data_17967
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 17967
_Entry.PDB_ID 2LJX
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 17967
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.625 -0.335 17967
2 1 1 . 1 1 2 2 ALA CA C 0 52.530 52.530 52.007 0.523 17967
3 1 1 . 1 1 2 2 ALA CB C 0 19.730 19.730 20.370 -0.640 17967
4 1 1 . 1 1 3 3 MET N N 1 122.210 122.210 125.566 -3.356 17967
5 1 1 . 1 1 3 3 MET HA H 1 4.300 4.300 5.060 -0.760 17967
6 1 1 . 1 1 3 3 MET CA C 1 56.030 56.030 55.100 0.930 17967
7 1 1 . 1 1 3 3 MET CB C 1 33.430 33.430 34.036 -0.606 17967
8 1 1 . 1 1 3 3 MET H H 1 8.370 8.370 8.494 -0.124 17967
9 1 1 . 1 1 4 4 PHE N N 2 122.310 122.310 126.837 -4.527 17967
10 1 1 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.790 -0.160 17967
11 1 1 . 1 1 4 4 PHE CA C 2 57.330 57.330 56.283 1.047 17967
12 1 1 . 1 1 4 4 PHE CB C 2 39.430 39.430 40.091 -0.661 17967
13 1 1 . 1 1 4 4 PHE H H 2 8.370 8.370 8.399 -0.029 17967
14 1 1 . 1 1 5 5 GLN N N 3 123.510 123.510 124.516 -1.006 17967
15 1 1 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.469 -0.289 17967
16 1 1 . 1 1 5 5 GLN CA C 3 56.130 56.130 54.173 1.957 17967
17 1 1 . 1 1 5 5 GLN CB C 3 29.930 29.930 32.455 -2.525 17967
18 1 1 . 1 1 5 5 GLN H H 3 8.260 8.260 8.349 -0.089 17967
19 1 1 . 1 1 6 6 ASP N N 4 125.010 125.010 121.373 3.637 17967
20 1 1 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.439 0.351 17967
21 1 1 . 1 1 6 6 ASP CA C 4 51.930 51.930 53.903 -1.973 17967
22 1 1 . 1 1 6 6 ASP CB C 4 41.730 41.730 41.265 0.465 17967
23 1 1 . 1 1 6 6 ASP H H 4 8.420 8.420 8.261 0.159 17967
24 1 1 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.432 -0.312 17967
25 1 1 . 1 1 7 7 PRO CA C 5 64.030 64.030 63.218 0.812 17967
26 1 1 . 1 1 7 7 PRO CB C 5 32.330 32.330 31.896 0.434 17967
27 1 1 . 1 1 8 8 GLN N N 6 119.710 119.710 120.704 -0.994 17967
28 1 1 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.147 0.013 17967
29 1 1 . 1 1 8 8 GLN CA C 6 56.630 56.630 54.680 1.950 17967
30 1 1 . 1 1 8 8 GLN CB C 6 29.330 29.330 25.713 3.617 17967
31 1 1 . 1 1 8 8 GLN H H 6 8.430 8.430 7.478 0.952 17967
32 1 1 . 1 1 9 9 GLU N N 7 122.110 122.110 122.492 -0.382 17967
33 1 1 . 1 1 9 9 GLU HA H 7 4.200 4.200 3.912 0.288 17967
34 1 1 . 1 1 9 9 GLU CA C 7 56.030 56.030 57.797 -1.767 17967
35 1 1 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.947 0.583 17967
36 1 1 . 1 1 9 9 GLU H H 7 7.940 7.940 8.126 -0.186 17967
37 1 1 . 1 1 10 10 ARG N N 8 123.410 123.410 114.074 9.336 17967
38 1 1 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.268 0.132 17967
39 1 1 . 1 1 10 10 ARG CA C 8 54.130 54.130 56.133 -2.003 17967
40 1 1 . 1 1 10 10 ARG CB C 8 29.330 29.330 28.299 1.031 17967
41 1 1 . 1 1 10 10 ARG H H 8 7.660 7.660 8.172 -0.512 17967
42 1 1 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.683 -0.333 17967
43 1 1 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.296 1.234 17967
44 1 1 . 1 1 11 11 PRO CB C 9 32.630 32.630 32.916 -0.286 17967
45 1 1 . 1 1 12 12 ARG N N 10 123.810 123.810 117.042 6.768 17967
46 1 1 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.921 -0.251 17967
47 1 1 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.621 1.209 17967
48 1 1 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.951 0.579 17967
49 1 1 . 1 1 12 12 ARG H H 10 8.710 8.710 8.828 -0.118 17967
50 1 1 . 1 1 13 13 LYS N N 11 118.410 118.410 119.545 -1.135 17967
51 1 1 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.802 0.248 17967
52 1 1 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.549 -1.219 17967
53 1 1 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.679 0.751 17967
54 1 1 . 1 1 13 13 LYS H H 11 7.800 7.800 7.703 0.097 17967
55 1 1 . 1 1 14 14 LEU N N 12 125.010 125.010 126.136 -1.126 17967
56 1 1 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.183 -0.013 17967
57 1 1 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.209 0.521 17967
58 1 1 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.967 0.563 17967
59 1 1 . 1 1 14 14 LEU H H 12 10.210 10.210 9.193 1.017 17967
60 1 1 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.263 -0.043 17967
61 1 1 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.692 1.538 17967
62 1 1 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.022 -0.292 17967
63 1 1 . 1 1 16 16 GLN N N 14 117.810 117.810 117.443 0.367 17967
64 1 1 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.132 0.058 17967
65 1 1 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.950 0.080 17967
66 1 1 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.320 0.310 17967
67 1 1 . 1 1 16 16 GLN H H 14 7.110 7.110 8.320 -1.210 17967
68 1 1 . 1 1 17 17 LEU N N 15 124.710 124.710 122.311 2.399 17967
69 1 1 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.344 -0.334 17967
70 1 1 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.489 0.841 17967
71 1 1 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.823 0.207 17967
72 1 1 . 1 1 17 17 LEU H H 15 8.010 8.010 8.112 -0.102 17967
73 1 1 . 1 1 18 18 CYS N N 16 117.210 117.210 116.235 0.975 17967
74 1 1 . 1 1 18 18 CYS HA H 16 3.750 3.750 3.998 -0.248 17967
75 1 1 . 1 1 18 18 CYS CA C 16 64.730 64.730 64.063 0.667 17967
76 1 1 . 1 1 18 18 CYS CB C 16 26.230 26.230 25.981 0.249 17967
77 1 1 . 1 1 18 18 CYS H H 16 8.380 8.380 8.394 -0.014 17967
78 1 1 . 1 1 19 19 THR N N 17 117.810 117.810 116.407 1.403 17967
79 1 1 . 1 1 19 19 THR HA H 17 4.000 4.000 4.056 -0.056 17967
80 1 1 . 1 1 19 19 THR CA C 17 66.830 66.830 67.074 -0.244 17967
81 1 1 . 1 1 19 19 THR CB C 17 68.830 68.830 68.612 0.217 17967
82 1 1 . 1 1 19 19 THR H H 17 7.720 7.720 7.500 0.220 17967
83 1 1 . 1 1 20 20 GLU N N 18 125.410 125.410 120.898 4.512 17967
84 1 1 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.170 -0.100 17967
85 1 1 . 1 1 20 20 GLU CA C 18 59.730 59.730 59.284 0.446 17967
86 1 1 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.445 0.285 17967
87 1 1 . 1 1 20 20 GLU H H 18 8.010 8.010 7.560 0.450 17967
88 1 1 . 1 1 21 21 LEU N N 19 118.810 118.810 116.645 2.165 17967
89 1 1 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.335 -0.035 17967
90 1 1 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.479 -0.649 17967
91 1 1 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.914 0.416 17967
92 1 1 . 1 1 21 21 LEU H H 19 8.010 8.010 7.923 0.087 17967
93 1 1 . 1 1 22 22 GLN N N 20 118.310 118.310 115.203 3.107 17967
94 1 1 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.090 -0.140 17967
95 1 1 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.272 -0.542 17967
96 1 1 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.188 -0.058 17967
97 1 1 . 1 1 22 22 GLN H H 20 7.860 7.860 7.832 0.028 17967
98 1 1 . 1 1 23 23 THR N N 21 115.910 115.910 112.190 3.720 17967
99 1 1 . 1 1 23 23 THR HA H 21 4.950 4.950 4.573 0.377 17967
100 1 1 . 1 1 23 23 THR CA C 21 58.530 58.530 60.244 -1.714 17967
101 1 1 . 1 1 23 23 THR CB C 21 70.330 70.330 70.998 -0.668 17967
102 1 1 . 1 1 23 23 THR H H 21 8.250 8.250 8.190 0.060 17967
103 1 1 . 1 1 24 24 THR N N 22 112.810 112.810 114.074 -1.264 17967
104 1 1 . 1 1 24 24 THR HA H 22 4.880 4.880 4.589 0.291 17967
105 1 1 . 1 1 24 24 THR CA C 22 59.730 59.730 60.112 -0.382 17967
106 1 1 . 1 1 24 24 THR CB C 22 74.130 74.130 71.141 2.989 17967
107 1 1 . 1 1 24 24 THR H H 22 8.660 8.660 7.795 0.865 17967
108 1 1 . 1 1 25 25 ILE N N 23 123.710 123.710 119.985 3.725 17967
109 1 1 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.737 0.043 17967
110 1 1 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.035 -0.605 17967
111 1 1 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.996 0.634 17967
112 1 1 . 1 1 25 25 ILE H H 23 9.060 9.060 8.147 0.913 17967
113 1 1 . 1 1 26 26 HIS N N 24 119.510 119.510 112.985 6.525 17967
114 1 1 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.756 -0.316 17967
115 1 1 . 1 1 26 26 HIS CA C 24 57.030 57.030 54.925 2.105 17967
116 1 1 . 1 1 26 26 HIS CB C 24 30.830 30.830 28.799 2.030 17967
117 1 1 . 1 1 26 26 HIS H H 24 7.040 7.040 7.477 -0.437 17967
118 1 1 . 1 1 27 27 ASP N N 25 116.810 116.810 118.347 -1.537 17967
119 1 1 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.641 0.119 17967
120 1 1 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.305 0.125 17967
121 1 1 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.136 1.194 17967
122 1 1 . 1 1 27 27 ASP H H 25 7.250 7.250 7.560 -0.310 17967
123 1 1 . 1 1 28 28 ILE N N 26 123.210 123.210 122.228 0.982 17967
124 1 1 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.807 0.123 17967
125 1 1 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.600 0.430 17967
126 1 1 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.541 -0.611 17967
127 1 1 . 1 1 28 28 ILE H H 26 7.750 7.750 7.915 -0.165 17967
128 1 1 . 1 1 29 29 ILE N N 27 131.110 131.110 129.127 1.983 17967
129 1 1 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.061 0.319 17967
130 1 1 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.863 -1.033 17967
131 1 1 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.273 1.357 17967
132 1 1 . 1 1 29 29 ILE H H 27 8.270 8.270 8.267 0.003 17967
133 1 1 . 1 1 30 30 LEU N N 28 129.410 129.410 128.837 0.573 17967
134 1 1 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.731 -0.071 17967
135 1 1 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.192 -0.662 17967
136 1 1 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.554 2.776 17967
137 1 1 . 1 1 30 30 LEU H H 28 8.500 8.500 8.246 0.254 17967
138 1 1 . 1 1 31 31 GLU N N 29 121.910 121.910 121.242 0.668 17967
139 1 1 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.705 -0.025 17967
140 1 1 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.287 0.643 17967
141 1 1 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.442 0.588 17967
142 1 1 . 1 1 31 31 GLU H H 29 8.860 8.860 8.243 0.617 17967
143 1 1 . 1 1 32 32 CYS N N 30 125.710 125.710 120.451 5.259 17967
144 1 1 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.779 -0.759 17967
145 1 1 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.483 -1.252 17967
146 1 1 . 1 1 32 32 CYS CB C 30 31.730 31.730 26.779 4.951 17967
147 1 1 . 1 1 32 32 CYS H H 30 8.270 8.270 8.495 -0.225 17967
148 1 1 . 1 1 33 33 VAL N N 31 132.310 132.310 128.241 4.069 17967
149 1 1 . 1 1 33 33 VAL HA H 31 3.100 3.100 2.926 0.174 17967
150 1 1 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.838 -1.608 17967
151 1 1 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.869 -0.239 17967
152 1 1 . 1 1 33 33 VAL H H 31 8.860 8.860 7.869 0.991 17967
153 1 1 . 1 1 34 34 TYR N N 32 124.310 124.310 116.305 8.005 17967
154 1 1 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.500 -0.060 17967
155 1 1 . 1 1 34 34 TYR CA C 32 61.030 61.030 59.852 1.178 17967
156 1 1 . 1 1 34 34 TYR CB C 32 40.130 40.130 37.917 2.213 17967
157 1 1 . 1 1 34 34 TYR H H 32 8.590 8.590 7.107 1.483 17967
158 1 1 . 1 1 35 35 CYS N N 33 119.810 119.810 115.511 4.299 17967
159 1 1 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.524 0.316 17967
160 1 1 . 1 1 35 35 CYS CA C 33 59.430 59.430 59.171 0.259 17967
161 1 1 . 1 1 35 35 CYS CB C 33 32.230 32.230 27.835 4.395 17967
162 1 1 . 1 1 35 35 CYS H H 33 8.070 8.070 7.634 0.436 17967
163 1 1 . 1 1 36 36 LYS N N 34 119.910 119.910 114.660 5.250 17967
164 1 1 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.963 0.227 17967
165 1 1 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.205 0.625 17967
166 1 1 . 1 1 36 36 LYS CB C 34 29.330 29.330 29.630 -0.300 17967
167 1 1 . 1 1 36 36 LYS H H 34 7.860 7.860 8.240 -0.380 17967
168 1 1 . 1 1 37 37 GLN N N 35 120.710 120.710 115.229 5.481 17967
169 1 1 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.414 -0.054 17967
170 1 1 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.215 1.215 17967
171 1 1 . 1 1 37 37 GLN CB C 35 29.630 29.630 29.399 0.231 17967
172 1 1 . 1 1 37 37 GLN H H 35 8.270 8.270 7.661 0.609 17967
173 1 1 . 1 1 38 38 GLN N N 36 123.710 123.710 124.529 -0.819 17967
174 1 1 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.139 0.161 17967
175 1 1 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.420 0.310 17967
176 1 1 . 1 1 38 38 GLN CB C 36 29.330 29.330 29.050 0.279 17967
177 1 1 . 1 1 38 38 GLN H H 36 8.640 8.640 8.638 0.002 17967
178 1 1 . 1 1 39 39 LEU N N 37 131.310 131.310 127.796 3.514 17967
179 1 1 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.202 -0.092 17967
180 1 1 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.230 2.100 17967
181 1 1 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.489 -0.559 17967
182 1 1 . 1 1 39 39 LEU H H 37 8.870 8.870 7.863 1.007 17967
183 1 1 . 1 1 40 40 LEU N N 38 126.310 126.310 124.730 1.580 17967
184 1 1 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.263 0.047 17967
185 1 1 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.862 -0.632 17967
186 1 1 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.115 0.015 17967
187 1 1 . 1 1 40 40 LEU H H 38 9.850 9.850 8.394 1.456 17967
188 1 1 . 1 1 41 41 ARG N N 39 127.110 127.110 125.743 1.367 17967
189 1 1 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.684 -0.164 17967
190 1 1 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.629 -1.799 17967
191 1 1 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.673 -2.743 17967
192 1 1 . 1 1 41 41 ARG H H 39 8.970 8.970 8.876 0.094 17967
193 1 1 . 1 1 42 42 ARG N N 40 115.810 115.810 117.596 -1.786 17967
194 1 1 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.305 -0.225 17967
195 1 1 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.105 0.025 17967
196 1 1 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.210 0.120 17967
197 1 1 . 1 1 42 42 ARG H H 40 8.610 8.610 8.606 0.004 17967
198 1 1 . 1 1 43 43 GLU N N 41 119.910 119.910 119.209 0.701 17967
199 1 1 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.208 0.042 17967
200 1 1 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.698 0.332 17967
201 1 1 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.088 1.242 17967
202 1 1 . 1 1 43 43 GLU H H 41 6.950 6.950 7.853 -0.903 17967
203 1 1 . 1 1 44 44 VAL N N 42 125.010 125.010 119.991 5.019 17967
204 1 1 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.514 -0.274 17967
205 1 1 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.200 1.431 17967
206 1 1 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.423 -0.093 17967
207 1 1 . 1 1 44 44 VAL H H 42 7.820 7.820 8.050 -0.230 17967
208 1 1 . 1 1 45 45 TYR N N 43 118.410 118.410 119.025 -0.615 17967
209 1 1 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.170 0.260 17967
210 1 1 . 1 1 45 45 TYR CA C 43 58.830 58.830 60.235 -1.405 17967
211 1 1 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.165 -0.435 17967
212 1 1 . 1 1 45 45 TYR H H 43 7.820 7.820 8.008 -0.188 17967
213 1 1 . 1 1 46 46 ASP N N 44 122.410 122.410 119.758 2.652 17967
214 1 1 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.361 0.239 17967
215 1 1 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.928 -0.098 17967
216 1 1 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.331 0.699 17967
217 1 1 . 1 1 46 46 ASP H H 44 8.540 8.540 8.097 0.443 17967
218 1 1 . 1 1 47 47 PHE N N 45 126.210 126.210 119.160 7.050 17967
219 1 1 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.204 -0.294 17967
220 1 1 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.770 0.860 17967
221 1 1 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.263 0.067 17967
222 1 1 . 1 1 47 47 PHE H H 45 8.320 8.320 7.538 0.782 17967
223 1 1 . 1 1 48 48 ALA N N 46 119.110 119.110 118.862 0.248 17967
224 1 1 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.388 0.132 17967
225 1 1 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.474 0.756 17967
226 1 1 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.789 -0.059 17967
227 1 1 . 1 1 48 48 ALA H H 46 7.740 7.740 7.675 0.065 17967
228 1 1 . 1 1 49 49 ARG N N 47 124.010 124.010 117.455 6.555 17967
229 1 1 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.313 -0.263 17967
230 1 1 . 1 1 49 49 ARG CA C 47 59.630 59.630 56.986 2.644 17967
231 1 1 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.262 0.168 17967
232 1 1 . 1 1 49 49 ARG H H 47 8.500 8.500 8.295 0.205 17967
233 1 1 . 1 1 50 50 ARG N N 48 119.110 119.110 117.241 1.869 17967
234 1 1 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.537 -0.527 17967
235 1 1 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.493 2.637 17967
236 1 1 . 1 1 50 50 ARG CB C 48 31.130 31.130 32.704 -1.574 17967
237 1 1 . 1 1 50 50 ARG H H 48 7.940 7.940 7.609 0.331 17967
238 1 1 . 1 1 51 51 ASP N N 49 120.910 120.910 119.125 1.785 17967
239 1 1 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.725 -0.305 17967
240 1 1 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.160 1.369 17967
241 1 1 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.231 -0.301 17967
242 1 1 . 1 1 51 51 ASP H H 49 7.950 7.950 8.411 -0.461 17967
243 1 1 . 1 1 52 52 LEU N N 50 118.410 118.410 119.962 -1.552 17967
244 1 1 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.233 -0.083 17967
245 1 1 . 1 1 52 52 LEU CA C 50 54.230 54.230 55.681 -1.451 17967
246 1 1 . 1 1 52 52 LEU CB C 50 41.130 41.130 42.262 -1.132 17967
247 1 1 . 1 1 52 52 LEU H H 50 6.640 6.640 7.265 -0.625 17967
248 1 1 . 1 1 53 53 CYS N N 51 117.410 117.410 115.656 1.754 17967
249 1 1 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.284 -0.354 17967
250 1 1 . 1 1 53 53 CYS CA C 51 58.930 58.930 55.989 2.941 17967
251 1 1 . 1 1 53 53 CYS CB C 51 28.630 28.630 31.154 -2.524 17967
252 1 1 . 1 1 53 53 CYS H H 51 8.030 8.030 8.041 -0.011 17967
253 1 1 . 1 1 54 54 ILE N N 52 125.110 125.110 122.748 2.362 17967
254 1 1 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.430 -0.420 17967
255 1 1 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.740 -2.110 17967
256 1 1 . 1 1 54 54 ILE CB C 52 37.330 37.330 39.189 -1.859 17967
257 1 1 . 1 1 54 54 ILE H H 52 8.500 8.500 8.993 -0.493 17967
258 1 1 . 1 1 55 55 VAL N N 53 127.010 127.010 121.502 5.508 17967
259 1 1 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.660 -0.290 17967
260 1 1 . 1 1 55 55 VAL CA C 53 60.630 60.630 59.796 0.834 17967
261 1 1 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.446 1.784 17967
262 1 1 . 1 1 55 55 VAL H H 53 8.130 8.130 8.245 -0.115 17967
263 1 1 . 1 1 56 56 TYR N N 54 124.910 124.910 126.282 -1.372 17967
264 1 1 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.282 0.118 17967
265 1 1 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.425 -0.095 17967
266 1 1 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.331 1.699 17967
267 1 1 . 1 1 56 56 TYR H H 54 8.700 8.700 8.573 0.127 17967
268 1 1 . 1 1 57 57 ARG N N 55 123.810 123.810 125.419 -1.609 17967
269 1 1 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.354 0.286 17967
270 1 1 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.679 -0.249 17967
271 1 1 . 1 1 57 57 ARG CB C 55 32.830 32.830 29.961 2.869 17967
272 1 1 . 1 1 57 57 ARG H H 55 8.870 8.870 8.436 0.434 17967
273 1 1 . 1 1 58 58 ASP N N 56 129.110 129.110 125.861 3.249 17967
274 1 1 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.256 0.054 17967
275 1 1 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.781 -0.951 17967
276 1 1 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.398 -0.267 17967
277 1 1 . 1 1 58 58 ASP H H 56 9.620 9.620 9.005 0.615 17967
278 1 1 . 1 1 59 59 GLY N N 57 104.510 104.510 106.528 -2.018 17967
279 1 1 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.071 0.559 17967
280 1 1 . 1 1 59 59 GLY H H 57 8.720 8.720 8.459 0.261 17967
281 1 1 . 1 1 60 60 ASN N N 58 122.210 122.210 118.562 3.648 17967
282 1 1 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.224 0.176 17967
283 1 1 . 1 1 60 60 ASN CA C 58 50.330 50.330 51.023 -0.693 17967
284 1 1 . 1 1 60 60 ASN CB C 58 40.430 40.430 41.194 -0.763 17967
285 1 1 . 1 1 60 60 ASN H H 58 8.120 8.120 7.865 0.255 17967
286 1 1 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.697 0.093 17967
287 1 1 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.372 -0.342 17967
288 1 1 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.236 2.294 17967
289 1 1 . 1 1 62 62 TYR N N 60 119.810 119.810 122.693 -2.883 17967
290 1 1 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.525 -0.165 17967
291 1 1 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.363 1.867 17967
292 1 1 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.361 1.069 17967
293 1 1 . 1 1 62 62 TYR H H 60 8.590 8.590 7.676 0.914 17967
294 1 1 . 1 1 63 63 ALA N N 61 123.810 123.810 122.235 1.575 17967
295 1 1 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.156 0.264 17967
296 1 1 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.596 -0.266 17967
297 1 1 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.384 -0.055 17967
298 1 1 . 1 1 63 63 ALA H H 61 8.010 8.010 8.777 -0.767 17967
299 1 1 . 1 1 64 64 VAL N N 62 120.510 120.510 117.378 3.132 17967
300 1 1 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.309 1.191 17967
301 1 1 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.139 0.090 17967
302 1 1 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.043 3.287 17967
303 1 1 . 1 1 64 64 VAL H H 62 6.380 6.380 8.473 -2.093 17967
304 1 1 . 1 1 65 65 CYS N N 63 130.310 130.310 125.413 4.897 17967
305 1 1 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.404 0.156 17967
306 1 1 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.612 -0.182 17967
307 1 1 . 1 1 65 65 CYS CB C 63 31.130 31.130 28.781 2.349 17967
308 1 1 . 1 1 65 65 CYS H H 63 9.430 9.430 8.317 1.113 17967
309 1 1 . 1 1 66 66 ASP N N 64 121.110 121.110 121.304 -0.194 17967
310 1 1 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.344 0.066 17967
311 1 1 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.354 -0.124 17967
312 1 1 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.883 1.446 17967
313 1 1 . 1 1 66 66 ASP H H 64 9.120 9.120 8.735 0.385 17967
314 1 1 . 1 1 67 67 LYS N N 65 122.110 122.110 118.772 3.338 17967
315 1 1 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.952 0.058 17967
316 1 1 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.609 1.521 17967
317 1 1 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.454 0.376 17967
318 1 1 . 1 1 67 67 LYS H H 65 8.330 8.330 7.665 0.665 17967
319 1 1 . 1 1 68 68 CYS N N 66 125.610 125.610 119.010 6.600 17967
320 1 1 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.437 -0.327 17967
321 1 1 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.114 1.416 17967
322 1 1 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.448 4.282 17967
323 1 1 . 1 1 68 68 CYS H H 66 8.700 8.700 7.572 1.128 17967
324 1 1 . 1 1 69 69 LEU N N 67 125.310 125.310 121.318 3.992 17967
325 1 1 . 1 1 69 69 LEU HA H 67 4.000 4.000 3.966 0.034 17967
326 1 1 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.846 -0.316 17967
327 1 1 . 1 1 69 69 LEU CB C 67 42.130 42.130 42.154 -0.024 17967
328 1 1 . 1 1 69 69 LEU H H 67 8.470 8.470 8.891 -0.421 17967
329 1 1 . 1 1 70 70 LYS N N 68 119.010 119.010 116.100 2.910 17967
330 1 1 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.076 -0.096 17967
331 1 1 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.441 0.389 17967
332 1 1 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.659 0.471 17967
333 1 1 . 1 1 70 70 LYS H H 68 7.810 7.810 7.363 0.447 17967
334 1 1 . 1 1 71 71 PHE N N 69 121.710 121.710 116.982 4.728 17967
335 1 1 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.292 -0.012 17967
336 1 1 . 1 1 71 71 PHE CA C 69 59.930 59.930 58.679 1.251 17967
337 1 1 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.974 0.456 17967
338 1 1 . 1 1 71 71 PHE H H 69 7.810 7.810 7.200 0.610 17967
339 1 1 . 1 1 72 72 TYR N N 70 120.110 120.110 116.144 3.966 17967
340 1 1 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.723 -0.403 17967
341 1 1 . 1 1 72 72 TYR CA C 70 60.330 60.330 58.038 2.292 17967
342 1 1 . 1 1 72 72 TYR CB C 70 40.430 40.430 37.878 2.552 17967
343 1 1 . 1 1 72 72 TYR H H 70 8.280 8.280 8.801 -0.521 17967
344 1 1 . 1 1 73 73 SER N N 71 117.210 117.210 116.731 0.479 17967
345 1 1 . 1 1 73 73 SER HA H 71 4.320 4.320 4.163 0.157 17967
346 1 1 . 1 1 73 73 SER CA C 71 60.130 60.130 60.693 -0.562 17967
347 1 1 . 1 1 73 73 SER CB C 71 63.630 63.630 62.788 0.842 17967
348 1 1 . 1 1 73 73 SER H H 71 7.870 7.870 8.059 -0.189 17967
349 1 1 . 1 1 74 74 LYS N N 72 122.810 122.810 122.772 0.038 17967
350 1 1 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.114 0.156 17967
351 1 1 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.606 -0.676 17967
352 1 1 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.473 0.157 17967
353 1 1 . 1 1 74 74 LYS H H 72 7.800 7.800 8.030 -0.230 17967
354 1 1 . 1 1 75 75 ILE N N 73 121.610 121.610 120.777 0.833 17967
355 1 1 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.108 0.002 17967
356 1 1 . 1 1 75 75 ILE CA C 73 61.830 61.830 61.644 0.186 17967
357 1 1 . 1 1 75 75 ILE CB C 73 38.630 38.630 37.532 1.098 17967
358 1 1 . 1 1 75 75 ILE H H 73 7.750 7.750 7.594 0.156 17967
359 1 1 . 1 1 76 76 SER N N 74 120.410 120.410 124.788 -4.378 17967
360 1 1 . 1 1 76 76 SER HA H 74 4.300 4.300 4.695 -0.395 17967
361 1 1 . 1 1 76 76 SER CA C 74 59.330 59.330 56.980 2.350 17967
362 1 1 . 1 1 76 76 SER CB C 74 63.830 63.830 62.900 0.930 17967
363 1 1 . 1 1 76 76 SER H H 74 8.130 8.130 8.578 -0.448 17967
364 1 1 . 1 1 77 77 GLU N N 75 123.810 123.810 122.750 1.060 17967
365 1 1 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.063 0.127 17967
366 1 1 . 1 1 77 77 GLU CA C 75 57.330 57.330 57.266 0.064 17967
367 1 1 . 1 1 77 77 GLU CB C 75 30.130 30.130 29.875 0.255 17967
368 1 1 . 1 1 77 77 GLU H H 75 8.270 8.270 8.127 0.143 17967
369 1 1 . 1 1 78 78 TYR N N 76 122.410 122.410 125.366 -2.956 17967
370 1 1 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.602 -0.142 17967
371 1 1 . 1 1 78 78 TYR CA C 76 58.130 58.130 57.794 0.336 17967
372 1 1 . 1 1 78 78 TYR CB C 76 38.630 38.630 40.779 -2.149 17967
373 1 1 . 1 1 78 78 TYR H H 76 7.980 7.980 8.707 -0.727 17967
374 1 1 . 1 1 79 79 ARG N N 77 124.710 124.710 120.610 4.100 17967
375 1 1 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.765 -0.565 17967
376 1 1 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.266 0.764 17967
377 1 1 . 1 1 79 79 ARG CB C 77 31.030 31.030 29.677 1.353 17967
378 1 1 . 1 1 79 79 ARG H H 77 7.880 7.880 8.217 -0.337 17967
379 1 1 . 1 1 80 80 HIS N N 78 122.110 122.110 117.467 4.643 17967
380 1 1 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.816 -0.306 17967
381 1 1 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.432 0.898 17967
382 1 1 . 1 1 80 80 HIS CB C 78 30.830 30.830 28.651 2.179 17967
383 1 1 . 1 1 80 80 HIS H H 78 8.120 8.120 8.582 -0.462 17967
384 1 1 . 1 1 81 81 TYR N N 79 123.610 123.610 122.932 0.678 17967
385 1 1 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.617 -0.027 17967
386 1 1 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.940 -0.110 17967
387 1 1 . 1 1 81 81 TYR CB C 79 39.130 39.130 40.401 -1.271 17967
388 1 1 . 1 1 81 81 TYR H H 79 7.970 7.970 8.296 -0.326 17967
389 1 2 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.068 0.222 17967
390 1 2 . 1 1 2 2 ALA CA C 0 52.530 52.530 53.490 -0.960 17967
391 1 2 . 1 1 2 2 ALA CB C 0 19.730 19.730 19.064 0.666 17967
392 1 2 . 1 1 3 3 MET N N 1 122.210 122.210 116.449 5.761 17967
393 1 2 . 1 1 3 3 MET HA H 1 4.300 4.300 4.473 -0.173 17967
394 1 2 . 1 1 3 3 MET CA C 1 56.030 56.030 55.195 0.835 17967
395 1 2 . 1 1 3 3 MET CB C 1 33.430 33.430 32.985 0.445 17967
396 1 2 . 1 1 3 3 MET H H 1 8.370 8.370 7.384 0.986 17967
397 1 2 . 1 1 4 4 PHE N N 2 122.310 122.310 123.348 -1.038 17967
398 1 2 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.818 -0.188 17967
399 1 2 . 1 1 4 4 PHE CA C 2 57.330 57.330 57.110 0.220 17967
400 1 2 . 1 1 4 4 PHE CB C 2 39.430 39.430 40.758 -1.328 17967
401 1 2 . 1 1 4 4 PHE H H 2 8.370 8.370 8.423 -0.053 17967
402 1 2 . 1 1 5 5 GLN N N 3 123.510 123.510 122.100 1.410 17967
403 1 2 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.427 -0.247 17967
404 1 2 . 1 1 5 5 GLN CA C 3 56.130 56.130 55.358 0.772 17967
405 1 2 . 1 1 5 5 GLN CB C 3 29.930 29.930 31.280 -1.350 17967
406 1 2 . 1 1 5 5 GLN H H 3 8.260 8.260 9.115 -0.855 17967
407 1 2 . 1 1 6 6 ASP N N 4 125.010 125.010 119.443 5.567 17967
408 1 2 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.731 0.059 17967
409 1 2 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.782 0.148 17967
410 1 2 . 1 1 6 6 ASP CB C 4 41.730 41.730 41.561 0.169 17967
411 1 2 . 1 1 6 6 ASP H H 4 8.420 8.420 8.596 -0.176 17967
412 1 2 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.436 -0.316 17967
413 1 2 . 1 1 7 7 PRO CA C 5 64.030 64.030 64.068 -0.038 17967
414 1 2 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.323 0.007 17967
415 1 2 . 1 1 8 8 GLN N N 6 119.710 119.710 118.128 1.582 17967
416 1 2 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.280 -0.120 17967
417 1 2 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.358 1.272 17967
418 1 2 . 1 1 8 8 GLN CB C 6 29.330 29.330 27.462 1.867 17967
419 1 2 . 1 1 8 8 GLN H H 6 8.430 8.430 8.073 0.357 17967
420 1 2 . 1 1 9 9 GLU N N 7 122.110 122.110 122.698 -0.588 17967
421 1 2 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.190 0.010 17967
422 1 2 . 1 1 9 9 GLU CA C 7 56.030 56.030 57.263 -1.233 17967
423 1 2 . 1 1 9 9 GLU CB C 7 30.530 30.530 30.356 0.174 17967
424 1 2 . 1 1 9 9 GLU H H 7 7.940 7.940 7.833 0.107 17967
425 1 2 . 1 1 10 10 ARG N N 8 123.410 123.410 117.913 5.497 17967
426 1 2 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.333 0.067 17967
427 1 2 . 1 1 10 10 ARG CA C 8 54.130 54.130 52.263 1.867 17967
428 1 2 . 1 1 10 10 ARG CB C 8 29.330 29.330 29.138 0.192 17967
429 1 2 . 1 1 10 10 ARG H H 8 7.660 7.660 7.463 0.197 17967
430 1 2 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.536 -0.186 17967
431 1 2 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.583 0.947 17967
432 1 2 . 1 1 11 11 PRO CB C 9 32.630 32.630 32.803 -0.173 17967
433 1 2 . 1 1 12 12 ARG N N 10 123.810 123.810 116.153 7.657 17967
434 1 2 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.640 0.030 17967
435 1 2 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.962 0.868 17967
436 1 2 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.535 0.995 17967
437 1 2 . 1 1 12 12 ARG H H 10 8.710 8.710 8.517 0.193 17967
438 1 2 . 1 1 13 13 LYS N N 11 118.410 118.410 119.333 -0.923 17967
439 1 2 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.741 0.309 17967
440 1 2 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.559 -1.229 17967
441 1 2 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.657 0.773 17967
442 1 2 . 1 1 13 13 LYS H H 11 7.800 7.800 7.694 0.106 17967
443 1 2 . 1 1 14 14 LEU N N 12 125.010 125.010 126.875 -1.865 17967
444 1 2 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.221 -0.051 17967
445 1 2 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.593 0.137 17967
446 1 2 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.736 0.794 17967
447 1 2 . 1 1 14 14 LEU H H 12 10.210 10.210 9.189 1.021 17967
448 1 2 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.247 -0.027 17967
449 1 2 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.820 1.410 17967
450 1 2 . 1 1 15 15 PRO CB C 13 30.730 30.730 30.913 -0.183 17967
451 1 2 . 1 1 16 16 GLN N N 14 117.810 117.810 117.473 0.337 17967
452 1 2 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.108 0.082 17967
453 1 2 . 1 1 16 16 GLN CA C 14 59.030 59.030 59.030 0.000 17967
454 1 2 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.217 0.413 17967
455 1 2 . 1 1 16 16 GLN H H 14 7.110 7.110 8.386 -1.276 17967
456 1 2 . 1 1 17 17 LEU N N 15 124.710 124.710 122.396 2.314 17967
457 1 2 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.017 -0.007 17967
458 1 2 . 1 1 17 17 LEU CA C 15 58.330 58.330 58.023 0.307 17967
459 1 2 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.654 0.376 17967
460 1 2 . 1 1 17 17 LEU H H 15 8.010 8.010 8.260 -0.250 17967
461 1 2 . 1 1 18 18 CYS N N 16 117.210 117.210 117.021 0.189 17967
462 1 2 . 1 1 18 18 CYS HA H 16 3.750 3.750 4.037 -0.287 17967
463 1 2 . 1 1 18 18 CYS CA C 16 64.730 64.730 64.162 0.568 17967
464 1 2 . 1 1 18 18 CYS CB C 16 26.230 26.230 26.113 0.117 17967
465 1 2 . 1 1 18 18 CYS H H 16 8.380 8.380 8.714 -0.334 17967
466 1 2 . 1 1 19 19 THR N N 17 117.810 117.810 116.353 1.457 17967
467 1 2 . 1 1 19 19 THR HA H 17 4.000 4.000 4.018 -0.018 17967
468 1 2 . 1 1 19 19 THR CA C 17 66.830 66.830 67.142 -0.312 17967
469 1 2 . 1 1 19 19 THR CB C 17 68.830 68.830 68.502 0.328 17967
470 1 2 . 1 1 19 19 THR H H 17 7.720 7.720 7.820 -0.100 17967
471 1 2 . 1 1 20 20 GLU N N 18 125.410 125.410 120.574 4.836 17967
472 1 2 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.170 -0.100 17967
473 1 2 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.995 0.735 17967
474 1 2 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.802 -0.072 17967
475 1 2 . 1 1 20 20 GLU H H 18 8.010 8.010 7.670 0.340 17967
476 1 2 . 1 1 21 21 LEU N N 19 118.810 118.810 115.448 3.362 17967
477 1 2 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.323 -0.023 17967
478 1 2 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.353 -0.523 17967
479 1 2 . 1 1 21 21 LEU CB C 19 42.330 42.330 42.009 0.321 17967
480 1 2 . 1 1 21 21 LEU H H 19 8.010 8.010 8.299 -0.289 17967
481 1 2 . 1 1 22 22 GLN N N 20 118.310 118.310 115.062 3.248 17967
482 1 2 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.029 -0.079 17967
483 1 2 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.109 -0.379 17967
484 1 2 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.003 0.127 17967
485 1 2 . 1 1 22 22 GLN H H 20 7.860 7.860 7.858 0.002 17967
486 1 2 . 1 1 23 23 THR N N 21 115.910 115.910 111.301 4.609 17967
487 1 2 . 1 1 23 23 THR HA H 21 4.950 4.950 4.617 0.333 17967
488 1 2 . 1 1 23 23 THR CA C 21 58.530 58.530 59.808 -1.278 17967
489 1 2 . 1 1 23 23 THR CB C 21 70.330 70.330 70.359 -0.029 17967
490 1 2 . 1 1 23 23 THR H H 21 8.250 8.250 8.243 0.007 17967
491 1 2 . 1 1 24 24 THR N N 22 112.810 112.810 114.368 -1.558 17967
492 1 2 . 1 1 24 24 THR HA H 22 4.880 4.880 4.624 0.256 17967
493 1 2 . 1 1 24 24 THR CA C 22 59.730 59.730 60.016 -0.286 17967
494 1 2 . 1 1 24 24 THR CB C 22 74.130 74.130 71.520 2.610 17967
495 1 2 . 1 1 24 24 THR H H 22 8.660 8.660 7.882 0.778 17967
496 1 2 . 1 1 25 25 ILE N N 23 123.710 123.710 120.105 3.605 17967
497 1 2 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.854 -0.074 17967
498 1 2 . 1 1 25 25 ILE CA C 23 63.430 63.430 63.711 -0.281 17967
499 1 2 . 1 1 25 25 ILE CB C 23 38.630 38.630 38.078 0.552 17967
500 1 2 . 1 1 25 25 ILE H H 23 9.060 9.060 8.302 0.758 17967
501 1 2 . 1 1 26 26 HIS N N 24 119.510 119.510 113.434 6.076 17967
502 1 2 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.944 -0.504 17967
503 1 2 . 1 1 26 26 HIS CA C 24 57.030 57.030 54.871 2.159 17967
504 1 2 . 1 1 26 26 HIS CB C 24 30.830 30.830 28.818 2.012 17967
505 1 2 . 1 1 26 26 HIS H H 24 7.040 7.040 7.595 -0.555 17967
506 1 2 . 1 1 27 27 ASP N N 25 116.810 116.810 117.510 -0.700 17967
507 1 2 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.701 0.059 17967
508 1 2 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.300 0.130 17967
509 1 2 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.572 0.758 17967
510 1 2 . 1 1 27 27 ASP H H 25 7.250 7.250 7.563 -0.313 17967
511 1 2 . 1 1 28 28 ILE N N 26 123.210 123.210 121.653 1.557 17967
512 1 2 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.919 0.011 17967
513 1 2 . 1 1 28 28 ILE CA C 26 63.030 63.030 63.040 -0.010 17967
514 1 2 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.762 -0.832 17967
515 1 2 . 1 1 28 28 ILE H H 26 7.750 7.750 7.927 -0.177 17967
516 1 2 . 1 1 29 29 ILE N N 27 131.110 131.110 128.834 2.276 17967
517 1 2 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.139 0.241 17967
518 1 2 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.946 -1.116 17967
519 1 2 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.111 1.519 17967
520 1 2 . 1 1 29 29 ILE H H 27 8.270 8.270 8.416 -0.146 17967
521 1 2 . 1 1 30 30 LEU N N 28 129.410 129.410 129.699 -0.289 17967
522 1 2 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.822 -0.162 17967
523 1 2 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.450 -0.920 17967
524 1 2 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.245 3.085 17967
525 1 2 . 1 1 30 30 LEU H H 28 8.500 8.500 8.103 0.397 17967
526 1 2 . 1 1 31 31 GLU N N 29 121.910 121.910 121.745 0.165 17967
527 1 2 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.727 -0.047 17967
528 1 2 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.393 0.537 17967
529 1 2 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.283 0.747 17967
530 1 2 . 1 1 31 31 GLU H H 29 8.860 8.860 8.313 0.547 17967
531 1 2 . 1 1 32 32 CYS N N 30 125.710 125.710 120.347 5.363 17967
532 1 2 . 1 1 32 32 CYS HA H 30 4.020 4.020 5.019 -0.999 17967
533 1 2 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.619 -1.389 17967
534 1 2 . 1 1 32 32 CYS CB C 30 31.730 31.730 27.076 4.654 17967
535 1 2 . 1 1 32 32 CYS H H 30 8.270 8.270 8.289 -0.019 17967
536 1 2 . 1 1 33 33 VAL N N 31 132.310 132.310 129.161 3.149 17967
537 1 2 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.077 0.023 17967
538 1 2 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.057 -0.827 17967
539 1 2 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.879 -0.249 17967
540 1 2 . 1 1 33 33 VAL H H 31 8.860 8.860 8.243 0.617 17967
541 1 2 . 1 1 34 34 TYR N N 32 124.310 124.310 114.947 9.363 17967
542 1 2 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.610 -0.170 17967
543 1 2 . 1 1 34 34 TYR CA C 32 61.030 61.030 59.327 1.704 17967
544 1 2 . 1 1 34 34 TYR CB C 32 40.130 40.130 39.066 1.065 17967
545 1 2 . 1 1 34 34 TYR H H 32 8.590 8.590 7.270 1.320 17967
546 1 2 . 1 1 35 35 CYS N N 33 119.810 119.810 116.513 3.297 17967
547 1 2 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.656 0.184 17967
548 1 2 . 1 1 35 35 CYS CA C 33 59.430 59.430 58.226 1.204 17967
549 1 2 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.093 4.136 17967
550 1 2 . 1 1 35 35 CYS H H 33 8.070 8.070 7.728 0.342 17967
551 1 2 . 1 1 36 36 LYS N N 34 119.910 119.910 116.148 3.762 17967
552 1 2 . 1 1 36 36 LYS HA H 34 4.190 4.190 4.055 0.135 17967
553 1 2 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.169 0.661 17967
554 1 2 . 1 1 36 36 LYS CB C 34 29.330 29.330 30.881 -1.551 17967
555 1 2 . 1 1 36 36 LYS H H 34 7.860 7.860 7.883 -0.023 17967
556 1 2 . 1 1 37 37 GLN N N 35 120.710 120.710 116.693 4.017 17967
557 1 2 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.309 0.051 17967
558 1 2 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.676 0.754 17967
559 1 2 . 1 1 37 37 GLN CB C 35 29.630 29.630 28.830 0.800 17967
560 1 2 . 1 1 37 37 GLN H H 35 8.270 8.270 7.808 0.462 17967
561 1 2 . 1 1 38 38 GLN N N 36 123.710 123.710 124.394 -0.684 17967
562 1 2 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.025 0.275 17967
563 1 2 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.561 0.169 17967
564 1 2 . 1 1 38 38 GLN CB C 36 29.330 29.330 29.013 0.317 17967
565 1 2 . 1 1 38 38 GLN H H 36 8.640 8.640 8.595 0.045 17967
566 1 2 . 1 1 39 39 LEU N N 37 131.310 131.310 127.885 3.425 17967
567 1 2 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.227 -0.117 17967
568 1 2 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.231 2.099 17967
569 1 2 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.585 -0.655 17967
570 1 2 . 1 1 39 39 LEU H H 37 8.870 8.870 7.917 0.953 17967
571 1 2 . 1 1 40 40 LEU N N 38 126.310 126.310 123.440 2.870 17967
572 1 2 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.329 -0.019 17967
573 1 2 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.432 -0.202 17967
574 1 2 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.435 -0.305 17967
575 1 2 . 1 1 40 40 LEU H H 38 9.850 9.850 8.293 1.557 17967
576 1 2 . 1 1 41 41 ARG N N 39 127.110 127.110 125.983 1.127 17967
577 1 2 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.732 -0.212 17967
578 1 2 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.020 -1.190 17967
579 1 2 . 1 1 41 41 ARG CB C 39 26.930 26.930 28.785 -1.855 17967
580 1 2 . 1 1 41 41 ARG H H 39 8.970 8.970 8.813 0.157 17967
581 1 2 . 1 1 42 42 ARG N N 40 115.810 115.810 118.808 -2.998 17967
582 1 2 . 1 1 42 42 ARG HA H 40 4.080 4.080 3.923 0.157 17967
583 1 2 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.751 -0.621 17967
584 1 2 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.554 -0.224 17967
585 1 2 . 1 1 42 42 ARG H H 40 8.610 8.610 8.363 0.247 17967
586 1 2 . 1 1 43 43 GLU N N 41 119.910 119.910 118.675 1.235 17967
587 1 2 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.556 -0.306 17967
588 1 2 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.162 0.868 17967
589 1 2 . 1 1 43 43 GLU CB C 41 30.330 30.330 28.984 1.346 17967
590 1 2 . 1 1 43 43 GLU H H 41 6.950 6.950 7.939 -0.989 17967
591 1 2 . 1 1 44 44 VAL N N 42 125.010 125.010 119.887 5.123 17967
592 1 2 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.738 -0.498 17967
593 1 2 . 1 1 44 44 VAL CA C 42 67.630 67.630 65.383 2.247 17967
594 1 2 . 1 1 44 44 VAL CB C 42 31.330 31.330 30.931 0.399 17967
595 1 2 . 1 1 44 44 VAL H H 42 7.820 7.820 7.922 -0.102 17967
596 1 2 . 1 1 45 45 TYR N N 43 118.410 118.410 119.700 -1.290 17967
597 1 2 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.228 0.202 17967
598 1 2 . 1 1 45 45 TYR CA C 43 58.830 58.830 59.063 -0.233 17967
599 1 2 . 1 1 45 45 TYR CB C 43 36.730 36.730 36.847 -0.117 17967
600 1 2 . 1 1 45 45 TYR H H 43 7.820 7.820 8.396 -0.576 17967
601 1 2 . 1 1 46 46 ASP N N 44 122.410 122.410 120.239 2.171 17967
602 1 2 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.328 0.272 17967
603 1 2 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.620 0.210 17967
604 1 2 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.147 0.883 17967
605 1 2 . 1 1 46 46 ASP H H 44 8.540 8.540 8.144 0.396 17967
606 1 2 . 1 1 47 47 PHE N N 45 126.210 126.210 119.414 6.796 17967
607 1 2 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.128 -0.218 17967
608 1 2 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.964 0.666 17967
609 1 2 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.158 0.172 17967
610 1 2 . 1 1 47 47 PHE H H 45 8.320 8.320 7.748 0.572 17967
611 1 2 . 1 1 48 48 ALA N N 46 119.110 119.110 119.129 -0.019 17967
612 1 2 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.339 0.181 17967
613 1 2 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.751 0.479 17967
614 1 2 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.604 0.126 17967
615 1 2 . 1 1 48 48 ALA H H 46 7.740 7.740 7.815 -0.075 17967
616 1 2 . 1 1 49 49 ARG N N 47 124.010 124.010 118.196 5.814 17967
617 1 2 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.304 -0.254 17967
618 1 2 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.212 2.417 17967
619 1 2 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.550 -0.120 17967
620 1 2 . 1 1 49 49 ARG H H 47 8.500 8.500 8.343 0.157 17967
621 1 2 . 1 1 50 50 ARG N N 48 119.110 119.110 118.263 0.847 17967
622 1 2 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.527 -0.517 17967
623 1 2 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.786 2.344 17967
624 1 2 . 1 1 50 50 ARG CB C 48 31.130 31.130 31.847 -0.717 17967
625 1 2 . 1 1 50 50 ARG H H 48 7.940 7.940 7.847 0.093 17967
626 1 2 . 1 1 51 51 ASP N N 49 120.910 120.910 119.836 1.074 17967
627 1 2 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.782 -0.362 17967
628 1 2 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.738 0.792 17967
629 1 2 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.417 -0.487 17967
630 1 2 . 1 1 51 51 ASP H H 49 7.950 7.950 8.418 -0.468 17967
631 1 2 . 1 1 52 52 LEU N N 50 118.410 118.410 122.873 -4.463 17967
632 1 2 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.515 -0.365 17967
633 1 2 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.370 0.860 17967
634 1 2 . 1 1 52 52 LEU CB C 50 41.130 41.130 43.992 -2.861 17967
635 1 2 . 1 1 52 52 LEU H H 50 6.640 6.640 7.555 -0.915 17967
636 1 2 . 1 1 53 53 CYS N N 51 117.410 117.410 116.953 0.457 17967
637 1 2 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.225 -0.295 17967
638 1 2 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.565 2.365 17967
639 1 2 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.771 -2.141 17967
640 1 2 . 1 1 53 53 CYS H H 51 8.030 8.030 8.061 -0.031 17967
641 1 2 . 1 1 54 54 ILE N N 52 125.110 125.110 123.799 1.311 17967
642 1 2 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.321 -0.311 17967
643 1 2 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.780 -2.150 17967
644 1 2 . 1 1 54 54 ILE CB C 52 37.330 37.330 39.155 -1.825 17967
645 1 2 . 1 1 54 54 ILE H H 52 8.500 8.500 8.985 -0.485 17967
646 1 2 . 1 1 55 55 VAL N N 53 127.010 127.010 122.217 4.793 17967
647 1 2 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.548 -0.178 17967
648 1 2 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.152 0.478 17967
649 1 2 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.124 2.106 17967
650 1 2 . 1 1 55 55 VAL H H 53 8.130 8.130 7.980 0.150 17967
651 1 2 . 1 1 56 56 TYR N N 54 124.910 124.910 126.507 -1.597 17967
652 1 2 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.231 0.169 17967
653 1 2 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.614 -0.284 17967
654 1 2 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.481 1.549 17967
655 1 2 . 1 1 56 56 TYR H H 54 8.700 8.700 8.573 0.127 17967
656 1 2 . 1 1 57 57 ARG N N 55 123.810 123.810 125.377 -1.567 17967
657 1 2 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.455 0.185 17967
658 1 2 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.489 -0.059 17967
659 1 2 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.739 2.091 17967
660 1 2 . 1 1 57 57 ARG H H 55 8.870 8.870 8.414 0.456 17967
661 1 2 . 1 1 58 58 ASP N N 56 129.110 129.110 125.367 3.743 17967
662 1 2 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.306 0.004 17967
663 1 2 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.600 -0.770 17967
