6 4.009 4.009 4.234 -0.225 19275
16 1 . 1 1 6 6 ILE CA C 6 60.568 60.568 61.423 -0.855 19275
17 1 . 1 1 6 6 ILE CB C 6 39.279 39.279 38.333 0.946 19275
18 1 . 1 1 6 6 ILE H H 6 7.996 7.996 8.278 -0.282 19275
19 1 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.728 -0.207 19275
20 1 . 1 1 12 12 ASP CA C 12 55.690 55.690 54.147 1.543 19275
21 1 . 1 1 12 12 ASP CB C 12 38.400 38.400 41.033 -2.633 19275
22 1 . 1 1 12 12 ASP H H 12 8.462 8.462 8.239 0.223 19275
23 1 . 1 1 13 13 CYS HA H 13 4.888 4.888 4.686 0.202 19275
24 1 . 1 1 13 13 CYS CA C 13 54.210 54.210 56.126 -1.916 19275
25 1 . 1 1 13 13 CYS CB C 13 38.039 38.039 26.992 11.047 19275
26 1 . 1 1 13 13 CYS H H 13 7.379 7.379 7.908 -0.529 19275
27 1 . 1 1 14 14 PRO HA H 14 4.376 4.376 4.404 -0.028 19275
28 1 . 1 1 14 14 PRO CA C 14 64.055 64.055 63.820 0.235 19275
29 1 . 1 1 14 14 PRO CB C 14 32.142 32.142 31.617 0.525 19275
30 1 . 1 1 15 15 ASN HA H 15 4.685 4.685 4.696 -0.011 19275
31 1 . 1 1 15 15 ASN CA C 15 53.645 53.645 53.214 0.431 19275
32 1 . 1 1 15 15 ASN CB C 15 38.632 38.632 39.402 -0.770 19275
33 1 . 1 1 15 15 ASN H H 15 8.574 8.574 8.051 0.523 19275
34 1 . 1 1 16 16 VAL HA H 16 4.136 4.136 4.043 0.093 19275
35 1 . 1 1 16 16 VAL CA C 16 62.669 62.669 62.632 0.037 19275
36 1 . 1 1 16 16 VAL CB C 16 32.555 32.555 31.828 0.727 19275
37 1 . 1 1 16 16 VAL H H 16 7.763 7.763 8.062 -0.299 19275
38 1 . 1 1 17 17 ILE HA H 17 4.186 4.186 4.356 -0.171 19275
39 1 . 1 1 17 17 ILE CA C 17 61.580 61.580 60.902 0.678 19275
40 1 . 1 1 17 17 ILE CB C 17 38.480 38.480 38.835 -0.354 19275
41 1 . 1 1 17 17 ILE H H 17 8.210 8.210 8.161 0.048 19275
42 1 . 1 1 18 18 SER HA H 18 4.486 4.486 4.384 0.102 19275
43 1 . 1 1 18 18 SER CA C 18 58.520 58.520 59.063 -0.543 19275
44 1 . 1 1 18 18 SER CB C 18 63.880 63.880 63.479 0.401 19275
45 1 . 1 1 18 18 SER H H 18 8.318 8.318 8.433 -0.115 19275
46 1 . 1 1 19 19 SER HA H 19 4.483 4.483 4.501 -0.018 19275
47 1 . 1 1 19 19 SER CA C 19 59.080 59.080 58.944 0.136 19275
48 1 . 1 1 19 19 SER CB C 19 63.710 63.710 63.481 0.229 19275
49 1 . 1 1 19 19 SER H H 19 8.335 8.335 8.187 0.148 19275
50 1 . 1 1 20 20 ILE HA H 20 4.233 4.233 4.016 0.217 19275
51 1 . 1 1 20 20 ILE CA C 20 61.890 61.890 61.254 0.636 19275
52 1 . 1 1 20 20 ILE CB C 20 38.500 38.500 39.072 -0.572 19275
53 1 . 1 1 20 20 ILE H H 20 8.002 8.002 7.832 0.170 19275
54 1 . 1 1 21 21 CYS HA H 21 4.734 4.734 4.494 0.240 19275
55 1 . 1 1 21 21 CYS CA C 21 55.230 55.230 58.865 -3.635 19275
56 1 . 1 1 21 21 CYS CB C 21 40.945 40.945 27.180 13.765 19275
57 1 . 1 1 21 21 CYS H H 21 8.282 8.282 8.636 -0.354 19275