664 1 2 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.155 -0.025 17967
665 1 2 . 1 1 58 58 ASP H H 56 9.620 9.620 9.175 0.445 17967
666 1 2 . 1 1 59 59 GLY N N 57 104.510 104.510 107.707 -3.197 17967
667 1 2 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.215 0.415 17967
668 1 2 . 1 1 59 59 GLY H H 57 8.720 8.720 8.395 0.325 17967
669 1 2 . 1 1 60 60 ASN N N 58 122.210 122.210 119.045 3.165 17967
670 1 2 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.207 0.193 17967
671 1 2 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.739 -0.409 17967
672 1 2 . 1 1 60 60 ASN CB C 58 40.430 40.430 41.202 -0.772 17967
673 1 2 . 1 1 60 60 ASN H H 58 8.120 8.120 7.929 0.191 17967
674 1 2 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.615 0.175 17967
675 1 2 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.527 -0.497 17967
676 1 2 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.394 2.136 17967
677 1 2 . 1 1 62 62 TYR N N 60 119.810 119.810 122.213 -2.403 17967
678 1 2 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.538 -0.178 17967
679 1 2 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.459 1.771 17967
680 1 2 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.581 0.849 17967
681 1 2 . 1 1 62 62 TYR H H 60 8.590 8.590 7.636 0.954 17967
682 1 2 . 1 1 63 63 ALA N N 61 123.810 123.810 121.301 2.509 17967
683 1 2 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.255 0.165 17967
684 1 2 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.198 0.132 17967
685 1 2 . 1 1 63 63 ALA CB C 61 20.330 20.330 21.022 -0.692 17967
686 1 2 . 1 1 63 63 ALA H H 61 8.010 8.010 8.936 -0.926 17967
687 1 2 . 1 1 64 64 VAL N N 62 120.510 120.510 118.623 1.887 17967
688 1 2 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.257 1.243 17967
689 1 2 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.402 -0.172 17967
690 1 2 . 1 1 64 64 VAL CB C 62 36.330 36.330 31.901 4.428 17967
691 1 2 . 1 1 64 64 VAL H H 62 6.380 6.380 8.491 -2.111 17967
692 1 2 . 1 1 65 65 CYS N N 63 130.310 130.310 125.780 4.530 17967
693 1 2 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.385 0.175 17967
694 1 2 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.611 -0.181 17967
695 1 2 . 1 1 65 65 CYS CB C 63 31.130 31.130 28.712 2.417 17967
696 1 2 . 1 1 65 65 CYS H H 63 9.430 9.430 8.117 1.313 17967
697 1 2 . 1 1 66 66 ASP N N 64 121.110 121.110 120.828 0.282 17967
698 1 2 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.210 0.200 17967
699 1 2 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.274 -0.044 17967
700 1 2 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.943 1.387 17967
701 1 2 . 1 1 66 66 ASP H H 64 9.120 9.120 8.759 0.361 17967
702 1 2 . 1 1 67 67 LYS N N 65 122.110 122.110 119.265 2.845 17967
703 1 2 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.765 0.245 17967
704 1 2 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.909 1.221 17967
705 1 2 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.305 0.525 17967
706 1 2 . 1 1 67 67 LYS H H 65 8.330 8.330 7.793 0.537 17967
707 1 2 . 1 1 68 68 CYS N N 66 125.610 125.610 118.573 7.037 17967
708 1 2 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.365 -0.255 17967
709 1 2 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.195 1.335 17967
710 1 2 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.442 4.288 17967
711 1 2 . 1 1 68 68 CYS H H 66 8.700 8.700 7.543 1.157 17967
712 1 2 . 1 1 69 69 LEU N N 67 125.310 125.310 121.932 3.378 17967
713 1 2 . 1 1 69 69 LEU HA H 67 4.000 4.000 3.894 0.106 17967
714 1 2 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.727 -0.197 17967
715 1 2 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.320 0.810 17967
716 1 2 . 1 1 69 69 LEU H H 67 8.470 8.470 8.819 -0.349 17967
717 1 2 . 1 1 70 70 LYS N N 68 119.010 119.010 118.767 0.243 17967
718 1 2 . 1 1 70 70 LYS HA H 68 3.980 3.980 3.997 -0.017 17967
719 1 2 . 1 1 70 70 LYS CA C 68 58.830 58.830 59.088 -0.258 17967
720 1 2 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.723 0.407 17967
721 1 2 . 1 1 70 70 LYS H H 68 7.810 7.810 7.494 0.316 17967
722 1 2 . 1 1 71 71 PHE N N 69 121.710 121.710 118.353 3.357 17967
723 1 2 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.170 0.110 17967
724 1 2 . 1 1 71 71 PHE CA C 69 59.930 59.930 58.650 1.280 17967
725 1 2 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.352 1.078 17967
726 1 2 . 1 1 71 71 PHE H H 69 7.810 7.810 7.066 0.744 17967
727 1 2 . 1 1 72 72 TYR N N 70 120.110 120.110 117.042 3.068 17967
728 1 2 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.437 -0.117 17967
729 1 2 . 1 1 72 72 TYR CA C 70 60.330 60.330 59.531 0.799 17967
730 1 2 . 1 1 72 72 TYR CB C 70 40.430 40.430 37.300 3.130 17967
731 1 2 . 1 1 72 72 TYR H H 70 8.280 8.280 8.768 -0.488 17967
732 1 2 . 1 1 73 73 SER N N 71 117.210 117.210 114.906 2.304 17967
733 1 2 . 1 1 73 73 SER HA H 71 4.320 4.320 4.349 -0.029 17967
734 1 2 . 1 1 73 73 SER CA C 71 60.130 60.130 60.705 -0.575 17967
735 1 2 . 1 1 73 73 SER CB C 71 63.630 63.630 63.348 0.282 17967
736 1 2 . 1 1 73 73 SER H H 71 7.870 7.870 8.055 -0.185 17967
737 1 2 . 1 1 74 74 LYS N N 72 122.810 122.810 120.936 1.874 17967
738 1 2 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.272 -0.002 17967
739 1 2 . 1 1 74 74 LYS CA C 72 56.930 56.930 56.924 0.006 17967
740 1 2 . 1 1 74 74 LYS CB C 72 32.630 32.630 33.157 -0.527 17967
741 1 2 . 1 1 74 74 LYS H H 72 7.800 7.800 7.462 0.338 17967
742 1 2 . 1 1 75 75 ILE N N 73 121.610 121.610 120.274 1.336 17967
743 1 2 . 1 1 75 75 ILE HA H 73 4.110 4.110 3.927 0.183 17967
744 1 2 . 1 1 75 75 ILE CA C 73 61.830 61.830 62.169 -0.339 17967
745 1 2 . 1 1 75 75 ILE CB C 73 38.630 38.630 36.482 2.148 17967
746 1 2 . 1 1 75 75 ILE H H 73 7.750 7.750 7.568 0.182 17967
747 1 2 . 1 1 76 76 SER N N 74 120.410 120.410 119.942 0.468 17967
748 1 2 . 1 1 76 76 SER HA H 74 4.300 4.300 4.837 -0.537 17967
749 1 2 . 1 1 76 76 SER CA C 74 59.330 59.330 58.752 0.578 17967
750 1 2 . 1 1 76 76 SER CB C 74 63.830 63.830 65.810 -1.980 17967
751 1 2 . 1 1 76 76 SER H H 74 8.130 8.130 8.239 -0.109 17967
752 1 2 . 1 1 77 77 GLU N N 75 123.810 123.810 123.063 0.747 17967
753 1 2 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.608 -0.418 17967
754 1 2 . 1 1 77 77 GLU CA C 75 57.330 57.330 55.734 1.596 17967
755 1 2 . 1 1 77 77 GLU CB C 75 30.130 30.130 28.892 1.238 17967
756 1 2 . 1 1 77 77 GLU H H 75 8.270 8.270 8.635 -0.365 17967
757 1 2 . 1 1 78 78 TYR N N 76 122.410 122.410 123.302 -0.892 17967
758 1 2 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.676 -0.216 17967
759 1 2 . 1 1 78 78 TYR CA C 76 58.130 58.130 58.338 -0.208 17967
760 1 2 . 1 1 78 78 TYR CB C 76 38.630 38.630 41.912 -3.282 17967
761 1 2 . 1 1 78 78 TYR H H 76 7.980 7.980 7.817 0.163 17967
762 1 2 . 1 1 79 79 ARG N N 77 124.710 124.710 122.210 2.500 17967
763 1 2 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.953 -0.753 17967
764 1 2 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.765 0.265 17967
765 1 2 . 1 1 79 79 ARG CB C 77 31.030 31.030 29.290 1.740 17967
766 1 2 . 1 1 79 79 ARG H H 77 7.880 7.880 8.230 -0.350 17967
767 1 2 . 1 1 80 80 HIS N N 78 122.110 122.110 117.646 4.464 17967
768 1 2 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.603 -0.093 17967
769 1 2 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.392 0.938 17967
770 1 2 . 1 1 80 80 HIS CB C 78 30.830 30.830 29.909 0.921 17967
771 1 2 . 1 1 80 80 HIS H H 78 8.120 8.120 8.785 -0.665 17967
772 1 2 . 1 1 81 81 TYR N N 79 123.610 123.610 120.810 2.800 17967
773 1 2 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.426 0.164 17967
774 1 2 . 1 1 81 81 TYR CA C 79 57.830 57.830 58.372 -0.542 17967
775 1 2 . 1 1 81 81 TYR CB C 79 39.130 39.130 39.292 -0.162 17967
776 1 2 . 1 1 81 81 TYR H H 79 7.970 7.970 7.928 0.042 17967
777 1 3 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.019 0.271 17967
778 1 3 . 1 1 2 2 ALA CA C 0 52.530 52.530 53.418 -0.888 17967
779 1 3 . 1 1 2 2 ALA CB C 0 19.730 19.730 19.634 0.096 17967
780 1 3 . 1 1 3 3 MET N N 1 122.210 122.210 117.994 4.216 17967
781 1 3 . 1 1 3 3 MET HA H 1 4.300 4.300 4.602 -0.302 17967
782 1 3 . 1 1 3 3 MET CA C 1 56.030 56.030 54.498 1.532 17967
783 1 3 . 1 1 3 3 MET CB C 1 33.430 33.430 33.170 0.260 17967
784 1 3 . 1 1 3 3 MET H H 1 8.370 8.370 7.434 0.936 17967
785 1 3 . 1 1 4 4 PHE N N 2 122.310 122.310 126.426 -4.116 17967
786 1 3 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.677 -0.047 17967
787 1 3 . 1 1 4 4 PHE CA C 2 57.330 57.330 56.296 1.034 17967
788 1 3 . 1 1 4 4 PHE CB C 2 39.430 39.430 40.686 -1.256 17967
789 1 3 . 1 1 4 4 PHE H H 2 8.370 8.370 8.550 -0.180 17967
790 1 3 . 1 1 5 5 GLN N N 3 123.510 123.510 122.867 0.643 17967
791 1 3 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.600 -0.420 17967
792 1 3 . 1 1 5 5 GLN CA C 3 56.130 56.130 53.891 2.239 17967
793 1 3 . 1 1 5 5 GLN CB C 3 29.930 29.930 30.043 -0.113 17967
794 1 3 . 1 1 5 5 GLN H H 3 8.260 8.260 8.709 -0.449 17967
795 1 3 . 1 1 6 6 ASP N N 4 125.010 125.010 118.999 6.011 17967
796 1 3 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.718 0.072 17967
797 1 3 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.538 0.392 17967
798 1 3 . 1 1 6 6 ASP CB C 4 41.730 41.730 41.550 0.180 17967
799 1 3 . 1 1 6 6 ASP H H 4 8.420 8.420 8.463 -0.043 17967
800 1 3 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.524 -0.404 17967
801 1 3 . 1 1 7 7 PRO CA C 5 64.030 64.030 63.120 0.910 17967
802 1 3 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.135 0.195 17967
803 1 3 . 1 1 8 8 GLN N N 6 119.710 119.710 121.116 -1.406 17967
804 1 3 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.123 0.037 17967
805 1 3 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.477 1.153 17967
806 1 3 . 1 1 8 8 GLN CB C 6 29.330 29.330 26.624 2.706 17967
807 1 3 . 1 1 8 8 GLN H H 6 8.430 8.430 7.675 0.755 17967
808 1 3 . 1 1 9 9 GLU N N 7 122.110 122.110 121.244 0.866 17967
809 1 3 . 1 1 9 9 GLU HA H 7 4.200 4.200 3.963 0.237 17967
810 1 3 . 1 1 9 9 GLU CA C 7 56.030 56.030 57.330 -1.300 17967
811 1 3 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.549 0.981 17967
812 1 3 . 1 1 9 9 GLU H H 7 7.940 7.940 8.087 -0.147 17967
813 1 3 . 1 1 10 10 ARG N N 8 123.410 123.410 115.512 7.898 17967
814 1 3 . 1 1 10 10 ARG HA H 8 4.400 4.400 3.938 0.462 17967
815 1 3 . 1 1 10 10 ARG CA C 8 54.130 54.130 56.059 -1.929 17967
816 1 3 . 1 1 10 10 ARG CB C 8 29.330 29.330 27.783 1.547 17967
817 1 3 . 1 1 10 10 ARG H H 8 7.660 7.660 7.916 -0.256 17967
818 1 3 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.626 -0.276 17967
819 1 3 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.796 0.734 17967
820 1 3 . 1 1 11 11 PRO CB C 9 32.630 32.630 32.917 -0.287 17967
821 1 3 . 1 1 12 12 ARG N N 10 123.810 123.810 116.652 7.158 17967
822 1 3 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.755 -0.085 17967
823 1 3 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.754 1.076 17967
824 1 3 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.850 0.680 17967
825 1 3 . 1 1 12 12 ARG H H 10 8.710 8.710 8.720 -0.010 17967
826 1 3 . 1 1 13 13 LYS N N 11 118.410 118.410 119.552 -1.142 17967
827 1 3 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.809 0.241 17967
828 1 3 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.351 -1.021 17967
829 1 3 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.206 1.224 17967
830 1 3 . 1 1 13 13 LYS H H 11 7.800 7.800 7.680 0.120 17967
831 1 3 . 1 1 14 14 LEU N N 12 125.010 125.010 125.994 -0.984 17967
832 1 3 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.197 -0.027 17967
833 1 3 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.372 0.358 17967
834 1 3 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.897 0.633 17967
835 1 3 . 1 1 14 14 LEU H H 12 10.210 10.210 9.168 1.042 17967
836 1 3 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.279 -0.059 17967
837 1 3 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.685 1.545 17967
838 1 3 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.033 -0.303 17967
839 1 3 . 1 1 16 16 GLN N N 14 117.810 117.810 117.296 0.514 17967
840 1 3 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.131 0.059 17967
841 1 3 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.993 0.037 17967
842 1 3 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.165 0.465 17967
843 1 3 . 1 1 16 16 GLN H H 14 7.110 7.110 8.470 -1.360 17967
844 1 3 . 1 1 17 17 LEU N N 15 124.710 124.710 122.389 2.321 17967
845 1 3 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.195 -0.185 17967
846 1 3 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.891 0.439 17967
847 1 3 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.779 0.251 17967
848 1 3 . 1 1 17 17 LEU H H 15 8.010 8.010 8.021 -0.011 17967
849 1 3 . 1 1 18 18 CYS N N 16 117.210 117.210 117.332 -0.122 17967
850 1 3 . 1 1 18 18 CYS HA H 16 3.750 3.750 4.009 -0.259 17967
851 1 3 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.969 0.761 17967
852 1 3 . 1 1 18 18 CYS CB C 16 26.230 26.230 26.006 0.224 17967
853 1 3 . 1 1 18 18 CYS H H 16 8.380 8.380 8.582 -0.202 17967
854 1 3 . 1 1 19 19 THR N N 17 117.810 117.810 115.576 2.234 17967
855 1 3 . 1 1 19 19 THR HA H 17 4.000 4.000 4.046 -0.046 17967
856 1 3 . 1 1 19 19 THR CA C 17 66.830 66.830 67.069 -0.239 17967
857 1 3 . 1 1 19 19 THR CB C 17 68.830 68.830 68.625 0.205 17967
858 1 3 . 1 1 19 19 THR H H 17 7.720 7.720 7.878 -0.158 17967
859 1 3 . 1 1 20 20 GLU N N 18 125.410 125.410 120.362 5.048 17967
860 1 3 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.196 -0.126 17967
861 1 3 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.772 0.958 17967
862 1 3 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.315 0.415 17967
863 1 3 . 1 1 20 20 GLU H H 18 8.010 8.010 7.429 0.581 17967
864 1 3 . 1 1 21 21 LEU N N 19 118.810 118.810 117.471 1.339 17967
865 1 3 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.344 -0.044 17967
866 1 3 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.149 -0.319 17967
867 1 3 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.521 0.809 17967
868 1 3 . 1 1 21 21 LEU H H 19 8.010 8.010 8.121 -0.111 17967
869 1 3 . 1 1 22 22 GLN N N 20 118.310 118.310 114.621 3.689 17967
870 1 3 . 1 1 22 22 GLN HA H 20 3.950 3.950 3.995 -0.045 17967
871 1 3 . 1 1 22 22 GLN CA C 20 56.730 56.730 56.998 -0.268 17967
872 1 3 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.253 -0.123 17967
873 1 3 . 1 1 22 22 GLN H H 20 7.860 7.860 7.606 0.254 17967
874 1 3 . 1 1 23 23 THR N N 21 115.910 115.910 111.313 4.597 17967
875 1 3 . 1 1 23 23 THR HA H 21 4.950 4.950 4.611 0.339 17967
876 1 3 . 1 1 23 23 THR CA C 21 58.530 58.530 60.198 -1.668 17967
877 1 3 . 1 1 23 23 THR CB C 21 70.330 70.330 71.430 -1.099 17967
878 1 3 . 1 1 23 23 THR H H 21 8.250 8.250 8.205 0.045 17967
879 1 3 . 1 1 24 24 THR N N 22 112.810 112.810 115.073 -2.263 17967
880 1 3 . 1 1 24 24 THR HA H 22 4.880 4.880 4.635 0.245 17967
881 1 3 . 1 1 24 24 THR CA C 22 59.730 59.730 59.631 0.099 17967
882 1 3 . 1 1 24 24 THR CB C 22 74.130 74.130 71.572 2.558 17967
883 1 3 . 1 1 24 24 THR H H 22 8.660 8.660 7.818 0.842 17967
884 1 3 . 1 1 25 25 ILE N N 23 123.710 123.710 120.513 3.197 17967
885 1 3 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.658 0.122 17967
886 1 3 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.135 -0.705 17967
887 1 3 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.883 0.747 17967
888 1 3 . 1 1 25 25 ILE H H 23 9.060 9.060 8.329 0.731 17967
889 1 3 . 1 1 26 26 HIS N N 24 119.510 119.510 113.664 5.846 17967
890 1 3 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.662 -0.222 17967
891 1 3 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.864 1.166 17967
892 1 3 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.140 1.690 17967
893 1 3 . 1 1 26 26 HIS H H 24 7.040 7.040 7.527 -0.487 17967
894 1 3 . 1 1 27 27 ASP N N 25 116.810 116.810 118.324 -1.514 17967
895 1 3 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.649 0.111 17967
896 1 3 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.088 0.342 17967
897 1 3 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.092 1.238 17967
898 1 3 . 1 1 27 27 ASP H H 25 7.250 7.250 7.615 -0.365 17967
899 1 3 . 1 1 28 28 ILE N N 26 123.210 123.210 121.749 1.461 17967
900 1 3 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.925 0.005 17967
901 1 3 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.324 0.706 17967
902 1 3 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.852 -0.923 17967
903 1 3 . 1 1 28 28 ILE H H 26 7.750 7.750 7.712 0.038 17967
904 1 3 . 1 1 29 29 ILE N N 27 131.110 131.110 129.028 2.082 17967
905 1 3 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.108 0.272 17967
906 1 3 . 1 1 29 29 ILE CA C 27 58.830 58.830 60.019 -1.189 17967
907 1 3 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.665 0.965 17967
908 1 3 . 1 1 29 29 ILE H H 27 8.270 8.270 8.254 0.016 17967
909 1 3 . 1 1 30 30 LEU N N 28 129.410 129.410 128.918 0.492 17967
910 1 3 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.788 -0.128 17967
911 1 3 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.243 -0.713 17967
912 1 3 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.399 2.931 17967
913 1 3 . 1 1 30 30 LEU H H 28 8.500 8.500 8.360 0.140 17967
914 1 3 . 1 1 31 31 GLU N N 29 121.910 121.910 121.033 0.877 17967
915 1 3 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.734 -0.054 17967
916 1 3 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.358 0.572 17967
917 1 3 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.401 0.629 17967
918 1 3 . 1 1 31 31 GLU H H 29 8.860 8.860 8.283 0.577 17967
919 1 3 . 1 1 32 32 CYS N N 30 125.710 125.710 120.372 5.338 17967
920 1 3 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.884 -0.864 17967
921 1 3 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.399 -1.169 17967
922 1 3 . 1 1 32 32 CYS CB C 30 31.730 31.730 27.010 4.720 17967
923 1 3 . 1 1 32 32 CYS H H 30 8.270 8.270 8.503 -0.233 17967
924 1 3 . 1 1 33 33 VAL N N 31 132.310 132.310 128.442 3.868 17967
925 1 3 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.053 0.047 17967
926 1 3 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.526 -1.296 17967
927 1 3 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.930 -0.300 17967
928 1 3 . 1 1 33 33 VAL H H 31 8.860 8.860 8.029 0.831 17967
929 1 3 . 1 1 34 34 TYR N N 32 124.310 124.310 115.612 8.698 17967
930 1 3 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.514 -0.074 17967
931 1 3 . 1 1 34 34 TYR CA C 32 61.030 61.030 59.606 1.423 17967
932 1 3 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.458 1.672 17967
933 1 3 . 1 1 34 34 TYR H H 32 8.590 8.590 7.304 1.286 17967
934 1 3 . 1 1 35 35 CYS N N 33 119.810 119.810 115.259 4.551 17967
935 1 3 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.696 0.144 17967
936 1 3 . 1 1 35 35 CYS CA C 33 59.430 59.430 58.876 0.554 17967
937 1 3 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.765 3.465 17967
938 1 3 . 1 1 35 35 CYS H H 33 8.070 8.070 7.659 0.411 17967
939 1 3 . 1 1 36 36 LYS N N 34 119.910 119.910 116.475 3.435 17967
940 1 3 . 1 1 36 36 LYS HA H 34 4.190 4.190 4.007 0.183 17967
941 1 3 . 1 1 36 36 LYS CA C 34 57.830 57.830 56.515 1.315 17967
942 1 3 . 1 1 36 36 LYS CB C 34 29.330 29.330 30.175 -0.845 17967
943 1 3 . 1 1 36 36 LYS H H 34 7.860 7.860 7.815 0.045 17967
944 1 3 . 1 1 37 37 GLN N N 35 120.710 120.710 117.791 2.919 17967
945 1 3 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.395 -0.035 17967
946 1 3 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.302 1.128 17967
947 1 3 . 1 1 37 37 GLN CB C 35 29.630 29.630 29.232 0.398 17967
948 1 3 . 1 1 37 37 GLN H H 35 8.270 8.270 7.850 0.420 17967
949 1 3 . 1 1 38 38 GLN N N 36 123.710 123.710 127.498 -3.788 17967
950 1 3 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.032 0.268 17967
951 1 3 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.582 0.148 17967
952 1 3 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.831 0.499 17967
953 1 3 . 1 1 38 38 GLN H H 36 8.640 8.640 8.688 -0.048 17967
954 1 3 . 1 1 39 39 LEU N N 37 131.310 131.310 128.321 2.989 17967
955 1 3 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.185 -0.075 17967
956 1 3 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.367 1.963 17967
957 1 3 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.376 -0.446 17967
958 1 3 . 1 1 39 39 LEU H H 37 8.870 8.870 7.835 1.035 17967
959 1 3 . 1 1 40 40 LEU N N 38 126.310 126.310 124.970 1.340 17967
960 1 3 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.253 0.057 17967
961 1 3 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.762 -0.532 17967
962 1 3 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.146 -0.016 17967
963 1 3 . 1 1 40 40 LEU H H 38 9.850 9.850 8.334 1.516 17967
964 1 3 . 1 1 41 41 ARG N N 39 127.110 127.110 125.680 1.430 17967
965 1 3 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.699 -0.179 17967
966 1 3 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.726 -1.896 17967
967 1 3 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.882 -2.952 17967
968 1 3 . 1 1 41 41 ARG H H 39 8.970 8.970 8.817 0.153 17967
969 1 3 . 1 1 42 42 ARG N N 40 115.810 115.810 118.292 -2.482 17967
970 1 3 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.263 -0.183 17967
971 1 3 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.722 -0.592 17967
972 1 3 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.847 -0.517 17967
973 1 3 . 1 1 42 42 ARG H H 40 8.610 8.610 8.666 -0.056 17967
974 1 3 . 1 1 43 43 GLU N N 41 119.910 119.910 117.531 2.379 17967
975 1 3 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.374 -0.124 17967
976 1 3 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.188 0.842 17967
977 1 3 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.185 1.145 17967
978 1 3 . 1 1 43 43 GLU H H 41 6.950 6.950 7.993 -1.043 17967
979 1 3 . 1 1 44 44 VAL N N 42 125.010 125.010 120.483 4.527 17967
980 1 3 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.571 -0.331 17967
981 1 3 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.072 1.558 17967
982 1 3 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.550 -0.220 17967
983 1 3 . 1 1 44 44 VAL H H 42 7.820 7.820 7.856 -0.036 17967
984 1 3 . 1 1 45 45 TYR N N 43 118.410 118.410 118.624 -0.214 17967
985 1 3 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.196 0.234 17967
986 1 3 . 1 1 45 45 TYR CA C 43 58.830 58.830 60.651 -1.821 17967
987 1 3 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.342 -0.612 17967
988 1 3 . 1 1 45 45 TYR H H 43 7.820 7.820 8.044 -0.224 17967
989 1 3 . 1 1 46 46 ASP N N 44 122.410 122.410 120.154 2.256 17967
990 1 3 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.352 0.248 17967
991 1 3 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.958 -0.128 17967
992 1 3 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.338 0.692 17967
993 1 3 . 1 1 46 46 ASP H H 44 8.540 8.540 7.921 0.619 17967
994 1 3 . 1 1 47 47 PHE N N 45 126.210 126.210 118.948 7.262 17967
995 1 3 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.236 -0.326 17967
996 1 3 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.565 1.065 17967
997 1 3 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.373 -0.043 17967
998 1 3 . 1 1 47 47 PHE H H 45 8.320 8.320 7.678 0.642 17967
999 1 3 . 1 1 48 48 ALA N N 46 119.110 119.110 120.004 -0.894 17967
1000 1 3 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.399 0.121 17967
1001 1 3 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.718 0.512 17967
1002 1 3 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.790 -0.060 17967
1003 1 3 . 1 1 48 48 ALA H H 46 7.740 7.740 7.880 -0.140 17967
1004 1 3 . 1 1 49 49 ARG N N 47 124.010 124.010 117.459 6.551 17967
1005 1 3 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.211 -0.161 17967
1006 1 3 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.774 1.856 17967
1007 1 3 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.755 -0.325 17967
1008 1 3 . 1 1 49 49 ARG H H 47 8.500 8.500 8.487 0.013 17967
1009 1 3 . 1 1 50 50 ARG N N 48 119.110 119.110 117.898 1.212 17967
1010 1 3 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.519 -0.509 17967
1011 1 3 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.774 2.356 17967
1012 1 3 . 1 1 50 50 ARG CB C 48 31.130 31.130 32.362 -1.232 17967
1013 1 3 . 1 1 50 50 ARG H H 48 7.940 7.940 7.517 0.423 17967
1014 1 3 . 1 1 51 51 ASP N N 49 120.910 120.910 119.589 1.321 17967
1015 1 3 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.822 -0.402 17967
1016 1 3 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.779 0.751 17967
1017 1 3 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.781 -0.851 17967
1018 1 3 . 1 1 51 51 ASP H H 49 7.950 7.950 8.397 -0.447 17967
1019 1 3 . 1 1 52 52 LEU N N 50 118.410 118.410 122.558 -4.148 17967
1020 1 3 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.485 -0.335 17967
1021 1 3 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.189 1.041 17967
1022 1 3 . 1 1 52 52 LEU CB C 50 41.130 41.130 43.667 -2.538 17967
1023 1 3 . 1 1 52 52 LEU H H 50 6.640 6.640 7.604 -0.964 17967
1024 1 3 . 1 1 53 53 CYS N N 51 117.410 117.410 116.803 0.607 17967
1025 1 3 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.347 -0.417 17967
1026 1 3 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.379 2.551 17967
1027 1 3 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.217 -1.587 17967
1028 1 3 . 1 1 53 53 CYS H H 51 8.030 8.030 8.012 0.018 17967
1029 1 3 . 1 1 54 54 ILE N N 52 125.110 125.110 123.194 1.916 17967
1030 1 3 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.267 -0.257 17967
1031 1 3 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.899 -2.269 17967
1032 1 3 . 1 1 54 54 ILE CB C 52 37.330 37.330 39.149 -1.819 17967
1033 1 3 . 1 1 54 54 ILE H H 52 8.500 8.500 8.871 -0.371 17967
1034 1 3 . 1 1 55 55 VAL N N 53 127.010 127.010 124.200 2.810 17967
1035 1 3 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.608 -0.238 17967
1036 1 3 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.766 -0.136 17967
1037 1 3 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.205 2.025 17967
1038 1 3 . 1 1 55 55 VAL H H 53 8.130 8.130 8.096 0.034 17967
1039 1 3 . 1 1 56 56 TYR N N 54 124.910 124.910 127.039 -2.129 17967
1040 1 3 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.280 0.120 17967
1041 1 3 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.628 -0.298 17967
1042 1 3 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.730 1.300 17967
1043 1 3 . 1 1 56 56 TYR H H 54 8.700 8.700 8.575 0.125 17967
1044 1 3 . 1 1 57 57 ARG N N 55 123.810 123.810 125.198 -1.388 17967
1045 1 3 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.412 0.228 17967
1046 1 3 . 1 1 57 57 ARG CA C 55 55.430 55.430 56.038 -0.608 17967
1047 1 3 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.175 2.655 17967
1048 1 3 . 1 1 57 57 ARG H H 55 8.870 8.870 8.476 0.394 17967
1049 1 3 . 1 1 58 58 ASP N N 56 129.110 129.110 124.310 4.800 17967
1050 1 3 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.325 -0.015 17967
1051 1 3 . 1 1 58 58 ASP CA C 56 55.830 55.830 57.060 -1.230 17967
1052 1 3 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.071 0.059 17967
1053 1 3 . 1 1 58 58 ASP H H 56 9.620 9.620 8.916 0.704 17967
1054 1 3 . 1 1 59 59 GLY N N 57 104.510 104.510 107.559 -3.049 17967
1055 1 3 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.106 0.524 17967
1056 1 3 . 1 1 59 59 GLY H H 57 8.720 8.720 8.323 0.397 17967
1057 1 3 . 1 1 60 60 ASN N N 58 122.210 122.210 119.582 2.628 17967
1058 1 3 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.211 0.189 17967
1059 1 3 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.734 -0.404 17967
1060 1 3 . 1 1 60 60 ASN CB C 58 40.430 40.430 40.782 -0.352 17967
1061 1 3 . 1 1 60 60 ASN H H 58 8.120 8.120 7.937 0.183 17967
1062 1 3 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.676 0.114 17967
1063 1 3 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.450 -0.420 17967
1064 1 3 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.412 2.119 17967
1065 1 3 . 1 1 62 62 TYR N N 60 119.810 119.810 122.339 -2.529 17967
1066 1 3 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.538 -0.178 17967
1067 1 3 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.417 1.813 17967
1068 1 3 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.545 0.885 17967
1069 1 3 . 1 1 62 62 TYR H H 60 8.590 8.590 7.654 0.936 17967
1070 1 3 . 1 1 63 63 ALA N N 61 123.810 123.810 121.757 2.053 17967
1071 1 3 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.200 0.220 17967
1072 1 3 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.413 -0.083 17967
1073 1 3 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.720 -0.390 17967
1074 1 3 . 1 1 63 63 ALA H H 61 8.010 8.010 8.868 -0.858 17967
1075 1 3 . 1 1 64 64 VAL N N 62 120.510 120.510 118.187 2.323 17967
1076 1 3 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.312 1.188 17967
1077 1 3 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.253 -0.023 17967
1078 1 3 . 1 1 64 64 VAL CB C 62 36.330 36.330 32.383 3.947 17967
1079 1 3 . 1 1 64 64 VAL H H 62 6.380 6.380 8.470 -2.090 17967
1080 1 3 . 1 1 65 65 CYS N N 63 130.310 130.310 125.587 4.723 17967
1081 1 3 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.341 0.219 17967
1082 1 3 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.795 -0.366 17967
1083 1 3 . 1 1 65 65 CYS CB C 63 31.130 31.130 28.547 2.583 17967
1084 1 3 . 1 1 65 65 CYS H H 63 9.430 9.430 8.256 1.174 17967
1085 1 3 . 1 1 66 66 ASP N N 64 121.110 121.110 121.089 0.021 17967
1086 1 3 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.235 0.175 17967
1087 1 3 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.254 -0.024 17967
1088 1 3 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.924 1.406 17967
1089 1 3 . 1 1 66 66 ASP H H 64 9.120 9.120 8.854 0.266 17967
1090 1 3 . 1 1 67 67 LYS N N 65 122.110 122.110 119.081 3.029 17967
1091 1 3 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.754 0.256 17967
1092 1 3 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.828 1.302 17967
1093 1 3 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.192 0.638 17967
1094 1 3 . 1 1 67 67 LYS H H 65 8.330 8.330 7.847 0.483 17967
1095 1 3 . 1 1 68 68 CYS N N 66 125.610 125.610 119.298 6.312 17967
1096 1 3 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.325 -0.215 17967
1097 1 3 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.908 0.622 17967
1098 1 3 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.397 4.333 17967
1099 1 3 . 1 1 68 68 CYS H H 66 8.700 8.700 7.688 1.012 17967
1100 1 3 . 1 1 69 69 LEU N N 67 125.310 125.310 120.948 4.362 17967
1101 1 3 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.000 0.000 17967
1102 1 3 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.431 0.099 17967
1103 1 3 . 1 1 69 69 LEU CB C 67 42.130 42.130 42.129 0.001 17967
1104 1 3 . 1 1 69 69 LEU H H 67 8.470 8.470 8.838 -0.368 17967
1105 1 3 . 1 1 70 70 LYS N N 68 119.010 119.010 119.131 -0.121 17967
1106 1 3 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.026 -0.046 17967
1107 1 3 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.875 -0.045 17967
1108 1 3 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.724 0.406 17967
1109 1 3 . 1 1 70 70 LYS H H 68 7.810 7.810 6.951 0.859 17967
1110 1 3 . 1 1 71 71 PHE N N 69 121.710 121.710 118.182 3.528 17967
1111 1 3 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.076 0.204 17967
1112 1 3 . 1 1 71 71 PHE CA C 69 59.930 59.930 60.193 -0.263 17967
1113 1 3 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.264 1.165 17967
1114 1 3 . 1 1 71 71 PHE H H 69 7.810 7.810 7.496 0.314 17967
1115 1 3 . 1 1 72 72 TYR N N 70 120.110 120.110 115.836 4.274 17967
1116 1 3 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.772 -0.452 17967
1117 1 3 . 1 1 72 72 TYR CA C 70 60.330 60.330 56.791 3.539 17967
1118 1 3 . 1 1 72 72 TYR CB C 70 40.430 40.430 36.726 3.704 17967
1119 1 3 . 1 1 72 72 TYR H H 70 8.280 8.280 8.717 -0.437 17967
1120 1 3 . 1 1 73 73 SER N N 71 117.210 117.210 116.576 0.634 17967
1121 1 3 . 1 1 73 73 SER HA H 71 4.320 4.320 4.246 0.074 17967
1122 1 3 . 1 1 73 73 SER CA C 71 60.130 60.130 61.243 -1.113 17967
1123 1 3 . 1 1 73 73 SER CB C 71 63.630 63.630 63.243 0.387 17967
1124 1 3 . 1 1 73 73 SER H H 71 7.870 7.870 7.838 0.032 17967
1125 1 3 . 1 1 74 74 LYS N N 72 122.810 122.810 122.469 0.341 17967
1126 1 3 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.139 0.131 17967
1127 1 3 . 1 1 74 74 LYS CA C 72 56.930 56.930 58.238 -1.308 17967
1128 1 3 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.154 0.476 17967
1129 1 3 . 1 1 74 74 LYS H H 72 7.800 7.800 8.362 -0.562 17967
1130 1 3 . 1 1 75 75 ILE N N 73 121.610 121.610 118.602 3.008 17967
1131 1 3 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.383 -0.273 17967
1132 1 3 . 1 1 75 75 ILE CA C 73 61.830 61.830 61.707 0.123 17967
1133 1 3 . 1 1 75 75 ILE CB C 73 38.630 38.630 37.829 0.801 17967
1134 1 3 . 1 1 75 75 ILE H H 73 7.750 7.750 7.697 0.053 17967
1135 1 3 . 1 1 76 76 SER N N 74 120.410 120.410 117.334 3.076 17967
1136 1 3 . 1 1 76 76 SER HA H 74 4.300 4.300 4.273 0.027 17967
1137 1 3 . 1 1 76 76 SER CA C 74 59.330 59.330 61.164 -1.834 17967
1138 1 3 . 1 1 76 76 SER CB C 74 63.830 63.830 63.424 0.406 17967
1139 1 3 . 1 1 76 76 SER H H 74 8.130 8.130 7.696 0.434 17967
1140 1 3 . 1 1 77 77 GLU N N 75 123.810 123.810 120.866 2.944 17967
1141 1 3 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.586 -0.396 17967
1142 1 3 . 1 1 77 77 GLU CA C 75 57.330 57.330 55.731 1.599 17967
1143 1 3 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.990 -0.860 17967
1144 1 3 . 1 1 77 77 GLU H H 75 8.270 8.270 8.214 0.056 17967
1145 1 3 . 1 1 78 78 TYR N N 76 122.410 122.410 125.813 -3.403 17967
1146 1 3 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.925 -0.465 17967
1147 1 3 . 1 1 78 78 TYR CA C 76 58.130 58.130 57.296 0.834 17967
1148 1 3 . 1 1 78 78 TYR CB C 76 38.630 38.630 39.115 -0.485 17967
1149 1 3 . 1 1 78 78 TYR H H 76 7.980 7.980 8.565 -0.585 17967
1150 1 3 . 1 1 79 79 ARG N N 77 124.710 124.710 125.148 -0.438 17967
1151 1 3 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.516 -0.316 17967
1152 1 3 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.384 0.646 17967
1153 1 3 . 1 1 79 79 ARG CB C 77 31.030 31.030 31.520 -0.490 17967
1154 1 3 . 1 1 79 79 ARG H H 77 7.880 7.880 8.756 -0.876 17967
1155 1 3 . 1 1 80 80 HIS N N 78 122.110 122.110 117.885 4.225 17967
1156 1 3 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.823 -0.313 17967
1157 1 3 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.800 0.530 17967
1158 1 3 . 1 1 80 80 HIS CB C 78 30.830 30.830 28.221 2.609 17967
1159 1 3 . 1 1 80 80 HIS H H 78 8.120 8.120 8.123 -0.003 17967
1160 1 3 . 1 1 81 81 TYR N N 79 123.610 123.610 124.954 -1.344 17967
1161 1 3 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.698 -0.108 17967
1162 1 3 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.346 0.485 17967
1163 1 3 . 1 1 81 81 TYR CB C 79 39.130 39.130 41.478 -2.348 17967
1164 1 3 . 1 1 81 81 TYR H H 79 7.970 7.970 8.109 -0.139 17967
1165 1 4 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.227 0.063 17967
1166 1 4 . 1 1 2 2 ALA CA C 0 52.530 52.530 52.567 -0.037 17967
1167 1 4 . 1 1 2 2 ALA CB C 0 19.730 19.730 18.606 1.124 17967
1168 1 4 . 1 1 3 3 MET N N 1 122.210 122.210 125.110 -2.900 17967
1169 1 4 . 1 1 3 3 MET HA H 1 4.300 4.300 4.978 -0.678 17967
1170 1 4 . 1 1 3 3 MET CA C 1 56.030 56.030 54.016 2.014 17967
1171 1 4 . 1 1 3 3 MET CB C 1 33.430 33.430 33.266 0.164 17967
1172 1 4 . 1 1 3 3 MET H H 1 8.370 8.370 7.956 0.414 17967
1173 1 4 . 1 1 4 4 PHE N N 2 122.310 122.310 126.016 -3.706 17967
1174 1 4 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.737 -0.107 17967
1175 1 4 . 1 1 4 4 PHE CA C 2 57.330 57.330 55.431 1.899 17967
1176 1 4 . 1 1 4 4 PHE CB C 2 39.430 39.430 41.057 -1.627 17967
1177 1 4 . 1 1 4 4 PHE H H 2 8.370 8.370 8.546 -0.176 17967
1178 1 4 . 1 1 5 5 GLN N N 3 123.510 123.510 125.483 -1.973 17967
1179 1 4 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.532 -0.352 17967
1180 1 4 . 1 1 5 5 GLN CA C 3 56.130 56.130 53.263 2.867 17967
1181 1 4 . 1 1 5 5 GLN CB C 3 29.930 29.930 31.186 -1.256 17967
1182 1 4 . 1 1 5 5 GLN H H 3 8.260 8.260 8.421 -0.161 17967
1183 1 4 . 1 1 6 6 ASP N N 4 125.010 125.010 118.117 6.893 17967
1184 1 4 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.611 0.179 17967
1185 1 4 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.833 0.097 17967
1186 1 4 . 1 1 6 6 ASP CB C 4 41.730 41.730 40.767 0.963 17967
1187 1 4 . 1 1 6 6 ASP H H 4 8.420 8.420 8.345 0.075 17967
1188 1 4 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.235 -0.115 17967
1189 1 4 . 1 1 7 7 PRO CA C 5 64.030 64.030 63.764 0.266 17967
1190 1 4 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.102 0.228 17967
1191 1 4 . 1 1 8 8 GLN N N 6 119.710 119.710 119.479 0.231 17967
1192 1 4 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.006 0.154 17967
1193 1 4 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.239 1.391 17967
1194 1 4 . 1 1 8 8 GLN CB C 6 29.330 29.330 25.715 3.615 17967
1195 1 4 . 1 1 8 8 GLN H H 6 8.430 8.430 7.872 0.558 17967
1196 1 4 . 1 1 9 9 GLU N N 7 122.110 122.110 121.696 0.414 17967
1197 1 4 . 1 1 9 9 GLU HA H 7 4.200 4.200 3.741 0.459 17967
1198 1 4 . 1 1 9 9 GLU CA C 7 56.030 56.030 58.709 -2.679 17967
1199 1 4 . 1 1 9 9 GLU CB C 7 30.530 30.530 30.040 0.490 17967
1200 1 4 . 1 1 9 9 GLU H H 7 7.940 7.940 8.444 -0.504 17967
1201 1 4 . 1 1 10 10 ARG N N 8 123.410 123.410 114.783 8.627 17967
1202 1 4 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.235 0.165 17967
1203 1 4 . 1 1 10 10 ARG CA C 8 54.130 54.130 55.675 -1.545 17967
1204 1 4 . 1 1 10 10 ARG CB C 8 29.330 29.330 28.593 0.737 17967
1205 1 4 . 1 1 10 10 ARG H H 8 7.660 7.660 7.639 0.021 17967
1206 1 4 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.741 -0.391 17967
1207 1 4 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.765 0.765 17967
1208 1 4 . 1 1 11 11 PRO CB C 9 32.630 32.630 32.920 -0.290 17967
1209 1 4 . 1 1 12 12 ARG N N 10 123.810 123.810 116.568 7.242 17967
1210 1 4 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.756 -0.086 17967
1211 1 4 . 1 1 12 12 ARG CA C 10 56.830 56.830 56.414 0.416 17967
1212 1 4 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.727 0.803 17967
1213 1 4 . 1 1 12 12 ARG H H 10 8.710 8.710 8.790 -0.080 17967
1214 1 4 . 1 1 13 13 LYS N N 11 118.410 118.410 119.518 -1.108 17967
1215 1 4 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.809 0.241 17967
1216 1 4 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.453 -1.123 17967
1217 1 4 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.855 0.575 17967
1218 1 4 . 1 1 13 13 LYS H H 11 7.800 7.800 7.703 0.097 17967
1219 1 4 . 1 1 14 14 LEU N N 12 125.010 125.010 125.974 -0.964 17967
1220 1 4 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.141 0.029 17967
1221 1 4 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.246 0.484 17967
1222 1 4 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.922 0.608 17967
1223 1 4 . 1 1 14 14 LEU H H 12 10.210 10.210 9.173 1.037 17967
1224 1 4 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.276 -0.056 17967
1225 1 4 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.610 1.620 17967
1226 1 4 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.038 -0.308 17967
1227 1 4 . 1 1 16 16 GLN N N 14 117.810 117.810 117.234 0.576 17967
1228 1 4 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.166 0.024 17967
1229 1 4 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.734 0.296 17967
1230 1 4 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.181 0.449 17967
1231 1 4 . 1 1 16 16 GLN H H 14 7.110 7.110 8.492 -1.382 17967
1232 1 4 . 1 1 17 17 LEU N N 15 124.710 124.710 122.831 1.879 17967
1233 1 4 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.177 -0.167 17967
1234 1 4 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.884 0.446 17967
1235 1 4 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.684 0.346 17967
1236 1 4 . 1 1 17 17 LEU H H 15 8.010 8.010 8.186 -0.176 17967
1237 1 4 . 1 1 18 18 CYS N N 16 117.210 117.210 117.257 -0.047 17967
1238 1 4 . 1 1 18 18 CYS HA H 16 3.750 3.750 3.971 -0.221 17967
1239 1 4 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.560 1.170 17967
1240 1 4 . 1 1 18 18 CYS CB C 16 26.230 26.230 25.844 0.386 17967
1241 1 4 . 1 1 18 18 CYS H H 16 8.380 8.380 8.503 -0.123 17967
1242 1 4 . 1 1 19 19 THR N N 17 117.810 117.810 117.050 0.760 17967
1243 1 4 . 1 1 19 19 THR HA H 17 4.000 4.000 3.942 0.058 17967
1244 1 4 . 1 1 19 19 THR CA C 17 66.830 66.830 67.095 -0.265 17967
1245 1 4 . 1 1 19 19 THR CB C 17 68.830 68.830 68.689 0.141 17967
1246 1 4 . 1 1 19 19 THR H H 17 7.720 7.720 7.964 -0.244 17967
1247 1 4 . 1 1 20 20 GLU N N 18 125.410 125.410 121.056 4.354 17967
1248 1 4 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.141 -0.071 17967
1249 1 4 . 1 1 20 20 GLU CA C 18 59.730 59.730 59.130 0.600 17967
1250 1 4 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.699 0.031 17967
1251 1 4 . 1 1 20 20 GLU H H 18 8.010 8.010 7.650 0.360 17967
1252 1 4 . 1 1 21 21 LEU N N 19 118.810 118.810 116.558 2.252 17967
1253 1 4 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.223 0.077 17967
1254 1 4 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.228 -0.398 17967
1255 1 4 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.925 0.405 17967
1256 1 4 . 1 1 21 21 LEU H H 19 8.010 8.010 8.037 -0.027 17967
1257 1 4 . 1 1 22 22 GLN N N 20 118.310 118.310 115.723 2.587 17967
1258 1 4 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.024 -0.074 17967
1259 1 4 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.071 -0.341 17967
1260 1 4 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.096 0.034 17967
1261 1 4 . 1 1 22 22 GLN H H 20 7.860 7.860 7.911 -0.051 17967
1262 1 4 . 1 1 23 23 THR N N 21 115.910 115.910 111.350 4.560 17967
1263 1 4 . 1 1 23 23 THR HA H 21 4.950 4.950 4.606 0.344 17967
1264 1 4 . 1 1 23 23 THR CA C 21 58.530 58.530 59.606 -1.076 17967
1265 1 4 . 1 1 23 23 THR CB C 21 70.330 70.330 70.242 0.088 17967
1266 1 4 . 1 1 23 23 THR H H 21 8.250 8.250 8.165 0.085 17967
1267 1 4 . 1 1 24 24 THR N N 22 112.810 112.810 114.084 -1.274 17967
1268 1 4 . 1 1 24 24 THR HA H 22 4.880 4.880 4.557 0.323 17967
1269 1 4 . 1 1 24 24 THR CA C 22 59.730 59.730 60.404 -0.674 17967
1270 1 4 . 1 1 24 24 THR CB C 22 74.130 74.130 71.095 3.035 17967
1271 1 4 . 1 1 24 24 THR H H 22 8.660 8.660 7.880 0.780 17967
1272 1 4 . 1 1 25 25 ILE N N 23 123.710 123.710 120.759 2.951 17967
1273 1 4 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.697 0.083 17967
1274 1 4 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.322 -0.892 17967
1275 1 4 . 1 1 25 25 ILE CB C 23 38.630 38.630 38.000 0.630 17967
1276 1 4 . 1 1 25 25 ILE H H 23 9.060 9.060 8.198 0.862 17967
1277 1 4 . 1 1 26 26 HIS N N 24 119.510 119.510 113.531 5.979 17967
1278 1 4 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.502 -0.062 17967
1279 1 4 . 1 1 26 26 HIS CA C 24 57.030 57.030 56.078 0.952 17967
1280 1 4 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.325 1.505 17967
1281 1 4 . 1 1 26 26 HIS H H 24 7.040 7.040 7.611 -0.571 17967
1282 1 4 . 1 1 27 27 ASP N N 25 116.810 116.810 118.346 -1.536 17967
1283 1 4 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.603 0.157 17967
1284 1 4 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.119 0.311 17967
1285 1 4 . 1 1 27 27 ASP CB C 25 44.330 44.330 42.834 1.496 17967
1286 1 4 . 1 1 27 27 ASP H H 25 7.250 7.250 7.680 -0.430 17967
1287 1 4 . 1 1 28 28 ILE N N 26 123.210 123.210 121.947 1.263 17967
1288 1 4 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.833 0.097 17967
1289 1 4 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.443 0.587 17967
1290 1 4 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.543 -0.613 17967
1291 1 4 . 1 1 28 28 ILE H H 26 7.750 7.750 7.725 0.025 17967
1292 1 4 . 1 1 29 29 ILE N N 27 131.110 131.110 129.339 1.771 17967
1293 1 4 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.028 0.352 17967
1294 1 4 . 1 1 29 29 ILE CA C 27 58.830 58.830 60.023 -1.192 17967
1295 1 4 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.483 1.147 17967
1296 1 4 . 1 1 29 29 ILE H H 27 8.270 8.270 8.272 -0.002 17967
1297 1 4 . 1 1 30 30 LEU N N 28 129.410 129.410 128.674 0.736 17967
1298 1 4 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.569 0.091 17967
1299 1 4 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.078 -0.548 17967
1300 1 4 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.562 2.768 17967
1301 1 4 . 1 1 30 30 LEU H H 28 8.500 8.500 8.288 0.212 17967
1302 1 4 . 1 1 31 31 GLU N N 29 121.910 121.910 120.995 0.915 17967
1303 1 4 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.826 -0.146 17967
1304 1 4 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.366 0.564 17967
1305 1 4 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.524 0.506 17967
1306 1 4 . 1 1 31 31 GLU H H 29 8.860 8.860 8.223 0.637 17967
1307 1 4 . 1 1 32 32 CYS N N 30 125.710 125.710 119.877 5.833 17967
1308 1 4 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.952 -0.932 17967
1309 1 4 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.608 -1.378 17967
1310 1 4 . 1 1 32 32 CYS CB C 30 31.730 31.730 27.467 4.263 17967
1311 1 4 . 1 1 32 32 CYS H H 30 8.270 8.270 8.586 -0.316 17967
1312 1 4 . 1 1 33 33 VAL N N 31 132.310 132.310 127.924 4.386 17967
1313 1 4 . 1 1 33 33 VAL HA H 31 3.100 3.100 2.863 0.237 17967
1314 1 4 . 1 1 33 33 VAL CA C 31 64.230 64.230 64.829 -0.599 17967
1315 1 4 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.953 -0.323 17967
1316 1 4 . 1 1 33 33 VAL H H 31 8.860 8.860 7.995 0.865 17967
1317 1 4 . 1 1 34 34 TYR N N 32 124.310 124.310 116.406 7.904 17967
1318 1 4 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.611 -0.171 17967
1319 1 4 . 1 1 34 34 TYR CA C 32 61.030 61.030 59.762 1.268 17967
1320 1 4 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.004 2.126 17967
1321 1 4 . 1 1 34 34 TYR H H 32 8.590 8.590 7.258 1.332 17967
1322 1 4 . 1 1 35 35 CYS N N 33 119.810 119.810 115.104 4.706 17967
1323 1 4 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.606 0.234 17967
1324 1 4 . 1 1 35 35 CYS CA C 33 59.430 59.430 58.484 0.946 17967
1325 1 4 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.083 4.147 17967
1326 1 4 . 1 1 35 35 CYS H H 33 8.070 8.070 7.713 0.357 17967
1327 1 4 . 1 1 36 36 LYS N N 34 119.910 119.910 116.132 3.778 17967
1328 1 4 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.954 0.236 17967
1329 1 4 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.134 0.696 17967
1330 1 4 . 1 1 36 36 LYS CB C 34 29.330 29.330 29.613 -0.282 17967
1331 1 4 . 1 1 36 36 LYS H H 34 7.860 7.860 7.923 -0.063 17967
1332 1 4 . 1 1 37 37 GLN N N 35 120.710 120.710 114.520 6.190 17967
1333 1 4 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.494 -0.134 17967
1334 1 4 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.157 1.273 17967
1335 1 4 . 1 1 37 37 GLN CB C 35 29.630 29.630 30.072 -0.442 17967
1336 1 4 . 1 1 37 37 GLN H H 35 8.270 8.270 7.738 0.532 17967
1337 1 4 . 1 1 38 38 GLN N N 36 123.710 123.710 122.576 1.134 17967
1338 1 4 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.300 0.000 17967
1339 1 4 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.141 0.589 17967
1340 1 4 . 1 1 38 38 GLN CB C 36 29.330 29.330 29.184 0.146 17967
1341 1 4 . 1 1 38 38 GLN H H 36 8.640 8.640 8.518 0.122 17967
1342 1 4 . 1 1 39 39 LEU N N 37 131.310 131.310 125.266 6.044 17967
1343 1 4 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.308 -0.198 17967
1344 1 4 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.492 1.837 17967
1345 1 4 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.345 -0.415 17967
1346 1 4 . 1 1 39 39 LEU H H 37 8.870 8.870 8.163 0.707 17967
1347 1 4 . 1 1 40 40 LEU N N 38 126.310 126.310 124.905 1.405 17967
1348 1 4 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.315 -0.005 17967
1349 1 4 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.644 -0.414 17967
1350 1 4 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.233 -0.103 17967
1351 1 4 . 1 1 40 40 LEU H H 38 9.850 9.850 9.529 0.321 17967
1352 1 4 . 1 1 41 41 ARG N N 39 127.110 127.110 125.245 1.865 17967
1353 1 4 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.715 -0.195 17967
1354 1 4 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.527 -1.697 17967
1355 1 4 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.570 -2.640 17967
1356 1 4 . 1 1 41 41 ARG H H 39 8.970 8.970 8.880 0.090 17967
1357 1 4 . 1 1 42 42 ARG N N 40 115.810 115.810 117.679 -1.869 17967
1358 1 4 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.271 -0.191 17967
1359 1 4 . 1 1 42 42 ARG CA C 40 59.130 59.130 58.979 0.151 17967
1360 1 4 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.357 -0.027 17967
1361 1 4 . 1 1 42 42 ARG H H 40 8.610 8.610 8.585 0.025 17967
1362 1 4 . 1 1 43 43 GLU N N 41 119.910 119.910 119.718 0.192 17967
1363 1 4 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.605 -0.355 17967
1364 1 4 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.929 0.101 17967
1365 1 4 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.517 0.813 17967
1366 1 4 . 1 1 43 43 GLU H H 41 6.950 6.950 7.998 -1.048 17967
1367 1 4 . 1 1 44 44 VAL N N 42 125.010 125.010 120.150 4.860 17967
1368 1 4 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.658 -0.418 17967
1369 1 4 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.330 1.300 17967
1370 1 4 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.329 0.001 17967
1371 1 4 . 1 1 44 44 VAL H H 42 7.820 7.820 7.779 0.041 17967
1372 1 4 . 1 1 45 45 TYR N N 43 118.410 118.410 118.986 -0.576 17967
1373 1 4 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.143 0.287 17967
1374 1 4 . 1 1 45 45 TYR CA C 43 58.830 58.830 60.804 -1.974 17967
1375 1 4 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.201 -0.471 17967
1376 1 4 . 1 1 45 45 TYR H H 43 7.820 7.820 7.947 -0.127 17967
1377 1 4 . 1 1 46 46 ASP N N 44 122.410 122.410 120.068 2.342 17967
1378 1 4 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.303 0.297 17967
1379 1 4 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.678 0.152 17967
1380 1 4 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.298 0.732 17967
1381 1 4 . 1 1 46 46 ASP H H 44 8.540 8.540 7.905 0.635 17967
1382 1 4 . 1 1 47 47 PHE N N 45 126.210 126.210 119.261 6.949 17967
1383 1 4 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.114 -0.204 17967
1384 1 4 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.827 0.803 17967
1385 1 4 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.124 0.206 17967
1386 1 4 . 1 1 47 47 PHE H H 45 8.320 8.320 7.812 0.508 17967
1387 1 4 . 1 1 48 48 ALA N N 46 119.110 119.110 118.108 1.002 17967
1388 1 4 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.366 0.154 17967
1389 1 4 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.447 0.783 17967
1390 1 4 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.804 -0.074 17967
1391 1 4 . 1 1 48 48 ALA H H 46 7.740 7.740 7.717 0.023 17967
1392 1 4 . 1 1 49 49 ARG N N 47 124.010 124.010 117.389 6.621 17967
1393 1 4 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.349 -0.299 17967
1394 1 4 . 1 1 49 49 ARG CA C 47 59.630 59.630 56.654 2.976 17967
1395 1 4 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.265 0.165 17967
1396 1 4 . 1 1 49 49 ARG H H 47 8.500 8.500 8.142 0.358 17967
1397 1 4 . 1 1 50 50 ARG N N 48 119.110 119.110 118.610 0.500 17967
1398 1 4 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.584 -0.574 17967
1399 1 4 . 1 1 50 50 ARG CA C 48 57.130 57.130 55.127 2.003 17967
1400 1 4 . 1 1 50 50 ARG CB C 48 31.130 31.130 32.049 -0.919 17967
1401 1 4 . 1 1 50 50 ARG H H 48 7.940 7.940 7.681 0.259 17967
1402 1 4 . 1 1 51 51 ASP N N 49 120.910 120.910 118.020 2.890 17967
1403 1 4 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.661 -0.241 17967
1404 1 4 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.405 1.125 17967
1405 1 4 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.659 -0.729 17967
1406 1 4 . 1 1 51 51 ASP H H 49 7.950 7.950 8.366 -0.416 17967
1407 1 4 . 1 1 52 52 LEU N N 50 118.410 118.410 121.058 -2.648 17967
1408 1 4 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.203 -0.053 17967
1409 1 4 . 1 1 52 52 LEU CA C 50 54.230 54.230 55.702 -1.472 17967
1410 1 4 . 1 1 52 52 LEU CB C 50 41.130 41.130 41.947 -0.817 17967
1411 1 4 . 1 1 52 52 LEU H H 50 6.640 6.640 7.222 -0.582 17967
1412 1 4 . 1 1 53 53 CYS N N 51 117.410 117.410 116.689 0.721 17967
1413 1 4 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.187 -0.257 17967
1414 1 4 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.343 2.587 17967
1415 1 4 . 1 1 53 53 CYS CB C 51 28.630 28.630 31.141 -2.511 17967
1416 1 4 . 1 1 53 53 CYS H H 51 8.030 8.030 8.390 -0.360 17967
1417 1 4 . 1 1 54 54 ILE N N 52 125.110 125.110 121.999 3.111 17967
1418 1 4 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.365 -0.355 17967
1419 1 4 . 1 1 54 54 ILE CA C 52 59.630 59.630 62.161 -2.531 17967
1420 1 4 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.697 -1.367 17967
1421 1 4 . 1 1 54 54 ILE H H 52 8.500 8.500 8.817 -0.317 17967
1422 1 4 . 1 1 55 55 VAL N N 53 127.010 127.010 122.641 4.369 17967
1423 1 4 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.614 -0.244 17967
1424 1 4 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.721 -0.091 17967
1425 1 4 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.798 1.432 17967
1426 1 4 . 1 1 55 55 VAL H H 53 8.130 8.130 8.155 -0.025 17967
1427 1 4 . 1 1 56 56 TYR N N 54 124.910 124.910 127.094 -2.184 17967
1428 1 4 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.341 0.059 17967
1429 1 4 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.178 0.152 17967
1430 1 4 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.442 1.588 17967
1431 1 4 . 1 1 56 56 TYR H H 54 8.700 8.700 8.925 -0.225 17967
1432 1 4 . 1 1 57 57 ARG N N 55 123.810 123.810 126.108 -2.298 17967
1433 1 4 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.356 0.284 17967
1434 1 4 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.985 -0.555 17967
1435 1 4 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.175 2.655 17967
1436 1 4 . 1 1 57 57 ARG H H 55 8.870 8.870 8.579 0.291 17967
1437 1 4 . 1 1 58 58 ASP N N 56 129.110 129.110 125.171 3.939 17967
1438 1 4 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.318 -0.008 17967
1439 1 4 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.643 -0.813 17967
1440 1 4 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.519 -0.389 17967
1441 1 4 . 1 1 58 58 ASP H H 56 9.620 9.620 8.899 0.721 17967
1442 1 4 . 1 1 59 59 GLY N N 57 104.510 104.510 107.265 -2.755 17967
1443 1 4 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.436 0.194 17967
1444 1 4 . 1 1 59 59 GLY H H 57 8.720 8.720 8.532 0.188 17967
1445 1 4 . 1 1 60 60 ASN N N 58 122.210 122.210 119.123 3.087 17967
1446 1 4 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.338 0.062 17967
1447 1 4 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.506 -0.176 17967
1448 1 4 . 1 1 60 60 ASN CB C 58 40.430 40.430 41.452 -1.022 17967
1449 1 4 . 1 1 60 60 ASN H H 58 8.120 8.120 7.964 0.156 17967
1450 1 4 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.653 0.137 17967
1451 1 4 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.474 -0.444 17967
1452 1 4 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.225 2.305 17967
1453 1 4 . 1 1 62 62 TYR N N 60 119.810 119.810 123.060 -3.250 17967
1454 1 4 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.600 -0.240 17967
1455 1 4 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.323 1.907 17967
1456 1 4 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.482 0.948 17967
1457 1 4 . 1 1 62 62 TYR H H 60 8.590 8.590 7.726 0.864 17967
1458 1 4 . 1 1 63 63 ALA N N 61 123.810 123.810 122.038 1.772 17967
1459 1 4 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.116 0.304 17967
1460 1 4 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.416 -0.086 17967
1461 1 4 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.629 -0.299 17967
1462 1 4 . 1 1 63 63 ALA H H 61 8.010 8.010 8.750 -0.740 17967
1463 1 4 . 1 1 64 64 VAL N N 62 120.510 120.510 117.979 2.531 17967
1464 1 4 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.258 1.242 17967
1465 1 4 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.627 -0.397 17967
1466 1 4 . 1 1 64 64 VAL CB C 62 36.330 36.330 32.943 3.387 17967
1467 1 4 . 1 1 64 64 VAL H H 62 6.380 6.380 8.391 -2.011 17967
1468 1 4 . 1 1 65 65 CYS N N 63 130.310 130.310 125.563 4.747 17967
1469 1 4 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.333 0.227 17967
1470 1 4 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.826 -0.396 17967
1471 1 4 . 1 1 65 65 CYS CB C 63 31.130 31.130 29.293 1.837 17967
1472 1 4 . 1 1 65 65 CYS H H 63 9.430 9.430 8.137 1.293 17967
1473 1 4 . 1 1 66 66 ASP N N 64 121.110 121.110 121.557 -0.447 17967
1474 1 4 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.251 0.159 17967
1475 1 4 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.049 0.181 17967
1476 1 4 . 1 1 66 66 ASP CB C 64 42.330 42.330 41.107 1.223 17967
1477 1 4 . 1 1 66 66 ASP H H 64 9.120 9.120 8.596 0.524 17967
1478 1 4 . 1 1 67 67 LYS N N 65 122.110 122.110 119.240 2.870 17967
1479 1 4 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.772 0.238 17967
1480 1 4 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.921 1.209 17967
1481 1 4 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.288 0.543 17967
1482 1 4 . 1 1 67 67 LYS H H 65 8.330 8.330 7.803 0.527 17967
1483 1 4 . 1 1 68 68 CYS N N 66 125.610 125.610 118.243 7.367 17967
1484 1 4 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.340 -0.230 17967
1485 1 4 . 1 1 68 68 CYS CA C 66 63.530 63.530 61.937 1.593 17967
1486 1 4 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.278 4.452 17967
1487 1 4 . 1 1 68 68 CYS H H 66 8.700 8.700 7.508 1.192 17967
1488 1 4 . 1 1 69 69 LEU N N 67 125.310 125.310 120.755 4.555 17967
1489 1 4 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.073 -0.073 17967
1490 1 4 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.061 0.469 17967
1491 1 4 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.342 0.789 17967
1492 1 4 . 1 1 69 69 LEU H H 67 8.470 8.470 8.569 -0.099 17967
1493 1 4 . 1 1 70 70 LYS N N 68 119.010 119.010 118.305 0.705 17967
1494 1 4 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.166 -0.186 17967
1495 1 4 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.627 0.203 17967
1496 1 4 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.922 0.208 17967
1497 1 4 . 1 1 70 70 LYS H H 68 7.810 7.810 7.310 0.500 17967
1498 1 4 . 1 1 71 71 PHE N N 69 121.710 121.710 117.815 3.895 17967
1499 1 4 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.246 0.034 17967
1500 1 4 . 1 1 71 71 PHE CA C 69 59.930 59.930 59.829 0.101 17967
1501 1 4 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.438 0.992 17967
1502 1 4 . 1 1 71 71 PHE H H 69 7.810 7.810 7.359 0.451 17967
1503 1 4 . 1 1 72 72 TYR N N 70 120.110 120.110 115.904 4.206 17967
1504 1 4 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.590 -0.270 17967
1505 1 4 . 1 1 72 72 TYR CA C 70 60.330 60.330 59.660 0.670 17967
1506 1 4 . 1 1 72 72 TYR CB C 70 40.430 40.430 39.351 1.079 17967
1507 1 4 . 1 1 72 72 TYR H H 70 8.280 8.280 8.665 -0.385 17967
1508 1 4 . 1 1 73 73 SER N N 71 117.210 117.210 112.785 4.425 17967
1509 1 4 . 1 1 73 73 SER HA H 71 4.320 4.320 3.990 0.330 17967
1510 1 4 . 1 1 73 73 SER CA C 71 60.130 60.130 61.388 -1.258 17967
1511 1 4 . 1 1 73 73 SER CB C 71 63.630 63.630 62.165 1.465 17967
1512 1 4 . 1 1 73 73 SER H H 71 7.870 7.870 8.839 -0.969 17967
1513 1 4 . 1 1 74 74 LYS N N 72 122.810 122.810 122.838 -0.028 17967
1514 1 4 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.203 0.067 17967
1515 1 4 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.147 -0.217 17967
1516 1 4 . 1 1 74 74 LYS CB C 72 32.630 32.630 33.067 -0.437 17967
1517 1 4 . 1 1 74 74 LYS H H 72 7.800 7.800 7.953 -0.153 17967
1518 1 4 . 1 1 75 75 ILE N N 73 121.610 121.610 120.640 0.970 17967
1519 1 4 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.176 -0.066 17967
1520 1 4 . 1 1 75 75 ILE CA C 73 61.830 61.830 62.169 -0.339 17967
1521 1 4 . 1 1 75 75 ILE CB C 73 38.630 38.630 36.810 1.820 17967
1522 1 4 . 1 1 75 75 ILE H H 73 7.750 7.750 7.476 0.274 17967
1523 1 4 . 1 1 76 76 SER N N 74 120.410 120.410 121.494 -1.084 17967
1524 1 4 . 1 1 76 76 SER HA H 74 4.300 4.300 4.889 -0.589 17967
1525 1 4 . 1 1 76 76 SER CA C 74 59.330 59.330 58.912 0.418 17967
1526 1 4 . 1 1 76 76 SER CB C 74 63.830 63.830 64.869 -1.039 17967
1527 1 4 . 1 1 76 76 SER H H 74 8.130 8.130 8.218 -0.088 17967
1528 1 4 . 1 1 77 77 GLU N N 75 123.810 123.810 122.223 1.587 17967
1529 1 4 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.252 -0.062 17967
1530 1 4 . 1 1 77 77 GLU CA C 75 57.330 57.330 57.676 -0.346 17967
1531 1 4 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.153 -0.023 17967
1532 1 4 . 1 1 77 77 GLU H H 75 8.270 8.270 8.852 -0.582 17967
1533 1 4 . 1 1 78 78 TYR N N 76 122.410 122.410 119.992 2.418 17967
1534 1 4 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.533 -0.073 17967
1535 1 4 . 1 1 78 78 TYR CA C 76 58.130 58.130 58.384 -0.254 17967
1536 1 4 . 1 1 78 78 TYR CB C 76 38.630 38.630 38.969 -0.340 17967
1537 1 4 . 1 1 78 78 TYR H H 76 7.980 7.980 8.084 -0.104 17967
1538 1 4 . 1 1 79 79 ARG N N 77 124.710 124.710 127.329 -2.619 17967
1539 1 4 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.581 -0.381 17967
1540 1 4 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.184 0.846 17967
1541 1 4 . 1 1 79 79 ARG CB C 77 31.030 31.030 32.293 -1.263 17967
1542 1 4 . 1 1 79 79 ARG H H 77 7.880 7.880 8.277 -0.397 17967
1543 1 4 . 1 1 80 80 HIS N N 78 122.110 122.110 120.379 1.731 17967
1544 1 4 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.641 -0.131 17967
1545 1 4 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.328 1.002 17967
1546 1 4 . 1 1 80 80 HIS CB C 78 30.830 30.830 27.714 3.116 17967
1547 1 4 . 1 1 80 80 HIS H H 78 8.120 8.120 8.498 -0.378 17967
1548 1 4 . 1 1 81 81 TYR N N 79 123.610 123.610 122.570 1.040 17967
1549 1 4 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.523 0.067 17967
1550 1 4 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.396 0.434 17967
1551 1 4 . 1 1 81 81 TYR CB C 79 39.130 39.130 39.915 -0.785 17967
1552 1 4 . 1 1 81 81 TYR H H 79 7.970 7.970 8.010 -0.040 17967
1553 1 5 . 1 1 2 2 ALA HA H 0 4.290 4.290 3.614 0.676 17967
1554 1 5 . 1 1 2 2 ALA CA C 0 52.530 52.530 53.579 -1.049 17967
1555 1 5 . 1 1 2 2 ALA CB C 0 19.730 19.730 18.083 1.647 17967
1556 1 5 . 1 1 3 3 MET N N 1 122.210 122.210 121.202 1.008 17967
1557 1 5 . 1 1 3 3 MET HA H 1 4.300 4.300 4.543 -0.243 17967
1558 1 5 . 1 1 3 3 MET CA C 1 56.030 56.030 54.255 1.775 17967
1559 1 5 . 1 1 3 3 MET CB C 1 33.430 33.430 30.533 2.897 17967
1560 1 5 . 1 1 3 3 MET H H 1 8.370 8.370 7.744 0.626 17967
1561 1 5 . 1 1 4 4 PHE N N 2 122.310 122.310 127.763 -5.453 17967
1562 1 5 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.796 -0.166 17967
1563 1 5 . 1 1 4 4 PHE CA C 2 57.330 57.330 55.329 2.001 17967
1564 1 5 . 1 1 4 4 PHE CB C 2 39.430 39.430 40.403 -0.973 17967
1565 1 5 . 1 1 4 4 PHE H H 2 8.370 8.370 8.224 0.146 17967
1566 1 5 . 1 1 5 5 GLN N N 3 123.510 123.510 125.218 -1.708 17967
1567 1 5 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.408 -0.228 17967
1568 1 5 . 1 1 5 5 GLN CA C 3 56.130 56.130 54.842 1.288 17967
1569 1 5 . 1 1 5 5 GLN CB C 3 29.930 29.930 30.840 -0.910 17967
1570 1 5 . 1 1 5 5 GLN H H 3 8.260 8.260 8.690 -0.430 17967
1571 1 5 . 1 1 6 6 ASP N N 4 125.010 125.010 124.001 1.009 17967
1572 1 5 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.525 0.265 17967
1573 1 5 . 1 1 6 6 ASP CA C 4 51.930 51.930 53.033 -1.103 17967
1574 1 5 . 1 1 6 6 ASP CB C 4 41.730 41.730 40.196 1.534 17967
1575 1 5 . 1 1 6 6 ASP H H 4 8.420 8.420 8.371 0.049 17967
1576 1 5 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.204 -0.084 17967
1577 1 5 . 1 1 7 7 PRO CA C 5 64.030 64.030 63.734 0.296 17967
1578 1 5 . 1 1 7 7 PRO CB C 5 32.330 32.330 31.662 0.668 17967
1579 1 5 . 1 1 8 8 GLN N N 6 119.710 119.710 116.511 3.199 17967
1580 1 5 . 1 1 8 8 GLN HA H 6 4.160 4.160 3.786 0.374 17967
1581 1 5 . 1 1 8 8 GLN CA C 6 56.630 56.630 56.394 0.236 17967
1582 1 5 . 1 1 8 8 GLN CB C 6 29.330 29.330 26.088 3.242 17967
1583 1 5 . 1 1 8 8 GLN H H 6 8.430 8.430 8.351 0.079 17967
1584 1 5 . 1 1 9 9 GLU N N 7 122.110 122.110 122.079 0.031 17967
1585 1 5 . 1 1 9 9 GLU HA H 7 4.200 4.200 3.995 0.205 17967
1586 1 5 . 1 1 9 9 GLU CA C 7 56.030 56.030 57.554 -1.524 17967
1587 1 5 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.992 0.538 17967
1588 1 5 . 1 1 9 9 GLU H H 7 7.940 7.940 8.589 -0.649 17967
1589 1 5 . 1 1 10 10 ARG N N 8 123.410 123.410 115.116 8.294 17967
1590 1 5 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.227 0.173 17967
1591 1 5 . 1 1 10 10 ARG CA C 8 54.130 54.130 56.220 -2.090 17967
1592 1 5 . 1 1 10 10 ARG CB C 8 29.330 29.330 28.247 1.083 17967
1593 1 5 . 1 1 10 10 ARG H H 8 7.660 7.660 8.167 -0.507 17967
1594 1 5 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.702 -0.352 17967
1595 1 5 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.713 0.817 17967
1596 1 5 . 1 1 11 11 PRO CB C 9 32.630 32.630 33.057 -0.427 17967
1597 1 5 . 1 1 12 12 ARG N N 10 123.810 123.810 117.106 6.704 17967
1598 1 5 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.734 -0.064 17967
1599 1 5 . 1 1 12 12 ARG CA C 10 56.830 56.830 56.483 0.347 17967
1600 1 5 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.714 0.816 17967
1601 1 5 . 1 1 12 12 ARG H H 10 8.710 8.710 8.853 -0.143 17967
1602 1 5 . 1 1 13 13 LYS N N 11 118.410 118.410 119.804 -1.394 17967
1603 1 5 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.808 0.242 17967
1604 1 5 . 1 1 13 13 LYS CA C 11 53.330 53.330 55.013 -1.683 17967
1605 1 5 . 1 1 13 13 LYS CB C 11 35.430 35.430 32.668 2.762 17967
1606 1 5 . 1 1 13 13 LYS H H 11 7.800 7.800 7.864 -0.064 17967
1607 1 5 . 1 1 14 14 LEU N N 12 125.010 125.010 126.697 -1.687 17967
1608 1 5 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.229 -0.059 17967
1609 1 5 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.280 0.450 17967
1610 1 5 . 1 1 14 14 LEU CB C 12 40.530 40.530 40.153 0.377 17967
1611 1 5 . 1 1 14 14 LEU H H 12 10.210 10.210 9.209 1.001 17967
1612 1 5 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.212 0.008 17967
1613 1 5 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.708 1.522 17967
1614 1 5 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.037 -0.307 17967
1615 1 5 . 1 1 16 16 GLN N N 14 117.810 117.810 118.161 -0.351 17967
1616 1 5 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.142 0.048 17967
1617 1 5 . 1 1 16 16 GLN CA C 14 59.030 59.030 59.096 -0.066 17967
1618 1 5 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.299 0.331 17967
1619 1 5 . 1 1 16 16 GLN H H 14 7.110 7.110 8.345 -1.235 17967
1620 1 5 . 1 1 17 17 LEU N N 15 124.710 124.710 121.855 2.855 17967
1621 1 5 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.135 -0.125 17967
1622 1 5 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.952 0.378 17967
1623 1 5 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.617 0.413 17967
1624 1 5 . 1 1 17 17 LEU H H 15 8.010 8.010 7.896 0.114 17967
1625 1 5 . 1 1 18 18 CYS N N 16 117.210 117.210 117.168 0.042 17967
1626 1 5 . 1 1 18 18 CYS HA H 16 3.750 3.750 3.976 -0.226 17967
1627 1 5 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.965 0.766 17967
1628 1 5 . 1 1 18 18 CYS CB C 16 26.230 26.230 26.026 0.204 17967
1629 1 5 . 1 1 18 18 CYS H H 16 8.380 8.380 8.453 -0.073 17967
1630 1 5 . 1 1 19 19 THR N N 17 117.810 117.810 116.282 1.528 17967
1631 1 5 . 1 1 19 19 THR HA H 17 4.000 4.000 4.037 -0.037 17967
1632 1 5 . 1 1 19 19 THR CA C 17 66.830 66.830 66.896 -0.066 17967
1633 1 5 . 1 1 19 19 THR CB C 17 68.830 68.830 68.446 0.384 17967
1634 1 5 . 1 1 19 19 THR H H 17 7.720 7.720 7.911 -0.191 17967
1635 1 5 . 1 1 20 20 GLU N N 18 125.410 125.410 121.291 4.119 17967
1636 1 5 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.239 -0.169 17967
1637 1 5 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.833 0.897 17967
1638 1 5 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.472 0.258 17967
1639 1 5 . 1 1 20 20 GLU H H 18 8.010 8.010 7.728 0.282 17967
1640 1 5 . 1 1 21 21 LEU N N 19 118.810 118.810 117.100 1.710 17967
1641 1 5 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.307 -0.007 17967
1642 1 5 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.171 -0.341 17967
1643 1 5 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.683 0.647 17967
1644 1 5 . 1 1 21 21 LEU H H 19 8.010 8.010 8.016 -0.006 17967
1645 1 5 . 1 1 22 22 GLN N N 20 118.310 118.310 115.019 3.291 17967
1646 1 5 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.050 -0.100 17967
1647 1 5 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.057 -0.327 17967
1648 1 5 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.556 -0.426 17967
1649 1 5 . 1 1 22 22 GLN H H 20 7.860 7.860 7.779 0.081 17967
1650 1 5 . 1 1 23 23 THR N N 21 115.910 115.910 112.563 3.347 17967
1651 1 5 . 1 1 23 23 THR HA H 21 4.950 4.950 4.507 0.443 17967
1652 1 5 . 1 1 23 23 THR CA C 21 58.530 58.530 60.215 -1.685 17967
1653 1 5 . 1 1 23 23 THR CB C 21 70.330 70.330 70.913 -0.583 17967
1654 1 5 . 1 1 23 23 THR H H 21 8.250 8.250 8.488 -0.238 17967
1655 1 5 . 1 1 24 24 THR N N 22 112.810 112.810 114.610 -1.800 17967
1656 1 5 . 1 1 24 24 THR HA H 22 4.880 4.880 4.638 0.242 17967
1657 1 5 . 1 1 24 24 THR CA C 22 59.730 59.730 60.277 -0.547 17967
1658 1 5 . 1 1 24 24 THR CB C 22 74.130 74.130 71.237 2.892 17967
1659 1 5 . 1 1 24 24 THR H H 22 8.660 8.660 7.940 0.720 17967
1660 1 5 . 1 1 25 25 ILE N N 23 123.710 123.710 120.203 3.507 17967
1661 1 5 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.755 0.025 17967
1662 1 5 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.402 -0.972 17967
1663 1 5 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.882 0.748 17967
1664 1 5 . 1 1 25 25 ILE H H 23 9.060 9.060 8.276 0.784 17967
1665 1 5 . 1 1 26 26 HIS N N 24 119.510 119.510 113.029 6.481 17967
1666 1 5 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.691 -0.251 17967
1667 1 5 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.331 1.699 17967
1668 1 5 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.281 1.549 17967
1669 1 5 . 1 1 26 26 HIS H H 24 7.040 7.040 7.573 -0.533 17967
1670 1 5 . 1 1 27 27 ASP N N 25 116.810 116.810 117.705 -0.895 17967
1671 1 5 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.645 0.115 17967
1672 1 5 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.233 0.196 17967
1673 1 5 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.395 0.935 17967
1674 1 5 . 1 1 27 27 ASP H H 25 7.250 7.250 7.541 -0.291 17967
1675 1 5 . 1 1 28 28 ILE N N 26 123.210 123.210 121.439 1.771 17967
1676 1 5 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.919 0.011 17967
1677 1 5 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.420 0.610 17967
1678 1 5 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.886 -0.956 17967
1679 1 5 . 1 1 28 28 ILE H H 26 7.750 7.750 7.730 0.020 17967
1680 1 5 . 1 1 29 29 ILE N N 27 131.110 131.110 129.160 1.950 17967
1681 1 5 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.117 0.263 17967
1682 1 5 . 1 1 29 29 ILE CA C 27 58.830 58.830 60.069 -1.239 17967
1683 1 5 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.399 1.231 17967
1684 1 5 . 1 1 29 29 ILE H H 27 8.270 8.270 8.384 -0.114 17967
1685 1 5 . 1 1 30 30 LEU N N 28 129.410 129.410 128.735 0.675 17967
1686 1 5 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.664 -0.004 17967
1687 1 5 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.176 -0.646 17967
1688 1 5 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.659 2.671 17967
1689 1 5 . 1 1 30 30 LEU H H 28 8.500 8.500 8.219 0.281 17967
1690 1 5 . 1 1 31 31 GLU N N 29 121.910 121.910 120.864 1.046 17967
1691 1 5 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.915 -0.235 17967
1692 1 5 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.357 0.573 17967
1693 1 5 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.484 0.546 17967
1694 1 5 . 1 1 31 31 GLU H H 29 8.860 8.860 8.275 0.585 17967
1695 1 5 . 1 1 32 32 CYS N N 30 125.710 125.710 118.830 6.880 17967
1696 1 5 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.828 -0.808 17967
1697 1 5 . 1 1 32 32 CYS CA C 30 58.230 58.230 60.932 -2.702 17967
1698 1 5 . 1 1 32 32 CYS CB C 30 31.730 31.730 26.382 5.348 17967
1699 1 5 . 1 1 32 32 CYS H H 30 8.270 8.270 8.720 -0.450 17967
1700 1 5 . 1 1 33 33 VAL N N 31 132.310 132.310 124.400 7.910 17967
1701 1 5 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.130 -0.030 17967
1702 1 5 . 1 1 33 33 VAL CA C 31 64.230 64.230 64.578 -0.348 17967
1703 1 5 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.692 -0.062 17967
1704 1 5 . 1 1 33 33 VAL H H 31 8.860 8.860 7.866 0.994 17967
1705 1 5 . 1 1 34 34 TYR N N 32 124.310 124.310 118.136 6.174 17967
1706 1 5 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.516 -0.075 17967
1707 1 5 . 1 1 34 34 TYR CA C 32 61.030 61.030 60.359 0.670 17967
1708 1 5 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.446 1.684 17967
1709 1 5 . 1 1 34 34 TYR H H 32 8.590 8.590 7.494 1.096 17967
1710 1 5 . 1 1 35 35 CYS N N 33 119.810 119.810 116.106 3.704 17967
1711 1 5 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.635 0.205 17967
1712 1 5 . 1 1 35 35 CYS CA C 33 59.430 59.430 59.797 -0.367 17967
1713 1 5 . 1 1 35 35 CYS CB C 33 32.230 32.230 27.969 4.261 17967
1714 1 5 . 1 1 35 35 CYS H H 33 8.070 8.070 8.465 -0.395 17967
1715 1 5 . 1 1 36 36 LYS N N 34 119.910 119.910 116.667 3.243 17967
1716 1 5 . 1 1 36 36 LYS HA H 34 4.190 4.190 4.044 0.146 17967
1717 1 5 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.194 0.636 17967
1718 1 5 . 1 1 36 36 LYS CB C 34 29.330 29.330 29.921 -0.591 17967
1719 1 5 . 1 1 36 36 LYS H H 34 7.860 7.860 7.992 -0.132 17967
1720 1 5 . 1 1 37 37 GLN N N 35 120.710 120.710 114.929 5.781 17967
1721 1 5 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.628 -0.268 17967
1722 1 5 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.050 1.380 17967
1723 1 5 . 1 1 37 37 GLN CB C 35 29.630 29.630 30.559 -0.929 17967
1724 1 5 . 1 1 37 37 GLN H H 35 8.270 8.270 7.945 0.325 17967
1725 1 5 . 1 1 38 38 GLN N N 36 123.710 123.710 122.809 0.901 17967
1726 1 5 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.248 0.052 17967
1727 1 5 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.498 0.232 17967
1728 1 5 . 1 1 38 38 GLN CB C 36 29.330 29.330 29.147 0.183 17967
1729 1 5 . 1 1 38 38 GLN H H 36 8.640 8.640 8.544 0.096 17967
1730 1 5 . 1 1 39 39 LEU N N 37 131.310 131.310 126.134 5.176 17967
1731 1 5 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.158 -0.048 17967
1732 1 5 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.502 1.828 17967
1733 1 5 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.589 -0.659 17967
1734 1 5 . 1 1 39 39 LEU H H 37 8.870 8.870 7.764 1.106 17967
1735 1 5 . 1 1 40 40 LEU N N 38 126.310 126.310 124.026 2.284 17967
1736 1 5 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.337 -0.027 17967
1737 1 5 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.697 -0.467 17967
1738 1 5 . 1 1 40 40 LEU CB C 38 43.130 43.130 42.864 0.266 17967
1739 1 5 . 1 1 40 40 LEU H H 38 9.850 9.850 8.421 1.429 17967
1740 1 5 . 1 1 41 41 ARG N N 39 127.110 127.110 125.357 1.753 17967
1741 1 5 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.691 -0.171 17967
1742 1 5 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.450 -1.621 17967
1743 1 5 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.804 -2.874 17967
1744 1 5 . 1 1 41 41 ARG H H 39 8.970 8.970 8.874 0.096 17967
1745 1 5 . 1 1 42 42 ARG N N 40 115.810 115.810 117.156 -1.346 17967
1746 1 5 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.149 -0.069 17967
1747 1 5 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.662 -0.532 17967
1748 1 5 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.723 -0.393 17967
1749 1 5 . 1 1 42 42 ARG H H 40 8.610 8.610 8.452 0.158 17967
1750 1 5 . 1 1 43 43 GLU N N 41 119.910 119.910 120.197 -0.287 17967
1751 1 5 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.468 -0.218 17967
1752 1 5 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.786 0.244 17967
1753 1 5 . 1 1 43 43 GLU CB C 41 30.330 30.330 28.889 1.442 17967
1754 1 5 . 1 1 43 43 GLU H H 41 6.950 6.950 7.763 -0.813 17967
1755 1 5 . 1 1 44 44 VAL N N 42 125.010 125.010 120.000 5.010 17967
1756 1 5 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.589 -0.349 17967
1757 1 5 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.275 1.355 17967
1758 1 5 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.498 -0.168 17967
1759 1 5 . 1 1 44 44 VAL H H 42 7.820 7.820 8.138 -0.318 17967
1760 1 5 . 1 1 45 45 TYR N N 43 118.410 118.410 119.000 -0.590 17967
1761 1 5 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.194 0.236 17967
1762 1 5 . 1 1 45 45 TYR CA C 43 58.830 58.830 59.291 -0.461 17967
1763 1 5 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.148 -0.418 17967
1764 1 5 . 1 1 45 45 TYR H H 43 7.820 7.820 7.846 -0.026 17967
1765 1 5 . 1 1 46 46 ASP N N 44 122.410 122.410 120.193 2.217 17967
1766 1 5 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.343 0.257 17967
1767 1 5 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.737 0.093 17967
1768 1 5 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.263 0.767 17967
1769 1 5 . 1 1 46 46 ASP H H 44 8.540 8.540 8.264 0.276 17967
1770 1 5 . 1 1 47 47 PHE N N 45 126.210 126.210 119.660 6.550 17967
1771 1 5 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.074 -0.164 17967
1772 1 5 . 1 1 47 47 PHE CA C 45 62.630 62.630 62.240 0.390 17967
1773 1 5 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.137 0.193 17967
1774 1 5 . 1 1 47 47 PHE H H 45 8.320 8.320 7.943 0.377 17967
1775 1 5 . 1 1 48 48 ALA N N 46 119.110 119.110 119.103 0.007 17967
1776 1 5 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.341 0.179 17967
1777 1 5 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.803 0.427 17967
1778 1 5 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.709 0.021 17967
1779 1 5 . 1 1 48 48 ALA H H 46 7.740 7.740 7.772 -0.032 17967
1780 1 5 . 1 1 49 49 ARG N N 47 124.010 124.010 117.987 6.023 17967
1781 1 5 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.295 -0.245 17967
1782 1 5 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.441 2.189 17967
1783 1 5 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.537 -0.107 17967
1784 1 5 . 1 1 49 49 ARG H H 47 8.500 8.500 8.374 0.126 17967
1785 1 5 . 1 1 50 50 ARG N N 48 119.110 119.110 117.009 2.101 17967
1786 1 5 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.597 -0.587 17967
1787 1 5 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.532 2.598 17967
1788 1 5 . 1 1 50 50 ARG CB C 48 31.130 31.130 32.767 -1.637 17967
1789 1 5 . 1 1 50 50 ARG H H 48 7.940 7.940 8.005 -0.065 17967
1790 1 5 . 1 1 51 51 ASP N N 49 120.910 120.910 119.342 1.568 17967
1791 1 5 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.955 -0.535 17967
1792 1 5 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.821 0.709 17967
1793 1 5 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.978 -1.048 17967
1794 1 5 . 1 1 51 51 ASP H H 49 7.950 7.950 8.505 -0.555 17967
1795 1 5 . 1 1 52 52 LEU N N 50 118.410 118.410 122.172 -3.762 17967
1796 1 5 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.388 -0.238 17967
1797 1 5 . 1 1 52 52 LEU CA C 50 54.230 54.230 54.267 -0.037 17967
1798 1 5 . 1 1 52 52 LEU CB C 50 41.130 41.130 41.168 -0.038 17967
1799 1 5 . 1 1 52 52 LEU H H 50 6.640 6.640 7.842 -1.202 17967
1800 1 5 . 1 1 53 53 CYS N N 51 117.410 117.410 116.037 1.373 17967
1801 1 5 . 1 1 53 53 CYS HA H 51 4.930 4.930 4.374 0.556 17967
1802 1 5 . 1 1 53 53 CYS CA C 51 58.930 58.930 59.029 -0.099 17967
1803 1 5 . 1 1 53 53 CYS CB C 51 28.630 28.630 26.061 2.569 17967
1804 1 5 . 1 1 53 53 CYS H H 51 8.030 8.030 7.637 0.393 17967
1805 1 5 . 1 1 54 54 ILE N N 52 125.110 125.110 124.254 0.856 17967
1806 1 5 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.385 -0.375 17967
1807 1 5 . 1 1 54 54 ILE CA C 52 59.630 59.630 62.473 -2.843 17967
1808 1 5 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.741 -1.411 17967
1809 1 5 . 1 1 54 54 ILE H H 52 8.500 8.500 8.378 0.122 17967
1810 1 5 . 1 1 55 55 VAL N N 53 127.010 127.010 124.139 2.871 17967
1811 1 5 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.567 -0.197 17967
1812 1 5 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.328 0.302 17967
1813 1 5 . 1 1 55 55 VAL CB C 53 34.230 34.230 33.203 1.027 17967
1814 1 5 . 1 1 55 55 VAL H H 53 8.130 8.130 8.274 -0.144 17967
1815 1 5 . 1 1 56 56 TYR N N 54 124.910 124.910 126.425 -1.515 17967
1816 1 5 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.248 0.152 17967
1817 1 5 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.701 -0.371 17967
1818 1 5 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.816 1.214 17967
1819 1 5 . 1 1 56 56 TYR H H 54 8.700 8.700 8.643 0.057 17967
1820 1 5 . 1 1 57 57 ARG N N 55 123.810 123.810 125.298 -1.488 17967
1821 1 5 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.470 0.170 17967
1822 1 5 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.377 0.054 17967
1823 1 5 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.709 2.121 17967
1824 1 5 . 1 1 57 57 ARG H H 55 8.870 8.870 8.406 0.464 17967
1825 1 5 . 1 1 58 58 ASP N N 56 129.110 129.110 125.546 3.564 17967
1826 1 5 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.318 -0.008 17967
1827 1 5 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.228 -0.398 17967
1828 1 5 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.274 -0.144 17967
1829 1 5 . 1 1 58 58 ASP H H 56 9.620 9.620 8.934 0.686 17967
1830 1 5 . 1 1 59 59 GLY N N 57 104.510 104.510 106.949 -2.439 17967
1831 1 5 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.269 0.361 17967
1832 1 5 . 1 1 59 59 GLY H H 57 8.720 8.720 8.381 0.339 17967
1833 1 5 . 1 1 60 60 ASN N N 58 122.210 122.210 119.549 2.661 17967
1834 1 5 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.303 0.097 17967
1835 1 5 . 1 1 60 60 ASN CA C 58 50.330 50.330 51.054 -0.724 17967
1836 1 5 . 1 1 60 60 ASN CB C 58 40.430 40.430 40.744 -0.314 17967
1837 1 5 . 1 1 60 60 ASN H H 58 8.120 8.120 7.989 0.131 17967
1838 1 5 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.556 0.234 17967
1839 1 5 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.352 -0.322 17967
1840 1 5 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.301 2.229 17967
1841 1 5 . 1 1 62 62 TYR N N 60 119.810 119.810 122.596 -2.786 17967
1842 1 5 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.589 -0.229 17967
1843 1 5 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.359 1.871 17967
1844 1 5 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.518 0.912 17967
1845 1 5 . 1 1 62 62 TYR H H 60 8.590 8.590 7.601 0.989 17967
1846 1 5 . 1 1 63 63 ALA N N 61 123.810 123.810 121.182 2.628 17967
1847 1 5 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.236 0.184 17967
1848 1 5 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.409 -0.079 17967
1849 1 5 . 1 1 63 63 ALA CB C 61 20.330 20.330 21.050 -0.720 17967
1850 1 5 . 1 1 63 63 ALA H H 61 8.010 8.010 8.988 -0.978 17967
1851 1 5 . 1 1 64 64 VAL N N 62 120.510 120.510 117.428 3.082 17967
1852 1 5 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.410 1.090 17967
1853 1 5 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.435 -0.205 17967
1854 1 5 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.614 2.716 17967
1855 1 5 . 1 1 64 64 VAL H H 62 6.380 6.380 8.542 -2.162 17967
1856 1 5 . 1 1 65 65 CYS N N 63 130.310 130.310 123.419 6.891 17967
1857 1 5 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.503 0.057 17967
1858 1 5 . 1 1 65 65 CYS CA C 63 58.430 58.430 57.975 0.455 17967
1859 1 5 . 1 1 65 65 CYS CB C 63 31.130 31.130 29.781 1.349 17967
1860 1 5 . 1 1 65 65 CYS H H 63 9.430 9.430 8.347 1.083 17967
1861 1 5 . 1 1 66 66 ASP N N 64 121.110 121.110 120.624 0.486 17967
1862 1 5 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.252 0.158 17967
1863 1 5 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.077 0.153 17967
1864 1 5 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.801 1.529 17967
1865 1 5 . 1 1 66 66 ASP H H 64 9.120 9.120 8.916 0.204 17967
1866 1 5 . 1 1 67 67 LYS N N 65 122.110 122.110 119.631 2.479 17967
1867 1 5 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.834 0.176 17967
1868 1 5 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.751 1.379 17967
1869 1 5 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.237 0.593 17967
1870 1 5 . 1 1 67 67 LYS H H 65 8.330 8.330 7.510 0.820 17967
1871 1 5 . 1 1 68 68 CYS N N 66 125.610 125.610 119.223 6.387 17967
1872 1 5 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.150 -0.040 17967
1873 1 5 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.920 0.610 17967
1874 1 5 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.165 4.565 17967
1875 1 5 . 1 1 68 68 CYS H H 66 8.700 8.700 7.704 0.996 17967
1876 1 5 . 1 1 69 69 LEU N N 67 125.310 125.310 120.106 5.204 17967
1877 1 5 . 1 1 69 69 LEU HA H 67 4.000 4.000 3.994 0.006 17967
1878 1 5 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.530 -0.000 17967
1879 1 5 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.738 0.392 17967
1880 1 5 . 1 1 69 69 LEU H H 67 8.470 8.470 8.675 -0.205 17967
1881 1 5 . 1 1 70 70 LYS N N 68 119.010 119.010 118.123 0.887 17967
1882 1 5 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.211 -0.231 17967
1883 1 5 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.364 0.466 17967
1884 1 5 . 1 1 70 70 LYS CB C 68 32.130 32.130 32.058 0.072 17967
1885 1 5 . 1 1 70 70 LYS H H 68 7.810 7.810 7.314 0.496 17967
1886 1 5 . 1 1 71 71 PHE N N 69 121.710 121.710 119.734 1.976 17967
1887 1 5 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.050 0.230 17967
1888 1 5 . 1 1 71 71 PHE CA C 69 59.930 59.930 59.150 0.780 17967
1889 1 5 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.682 0.748 17967
1890 1 5 . 1 1 71 71 PHE H H 69 7.810 7.810 7.366 0.444 17967
1891 1 5 . 1 1 72 72 TYR N N 70 120.110 120.110 117.620 2.490 17967
1892 1 5 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.757 -0.437 17967
1893 1 5 . 1 1 72 72 TYR CA C 70 60.330 60.330 56.711 3.619 17967
1894 1 5 . 1 1 72 72 TYR CB C 70 40.430 40.430 36.608 3.822 17967
1895 1 5 . 1 1 72 72 TYR H H 70 8.280 8.280 8.918 -0.638 17967
1896 1 5 . 1 1 73 73 SER N N 71 117.210 117.210 117.608 -0.398 17967
1897 1 5 . 1 1 73 73 SER HA H 71 4.320 4.320 4.518 -0.198 17967
1898 1 5 . 1 1 73 73 SER CA C 71 60.130 60.130 60.064 0.066 17967
1899 1 5 . 1 1 73 73 SER CB C 71 63.630 63.630 63.440 0.190 17967
1900 1 5 . 1 1 73 73 SER H H 71 7.870 7.870 8.229 -0.359 17967
1901 1 5 . 1 1 74 74 LYS N N 72 122.810 122.810 120.165 2.645 17967
1902 1 5 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.062 0.208 17967
1903 1 5 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.684 -0.755 17967
1904 1 5 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.185 0.445 17967
1905 1 5 . 1 1 74 74 LYS H H 72 7.800 7.800 8.501 -0.701 17967
1906 1 5 . 1 1 75 75 ILE N N 73 121.610 121.610 118.321 3.289 17967
1907 1 5 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.195 -0.085 17967
1908 1 5 . 1 1 75 75 ILE CA C 73 61.830 61.830 63.962 -2.132 17967
1909 1 5 . 1 1 75 75 ILE CB C 73 38.630 38.630 38.152 0.478 17967
1910 1 5 . 1 1 75 75 ILE H H 73 7.750 7.750 7.910 -0.160 17967
1911 1 5 . 1 1 76 76 SER N N 74 120.410 120.410 112.336 8.074 17967
1912 1 5 . 1 1 76 76 SER HA H 74 4.300 4.300 4.726 -0.425 17967
1913 1 5 . 1 1 76 76 SER CA C 74 59.330 59.330 59.583 -0.253 17967
1914 1 5 . 1 1 76 76 SER CB C 74 63.830 63.830 62.689 1.141 17967
1915 1 5 . 1 1 76 76 SER H H 74 8.130 8.130 7.964 0.166 17967
1916 1 5 . 1 1 77 77 GLU N N 75 123.810 123.810 118.380 5.430 17967
1917 1 5 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.525 -0.335 17967
1918 1 5 . 1 1 77 77 GLU CA C 75 57.330 57.330 54.734 2.596 17967
1919 1 5 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.639 -0.509 17967
1920 1 5 . 1 1 77 77 GLU H H 75 8.270 8.270 7.424 0.846 17967
1921 1 5 . 1 1 78 78 TYR N N 76 122.410 122.410 122.819 -0.409 17967
1922 1 5 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.338 0.122 17967
1923 1 5 . 1 1 78 78 TYR CA C 76 58.130 58.130 60.320 -2.190 17967
1924 1 5 . 1 1 78 78 TYR CB C 76 38.630 38.630 38.518 0.112 17967
1925 1 5 . 1 1 78 78 TYR H H 76 7.980 7.980 7.654 0.326 17967
1926 1 5 . 1 1 79 79 ARG N N 77 124.710 124.710 124.154 0.556 17967
1927 1 5 . 1 1 79 79 ARG HA H 77 4.200 4.200 5.087 -0.887 17967
1928 1 5 . 1 1 79 79 ARG CA C 77 56.030 56.030 56.031 -0.001 17967
1929 1 5 . 1 1 79 79 ARG CB C 77 31.030 31.030 30.149 0.881 17967
1930 1 5 . 1 1 79 79 ARG H H 77 7.880 7.880 8.976 -1.096 17967
1931 1 5 . 1 1 80 80 HIS N N 78 122.110 122.110 119.054 3.056 17967
1932 1 5 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.739 -0.229 17967
1933 1 5 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.373 0.957 17967
1934 1 5 . 1 1 80 80 HIS CB C 78 30.830 30.830 30.241 0.589 17967
1935 1 5 . 1 1 80 80 HIS H H 78 8.120 8.120 8.918 -0.798 17967
1936 1 5 . 1 1 81 81 TYR N N 79 123.610 123.610 120.658 2.952 17967
1937 1 5 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.236 0.354 17967
1938 1 5 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.853 -0.023 17967
1939 1 5 . 1 1 81 81 TYR CB C 79 39.130 39.130 37.199 1.931 17967
1940 1 5 . 1 1 81 81 TYR H H 79 7.970 7.970 8.231 -0.261 17967
1941 1 6 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.538 -0.248 17967
1942 1 6 . 1 1 2 2 ALA CA C 0 52.530 52.530 51.653 0.877 17967
1943 1 6 . 1 1 2 2 ALA CB C 0 19.730 19.730 19.094 0.636 17967
1944 1 6 . 1 1 3 3 MET N N 1 122.210 122.210 124.816 -2.606 17967
1945 1 6 . 1 1 3 3 MET HA H 1 4.300 4.300 4.405 -0.105 17967
1946 1 6 . 1 1 3 3 MET CA C 1 56.030 56.030 55.149 0.881 17967
1947 1 6 . 1 1 3 3 MET CB C 1 33.430 33.430 32.179 1.251 17967
1948 1 6 . 1 1 3 3 MET H H 1 8.370 8.370 8.484 -0.114 17967
1949 1 6 . 1 1 4 4 PHE N N 2 122.310 122.310 126.097 -3.787 17967
1950 1 6 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.757 -0.127 17967
1951 1 6 . 1 1 4 4 PHE CA C 2 57.330 57.330 55.624 1.706 17967
1952 1 6 . 1 1 4 4 PHE CB C 2 39.430 39.430 41.363 -1.933 17967
1953 1 6 . 1 1 4 4 PHE H H 2 8.370 8.370 8.703 -0.333 17967
1954 1 6 . 1 1 5 5 GLN N N 3 123.510 123.510 124.424 -0.914 17967
1955 1 6 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.150 0.030 17967
1956 1 6 . 1 1 5 5 GLN CA C 3 56.130 56.130 55.651 0.479 17967
1957 1 6 . 1 1 5 5 GLN CB C 3 29.930 29.930 29.145 0.785 17967
1958 1 6 . 1 1 5 5 GLN H H 3 8.260 8.260 8.328 -0.068 17967
1959 1 6 . 1 1 6 6 ASP N N 4 125.010 125.010 118.942 6.068 17967
1960 1 6 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.694 0.096 17967
1961 1 6 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.591 0.339 17967
1962 1 6 . 1 1 6 6 ASP CB C 4 41.730 41.730 41.829 -0.099 17967
1963 1 6 . 1 1 6 6 ASP H H 4 8.420 8.420 8.381 0.039 17967
1964 1 6 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.442 -0.322 17967
1965 1 6 . 1 1 7 7 PRO CA C 5 64.030 64.030 64.329 -0.299 17967
1966 1 6 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.646 -0.316 17967
1967 1 6 . 1 1 8 8 GLN N N 6 119.710 119.710 116.932 2.778 17967
1968 1 6 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.415 -0.255 17967
1969 1 6 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.103 1.527 17967
1970 1 6 . 1 1 8 8 GLN CB C 6 29.330 29.330 28.842 0.488 17967
1971 1 6 . 1 1 8 8 GLN H H 6 8.430 8.430 8.011 0.419 17967
1972 1 6 . 1 1 9 9 GLU N N 7 122.110 122.110 120.995 1.115 17967
1973 1 6 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.137 0.063 17967
1974 1 6 . 1 1 9 9 GLU CA C 7 56.030 56.030 56.743 -0.713 17967
1975 1 6 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.722 0.808 17967
1976 1 6 . 1 1 9 9 GLU H H 7 7.940 7.940 8.277 -0.337 17967
1977 1 6 . 1 1 10 10 ARG N N 8 123.410 123.410 119.607 3.803 17967
1978 1 6 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.671 -0.271 17967