58 1 . 1 1 22 22 ALA HA H 22 4.391 4.391 4.317 0.074 19275
59 1 . 1 1 22 22 ALA CA C 22 52.899 52.899 52.145 0.754 19275
60 1 . 1 1 22 22 ALA CB C 22 19.346 19.346 19.151 0.196 19275
61 1 . 1 1 22 22 ALA H H 22 8.119 8.119 7.816 0.303 19275
62 1 . 1 1 23 23 GLY CA C 23 45.540 45.540 45.411 0.129 19275
63 1 . 1 1 23 23 GLY H H 23 8.417 8.417 8.351 0.066 19275
64 1 . 1 1 24 24 THR HA H 24 4.398 4.398 4.379 0.019 19275
65 1 . 1 1 24 24 THR CA C 24 61.740 61.740 61.816 -0.076 19275
66 1 . 1 1 24 24 THR CB C 24 69.900 69.900 69.675 0.225 19275
67 1 . 1 1 24 24 THR H H 24 8.081 8.081 7.968 0.113 19275
68 1 . 1 1 25 25 ILE HA H 25 4.278 4.278 4.283 -0.005 19275
69 1 . 1 1 25 25 ILE CA C 25 61.386 61.386 61.365 0.021 19275
70 1 . 1 1 25 25 ILE CB C 25 38.489 38.489 38.040 0.449 19275
71 1 . 1 1 25 25 ILE H H 25 8.073 8.073 8.215 -0.142 19275
72 1 . 1 1 26 26 ILE HA H 26 4.240 4.240 4.196 0.044 19275
73 1 . 1 1 26 26 ILE CA C 26 61.550 61.550 61.834 -0.284 19275
74 1 . 1 1 26 26 ILE CB C 26 38.379 38.379 38.702 -0.323 19275
75 1 . 1 1 26 26 ILE H H 26 8.114 8.114 8.056 0.058 19275
76 1 . 1 1 27 27 THR HA H 27 4.186 4.186 4.414 -0.228 19275
77 1 . 1 1 27 27 THR CA C 27 62.850 62.850 62.519 0.331 19275
78 1 . 1 1 27 27 THR CB C 27 69.160 69.160 69.791 -0.631 19275
79 1 . 1 1 27 27 THR H H 27 7.873 7.873 8.107 -0.234 19275
80 1 . 1 1 28 28 ALA HA H 28 4.364 4.364 4.477 -0.114 19275
81 1 . 1 1 28 28 ALA CA C 28 52.828 52.828 52.320 0.508 19275
82 1 . 1 1 28 28 ALA CB C 28 18.956 18.956 19.528 -0.572 19275
83 1 . 1 1 28 28 ALA H H 28 8.114 8.114 8.272 -0.158 19275
84 1 . 1 1 29 29 CYS HA H 29 4.635 4.635 4.460 0.175 19275
85 1 . 1 1 29 29 CYS CA C 29 56.230 56.230 58.137 -1.907 19275
86 1 . 1 1 29 29 CYS CB C 29 41.976 41.976 26.400 15.576 19275
87 1 . 1 1 29 29 CYS H H 29 8.008 8.008 8.062 -0.054 19275
88 1 . 1 1 30 30 LYS HA H 30 4.371 4.371 4.226 0.145 19275
89 1 . 1 1 30 30 LYS CA C 30 56.500 56.500 57.537 -1.037 19275
90 1 . 1 1 30 30 LYS CB C 30 32.970 32.970 32.858 0.112 19275
91 1 . 1 1 30 30 LYS H H 30 8.311 8.311 8.503 -0.192 19275
92 1 . 1 1 31 31 ASN HA H 31 4.761 4.761 4.716 0.045 19275
93 1 . 1 1 31 31 ASN CA C 31 53.583 53.583 53.052 0.531 19275
94 1 . 1 1 31 31 ASN CB C 31 39.178 39.178 38.955 0.223 19275
95 1 . 1 1 31 31 ASN H H 31 8.351 8.351 7.923 0.428 19275
96 1 . 1 1 32 32 CYS HA H 32 4.515 4.515 4.550 -0.035 19275
97 1 . 1 1 32 32 CYS CA C 32 55.690 55.690 59.411 -3.721 19275
98 1 . 1 1 32 32 CYS CB C 32 34.190 34.190 27.069 7.121 19275
99 1 . 1 1 32 32 CYS H H 32 8.285 8.285 8.670 -0.385 19275
stop_
save_