1979 1 6 . 1 1 10 10 ARG CA C 8 54.130 54.130 53.581 0.549 17967
1980 1 6 . 1 1 10 10 ARG CB C 8 29.330 29.330 30.105 -0.775 17967
1981 1 6 . 1 1 10 10 ARG H H 8 7.660 7.660 7.738 -0.078 17967
1982 1 6 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.655 -0.305 17967
1983 1 6 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.623 0.907 17967
1984 1 6 . 1 1 11 11 PRO CB C 9 32.630 32.630 33.433 -0.803 17967
1985 1 6 . 1 1 12 12 ARG N N 10 123.810 123.810 116.606 7.204 17967
1986 1 6 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.742 -0.072 17967
1987 1 6 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.487 1.343 17967
1988 1 6 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.585 0.945 17967
1989 1 6 . 1 1 12 12 ARG H H 10 8.710 8.710 8.744 -0.034 17967
1990 1 6 . 1 1 13 13 LYS N N 11 118.410 118.410 119.642 -1.232 17967
1991 1 6 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.779 0.271 17967
1992 1 6 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.123 -0.793 17967
1993 1 6 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.029 1.401 17967
1994 1 6 . 1 1 13 13 LYS H H 11 7.800 7.800 7.661 0.139 17967
1995 1 6 . 1 1 14 14 LEU N N 12 125.010 125.010 126.334 -1.324 17967
1996 1 6 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.230 -0.060 17967
1997 1 6 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.408 0.322 17967
1998 1 6 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.961 0.569 17967
1999 1 6 . 1 1 14 14 LEU H H 12 10.210 10.210 9.157 1.053 17967
2000 1 6 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.267 -0.047 17967
2001 1 6 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.415 1.815 17967
2002 1 6 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.166 -0.436 17967
2003 1 6 . 1 1 16 16 GLN N N 14 117.810 117.810 118.088 -0.278 17967
2004 1 6 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.133 0.057 17967
2005 1 6 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.953 0.077 17967
2006 1 6 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.361 0.268 17967
2007 1 6 . 1 1 16 16 GLN H H 14 7.110 7.110 8.333 -1.223 17967
2008 1 6 . 1 1 17 17 LEU N N 15 124.710 124.710 121.660 3.050 17967
2009 1 6 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.177 -0.167 17967
2010 1 6 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.660 0.670 17967
2011 1 6 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.699 0.331 17967
2012 1 6 . 1 1 17 17 LEU H H 15 8.010 8.010 7.971 0.039 17967
2013 1 6 . 1 1 18 18 CYS N N 16 117.210 117.210 117.251 -0.041 17967
2014 1 6 . 1 1 18 18 CYS HA H 16 3.750 3.750 4.005 -0.255 17967
2015 1 6 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.879 0.851 17967
2016 1 6 . 1 1 18 18 CYS CB C 16 26.230 26.230 25.990 0.240 17967
2017 1 6 . 1 1 18 18 CYS H H 16 8.380 8.380 8.287 0.093 17967
2018 1 6 . 1 1 19 19 THR N N 17 117.810 117.810 115.618 2.192 17967
2019 1 6 . 1 1 19 19 THR HA H 17 4.000 4.000 3.979 0.021 17967
2020 1 6 . 1 1 19 19 THR CA C 17 66.830 66.830 66.853 -0.023 17967
2021 1 6 . 1 1 19 19 THR CB C 17 68.830 68.830 68.605 0.225 17967
2022 1 6 . 1 1 19 19 THR H H 17 7.720 7.720 7.665 0.055 17967
2023 1 6 . 1 1 20 20 GLU N N 18 125.410 125.410 121.088 4.322 17967
2024 1 6 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.226 -0.156 17967
2025 1 6 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.563 1.167 17967
2026 1 6 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.466 0.264 17967
2027 1 6 . 1 1 20 20 GLU H H 18 8.010 8.010 7.735 0.275 17967
2028 1 6 . 1 1 21 21 LEU N N 19 118.810 118.810 117.190 1.620 17967
2029 1 6 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.372 -0.072 17967
2030 1 6 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.347 -0.517 17967
2031 1 6 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.871 0.459 17967
2032 1 6 . 1 1 21 21 LEU H H 19 8.010 8.010 7.965 0.045 17967
2033 1 6 . 1 1 22 22 GLN N N 20 118.310 118.310 115.516 2.794 17967
2034 1 6 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.042 -0.092 17967
2035 1 6 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.103 -0.373 17967
2036 1 6 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.362 -0.232 17967
2037 1 6 . 1 1 22 22 GLN H H 20 7.860 7.860 7.781 0.079 17967
2038 1 6 . 1 1 23 23 THR N N 21 115.910 115.910 111.642 4.268 17967
2039 1 6 . 1 1 23 23 THR HA H 21 4.950 4.950 4.617 0.333 17967
2040 1 6 . 1 1 23 23 THR CA C 21 58.530 58.530 59.634 -1.104 17967
2041 1 6 . 1 1 23 23 THR CB C 21 70.330 70.330 70.208 0.122 17967
2042 1 6 . 1 1 23 23 THR H H 21 8.250 8.250 8.181 0.069 17967
2043 1 6 . 1 1 24 24 THR N N 22 112.810 112.810 114.041 -1.231 17967
2044 1 6 . 1 1 24 24 THR HA H 22 4.880 4.880 4.594 0.286 17967
2045 1 6 . 1 1 24 24 THR CA C 22 59.730 59.730 60.401 -0.671 17967
2046 1 6 . 1 1 24 24 THR CB C 22 74.130 74.130 71.089 3.041 17967
2047 1 6 . 1 1 24 24 THR H H 22 8.660 8.660 7.897 0.763 17967
2048 1 6 . 1 1 25 25 ILE N N 23 123.710 123.710 121.855 1.855 17967
2049 1 6 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.682 0.098 17967
2050 1 6 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.434 -1.004 17967
2051 1 6 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.710 0.920 17967
2052 1 6 . 1 1 25 25 ILE H H 23 9.060 9.060 8.367 0.693 17967
2053 1 6 . 1 1 26 26 HIS N N 24 119.510 119.510 114.856 4.654 17967
2054 1 6 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.825 -0.385 17967
2055 1 6 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.721 1.308 17967
2056 1 6 . 1 1 26 26 HIS CB C 24 30.830 30.830 28.518 2.312 17967
2057 1 6 . 1 1 26 26 HIS H H 24 7.040 7.040 7.676 -0.636 17967
2058 1 6 . 1 1 27 27 ASP N N 25 116.810 116.810 117.895 -1.085 17967
2059 1 6 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.590 0.170 17967
2060 1 6 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.383 0.047 17967
2061 1 6 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.375 0.955 17967
2062 1 6 . 1 1 27 27 ASP H H 25 7.250 7.250 7.618 -0.368 17967
2063 1 6 . 1 1 28 28 ILE N N 26 123.210 123.210 122.034 1.176 17967
2064 1 6 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.891 0.039 17967
2065 1 6 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.837 0.194 17967
2066 1 6 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.658 -0.728 17967
2067 1 6 . 1 1 28 28 ILE H H 26 7.750 7.750 8.129 -0.379 17967
2068 1 6 . 1 1 29 29 ILE N N 27 131.110 131.110 129.501 1.609 17967
2069 1 6 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.129 0.251 17967
2070 1 6 . 1 1 29 29 ILE CA C 27 58.830 58.830 60.195 -1.365 17967
2071 1 6 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.470 1.160 17967
2072 1 6 . 1 1 29 29 ILE H H 27 8.270 8.270 8.497 -0.227 17967
2073 1 6 . 1 1 30 30 LEU N N 28 129.410 129.410 129.599 -0.189 17967
2074 1 6 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.747 -0.087 17967
2075 1 6 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.368 -0.838 17967
2076 1 6 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.551 2.779 17967
2077 1 6 . 1 1 30 30 LEU H H 28 8.500 8.500 8.360 0.140 17967
2078 1 6 . 1 1 31 31 GLU N N 29 121.910 121.910 121.998 -0.088 17967
2079 1 6 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.652 0.028 17967
2080 1 6 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.165 0.765 17967
2081 1 6 . 1 1 31 31 GLU CB C 29 33.030 33.030 31.919 1.111 17967
2082 1 6 . 1 1 31 31 GLU H H 29 8.860 8.860 8.265 0.595 17967
2083 1 6 . 1 1 32 32 CYS N N 30 125.710 125.710 119.609 6.101 17967
2084 1 6 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.770 -0.750 17967
2085 1 6 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.800 -1.570 17967
2086 1 6 . 1 1 32 32 CYS CB C 30 31.730 31.730 26.988 4.742 17967
2087 1 6 . 1 1 32 32 CYS H H 30 8.270 8.270 8.358 -0.088 17967
2088 1 6 . 1 1 33 33 VAL N N 31 132.310 132.310 128.096 4.214 17967
2089 1 6 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.144 -0.044 17967
2090 1 6 . 1 1 33 33 VAL CA C 31 64.230 64.230 64.835 -0.605 17967
2091 1 6 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.932 -0.302 17967
2092 1 6 . 1 1 33 33 VAL H H 31 8.860 8.860 8.045 0.815 17967
2093 1 6 . 1 1 34 34 TYR N N 32 124.310 124.310 114.788 9.522 17967
2094 1 6 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.515 -0.075 17967
2095 1 6 . 1 1 34 34 TYR CA C 32 61.030 61.030 59.045 1.985 17967
2096 1 6 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.567 1.563 17967
2097 1 6 . 1 1 34 34 TYR H H 32 8.590 8.590 7.145 1.445 17967
2098 1 6 . 1 1 35 35 CYS N N 33 119.810 119.810 115.711 4.099 17967
2099 1 6 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.608 0.232 17967
2100 1 6 . 1 1 35 35 CYS CA C 33 59.430 59.430 58.787 0.643 17967
2101 1 6 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.305 3.925 17967
2102 1 6 . 1 1 35 35 CYS H H 33 8.070 8.070 7.723 0.347 17967
2103 1 6 . 1 1 36 36 LYS N N 34 119.910 119.910 114.957 4.953 17967
2104 1 6 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.874 0.316 17967
2105 1 6 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.420 0.410 17967
2106 1 6 . 1 1 36 36 LYS CB C 34 29.330 29.330 30.441 -1.111 17967
2107 1 6 . 1 1 36 36 LYS H H 34 7.860 7.860 8.068 -0.208 17967
2108 1 6 . 1 1 37 37 GLN N N 35 120.710 120.710 116.317 4.393 17967
2109 1 6 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.369 -0.009 17967
2110 1 6 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.620 0.810 17967
2111 1 6 . 1 1 37 37 GLN CB C 35 29.630 29.630 29.264 0.366 17967
2112 1 6 . 1 1 37 37 GLN H H 35 8.270 8.270 7.748 0.522 17967
2113 1 6 . 1 1 38 38 GLN N N 36 123.710 123.710 121.665 2.045 17967
2114 1 6 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.215 0.085 17967
2115 1 6 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.706 0.024 17967
2116 1 6 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.959 0.371 17967
2117 1 6 . 1 1 38 38 GLN H H 36 8.640 8.640 8.468 0.172 17967
2118 1 6 . 1 1 39 39 LEU N N 37 131.310 131.310 125.838 5.472 17967
2119 1 6 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.174 -0.064 17967
2120 1 6 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.153 2.177 17967
2121 1 6 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.565 -0.635 17967
2122 1 6 . 1 1 39 39 LEU H H 37 8.870 8.870 7.768 1.102 17967
2123 1 6 . 1 1 40 40 LEU N N 38 126.310 126.310 123.174 3.136 17967
2124 1 6 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.272 0.038 17967
2125 1 6 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.844 -0.615 17967
2126 1 6 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.026 0.104 17967
2127 1 6 . 1 1 40 40 LEU H H 38 9.850 9.850 8.267 1.583 17967
2128 1 6 . 1 1 41 41 ARG N N 39 127.110 127.110 126.092 1.018 17967
2129 1 6 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.748 -0.228 17967
2130 1 6 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.248 -1.418 17967
2131 1 6 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.086 -2.156 17967
2132 1 6 . 1 1 41 41 ARG H H 39 8.970 8.970 8.908 0.062 17967
2133 1 6 . 1 1 42 42 ARG N N 40 115.810 115.810 117.585 -1.775 17967
2134 1 6 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.268 -0.188 17967
2135 1 6 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.127 0.003 17967
2136 1 6 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.070 0.260 17967
2137 1 6 . 1 1 42 42 ARG H H 40 8.610 8.610 8.655 -0.045 17967
2138 1 6 . 1 1 43 43 GLU N N 41 119.910 119.910 119.021 0.889 17967
2139 1 6 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.380 -0.130 17967
2140 1 6 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.480 0.550 17967
2141 1 6 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.006 1.324 17967
2142 1 6 . 1 1 43 43 GLU H H 41 6.950 6.950 7.752 -0.802 17967
2143 1 6 . 1 1 44 44 VAL N N 42 125.010 125.010 119.953 5.057 17967
2144 1 6 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.525 -0.285 17967
2145 1 6 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.153 1.477 17967
2146 1 6 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.450 -0.120 17967
2147 1 6 . 1 1 44 44 VAL H H 42 7.820 7.820 7.872 -0.052 17967
2148 1 6 . 1 1 45 45 TYR N N 43 118.410 118.410 118.680 -0.270 17967
2149 1 6 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.174 0.256 17967
2150 1 6 . 1 1 45 45 TYR CA C 43 58.830 58.830 60.131 -1.301 17967
2151 1 6 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.311 -0.581 17967
2152 1 6 . 1 1 45 45 TYR H H 43 7.820 7.820 7.844 -0.024 17967
2153 1 6 . 1 1 46 46 ASP N N 44 122.410 122.410 119.942 2.468 17967
2154 1 6 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.346 0.254 17967
2155 1 6 . 1 1 46 46 ASP CA C 44 57.830 57.830 58.397 -0.567 17967
2156 1 6 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.536 0.494 17967
2157 1 6 . 1 1 46 46 ASP H H 44 8.540 8.540 8.083 0.457 17967
2158 1 6 . 1 1 47 47 PHE N N 45 126.210 126.210 119.083 7.127 17967
2159 1 6 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.082 -0.172 17967
2160 1 6 . 1 1 47 47 PHE CA C 45 62.630 62.630 62.022 0.608 17967
2161 1 6 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.036 0.294 17967
2162 1 6 . 1 1 47 47 PHE H H 45 8.320 8.320 7.572 0.748 17967
2163 1 6 . 1 1 48 48 ALA N N 46 119.110 119.110 120.062 -0.952 17967
2164 1 6 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.359 0.161 17967
2165 1 6 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.739 0.491 17967
2166 1 6 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.826 -0.096 17967
2167 1 6 . 1 1 48 48 ALA H H 46 7.740 7.740 7.708 0.032 17967
2168 1 6 . 1 1 49 49 ARG N N 47 124.010 124.010 117.854 6.156 17967
2169 1 6 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.282 -0.232 17967
2170 1 6 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.478 2.152 17967
2171 1 6 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.518 -0.088 17967
2172 1 6 . 1 1 49 49 ARG H H 47 8.500 8.500 8.197 0.303 17967
2173 1 6 . 1 1 50 50 ARG N N 48 119.110 119.110 118.003 1.107 17967
2174 1 6 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.494 -0.484 17967
2175 1 6 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.756 2.374 17967
2176 1 6 . 1 1 50 50 ARG CB C 48 31.130 31.130 31.761 -0.631 17967
2177 1 6 . 1 1 50 50 ARG H H 48 7.940 7.940 7.820 0.120 17967
2178 1 6 . 1 1 51 51 ASP N N 49 120.910 120.910 120.359 0.551 17967
2179 1 6 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.716 -0.296 17967
2180 1 6 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.761 0.769 17967
2181 1 6 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.727 -0.798 17967
2182 1 6 . 1 1 51 51 ASP H H 49 7.950 7.950 8.489 -0.539 17967
2183 1 6 . 1 1 52 52 LEU N N 50 118.410 118.410 123.316 -4.906 17967
2184 1 6 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.502 -0.352 17967
2185 1 6 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.405 0.825 17967
2186 1 6 . 1 1 52 52 LEU CB C 50 41.130 41.130 43.349 -2.219 17967
2187 1 6 . 1 1 52 52 LEU H H 50 6.640 6.640 7.433 -0.793 17967
2188 1 6 . 1 1 53 53 CYS N N 51 117.410 117.410 118.552 -1.142 17967
2189 1 6 . 1 1 53 53 CYS HA H 51 4.930 4.930 4.941 -0.011 17967
2190 1 6 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.136 2.794 17967
2191 1 6 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.138 -1.508 17967
2192 1 6 . 1 1 53 53 CYS H H 51 8.030 8.030 8.123 -0.093 17967
2193 1 6 . 1 1 54 54 ILE N N 52 125.110 125.110 122.737 2.373 17967
2194 1 6 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.316 -0.306 17967
2195 1 6 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.791 -2.161 17967
2196 1 6 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.749 -1.419 17967
2197 1 6 . 1 1 54 54 ILE H H 52 8.500 8.500 8.646 -0.146 17967
2198 1 6 . 1 1 55 55 VAL N N 53 127.010 127.010 123.239 3.771 17967
2199 1 6 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.604 -0.234 17967
2200 1 6 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.705 -0.075 17967
2201 1 6 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.924 1.306 17967
2202 1 6 . 1 1 55 55 VAL H H 53 8.130 8.130 8.233 -0.103 17967
2203 1 6 . 1 1 56 56 TYR N N 54 124.910 124.910 126.206 -1.296 17967
2204 1 6 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.227 0.173 17967
2205 1 6 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.480 -0.150 17967
2206 1 6 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.580 1.450 17967
2207 1 6 . 1 1 56 56 TYR H H 54 8.700 8.700 8.739 -0.039 17967
2208 1 6 . 1 1 57 57 ARG N N 55 123.810 123.810 125.228 -1.418 17967
2209 1 6 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.419 0.221 17967
2210 1 6 . 1 1 57 57 ARG CA C 55 55.430 55.430 56.136 -0.706 17967
2211 1 6 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.289 2.541 17967
2212 1 6 . 1 1 57 57 ARG H H 55 8.870 8.870 8.432 0.438 17967
2213 1 6 . 1 1 58 58 ASP N N 56 129.110 129.110 124.647 4.463 17967
2214 1 6 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.353 -0.043 17967
2215 1 6 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.969 -1.139 17967
2216 1 6 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.044 0.086 17967
2217 1 6 . 1 1 58 58 ASP H H 56 9.620 9.620 9.016 0.604 17967
2218 1 6 . 1 1 59 59 GLY N N 57 104.510 104.510 108.756 -4.246 17967
2219 1 6 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.187 0.443 17967
2220 1 6 . 1 1 59 59 GLY H H 57 8.720 8.720 8.394 0.326 17967
2221 1 6 . 1 1 60 60 ASN N N 58 122.210 122.210 119.372 2.838 17967
2222 1 6 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.210 0.190 17967
2223 1 6 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.905 -0.575 17967
2224 1 6 . 1 1 60 60 ASN CB C 58 40.430 40.430 40.767 -0.337 17967
2225 1 6 . 1 1 60 60 ASN H H 58 8.120 8.120 7.885 0.235 17967
2226 1 6 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.599 0.191 17967
2227 1 6 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.328 -0.298 17967
2228 1 6 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.345 2.185 17967
2229 1 6 . 1 1 62 62 TYR N N 60 119.810 119.810 121.667 -1.857 17967
2230 1 6 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.461 -0.101 17967
2231 1 6 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.515 1.715 17967
2232 1 6 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.415 1.015 17967
2233 1 6 . 1 1 62 62 TYR H H 60 8.590 8.590 7.616 0.974 17967
2234 1 6 . 1 1 63 63 ALA N N 61 123.810 123.810 121.342 2.468 17967
2235 1 6 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.143 0.277 17967
2236 1 6 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.218 0.112 17967
2237 1 6 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.717 -0.387 17967
2238 1 6 . 1 1 63 63 ALA H H 61 8.010 8.010 8.803 -0.793 17967
2239 1 6 . 1 1 64 64 VAL N N 62 120.510 120.510 117.982 2.528 17967
2240 1 6 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.285 1.215 17967
2241 1 6 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.662 -0.432 17967
2242 1 6 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.051 3.279 17967
2243 1 6 . 1 1 64 64 VAL H H 62 6.380 6.380 8.373 -1.993 17967
2244 1 6 . 1 1 65 65 CYS N N 63 130.310 130.310 126.111 4.199 17967
2245 1 6 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.398 0.162 17967
2246 1 6 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.504 -0.074 17967
2247 1 6 . 1 1 65 65 CYS CB C 63 31.130 31.130 28.969 2.161 17967
2248 1 6 . 1 1 65 65 CYS H H 63 9.430 9.430 8.250 1.180 17967
2249 1 6 . 1 1 66 66 ASP N N 64 121.110 121.110 121.504 -0.394 17967
2250 1 6 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.392 0.018 17967
2251 1 6 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.415 -0.185 17967
2252 1 6 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.828 1.502 17967
2253 1 6 . 1 1 66 66 ASP H H 64 9.120 9.120 8.683 0.437 17967
2254 1 6 . 1 1 67 67 LYS N N 65 122.110 122.110 119.040 3.070 17967
2255 1 6 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.789 0.221 17967
2256 1 6 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.656 1.474 17967
2257 1 6 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.332 0.498 17967
2258 1 6 . 1 1 67 67 LYS H H 65 8.330 8.330 7.673 0.657 17967
2259 1 6 . 1 1 68 68 CYS N N 66 125.610 125.610 118.807 6.803 17967
2260 1 6 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.270 -0.160 17967
2261 1 6 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.207 1.323 17967
2262 1 6 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.375 4.355 17967
2263 1 6 . 1 1 68 68 CYS H H 66 8.700 8.700 7.485 1.215 17967
2264 1 6 . 1 1 69 69 LEU N N 67 125.310 125.310 122.198 3.112 17967
2265 1 6 . 1 1 69 69 LEU HA H 67 4.000 4.000 3.956 0.044 17967
2266 1 6 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.955 -0.425 17967
2267 1 6 . 1 1 69 69 LEU CB C 67 42.130 42.130 42.062 0.068 17967
2268 1 6 . 1 1 69 69 LEU H H 67 8.470 8.470 8.930 -0.460 17967
2269 1 6 . 1 1 70 70 LYS N N 68 119.010 119.010 118.907 0.103 17967
2270 1 6 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.011 -0.031 17967
2271 1 6 . 1 1 70 70 LYS CA C 68 58.830 58.830 59.141 -0.311 17967
2272 1 6 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.668 0.462 17967
2273 1 6 . 1 1 70 70 LYS H H 68 7.810 7.810 7.444 0.366 17967
2274 1 6 . 1 1 71 71 PHE N N 69 121.710 121.710 118.094 3.616 17967
2275 1 6 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.211 0.069 17967
2276 1 6 . 1 1 71 71 PHE CA C 69 59.930 59.930 58.775 1.155 17967
2277 1 6 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.063 1.367 17967
2278 1 6 . 1 1 71 71 PHE H H 69 7.810 7.810 6.969 0.841 17967
2279 1 6 . 1 1 72 72 TYR N N 70 120.110 120.110 117.703 2.407 17967
2280 1 6 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.517 -0.197 17967
2281 1 6 . 1 1 72 72 TYR CA C 70 60.330 60.330 59.428 0.902 17967
2282 1 6 . 1 1 72 72 TYR CB C 70 40.430 40.430 37.445 2.985 17967
2283 1 6 . 1 1 72 72 TYR H H 70 8.280 8.280 8.817 -0.537 17967
2284 1 6 . 1 1 73 73 SER N N 71 117.210 117.210 115.858 1.352 17967
2285 1 6 . 1 1 73 73 SER HA H 71 4.320 4.320 4.355 -0.035 17967
2286 1 6 . 1 1 73 73 SER CA C 71 60.130 60.130 61.570 -1.440 17967
2287 1 6 . 1 1 73 73 SER CB C 71 63.630 63.630 62.895 0.735 17967
2288 1 6 . 1 1 73 73 SER H H 71 7.870 7.870 8.385 -0.515 17967
2289 1 6 . 1 1 74 74 LYS N N 72 122.810 122.810 121.770 1.040 17967
2290 1 6 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.321 -0.051 17967
2291 1 6 . 1 1 74 74 LYS CA C 72 56.930 56.930 58.205 -1.275 17967
2292 1 6 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.806 -0.176 17967
2293 1 6 . 1 1 74 74 LYS H H 72 7.800 7.800 7.409 0.391 17967
2294 1 6 . 1 1 75 75 ILE N N 73 121.610 121.610 120.240 1.370 17967
2295 1 6 . 1 1 75 75 ILE HA H 73 4.110 4.110 3.796 0.314 17967
2296 1 6 . 1 1 75 75 ILE CA C 73 61.830 61.830 64.280 -2.450 17967
2297 1 6 . 1 1 75 75 ILE CB C 73 38.630 38.630 37.846 0.784 17967
2298 1 6 . 1 1 75 75 ILE H H 73 7.750 7.750 8.491 -0.741 17967
2299 1 6 . 1 1 76 76 SER N N 74 120.410 120.410 115.446 4.964 17967
2300 1 6 . 1 1 76 76 SER HA H 74 4.300 4.300 4.362 -0.062 17967
2301 1 6 . 1 1 76 76 SER CA C 74 59.330 59.330 61.179 -1.849 17967
2302 1 6 . 1 1 76 76 SER CB C 74 63.830 63.830 63.376 0.454 17967
2303 1 6 . 1 1 76 76 SER H H 74 8.130 8.130 8.009 0.121 17967
2304 1 6 . 1 1 77 77 GLU N N 75 123.810 123.810 120.685 3.125 17967
2305 1 6 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.332 -0.142 17967
2306 1 6 . 1 1 77 77 GLU CA C 75 57.330 57.330 56.841 0.489 17967
2307 1 6 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.591 -0.461 17967
2308 1 6 . 1 1 77 77 GLU H H 75 8.270 8.270 7.639 0.631 17967
2309 1 6 . 1 1 78 78 TYR N N 76 122.410 122.410 119.275 3.135 17967
2310 1 6 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.277 0.183 17967
2311 1 6 . 1 1 78 78 TYR CA C 76 58.130 58.130 59.028 -0.897 17967
2312 1 6 . 1 1 78 78 TYR CB C 76 38.630 38.630 36.896 1.734 17967
2313 1 6 . 1 1 78 78 TYR H H 76 7.980 7.980 8.289 -0.309 17967
2314 1 6 . 1 1 79 79 ARG N N 77 124.710 124.710 126.291 -1.581 17967
2315 1 6 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.795 -0.595 17967
2316 1 6 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.612 0.418 17967
2317 1 6 . 1 1 79 79 ARG CB C 77 31.030 31.030 31.177 -0.147 17967
2318 1 6 . 1 1 79 79 ARG H H 77 7.880 7.880 8.717 -0.837 17967
2319 1 6 . 1 1 80 80 HIS N N 78 122.110 122.110 121.016 1.094 17967
2320 1 6 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.919 -0.409 17967
2321 1 6 . 1 1 80 80 HIS CA C 78 56.330 56.330 54.646 1.684 17967
2322 1 6 . 1 1 80 80 HIS CB C 78 30.830 30.830 28.950 1.880 17967
2323 1 6 . 1 1 80 80 HIS H H 78 8.120 8.120 8.654 -0.534 17967
2324 1 6 . 1 1 81 81 TYR N N 79 123.610 123.610 124.894 -1.284 17967
2325 1 6 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.596 -0.006 17967
2326 1 6 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.731 0.099 17967
2327 1 6 . 1 1 81 81 TYR CB C 79 39.130 39.130 38.982 0.148 17967
2328 1 6 . 1 1 81 81 TYR H H 79 7.970 7.970 8.642 -0.672 17967
2329 1 7 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.477 -0.187 17967
2330 1 7 . 1 1 2 2 ALA CA C 0 52.530 52.530 52.648 -0.118 17967
2331 1 7 . 1 1 2 2 ALA CB C 0 19.730 19.730 19.385 0.345 17967
2332 1 7 . 1 1 3 3 MET N N 1 122.210 122.210 115.415 6.795 17967
2333 1 7 . 1 1 3 3 MET HA H 1 4.300 4.300 4.632 -0.332 17967
2334 1 7 . 1 1 3 3 MET CA C 1 56.030 56.030 53.425 2.605 17967
2335 1 7 . 1 1 3 3 MET CB C 1 33.430 33.430 31.412 2.018 17967
2336 1 7 . 1 1 3 3 MET H H 1 8.370 8.370 7.625 0.745 17967
2337 1 7 . 1 1 4 4 PHE N N 2 122.310 122.310 124.145 -1.835 17967
2338 1 7 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.357 0.273 17967
2339 1 7 . 1 1 4 4 PHE CA C 2 57.330 57.330 58.408 -1.078 17967
2340 1 7 . 1 1 4 4 PHE CB C 2 39.430 39.430 39.589 -0.159 17967
2341 1 7 . 1 1 4 4 PHE H H 2 8.370 8.370 7.894 0.476 17967
2342 1 7 . 1 1 5 5 GLN N N 3 123.510 123.510 122.779 0.731 17967
2343 1 7 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.422 -0.242 17967
2344 1 7 . 1 1 5 5 GLN CA C 3 56.130 56.130 54.767 1.363 17967
2345 1 7 . 1 1 5 5 GLN CB C 3 29.930 29.930 29.535 0.395 17967
2346 1 7 . 1 1 5 5 GLN H H 3 8.260 8.260 8.009 0.251 17967
2347 1 7 . 1 1 6 6 ASP N N 4 125.010 125.010 121.102 3.908 17967
2348 1 7 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.837 -0.047 17967
2349 1 7 . 1 1 6 6 ASP CA C 4 51.930 51.930 52.172 -0.242 17967
2350 1 7 . 1 1 6 6 ASP CB C 4 41.730 41.730 41.505 0.225 17967
2351 1 7 . 1 1 6 6 ASP H H 4 8.420 8.420 8.409 0.011 17967
2352 1 7 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.489 -0.369 17967
2353 1 7 . 1 1 7 7 PRO CA C 5 64.030 64.030 63.495 0.535 17967
2354 1 7 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.029 0.301 17967
2355 1 7 . 1 1 8 8 GLN N N 6 119.710 119.710 114.271 5.439 17967
2356 1 7 . 1 1 8 8 GLN HA H 6 4.160 4.160 3.941 0.219 17967
2357 1 7 . 1 1 8 8 GLN CA C 6 56.630 56.630 56.947 -0.317 17967
2358 1 7 . 1 1 8 8 GLN CB C 6 29.330 29.330 27.044 2.286 17967
2359 1 7 . 1 1 8 8 GLN H H 6 8.430 8.430 8.573 -0.143 17967
2360 1 7 . 1 1 9 9 GLU N N 7 122.110 122.110 117.309 4.801 17967
2361 1 7 . 1 1 9 9 GLU HA H 7 4.200 4.200 3.732 0.468 17967
2362 1 7 . 1 1 9 9 GLU CA C 7 56.030 56.030 58.479 -2.449 17967
2363 1 7 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.465 1.065 17967
2364 1 7 . 1 1 9 9 GLU H H 7 7.940 7.940 8.658 -0.718 17967
2365 1 7 . 1 1 10 10 ARG N N 8 123.410 123.410 117.192 6.218 17967
2366 1 7 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.240 0.160 17967
2367 1 7 . 1 1 10 10 ARG CA C 8 54.130 54.130 56.105 -1.975 17967
2368 1 7 . 1 1 10 10 ARG CB C 8 29.330 29.330 29.453 -0.122 17967
2369 1 7 . 1 1 10 10 ARG H H 8 7.660 7.660 8.313 -0.653 17967
2370 1 7 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.623 -0.273 17967
2371 1 7 . 1 1 11 11 PRO CA C 9 63.530 63.530 61.517 2.013 17967
2372 1 7 . 1 1 11 11 PRO CB C 9 32.630 32.630 32.748 -0.118 17967
2373 1 7 . 1 1 12 12 ARG N N 10 123.810 123.810 117.823 5.987 17967
2374 1 7 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.768 -0.098 17967
2375 1 7 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.556 1.274 17967
2376 1 7 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.172 1.359 17967
2377 1 7 . 1 1 12 12 ARG H H 10 8.710 8.710 8.693 0.017 17967
2378 1 7 . 1 1 13 13 LYS N N 11 118.410 118.410 118.970 -0.560 17967
2379 1 7 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.775 0.275 17967
2380 1 7 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.164 -0.834 17967
2381 1 7 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.040 1.390 17967
2382 1 7 . 1 1 13 13 LYS H H 11 7.800 7.800 7.430 0.370 17967
2383 1 7 . 1 1 14 14 LEU N N 12 125.010 125.010 126.178 -1.168 17967
2384 1 7 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.157 0.013 17967
2385 1 7 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.523 0.207 17967
2386 1 7 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.980 0.550 17967
2387 1 7 . 1 1 14 14 LEU H H 12 10.210 10.210 9.283 0.927 17967
2388 1 7 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.276 -0.056 17967
2389 1 7 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.624 1.606 17967
2390 1 7 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.084 -0.353 17967
2391 1 7 . 1 1 16 16 GLN N N 14 117.810 117.810 116.757 1.053 17967
2392 1 7 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.141 0.049 17967
2393 1 7 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.676 0.354 17967
2394 1 7 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.215 0.415 17967
2395 1 7 . 1 1 16 16 GLN H H 14 7.110 7.110 8.416 -1.306 17967
2396 1 7 . 1 1 17 17 LEU N N 15 124.710 124.710 122.067 2.643 17967
2397 1 7 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.185 -0.175 17967
2398 1 7 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.545 0.785 17967
2399 1 7 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.754 0.276 17967
2400 1 7 . 1 1 17 17 LEU H H 15 8.010 8.010 7.761 0.249 17967
2401 1 7 . 1 1 18 18 CYS N N 16 117.210 117.210 117.155 0.055 17967
2402 1 7 . 1 1 18 18 CYS HA H 16 3.750 3.750 4.021 -0.271 17967
2403 1 7 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.723 1.007 17967
2404 1 7 . 1 1 18 18 CYS CB C 16 26.230 26.230 25.924 0.306 17967
2405 1 7 . 1 1 18 18 CYS H H 16 8.380 8.380 8.293 0.087 17967
2406 1 7 . 1 1 19 19 THR N N 17 117.810 117.810 115.562 2.248 17967
2407 1 7 . 1 1 19 19 THR HA H 17 4.000 4.000 4.014 -0.014 17967
2408 1 7 . 1 1 19 19 THR CA C 17 66.830 66.830 67.157 -0.327 17967
2409 1 7 . 1 1 19 19 THR CB C 17 68.830 68.830 68.517 0.313 17967
2410 1 7 . 1 1 19 19 THR H H 17 7.720 7.720 7.664 0.056 17967
2411 1 7 . 1 1 20 20 GLU N N 18 125.410 125.410 120.504 4.906 17967
2412 1 7 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.184 -0.114 17967
2413 1 7 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.746 0.984 17967
2414 1 7 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.344 0.386 17967
2415 1 7 . 1 1 20 20 GLU H H 18 8.010 8.010 7.776 0.234 17967
2416 1 7 . 1 1 21 21 LEU N N 19 118.810 118.810 118.308 0.502 17967
2417 1 7 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.205 0.095 17967
2418 1 7 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.916 -1.086 17967
2419 1 7 . 1 1 21 21 LEU CB C 19 42.330 42.330 42.096 0.234 17967
2420 1 7 . 1 1 21 21 LEU H H 19 8.010 8.010 7.859 0.151 17967
2421 1 7 . 1 1 22 22 GLN N N 20 118.310 118.310 115.430 2.880 17967
2422 1 7 . 1 1 22 22 GLN HA H 20 3.950 3.950 3.958 -0.008 17967
2423 1 7 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.334 -0.604 17967
2424 1 7 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.402 -0.272 17967
2425 1 7 . 1 1 22 22 GLN H H 20 7.860 7.860 7.673 0.187 17967
2426 1 7 . 1 1 23 23 THR N N 21 115.910 115.910 112.475 3.435 17967
2427 1 7 . 1 1 23 23 THR HA H 21 4.950 4.950 4.634 0.316 17967
2428 1 7 . 1 1 23 23 THR CA C 21 58.530 58.530 60.121 -1.591 17967
2429 1 7 . 1 1 23 23 THR CB C 21 70.330 70.330 70.648 -0.318 17967
2430 1 7 . 1 1 23 23 THR H H 21 8.250 8.250 8.368 -0.118 17967
2431 1 7 . 1 1 24 24 THR N N 22 112.810 112.810 113.981 -1.171 17967
2432 1 7 . 1 1 24 24 THR HA H 22 4.880 4.880 4.659 0.221 17967
2433 1 7 . 1 1 24 24 THR CA C 22 59.730 59.730 59.676 0.054 17967
2434 1 7 . 1 1 24 24 THR CB C 22 74.130 74.130 71.412 2.718 17967
2435 1 7 . 1 1 24 24 THR H H 22 8.660 8.660 7.847 0.813 17967
2436 1 7 . 1 1 25 25 ILE N N 23 123.710 123.710 119.657 4.053 17967
2437 1 7 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.643 0.137 17967
2438 1 7 . 1 1 25 25 ILE CA C 23 63.430 63.430 63.850 -0.420 17967
2439 1 7 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.756 0.874 17967
2440 1 7 . 1 1 25 25 ILE H H 23 9.060 9.060 8.247 0.813 17967
2441 1 7 . 1 1 26 26 HIS N N 24 119.510 119.510 113.624 5.886 17967
2442 1 7 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.657 -0.217 17967
2443 1 7 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.928 1.102 17967
2444 1 7 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.328 1.502 17967
2445 1 7 . 1 1 26 26 HIS H H 24 7.040 7.040 7.431 -0.391 17967
2446 1 7 . 1 1 27 27 ASP N N 25 116.810 116.810 118.002 -1.192 17967
2447 1 7 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.612 0.148 17967
2448 1 7 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.144 0.286 17967
2449 1 7 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.002 1.328 17967
2450 1 7 . 1 1 27 27 ASP H H 25 7.250 7.250 7.475 -0.225 17967
2451 1 7 . 1 1 28 28 ILE N N 26 123.210 123.210 122.030 1.180 17967
2452 1 7 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.896 0.034 17967
2453 1 7 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.645 0.384 17967
2454 1 7 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.556 -0.626 17967
2455 1 7 . 1 1 28 28 ILE H H 26 7.750 7.750 7.947 -0.197 17967
2456 1 7 . 1 1 29 29 ILE N N 27 131.110 131.110 129.852 1.258 17967
2457 1 7 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.178 0.202 17967
2458 1 7 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.654 -0.824 17967
2459 1 7 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.444 1.187 17967
2460 1 7 . 1 1 29 29 ILE H H 27 8.270 8.270 8.458 -0.188 17967
2461 1 7 . 1 1 30 30 LEU N N 28 129.410 129.410 129.117 0.293 17967
2462 1 7 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.546 0.114 17967
2463 1 7 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.274 -0.744 17967
2464 1 7 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.022 3.308 17967
2465 1 7 . 1 1 30 30 LEU H H 28 8.500 8.500 8.257 0.243 17967
2466 1 7 . 1 1 31 31 GLU N N 29 121.910 121.910 120.979 0.931 17967
2467 1 7 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.736 -0.056 17967
2468 1 7 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.287 0.643 17967
2469 1 7 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.510 0.520 17967
2470 1 7 . 1 1 31 31 GLU H H 29 8.860 8.860 8.139 0.721 17967
2471 1 7 . 1 1 32 32 CYS N N 30 125.710 125.710 120.389 5.321 17967
2472 1 7 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.954 -0.934 17967
2473 1 7 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.486 -1.256 17967
2474 1 7 . 1 1 32 32 CYS CB C 30 31.730 31.730 27.069 4.661 17967
2475 1 7 . 1 1 32 32 CYS H H 30 8.270 8.270 8.554 -0.284 17967
2476 1 7 . 1 1 33 33 VAL N N 31 132.310 132.310 128.400 3.910 17967
2477 1 7 . 1 1 33 33 VAL HA H 31 3.100 3.100 2.659 0.441 17967
2478 1 7 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.221 -0.991 17967
2479 1 7 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.810 -0.180 17967
2480 1 7 . 1 1 33 33 VAL H H 31 8.860 8.860 7.840 1.020 17967
2481 1 7 . 1 1 34 34 TYR N N 32 124.310 124.310 117.116 7.194 17967
2482 1 7 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.567 -0.127 17967
2483 1 7 . 1 1 34 34 TYR CA C 32 61.030 61.030 60.241 0.789 17967
2484 1 7 . 1 1 34 34 TYR CB C 32 40.130 40.130 37.712 2.418 17967
2485 1 7 . 1 1 34 34 TYR H H 32 8.590 8.590 7.395 1.195 17967
2486 1 7 . 1 1 35 35 CYS N N 33 119.810 119.810 116.242 3.568 17967
2487 1 7 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.541 0.299 17967
2488 1 7 . 1 1 35 35 CYS CA C 33 59.430 59.430 59.515 -0.085 17967
2489 1 7 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.642 3.588 17967
2490 1 7 . 1 1 35 35 CYS H H 33 8.070 8.070 7.659 0.411 17967
2491 1 7 . 1 1 36 36 LYS N N 34 119.910 119.910 114.887 5.023 17967
2492 1 7 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.891 0.299 17967
2493 1 7 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.304 0.526 17967
2494 1 7 . 1 1 36 36 LYS CB C 34 29.330 29.330 29.467 -0.137 17967
2495 1 7 . 1 1 36 36 LYS H H 34 7.860 7.860 7.905 -0.045 17967
2496 1 7 . 1 1 37 37 GLN N N 35 120.710 120.710 116.655 4.055 17967
2497 1 7 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.489 -0.129 17967
2498 1 7 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.541 0.889 17967
2499 1 7 . 1 1 37 37 GLN CB C 35 29.630 29.630 29.349 0.281 17967
2500 1 7 . 1 1 37 37 GLN H H 35 8.270 8.270 7.919 0.351 17967
2501 1 7 . 1 1 38 38 GLN N N 36 123.710 123.710 124.071 -0.361 17967
2502 1 7 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.243 0.057 17967
2503 1 7 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.395 0.335 17967
2504 1 7 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.953 0.377 17967
2505 1 7 . 1 1 38 38 GLN H H 36 8.640 8.640 8.576 0.064 17967
2506 1 7 . 1 1 39 39 LEU N N 37 131.310 131.310 125.754 5.556 17967
2507 1 7 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.132 -0.022 17967
2508 1 7 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.920 1.410 17967
2509 1 7 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.402 -0.472 17967
2510 1 7 . 1 1 39 39 LEU H H 37 8.870 8.870 8.070 0.800 17967
2511 1 7 . 1 1 40 40 LEU N N 38 126.310 126.310 124.242 2.068 17967
2512 1 7 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.402 -0.092 17967
2513 1 7 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.560 -0.330 17967
2514 1 7 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.476 -0.346 17967
2515 1 7 . 1 1 40 40 LEU H H 38 9.850 9.850 8.224 1.626 17967
2516 1 7 . 1 1 41 41 ARG N N 39 127.110 127.110 126.566 0.544 17967
2517 1 7 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.788 -0.268 17967
2518 1 7 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.390 -1.560 17967
2519 1 7 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.026 -2.096 17967
2520 1 7 . 1 1 41 41 ARG H H 39 8.970 8.970 8.837 0.133 17967
2521 1 7 . 1 1 42 42 ARG N N 40 115.810 115.810 119.715 -3.905 17967
2522 1 7 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.364 -0.284 17967
2523 1 7 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.948 -0.818 17967
2524 1 7 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.927 -0.598 17967
2525 1 7 . 1 1 42 42 ARG H H 40 8.610 8.610 8.758 -0.148 17967
2526 1 7 . 1 1 43 43 GLU N N 41 119.910 119.910 118.684 1.226 17967
2527 1 7 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.626 -0.376 17967
2528 1 7 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.190 0.840 17967
2529 1 7 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.222 1.108 17967
2530 1 7 . 1 1 43 43 GLU H H 41 6.950 6.950 8.010 -1.060 17967
2531 1 7 . 1 1 44 44 VAL N N 42 125.010 125.010 120.826 4.184 17967
2532 1 7 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.530 -0.290 17967
2533 1 7 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.433 1.197 17967
2534 1 7 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.537 -0.207 17967
2535 1 7 . 1 1 44 44 VAL H H 42 7.820 7.820 7.971 -0.151 17967
2536 1 7 . 1 1 45 45 TYR N N 43 118.410 118.410 118.623 -0.213 17967
2537 1 7 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.124 0.306 17967
2538 1 7 . 1 1 45 45 TYR CA C 43 58.830 58.830 61.366 -2.536 17967
2539 1 7 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.531 -0.801 17967
2540 1 7 . 1 1 45 45 TYR H H 43 7.820 7.820 8.510 -0.690 17967
2541 1 7 . 1 1 46 46 ASP N N 44 122.410 122.410 119.506 2.904 17967
2542 1 7 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.363 0.237 17967
2543 1 7 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.770 0.060 17967
2544 1 7 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.346 0.684 17967
2545 1 7 . 1 1 46 46 ASP H H 44 8.540 8.540 7.988 0.552 17967
2546 1 7 . 1 1 47 47 PHE N N 45 126.210 126.210 120.148 6.062 17967
2547 1 7 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.175 -0.265 17967
2548 1 7 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.871 0.759 17967
2549 1 7 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.139 0.191 17967
2550 1 7 . 1 1 47 47 PHE H H 45 8.320 8.320 7.807 0.513 17967
2551 1 7 . 1 1 48 48 ALA N N 46 119.110 119.110 119.646 -0.536 17967
2552 1 7 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.335 0.185 17967
2553 1 7 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.762 0.468 17967
2554 1 7 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.575 0.155 17967
2555 1 7 . 1 1 48 48 ALA H H 46 7.740 7.740 7.778 -0.038 17967
2556 1 7 . 1 1 49 49 ARG N N 47 124.010 124.010 118.617 5.393 17967
2557 1 7 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.255 -0.205 17967
2558 1 7 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.731 1.899 17967
2559 1 7 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.516 -0.086 17967
2560 1 7 . 1 1 49 49 ARG H H 47 8.500 8.500 8.514 -0.014 17967
2561 1 7 . 1 1 50 50 ARG N N 48 119.110 119.110 117.930 1.180 17967
2562 1 7 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.543 -0.533 17967
2563 1 7 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.891 2.239 17967
2564 1 7 . 1 1 50 50 ARG CB C 48 31.130 31.130 32.109 -0.979 17967
2565 1 7 . 1 1 50 50 ARG H H 48 7.940 7.940 7.874 0.066 17967
2566 1 7 . 1 1 51 51 ASP N N 49 120.910 120.910 120.332 0.578 17967
2567 1 7 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.749 -0.329 17967
2568 1 7 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.569 0.961 17967
2569 1 7 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.740 -0.810 17967
2570 1 7 . 1 1 51 51 ASP H H 49 7.950 7.950 8.281 -0.331 17967
2571 1 7 . 1 1 52 52 LEU N N 50 118.410 118.410 123.284 -4.874 17967
2572 1 7 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.476 -0.326 17967
2573 1 7 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.305 0.925 17967
2574 1 7 . 1 1 52 52 LEU CB C 50 41.130 41.130 43.050 -1.920 17967
2575 1 7 . 1 1 52 52 LEU H H 50 6.640 6.640 7.628 -0.988 17967
2576 1 7 . 1 1 53 53 CYS N N 51 117.410 117.410 117.632 -0.222 17967
2577 1 7 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.544 -0.614 17967
2578 1 7 . 1 1 53 53 CYS CA C 51 58.930 58.930 55.491 3.439 17967
2579 1 7 . 1 1 53 53 CYS CB C 51 28.630 28.630 29.493 -0.863 17967
2580 1 7 . 1 1 53 53 CYS H H 51 8.030 8.030 8.196 -0.166 17967
2581 1 7 . 1 1 54 54 ILE N N 52 125.110 125.110 123.254 1.856 17967
2582 1 7 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.291 -0.281 17967
2583 1 7 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.720 -2.090 17967
2584 1 7 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.809 -1.479 17967
2585 1 7 . 1 1 54 54 ILE H H 52 8.500 8.500 8.512 -0.012 17967
2586 1 7 . 1 1 55 55 VAL N N 53 127.010 127.010 124.099 2.911 17967
2587 1 7 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.552 -0.182 17967
2588 1 7 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.072 0.558 17967
2589 1 7 . 1 1 55 55 VAL CB C 53 34.230 34.230 31.833 2.397 17967
2590 1 7 . 1 1 55 55 VAL H H 53 8.130 8.130 8.208 -0.078 17967
2591 1 7 . 1 1 56 56 TYR N N 54 124.910 124.910 126.945 -2.035 17967
2592 1 7 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.151 0.249 17967
2593 1 7 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.508 -0.178 17967
2594 1 7 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.312 1.718 17967
2595 1 7 . 1 1 56 56 TYR H H 54 8.700 8.700 8.437 0.263 17967
2596 1 7 . 1 1 57 57 ARG N N 55 123.810 123.810 125.872 -2.062 17967
2597 1 7 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.224 0.416 17967
2598 1 7 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.752 -0.321 17967
2599 1 7 . 1 1 57 57 ARG CB C 55 32.830 32.830 29.617 3.213 17967
2600 1 7 . 1 1 57 57 ARG H H 55 8.870 8.870 8.428 0.442 17967
2601 1 7 . 1 1 58 58 ASP N N 56 129.110 129.110 125.476 3.634 17967
2602 1 7 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.265 0.045 17967
2603 1 7 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.314 -0.484 17967
2604 1 7 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.162 -0.032 17967
2605 1 7 . 1 1 58 58 ASP H H 56 9.620 9.620 8.481 1.139 17967
2606 1 7 . 1 1 59 59 GLY N N 57 104.510 104.510 106.147 -1.637 17967
2607 1 7 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.451 0.179 17967
2608 1 7 . 1 1 59 59 GLY H H 57 8.720 8.720 8.237 0.483 17967
2609 1 7 . 1 1 60 60 ASN N N 58 122.210 122.210 119.524 2.686 17967
2610 1 7 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.210 0.190 17967
2611 1 7 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.506 -0.176 17967
2612 1 7 . 1 1 60 60 ASN CB C 58 40.430 40.430 40.812 -0.382 17967
2613 1 7 . 1 1 60 60 ASN H H 58 8.120 8.120 7.974 0.146 17967
2614 1 7 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.403 0.387 17967
2615 1 7 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.233 -0.204 17967
2616 1 7 . 1 1 61 61 PRO CB C 59 33.530 33.530 30.774 2.756 17967
2617 1 7 . 1 1 62 62 TYR N N 60 119.810 119.810 122.682 -2.872 17967
2618 1 7 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.495 -0.135 17967
2619 1 7 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.227 2.003 17967
2620 1 7 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.430 1.000 17967
2621 1 7 . 1 1 62 62 TYR H H 60 8.590 8.590 7.590 1.000 17967
2622 1 7 . 1 1 63 63 ALA N N 61 123.810 123.810 122.237 1.573 17967
2623 1 7 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.089 0.331 17967
2624 1 7 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.465 -0.135 17967
2625 1 7 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.450 -0.120 17967
2626 1 7 . 1 1 63 63 ALA H H 61 8.010 8.010 8.591 -0.581 17967
2627 1 7 . 1 1 64 64 VAL N N 62 120.510 120.510 119.536 0.974 17967
2628 1 7 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.163 1.337 17967
2629 1 7 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.564 -0.334 17967
2630 1 7 . 1 1 64 64 VAL CB C 62 36.330 36.330 32.548 3.782 17967
2631 1 7 . 1 1 64 64 VAL H H 62 6.380 6.380 8.399 -2.019 17967
2632 1 7 . 1 1 65 65 CYS N N 63 130.310 130.310 126.276 4.034 17967
2633 1 7 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.373 0.187 17967
2634 1 7 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.643 -0.213 17967
2635 1 7 . 1 1 65 65 CYS CB C 63 31.130 31.130 28.593 2.537 17967
2636 1 7 . 1 1 65 65 CYS H H 63 9.430 9.430 8.597 0.833 17967
2637 1 7 . 1 1 66 66 ASP N N 64 121.110 121.110 121.075 0.035 17967
2638 1 7 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.318 0.092 17967
2639 1 7 . 1 1 66 66 ASP CA C 64 58.230 58.230 57.991 0.239 17967
2640 1 7 . 1 1 66 66 ASP CB C 64 42.330 42.330 41.081 1.250 17967
2641 1 7 . 1 1 66 66 ASP H H 64 9.120 9.120 8.802 0.318 17967
2642 1 7 . 1 1 67 67 LYS N N 65 122.110 122.110 119.467 2.643 17967
2643 1 7 . 1 1 67 67 LYS HA H 65 4.010 4.010 4.232 -0.222 17967
2644 1 7 . 1 1 67 67 LYS CA C 65 60.130 60.130 59.054 1.076 17967
2645 1 7 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.502 0.328 17967
2646 1 7 . 1 1 67 67 LYS H H 65 8.330 8.330 7.752 0.578 17967
2647 1 7 . 1 1 68 68 CYS N N 66 125.610 125.610 119.642 5.968 17967
2648 1 7 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.242 -0.132 17967
2649 1 7 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.024 1.506 17967
2650 1 7 . 1 1 68 68 CYS CB C 66 30.730 30.730 25.761 4.969 17967
2651 1 7 . 1 1 68 68 CYS H H 66 8.700 8.700 7.815 0.885 17967
2652 1 7 . 1 1 69 69 LEU N N 67 125.310 125.310 121.912 3.398 17967
2653 1 7 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.114 -0.114 17967
2654 1 7 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.867 -0.337 17967
2655 1 7 . 1 1 69 69 LEU CB C 67 42.130 42.130 42.304 -0.174 17967
2656 1 7 . 1 1 69 69 LEU H H 67 8.470 8.470 8.494 -0.024 17967
2657 1 7 . 1 1 70 70 LYS N N 68 119.010 119.010 116.246 2.764 17967
2658 1 7 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.265 -0.285 17967
2659 1 7 . 1 1 70 70 LYS CA C 68 58.830 58.830 57.634 1.196 17967
2660 1 7 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.306 0.824 17967
2661 1 7 . 1 1 70 70 LYS H H 68 7.810 7.810 7.846 -0.036 17967
2662 1 7 . 1 1 71 71 PHE N N 69 121.710 121.710 119.527 2.183 17967
2663 1 7 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.097 0.183 17967
2664 1 7 . 1 1 71 71 PHE CA C 69 59.930 59.930 61.283 -1.353 17967
2665 1 7 . 1 1 71 71 PHE CB C 69 39.430 39.430 39.868 -0.438 17967
2666 1 7 . 1 1 71 71 PHE H H 69 7.810 7.810 7.647 0.163 17967
2667 1 7 . 1 1 72 72 TYR N N 70 120.110 120.110 117.386 2.724 17967
2668 1 7 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.811 -0.491 17967
2669 1 7 . 1 1 72 72 TYR CA C 70 60.330 60.330 57.164 3.166 17967
2670 1 7 . 1 1 72 72 TYR CB C 70 40.430 40.430 37.709 2.721 17967
2671 1 7 . 1 1 72 72 TYR H H 70 8.280 8.280 8.331 -0.051 17967
2672 1 7 . 1 1 73 73 SER N N 71 117.210 117.210 116.580 0.630 17967
2673 1 7 . 1 1 73 73 SER HA H 71 4.320 4.320 4.563 -0.243 17967
2674 1 7 . 1 1 73 73 SER CA C 71 60.130 60.130 59.535 0.595 17967
2675 1 7 . 1 1 73 73 SER CB C 71 63.630 63.630 64.132 -0.502 17967
2676 1 7 . 1 1 73 73 SER H H 71 7.870 7.870 8.474 -0.604 17967
2677 1 7 . 1 1 74 74 LYS N N 72 122.810 122.810 123.506 -0.696 17967
2678 1 7 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.265 0.005 17967
2679 1 7 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.256 -0.326 17967
2680 1 7 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.663 -0.033 17967
2681 1 7 . 1 1 74 74 LYS H H 72 7.800 7.800 8.268 -0.468 17967
2682 1 7 . 1 1 75 75 ILE N N 73 121.610 121.610 119.361 2.249 17967
2683 1 7 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.333 -0.223 17967
2684 1 7 . 1 1 75 75 ILE CA C 73 61.830 61.830 62.074 -0.244 17967
2685 1 7 . 1 1 75 75 ILE CB C 73 38.630 38.630 37.630 1.000 17967
2686 1 7 . 1 1 75 75 ILE H H 73 7.750 7.750 8.367 -0.617 17967
2687 1 7 . 1 1 76 76 SER N N 74 120.410 120.410 121.511 -1.101 17967
2688 1 7 . 1 1 76 76 SER HA H 74 4.300 4.300 4.893 -0.593 17967
2689 1 7 . 1 1 76 76 SER CA C 74 59.330 59.330 59.243 0.087 17967
2690 1 7 . 1 1 76 76 SER CB C 74 63.830 63.830 65.631 -1.801 17967
2691 1 7 . 1 1 76 76 SER H H 74 8.130 8.130 8.679 -0.549 17967
2692 1 7 . 1 1 77 77 GLU N N 75 123.810 123.810 122.790 1.020 17967
2693 1 7 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.602 -0.412 17967
2694 1 7 . 1 1 77 77 GLU CA C 75 57.330 57.330 56.048 1.282 17967
2695 1 7 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.131 -0.001 17967
2696 1 7 . 1 1 77 77 GLU H H 75 8.270 8.270 8.607 -0.337 17967
2697 1 7 . 1 1 78 78 TYR N N 76 122.410 122.410 123.502 -1.092 17967
2698 1 7 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.647 -0.187 17967
2699 1 7 . 1 1 78 78 TYR CA C 76 58.130 58.130 58.369 -0.239 17967
2700 1 7 . 1 1 78 78 TYR CB C 76 38.630 38.630 41.883 -3.252 17967
2701 1 7 . 1 1 78 78 TYR H H 76 7.980 7.980 8.505 -0.525 17967
2702 1 7 . 1 1 79 79 ARG N N 77 124.710 124.710 121.424 3.286 17967
2703 1 7 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.969 -0.769 17967
2704 1 7 . 1 1 79 79 ARG CA C 77 56.030 56.030 56.227 -0.197 17967
2705 1 7 . 1 1 79 79 ARG CB C 77 31.030 31.030 29.855 1.175 17967
2706 1 7 . 1 1 79 79 ARG H H 77 7.880 7.880 8.961 -1.081 17967
2707 1 7 . 1 1 80 80 HIS N N 78 122.110 122.110 116.061 6.049 17967
2708 1 7 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.811 -0.301 17967
2709 1 7 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.478 0.852 17967
2710 1 7 . 1 1 80 80 HIS CB C 78 30.830 30.830 29.740 1.090 17967
2711 1 7 . 1 1 80 80 HIS H H 78 8.120 8.120 8.859 -0.739 17967
2712 1 7 . 1 1 81 81 TYR N N 79 123.610 123.610 121.928 1.682 17967
2713 1 7 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.560 0.030 17967
2714 1 7 . 1 1 81 81 TYR CA C 79 57.830 57.830 58.149 -0.319 17967
2715 1 7 . 1 1 81 81 TYR CB C 79 39.130 39.130 38.546 0.584 17967
2716 1 7 . 1 1 81 81 TYR H H 79 7.970 7.970 8.342 -0.372 17967
2717 1 8 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.673 -0.383 17967
2718 1 8 . 1 1 2 2 ALA CA C 0 52.530 52.530 51.610 0.920 17967
2719 1 8 . 1 1 2 2 ALA CB C 0 19.730 19.730 19.994 -0.264 17967
2720 1 8 . 1 1 3 3 MET N N 1 122.210 122.210 120.106 2.104 17967
2721 1 8 . 1 1 3 3 MET HA H 1 4.300 4.300 4.589 -0.289 17967
2722 1 8 . 1 1 3 3 MET CA C 1 56.030 56.030 55.490 0.540 17967
2723 1 8 . 1 1 3 3 MET CB C 1 33.430 33.430 32.928 0.502 17967
2724 1 8 . 1 1 3 3 MET H H 1 8.370 8.370 7.722 0.648 17967
2725 1 8 . 1 1 4 4 PHE N N 2 122.310 122.310 124.716 -2.406 17967
2726 1 8 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.701 -0.071 17967
2727 1 8 . 1 1 4 4 PHE CA C 2 57.330 57.330 55.593 1.737 17967
2728 1 8 . 1 1 4 4 PHE CB C 2 39.430 39.430 40.867 -1.437 17967
2729 1 8 . 1 1 4 4 PHE H H 2 8.370 8.370 8.156 0.214 17967
2730 1 8 . 1 1 5 5 GLN N N 3 123.510 123.510 121.820 1.690 17967
2731 1 8 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.230 -0.050 17967
2732 1 8 . 1 1 5 5 GLN CA C 3 56.130 56.130 55.973 0.157 17967
2733 1 8 . 1 1 5 5 GLN CB C 3 29.930 29.930 29.549 0.381 17967
2734 1 8 . 1 1 5 5 GLN H H 3 8.260 8.260 8.387 -0.127 17967
2735 1 8 . 1 1 6 6 ASP N N 4 125.010 125.010 128.860 -3.850 17967
2736 1 8 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.836 -0.046 17967
2737 1 8 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.308 0.622 17967
2738 1 8 . 1 1 6 6 ASP CB C 4 41.730 41.730 42.121 -0.391 17967
2739 1 8 . 1 1 6 6 ASP H H 4 8.420 8.420 8.522 -0.102 17967
2740 1 8 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.531 -0.411 17967
2741 1 8 . 1 1 7 7 PRO CA C 5 64.030 64.030 63.142 0.888 17967
2742 1 8 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.238 0.092 17967
2743 1 8 . 1 1 8 8 GLN N N 6 119.710 119.710 121.053 -1.343 17967
2744 1 8 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.233 -0.073 17967
2745 1 8 . 1 1 8 8 GLN CA C 6 56.630 56.630 54.874 1.756 17967
2746 1 8 . 1 1 8 8 GLN CB C 6 29.330 29.330 26.564 2.766 17967
2747 1 8 . 1 1 8 8 GLN H H 6 8.430 8.430 7.879 0.551 17967
2748 1 8 . 1 1 9 9 GLU N N 7 122.110 122.110 122.231 -0.121 17967
2749 1 8 . 1 1 9 9 GLU HA H 7 4.200 4.200 3.718 0.482 17967
2750 1 8 . 1 1 9 9 GLU CA C 7 56.030 56.030 58.188 -2.158 17967
2751 1 8 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.497 1.032 17967
2752 1 8 . 1 1 9 9 GLU H H 7 7.940 7.940 8.259 -0.319 17967
2753 1 8 . 1 1 10 10 ARG N N 8 123.410 123.410 113.819 9.591 17967
2754 1 8 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.164 0.236 17967
2755 1 8 . 1 1 10 10 ARG CA C 8 54.130 54.130 56.135 -2.005 17967
2756 1 8 . 1 1 10 10 ARG CB C 8 29.330 29.330 27.458 1.872 17967
2757 1 8 . 1 1 10 10 ARG H H 8 7.660 7.660 7.836 -0.176 17967
2758 1 8 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.700 -0.350 17967
2759 1 8 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.671 0.859 17967
2760 1 8 . 1 1 11 11 PRO CB C 9 32.630 32.630 32.718 -0.088 17967
2761 1 8 . 1 1 12 12 ARG N N 10 123.810 123.810 117.155 6.655 17967
2762 1 8 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.672 -0.002 17967
2763 1 8 . 1 1 12 12 ARG CA C 10 56.830 56.830 56.561 0.269 17967
2764 1 8 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.605 0.925 17967
2765 1 8 . 1 1 12 12 ARG H H 10 8.710 8.710 8.752 -0.042 17967
2766 1 8 . 1 1 13 13 LYS N N 11 118.410 118.410 119.426 -1.016 17967
2767 1 8 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.779 0.271 17967
2768 1 8 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.096 -0.766 17967
2769 1 8 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.251 1.179 17967
2770 1 8 . 1 1 13 13 LYS H H 11 7.800 7.800 7.730 0.070 17967
2771 1 8 . 1 1 14 14 LEU N N 12 125.010 125.010 126.224 -1.214 17967
2772 1 8 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.168 0.002 17967
2773 1 8 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.423 0.307 17967
2774 1 8 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.946 0.584 17967
2775 1 8 . 1 1 14 14 LEU H H 12 10.210 10.210 9.166 1.044 17967
2776 1 8 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.288 -0.068 17967
2777 1 8 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.625 1.605 17967
2778 1 8 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.147 -0.417 17967
2779 1 8 . 1 1 16 16 GLN N N 14 117.810 117.810 116.648 1.162 17967
2780 1 8 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.172 0.018 17967
2781 1 8 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.432 0.598 17967
2782 1 8 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.282 0.348 17967
2783 1 8 . 1 1 16 16 GLN H H 14 7.110 7.110 8.392 -1.282 17967
2784 1 8 . 1 1 17 17 LEU N N 15 124.710 124.710 122.251 2.459 17967
2785 1 8 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.229 -0.219 17967
2786 1 8 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.410 0.921 17967
2787 1 8 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.826 0.204 17967
2788 1 8 . 1 1 17 17 LEU H H 15 8.010 8.010 7.964 0.046 17967
2789 1 8 . 1 1 18 18 CYS N N 16 117.210 117.210 117.594 -0.384 17967
2790 1 8 . 1 1 18 18 CYS HA H 16 3.750 3.750 4.012 -0.262 17967
2791 1 8 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.676 1.054 17967
2792 1 8 . 1 1 18 18 CYS CB C 16 26.230 26.230 25.858 0.371 17967
2793 1 8 . 1 1 18 18 CYS H H 16 8.380 8.380 8.261 0.119 17967
2794 1 8 . 1 1 19 19 THR N N 17 117.810 117.810 115.612 2.198 17967
2795 1 8 . 1 1 19 19 THR HA H 17 4.000 4.000 3.966 0.034 17967
2796 1 8 . 1 1 19 19 THR CA C 17 66.830 66.830 66.884 -0.054 17967
2797 1 8 . 1 1 19 19 THR CB C 17 68.830 68.830 68.569 0.261 17967
2798 1 8 . 1 1 19 19 THR H H 17 7.720 7.720 7.725 -0.005 17967
2799 1 8 . 1 1 20 20 GLU N N 18 125.410 125.410 120.744 4.666 17967
2800 1 8 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.145 -0.075 17967
2801 1 8 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.491 1.239 17967
2802 1 8 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.727 0.003 17967
2803 1 8 . 1 1 20 20 GLU H H 18 8.010 8.010 7.926 0.084 17967
2804 1 8 . 1 1 21 21 LEU N N 19 118.810 118.810 118.059 0.751 17967
2805 1 8 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.221 0.079 17967
2806 1 8 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.739 -0.909 17967
2807 1 8 . 1 1 21 21 LEU CB C 19 42.330 42.330 42.027 0.303 17967
2808 1 8 . 1 1 21 21 LEU H H 19 8.010 8.010 7.806 0.204 17967
2809 1 8 . 1 1 22 22 GLN N N 20 118.310 118.310 114.980 3.330 17967
2810 1 8 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.061 -0.111 17967
2811 1 8 . 1 1 22 22 GLN CA C 20 56.730 56.730 56.975 -0.245 17967
2812 1 8 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.208 -0.078 17967
2813 1 8 . 1 1 22 22 GLN H H 20 7.860 7.860 7.566 0.294 17967
2814 1 8 . 1 1 23 23 THR N N 21 115.910 115.910 111.531 4.379 17967
2815 1 8 . 1 1 23 23 THR HA H 21 4.950 4.950 4.603 0.347 17967
2816 1 8 . 1 1 23 23 THR CA C 21 58.530 58.530 59.672 -1.142 17967
2817 1 8 . 1 1 23 23 THR CB C 21 70.330 70.330 70.108 0.222 17967
2818 1 8 . 1 1 23 23 THR H H 21 8.250 8.250 8.274 -0.024 17967
2819 1 8 . 1 1 24 24 THR N N 22 112.810 112.810 113.869 -1.059 17967
2820 1 8 . 1 1 24 24 THR HA H 22 4.880 4.880 4.588 0.292 17967
2821 1 8 . 1 1 24 24 THR CA C 22 59.730 59.730 60.277 -0.547 17967
2822 1 8 . 1 1 24 24 THR CB C 22 74.130 74.130 70.885 3.244 17967
2823 1 8 . 1 1 24 24 THR H H 22 8.660 8.660 7.904 0.756 17967
2824 1 8 . 1 1 25 25 ILE N N 23 123.710 123.710 119.709 4.001 17967
2825 1 8 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.730 0.050 17967
2826 1 8 . 1 1 25 25 ILE CA C 23 63.430 63.430 63.702 -0.272 17967
2827 1 8 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.873 0.757 17967
2828 1 8 . 1 1 25 25 ILE H H 23 9.060 9.060 8.110 0.950 17967
2829 1 8 . 1 1 26 26 HIS N N 24 119.510 119.510 113.832 5.678 17967
2830 1 8 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.919 -0.479 17967
2831 1 8 . 1 1 26 26 HIS CA C 24 57.030 57.030 54.953 2.077 17967
2832 1 8 . 1 1 26 26 HIS CB C 24 30.830 30.830 28.741 2.089 17967
2833 1 8 . 1 1 26 26 HIS H H 24 7.040 7.040 7.580 -0.540 17967
2834 1 8 . 1 1 27 27 ASP N N 25 116.810 116.810 118.889 -2.079 17967
2835 1 8 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.631 0.129 17967
2836 1 8 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.768 -0.338 17967
2837 1 8 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.160 1.171 17967
2838 1 8 . 1 1 27 27 ASP H H 25 7.250 7.250 7.503 -0.253 17967
2839 1 8 . 1 1 28 28 ILE N N 26 123.210 123.210 121.435 1.775 17967
2840 1 8 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.890 0.040 17967
2841 1 8 . 1 1 28 28 ILE CA C 26 63.030 63.030 63.034 -0.004 17967
2842 1 8 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.632 -0.702 17967
2843 1 8 . 1 1 28 28 ILE H H 26 7.750 7.750 7.820 -0.070 17967
2844 1 8 . 1 1 29 29 ILE N N 27 131.110 131.110 129.034 2.076 17967
2845 1 8 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.142 0.238 17967
2846 1 8 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.856 -1.026 17967
2847 1 8 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.700 0.930 17967
2848 1 8 . 1 1 29 29 ILE H H 27 8.270 8.270 8.372 -0.102 17967
2849 1 8 . 1 1 30 30 LEU N N 28 129.410 129.410 128.723 0.687 17967
2850 1 8 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.616 0.044 17967
2851 1 8 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.285 -0.756 17967
2852 1 8 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.586 2.744 17967
2853 1 8 . 1 1 30 30 LEU H H 28 8.500 8.500 8.383 0.117 17967
2854 1 8 . 1 1 31 31 GLU N N 29 121.910 121.910 121.300 0.610 17967
2855 1 8 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.698 -0.018 17967
2856 1 8 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.479 0.451 17967
2857 1 8 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.366 0.664 17967
2858 1 8 . 1 1 31 31 GLU H H 29 8.860 8.860 8.187 0.673 17967
2859 1 8 . 1 1 32 32 CYS N N 30 125.710 125.710 119.684 6.026 17967
2860 1 8 . 1 1 32 32 CYS HA H 30 4.020 4.020 5.011 -0.991 17967
2861 1 8 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.415 -1.185 17967
2862 1 8 . 1 1 32 32 CYS CB C 30 31.730 31.730 28.319 3.411 17967
2863 1 8 . 1 1 32 32 CYS H H 30 8.270 8.270 8.613 -0.343 17967
2864 1 8 . 1 1 33 33 VAL N N 31 132.310 132.310 127.355 4.955 17967
2865 1 8 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.278 -0.178 17967
2866 1 8 . 1 1 33 33 VAL CA C 31 64.230 64.230 64.395 -0.165 17967
2867 1 8 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.769 -0.139 17967
2868 1 8 . 1 1 33 33 VAL H H 31 8.860 8.860 8.270 0.590 17967
2869 1 8 . 1 1 34 34 TYR N N 32 124.310 124.310 118.721 5.589 17967
2870 1 8 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.632 -0.192 17967
2871 1 8 . 1 1 34 34 TYR CA C 32 61.030 61.030 59.898 1.132 17967
2872 1 8 . 1 1 34 34 TYR CB C 32 40.130 40.130 39.070 1.060 17967
2873 1 8 . 1 1 34 34 TYR H H 32 8.590 8.590 7.571 1.019 17967
2874 1 8 . 1 1 35 35 CYS N N 33 119.810 119.810 114.067 5.743 17967
2875 1 8 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.798 0.042 17967
2876 1 8 . 1 1 35 35 CYS CA C 33 59.430 59.430 58.967 0.463 17967
2877 1 8 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.037 4.193 17967
2878 1 8 . 1 1 35 35 CYS H H 33 8.070 8.070 8.041 0.029 17967
2879 1 8 . 1 1 36 36 LYS N N 34 119.910 119.910 118.675 1.235 17967
2880 1 8 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.848 0.342 17967
2881 1 8 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.308 0.522 17967
2882 1 8 . 1 1 36 36 LYS CB C 34 29.330 29.330 30.409 -1.079 17967
2883 1 8 . 1 1 36 36 LYS H H 34 7.860 7.860 8.108 -0.248 17967
2884 1 8 . 1 1 37 37 GLN N N 35 120.710 120.710 117.243 3.467 17967
2885 1 8 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.389 -0.029 17967
2886 1 8 . 1 1 37 37 GLN CA C 35 55.430 55.430 53.968 1.462 17967
2887 1 8 . 1 1 37 37 GLN CB C 35 29.630 29.630 30.663 -1.033 17967
2888 1 8 . 1 1 37 37 GLN H H 35 8.270 8.270 7.769 0.501 17967
2889 1 8 . 1 1 38 38 GLN N N 36 123.710 123.710 122.214 1.496 17967
2890 1 8 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.092 0.208 17967
2891 1 8 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.586 0.144 17967
2892 1 8 . 1 1 38 38 GLN CB C 36 29.330 29.330 29.090 0.240 17967
2893 1 8 . 1 1 38 38 GLN H H 36 8.640 8.640 8.569 0.071 17967
2894 1 8 . 1 1 39 39 LEU N N 37 131.310 131.310 127.411 3.899 17967
2895 1 8 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.185 -0.075 17967
2896 1 8 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.609 1.721 17967
2897 1 8 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.570 -0.640 17967
2898 1 8 . 1 1 39 39 LEU H H 37 8.870 8.870 7.981 0.889 17967
2899 1 8 . 1 1 40 40 LEU N N 38 126.310 126.310 123.972 2.338 17967
2900 1 8 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.295 0.015 17967
2901 1 8 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.665 -0.435 17967
2902 1 8 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.092 0.038 17967
2903 1 8 . 1 1 40 40 LEU H H 38 9.850 9.850 8.335 1.515 17967
2904 1 8 . 1 1 41 41 ARG N N 39 127.110 127.110 125.528 1.582 17967
2905 1 8 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.790 -0.270 17967
2906 1 8 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.892 -2.062 17967
2907 1 8 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.806 -2.876 17967
2908 1 8 . 1 1 41 41 ARG H H 39 8.970 8.970 8.924 0.046 17967
2909 1 8 . 1 1 42 42 ARG N N 40 115.810 115.810 117.675 -1.865 17967
2910 1 8 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.281 -0.201 17967
2911 1 8 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.183 -0.053 17967
2912 1 8 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.244 0.086 17967
2913 1 8 . 1 1 42 42 ARG H H 40 8.610 8.610 8.673 -0.063 17967
2914 1 8 . 1 1 43 43 GLU N N 41 119.910 119.910 119.037 0.873 17967
2915 1 8 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.571 -0.321 17967
2916 1 8 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.353 0.677 17967
2917 1 8 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.027 1.303 17967
2918 1 8 . 1 1 43 43 GLU H H 41 6.950 6.950 7.872 -0.922 17967
2919 1 8 . 1 1 44 44 VAL N N 42 125.010 125.010 120.269 4.741 17967
2920 1 8 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.554 -0.314 17967
2921 1 8 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.352 1.278 17967
2922 1 8 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.387 -0.057 17967
2923 1 8 . 1 1 44 44 VAL H H 42 7.820 7.820 7.908 -0.088 17967
2924 1 8 . 1 1 45 45 TYR N N 43 118.410 118.410 118.249 0.161 17967
2925 1 8 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.143 0.287 17967
2926 1 8 . 1 1 45 45 TYR CA C 43 58.830 58.830 61.379 -2.549 17967
2927 1 8 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.600 -0.870 17967
2928 1 8 . 1 1 45 45 TYR H H 43 7.820 7.820 8.001 -0.181 17967
2929 1 8 . 1 1 46 46 ASP N N 44 122.410 122.410 120.133 2.277 17967
2930 1 8 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.296 0.304 17967
2931 1 8 . 1 1 46 46 ASP CA C 44 57.830 57.830 58.075 -0.245 17967
2932 1 8 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.464 0.566 17967
2933 1 8 . 1 1 46 46 ASP H H 44 8.540 8.540 7.883 0.657 17967
2934 1 8 . 1 1 47 47 PHE N N 45 126.210 126.210 119.315 6.895 17967
2935 1 8 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.109 -0.199 17967
2936 1 8 . 1 1 47 47 PHE CA C 45 62.630 62.630 62.001 0.629 17967
2937 1 8 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.086 0.244 17967
2938 1 8 . 1 1 47 47 PHE H H 45 8.320 8.320 7.816 0.504 17967
2939 1 8 . 1 1 48 48 ALA N N 46 119.110 119.110 119.168 -0.058 17967
2940 1 8 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.317 0.203 17967
2941 1 8 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.898 0.332 17967
2942 1 8 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.579 0.151 17967
2943 1 8 . 1 1 48 48 ALA H H 46 7.740 7.740 7.779 -0.039 17967
2944 1 8 . 1 1 49 49 ARG N N 47 124.010 124.010 118.036 5.974 17967
2945 1 8 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.326 -0.276 17967
2946 1 8 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.048 2.582 17967
2947 1 8 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.477 -0.046 17967
2948 1 8 . 1 1 49 49 ARG H H 47 8.500 8.500 8.244 0.256 17967
2949 1 8 . 1 1 50 50 ARG N N 48 119.110 119.110 118.479 0.631 17967
2950 1 8 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.483 -0.473 17967
2951 1 8 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.866 2.264 17967
2952 1 8 . 1 1 50 50 ARG CB C 48 31.130 31.130 31.801 -0.671 17967
2953 1 8 . 1 1 50 50 ARG H H 48 7.940 7.940 7.871 0.069 17967
2954 1 8 . 1 1 51 51 ASP N N 49 120.910 120.910 119.711 1.199 17967
2955 1 8 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.738 -0.318 17967
2956 1 8 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.679 0.851 17967
2957 1 8 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.580 -0.649 17967
2958 1 8 . 1 1 51 51 ASP H H 49 7.950 7.950 8.246 -0.296 17967
2959 1 8 . 1 1 52 52 LEU N N 50 118.410 118.410 121.533 -3.123 17967
2960 1 8 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.452 -0.302 17967
2961 1 8 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.378 0.852 17967
2962 1 8 . 1 1 52 52 LEU CB C 50 41.130 41.130 43.715 -2.585 17967
2963 1 8 . 1 1 52 52 LEU H H 50 6.640 6.640 7.299 -0.659 17967
2964 1 8 . 1 1 53 53 CYS N N 51 117.410 117.410 117.133 0.277 17967
2965 1 8 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.183 -0.253 17967
2966 1 8 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.474 2.456 17967
2967 1 8 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.754 -2.124 17967
2968 1 8 . 1 1 53 53 CYS H H 51 8.030 8.030 8.112 -0.082 17967
2969 1 8 . 1 1 54 54 ILE N N 52 125.110 125.110 124.497 0.613 17967
2970 1 8 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.260 -0.250 17967
2971 1 8 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.902 -2.272 17967
2972 1 8 . 1 1 54 54 ILE CB C 52 37.330 37.330 39.229 -1.899 17967
2973 1 8 . 1 1 54 54 ILE H H 52 8.500 8.500 8.853 -0.353 17967
2974 1 8 . 1 1 55 55 VAL N N 53 127.010 127.010 123.623 3.387 17967
2975 1 8 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.593 -0.223 17967
2976 1 8 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.681 -0.051 17967
2977 1 8 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.486 1.744 17967
2978 1 8 . 1 1 55 55 VAL H H 53 8.130 8.130 8.121 0.009 17967
2979 1 8 . 1 1 56 56 TYR N N 54 124.910 124.910 127.121 -2.211 17967
2980 1 8 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.214 0.186 17967
2981 1 8 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.572 -0.242 17967
2982 1 8 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.285 1.745 17967
2983 1 8 . 1 1 56 56 TYR H H 54 8.700 8.700 8.638 0.062 17967
2984 1 8 . 1 1 57 57 ARG N N 55 123.810 123.810 125.494 -1.684 17967
2985 1 8 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.422 0.218 17967
2986 1 8 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.742 -0.312 17967
2987 1 8 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.636 2.194 17967
2988 1 8 . 1 1 57 57 ARG H H 55 8.870 8.870 8.355 0.515 17967
2989 1 8 . 1 1 58 58 ASP N N 56 129.110 129.110 125.993 3.117 17967
2990 1 8 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.309 0.001 17967
2991 1 8 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.550 -0.720 17967
2992 1 8 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.029 0.101 17967
2993 1 8 . 1 1 58 58 ASP H H 56 9.620 9.620 9.155 0.465 17967
2994 1 8 . 1 1 59 59 GLY N N 57 104.510 104.510 108.624 -4.114 17967
2995 1 8 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.105 0.525 17967
2996 1 8 . 1 1 59 59 GLY H H 57 8.720 8.720 8.436 0.284 17967
2997 1 8 . 1 1 60 60 ASN N N 58 122.210 122.210 118.664 3.546 17967
2998 1 8 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.145 0.255 17967
2999 1 8 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.860 -0.530 17967
3000 1 8 . 1 1 60 60 ASN CB C 58 40.430 40.430 41.122 -0.692 17967
3001 1 8 . 1 1 60 60 ASN H H 58 8.120 8.120 7.884 0.236 17967
3002 1 8 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.483 0.307 17967
3003 1 8 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.183 -0.153 17967
3004 1 8 . 1 1 61 61 PRO CB C 59 33.530 33.530 30.992 2.538 17967
3005 1 8 . 1 1 62 62 TYR N N 60 119.810 119.810 122.534 -2.724 17967
3006 1 8 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.505 -0.145 17967
3007 1 8 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.279 1.951 17967
3008 1 8 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.495 0.935 17967
3009 1 8 . 1 1 62 62 TYR H H 60 8.590 8.590 7.551 1.039 17967
3010 1 8 . 1 1 63 63 ALA N N 61 123.810 123.810 122.002 1.808 17967
3011 1 8 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.157 0.263 17967
3012 1 8 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.252 0.079 17967
3013 1 8 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.666 -0.336 17967
3014 1 8 . 1 1 63 63 ALA H H 61 8.010 8.010 8.846 -0.836 17967
3015 1 8 . 1 1 64 64 VAL N N 62 120.510 120.510 118.696 1.814 17967
3016 1 8 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.452 1.048 17967
3017 1 8 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.588 -0.358 17967
3018 1 8 . 1 1 64 64 VAL CB C 62 36.330 36.330 32.444 3.886 17967
3019 1 8 . 1 1 64 64 VAL H H 62 6.380 6.380 8.468 -2.088 17967
3020 1 8 . 1 1 65 65 CYS N N 63 130.310 130.310 125.725 4.585 17967
3021 1 8 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.590 -0.030 17967
3022 1 8 . 1 1 65 65 CYS CA C 63 58.430 58.430 57.612 0.818 17967
3023 1 8 . 1 1 65 65 CYS CB C 63 31.130 31.130 29.143 1.987 17967
3024 1 8 . 1 1 65 65 CYS H H 63 9.430 9.430 8.619 0.811 17967
3025 1 8 . 1 1 66 66 ASP N N 64 121.110 121.110 120.731 0.379 17967
3026 1 8 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.239 0.171 17967
3027 1 8 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.439 -0.209 17967
3028 1 8 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.853 1.477 17967
3029 1 8 . 1 1 66 66 ASP H H 64 9.120 9.120 8.778 0.342 17967
3030 1 8 . 1 1 67 67 LYS N N 65 122.110 122.110 118.362 3.748 17967
3031 1 8 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.866 0.144 17967
3032 1 8 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.798 1.332 17967
3033 1 8 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.400 0.430 17967
3034 1 8 . 1 1 67 67 LYS H H 65 8.330 8.330 7.849 0.481 17967
3035 1 8 . 1 1 68 68 CYS N N 66 125.610 125.610 116.869 8.741 17967
3036 1 8 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.618 -0.508 17967
3037 1 8 . 1 1 68 68 CYS CA C 66 63.530 63.530 60.531 2.999 17967
3038 1 8 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.555 4.175 17967
3039 1 8 . 1 1 68 68 CYS H H 66 8.700 8.700 7.767 0.933 17967
3040 1 8 . 1 1 69 69 LEU N N 67 125.310 125.310 122.591 2.719 17967
3041 1 8 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.063 -0.063 17967
3042 1 8 . 1 1 69 69 LEU CA C 67 58.530 58.530 57.920 0.610 17967
3043 1 8 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.864 0.266 17967
3044 1 8 . 1 1 69 69 LEU H H 67 8.470 8.470 8.778 -0.308 17967
3045 1 8 . 1 1 70 70 LYS N N 68 119.010 119.010 116.275 2.735 17967
3046 1 8 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.156 -0.176 17967
3047 1 8 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.120 0.710 17967
3048 1 8 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.631 0.499 17967
3049 1 8 . 1 1 70 70 LYS H H 68 7.810 7.810 7.475 0.335 17967
3050 1 8 . 1 1 71 71 PHE N N 69 121.710 121.710 120.256 1.454 17967
3051 1 8 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.214 0.066 17967
3052 1 8 . 1 1 71 71 PHE CA C 69 59.930 59.930 59.646 0.284 17967
3053 1 8 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.516 0.914 17967
3054 1 8 . 1 1 71 71 PHE H H 69 7.810 7.810 7.213 0.597 17967
3055 1 8 . 1 1 72 72 TYR N N 70 120.110 120.110 116.295 3.815 17967
3056 1 8 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.617 -0.297 17967
3057 1 8 . 1 1 72 72 TYR CA C 70 60.330 60.330 57.897 2.433 17967
3058 1 8 . 1 1 72 72 TYR CB C 70 40.430 40.430 37.040 3.390 17967
3059 1 8 . 1 1 72 72 TYR H H 70 8.280 8.280 8.829 -0.549 17967
3060 1 8 . 1 1 73 73 SER N N 71 117.210 117.210 115.307 1.903 17967
3061 1 8 . 1 1 73 73 SER HA H 71 4.320 4.320 4.312 0.008 17967
3062 1 8 . 1 1 73 73 SER CA C 71 60.130 60.130 60.431 -0.301 17967
3063 1 8 . 1 1 73 73 SER CB C 71 63.630 63.630 63.141 0.489 17967
3064 1 8 . 1 1 73 73 SER H H 71 7.870 7.870 7.886 -0.016 17967
3065 1 8 . 1 1 74 74 LYS N N 72 122.810 122.810 121.247 1.563 17967
3066 1 8 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.230 0.040 17967
3067 1 8 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.286 -0.356 17967
3068 1 8 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.901 -0.271 17967
3069 1 8 . 1 1 74 74 LYS H H 72 7.800 7.800 7.740 0.060 17967
3070 1 8 . 1 1 75 75 ILE N N 73 121.610 121.610 121.045 0.565 17967
3071 1 8 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.172 -0.062 17967
3072 1 8 . 1 1 75 75 ILE CA C 73 61.830 61.830 61.806 0.024 17967
3073 1 8 . 1 1 75 75 ILE CB C 73 38.630 38.630 36.939 1.691 17967
3074 1 8 . 1 1 75 75 ILE H H 73 7.750 7.750 7.635 0.115 17967
3075 1 8 . 1 1 76 76 SER N N 74 120.410 120.410 119.957 0.453 17967
3076 1 8 . 1 1 76 76 SER HA H 74 4.300 4.300 4.784 -0.484 17967
3077 1 8 . 1 1 76 76 SER CA C 74 59.330 59.330 59.363 -0.033 17967
3078 1 8 . 1 1 76 76 SER CB C 74 63.830 63.830 65.722 -1.892 17967
3079 1 8 . 1 1 76 76 SER H H 74 8.130 8.130 8.187 -0.057 17967
3080 1 8 . 1 1 77 77 GLU N N 75 123.810 123.810 122.140 1.670 17967
3081 1 8 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.193 -0.003 17967
3082 1 8 . 1 1 77 77 GLU CA C 75 57.330 57.330 57.897 -0.567 17967
3083 1 8 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.104 0.026 17967
3084 1 8 . 1 1 77 77 GLU H H 75 8.270 8.270 8.286 -0.016 17967
3085 1 8 . 1 1 78 78 TYR N N 76 122.410 122.410 120.173 2.237 17967
3086 1 8 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.339 0.121 17967
3087 1 8 . 1 1 78 78 TYR CA C 76 58.130 58.130 59.179 -1.050 17967
3088 1 8 . 1 1 78 78 TYR CB C 76 38.630 38.630 38.538 0.091 17967
3089 1 8 . 1 1 78 78 TYR H H 76 7.980 7.980 8.066 -0.086 17967
3090 1 8 . 1 1 79 79 ARG N N 77 124.710 124.710 125.547 -0.837 17967
3091 1 8 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.179 0.021 17967
3092 1 8 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.405 0.625 17967
3093 1 8 . 1 1 79 79 ARG CB C 77 31.030 31.030 31.475 -0.445 17967
3094 1 8 . 1 1 79 79 ARG H H 77 7.880 7.880 8.249 -0.369 17967
3095 1 8 . 1 1 80 80 HIS N N 78 122.110 122.110 112.314 9.796 17967
3096 1 8 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.135 0.375 17967
3097 1 8 . 1 1 80 80 HIS CA C 78 56.330 56.330 56.259 0.071 17967
3098 1 8 . 1 1 80 80 HIS CB C 78 30.830 30.830 26.836 3.994 17967
3099 1 8 . 1 1 80 80 HIS H H 78 8.120 8.120 7.995 0.125 17967
3100 1 8 . 1 1 81 81 TYR N N 79 123.610 123.610 118.812 4.798 17967
3101 1 8 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.723 -0.133 17967
3102 1 8 . 1 1 81 81 TYR CA C 79 57.830 57.830 56.576 1.254 17967
3103 1 8 . 1 1 81 81 TYR CB C 79 39.130 39.130 40.496 -1.366 17967
3104 1 8 . 1 1 81 81 TYR H H 79 7.970 7.970 7.852 0.118 17967
3105 1 9 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.516 -0.226 17967
3106 1 9 . 1 1 2 2 ALA CA C 0 52.530 52.530 51.531 0.999 17967
3107 1 9 . 1 1 2 2 ALA CB C 0 19.730 19.730 20.175 -0.445 17967
3108 1 9 . 1 1 3 3 MET N N 1 122.210 122.210 118.216 3.994 17967
3109 1 9 . 1 1 3 3 MET HA H 1 4.300 4.300 4.346 -0.046 17967
3110 1 9 . 1 1 3 3 MET CA C 1 56.030 56.030 56.053 -0.023 17967
3111 1 9 . 1 1 3 3 MET CB C 1 33.430 33.430 31.700 1.730 17967
3112 1 9 . 1 1 3 3 MET H H 1 8.370 8.370 8.246 0.124 17967
3113 1 9 . 1 1 4 4 PHE N N 2 122.310 122.310 128.135 -5.825 17967
3114 1 9 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.824 -0.194 17967
3115 1 9 . 1 1 4 4 PHE CA C 2 57.330 57.330 56.610 0.720 17967
3116 1 9 . 1 1 4 4 PHE CB C 2 39.430 39.430 39.546 -0.116 17967
3117 1 9 . 1 1 4 4 PHE H H 2 8.370 8.370 8.993 -0.623 17967
3118 1 9 . 1 1 5 5 GLN N N 3 123.510 123.510 123.282 0.228 17967
3119 1 9 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.534 -0.354 17967
3120 1 9 . 1 1 5 5 GLN CA C 3 56.130 56.130 53.575 2.555 17967
3121 1 9 . 1 1 5 5 GLN CB C 3 29.930 29.930 31.245 -1.315 17967
3122 1 9 . 1 1 5 5 GLN H H 3 8.260 8.260 7.591 0.669 17967
3123 1 9 . 1 1 6 6 ASP N N 4 125.010 125.010 120.303 4.707 17967
3124 1 9 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.421 0.369 17967
3125 1 9 . 1 1 6 6 ASP CA C 4 51.930 51.930 52.845 -0.915 17967
3126 1 9 . 1 1 6 6 ASP CB C 4 41.730 41.730 41.274 0.456 17967
3127 1 9 . 1 1 6 6 ASP H H 4 8.420 8.420 8.401 0.019 17967
3128 1 9 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.279 -0.159 17967
3129 1 9 . 1 1 7 7 PRO CA C 5 64.030 64.030 64.025 0.005 17967
3130 1 9 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.113 0.217 17967
3131 1 9 . 1 1 8 8 GLN N N 6 119.710 119.710 119.189 0.521 17967
3132 1 9 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.421 -0.261 17967
3133 1 9 . 1 1 8 8 GLN CA C 6 56.630 56.630 54.457 2.173 17967
3134 1 9 . 1 1 8 8 GLN CB C 6 29.330 29.330 25.570 3.760 17967
3135 1 9 . 1 1 8 8 GLN H H 6 8.430 8.430 7.595 0.835 17967
3136 1 9 . 1 1 9 9 GLU N N 7 122.110 122.110 121.124 0.986 17967
3137 1 9 . 1 1 9 9 GLU HA H 7 4.200 4.200 3.891 0.309 17967
3138 1 9 . 1 1 9 9 GLU CA C 7 56.030 56.030 57.139 -1.109 17967
3139 1 9 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.954 0.576 17967
3140 1 9 . 1 1 9 9 GLU H H 7 7.940 7.940 8.468 -0.528 17967
3141 1 9 . 1 1 10 10 ARG N N 8 123.410 123.410 115.251 8.159 17967
3142 1 9 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.254 0.146 17967
3143 1 9 . 1 1 10 10 ARG CA C 8 54.130 54.130 56.180 -2.050 17967
3144 1 9 . 1 1 10 10 ARG CB C 8 29.330 29.330 28.194 1.136 17967
3145 1 9 . 1 1 10 10 ARG H H 8 7.660 7.660 8.272 -0.612 17967
3146 1 9 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.550 -0.200 17967
3147 1 9 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.937 0.593 17967
3148 1 9 . 1 1 11 11 PRO CB C 9 32.630 32.630 32.880 -0.250 17967
3149 1 9 . 1 1 12 12 ARG N N 10 123.810 123.810 115.938 7.872 17967
3150 1 9 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.676 -0.006 17967
3151 1 9 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.408 1.422 17967
3152 1 9 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.321 1.209 17967
3153 1 9 . 1 1 12 12 ARG H H 10 8.710 8.710 8.665 0.045 17967
3154 1 9 . 1 1 13 13 LYS N N 11 118.410 118.410 119.505 -1.095 17967
3155 1 9 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.821 0.229 17967
3156 1 9 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.040 -0.710 17967
3157 1 9 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.246 1.184 17967
3158 1 9 . 1 1 13 13 LYS H H 11 7.800 7.800 7.719 0.081 17967
3159 1 9 . 1 1 14 14 LEU N N 12 125.010 125.010 126.228 -1.218 17967
3160 1 9 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.213 -0.043 17967
3161 1 9 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.280 0.450 17967
3162 1 9 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.958 0.572 17967
3163 1 9 . 1 1 14 14 LEU H H 12 10.210 10.210 9.158 1.052 17967
3164 1 9 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.251 -0.031 17967
3165 1 9 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.526 1.704 17967
3166 1 9 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.134 -0.404 17967
3167 1 9 . 1 1 16 16 GLN N N 14 117.810 117.810 118.043 -0.233 17967
3168 1 9 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.155 0.035 17967
3169 1 9 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.984 0.045 17967
3170 1 9 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.387 0.243 17967
3171 1 9 . 1 1 16 16 GLN H H 14 7.110 7.110 8.350 -1.240 17967
3172 1 9 . 1 1 17 17 LEU N N 15 124.710 124.710 122.134 2.576 17967
3173 1 9 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.166 -0.156 17967
3174 1 9 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.890 0.440 17967
3175 1 9 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.676 0.354 17967
3176 1 9 . 1 1 17 17 LEU H H 15 8.010 8.010 8.058 -0.048 17967
3177 1 9 . 1 1 18 18 CYS N N 16 117.210 117.210 117.144 0.066 17967
3178 1 9 . 1 1 18 18 CYS HA H 16 3.750 3.750 3.986 -0.236 17967
3179 1 9 . 1 1 18 18 CYS CA C 16 64.730 64.730 64.008 0.722 17967
3180 1 9 . 1 1 18 18 CYS CB C 16 26.230 26.230 25.992 0.238 17967
3181 1 9 . 1 1 18 18 CYS H H 16 8.380 8.380 8.560 -0.180 17967
3182 1 9 . 1 1 19 19 THR N N 17 117.810 117.810 116.500 1.310 17967
3183 1 9 . 1 1 19 19 THR HA H 17 4.000 4.000 4.018 -0.018 17967
3184 1 9 . 1 1 19 19 THR CA C 17 66.830 66.830 67.169 -0.339 17967
3185 1 9 . 1 1 19 19 THR CB C 17 68.830 68.830 68.566 0.264 17967
3186 1 9 . 1 1 19 19 THR H H 17 7.720 7.720 7.686 0.034 17967
3187 1 9 . 1 1 20 20 GLU N N 18 125.410 125.410 120.764 4.646 17967
3188 1 9 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.151 -0.081 17967
3189 1 9 . 1 1 20 20 GLU CA C 18 59.730 59.730 59.318 0.412 17967
3190 1 9 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.690 0.040 17967
3191 1 9 . 1 1 20 20 GLU H H 18 8.010 8.010 7.596 0.414 17967
3192 1 9 . 1 1 21 21 LEU N N 19 118.810 118.810 117.298 1.512 17967
3193 1 9 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.408 -0.108 17967
3194 1 9 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.606 -0.776 17967
3195 1 9 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.859 0.471 17967
3196 1 9 . 1 1 21 21 LEU H H 19 8.010 8.010 8.195 -0.185 17967
3197 1 9 . 1 1 22 22 GLN N N 20 118.310 118.310 115.775 2.535 17967
3198 1 9 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.083 -0.133 17967
3199 1 9 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.336 -0.606 17967
3200 1 9 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.308 -0.178 17967
3201 1 9 . 1 1 22 22 GLN H H 20 7.860 7.860 7.792 0.068 17967
3202 1 9 . 1 1 23 23 THR N N 21 115.910 115.910 112.441 3.469 17967
3203 1 9 . 1 1 23 23 THR HA H 21 4.950 4.950 4.634 0.316 17967
3204 1 9 . 1 1 23 23 THR CA C 21 58.530 58.530 60.063 -1.533 17967
3205 1 9 . 1 1 23 23 THR CB C 21 70.330 70.330 70.601 -0.271 17967
3206 1 9 . 1 1 23 23 THR H H 21 8.250 8.250 8.387 -0.137 17967
3207 1 9 . 1 1 24 24 THR N N 22 112.810 112.810 114.328 -1.518 17967
3208 1 9 . 1 1 24 24 THR HA H 22 4.880 4.880 4.638 0.242 17967
3209 1 9 . 1 1 24 24 THR CA C 22 59.730 59.730 60.341 -0.611 17967
3210 1 9 . 1 1 24 24 THR CB C 22 74.130 74.130 71.238 2.892 17967
3211 1 9 . 1 1 24 24 THR H H 22 8.660 8.660 7.878 0.782 17967
3212 1 9 . 1 1 25 25 ILE N N 23 123.710 123.710 120.336 3.374 17967
3213 1 9 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.689 0.091 17967
3214 1 9 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.192 -0.762 17967
3215 1 9 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.922 0.708 17967
3216 1 9 . 1 1 25 25 ILE H H 23 9.060 9.060 8.185 0.875 17967
3217 1 9 . 1 1 26 26 HIS N N 24 119.510 119.510 113.086 6.424 17967
3218 1 9 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.721 -0.281 17967
3219 1 9 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.358 1.671 17967
3220 1 9 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.061 1.768 17967
3221 1 9 . 1 1 26 26 HIS H H 24 7.040 7.040 7.403 -0.363 17967
3222 1 9 . 1 1 27 27 ASP N N 25 116.810 116.810 118.350 -1.540 17967
3223 1 9 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.675 0.085 17967
3224 1 9 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.333 0.097 17967
3225 1 9 . 1 1 27 27 ASP CB C 25 44.330 44.330 42.996 1.333 17967
3226 1 9 . 1 1 27 27 ASP H H 25 7.250 7.250 7.627 -0.377 17967
3227 1 9 . 1 1 28 28 ILE N N 26 123.210 123.210 120.811 2.399 17967
3228 1 9 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.954 -0.024 17967
3229 1 9 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.660 0.370 17967
3230 1 9 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.640 -0.710 17967
3231 1 9 . 1 1 28 28 ILE H H 26 7.750 7.750 7.656 0.094 17967
3232 1 9 . 1 1 29 29 ILE N N 27 131.110 131.110 129.678 1.432 17967
3233 1 9 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.115 0.265 17967
3234 1 9 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.608 -0.777 17967
3235 1 9 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.946 0.685 17967
3236 1 9 . 1 1 29 29 ILE H H 27 8.270 8.270 8.293 -0.023 17967
3237 1 9 . 1 1 30 30 LEU N N 28 129.410 129.410 128.386 1.024 17967
3238 1 9 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.552 0.108 17967
3239 1 9 . 1 1 30 30 LEU CA C 28 52.530 52.530 52.973 -0.443 17967
3240 1 9 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.246 3.084 17967
3241 1 9 . 1 1 30 30 LEU H H 28 8.500 8.500 8.382 0.118 17967
3242 1 9 . 1 1 31 31 GLU N N 29 121.910 121.910 120.457 1.453 17967
3243 1 9 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.740 -0.060 17967
3244 1 9 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.338 0.592 17967
3245 1 9 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.327 0.703 17967
3246 1 9 . 1 1 31 31 GLU H H 29 8.860 8.860 8.244 0.616 17967
3247 1 9 . 1 1 32 32 CYS N N 30 125.710 125.710 120.370 5.340 17967
3248 1 9 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.893 -0.873 17967
3249 1 9 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.535 -1.305 17967
3250 1 9 . 1 1 32 32 CYS CB C 30 31.730 31.730 26.871 4.859 17967
3251 1 9 . 1 1 32 32 CYS H H 30 8.270 8.270 8.471 -0.201 17967
3252 1 9 . 1 1 33 33 VAL N N 31 132.310 132.310 128.770 3.540 17967
3253 1 9 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.104 -0.004 17967
3254 1 9 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.071 -0.841 17967
3255 1 9 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.974 -0.344 17967
3256 1 9 . 1 1 33 33 VAL H H 31 8.860 8.860 7.939 0.921 17967
3257 1 9 . 1 1 34 34 TYR N N 32 124.310 124.310 114.408 9.902 17967
3258 1 9 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.510 -0.070 17967
3259 1 9 . 1 1 34 34 TYR CA C 32 61.030 61.030 59.789 1.241 17967
3260 1 9 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.319 1.811 17967
3261 1 9 . 1 1 34 34 TYR H H 32 8.590 8.590 7.094 1.496 17967
3262 1 9 . 1 1 35 35 CYS N N 33 119.810 119.810 112.610 7.200 17967
3263 1 9 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.700 0.140 17967
3264 1 9 . 1 1 35 35 CYS CA C 33 59.430 59.430 57.261 2.169 17967
3265 1 9 . 1 1 35 35 CYS CB C 33 32.230 32.230 27.733 4.497 17967
3266 1 9 . 1 1 35 35 CYS H H 33 8.070 8.070 7.588 0.482 17967
3267 1 9 . 1 1 36 36 LYS N N 34 119.910 119.910 118.590 1.320 17967
3268 1 9 . 1 1 36 36 LYS HA H 34 4.190 4.190 4.018 0.172 17967
3269 1 9 . 1 1 36 36 LYS CA C 34 57.830 57.830 56.998 0.832 17967
3270 1 9 . 1 1 36 36 LYS CB C 34 29.330 29.330 29.637 -0.308 17967
3271 1 9 . 1 1 36 36 LYS H H 34 7.860 7.860 7.788 0.072 17967
3272 1 9 . 1 1 37 37 GLN N N 35 120.710 120.710 118.107 2.603 17967
3273 1 9 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.517 -0.157 17967
3274 1 9 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.254 1.176 17967
3275 1 9 . 1 1 37 37 GLN CB C 35 29.630 29.630 30.685 -1.055 17967
3276 1 9 . 1 1 37 37 GLN H H 35 8.270 8.270 8.151 0.119 17967
3277 1 9 . 1 1 38 38 GLN N N 36 123.710 123.710 123.637 0.073 17967
3278 1 9 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.268 0.032 17967
3279 1 9 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.361 0.368 17967
3280 1 9 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.769 0.561 17967
3281 1 9 . 1 1 38 38 GLN H H 36 8.640 8.640 8.608 0.032 17967
3282 1 9 . 1 1 39 39 LEU N N 37 131.310 131.310 126.501 4.809 17967
3283 1 9 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.128 -0.018 17967
3284 1 9 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.482 1.848 17967
3285 1 9 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.423 -0.493 17967
3286 1 9 . 1 1 39 39 LEU H H 37 8.870 8.870 8.037 0.833 17967
3287 1 9 . 1 1 40 40 LEU N N 38 126.310 126.310 124.035 2.275 17967
3288 1 9 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.327 -0.017 17967
3289 1 9 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.611 -0.381 17967
3290 1 9 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.159 -0.029 17967
3291 1 9 . 1 1 40 40 LEU H H 38 9.850 9.850 8.370 1.480 17967
3292 1 9 . 1 1 41 41 ARG N N 39 127.110 127.110 126.092 1.018 17967
3293 1 9 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.652 -0.132 17967
3294 1 9 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.155 -1.325 17967
3295 1 9 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.305 -2.375 17967
3296 1 9 . 1 1 41 41 ARG H H 39 8.970 8.970 8.817 0.153 17967
3297 1 9 . 1 1 42 42 ARG N N 40 115.810 115.810 119.843 -4.033 17967
3298 1 9 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.218 -0.138 17967
3299 1 9 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.717 -0.587 17967
3300 1 9 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.834 -0.504 17967
3301 1 9 . 1 1 42 42 ARG H H 40 8.610 8.610 8.656 -0.046 17967
3302 1 9 . 1 1 43 43 GLU N N 41 119.910 119.910 117.698 2.212 17967
3303 1 9 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.434 -0.184 17967
3304 1 9 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.359 0.671 17967
3305 1 9 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.183 1.147 17967
3306 1 9 . 1 1 43 43 GLU H H 41 6.950 6.950 8.119 -1.169 17967
3307 1 9 . 1 1 44 44 VAL N N 42 125.010 125.010 120.451 4.559 17967
3308 1 9 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.660 -0.420 17967
3309 1 9 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.209 1.421 17967
3310 1 9 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.196 0.134 17967
3311 1 9 . 1 1 44 44 VAL H H 42 7.820 7.820 7.897 -0.077 17967
3312 1 9 . 1 1 45 45 TYR N N 43 118.410 118.410 119.362 -0.952 17967
3313 1 9 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.139 0.291 17967
3314 1 9 . 1 1 45 45 TYR CA C 43 58.830 58.830 60.389 -1.558 17967
3315 1 9 . 1 1 45 45 TYR CB C 43 36.730 36.730 36.975 -0.245 17967
3316 1 9 . 1 1 45 45 TYR H H 43 7.820 7.820 8.270 -0.450 17967
3317 1 9 . 1 1 46 46 ASP N N 44 122.410 122.410 120.289 2.121 17967
3318 1 9 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.343 0.257 17967
3319 1 9 . 1 1 46 46 ASP CA C 44 57.830 57.830 58.789 -0.959 17967
3320 1 9 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.492 0.538 17967
3321 1 9 . 1 1 46 46 ASP H H 44 8.540 8.540 7.935 0.605 17967
3322 1 9 . 1 1 47 47 PHE N N 45 126.210 126.210 118.580 7.630 17967
3323 1 9 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.153 -0.243 17967
3324 1 9 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.846 0.784 17967
3325 1 9 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.208 0.123 17967
3326 1 9 . 1 1 47 47 PHE H H 45 8.320 8.320 7.520 0.800 17967
3327 1 9 . 1 1 48 48 ALA N N 46 119.110 119.110 119.230 -0.120 17967
3328 1 9 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.359 0.161 17967
3329 1 9 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.819 0.411 17967
3330 1 9 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.798 -0.068 17967
3331 1 9 . 1 1 48 48 ALA H H 46 7.740 7.740 7.668 0.072 17967
3332 1 9 . 1 1 49 49 ARG N N 47 124.010 124.010 117.741 6.269 17967
3333 1 9 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.277 -0.227 17967
3334 1 9 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.628 2.002 17967
3335 1 9 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.489 -0.059 17967
3336 1 9 . 1 1 49 49 ARG H H 47 8.500 8.500 8.344 0.156 17967
3337 1 9 . 1 1 50 50 ARG N N 48 119.110 119.110 118.169 0.941 17967
3338 1 9 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.494 -0.484 17967
3339 1 9 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.831 2.299 17967
3340 1 9 . 1 1 50 50 ARG CB C 48 31.130 31.130 31.761 -0.631 17967
3341 1 9 . 1 1 50 50 ARG H H 48 7.940 7.940 7.767 0.173 17967
3342 1 9 . 1 1 51 51 ASP N N 49 120.910 120.910 120.607 0.303 17967
3343 1 9 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.767 -0.347 17967
3344 1 9 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.617 0.913 17967
3345 1 9 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.564 -0.634 17967
3346 1 9 . 1 1 51 51 ASP H H 49 7.950 7.950 8.485 -0.535 17967
3347 1 9 . 1 1 52 52 LEU N N 50 118.410 118.410 121.720 -3.310 17967
3348 1 9 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.748 -0.598 17967
3349 1 9 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.445 0.785 17967
3350 1 9 . 1 1 52 52 LEU CB C 50 41.130 41.130 43.455 -2.325 17967
3351 1 9 . 1 1 52 52 LEU H H 50 6.640 6.640 7.456 -0.816 17967
3352 1 9 . 1 1 53 53 CYS N N 51 117.410 117.410 118.953 -1.543 17967
3353 1 9 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.070 -0.140 17967
3354 1 9 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.015 2.915 17967
3355 1 9 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.711 -2.081 17967
3356 1 9 . 1 1 53 53 CYS H H 51 8.030 8.030 8.345 -0.315 17967
3357 1 9 . 1 1 54 54 ILE N N 52 125.110 125.110 122.244 2.866 17967
3358 1 9 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.312 -0.302 17967
3359 1 9 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.996 -2.366 17967
3360 1 9 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.989 -1.659 17967
3361 1 9 . 1 1 54 54 ILE H H 52 8.500 8.500 8.761 -0.261 17967
3362 1 9 . 1 1 55 55 VAL N N 53 127.010 127.010 123.654 3.356 17967
3363 1 9 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.732 -0.362 17967
3364 1 9 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.126 0.504 17967
3365 1 9 . 1 1 55 55 VAL CB C 53 34.230 34.230 33.195 1.035 17967
3366 1 9 . 1 1 55 55 VAL H H 53 8.130 8.130 8.101 0.029 17967
3367 1 9 . 1 1 56 56 TYR N N 54 124.910 124.910 126.826 -1.916 17967
3368 1 9 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.301 0.099 17967
3369 1 9 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.719 -0.389 17967
3370 1 9 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.565 1.466 17967
3371 1 9 . 1 1 56 56 TYR H H 54 8.700 8.700 8.668 0.032 17967
3372 1 9 . 1 1 57 57 ARG N N 55 123.810 123.810 125.456 -1.646 17967
3373 1 9 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.497 0.143 17967
3374 1 9 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.384 0.046 17967
3375 1 9 . 1 1 57 57 ARG CB C 55 32.830 32.830 31.241 1.589 17967
3376 1 9 . 1 1 57 57 ARG H H 55 8.870 8.870 8.368 0.502 17967
3377 1 9 . 1 1 58 58 ASP N N 56 129.110 129.110 124.980 4.130 17967
3378 1 9 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.323 -0.013 17967
3379 1 9 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.310 -0.480 17967
3380 1 9 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.264 -0.134 17967
3381 1 9 . 1 1 58 58 ASP H H 56 9.620 9.620 8.884 0.736 17967
3382 1 9 . 1 1 59 59 GLY N N 57 104.510 104.510 106.812 -2.302 17967
3383 1 9 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.300 0.330 17967
3384 1 9 . 1 1 59 59 GLY H H 57 8.720 8.720 8.288 0.432 17967
3385 1 9 . 1 1 60 60 ASN N N 58 122.210 122.210 118.876 3.334 17967
3386 1 9 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.264 0.136 17967
3387 1 9 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.908 -0.578 17967
3388 1 9 . 1 1 60 60 ASN CB C 58 40.430 40.430 41.321 -0.891 17967
3389 1 9 . 1 1 60 60 ASN H H 58 8.120 8.120 7.931 0.189 17967
3390 1 9 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.633 0.157 17967
3391 1 9 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.359 -0.329 17967
3392 1 9 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.202 2.328 17967
3393 1 9 . 1 1 62 62 TYR N N 60 119.810 119.810 122.623 -2.813 17967
3394 1 9 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.509 -0.149 17967
3395 1 9 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.377 1.853 17967
3396 1 9 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.485 0.945 17967
3397 1 9 . 1 1 62 62 TYR H H 60 8.590 8.590 7.641 0.949 17967
3398 1 9 . 1 1 63 63 ALA N N 61 123.810 123.810 121.607 2.203 17967
3399 1 9 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.301 0.119 17967
3400 1 9 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.202 0.128 17967
3401 1 9 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.876 -0.546 17967
3402 1 9 . 1 1 63 63 ALA H H 61 8.010 8.010 8.843 -0.833 17967
3403 1 9 . 1 1 64 64 VAL N N 62 120.510 120.510 118.362 2.148 17967
3404 1 9 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.253 1.247 17967
3405 1 9 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.246 -0.016 17967
3406 1 9 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.315 3.015 17967
3407 1 9 . 1 1 64 64 VAL H H 62 6.380 6.380 8.475 -2.095 17967
3408 1 9 . 1 1 65 65 CYS N N 63 130.310 130.310 125.956 4.354 17967
3409 1 9 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.432 0.128 17967
3410 1 9 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.400 0.030 17967
3411 1 9 . 1 1 65 65 CYS CB C 63 31.130 31.130 28.625 2.506 17967
3412 1 9 . 1 1 65 65 CYS H H 63 9.430 9.430 8.288 1.142 17967
3413 1 9 . 1 1 66 66 ASP N N 64 121.110 121.110 120.019 1.091 17967
3414 1 9 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.326 0.084 17967
3415 1 9 . 1 1 66 66 ASP CA C 64 58.230 58.230 57.579 0.651 17967
3416 1 9 . 1 1 66 66 ASP CB C 64 42.330 42.330 41.039 1.291 17967
3417 1 9 . 1 1 66 66 ASP H H 64 9.120 9.120 8.711 0.409 17967
3418 1 9 . 1 1 67 67 LYS N N 65 122.110 122.110 118.539 3.571 17967
3419 1 9 . 1 1 67 67 LYS HA H 65 4.010 4.010 4.248 -0.238 17967
3420 1 9 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.731 1.399 17967
3421 1 9 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.707 0.123 17967
3422 1 9 . 1 1 67 67 LYS H H 65 8.330 8.330 7.592 0.738 17967
3423 1 9 . 1 1 68 68 CYS N N 66 125.610 125.610 119.276 6.334 17967
3424 1 9 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.122 -0.012 17967
3425 1 9 . 1 1 68 68 CYS CA C 66 63.530 63.530 61.197 2.333 17967
3426 1 9 . 1 1 68 68 CYS CB C 66 30.730 30.730 25.729 5.001 17967
3427 1 9 . 1 1 68 68 CYS H H 66 8.700 8.700 7.698 1.002 17967
3428 1 9 . 1 1 69 69 LEU N N 67 125.310 125.310 122.051 3.259 17967
3429 1 9 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.034 -0.034 17967
3430 1 9 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.364 0.166 17967
3431 1 9 . 1 1 69 69 LEU CB C 67 42.130 42.130 42.133 -0.003 17967
3432 1 9 . 1 1 69 69 LEU H H 67 8.470 8.470 8.240 0.230 17967
3433 1 9 . 1 1 70 70 LYS N N 68 119.010 119.010 117.742 1.268 17967
3434 1 9 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.155 -0.175 17967
3435 1 9 . 1 1 70 70 LYS CA C 68 58.830 58.830 57.927 0.903 17967
3436 1 9 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.459 0.672 17967
3437 1 9 . 1 1 70 70 LYS H H 68 7.810 7.810 7.821 -0.011 17967
3438 1 9 . 1 1 71 71 PHE N N 69 121.710 121.710 119.481 2.229 17967
3439 1 9 . 1 1 71 71 PHE HA H 69 4.280 4.280 3.882 0.398 17967
3440 1 9 . 1 1 71 71 PHE CA C 69 59.930 59.930 61.178 -1.248 17967
3441 1 9 . 1 1 71 71 PHE CB C 69 39.430 39.430 39.650 -0.220 17967
3442 1 9 . 1 1 71 71 PHE H H 69 7.810 7.810 7.810 0.000 17967
3443 1 9 . 1 1 72 72 TYR N N 70 120.110 120.110 115.589 4.521 17967
3444 1 9 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.627 -0.307 17967
3445 1 9 . 1 1 72 72 TYR CA C 70 60.330 60.330 57.791 2.539 17967
3446 1 9 . 1 1 72 72 TYR CB C 70 40.430 40.430 39.813 0.617 17967
3447 1 9 . 1 1 72 72 TYR H H 70 8.280 8.280 7.963 0.317 17967
3448 1 9 . 1 1 73 73 SER N N 71 117.210 117.210 117.516 -0.306 17967
3449 1 9 . 1 1 73 73 SER HA H 71 4.320 4.320 4.609 -0.289 17967
3450 1 9 . 1 1 73 73 SER CA C 71 60.130 60.130 58.977 1.153 17967
3451 1 9 . 1 1 73 73 SER CB C 71 63.630 63.630 64.841 -1.211 17967
3452 1 9 . 1 1 73 73 SER H H 71 7.870 7.870 8.444 -0.574 17967
3453 1 9 . 1 1 74 74 LYS N N 72 122.810 122.810 123.839 -1.029 17967
3454 1 9 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.246 0.024 17967
3455 1 9 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.072 -0.142 17967
3456 1 9 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.715 -0.085 17967
3457 1 9 . 1 1 74 74 LYS H H 72 7.800 7.800 8.547 -0.747 17967
3458 1 9 . 1 1 75 75 ILE N N 73 121.610 121.610 114.776 6.834 17967
3459 1 9 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.369 -0.259 17967
3460 1 9 . 1 1 75 75 ILE CA C 73 61.830 61.830 61.006 0.824 17967
3461 1 9 . 1 1 75 75 ILE CB C 73 38.630 38.630 37.513 1.117 17967
3462 1 9 . 1 1 75 75 ILE H H 73 7.750 7.750 7.571 0.179 17967
3463 1 9 . 1 1 76 76 SER N N 74 120.410 120.410 120.795 -0.385 17967
3464 1 9 . 1 1 76 76 SER HA H 74 4.300 4.300 4.559 -0.259 17967
3465 1 9 . 1 1 76 76 SER CA C 74 59.330 59.330 59.262 0.068 17967
3466 1 9 . 1 1 76 76 SER CB C 74 63.830 63.830 64.597 -0.768 17967
3467 1 9 . 1 1 76 76 SER H H 74 8.130 8.130 8.630 -0.500 17967
3468 1 9 . 1 1 77 77 GLU N N 75 123.810 123.810 121.736 2.074 17967
3469 1 9 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.644 -0.454 17967
3470 1 9 . 1 1 77 77 GLU CA C 75 57.330 57.330 55.882 1.448 17967
3471 1 9 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.032 0.098 17967
3472 1 9 . 1 1 77 77 GLU H H 75 8.270 8.270 8.370 -0.100 17967
3473 1 9 . 1 1 78 78 TYR N N 76 122.410 122.410 124.451 -2.041 17967
3474 1 9 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.743 -0.283 17967
3475 1 9 . 1 1 78 78 TYR CA C 76 58.130 58.130 56.749 1.381 17967
3476 1 9 . 1 1 78 78 TYR CB C 76 38.630 38.630 41.147 -2.517 17967
3477 1 9 . 1 1 78 78 TYR H H 76 7.980 7.980 8.532 -0.552 17967
3478 1 9 . 1 1 79 79 ARG N N 77 124.710 124.710 127.148 -2.438 17967
3479 1 9 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.817 -0.617 17967
3480 1 9 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.552 0.478 17967
3481 1 9 . 1 1 79 79 ARG CB C 77 31.030 31.030 28.886 2.144 17967
3482 1 9 . 1 1 79 79 ARG H H 77 7.880 7.880 8.443 -0.563 17967
3483 1 9 . 1 1 80 80 HIS N N 78 122.110 122.110 120.958 1.152 17967
3484 1 9 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.388 0.122 17967
3485 1 9 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.776 0.554 17967
3486 1 9 . 1 1 80 80 HIS CB C 78 30.830 30.830 29.734 1.096 17967
3487 1 9 . 1 1 80 80 HIS H H 78 8.120 8.120 8.314 -0.194 17967
3488 1 9 . 1 1 81 81 TYR N N 79 123.610 123.610 118.724 4.886 17967
3489 1 9 . 1 1 81 81 TYR HA H 79 4.590 4.590 3.903 0.687 17967
3490 1 9 . 1 1 81 81 TYR CA C 79 57.830 57.830 58.464 -0.634 17967
3491 1 9 . 1 1 81 81 TYR CB C 79 39.130 39.130 38.005 1.125 17967
3492 1 9 . 1 1 81 81 TYR H H 79 7.970 7.970 7.044 0.926 17967
3493 1 10 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.062 0.228 17967
3494 1 10 . 1 1 2 2 ALA CA C 0 52.530 52.530 53.391 -0.861 17967
3495 1 10 . 1 1 2 2 ALA CB C 0 19.730 19.730 19.420 0.310 17967
3496 1 10 . 1 1 3 3 MET N N 1 122.210 122.210 119.307 2.903 17967
3497 1 10 . 1 1 3 3 MET HA H 1 4.300 4.300 4.344 -0.044 17967
3498 1 10 . 1 1 3 3 MET CA C 1 56.030 56.030 55.234 0.796 17967
3499 1 10 . 1 1 3 3 MET CB C 1 33.430 33.430 32.642 0.788 17967
3500 1 10 . 1 1 3 3 MET H H 1 8.370 8.370 7.685 0.685 17967
3501 1 10 . 1 1 4 4 PHE N N 2 122.310 122.310 124.741 -2.431 17967
3502 1 10 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.745 -0.115 17967
3503 1 10 . 1 1 4 4 PHE CA C 2 57.330 57.330 55.736 1.594 17967
3504 1 10 . 1 1 4 4 PHE CB C 2 39.430 39.430 41.006 -1.576 17967
3505 1 10 . 1 1 4 4 PHE H H 2 8.370 8.370 8.536 -0.166 17967
3506 1 10 . 1 1 5 5 GLN N N 3 123.510 123.510 119.623 3.887 17967
3507 1 10 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.438 -0.258 17967
3508 1 10 . 1 1 5 5 GLN CA C 3 56.130 56.130 54.448 1.682 17967
3509 1 10 . 1 1 5 5 GLN CB C 3 29.930 29.930 30.330 -0.400 17967
3510 1 10 . 1 1 5 5 GLN H H 3 8.260 8.260 8.190 0.070 17967
3511 1 10 . 1 1 6 6 ASP N N 4 125.010 125.010 120.008 5.002 17967
3512 1 10 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.740 0.050 17967
3513 1 10 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.437 0.493 17967
3514 1 10 . 1 1 6 6 ASP CB C 4 41.730 41.730 42.007 -0.277 17967
3515 1 10 . 1 1 6 6 ASP H H 4 8.420 8.420 8.344 0.076 17967
3516 1 10 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.560 -0.440 17967
3517 1 10 . 1 1 7 7 PRO CA C 5 64.030 64.030 63.416 0.614 17967
3518 1 10 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.734 -0.404 17967
3519 1 10 . 1 1 8 8 GLN N N 6 119.710 119.710 118.353 1.357 17967
3520 1 10 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.308 -0.148 17967
3521 1 10 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.422 1.208 17967
3522 1 10 . 1 1 8 8 GLN CB C 6 29.330 29.330 26.808 2.522 17967
3523 1 10 . 1 1 8 8 GLN H H 6 8.430 8.430 8.312 0.118 17967
3524 1 10 . 1 1 9 9 GLU N N 7 122.110 122.110 120.194 1.916 17967
3525 1 10 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.246 -0.046 17967
3526 1 10 . 1 1 9 9 GLU CA C 7 56.030 56.030 56.097 -0.067 17967
3527 1 10 . 1 1 9 9 GLU CB C 7 30.530 30.530 30.131 0.399 17967
3528 1 10 . 1 1 9 9 GLU H H 7 7.940 7.940 7.716 0.224 17967
3529 1 10 . 1 1 10 10 ARG N N 8 123.410 123.410 119.091 4.319 17967
3530 1 10 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.652 -0.252 17967
3531 1 10 . 1 1 10 10 ARG CA C 8 54.130 54.130 53.609 0.521 17967
3532 1 10 . 1 1 10 10 ARG CB C 8 29.330 29.330 30.374 -1.044 17967
3533 1 10 . 1 1 10 10 ARG H H 8 7.660 7.660 7.557 0.103 17967
3534 1 10 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.637 -0.287 17967
3535 1 10 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.656 0.874 17967
3536 1 10 . 1 1 11 11 PRO CB C 9 32.630 32.630 33.532 -0.902 17967
3537 1 10 . 1 1 12 12 ARG N N 10 123.810 123.810 115.591 8.219 17967
3538 1 10 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.787 -0.117 17967
3539 1 10 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.960 0.870 17967
3540 1 10 . 1 1 12 12 ARG CB C 10 32.530 32.530 32.123 0.407 17967
3541 1 10 . 1 1 12 12 ARG H H 10 8.710 8.710 8.587 0.123 17967
3542 1 10 . 1 1 13 13 LYS N N 11 118.410 118.410 119.394 -0.984 17967
3543 1 10 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.795 0.255 17967
3544 1 10 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.504 -1.174 17967
3545 1 10 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.833 0.597 17967
3546 1 10 . 1 1 13 13 LYS H H 11 7.800 7.800 7.688 0.112 17967
3547 1 10 . 1 1 14 14 LEU N N 12 125.010 125.010 126.358 -1.348 17967
3548 1 10 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.224 -0.054 17967
3549 1 10 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.726 0.004 17967
3550 1 10 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.773 0.756 17967
3551 1 10 . 1 1 14 14 LEU H H 12 10.210 10.210 9.213 0.997 17967
3552 1 10 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.276 -0.056 17967
3553 1 10 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.703 1.527 17967
3554 1 10 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.024 -0.294 17967
3555 1 10 . 1 1 16 16 GLN N N 14 117.810 117.810 117.507 0.303 17967
3556 1 10 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.139 0.051 17967
3557 1 10 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.979 0.051 17967
3558 1 10 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.201 0.429 17967
3559 1 10 . 1 1 16 16 GLN H H 14 7.110 7.110 8.405 -1.295 17967
3560 1 10 . 1 1 17 17 LEU N N 15 124.710 124.710 122.287 2.423 17967
3561 1 10 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.194 -0.184 17967
3562 1 10 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.924 0.406 17967
3563 1 10 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.731 0.299 17967
3564 1 10 . 1 1 17 17 LEU H H 15 8.010 8.010 8.132 -0.122 17967
3565 1 10 . 1 1 18 18 CYS N N 16 117.210 117.210 117.248 -0.038 17967
3566 1 10 . 1 1 18 18 CYS HA H 16 3.750 3.750 4.013 -0.263 17967
3567 1 10 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.856 0.874 17967
3568 1 10 . 1 1 18 18 CYS CB C 16 26.230 26.230 26.044 0.186 17967
3569 1 10 . 1 1 18 18 CYS H H 16 8.380 8.380 8.436 -0.056 17967
3570 1 10 . 1 1 19 19 THR N N 17 117.810 117.810 116.509 1.301 17967
3571 1 10 . 1 1 19 19 THR HA H 17 4.000 4.000 4.002 -0.002 17967
3572 1 10 . 1 1 19 19 THR CA C 17 66.830 66.830 66.935 -0.105 17967
3573 1 10 . 1 1 19 19 THR CB C 17 68.830 68.830 68.664 0.166 17967
3574 1 10 . 1 1 19 19 THR H H 17 7.720 7.720 7.749 -0.029 17967
3575 1 10 . 1 1 20 20 GLU N N 18 125.410 125.410 121.284 4.126 17967
3576 1 10 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.191 -0.121 17967
3577 1 10 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.885 0.845 17967
3578 1 10 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.579 0.151 17967
3579 1 10 . 1 1 20 20 GLU H H 18 8.010 8.010 7.596 0.414 17967
3580 1 10 . 1 1 21 21 LEU N N 19 118.810 118.810 116.903 1.907 17967
3581 1 10 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.348 -0.048 17967
3582 1 10 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.400 -0.570 17967
3583 1 10 . 1 1 21 21 LEU CB C 19 42.330 42.330 42.004 0.326 17967
3584 1 10 . 1 1 21 21 LEU H H 19 8.010 8.010 8.072 -0.062 17967
3585 1 10 . 1 1 22 22 GLN N N 20 118.310 118.310 115.701 2.609 17967
3586 1 10 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.063 -0.113 17967
3587 1 10 . 1 1 22 22 GLN CA C 20 56.730 56.730 56.993 -0.263 17967
3588 1 10 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.076 0.054 17967
3589 1 10 . 1 1 22 22 GLN H H 20 7.860 7.860 7.614 0.246 17967
3590 1 10 . 1 1 23 23 THR N N 21 115.910 115.910 111.050 4.860 17967
3591 1 10 . 1 1 23 23 THR HA H 21 4.950 4.950 4.572 0.378 17967
3592 1 10 . 1 1 23 23 THR CA C 21 58.530 58.530 59.790 -1.260 17967
3593 1 10 . 1 1 23 23 THR CB C 21 70.330 70.330 70.177 0.153 17967
3594 1 10 . 1 1 23 23 THR H H 21 8.250 8.250 8.391 -0.141 17967
3595 1 10 . 1 1 24 24 THR N N 22 112.810 112.810 114.465 -1.655 17967
3596 1 10 . 1 1 24 24 THR HA H 22 4.880 4.880 4.613 0.267 17967
3597 1 10 . 1 1 24 24 THR CA C 22 59.730 59.730 60.478 -0.748 17967
3598 1 10 . 1 1 24 24 THR CB C 22 74.130 74.130 71.322 2.808 17967
3599 1 10 . 1 1 24 24 THR H H 22 8.660 8.660 7.966 0.694 17967
3600 1 10 . 1 1 25 25 ILE N N 23 123.710 123.710 121.110 2.600 17967
3601 1 10 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.716 0.064 17967
3602 1 10 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.225 -0.795 17967
3603 1 10 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.834 0.796 17967
3604 1 10 . 1 1 25 25 ILE H H 23 9.060 9.060 8.300 0.760 17967
3605 1 10 . 1 1 26 26 HIS N N 24 119.510 119.510 114.026 5.484 17967
3606 1 10 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.704 -0.264 17967
3607 1 10 . 1 1 26 26 HIS CA C 24 57.030 57.030 56.168 0.862 17967
3608 1 10 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.076 1.754 17967
3609 1 10 . 1 1 26 26 HIS H H 24 7.040 7.040 7.459 -0.419 17967
3610 1 10 . 1 1 27 27 ASP N N 25 116.810 116.810 118.760 -1.950 17967
3611 1 10 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.658 0.102 17967
3612 1 10 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.131 0.299 17967
3613 1 10 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.017 1.313 17967
3614 1 10 . 1 1 27 27 ASP H H 25 7.250 7.250 7.594 -0.344 17967
3615 1 10 . 1 1 28 28 ILE N N 26 123.210 123.210 121.671 1.539 17967
3616 1 10 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.896 0.034 17967
3617 1 10 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.478 0.552 17967
3618 1 10 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.898 -0.968 17967
3619 1 10 . 1 1 28 28 ILE H H 26 7.750 7.750 7.814 -0.064 17967
3620 1 10 . 1 1 29 29 ILE N N 27 131.110 131.110 128.232 2.878 17967
3621 1 10 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.106 0.274 17967
3622 1 10 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.869 -1.039 17967
3623 1 10 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.629 1.001 17967
3624 1 10 . 1 1 29 29 ILE H H 27 8.270 8.270 8.272 -0.002 17967
3625 1 10 . 1 1 30 30 LEU N N 28 129.410 129.410 129.531 -0.121 17967
3626 1 10 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.547 0.113 17967
3627 1 10 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.416 -0.886 17967
3628 1 10 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.391 2.939 17967
3629 1 10 . 1 1 30 30 LEU H H 28 8.500 8.500 8.398 0.102 17967
3630 1 10 . 1 1 31 31 GLU N N 29 121.910 121.910 121.362 0.548 17967
3631 1 10 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.691 -0.011 17967
3632 1 10 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.316 0.614 17967
3633 1 10 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.441 0.589 17967
3634 1 10 . 1 1 31 31 GLU H H 29 8.860 8.860 8.230 0.630 17967
3635 1 10 . 1 1 32 32 CYS N N 30 125.710 125.710 120.473 5.237 17967
3636 1 10 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.879 -0.859 17967
3637 1 10 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.629 -1.399 17967
3638 1 10 . 1 1 32 32 CYS CB C 30 31.730 31.730 26.802 4.928 17967
3639 1 10 . 1 1 32 32 CYS H H 30 8.270 8.270 8.512 -0.242 17967
3640 1 10 . 1 1 33 33 VAL N N 31 132.310 132.310 128.643 3.667 17967
3641 1 10 . 1 1 33 33 VAL HA H 31 3.100 3.100 2.992 0.108 17967
3642 1 10 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.605 -1.375 17967
3643 1 10 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.850 -0.220 17967
3644 1 10 . 1 1 33 33 VAL H H 31 8.860 8.860 8.101 0.759 17967
3645 1 10 . 1 1 34 34 TYR N N 32 124.310 124.310 116.753 7.557 17967
3646 1 10 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.623 -0.183 17967
3647 1 10 . 1 1 34 34 TYR CA C 32 61.030 61.030 60.138 0.892 17967
3648 1 10 . 1 1 34 34 TYR CB C 32 40.130 40.130 37.815 2.315 17967
3649 1 10 . 1 1 34 34 TYR H H 32 8.590 8.590 7.430 1.160 17967
3650 1 10 . 1 1 35 35 CYS N N 33 119.810 119.810 116.569 3.241 17967
3651 1 10 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.631 0.209 17967
3652 1 10 . 1 1 35 35 CYS CA C 33 59.430 59.430 59.264 0.166 17967
3653 1 10 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.670 3.560 17967
3654 1 10 . 1 1 35 35 CYS H H 33 8.070 8.070 7.570 0.500 17967
3655 1 10 . 1 1 36 36 LYS N N 34 119.910 119.910 115.182 4.728 17967
3656 1 10 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.878 0.312 17967
3657 1 10 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.205 0.625 17967
3658 1 10 . 1 1 36 36 LYS CB C 34 29.330 29.330 29.949 -0.619 17967
3659 1 10 . 1 1 36 36 LYS H H 34 7.860 7.860 8.199 -0.339 17967
3660 1 10 . 1 1 37 37 GLN N N 35 120.710 120.710 114.203 6.507 17967
3661 1 10 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.428 -0.068 17967
3662 1 10 . 1 1 37 37 GLN CA C 35 55.430 55.430 53.974 1.456 17967
3663 1 10 . 1 1 37 37 GLN CB C 35 29.630 29.630 30.135 -0.505 17967
3664 1 10 . 1 1 37 37 GLN H H 35 8.270 8.270 7.699 0.571 17967
3665 1 10 . 1 1 38 38 GLN N N 36 123.710 123.710 124.439 -0.729 17967
3666 1 10 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.141 0.159 17967
3667 1 10 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.443 0.287 17967
3668 1 10 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.964 0.366 17967
3669 1 10 . 1 1 38 38 GLN H H 36 8.640 8.640 8.642 -0.002 17967
3670 1 10 . 1 1 39 39 LEU N N 37 131.310 131.310 127.886 3.424 17967
3671 1 10 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.149 -0.039 17967
3672 1 10 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.627 1.703 17967
3673 1 10 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.510 -0.579 17967
3674 1 10 . 1 1 39 39 LEU H H 37 8.870 8.870 7.817 1.053 17967
3675 1 10 . 1 1 40 40 LEU N N 38 126.310 126.310 124.377 1.933 17967
3676 1 10 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.255 0.055 17967
3677 1 10 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.817 -0.587 17967
3678 1 10 . 1 1 40 40 LEU CB C 38 43.130 43.130 42.949 0.181 17967
3679 1 10 . 1 1 40 40 LEU H H 38 9.850 9.850 8.294 1.556 17967
3680 1 10 . 1 1 41 41 ARG N N 39 127.110 127.110 125.471 1.639 17967
3681 1 10 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.728 -0.208 17967
3682 1 10 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.411 -1.581 17967
3683 1 10 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.740 -2.810 17967
3684 1 10 . 1 1 41 41 ARG H H 39 8.970 8.970 8.867 0.103 17967
3685 1 10 . 1 1 42 42 ARG N N 40 115.810 115.810 117.767 -1.957 17967
3686 1 10 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.175 -0.095 17967
3687 1 10 . 1 1 42 42 ARG CA C 40 59.130 59.130 60.005 -0.875 17967
3688 1 10 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.837 -0.507 17967
3689 1 10 . 1 1 42 42 ARG H H 40 8.610 8.610 8.504 0.106 17967
3690 1 10 . 1 1 43 43 GLU N N 41 119.910 119.910 119.112 0.798 17967
3691 1 10 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.098 0.152 17967
3692 1 10 . 1 1 43 43 GLU CA C 41 59.030 59.030 59.140 -0.110 17967
3693 1 10 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.453 0.877 17967
3694 1 10 . 1 1 43 43 GLU H H 41 6.950 6.950 7.903 -0.953 17967
3695 1 10 . 1 1 44 44 VAL N N 42 125.010 125.010 120.026 4.984 17967
3696 1 10 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.552 -0.312 17967
3697 1 10 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.048 1.582 17967
3698 1 10 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.621 -0.291 17967
3699 1 10 . 1 1 44 44 VAL H H 42 7.820 7.820 7.581 0.239 17967
3700 1 10 . 1 1 45 45 TYR N N 43 118.410 118.410 118.411 -0.001 17967
3701 1 10 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.234 0.196 17967
3702 1 10 . 1 1 45 45 TYR CA C 43 58.830 58.830 59.736 -0.905 17967
3703 1 10 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.410 -0.680 17967
3704 1 10 . 1 1 45 45 TYR H H 43 7.820 7.820 7.915 -0.095 17967
3705 1 10 . 1 1 46 46 ASP N N 44 122.410 122.410 121.029 1.381 17967
3706 1 10 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.364 0.236 17967
3707 1 10 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.746 0.084 17967
3708 1 10 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.036 0.994 17967
3709 1 10 . 1 1 46 46 ASP H H 44 8.540 8.540 8.342 0.198 17967
3710 1 10 . 1 1 47 47 PHE N N 45 126.210 126.210 119.069 7.141 17967
3711 1 10 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.161 -0.251 17967
3712 1 10 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.611 1.019 17967
3713 1 10 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.197 0.133 17967
3714 1 10 . 1 1 47 47 PHE H H 45 8.320 8.320 7.601 0.719 17967
3715 1 10 . 1 1 48 48 ALA N N 46 119.110 119.110 119.402 -0.292 17967
3716 1 10 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.354 0.166 17967
3717 1 10 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.746 0.484 17967
3718 1 10 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.728 0.002 17967
3719 1 10 . 1 1 48 48 ALA H H 46 7.740 7.740 8.120 -0.380 17967
3720 1 10 . 1 1 49 49 ARG N N 47 124.010 124.010 118.210 5.800 17967
3721 1 10 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.291 -0.241 17967
3722 1 10 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.239 2.392 17967
3723 1 10 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.509 -0.079 17967
3724 1 10 . 1 1 49 49 ARG H H 47 8.500 8.500 8.222 0.278 17967
3725 1 10 . 1 1 50 50 ARG N N 48 119.110 119.110 117.669 1.441 17967
3726 1 10 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.547 -0.537 17967
3727 1 10 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.742 2.388 17967
3728 1 10 . 1 1 50 50 ARG CB C 48 31.130 31.130 32.259 -1.129 17967
3729 1 10 . 1 1 50 50 ARG H H 48 7.940 7.940 7.737 0.203 17967
3730 1 10 . 1 1 51 51 ASP N N 49 120.910 120.910 119.843 1.067 17967
3731 1 10 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.793 -0.373 17967
3732 1 10 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.739 0.791 17967
3733 1 10 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.561 -0.631 17967
3734 1 10 . 1 1 51 51 ASP H H 49 7.950 7.950 8.413 -0.463 17967
3735 1 10 . 1 1 52 52 LEU N N 50 118.410 118.410 123.430 -5.020 17967
3736 1 10 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.588 -0.438 17967
3737 1 10 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.247 0.983 17967
3738 1 10 . 1 1 52 52 LEU CB C 50 41.130 41.130 44.304 -3.174 17967
3739 1 10 . 1 1 52 52 LEU H H 50 6.640 6.640 7.508 -0.868 17967
3740 1 10 . 1 1 53 53 CYS N N 51 117.410 117.410 116.728 0.682 17967
3741 1 10 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.356 -0.426 17967
3742 1 10 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.043 2.887 17967
3743 1 10 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.803 -2.173 17967
3744 1 10 . 1 1 53 53 CYS H H 51 8.030 8.030 8.283 -0.253 17967
3745 1 10 . 1 1 54 54 ILE N N 52 125.110 125.110 123.505 1.605 17967
3746 1 10 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.301 -0.291 17967
3747 1 10 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.885 -2.255 17967
3748 1 10 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.935 -1.605 17967
3749 1 10 . 1 1 54 54 ILE H H 52 8.500 8.500 9.020 -0.520 17967
3750 1 10 . 1 1 55 55 VAL N N 53 127.010 127.010 123.043 3.967 17967
3751 1 10 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.689 -0.319 17967
3752 1 10 . 1 1 55 55 VAL CA C 53 60.630 60.630 59.549 1.081 17967
3753 1 10 . 1 1 55 55 VAL CB C 53 34.230 34.230 31.376 2.854 17967
3754 1 10 . 1 1 55 55 VAL H H 53 8.130 8.130 8.077 0.053 17967
3755 1 10 . 1 1 56 56 TYR N N 54 124.910 124.910 127.760 -2.850 17967
3756 1 10 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.303 0.097 17967
3757 1 10 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.575 -0.245 17967
3758 1 10 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.154 1.876 17967
3759 1 10 . 1 1 56 56 TYR H H 54 8.700 8.700 8.601 0.099 17967
3760 1 10 . 1 1 57 57 ARG N N 55 123.810 123.810 124.516 -0.706 17967
3761 1 10 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.396 0.244 17967
3762 1 10 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.701 -0.271 17967
3763 1 10 . 1 1 57 57 ARG CB C 55 32.830 32.830 31.073 1.758 17967
3764 1 10 . 1 1 57 57 ARG H H 55 8.870 8.870 8.273 0.597 17967
3765 1 10 . 1 1 58 58 ASP N N 56 129.110 129.110 124.685 4.425 17967
3766 1 10 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.289 0.021 17967
3767 1 10 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.809 -0.979 17967
3768 1 10 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.130 0.000 17967
3769 1 10 . 1 1 58 58 ASP H H 56 9.620 9.620 9.106 0.514 17967
3770 1 10 . 1 1 59 59 GLY N N 57 104.510 104.510 106.758 -2.248 17967
3771 1 10 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.179 0.451 17967
3772 1 10 . 1 1 59 59 GLY H H 57 8.720 8.720 8.235 0.485 17967
3773 1 10 . 1 1 60 60 ASN N N 58 122.210 122.210 119.446 2.764 17967
3774 1 10 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.180 0.220 17967
3775 1 10 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.704 -0.374 17967
3776 1 10 . 1 1 60 60 ASN CB C 58 40.430 40.430 40.684 -0.255 17967
3777 1 10 . 1 1 60 60 ASN H H 58 8.120 8.120 8.027 0.093 17967
3778 1 10 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.850 -0.060 17967
3779 1 10 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.554 -0.524 17967
3780 1 10 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.308 2.222 17967
3781 1 10 . 1 1 62 62 TYR N N 60 119.810 119.810 122.774 -2.964 17967
3782 1 10 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.523 -0.163 17967
3783 1 10 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.385 1.845 17967
3784 1 10 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.443 0.987 17967
3785 1 10 . 1 1 62 62 TYR H H 60 8.590 8.590 7.668 0.922 17967
3786 1 10 . 1 1 63 63 ALA N N 61 123.810 123.810 121.711 2.099 17967
3787 1 10 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.106 0.314 17967
3788 1 10 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.334 -0.003 17967
3789 1 10 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.745 -0.415 17967
3790 1 10 . 1 1 63 63 ALA H H 61 8.010 8.010 8.696 -0.686 17967
3791 1 10 . 1 1 64 64 VAL N N 62 120.510 120.510 118.082 2.428 17967
3792 1 10 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.223 1.277 17967
3793 1 10 . 1 1 64 64 VAL CA C 62 61.230 61.230 60.962 0.268 17967
3794 1 10 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.361 2.969 17967
3795 1 10 . 1 1 64 64 VAL H H 62 6.380 6.380 8.376 -1.996 17967
3796 1 10 . 1 1 65 65 CYS N N 63 130.310 130.310 125.652 4.658 17967
3797 1 10 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.402 0.158 17967
3798 1 10 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.258 0.172 17967
3799 1 10 . 1 1 65 65 CYS CB C 63 31.130 31.130 29.212 1.918 17967
3800 1 10 . 1 1 65 65 CYS H H 63 9.430 9.430 8.174 1.256 17967
3801 1 10 . 1 1 66 66 ASP N N 64 121.110 121.110 122.256 -1.146 17967
3802 1 10 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.212 0.198 17967
3803 1 10 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.244 -0.014 17967
3804 1 10 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.996 1.334 17967
3805 1 10 . 1 1 66 66 ASP H H 64 9.120 9.120 9.223 -0.103 17967
3806 1 10 . 1 1 67 67 LYS N N 65 122.110 122.110 118.236 3.874 17967
3807 1 10 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.900 0.110 17967
3808 1 10 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.098 2.032 17967
3809 1 10 . 1 1 67 67 LYS CB C 65 32.830 32.830 31.692 1.138 17967
3810 1 10 . 1 1 67 67 LYS H H 65 8.330 8.330 7.868 0.462 17967
3811 1 10 . 1 1 68 68 CYS N N 66 125.610 125.610 119.105 6.505 17967
3812 1 10 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.423 -0.313 17967
3813 1 10 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.280 1.250 17967
3814 1 10 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.506 4.224 17967
3815 1 10 . 1 1 68 68 CYS H H 66 8.700 8.700 7.421 1.279 17967
3816 1 10 . 1 1 69 69 LEU N N 67 125.310 125.310 120.569 4.741 17967
3817 1 10 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.004 -0.004 17967
3818 1 10 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.198 0.332 17967
3819 1 10 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.775 0.355 17967
3820 1 10 . 1 1 69 69 LEU H H 67 8.470 8.470 8.492 -0.022 17967
3821 1 10 . 1 1 70 70 LYS N N 68 119.010 119.010 115.426 3.584 17967
3822 1 10 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.163 -0.183 17967
3823 1 10 . 1 1 70 70 LYS CA C 68 58.830 58.830 57.649 1.181 17967
3824 1 10 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.999 0.131 17967
3825 1 10 . 1 1 70 70 LYS H H 68 7.810 7.810 7.301 0.509 17967
3826 1 10 . 1 1 71 71 PHE N N 69 121.710 121.710 119.624 2.086 17967
3827 1 10 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.250 0.030 17967
3828 1 10 . 1 1 71 71 PHE CA C 69 59.930 59.930 58.600 1.330 17967
3829 1 10 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.705 0.726 17967
3830 1 10 . 1 1 71 71 PHE H H 69 7.810 7.810 7.156 0.654 17967
3831 1 10 . 1 1 72 72 TYR N N 70 120.110 120.110 119.583 0.527 17967
3832 1 10 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.489 -0.169 17967
3833 1 10 . 1 1 72 72 TYR CA C 70 60.330 60.330 58.990 1.340 17967
3834 1 10 . 1 1 72 72 TYR CB C 70 40.430 40.430 36.906 3.525 17967
3835 1 10 . 1 1 72 72 TYR H H 70 8.280 8.280 8.497 -0.217 17967
3836 1 10 . 1 1 73 73 SER N N 71 117.210 117.210 119.144 -1.934 17967
3837 1 10 . 1 1 73 73 SER HA H 71 4.320 4.320 4.513 -0.193 17967
3838 1 10 . 1 1 73 73 SER CA C 71 60.130 60.130 59.047 1.083 17967
3839 1 10 . 1 1 73 73 SER CB C 71 63.630 63.630 64.641 -1.012 17967
3840 1 10 . 1 1 73 73 SER H H 71 7.870 7.870 8.174 -0.304 17967
3841 1 10 . 1 1 74 74 LYS N N 72 122.810 122.810 123.432 -0.622 17967
3842 1 10 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.101 0.169 17967
3843 1 10 . 1 1 74 74 LYS CA C 72 56.930 56.930 58.218 -1.288 17967
3844 1 10 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.601 0.029 17967
3845 1 10 . 1 1 74 74 LYS H H 72 7.800 7.800 8.577 -0.777 17967
3846 1 10 . 1 1 75 75 ILE N N 73 121.610 121.610 115.522 6.088 17967
3847 1 10 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.475 -0.365 17967
3848 1 10 . 1 1 75 75 ILE CA C 73 61.830 61.830 59.853 1.977 17967
3849 1 10 . 1 1 75 75 ILE CB C 73 38.630 38.630 37.028 1.602 17967
3850 1 10 . 1 1 75 75 ILE H H 73 7.750 7.750 7.656 0.094 17967
3851 1 10 . 1 1 76 76 SER N N 74 120.410 120.410 118.582 1.828 17967
3852 1 10 . 1 1 76 76 SER HA H 74 4.300 4.300 4.673 -0.373 17967
3853 1 10 . 1 1 76 76 SER CA C 74 59.330 59.330 58.689 0.641 17967
3854 1 10 . 1 1 76 76 SER CB C 74 63.830 63.830 64.522 -0.692 17967
3855 1 10 . 1 1 76 76 SER H H 74 8.130 8.130 8.436 -0.306 17967
3856 1 10 . 1 1 77 77 GLU N N 75 123.810 123.810 122.108 1.702 17967
3857 1 10 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.641 -0.451 17967
3858 1 10 . 1 1 77 77 GLU CA C 75 57.330 57.330 56.161 1.169 17967
3859 1 10 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.650 -0.520 17967
3860 1 10 . 1 1 77 77 GLU H H 75 8.270 8.270 8.151 0.119 17967
3861 1 10 . 1 1 78 78 TYR N N 76 122.410 122.410 119.826 2.584 17967
3862 1 10 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.241 0.219 17967
3863 1 10 . 1 1 78 78 TYR CA C 76 58.130 58.130 59.217 -1.087 17967
3864 1 10 . 1 1 78 78 TYR CB C 76 38.630 38.630 38.528 0.102 17967
3865 1 10 . 1 1 78 78 TYR H H 76 7.980 7.980 8.456 -0.476 17967
3866 1 10 . 1 1 79 79 ARG N N 77 124.710 124.710 120.074 4.636 17967
3867 1 10 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.491 -0.291 17967
3868 1 10 . 1 1 79 79 ARG CA C 77 56.030 56.030 54.741 1.289 17967
3869 1 10 . 1 1 79 79 ARG CB C 77 31.030 31.030 29.319 1.711 17967
3870 1 10 . 1 1 79 79 ARG H H 77 7.880 7.880 7.323 0.557 17967
3871 1 10 . 1 1 80 80 HIS N N 78 122.110 122.110 121.301 0.809 17967
3872 1 10 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.549 -0.039 17967
3873 1 10 . 1 1 80 80 HIS CA C 78 56.330 56.330 56.031 0.299 17967
3874 1 10 . 1 1 80 80 HIS CB C 78 30.830 30.830 27.602 3.228 17967
3875 1 10 . 1 1 80 80 HIS H H 78 8.120 8.120 8.371 -0.251 17967
3876 1 10 . 1 1 81 81 TYR N N 79 123.610 123.610 121.080 2.530 17967
3877 1 10 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.767 -0.177 17967
3878 1 10 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.441 0.389 17967
3879 1 10 . 1 1 81 81 TYR CB C 79 39.130 39.130 40.911 -1.781 17967
3880 1 10 . 1 1 81 81 TYR H H 79 7.970 7.970 7.832 0.138 17967
3881 1 11 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.219 0.071 17967
3882 1 11 . 1 1 2 2 ALA CA C 0 52.530 52.530 51.645 0.885 17967
3883 1 11 . 1 1 2 2 ALA CB C 0 19.730 19.730 19.267 0.463 17967
3884 1 11 . 1 1 3 3 MET N N 1 122.210 122.210 119.461 2.749 17967
3885 1 11 . 1 1 3 3 MET HA H 1 4.300 4.300 4.616 -0.316 17967
3886 1 11 . 1 1 3 3 MET CA C 1 56.030 56.030 54.125 1.905 17967
3887 1 11 . 1 1 3 3 MET CB C 1 33.430 33.430 32.680 0.750 17967
3888 1 11 . 1 1 3 3 MET H H 1 8.370 8.370 7.642 0.728 17967
3889 1 11 . 1 1 4 4 PHE N N 2 122.310 122.310 125.495 -3.185 17967
3890 1 11 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.796 -0.166 17967
3891 1 11 . 1 1 4 4 PHE CA C 2 57.330 57.330 55.866 1.464 17967
3892 1 11 . 1 1 4 4 PHE CB C 2 39.430 39.430 40.694 -1.264 17967
3893 1 11 . 1 1 4 4 PHE H H 2 8.370 8.370 8.033 0.337 17967
3894 1 11 . 1 1 5 5 GLN N N 3 123.510 123.510 118.928 4.582 17967
3895 1 11 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.369 -0.189 17967
3896 1 11 . 1 1 5 5 GLN CA C 3 56.130 56.130 54.792 1.338 17967
3897 1 11 . 1 1 5 5 GLN CB C 3 29.930 29.930 29.213 0.717 17967
3898 1 11 . 1 1 5 5 GLN H H 3 8.260 8.260 8.427 -0.167 17967
3899 1 11 . 1 1 6 6 ASP N N 4 125.010 125.010 120.496 4.514 17967
3900 1 11 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.731 0.059 17967
3901 1 11 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.890 0.040 17967
3902 1 11 . 1 1 6 6 ASP CB C 4 41.730 41.730 40.878 0.852 17967
3903 1 11 . 1 1 6 6 ASP H H 4 8.420 8.420 8.405 0.015 17967
3904 1 11 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.539 -0.419 17967
3905 1 11 . 1 1 7 7 PRO CA C 5 64.030 64.030 63.810 0.220 17967
3906 1 11 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.785 -0.455 17967
3907 1 11 . 1 1 8 8 GLN N N 6 119.710 119.710 117.070 2.640 17967
3908 1 11 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.184 -0.024 17967
3909 1 11 . 1 1 8 8 GLN CA C 6 56.630 56.630 54.994 1.636 17967
3910 1 11 . 1 1 8 8 GLN CB C 6 29.330 29.330 29.131 0.199 17967
3911 1 11 . 1 1 8 8 GLN H H 6 8.430 8.430 7.874 0.556 17967
3912 1 11 . 1 1 9 9 GLU N N 7 122.110 122.110 121.303 0.807 17967
3913 1 11 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.169 0.031 17967
3914 1 11 . 1 1 9 9 GLU CA C 7 56.030 56.030 56.887 -0.857 17967
3915 1 11 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.904 0.626 17967
3916 1 11 . 1 1 9 9 GLU H H 7 7.940 7.940 8.462 -0.522 17967
3917 1 11 . 1 1 10 10 ARG N N 8 123.410 123.410 118.830 4.580 17967
3918 1 11 . 1 1 10 10 ARG HA H 8 4.400 4.400 5.089 -0.689 17967
3919 1 11 . 1 1 10 10 ARG CA C 8 54.130 54.130 53.003 1.127 17967
3920 1 11 . 1 1 10 10 ARG CB C 8 29.330 29.330 29.522 -0.192 17967
3921 1 11 . 1 1 10 10 ARG H H 8 7.660 7.660 7.856 -0.196 17967
3922 1 11 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.628 -0.278 17967
3923 1 11 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.331 1.199 17967
3924 1 11 . 1 1 11 11 PRO CB C 9 32.630 32.630 32.825 -0.195 17967
3925 1 11 . 1 1 12 12 ARG N N 10 123.810 123.810 118.535 5.275 17967
3926 1 11 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.569 0.101 17967
3927 1 11 . 1 1 12 12 ARG CA C 10 56.830 56.830 56.176 0.654 17967
3928 1 11 . 1 1 12 12 ARG CB C 10 32.530 32.530 30.495 2.035 17967
3929 1 11 . 1 1 12 12 ARG H H 10 8.710 8.710 8.670 0.040 17967
3930 1 11 . 1 1 13 13 LYS N N 11 118.410 118.410 119.447 -1.037 17967
3931 1 11 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.675 0.375 17967
3932 1 11 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.628 -1.298 17967
3933 1 11 . 1 1 13 13 LYS CB C 11 35.430 35.430 32.688 2.742 17967
3934 1 11 . 1 1 13 13 LYS H H 11 7.800 7.800 7.669 0.131 17967
3935 1 11 . 1 1 14 14 LEU N N 12 125.010 125.010 128.085 -3.075 17967
3936 1 11 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.253 -0.083 17967
3937 1 11 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.519 0.211 17967
3938 1 11 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.906 0.624 17967
3939 1 11 . 1 1 14 14 LEU H H 12 10.210 10.210 9.225 0.985 17967
3940 1 11 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.255 -0.035 17967
3941 1 11 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.512 1.718 17967
3942 1 11 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.167 -0.437 17967
3943 1 11 . 1 1 16 16 GLN N N 14 117.810 117.810 117.793 0.017 17967
3944 1 11 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.149 0.041 17967
3945 1 11 . 1 1 16 16 GLN CA C 14 59.030 59.030 59.029 0.001 17967
3946 1 11 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.383 0.247 17967
3947 1 11 . 1 1 16 16 GLN H H 14 7.110 7.110 8.231 -1.121 17967
3948 1 11 . 1 1 17 17 LEU N N 15 124.710 124.710 122.165 2.545 17967
3949 1 11 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.146 -0.136 17967
3950 1 11 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.904 0.426 17967
3951 1 11 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.689 0.341 17967
3952 1 11 . 1 1 17 17 LEU H H 15 8.010 8.010 8.284 -0.274 17967
3953 1 11 . 1 1 18 18 CYS N N 16 117.210 117.210 116.957 0.253 17967
3954 1 11 . 1 1 18 18 CYS HA H 16 3.750 3.750 3.992 -0.242 17967
3955 1 11 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.895 0.836 17967
3956 1 11 . 1 1 18 18 CYS CB C 16 26.230 26.230 25.971 0.259 17967
3957 1 11 . 1 1 18 18 CYS H H 16 8.380 8.380 8.480 -0.100 17967
3958 1 11 . 1 1 19 19 THR N N 17 117.810 117.810 115.810 2.000 17967
3959 1 11 . 1 1 19 19 THR HA H 17 4.000 4.000 4.060 -0.060 17967
3960 1 11 . 1 1 19 19 THR CA C 17 66.830 66.830 67.074 -0.244 17967
3961 1 11 . 1 1 19 19 THR CB C 17 68.830 68.830 68.686 0.144 17967
3962 1 11 . 1 1 19 19 THR H H 17 7.720 7.720 7.593 0.127 17967
3963 1 11 . 1 1 20 20 GLU N N 18 125.410 125.410 120.904 4.506 17967
3964 1 11 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.135 -0.065 17967
3965 1 11 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.873 0.857 17967
3966 1 11 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.317 0.413 17967
3967 1 11 . 1 1 20 20 GLU H H 18 8.010 8.010 7.447 0.563 17967
3968 1 11 . 1 1 21 21 LEU N N 19 118.810 118.810 116.641 2.169 17967
3969 1 11 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.438 -0.138 17967
3970 1 11 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.339 -0.509 17967
3971 1 11 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.883 0.448 17967
3972 1 11 . 1 1 21 21 LEU H H 19 8.010 8.010 7.973 0.037 17967
3973 1 11 . 1 1 22 22 GLN N N 20 118.310 118.310 115.417 2.893 17967
3974 1 11 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.057 -0.107 17967
3975 1 11 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.110 -0.380 17967
3976 1 11 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.434 -0.304 17967
3977 1 11 . 1 1 22 22 GLN H H 20 7.860 7.860 7.767 0.093 17967
3978 1 11 . 1 1 23 23 THR N N 21 115.910 115.910 111.792 4.118 17967
3979 1 11 . 1 1 23 23 THR HA H 21 4.950 4.950 4.596 0.354 17967
3980 1 11 . 1 1 23 23 THR CA C 21 58.530 58.530 60.000 -1.470 17967
3981 1 11 . 1 1 23 23 THR CB C 21 70.330 70.330 70.885 -0.555 17967
3982 1 11 . 1 1 23 23 THR H H 21 8.250 8.250 8.398 -0.148 17967
3983 1 11 . 1 1 24 24 THR N N 22 112.810 112.810 114.742 -1.932 17967
3984 1 11 . 1 1 24 24 THR HA H 22 4.880 4.880 4.616 0.264 17967
3985 1 11 . 1 1 24 24 THR CA C 22 59.730 59.730 60.228 -0.498 17967
3986 1 11 . 1 1 24 24 THR CB C 22 74.130 74.130 71.314 2.816 17967
3987 1 11 . 1 1 24 24 THR H H 22 8.660 8.660 7.920 0.740 17967
3988 1 11 . 1 1 25 25 ILE N N 23 123.710 123.710 120.862 2.848 17967
3989 1 11 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.653 0.127 17967
3990 1 11 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.522 -1.092 17967
3991 1 11 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.702 0.928 17967
3992 1 11 . 1 1 25 25 ILE H H 23 9.060 9.060 8.316 0.744 17967
3993 1 11 . 1 1 26 26 HIS N N 24 119.510 119.510 112.985 6.525 17967
3994 1 11 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.667 -0.227 17967
3995 1 11 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.268 1.762 17967
3996 1 11 . 1 1 26 26 HIS CB C 24 30.830 30.830 28.794 2.036 17967
3997 1 11 . 1 1 26 26 HIS H H 24 7.040 7.040 7.498 -0.458 17967
3998 1 11 . 1 1 27 27 ASP N N 25 116.810 116.810 118.842 -2.032 17967
3999 1 11 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.635 0.125 17967
4000 1 11 . 1 1 27 27 ASP CA C 25 54.430 54.430 53.983 0.447 17967
4001 1 11 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.372 0.958 17967
4002 1 11 . 1 1 27 27 ASP H H 25 7.250 7.250 7.644 -0.394 17967
4003 1 11 . 1 1 28 28 ILE N N 26 123.210 123.210 121.433 1.777 17967
4004 1 11 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.876 0.054 17967
4005 1 11 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.357 0.673 17967
4006 1 11 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.886 -0.956 17967
4007 1 11 . 1 1 28 28 ILE H H 26 7.750 7.750 7.785 -0.035 17967
4008 1 11 . 1 1 29 29 ILE N N 27 131.110 131.110 129.293 1.817 17967
4009 1 11 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.060 0.320 17967
4010 1 11 . 1 1 29 29 ILE CA C 27 58.830 58.830 60.100 -1.270 17967
4011 1 11 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.492 1.138 17967
4012 1 11 . 1 1 29 29 ILE H H 27 8.270 8.270 8.335 -0.065 17967
4013 1 11 . 1 1 30 30 LEU N N 28 129.410 129.410 128.451 0.959 17967
4014 1 11 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.580 0.080 17967
4015 1 11 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.056 -0.526 17967
4016 1 11 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.456 2.874 17967
4017 1 11 . 1 1 30 30 LEU H H 28 8.500 8.500 8.185 0.315 17967
4018 1 11 . 1 1 31 31 GLU N N 29 121.910 121.910 121.084 0.826 17967
4019 1 11 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.726 -0.046 17967
4020 1 11 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.336 0.594 17967
4021 1 11 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.349 0.680 17967
4022 1 11 . 1 1 31 31 GLU H H 29 8.860 8.860 8.252 0.608 17967
4023 1 11 . 1 1 32 32 CYS N N 30 125.710 125.710 120.341 5.369 17967
4024 1 11 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.925 -0.905 17967
4025 1 11 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.301 -1.071 17967
4026 1 11 . 1 1 32 32 CYS CB C 30 31.730 31.730 27.093 4.637 17967
4027 1 11 . 1 1 32 32 CYS H H 30 8.270 8.270 8.541 -0.271 17967
4028 1 11 . 1 1 33 33 VAL N N 31 132.310 132.310 128.149 4.161 17967
4029 1 11 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.094 0.006 17967
4030 1 11 . 1 1 33 33 VAL CA C 31 64.230 64.230 64.987 -0.757 17967
4031 1 11 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.859 -0.229 17967
4032 1 11 . 1 1 33 33 VAL H H 31 8.860 8.860 8.027 0.833 17967
4033 1 11 . 1 1 34 34 TYR N N 32 124.310 124.310 114.542 9.768 17967
4034 1 11 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.530 -0.090 17967
4035 1 11 . 1 1 34 34 TYR CA C 32 61.030 61.030 58.766 2.264 17967
4036 1 11 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.867 1.263 17967
4037 1 11 . 1 1 34 34 TYR H H 32 8.590 8.590 7.140 1.450 17967
4038 1 11 . 1 1 35 35 CYS N N 33 119.810 119.810 115.792 4.018 17967
4039 1 11 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.579 0.261 17967
4040 1 11 . 1 1 35 35 CYS CA C 33 59.430 59.430 59.024 0.406 17967
4041 1 11 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.476 3.754 17967
4042 1 11 . 1 1 35 35 CYS H H 33 8.070 8.070 7.723 0.347 17967
4043 1 11 . 1 1 36 36 LYS N N 34 119.910 119.910 116.590 3.320 17967
4044 1 11 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.914 0.276 17967
4045 1 11 . 1 1 36 36 LYS CA C 34 57.830 57.830 56.747 1.083 17967
4046 1 11 . 1 1 36 36 LYS CB C 34 29.330 29.330 30.106 -0.776 17967
4047 1 11 . 1 1 36 36 LYS H H 34 7.860 7.860 7.902 -0.042 17967
4048 1 11 . 1 1 37 37 GLN N N 35 120.710 120.710 117.315 3.395 17967
4049 1 11 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.439 -0.079 17967
4050 1 11 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.284 1.146 17967
4051 1 11 . 1 1 37 37 GLN CB C 35 29.630 29.630 30.486 -0.856 17967
4052 1 11 . 1 1 37 37 GLN H H 35 8.270 8.270 7.988 0.282 17967
4053 1 11 . 1 1 38 38 GLN N N 36 123.710 123.710 123.455 0.255 17967
4054 1 11 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.256 0.044 17967
4055 1 11 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.566 0.164 17967
4056 1 11 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.946 0.384 17967
4057 1 11 . 1 1 38 38 GLN H H 36 8.640 8.640 8.594 0.046 17967
4058 1 11 . 1 1 39 39 LEU N N 37 131.310 131.310 125.909 5.401 17967
4059 1 11 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.167 -0.057 17967
4060 1 11 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.391 1.939 17967
4061 1 11 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.484 -0.554 17967
4062 1 11 . 1 1 39 39 LEU H H 37 8.870 8.870 7.928 0.942 17967
4063 1 11 . 1 1 40 40 LEU N N 38 126.310 126.310 124.482 1.828 17967
4064 1 11 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.247 0.063 17967
4065 1 11 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.834 -0.604 17967
4066 1 11 . 1 1 40 40 LEU CB C 38 43.130 43.130 42.672 0.458 17967
4067 1 11 . 1 1 40 40 LEU H H 38 9.850 9.850 8.403 1.447 17967
4068 1 11 . 1 1 41 41 ARG N N 39 127.110 127.110 125.697 1.413 17967
4069 1 11 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.691 -0.171 17967
4070 1 11 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.887 -2.057 17967
4071 1 11 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.983 -3.053 17967
4072 1 11 . 1 1 41 41 ARG H H 39 8.970 8.970 8.861 0.109 17967
4073 1 11 . 1 1 42 42 ARG N N 40 115.810 115.810 118.485 -2.675 17967
4074 1 11 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.300 -0.220 17967
4075 1 11 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.693 -0.563 17967
4076 1 11 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.605 -0.275 17967
4077 1 11 . 1 1 42 42 ARG H H 40 8.610 8.610 8.716 -0.106 17967
4078 1 11 . 1 1 43 43 GLU N N 41 119.910 119.910 119.052 0.858 17967
4079 1 11 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.443 -0.193 17967
4080 1 11 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.591 0.439 17967
4081 1 11 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.056 1.274 17967
4082 1 11 . 1 1 43 43 GLU H H 41 6.950 6.950 7.919 -0.969 17967
4083 1 11 . 1 1 44 44 VAL N N 42 125.010 125.010 119.846 5.164 17967
4084 1 11 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.653 -0.413 17967
4085 1 11 . 1 1 44 44 VAL CA C 42 67.630 67.630 65.357 2.273 17967
4086 1 11 . 1 1 44 44 VAL CB C 42 31.330 31.330 30.689 0.641 17967
4087 1 11 . 1 1 44 44 VAL H H 42 7.820 7.820 8.280 -0.460 17967
4088 1 11 . 1 1 45 45 TYR N N 43 118.410 118.410 119.576 -1.166 17967
4089 1 11 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.163 0.267 17967
4090 1 11 . 1 1 45 45 TYR CA C 43 58.830 58.830 61.387 -2.557 17967
4091 1 11 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.229 -0.499 17967
4092 1 11 . 1 1 45 45 TYR H H 43 7.820 7.820 8.111 -0.291 17967
4093 1 11 . 1 1 46 46 ASP N N 44 122.410 122.410 120.311 2.099 17967
4094 1 11 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.311 0.289 17967
4095 1 11 . 1 1 46 46 ASP CA C 44 57.830 57.830 58.141 -0.311 17967
4096 1 11 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.507 0.523 17967
4097 1 11 . 1 1 46 46 ASP H H 44 8.540 8.540 7.961 0.579 17967
4098 1 11 . 1 1 47 47 PHE N N 45 126.210 126.210 119.387 6.823 17967
4099 1 11 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.114 -0.204 17967
4100 1 11 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.889 0.741 17967
4101 1 11 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.143 0.187 17967
4102 1 11 . 1 1 47 47 PHE H H 45 8.320 8.320 8.040 0.280 17967
4103 1 11 . 1 1 48 48 ALA N N 46 119.110 119.110 119.959 -0.849 17967
4104 1 11 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.369 0.151 17967
4105 1 11 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.829 0.401 17967
4106 1 11 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.823 -0.094 17967
4107 1 11 . 1 1 48 48 ALA H H 46 7.740 7.740 7.652 0.088 17967
4108 1 11 . 1 1 49 49 ARG N N 47 124.010 124.010 117.657 6.353 17967
4109 1 11 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.285 -0.235 17967
4110 1 11 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.200 2.430 17967
4111 1 11 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.358 0.072 17967
4112 1 11 . 1 1 49 49 ARG H H 47 8.500 8.500 8.310 0.190 17967
4113 1 11 . 1 1 50 50 ARG N N 48 119.110 119.110 118.771 0.339 17967
4114 1 11 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.518 -0.508 17967
4115 1 11 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.637 2.493 17967
4116 1 11 . 1 1 50 50 ARG CB C 48 31.130 31.130 31.762 -0.632 17967
4117 1 11 . 1 1 50 50 ARG H H 48 7.940 7.940 7.787 0.153 17967
4118 1 11 . 1 1 51 51 ASP N N 49 120.910 120.910 119.902 1.008 17967
4119 1 11 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.752 -0.332 17967
4120 1 11 . 1 1 51 51 ASP CA C 49 54.530 54.530 54.006 0.524 17967
4121 1 11 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.218 -0.288 17967
4122 1 11 . 1 1 51 51 ASP H H 49 7.950 7.950 8.481 -0.531 17967
4123 1 11 . 1 1 52 52 LEU N N 50 118.410 118.410 122.948 -4.538 17967
4124 1 11 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.519 -0.369 17967
4125 1 11 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.557 0.673 17967
4126 1 11 . 1 1 52 52 LEU CB C 50 41.130 41.130 43.598 -2.468 17967
4127 1 11 . 1 1 52 52 LEU H H 50 6.640 6.640 7.541 -0.901 17967
4128 1 11 . 1 1 53 53 CYS N N 51 117.410 117.410 118.418 -1.008 17967
4129 1 11 . 1 1 53 53 CYS HA H 51 4.930 4.930 4.989 -0.059 17967
4130 1 11 . 1 1 53 53 CYS CA C 51 58.930 58.930 55.631 3.299 17967
4131 1 11 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.039 -1.409 17967
4132 1 11 . 1 1 53 53 CYS H H 51 8.030 8.030 8.176 -0.146 17967
4133 1 11 . 1 1 54 54 ILE N N 52 125.110 125.110 122.911 2.199 17967
4134 1 11 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.419 -0.409 17967
4135 1 11 . 1 1 54 54 ILE CA C 52 59.630 59.630 62.066 -2.436 17967
4136 1 11 . 1 1 54 54 ILE CB C 52 37.330 37.330 39.105 -1.775 17967
4137 1 11 . 1 1 54 54 ILE H H 52 8.500 8.500 9.058 -0.558 17967
4138 1 11 . 1 1 55 55 VAL N N 53 127.010 127.010 123.081 3.929 17967
4139 1 11 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.648 -0.278 17967
4140 1 11 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.250 0.380 17967
4141 1 11 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.005 2.225 17967
4142 1 11 . 1 1 55 55 VAL H H 53 8.130 8.130 8.131 -0.001 17967
4143 1 11 . 1 1 56 56 TYR N N 54 124.910 124.910 126.481 -1.571 17967
4144 1 11 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.198 0.202 17967
4145 1 11 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.695 -0.365 17967
4146 1 11 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.794 1.236 17967
4147 1 11 . 1 1 56 56 TYR H H 54 8.700 8.700 8.658 0.042 17967
4148 1 11 . 1 1 57 57 ARG N N 55 123.810 123.810 125.499 -1.689 17967
4149 1 11 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.448 0.192 17967
4150 1 11 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.497 -0.067 17967
4151 1 11 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.240 2.590 17967
4152 1 11 . 1 1 57 57 ARG H H 55 8.870 8.870 8.454 0.416 17967
4153 1 11 . 1 1 58 58 ASP N N 56 129.110 129.110 125.409 3.701 17967
4154 1 11 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.301 0.009 17967
4155 1 11 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.745 -0.915 17967
4156 1 11 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.052 0.078 17967
4157 1 11 . 1 1 58 58 ASP H H 56 9.620 9.620 8.927 0.693 17967
4158 1 11 . 1 1 59 59 GLY N N 57 104.510 104.510 107.236 -2.726 17967
4159 1 11 . 1 1 59 59 GLY CA C 57 45.630 45.630 44.959 0.671 17967
4160 1 11 . 1 1 59 59 GLY H H 57 8.720 8.720 8.135 0.585 17967
4161 1 11 . 1 1 60 60 ASN N N 58 122.210 122.210 119.413 2.797 17967
4162 1 11 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.158 0.242 17967
4163 1 11 . 1 1 60 60 ASN CA C 58 50.330 50.330 51.023 -0.693 17967
4164 1 11 . 1 1 60 60 ASN CB C 58 40.430 40.430 40.885 -0.455 17967
4165 1 11 . 1 1 60 60 ASN H H 58 8.120 8.120 7.934 0.186 17967
4166 1 11 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.432 0.358 17967
4167 1 11 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.270 -0.240 17967
4168 1 11 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.095 2.435 17967
4169 1 11 . 1 1 62 62 TYR N N 60 119.810 119.810 122.191 -2.381 17967
4170 1 11 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.445 -0.085 17967
4171 1 11 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.459 1.771 17967
4172 1 11 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.516 0.914 17967
4173 1 11 . 1 1 62 62 TYR H H 60 8.590 8.590 7.634 0.956 17967
4174 1 11 . 1 1 63 63 ALA N N 61 123.810 123.810 120.745 3.065 17967
4175 1 11 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.264 0.156 17967
4176 1 11 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.003 0.327 17967
4177 1 11 . 1 1 63 63 ALA CB C 61 20.330 20.330 21.368 -1.038 17967
4178 1 11 . 1 1 63 63 ALA H H 61 8.010 8.010 8.935 -0.925 17967
4179 1 11 . 1 1 64 64 VAL N N 62 120.510 120.510 118.325 2.185 17967
4180 1 11 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.299 1.201 17967
4181 1 11 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.578 -0.348 17967
4182 1 11 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.001 3.329 17967
4183 1 11 . 1 1 64 64 VAL H H 62 6.380 6.380 8.341 -1.961 17967
4184 1 11 . 1 1 65 65 CYS N N 63 130.310 130.310 125.981 4.329 17967
4185 1 11 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.423 0.137 17967
4186 1 11 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.501 -0.070 17967
4187 1 11 . 1 1 65 65 CYS CB C 63 31.130 31.130 29.049 2.081 17967
4188 1 11 . 1 1 65 65 CYS H H 63 9.430 9.430 8.321 1.109 17967
4189 1 11 . 1 1 66 66 ASP N N 64 121.110 121.110 121.259 -0.149 17967
4190 1 11 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.306 0.104 17967
4191 1 11 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.453 -0.223 17967
4192 1 11 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.876 1.454 17967
4193 1 11 . 1 1 66 66 ASP H H 64 9.120 9.120 8.766 0.354 17967
4194 1 11 . 1 1 67 67 LYS N N 65 122.110 122.110 119.135 2.975 17967
4195 1 11 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.840 0.170 17967
4196 1 11 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.779 1.351 17967
4197 1 11 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.286 0.544 17967
4198 1 11 . 1 1 67 67 LYS H H 65 8.330 8.330 7.641 0.689 17967
4199 1 11 . 1 1 68 68 CYS N N 66 125.610 125.610 118.828 6.782 17967
4200 1 11 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.299 -0.189 17967
4201 1 11 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.426 1.104 17967
4202 1 11 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.484 4.246 17967
4203 1 11 . 1 1 68 68 CYS H H 66 8.700 8.700 7.577 1.123 17967
4204 1 11 . 1 1 69 69 LEU N N 67 125.310 125.310 121.538 3.772 17967
4205 1 11 . 1 1 69 69 LEU HA H 67 4.000 4.000 3.836 0.164 17967
4206 1 11 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.582 -0.052 17967
4207 1 11 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.258 0.872 17967
4208 1 11 . 1 1 69 69 LEU H H 67 8.470 8.470 8.851 -0.381 17967
4209 1 11 . 1 1 70 70 LYS N N 68 119.010 119.010 119.635 -0.625 17967
4210 1 11 . 1 1 70 70 LYS HA H 68 3.980 3.980 3.882 0.098 17967
4211 1 11 . 1 1 70 70 LYS CA C 68 58.830 58.830 59.482 -0.652 17967
4212 1 11 . 1 1 70 70 LYS CB C 68 32.130 32.130 32.050 0.081 17967
4213 1 11 . 1 1 70 70 LYS H H 68 7.810 7.810 7.384 0.426 17967
4214 1 11 . 1 1 71 71 PHE N N 69 121.710 121.710 117.511 4.199 17967
4215 1 11 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.125 0.155 17967
4216 1 11 . 1 1 71 71 PHE CA C 69 59.930 59.930 59.231 0.699 17967
4217 1 11 . 1 1 71 71 PHE CB C 69 39.430 39.430 37.774 1.656 17967
4218 1 11 . 1 1 71 71 PHE H H 69 7.810 7.810 7.019 0.791 17967
4219 1 11 . 1 1 72 72 TYR N N 70 120.110 120.110 117.106 3.004 17967
4220 1 11 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.460 -0.140 17967
4221 1 11 . 1 1 72 72 TYR CA C 70 60.330 60.330 60.906 -0.575 17967
4222 1 11 . 1 1 72 72 TYR CB C 70 40.430 40.430 38.062 2.368 17967
4223 1 11 . 1 1 72 72 TYR H H 70 8.280 8.280 8.957 -0.677 17967
4224 1 11 . 1 1 73 73 SER N N 71 117.210 117.210 115.171 2.039 17967
4225 1 11 . 1 1 73 73 SER HA H 71 4.320 4.320 4.339 -0.019 17967
4226 1 11 . 1 1 73 73 SER CA C 71 60.130 60.130 60.901 -0.771 17967
4227 1 11 . 1 1 73 73 SER CB C 71 63.630 63.630 62.892 0.738 17967
4228 1 11 . 1 1 73 73 SER H H 71 7.870 7.870 8.022 -0.152 17967
4229 1 11 . 1 1 74 74 LYS N N 72 122.810 122.810 121.887 0.923 17967
4230 1 11 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.061 0.209 17967
4231 1 11 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.721 -0.791 17967
4232 1 11 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.328 0.302 17967
4233 1 11 . 1 1 74 74 LYS H H 72 7.800 7.800 7.418 0.382 17967
4234 1 11 . 1 1 75 75 ILE N N 73 121.610 121.610 120.090 1.520 17967
4235 1 11 . 1 1 75 75 ILE HA H 73 4.110 4.110 3.897 0.213 17967
4236 1 11 . 1 1 75 75 ILE CA C 73 61.830 61.830 65.189 -3.359 17967
4237 1 11 . 1 1 75 75 ILE CB C 73 38.630 38.630 37.899 0.731 17967
4238 1 11 . 1 1 75 75 ILE H H 73 7.750 7.750 8.279 -0.529 17967
4239 1 11 . 1 1 76 76 SER N N 74 120.410 120.410 114.766 5.644 17967
4240 1 11 . 1 1 76 76 SER HA H 74 4.300 4.300 4.393 -0.093 17967
4241 1 11 . 1 1 76 76 SER CA C 74 59.330 59.330 60.860 -1.530 17967
4242 1 11 . 1 1 76 76 SER CB C 74 63.830 63.830 63.319 0.511 17967
4243 1 11 . 1 1 76 76 SER H H 74 8.130 8.130 8.232 -0.102 17967
4244 1 11 . 1 1 77 77 GLU N N 75 123.810 123.810 119.302 4.508 17967
4245 1 11 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.535 -0.345 17967
4246 1 11 . 1 1 77 77 GLU CA C 75 57.330 57.330 55.346 1.984 17967
4247 1 11 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.544 -0.414 17967
4248 1 11 . 1 1 77 77 GLU H H 75 8.270 8.270 7.484 0.786 17967
4249 1 11 . 1 1 78 78 TYR N N 76 122.410 122.410 121.640 0.770 17967
4250 1 11 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.516 -0.056 17967
4251 1 11 . 1 1 78 78 TYR CA C 76 58.130 58.130 59.028 -0.898 17967
4252 1 11 . 1 1 78 78 TYR CB C 76 38.630 38.630 38.303 0.327 17967
4253 1 11 . 1 1 78 78 TYR H H 76 7.980 7.980 7.632 0.348 17967
4254 1 11 . 1 1 79 79 ARG N N 77 124.710 124.710 127.479 -2.769 17967
4255 1 11 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.766 -0.566 17967
4256 1 11 . 1 1 79 79 ARG CA C 77 56.030 56.030 54.651 1.379 17967
4257 1 11 . 1 1 79 79 ARG CB C 77 31.030 31.030 29.948 1.082 17967
4258 1 11 . 1 1 79 79 ARG H H 77 7.880 7.880 8.803 -0.923 17967
4259 1 11 . 1 1 80 80 HIS N N 78 122.110 122.110 118.467 3.643 17967
4260 1 11 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.914 -0.404 17967
4261 1 11 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.578 0.752 17967
4262 1 11 . 1 1 80 80 HIS CB C 78 30.830 30.830 28.394 2.436 17967
4263 1 11 . 1 1 80 80 HIS H H 78 8.120 8.120 8.148 -0.028 17967
4264 1 11 . 1 1 81 81 TYR N N 79 123.610 123.610 124.280 -0.670 17967
4265 1 11 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.763 -0.173 17967
4266 1 11 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.355 0.475 17967
4267 1 11 . 1 1 81 81 TYR CB C 79 39.130 39.130 40.247 -1.117 17967
4268 1 11 . 1 1 81 81 TYR H H 79 7.970 7.970 8.692 -0.722 17967
4269 1 12 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.359 -0.069 17967
4270 1 12 . 1 1 2 2 ALA CA C 0 52.530 52.530 53.524 -0.994 17967
4271 1 12 . 1 1 2 2 ALA CB C 0 19.730 19.730 19.188 0.542 17967
4272 1 12 . 1 1 3 3 MET N N 1 122.210 122.210 115.739 6.471 17967
4273 1 12 . 1 1 3 3 MET HA H 1 4.300 4.300 4.723 -0.423 17967
4274 1 12 . 1 1 3 3 MET CA C 1 56.030 56.030 54.883 1.147 17967
4275 1 12 . 1 1 3 3 MET CB C 1 33.430 33.430 33.955 -0.524 17967
4276 1 12 . 1 1 3 3 MET H H 1 8.370 8.370 7.616 0.754 17967
4277 1 12 . 1 1 4 4 PHE N N 2 122.310 122.310 122.089 0.221 17967
4278 1 12 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.741 -0.111 17967
4279 1 12 . 1 1 4 4 PHE CA C 2 57.330 57.330 57.397 -0.067 17967
4280 1 12 . 1 1 4 4 PHE CB C 2 39.430 39.430 41.218 -1.788 17967
4281 1 12 . 1 1 4 4 PHE H H 2 8.370 8.370 8.604 -0.234 17967
4282 1 12 . 1 1 5 5 GLN N N 3 123.510 123.510 121.639 1.871 17967
4283 1 12 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.361 -0.181 17967
4284 1 12 . 1 1 5 5 GLN CA C 3 56.130 56.130 54.682 1.448 17967
4285 1 12 . 1 1 5 5 GLN CB C 3 29.930 29.930 29.295 0.635 17967
4286 1 12 . 1 1 5 5 GLN H H 3 8.260 8.260 8.097 0.163 17967
4287 1 12 . 1 1 6 6 ASP N N 4 125.010 125.010 118.727 6.283 17967
4288 1 12 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.830 -0.040 17967
4289 1 12 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.170 0.759 17967
4290 1 12 . 1 1 6 6 ASP CB C 4 41.730 41.730 41.973 -0.243 17967
4291 1 12 . 1 1 6 6 ASP H H 4 8.420 8.420 8.489 -0.069 17967
4292 1 12 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.461 -0.341 17967
4293 1 12 . 1 1 7 7 PRO CA C 5 64.030 64.030 64.686 -0.656 17967
4294 1 12 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.468 -0.138 17967
4295 1 12 . 1 1 8 8 GLN N N 6 119.710 119.710 114.682 5.028 17967
4296 1 12 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.353 -0.193 17967
4297 1 12 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.060 1.570 17967
4298 1 12 . 1 1 8 8 GLN CB C 6 29.330 29.330 28.642 0.688 17967
4299 1 12 . 1 1 8 8 GLN H H 6 8.430 8.430 8.244 0.186 17967
4300 1 12 . 1 1 9 9 GLU N N 7 122.110 122.110 122.082 0.028 17967
4301 1 12 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.248 -0.048 17967
4302 1 12 . 1 1 9 9 GLU CA C 7 56.030 56.030 55.965 0.064 17967
4303 1 12 . 1 1 9 9 GLU CB C 7 30.530 30.530 28.529 2.001 17967
4304 1 12 . 1 1 9 9 GLU H H 7 7.940 7.940 8.467 -0.527 17967
4305 1 12 . 1 1 10 10 ARG N N 8 123.410 123.410 121.754 1.656 17967
4306 1 12 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.894 -0.494 17967
4307 1 12 . 1 1 10 10 ARG CA C 8 54.130 54.130 53.416 0.714 17967
4308 1 12 . 1 1 10 10 ARG CB C 8 29.330 29.330 30.447 -1.117 17967
4309 1 12 . 1 1 10 10 ARG H H 8 7.660 7.660 8.187 -0.527 17967
4310 1 12 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.758 -0.408 17967
4311 1 12 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.550 0.980 17967
4312 1 12 . 1 1 11 11 PRO CB C 9 32.630 32.630 33.875 -1.245 17967
4313 1 12 . 1 1 12 12 ARG N N 10 123.810 123.810 117.518 6.292 17967
4314 1 12 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.685 -0.015 17967
4315 1 12 . 1 1 12 12 ARG CA C 10 56.830 56.830 56.960 -0.130 17967
4316 1 12 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.405 1.125 17967
4317 1 12 . 1 1 12 12 ARG H H 10 8.710 8.710 8.778 -0.068 17967
4318 1 12 . 1 1 13 13 LYS N N 11 118.410 118.410 119.105 -0.695 17967
4319 1 12 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.725 0.325 17967
4320 1 12 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.298 -0.968 17967
4321 1 12 . 1 1 13 13 LYS CB C 11 35.430 35.430 33.732 1.698 17967
4322 1 12 . 1 1 13 13 LYS H H 11 7.800 7.800 7.774 0.026 17967
4323 1 12 . 1 1 14 14 LEU N N 12 125.010 125.010 125.809 -0.799 17967
4324 1 12 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.224 -0.054 17967
4325 1 12 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.224 0.506 17967
4326 1 12 . 1 1 14 14 LEU CB C 12 40.530 40.530 40.152 0.378 17967
4327 1 12 . 1 1 14 14 LEU H H 12 10.210 10.210 9.091 1.119 17967
4328 1 12 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.252 -0.032 17967
4329 1 12 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.455 1.775 17967
4330 1 12 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.156 -0.426 17967
4331 1 12 . 1 1 16 16 GLN N N 14 117.810 117.810 117.931 -0.121 17967
4332 1 12 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.152 0.038 17967
4333 1 12 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.875 0.155 17967
4334 1 12 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.343 0.287 17967
4335 1 12 . 1 1 16 16 GLN H H 14 7.110 7.110 8.377 -1.267 17967
4336 1 12 . 1 1 17 17 LEU N N 15 124.710 124.710 121.934 2.776 17967
4337 1 12 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.169 -0.159 17967
4338 1 12 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.703 0.627 17967
4339 1 12 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.699 0.331 17967
4340 1 12 . 1 1 17 17 LEU H H 15 8.010 8.010 7.981 0.029 17967
4341 1 12 . 1 1 18 18 CYS N N 16 117.210 117.210 117.581 -0.371 17967
4342 1 12 . 1 1 18 18 CYS HA H 16 3.750 3.750 4.022 -0.272 17967
4343 1 12 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.773 0.957 17967
4344 1 12 . 1 1 18 18 CYS CB C 16 26.230 26.230 25.907 0.323 17967
4345 1 12 . 1 1 18 18 CYS H H 16 8.380 8.380 8.541 -0.161 17967
4346 1 12 . 1 1 19 19 THR N N 17 117.810 117.810 115.956 1.854 17967
4347 1 12 . 1 1 19 19 THR HA H 17 4.000 4.000 3.966 0.034 17967
4348 1 12 . 1 1 19 19 THR CA C 17 66.830 66.830 67.140 -0.310 17967
4349 1 12 . 1 1 19 19 THR CB C 17 68.830 68.830 68.636 0.194 17967
4350 1 12 . 1 1 19 19 THR H H 17 7.720 7.720 7.720 0.000 17967
4351 1 12 . 1 1 20 20 GLU N N 18 125.410 125.410 120.879 4.531 17967
4352 1 12 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.172 -0.102 17967
4353 1 12 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.816 0.914 17967
4354 1 12 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.510 0.220 17967
4355 1 12 . 1 1 20 20 GLU H H 18 8.010 8.010 7.494 0.516 17967
4356 1 12 . 1 1 21 21 LEU N N 19 118.810 118.810 116.577 2.233 17967
4357 1 12 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.242 0.058 17967
4358 1 12 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.311 -0.481 17967
4359 1 12 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.947 0.383 17967
4360 1 12 . 1 1 21 21 LEU H H 19 8.010 8.010 7.947 0.063 17967
4361 1 12 . 1 1 22 22 GLN N N 20 118.310 118.310 116.097 2.213 17967
4362 1 12 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.026 -0.076 17967
4363 1 12 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.036 -0.306 17967
4364 1 12 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.400 -0.270 17967
4365 1 12 . 1 1 22 22 GLN H H 20 7.860 7.860 7.775 0.085 17967
4366 1 12 . 1 1 23 23 THR N N 21 115.910 115.910 111.731 4.179 17967
4367 1 12 . 1 1 23 23 THR HA H 21 4.950 4.950 4.585 0.365 17967
4368 1 12 . 1 1 23 23 THR CA C 21 58.530 58.530 60.043 -1.513 17967
4369 1 12 . 1 1 23 23 THR CB C 21 70.330 70.330 70.793 -0.464 17967
4370 1 12 . 1 1 23 23 THR H H 21 8.250 8.250 8.415 -0.165 17967
4371 1 12 . 1 1 24 24 THR N N 22 112.810 112.810 114.499 -1.689 17967
4372 1 12 . 1 1 24 24 THR HA H 22 4.880 4.880 4.643 0.237 17967
4373 1 12 . 1 1 24 24 THR CA C 22 59.730 59.730 60.184 -0.454 17967
4374 1 12 . 1 1 24 24 THR CB C 22 74.130 74.130 71.136 2.994 17967
4375 1 12 . 1 1 24 24 THR H H 22 8.660 8.660 7.950 0.710 17967
4376 1 12 . 1 1 25 25 ILE N N 23 123.710 123.710 120.021 3.689 17967
4377 1 12 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.736 0.044 17967
4378 1 12 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.218 -0.788 17967
4379 1 12 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.830 0.800 17967
4380 1 12 . 1 1 25 25 ILE H H 23 9.060 9.060 8.287 0.773 17967
4381 1 12 . 1 1 26 26 HIS N N 24 119.510 119.510 112.873 6.637 17967
4382 1 12 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.736 -0.296 17967
4383 1 12 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.181 1.849 17967
4384 1 12 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.159 1.671 17967
4385 1 12 . 1 1 26 26 HIS H H 24 7.040 7.040 7.450 -0.410 17967
4386 1 12 . 1 1 27 27 ASP N N 25 116.810 116.810 118.858 -2.048 17967
4387 1 12 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.695 0.065 17967
4388 1 12 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.406 0.024 17967
4389 1 12 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.029 1.301 17967
4390 1 12 . 1 1 27 27 ASP H H 25 7.250 7.250 7.614 -0.364 17967
4391 1 12 . 1 1 28 28 ILE N N 26 123.210 123.210 120.937 2.273 17967
4392 1 12 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.950 -0.020 17967
4393 1 12 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.842 0.188 17967
4394 1 12 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.646 -0.716 17967
4395 1 12 . 1 1 28 28 ILE H H 26 7.750 7.750 7.682 0.068 17967
4396 1 12 . 1 1 29 29 ILE N N 27 131.110 131.110 128.640 2.470 17967
4397 1 12 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.183 0.197 17967
4398 1 12 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.920 -1.090 17967
4399 1 12 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.870 0.761 17967
4400 1 12 . 1 1 29 29 ILE H H 27 8.270 8.270 8.329 -0.059 17967
4401 1 12 . 1 1 30 30 LEU N N 28 129.410 129.410 128.692 0.718 17967
4402 1 12 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.651 0.009 17967
4403 1 12 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.364 -0.834 17967
4404 1 12 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.624 2.706 17967
4405 1 12 . 1 1 30 30 LEU H H 28 8.500 8.500 8.444 0.056 17967
4406 1 12 . 1 1 31 31 GLU N N 29 121.910 121.910 120.454 1.456 17967
4407 1 12 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.733 -0.053 17967
4408 1 12 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.487 0.443 17967
4409 1 12 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.321 0.709 17967
4410 1 12 . 1 1 31 31 GLU H H 29 8.860 8.860 8.217 0.643 17967
4411 1 12 . 1 1 32 32 CYS N N 30 125.710 125.710 118.661 7.049 17967
4412 1 12 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.659 -0.639 17967
4413 1 12 . 1 1 32 32 CYS CA C 30 58.230 58.230 60.819 -2.589 17967
4414 1 12 . 1 1 32 32 CYS CB C 30 31.730 31.730 26.139 5.591 17967
4415 1 12 . 1 1 32 32 CYS H H 30 8.270 8.270 8.660 -0.390 17967
4416 1 12 . 1 1 33 33 VAL N N 31 132.310 132.310 124.508 7.802 17967
4417 1 12 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.253 -0.153 17967
4418 1 12 . 1 1 33 33 VAL CA C 31 64.230 64.230 64.044 0.186 17967
4419 1 12 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.663 -0.033 17967
4420 1 12 . 1 1 33 33 VAL H H 31 8.860 8.860 7.737 1.123 17967
4421 1 12 . 1 1 34 34 TYR N N 32 124.310 124.310 116.770 7.540 17967
4422 1 12 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.473 -0.033 17967
4423 1 12 . 1 1 34 34 TYR CA C 32 61.030 61.030 58.874 2.156 17967
4424 1 12 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.828 1.302 17967
4425 1 12 . 1 1 34 34 TYR H H 32 8.590 8.590 7.030 1.560 17967
4426 1 12 . 1 1 35 35 CYS N N 33 119.810 119.810 116.388 3.422 17967
4427 1 12 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.351 0.489 17967
4428 1 12 . 1 1 35 35 CYS CA C 33 59.430 59.430 59.699 -0.269 17967
4429 1 12 . 1 1 35 35 CYS CB C 33 32.230 32.230 27.771 4.459 17967
4430 1 12 . 1 1 35 35 CYS H H 33 8.070 8.070 7.950 0.120 17967
4431 1 12 . 1 1 36 36 LYS N N 34 119.910 119.910 114.576 5.334 17967
4432 1 12 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.960 0.230 17967
4433 1 12 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.163 0.667 17967
4434 1 12 . 1 1 36 36 LYS CB C 34 29.330 29.330 28.978 0.352 17967
4435 1 12 . 1 1 36 36 LYS H H 34 7.860 7.860 8.252 -0.392 17967
4436 1 12 . 1 1 37 37 GLN N N 35 120.710 120.710 112.740 7.970 17967
4437 1 12 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.665 -0.305 17967
4438 1 12 . 1 1 37 37 GLN CA C 35 55.430 55.430 53.159 2.271 17967
4439 1 12 . 1 1 37 37 GLN CB C 35 29.630 29.630 31.503 -1.873 17967
4440 1 12 . 1 1 37 37 GLN H H 35 8.270 8.270 7.623 0.647 17967
4441 1 12 . 1 1 38 38 GLN N N 36 123.710 123.710 120.984 2.726 17967
4442 1 12 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.263 0.037 17967
4443 1 12 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.642 0.088 17967
4444 1 12 . 1 1 38 38 GLN CB C 36 29.330 29.330 29.038 0.292 17967
4445 1 12 . 1 1 38 38 GLN H H 36 8.640 8.640 8.592 0.048 17967
4446 1 12 . 1 1 39 39 LEU N N 37 131.310 131.310 125.674 5.636 17967
4447 1 12 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.194 -0.084 17967
4448 1 12 . 1 1 39 39 LEU CA C 37 57.330 57.330 54.982 2.348 17967
4449 1 12 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.617 -0.687 17967
4450 1 12 . 1 1 39 39 LEU H H 37 8.870 8.870 7.865 1.005 17967
4451 1 12 . 1 1 40 40 LEU N N 38 126.310 126.310 123.391 2.919 17967
4452 1 12 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.317 -0.007 17967
4453 1 12 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.629 -0.399 17967
4454 1 12 . 1 1 40 40 LEU CB C 38 43.130 43.130 42.927 0.203 17967
4455 1 12 . 1 1 40 40 LEU H H 38 9.850 9.850 8.346 1.504 17967
4456 1 12 . 1 1 41 41 ARG N N 39 127.110 127.110 126.232 0.878 17967
4457 1 12 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.787 -0.267 17967
4458 1 12 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.565 -1.735 17967
4459 1 12 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.896 -2.966 17967
4460 1 12 . 1 1 41 41 ARG H H 39 8.970 8.970 8.927 0.043 17967
4461 1 12 . 1 1 42 42 ARG N N 40 115.810 115.810 117.801 -1.991 17967
4462 1 12 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.225 -0.145 17967
4463 1 12 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.901 -0.771 17967
4464 1 12 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.690 -0.360 17967
4465 1 12 . 1 1 42 42 ARG H H 40 8.610 8.610 8.663 -0.053 17967
4466 1 12 . 1 1 43 43 GLU N N 41 119.910 119.910 118.447 1.463 17967
4467 1 12 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.493 -0.243 17967
4468 1 12 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.059 0.971 17967
4469 1 12 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.134 1.196 17967
4470 1 12 . 1 1 43 43 GLU H H 41 6.950 6.950 7.813 -0.863 17967
4471 1 12 . 1 1 44 44 VAL N N 42 125.010 125.010 120.391 4.619 17967
4472 1 12 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.585 -0.345 17967
4473 1 12 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.302 1.328 17967
4474 1 12 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.180 0.150 17967
4475 1 12 . 1 1 44 44 VAL H H 42 7.820 7.820 8.062 -0.242 17967
4476 1 12 . 1 1 45 45 TYR N N 43 118.410 118.410 118.342 0.068 17967
4477 1 12 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.148 0.282 17967
4478 1 12 . 1 1 45 45 TYR CA C 43 58.830 58.830 61.026 -2.196 17967
4479 1 12 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.626 -0.896 17967
4480 1 12 . 1 1 45 45 TYR H H 43 7.820 7.820 7.995 -0.175 17967
4481 1 12 . 1 1 46 46 ASP N N 44 122.410 122.410 119.359 3.051 17967
4482 1 12 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.360 0.240 17967
4483 1 12 . 1 1 46 46 ASP CA C 44 57.830 57.830 58.071 -0.241 17967
4484 1 12 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.614 0.416 17967
4485 1 12 . 1 1 46 46 ASP H H 44 8.540 8.540 7.849 0.691 17967
4486 1 12 . 1 1 47 47 PHE N N 45 126.210 126.210 119.368 6.842 17967
4487 1 12 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.143 -0.233 17967
4488 1 12 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.453 1.177 17967
4489 1 12 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.032 0.298 17967
4490 1 12 . 1 1 47 47 PHE H H 45 8.320 8.320 7.512 0.808 17967
4491 1 12 . 1 1 48 48 ALA N N 46 119.110 119.110 119.567 -0.457 17967
4492 1 12 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.330 0.190 17967
4493 1 12 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.338 0.892 17967
4494 1 12 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.990 -0.260 17967
4495 1 12 . 1 1 48 48 ALA H H 46 7.740 7.740 7.743 -0.003 17967
4496 1 12 . 1 1 49 49 ARG N N 47 124.010 124.010 117.297 6.713 17967
4497 1 12 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.375 -0.325 17967
4498 1 12 . 1 1 49 49 ARG CA C 47 59.630 59.630 56.398 3.232 17967
4499 1 12 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.440 -0.010 17967
4500 1 12 . 1 1 49 49 ARG H H 47 8.500 8.500 7.850 0.650 17967
4501 1 12 . 1 1 50 50 ARG N N 48 119.110 119.110 117.959 1.151 17967
4502 1 12 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.547 -0.537 17967
4503 1 12 . 1 1 50 50 ARG CA C 48 57.130 57.130 55.053 2.077 17967
4504 1 12 . 1 1 50 50 ARG CB C 48 31.130 31.130 32.267 -1.137 17967
4505 1 12 . 1 1 50 50 ARG H H 48 7.940 7.940 7.558 0.382 17967
4506 1 12 . 1 1 51 51 ASP N N 49 120.910 120.910 117.399 3.511 17967
4507 1 12 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.528 -0.108 17967
4508 1 12 . 1 1 51 51 ASP CA C 49 54.530 54.530 54.276 0.254 17967
4509 1 12 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.268 -0.338 17967
4510 1 12 . 1 1 51 51 ASP H H 49 7.950 7.950 8.450 -0.500 17967
4511 1 12 . 1 1 52 52 LEU N N 50 118.410 118.410 120.660 -2.250 17967
4512 1 12 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.076 0.074 17967
4513 1 12 . 1 1 52 52 LEU CA C 50 54.230 54.230 55.414 -1.184 17967
4514 1 12 . 1 1 52 52 LEU CB C 50 41.130 41.130 41.809 -0.679 17967
4515 1 12 . 1 1 52 52 LEU H H 50 6.640 6.640 7.551 -0.911 17967
4516 1 12 . 1 1 53 53 CYS N N 51 117.410 117.410 117.275 0.135 17967
4517 1 12 . 1 1 53 53 CYS HA H 51 4.930 4.930 4.761 0.169 17967
4518 1 12 . 1 1 53 53 CYS CA C 51 58.930 58.930 55.573 3.357 17967
4519 1 12 . 1 1 53 53 CYS CB C 51 28.630 28.630 31.089 -2.459 17967
4520 1 12 . 1 1 53 53 CYS H H 51 8.030 8.030 7.911 0.119 17967
4521 1 12 . 1 1 54 54 ILE N N 52 125.110 125.110 122.555 2.555 17967
4522 1 12 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.309 -0.299 17967
4523 1 12 . 1 1 54 54 ILE CA C 52 59.630 59.630 62.005 -2.374 17967
4524 1 12 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.738 -1.408 17967
4525 1 12 . 1 1 54 54 ILE H H 52 8.500 8.500 8.657 -0.157 17967
4526 1 12 . 1 1 55 55 VAL N N 53 127.010 127.010 123.602 3.408 17967
4527 1 12 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.584 -0.214 17967
4528 1 12 . 1 1 55 55 VAL CA C 53 60.630 60.630 59.959 0.671 17967
4529 1 12 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.759 1.471 17967
4530 1 12 . 1 1 55 55 VAL H H 53 8.130 8.130 8.264 -0.134 17967
4531 1 12 . 1 1 56 56 TYR N N 54 124.910 124.910 126.113 -1.203 17967
4532 1 12 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.187 0.213 17967
4533 1 12 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.496 -0.166 17967
4534 1 12 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.203 1.827 17967
4535 1 12 . 1 1 56 56 TYR H H 54 8.700 8.700 8.630 0.070 17967
4536 1 12 . 1 1 57 57 ARG N N 55 123.810 123.810 125.620 -1.810 17967
4537 1 12 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.409 0.231 17967
4538 1 12 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.996 -0.566 17967
4539 1 12 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.459 2.371 17967
4540 1 12 . 1 1 57 57 ARG H H 55 8.870 8.870 8.421 0.449 17967
4541 1 12 . 1 1 58 58 ASP N N 56 129.110 129.110 125.346 3.764 17967
4542 1 12 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.330 -0.020 17967
4543 1 12 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.798 -0.968 17967
4544 1 12 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.191 -0.061 17967
4545 1 12 . 1 1 58 58 ASP H H 56 9.620 9.620 9.205 0.415 17967
4546 1 12 . 1 1 59 59 GLY N N 57 104.510 104.510 109.819 -5.309 17967
4547 1 12 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.097 0.533 17967
4548 1 12 . 1 1 59 59 GLY H H 57 8.720 8.720 8.378 0.342 17967
4549 1 12 . 1 1 60 60 ASN N N 58 122.210 122.210 118.794 3.416 17967
4550 1 12 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.127 0.273 17967
4551 1 12 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.880 -0.550 17967
4552 1 12 . 1 1 60 60 ASN CB C 58 40.430 40.430 40.973 -0.543 17967
4553 1 12 . 1 1 60 60 ASN H H 58 8.120 8.120 7.846 0.274 17967
4554 1 12 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.584 0.206 17967
4555 1 12 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.317 -0.287 17967
4556 1 12 . 1 1 61 61 PRO CB C 59 33.530 33.530 30.945 2.585 17967
4557 1 12 . 1 1 62 62 TYR N N 60 119.810 119.810 122.847 -3.037 17967
4558 1 12 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.529 -0.169 17967
4559 1 12 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.254 1.976 17967
4560 1 12 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.404 1.026 17967
4561 1 12 . 1 1 62 62 TYR H H 60 8.590 8.590 7.640 0.950 17967
4562 1 12 . 1 1 63 63 ALA N N 61 123.810 123.810 121.608 2.202 17967
4563 1 12 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.131 0.289 17967
4564 1 12 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.199 0.132 17967
4565 1 12 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.756 -0.426 17967
4566 1 12 . 1 1 63 63 ALA H H 61 8.010 8.010 8.817 -0.807 17967
4567 1 12 . 1 1 64 64 VAL N N 62 120.510 120.510 117.660 2.850 17967
4568 1 12 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.220 1.280 17967
4569 1 12 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.425 -0.195 17967
4570 1 12 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.686 2.644 17967
4571 1 12 . 1 1 64 64 VAL H H 62 6.380 6.380 8.182 -1.802 17967
4572 1 12 . 1 1 65 65 CYS N N 63 130.310 130.310 124.892 5.418 17967
4573 1 12 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.489 0.071 17967
4574 1 12 . 1 1 65 65 CYS CA C 63 58.430 58.430 57.934 0.497 17967
4575 1 12 . 1 1 65 65 CYS CB C 63 31.130 31.130 29.792 1.338 17967
4576 1 12 . 1 1 65 65 CYS H H 63 9.430 9.430 8.050 1.380 17967
4577 1 12 . 1 1 66 66 ASP N N 64 121.110 121.110 120.316 0.794 17967
4578 1 12 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.334 0.076 17967
4579 1 12 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.125 0.105 17967
4580 1 12 . 1 1 66 66 ASP CB C 64 42.330 42.330 41.000 1.330 17967
4581 1 12 . 1 1 66 66 ASP H H 64 9.120 9.120 8.816 0.304 17967
4582 1 12 . 1 1 67 67 LYS N N 65 122.110 122.110 118.873 3.237 17967
4583 1 12 . 1 1 67 67 LYS HA H 65 4.010 4.010 4.377 -0.367 17967
4584 1 12 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.087 2.043 17967
4585 1 12 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.151 0.679 17967
4586 1 12 . 1 1 67 67 LYS H H 65 8.330 8.330 7.789 0.541 17967
4587 1 12 . 1 1 68 68 CYS N N 66 125.610 125.610 120.018 5.592 17967
4588 1 12 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.057 0.053 17967
4589 1 12 . 1 1 68 68 CYS CA C 66 63.530 63.530 63.132 0.398 17967
4590 1 12 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.201 4.529 17967
4591 1 12 . 1 1 68 68 CYS H H 66 8.700 8.700 7.910 0.790 17967
4592 1 12 . 1 1 69 69 LEU N N 67 125.310 125.310 120.834 4.476 17967
4593 1 12 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.281 -0.281 17967
4594 1 12 . 1 1 69 69 LEU CA C 67 58.530 58.530 57.950 0.580 17967
4595 1 12 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.941 0.188 17967
4596 1 12 . 1 1 69 69 LEU H H 67 8.470 8.470 8.636 -0.166 17967
4597 1 12 . 1 1 70 70 LYS N N 68 119.010 119.010 120.265 -1.255 17967
4598 1 12 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.105 -0.125 17967
4599 1 12 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.778 0.052 17967
4600 1 12 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.715 0.415 17967
4601 1 12 . 1 1 70 70 LYS H H 68 7.810 7.810 7.404 0.406 17967
4602 1 12 . 1 1 71 71 PHE N N 69 121.710 121.710 117.310 4.400 17967
4603 1 12 . 1 1 71 71 PHE HA H 69 4.280 4.280 3.964 0.316 17967
4604 1 12 . 1 1 71 71 PHE CA C 69 59.930 59.930 61.274 -1.344 17967
4605 1 12 . 1 1 71 71 PHE CB C 69 39.430 39.430 39.608 -0.179 17967
4606 1 12 . 1 1 71 71 PHE H H 69 7.810 7.810 7.664 0.146 17967
4607 1 12 . 1 1 72 72 TYR N N 70 120.110 120.110 116.932 3.178 17967
4608 1 12 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.653 -0.333 17967
4609 1 12 . 1 1 72 72 TYR CA C 70 60.330 60.330 57.211 3.119 17967
4610 1 12 . 1 1 72 72 TYR CB C 70 40.430 40.430 38.526 1.904 17967
4611 1 12 . 1 1 72 72 TYR H H 70 8.280 8.280 8.453 -0.173 17967
4612 1 12 . 1 1 73 73 SER N N 71 117.210 117.210 120.816 -3.606 17967
4613 1 12 . 1 1 73 73 SER HA H 71 4.320 4.320 4.481 -0.161 17967
4614 1 12 . 1 1 73 73 SER CA C 71 60.130 60.130 60.362 -0.232 17967
4615 1 12 . 1 1 73 73 SER CB C 71 63.630 63.630 63.673 -0.043 17967
4616 1 12 . 1 1 73 73 SER H H 71 7.870 7.870 8.772 -0.902 17967
4617 1 12 . 1 1 74 74 LYS N N 72 122.810 122.810 122.028 0.782 17967
4618 1 12 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.295 -0.025 17967
4619 1 12 . 1 1 74 74 LYS CA C 72 56.930 56.930 56.401 0.529 17967
4620 1 12 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.616 0.014 17967
4621 1 12 . 1 1 74 74 LYS H H 72 7.800 7.800 8.213 -0.413 17967
4622 1 12 . 1 1 75 75 ILE N N 73 121.610 121.610 119.928 1.682 17967
4623 1 12 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.134 -0.024 17967
4624 1 12 . 1 1 75 75 ILE CA C 73 61.830 61.830 61.960 -0.130 17967
4625 1 12 . 1 1 75 75 ILE CB C 73 38.630 38.630 37.432 1.198 17967
4626 1 12 . 1 1 75 75 ILE H H 73 7.750 7.750 8.144 -0.394 17967
4627 1 12 . 1 1 76 76 SER N N 74 120.410 120.410 121.045 -0.635 17967
4628 1 12 . 1 1 76 76 SER HA H 74 4.300 4.300 4.628 -0.328 17967
4629 1 12 . 1 1 76 76 SER CA C 74 59.330 59.330 58.125 1.205 17967
4630 1 12 . 1 1 76 76 SER CB C 74 63.830 63.830 64.758 -0.928 17967
4631 1 12 . 1 1 76 76 SER H H 74 8.130 8.130 8.476 -0.346 17967
4632 1 12 . 1 1 77 77 GLU N N 75 123.810 123.810 122.148 1.662 17967
4633 1 12 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.734 -0.544 17967
4634 1 12 . 1 1 77 77 GLU CA C 75 57.330 57.330 55.097 2.233 17967
4635 1 12 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.874 -0.744 17967
4636 1 12 . 1 1 77 77 GLU H H 75 8.270 8.270 8.102 0.168 17967
4637 1 12 . 1 1 78 78 TYR N N 76 122.410 122.410 126.681 -4.271 17967
4638 1 12 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.538 -0.078 17967
4639 1 12 . 1 1 78 78 TYR CA C 76 58.130 58.130 57.276 0.854 17967
4640 1 12 . 1 1 78 78 TYR CB C 76 38.630 38.630 38.684 -0.054 17967
4641 1 12 . 1 1 78 78 TYR H H 76 7.980 7.980 8.622 -0.642 17967
4642 1 12 . 1 1 79 79 ARG N N 77 124.710 124.710 130.479 -5.769 17967
4643 1 12 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.766 -0.566 17967
4644 1 12 . 1 1 79 79 ARG CA C 77 56.030 56.030 54.827 1.203 17967
4645 1 12 . 1 1 79 79 ARG CB C 77 31.030 31.030 28.637 2.393 17967
4646 1 12 . 1 1 79 79 ARG H H 77 7.880 7.880 9.043 -1.163 17967
4647 1 12 . 1 1 80 80 HIS N N 78 122.110 122.110 122.019 0.091 17967
4648 1 12 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.435 0.075 17967
4649 1 12 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.914 0.416 17967
4650 1 12 . 1 1 80 80 HIS CB C 78 30.830 30.830 29.182 1.648 17967
4651 1 12 . 1 1 80 80 HIS H H 78 8.120 8.120 7.903 0.217 17967
4652 1 12 . 1 1 81 81 TYR N N 79 123.610 123.610 118.743 4.867 17967
4653 1 12 . 1 1 81 81 TYR HA H 79 4.590 4.590 3.915 0.675 17967
4654 1 12 . 1 1 81 81 TYR CA C 79 57.830 57.830 58.137 -0.307 17967
4655 1 12 . 1 1 81 81 TYR CB C 79 39.130 39.130 37.756 1.374 17967
4656 1 12 . 1 1 81 81 TYR H H 79 7.970 7.970 6.952 1.018 17967
4657 1 13 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.540 -0.250 17967
4658 1 13 . 1 1 2 2 ALA CA C 0 52.530 52.530 52.379 0.151 17967
4659 1 13 . 1 1 2 2 ALA CB C 0 19.730 19.730 18.528 1.202 17967
4660 1 13 . 1 1 3 3 MET N N 1 122.210 122.210 122.830 -0.620 17967
4661 1 13 . 1 1 3 3 MET HA H 1 4.300 4.300 5.206 -0.906 17967
4662 1 13 . 1 1 3 3 MET CA C 1 56.030 56.030 54.375 1.655 17967
4663 1 13 . 1 1 3 3 MET CB C 1 33.430 33.430 33.892 -0.462 17967
4664 1 13 . 1 1 3 3 MET H H 1 8.370 8.370 7.865 0.505 17967
4665 1 13 . 1 1 4 4 PHE N N 2 122.310 122.310 126.880 -4.570 17967
4666 1 13 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.673 -0.043 17967
4667 1 13 . 1 1 4 4 PHE CA C 2 57.330 57.330 56.434 0.896 17967
4668 1 13 . 1 1 4 4 PHE CB C 2 39.430 39.430 40.529 -1.099 17967
4669 1 13 . 1 1 4 4 PHE H H 2 8.370 8.370 8.503 -0.133 17967
4670 1 13 . 1 1 5 5 GLN N N 3 123.510 123.510 125.617 -2.107 17967
4671 1 13 . 1 1 5 5 GLN HA H 3 4.180 4.180 3.991 0.189 17967
4672 1 13 . 1 1 5 5 GLN CA C 3 56.130 56.130 55.858 0.272 17967
4673 1 13 . 1 1 5 5 GLN CB C 3 29.930 29.930 29.012 0.919 17967
4674 1 13 . 1 1 5 5 GLN H H 3 8.260 8.260 8.262 -0.002 17967
4675 1 13 . 1 1 6 6 ASP N N 4 125.010 125.010 118.598 6.412 17967
4676 1 13 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.643 0.147 17967
4677 1 13 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.718 0.212 17967
4678 1 13 . 1 1 6 6 ASP CB C 4 41.730 41.730 40.823 0.907 17967
4679 1 13 . 1 1 6 6 ASP H H 4 8.420 8.420 8.326 0.094 17967
4680 1 13 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.340 -0.220 17967
4681 1 13 . 1 1 7 7 PRO CA C 5 64.030 64.030 64.225 -0.195 17967
4682 1 13 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.229 0.101 17967
4683 1 13 . 1 1 8 8 GLN N N 6 119.710 119.710 117.598 2.112 17967
4684 1 13 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.327 -0.167 17967
4685 1 13 . 1 1 8 8 GLN CA C 6 56.630 56.630 54.824 1.806 17967
4686 1 13 . 1 1 8 8 GLN CB C 6 29.330 29.330 29.226 0.104 17967
4687 1 13 . 1 1 8 8 GLN H H 6 8.430 8.430 7.773 0.657 17967
4688 1 13 . 1 1 9 9 GLU N N 7 122.110 122.110 120.060 2.050 17967
4689 1 13 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.200 -0.000 17967
4690 1 13 . 1 1 9 9 GLU CA C 7 56.030 56.030 55.502 0.528 17967
4691 1 13 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.313 1.217 17967
4692 1 13 . 1 1 9 9 GLU H H 7 7.940 7.940 8.014 -0.074 17967
4693 1 13 . 1 1 10 10 ARG N N 8 123.410 123.410 119.461 3.949 17967
4694 1 13 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.736 -0.336 17967
4695 1 13 . 1 1 10 10 ARG CA C 8 54.130 54.130 53.515 0.615 17967
4696 1 13 . 1 1 10 10 ARG CB C 8 29.330 29.330 30.332 -1.002 17967
4697 1 13 . 1 1 10 10 ARG H H 8 7.660 7.660 7.401 0.259 17967
4698 1 13 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.578 -0.228 17967
4699 1 13 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.531 0.999 17967
4700 1 13 . 1 1 11 11 PRO CB C 9 32.630 32.630 33.334 -0.704 17967
4701 1 13 . 1 1 12 12 ARG N N 10 123.810 123.810 115.209 8.601 17967
4702 1 13 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.875 -0.205 17967
4703 1 13 . 1 1 12 12 ARG CA C 10 56.830 56.830 54.986 1.844 17967
4704 1 13 . 1 1 12 12 ARG CB C 10 32.530 32.530 32.292 0.238 17967
4705 1 13 . 1 1 12 12 ARG H H 10 8.710 8.710 8.296 0.414 17967
4706 1 13 . 1 1 13 13 LYS N N 11 118.410 118.410 120.101 -1.691 17967
4707 1 13 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.806 0.244 17967
4708 1 13 . 1 1 13 13 LYS CA C 11 53.330 53.330 55.143 -1.813 17967
4709 1 13 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.458 0.972 17967
4710 1 13 . 1 1 13 13 LYS H H 11 7.800 7.800 7.969 -0.169 17967
4711 1 13 . 1 1 14 14 LEU N N 12 125.010 125.010 125.804 -0.794 17967
4712 1 13 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.227 -0.057 17967
4713 1 13 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.557 0.173 17967
4714 1 13 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.846 0.684 17967
4715 1 13 . 1 1 14 14 LEU H H 12 10.210 10.210 9.292 0.918 17967
4716 1 13 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.218 0.002 17967
4717 1 13 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.641 1.589 17967
4718 1 13 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.024 -0.294 17967
4719 1 13 . 1 1 16 16 GLN N N 14 117.810 117.810 118.009 -0.199 17967
4720 1 13 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.131 0.059 17967
4721 1 13 . 1 1 16 16 GLN CA C 14 59.030 59.030 59.091 -0.061 17967
4722 1 13 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.337 0.292 17967
4723 1 13 . 1 1 16 16 GLN H H 14 7.110 7.110 8.368 -1.258 17967
4724 1 13 . 1 1 17 17 LEU N N 15 124.710 124.710 121.800 2.910 17967
4725 1 13 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.195 -0.185 17967
4726 1 13 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.565 0.765 17967
4727 1 13 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.798 0.232 17967
4728 1 13 . 1 1 17 17 LEU H H 15 8.010 8.010 8.043 -0.033 17967
4729 1 13 . 1 1 18 18 CYS N N 16 117.210 117.210 117.504 -0.294 17967
4730 1 13 . 1 1 18 18 CYS HA H 16 3.750 3.750 3.954 -0.204 17967
4731 1 13 . 1 1 18 18 CYS CA C 16 64.730 64.730 64.090 0.640 17967
4732 1 13 . 1 1 18 18 CYS CB C 16 26.230 26.230 26.053 0.177 17967
4733 1 13 . 1 1 18 18 CYS H H 16 8.380 8.380 8.509 -0.129 17967
4734 1 13 . 1 1 19 19 THR N N 17 117.810 117.810 116.087 1.723 17967
4735 1 13 . 1 1 19 19 THR HA H 17 4.000 4.000 4.024 -0.024 17967
4736 1 13 . 1 1 19 19 THR CA C 17 66.830 66.830 67.240 -0.410 17967
4737 1 13 . 1 1 19 19 THR CB C 17 68.830 68.830 68.519 0.311 17967
4738 1 13 . 1 1 19 19 THR H H 17 7.720 7.720 7.917 -0.197 17967
4739 1 13 . 1 1 20 20 GLU N N 18 125.410 125.410 120.717 4.693 17967
4740 1 13 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.233 -0.163 17967
4741 1 13 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.883 0.847 17967
4742 1 13 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.473 0.257 17967
4743 1 13 . 1 1 20 20 GLU H H 18 8.010 8.010 7.508 0.502 17967
4744 1 13 . 1 1 21 21 LEU N N 19 118.810 118.810 116.987 1.823 17967
4745 1 13 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.246 0.054 17967
4746 1 13 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.163 -0.333 17967
4747 1 13 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.711 0.619 17967
4748 1 13 . 1 1 21 21 LEU H H 19 8.010 8.010 8.018 -0.008 17967
4749 1 13 . 1 1 22 22 GLN N N 20 118.310 118.310 114.652 3.658 17967
4750 1 13 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.044 -0.094 17967
4751 1 13 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.034 -0.304 17967
4752 1 13 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.499 -0.369 17967
4753 1 13 . 1 1 22 22 GLN H H 20 7.860 7.860 7.689 0.171 17967
4754 1 13 . 1 1 23 23 THR N N 21 115.910 115.910 112.680 3.230 17967
4755 1 13 . 1 1 23 23 THR HA H 21 4.950 4.950 4.529 0.421 17967
4756 1 13 . 1 1 23 23 THR CA C 21 58.530 58.530 60.240 -1.710 17967
4757 1 13 . 1 1 23 23 THR CB C 21 70.330 70.330 70.743 -0.413 17967
4758 1 13 . 1 1 23 23 THR H H 21 8.250 8.250 8.362 -0.112 17967
4759 1 13 . 1 1 24 24 THR N N 22 112.810 112.810 113.742 -0.932 17967
4760 1 13 . 1 1 24 24 THR HA H 22 4.880 4.880 4.614 0.266 17967
4761 1 13 . 1 1 24 24 THR CA C 22 59.730 59.730 60.238 -0.508 17967
4762 1 13 . 1 1 24 24 THR CB C 22 74.130 74.130 71.128 3.002 17967
4763 1 13 . 1 1 24 24 THR H H 22 8.660 8.660 7.817 0.843 17967
4764 1 13 . 1 1 25 25 ILE N N 23 123.710 123.710 119.753 3.957 17967
4765 1 13 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.709 0.071 17967
4766 1 13 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.141 -0.711 17967
4767 1 13 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.992 0.638 17967
4768 1 13 . 1 1 25 25 ILE H H 23 9.060 9.060 8.137 0.923 17967
4769 1 13 . 1 1 26 26 HIS N N 24 119.510 119.510 112.957 6.553 17967
4770 1 13 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.696 -0.256 17967
4771 1 13 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.274 1.756 17967
4772 1 13 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.233 1.597 17967
4773 1 13 . 1 1 26 26 HIS H H 24 7.040 7.040 7.470 -0.430 17967
4774 1 13 . 1 1 27 27 ASP N N 25 116.810 116.810 118.586 -1.776 17967
4775 1 13 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.686 0.074 17967
4776 1 13 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.245 0.185 17967
4777 1 13 . 1 1 27 27 ASP CB C 25 44.330 44.330 42.984 1.346 17967
4778 1 13 . 1 1 27 27 ASP H H 25 7.250 7.250 7.690 -0.440 17967
4779 1 13 . 1 1 28 28 ILE N N 26 123.210 123.210 121.534 1.676 17967
4780 1 13 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.901 0.029 17967
4781 1 13 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.273 0.757 17967
4782 1 13 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.620 -0.690 17967
4783 1 13 . 1 1 28 28 ILE H H 26 7.750 7.750 7.784 -0.034 17967
4784 1 13 . 1 1 29 29 ILE N N 27 131.110 131.110 128.385 2.725 17967
4785 1 13 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.107 0.273 17967
4786 1 13 . 1 1 29 29 ILE CA C 27 58.830 58.830 60.196 -1.366 17967
4787 1 13 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.627 1.003 17967
4788 1 13 . 1 1 29 29 ILE H H 27 8.270 8.270 8.291 -0.021 17967
4789 1 13 . 1 1 30 30 LEU N N 28 129.410 129.410 129.647 -0.237 17967
4790 1 13 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.556 0.104 17967
4791 1 13 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.548 -1.018 17967
4792 1 13 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.353 2.977 17967
4793 1 13 . 1 1 30 30 LEU H H 28 8.500 8.500 8.381 0.119 17967
4794 1 13 . 1 1 31 31 GLU N N 29 121.910 121.910 121.502 0.408 17967
4795 1 13 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.760 -0.080 17967
4796 1 13 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.298 0.632 17967
4797 1 13 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.463 0.567 17967
4798 1 13 . 1 1 31 31 GLU H H 29 8.860 8.860 8.216 0.644 17967
4799 1 13 . 1 1 32 32 CYS N N 30 125.710 125.710 118.998 6.712 17967
4800 1 13 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.682 -0.662 17967
4801 1 13 . 1 1 32 32 CYS CA C 30 58.230 58.230 60.933 -2.703 17967
4802 1 13 . 1 1 32 32 CYS CB C 30 31.730 31.730 26.065 5.665 17967
4803 1 13 . 1 1 32 32 CYS H H 30 8.270 8.270 8.685 -0.415 17967
4804 1 13 . 1 1 33 33 VAL N N 31 132.310 132.310 124.772 7.538 17967
4805 1 13 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.008 0.092 17967
4806 1 13 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.815 -1.585 17967
4807 1 13 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.741 -0.111 17967
4808 1 13 . 1 1 33 33 VAL H H 31 8.860 8.860 7.577 1.283 17967
4809 1 13 . 1 1 34 34 TYR N N 32 124.310 124.310 117.730 6.580 17967
4810 1 13 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.543 -0.103 17967
4811 1 13 . 1 1 34 34 TYR CA C 32 61.030 61.030 60.594 0.436 17967
4812 1 13 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.254 1.876 17967
4813 1 13 . 1 1 34 34 TYR H H 32 8.590 8.590 7.470 1.120 17967
4814 1 13 . 1 1 35 35 CYS N N 33 119.810 119.810 116.652 3.158 17967
4815 1 13 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.601 0.239 17967
4816 1 13 . 1 1 35 35 CYS CA C 33 59.430 59.430 59.013 0.417 17967
4817 1 13 . 1 1 35 35 CYS CB C 33 32.230 32.230 27.647 4.583 17967
4818 1 13 . 1 1 35 35 CYS H H 33 8.070 8.070 8.319 -0.249 17967
4819 1 13 . 1 1 36 36 LYS N N 34 119.910 119.910 115.296 4.614 17967
4820 1 13 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.931 0.259 17967
4821 1 13 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.245 0.585 17967
4822 1 13 . 1 1 36 36 LYS CB C 34 29.330 29.330 29.487 -0.157 17967
4823 1 13 . 1 1 36 36 LYS H H 34 7.860 7.860 8.040 -0.180 17967
4824 1 13 . 1 1 37 37 GLN N N 35 120.710 120.710 114.015 6.695 17967
4825 1 13 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.651 -0.291 17967
4826 1 13 . 1 1 37 37 GLN CA C 35 55.430 55.430 53.677 1.753 17967
4827 1 13 . 1 1 37 37 GLN CB C 35 29.630 29.630 30.635 -1.005 17967
4828 1 13 . 1 1 37 37 GLN H H 35 8.270 8.270 7.778 0.492 17967
4829 1 13 . 1 1 38 38 GLN N N 36 123.710 123.710 122.184 1.526 17967
4830 1 13 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.230 0.070 17967
4831 1 13 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.494 0.236 17967
4832 1 13 . 1 1 38 38 GLN CB C 36 29.330 29.330 29.066 0.264 17967
4833 1 13 . 1 1 38 38 GLN H H 36 8.640 8.640 8.530 0.110 17967
4834 1 13 . 1 1 39 39 LEU N N 37 131.310 131.310 125.892 5.418 17967
4835 1 13 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.150 -0.040 17967
4836 1 13 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.311 2.019 17967
4837 1 13 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.544 -0.613 17967
4838 1 13 . 1 1 39 39 LEU H H 37 8.870 8.870 7.745 1.125 17967
4839 1 13 . 1 1 40 40 LEU N N 38 126.310 126.310 123.421 2.889 17967
4840 1 13 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.294 0.016 17967
4841 1 13 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.992 -0.762 17967
4842 1 13 . 1 1 40 40 LEU CB C 38 43.130 43.130 42.869 0.261 17967
4843 1 13 . 1 1 40 40 LEU H H 38 9.850 9.850 8.396 1.454 17967
4844 1 13 . 1 1 41 41 ARG N N 39 127.110 127.110 125.973 1.137 17967
4845 1 13 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.727 -0.207 17967
4846 1 13 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.611 -1.781 17967
4847 1 13 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.936 -3.006 17967
4848 1 13 . 1 1 41 41 ARG H H 39 8.970 8.970 8.860 0.110 17967
4849 1 13 . 1 1 42 42 ARG N N 40 115.810 115.810 119.521 -3.711 17967
4850 1 13 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.252 -0.172 17967
4851 1 13 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.242 -0.112 17967
4852 1 13 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.155 0.175 17967
4853 1 13 . 1 1 42 42 ARG H H 40 8.610 8.610 8.668 -0.058 17967
4854 1 13 . 1 1 43 43 GLU N N 41 119.910 119.910 118.725 1.185 17967
4855 1 13 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.430 -0.180 17967
4856 1 13 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.709 0.321 17967
4857 1 13 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.199 1.131 17967
4858 1 13 . 1 1 43 43 GLU H H 41 6.950 6.950 7.888 -0.938 17967
4859 1 13 . 1 1 44 44 VAL N N 42 125.010 125.010 120.563 4.447 17967
4860 1 13 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.593 -0.353 17967
4861 1 13 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.479 1.151 17967
4862 1 13 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.057 0.273 17967
4863 1 13 . 1 1 44 44 VAL H H 42 7.820 7.820 7.947 -0.127 17967
4864 1 13 . 1 1 45 45 TYR N N 43 118.410 118.410 119.017 -0.607 17967
4865 1 13 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.148 0.282 17967
4866 1 13 . 1 1 45 45 TYR CA C 43 58.830 58.830 61.069 -2.239 17967
4867 1 13 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.373 -0.644 17967
4868 1 13 . 1 1 45 45 TYR H H 43 7.820 7.820 8.179 -0.359 17967
4869 1 13 . 1 1 46 46 ASP N N 44 122.410 122.410 120.180 2.230 17967
4870 1 13 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.337 0.263 17967
4871 1 13 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.971 -0.141 17967
4872 1 13 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.384 0.646 17967
4873 1 13 . 1 1 46 46 ASP H H 44 8.540 8.540 8.392 0.148 17967
4874 1 13 . 1 1 47 47 PHE N N 45 126.210 126.210 120.106 6.104 17967
4875 1 13 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.037 -0.127 17967
4876 1 13 . 1 1 47 47 PHE CA C 45 62.630 62.630 62.248 0.383 17967
4877 1 13 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.037 0.293 17967
4878 1 13 . 1 1 47 47 PHE H H 45 8.320 8.320 8.001 0.319 17967
4879 1 13 . 1 1 48 48 ALA N N 46 119.110 119.110 119.612 -0.502 17967
4880 1 13 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.305 0.215 17967
4881 1 13 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.884 0.346 17967
4882 1 13 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.638 0.092 17967
4883 1 13 . 1 1 48 48 ALA H H 46 7.740 7.740 7.823 -0.083 17967
4884 1 13 . 1 1 49 49 ARG N N 47 124.010 124.010 118.536 5.474 17967
4885 1 13 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.269 -0.219 17967
4886 1 13 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.599 2.031 17967
4887 1 13 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.548 -0.118 17967
4888 1 13 . 1 1 49 49 ARG H H 47 8.500 8.500 8.371 0.129 17967
4889 1 13 . 1 1 50 50 ARG N N 48 119.110 119.110 118.224 0.886 17967
4890 1 13 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.483 -0.473 17967
4891 1 13 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.963 2.167 17967
4892 1 13 . 1 1 50 50 ARG CB C 48 31.130 31.130 31.562 -0.432 17967
4893 1 13 . 1 1 50 50 ARG H H 48 7.940 7.940 8.031 -0.091 17967
4894 1 13 . 1 1 51 51 ASP N N 49 120.910 120.910 119.744 1.166 17967
4895 1 13 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.787 -0.367 17967
4896 1 13 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.562 0.968 17967
4897 1 13 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.661 -0.731 17967
4898 1 13 . 1 1 51 51 ASP H H 49 7.950 7.950 8.376 -0.426 17967
4899 1 13 . 1 1 52 52 LEU N N 50 118.410 118.410 122.512 -4.102 17967
4900 1 13 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.672 -0.522 17967
4901 1 13 . 1 1 52 52 LEU CA C 50 54.230 54.230 52.948 1.282 17967
4902 1 13 . 1 1 52 52 LEU CB C 50 41.130 41.130 43.886 -2.756 17967
4903 1 13 . 1 1 52 52 LEU H H 50 6.640 6.640 7.316 -0.676 17967
4904 1 13 . 1 1 53 53 CYS N N 51 117.410 117.410 117.458 -0.048 17967
4905 1 13 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.287 -0.357 17967
4906 1 13 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.245 2.685 17967
4907 1 13 . 1 1 53 53 CYS CB C 51 28.630 28.630 29.962 -1.332 17967
4908 1 13 . 1 1 53 53 CYS H H 51 8.030 8.030 8.285 -0.255 17967
4909 1 13 . 1 1 54 54 ILE N N 52 125.110 125.110 123.823 1.287 17967
4910 1 13 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.280 -0.270 17967
4911 1 13 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.898 -2.268 17967
4912 1 13 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.989 -1.659 17967
4913 1 13 . 1 1 54 54 ILE H H 52 8.500 8.500 8.722 -0.222 17967
4914 1 13 . 1 1 55 55 VAL N N 53 127.010 127.010 123.077 3.933 17967
4915 1 13 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.532 -0.162 17967
4916 1 13 . 1 1 55 55 VAL CA C 53 60.630 60.630 59.789 0.841 17967
4917 1 13 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.530 1.700 17967
4918 1 13 . 1 1 55 55 VAL H H 53 8.130 8.130 8.358 -0.228 17967
4919 1 13 . 1 1 56 56 TYR N N 54 124.910 124.910 126.076 -1.166 17967
4920 1 13 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.307 0.093 17967
4921 1 13 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.458 -0.128 17967
4922 1 13 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.246 1.784 17967
4923 1 13 . 1 1 56 56 TYR H H 54 8.700 8.700 8.555 0.145 17967
4924 1 13 . 1 1 57 57 ARG N N 55 123.810 123.810 125.646 -1.836 17967
4925 1 13 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.370 0.270 17967
4926 1 13 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.675 -0.245 17967
4927 1 13 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.415 2.416 17967
4928 1 13 . 1 1 57 57 ARG H H 55 8.870 8.870 8.375 0.495 17967
4929 1 13 . 1 1 58 58 ASP N N 56 129.110 129.110 125.896 3.214 17967
4930 1 13 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.294 0.016 17967
4931 1 13 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.625 -0.795 17967
4932 1 13 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.139 -0.009 17967
4933 1 13 . 1 1 58 58 ASP H H 56 9.620 9.620 9.109 0.511 17967
4934 1 13 . 1 1 59 59 GLY N N 57 104.510 104.510 107.436 -2.926 17967
4935 1 13 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.108 0.522 17967
4936 1 13 . 1 1 59 59 GLY H H 57 8.720 8.720 8.477 0.243 17967
4937 1 13 . 1 1 60 60 ASN N N 58 122.210 122.210 118.573 3.637 17967
4938 1 13 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.247 0.153 17967
4939 1 13 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.908 -0.578 17967
4940 1 13 . 1 1 60 60 ASN CB C 58 40.430 40.430 41.183 -0.753 17967
4941 1 13 . 1 1 60 60 ASN H H 58 8.120 8.120 7.984 0.136 17967
4942 1 13 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.768 0.022 17967
4943 1 13 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.516 -0.486 17967
4944 1 13 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.300 2.230 17967
4945 1 13 . 1 1 62 62 TYR N N 60 119.810 119.810 122.821 -3.011 17967
4946 1 13 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.550 -0.190 17967
4947 1 13 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.377 1.853 17967
4948 1 13 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.228 1.202 17967
4949 1 13 . 1 1 62 62 TYR H H 60 8.590 8.590 7.643 0.947 17967
4950 1 13 . 1 1 63 63 ALA N N 61 123.810 123.810 122.972 0.838 17967
4951 1 13 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.042 0.378 17967
4952 1 13 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.834 -0.504 17967
4953 1 13 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.122 0.207 17967
4954 1 13 . 1 1 63 63 ALA H H 61 8.010 8.010 8.539 -0.529 17967
4955 1 13 . 1 1 64 64 VAL N N 62 120.510 120.510 117.206 3.304 17967
4956 1 13 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.376 1.124 17967
4957 1 13 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.411 -0.181 17967
4958 1 13 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.900 2.430 17967
4959 1 13 . 1 1 64 64 VAL H H 62 6.380 6.380 8.302 -1.922 17967
4960 1 13 . 1 1 65 65 CYS N N 63 130.310 130.310 124.863 5.447 17967
4961 1 13 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.525 0.035 17967
4962 1 13 . 1 1 65 65 CYS CA C 63 58.430 58.430 57.978 0.452 17967
4963 1 13 . 1 1 65 65 CYS CB C 63 31.130 31.130 29.936 1.194 17967
4964 1 13 . 1 1 65 65 CYS H H 63 9.430 9.430 8.434 0.996 17967
4965 1 13 . 1 1 66 66 ASP N N 64 121.110 121.110 120.808 0.302 17967
4966 1 13 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.261 0.149 17967
4967 1 13 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.168 0.062 17967
4968 1 13 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.976 1.354 17967
4969 1 13 . 1 1 66 66 ASP H H 64 9.120 9.120 8.861 0.259 17967
4970 1 13 . 1 1 67 67 LYS N N 65 122.110 122.110 119.925 2.185 17967
4971 1 13 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.762 0.248 17967
4972 1 13 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.879 1.252 17967
4973 1 13 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.155 0.675 17967
4974 1 13 . 1 1 67 67 LYS H H 65 8.330 8.330 7.533 0.797 17967
4975 1 13 . 1 1 68 68 CYS N N 66 125.610 125.610 118.983 6.627 17967
4976 1 13 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.308 -0.198 17967
4977 1 13 . 1 1 68 68 CYS CA C 66 63.530 63.530 63.707 -0.177 17967
4978 1 13 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.166 4.564 17967
4979 1 13 . 1 1 68 68 CYS H H 66 8.700 8.700 7.775 0.925 17967
4980 1 13 . 1 1 69 69 LEU N N 67 125.310 125.310 120.765 4.545 17967
4981 1 13 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.024 -0.024 17967
4982 1 13 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.362 0.168 17967
4983 1 13 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.702 0.428 17967
4984 1 13 . 1 1 69 69 LEU H H 67 8.470 8.470 8.537 -0.067 17967
4985 1 13 . 1 1 70 70 LYS N N 68 119.010 119.010 118.143 0.867 17967
4986 1 13 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.283 -0.303 17967
4987 1 13 . 1 1 70 70 LYS CA C 68 58.830 58.830 57.997 0.833 17967
4988 1 13 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.622 0.508 17967
4989 1 13 . 1 1 70 70 LYS H H 68 7.810 7.810 7.662 0.148 17967
4990 1 13 . 1 1 71 71 PHE N N 69 121.710 121.710 118.887 2.823 17967
4991 1 13 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.219 0.061 17967
4992 1 13 . 1 1 71 71 PHE CA C 69 59.930 59.930 59.617 0.313 17967
4993 1 13 . 1 1 71 71 PHE CB C 69 39.430 39.430 39.040 0.390 17967
4994 1 13 . 1 1 71 71 PHE H H 69 7.810 7.810 7.452 0.358 17967
4995 1 13 . 1 1 72 72 TYR N N 70 120.110 120.110 115.385 4.725 17967
4996 1 13 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.738 -0.418 17967
4997 1 13 . 1 1 72 72 TYR CA C 70 60.330 60.330 56.347 3.983 17967
4998 1 13 . 1 1 72 72 TYR CB C 70 40.430 40.430 37.345 3.085 17967
4999 1 13 . 1 1 72 72 TYR H H 70 8.280 8.280 8.655 -0.375 17967
5000 1 13 . 1 1 73 73 SER N N 71 117.210 117.210 116.595 0.615 17967
5001 1 13 . 1 1 73 73 SER HA H 71 4.320 4.320 4.332 -0.012 17967
5002 1 13 . 1 1 73 73 SER CA C 71 60.130 60.130 60.653 -0.522 17967
5003 1 13 . 1 1 73 73 SER CB C 71 63.630 63.630 62.755 0.875 17967
5004 1 13 . 1 1 73 73 SER H H 71 7.870 7.870 8.475 -0.605 17967
5005 1 13 . 1 1 74 74 LYS N N 72 122.810 122.810 122.921 -0.111 17967
5006 1 13 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.136 0.134 17967
5007 1 13 . 1 1 74 74 LYS CA C 72 56.930 56.930 58.273 -1.343 17967
5008 1 13 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.335 0.295 17967
5009 1 13 . 1 1 74 74 LYS H H 72 7.800 7.800 7.927 -0.127 17967
5010 1 13 . 1 1 75 75 ILE N N 73 121.610 121.610 118.063 3.547 17967
5011 1 13 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.005 0.105 17967
5012 1 13 . 1 1 75 75 ILE CA C 73 61.830 61.830 64.702 -2.872 17967
5013 1 13 . 1 1 75 75 ILE CB C 73 38.630 38.630 38.232 0.398 17967
5014 1 13 . 1 1 75 75 ILE H H 73 7.750 7.750 7.772 -0.022 17967
5015 1 13 . 1 1 76 76 SER N N 74 120.410 120.410 111.920 8.490 17967
5016 1 13 . 1 1 76 76 SER HA H 74 4.300 4.300 3.926 0.374 17967
5017 1 13 . 1 1 76 76 SER CA C 74 59.330 59.330 61.280 -1.950 17967
5018 1 13 . 1 1 76 76 SER CB C 74 63.830 63.830 61.265 2.565 17967
5019 1 13 . 1 1 76 76 SER H H 74 8.130 8.130 8.693 -0.563 17967
5020 1 13 . 1 1 77 77 GLU N N 75 123.810 123.810 122.664 1.146 17967
5021 1 13 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.319 -0.129 17967
5022 1 13 . 1 1 77 77 GLU CA C 75 57.330 57.330 57.256 0.074 17967
5023 1 13 . 1 1 77 77 GLU CB C 75 30.130 30.130 31.073 -0.943 17967
5024 1 13 . 1 1 77 77 GLU H H 75 8.270 8.270 8.127 0.143 17967
5025 1 13 . 1 1 78 78 TYR N N 76 122.410 122.410 119.609 2.801 17967
5026 1 13 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.704 -0.244 17967
5027 1 13 . 1 1 78 78 TYR CA C 76 58.130 58.130 58.905 -0.775 17967
5028 1 13 . 1 1 78 78 TYR CB C 76 38.630 38.630 39.340 -0.710 17967
5029 1 13 . 1 1 78 78 TYR H H 76 7.980 7.980 7.739 0.241 17967
5030 1 13 . 1 1 79 79 ARG N N 77 124.710 124.710 127.501 -2.791 17967
5031 1 13 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.575 -0.375 17967
5032 1 13 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.405 0.625 17967
5033 1 13 . 1 1 79 79 ARG CB C 77 31.030 31.030 32.242 -1.212 17967
5034 1 13 . 1 1 79 79 ARG H H 77 7.880 7.880 8.421 -0.541 17967
5035 1 13 . 1 1 80 80 HIS N N 78 122.110 122.110 118.351 3.759 17967
5036 1 13 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.646 -0.136 17967
5037 1 13 . 1 1 80 80 HIS CA C 78 56.330 56.330 54.922 1.408 17967
5038 1 13 . 1 1 80 80 HIS CB C 78 30.830 30.830 29.897 0.933 17967
5039 1 13 . 1 1 80 80 HIS H H 78 8.120 8.120 8.295 -0.175 17967
5040 1 13 . 1 1 81 81 TYR N N 79 123.610 123.610 120.481 3.129 17967
5041 1 13 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.472 0.118 17967
5042 1 13 . 1 1 81 81 TYR CA C 79 57.830 57.830 58.248 -0.417 17967
5043 1 13 . 1 1 81 81 TYR CB C 79 39.130 39.130 38.480 0.650 17967
5044 1 13 . 1 1 81 81 TYR H H 79 7.970 7.970 7.851 0.119 17967
5045 1 14 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.354 -0.064 17967
5046 1 14 . 1 1 2 2 ALA CA C 0 52.530 52.530 51.585 0.945 17967
5047 1 14 . 1 1 2 2 ALA CB C 0 19.730 19.730 20.696 -0.966 17967
5048 1 14 . 1 1 3 3 MET N N 1 122.210 122.210 118.475 3.735 17967
5049 1 14 . 1 1 3 3 MET HA H 1 4.300 4.300 4.531 -0.231 17967
5050 1 14 . 1 1 3 3 MET CA C 1 56.030 56.030 55.092 0.938 17967
5051 1 14 . 1 1 3 3 MET CB C 1 33.430 33.430 32.916 0.513 17967
5052 1 14 . 1 1 3 3 MET H H 1 8.370 8.370 8.061 0.309 17967
5053 1 14 . 1 1 4 4 PHE N N 2 122.310 122.310 122.407 -0.097 17967
5054 1 14 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.989 -0.359 17967
5055 1 14 . 1 1 4 4 PHE CA C 2 57.330 57.330 55.597 1.733 17967
5056 1 14 . 1 1 4 4 PHE CB C 2 39.430 39.430 40.317 -0.887 17967
5057 1 14 . 1 1 4 4 PHE H H 2 8.370 8.370 8.258 0.112 17967
5058 1 14 . 1 1 5 5 GLN N N 3 123.510 123.510 122.584 0.926 17967
5059 1 14 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.562 -0.382 17967
5060 1 14 . 1 1 5 5 GLN CA C 3 56.130 56.130 55.097 1.033 17967
5061 1 14 . 1 1 5 5 GLN CB C 3 29.930 29.930 31.387 -1.457 17967
5062 1 14 . 1 1 5 5 GLN H H 3 8.260 8.260 9.802 -1.542 17967
5063 1 14 . 1 1 6 6 ASP N N 4 125.010 125.010 118.871 6.139 17967
5064 1 14 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.693 0.097 17967
5065 1 14 . 1 1 6 6 ASP CA C 4 51.930 51.930 52.537 -0.607 17967
5066 1 14 . 1 1 6 6 ASP CB C 4 41.730 41.730 40.588 1.142 17967
5067 1 14 . 1 1 6 6 ASP H H 4 8.420 8.420 8.454 -0.034 17967
5068 1 14 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.381 -0.261 17967
5069 1 14 . 1 1 7 7 PRO CA C 5 64.030 64.030 64.175 -0.145 17967
5070 1 14 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.416 -0.086 17967
5071 1 14 . 1 1 8 8 GLN N N 6 119.710 119.710 117.542 2.168 17967
5072 1 14 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.325 -0.165 17967
5073 1 14 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.156 1.474 17967
5074 1 14 . 1 1 8 8 GLN CB C 6 29.330 29.330 28.127 1.203 17967
5075 1 14 . 1 1 8 8 GLN H H 6 8.430 8.430 8.045 0.385 17967
5076 1 14 . 1 1 9 9 GLU N N 7 122.110 122.110 122.057 0.053 17967
5077 1 14 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.066 0.134 17967
5078 1 14 . 1 1 9 9 GLU CA C 7 56.030 56.030 57.728 -1.698 17967
5079 1 14 . 1 1 9 9 GLU CB C 7 30.530 30.530 30.412 0.118 17967
5080 1 14 . 1 1 9 9 GLU H H 7 7.940 7.940 7.830 0.110 17967
5081 1 14 . 1 1 10 10 ARG N N 8 123.410 123.410 116.391 7.019 17967
5082 1 14 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.348 0.052 17967
5083 1 14 . 1 1 10 10 ARG CA C 8 54.130 54.130 51.535 2.595 17967
5084 1 14 . 1 1 10 10 ARG CB C 8 29.330 29.330 30.311 -0.981 17967
5085 1 14 . 1 1 10 10 ARG H H 8 7.660 7.660 7.611 0.049 17967
5086 1 14 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.483 -0.133 17967
5087 1 14 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.691 0.839 17967
5088 1 14 . 1 1 11 11 PRO CB C 9 32.630 32.630 33.161 -0.531 17967
5089 1 14 . 1 1 12 12 ARG N N 10 123.810 123.810 115.693 8.117 17967
5090 1 14 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.812 -0.142 17967
5091 1 14 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.751 1.079 17967
5092 1 14 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.747 0.782 17967
5093 1 14 . 1 1 12 12 ARG H H 10 8.710 8.710 8.616 0.094 17967
5094 1 14 . 1 1 13 13 LYS N N 11 118.410 118.410 118.619 -0.209 17967
5095 1 14 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.758 0.292 17967
5096 1 14 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.646 -1.316 17967
5097 1 14 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.891 0.539 17967
5098 1 14 . 1 1 13 13 LYS H H 11 7.800 7.800 7.564 0.236 17967
5099 1 14 . 1 1 14 14 LEU N N 12 125.010 125.010 125.798 -0.788 17967
5100 1 14 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.232 -0.062 17967
5101 1 14 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.600 0.130 17967
5102 1 14 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.811 0.719 17967
5103 1 14 . 1 1 14 14 LEU H H 12 10.210 10.210 9.298 0.912 17967
5104 1 14 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.276 -0.056 17967
5105 1 14 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.474 1.756 17967
5106 1 14 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.227 -0.497 17967
5107 1 14 . 1 1 16 16 GLN N N 14 117.810 117.810 117.840 -0.030 17967
5108 1 14 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.117 0.073 17967
5109 1 14 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.962 0.068 17967
5110 1 14 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.455 0.175 17967
5111 1 14 . 1 1 16 16 GLN H H 14 7.110 7.110 8.245 -1.135 17967
5112 1 14 . 1 1 17 17 LEU N N 15 124.710 124.710 121.842 2.868 17967
5113 1 14 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.115 -0.105 17967
5114 1 14 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.684 0.646 17967
5115 1 14 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.786 0.244 17967
5116 1 14 . 1 1 17 17 LEU H H 15 8.010 8.010 8.167 -0.157 17967
5117 1 14 . 1 1 18 18 CYS N N 16 117.210 117.210 116.552 0.658 17967
5118 1 14 . 1 1 18 18 CYS HA H 16 3.750 3.750 4.057 -0.307 17967
5119 1 14 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.877 0.853 17967
5120 1 14 . 1 1 18 18 CYS CB C 16 26.230 26.230 25.935 0.295 17967
5121 1 14 . 1 1 18 18 CYS H H 16 8.380 8.380 8.320 0.060 17967
5122 1 14 . 1 1 19 19 THR N N 17 117.810 117.810 115.596 2.214 17967
5123 1 14 . 1 1 19 19 THR HA H 17 4.000 4.000 4.038 -0.038 17967
5124 1 14 . 1 1 19 19 THR CA C 17 66.830 66.830 67.497 -0.667 17967
5125 1 14 . 1 1 19 19 THR CB C 17 68.830 68.830 68.461 0.369 17967
5126 1 14 . 1 1 19 19 THR H H 17 7.720 7.720 7.605 0.115 17967
5127 1 14 . 1 1 20 20 GLU N N 18 125.410 125.410 121.092 4.318 17967
5128 1 14 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.110 -0.040 17967
5129 1 14 . 1 1 20 20 GLU CA C 18 59.730 59.730 59.292 0.438 17967
5130 1 14 . 1 1 20 20 GLU CB C 18 29.730 29.730 28.846 0.884 17967
5131 1 14 . 1 1 20 20 GLU H H 18 8.010 8.010 7.772 0.238 17967
5132 1 14 . 1 1 21 21 LEU N N 19 118.810 118.810 116.751 2.059 17967
5133 1 14 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.444 -0.144 17967
5134 1 14 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.130 -0.300 17967
5135 1 14 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.796 0.534 17967
5136 1 14 . 1 1 21 21 LEU H H 19 8.010 8.010 7.805 0.205 17967
5137 1 14 . 1 1 22 22 GLN N N 20 118.310 118.310 115.213 3.097 17967
5138 1 14 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.017 -0.067 17967
5139 1 14 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.040 -0.310 17967
5140 1 14 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.073 0.057 17967
5141 1 14 . 1 1 22 22 GLN H H 20 7.860 7.860 7.792 0.068 17967
5142 1 14 . 1 1 23 23 THR N N 21 115.910 115.910 111.186 4.724 17967
5143 1 14 . 1 1 23 23 THR HA H 21 4.950 4.950 4.563 0.387 17967
5144 1 14 . 1 1 23 23 THR CA C 21 58.530 58.530 59.806 -1.276 17967
5145 1 14 . 1 1 23 23 THR CB C 21 70.330 70.330 70.121 0.209 17967
5146 1 14 . 1 1 23 23 THR H H 21 8.250 8.250 8.416 -0.166 17967
5147 1 14 . 1 1 24 24 THR N N 22 112.810 112.810 114.131 -1.321 17967
5148 1 14 . 1 1 24 24 THR HA H 22 4.880 4.880 4.606 0.274 17967
5149 1 14 . 1 1 24 24 THR CA C 22 59.730 59.730 60.381 -0.651 17967
5150 1 14 . 1 1 24 24 THR CB C 22 74.130 74.130 71.290 2.840 17967
5151 1 14 . 1 1 24 24 THR H H 22 8.660 8.660 7.933 0.727 17967
5152 1 14 . 1 1 25 25 ILE N N 23 123.710 123.710 120.501 3.209 17967
5153 1 14 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.699 0.081 17967
5154 1 14 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.311 -0.881 17967
5155 1 14 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.804 0.826 17967
5156 1 14 . 1 1 25 25 ILE H H 23 9.060 9.060 8.288 0.772 17967
5157 1 14 . 1 1 26 26 HIS N N 24 119.510 119.510 113.639 5.871 17967
5158 1 14 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.670 -0.230 17967
5159 1 14 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.941 1.089 17967
5160 1 14 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.259 1.571 17967
5161 1 14 . 1 1 26 26 HIS H H 24 7.040 7.040 7.505 -0.465 17967
5162 1 14 . 1 1 27 27 ASP N N 25 116.810 116.810 118.391 -1.581 17967
5163 1 14 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.658 0.102 17967
5164 1 14 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.261 0.169 17967
5165 1 14 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.145 1.185 17967
5166 1 14 . 1 1 27 27 ASP H H 25 7.250 7.250 7.574 -0.324 17967
5167 1 14 . 1 1 28 28 ILE N N 26 123.210 123.210 122.243 0.967 17967
5168 1 14 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.869 0.061 17967
5169 1 14 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.615 0.414 17967
5170 1 14 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.735 -0.805 17967
5171 1 14 . 1 1 28 28 ILE H H 26 7.750 7.750 7.926 -0.176 17967
5172 1 14 . 1 1 29 29 ILE N N 27 131.110 131.110 129.246 1.864 17967
5173 1 14 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.105 0.275 17967
5174 1 14 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.972 -1.142 17967
5175 1 14 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.240 1.390 17967
5176 1 14 . 1 1 29 29 ILE H H 27 8.270 8.270 8.391 -0.121 17967
5177 1 14 . 1 1 30 30 LEU N N 28 129.410 129.410 129.390 0.020 17967
5178 1 14 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.683 -0.023 17967
5179 1 14 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.412 -0.882 17967
5180 1 14 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.678 2.652 17967
5181 1 14 . 1 1 30 30 LEU H H 28 8.500 8.500 8.292 0.208 17967
5182 1 14 . 1 1 31 31 GLU N N 29 121.910 121.910 120.649 1.261 17967
5183 1 14 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.807 -0.127 17967
5184 1 14 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.364 0.566 17967
5185 1 14 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.446 0.584 17967
5186 1 14 . 1 1 31 31 GLU H H 29 8.860 8.860 8.258 0.602 17967
5187 1 14 . 1 1 32 32 CYS N N 30 125.710 125.710 118.467 7.243 17967
5188 1 14 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.771 -0.751 17967
5189 1 14 . 1 1 32 32 CYS CA C 30 58.230 58.230 61.055 -2.825 17967
5190 1 14 . 1 1 32 32 CYS CB C 30 31.730 31.730 26.125 5.605 17967
5191 1 14 . 1 1 32 32 CYS H H 30 8.270 8.270 8.615 -0.345 17967
5192 1 14 . 1 1 33 33 VAL N N 31 132.310 132.310 125.551 6.759 17967
5193 1 14 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.070 0.030 17967
5194 1 14 . 1 1 33 33 VAL CA C 31 64.230 64.230 64.464 -0.234 17967
5195 1 14 . 1 1 33 33 VAL CB C 31 31.630 31.630 32.032 -0.402 17967
5196 1 14 . 1 1 33 33 VAL H H 31 8.860 8.860 7.679 1.181 17967
5197 1 14 . 1 1 34 34 TYR N N 32 124.310 124.310 115.685 8.625 17967
5198 1 14 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.515 -0.075 17967
5199 1 14 . 1 1 34 34 TYR CA C 32 61.030 61.030 60.244 0.786 17967
5200 1 14 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.123 2.007 17967
5201 1 14 . 1 1 34 34 TYR H H 32 8.590 8.590 7.046 1.544 17967
5202 1 14 . 1 1 35 35 CYS N N 33 119.810 119.810 116.280 3.530 17967
5203 1 14 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.370 0.470 17967
5204 1 14 . 1 1 35 35 CYS CA C 33 59.430 59.430 59.870 -0.440 17967
5205 1 14 . 1 1 35 35 CYS CB C 33 32.230 32.230 26.800 5.430 17967
5206 1 14 . 1 1 35 35 CYS H H 33 8.070 8.070 8.035 0.035 17967
5207 1 14 . 1 1 36 36 LYS N N 34 119.910 119.910 114.899 5.011 17967
5208 1 14 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.931 0.259 17967
5209 1 14 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.162 0.668 17967
5210 1 14 . 1 1 36 36 LYS CB C 34 29.330 29.330 29.621 -0.291 17967
5211 1 14 . 1 1 36 36 LYS H H 34 7.860 7.860 8.009 -0.149 17967
5212 1 14 . 1 1 37 37 GLN N N 35 120.710 120.710 116.834 3.876 17967
5213 1 14 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.549 -0.189 17967
5214 1 14 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.269 1.161 17967
5215 1 14 . 1 1 37 37 GLN CB C 35 29.630 29.630 30.940 -1.310 17967
5216 1 14 . 1 1 37 37 GLN H H 35 8.270 8.270 7.917 0.353 17967
5217 1 14 . 1 1 38 38 GLN N N 36 123.710 123.710 125.721 -2.011 17967
5218 1 14 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.216 0.084 17967
5219 1 14 . 1 1 38 38 GLN CA C 36 56.730 56.730 57.006 -0.276 17967
5220 1 14 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.928 0.402 17967
5221 1 14 . 1 1 38 38 GLN H H 36 8.640 8.640 8.576 0.064 17967
5222 1 14 . 1 1 39 39 LEU N N 37 131.310 131.310 126.366 4.944 17967
5223 1 14 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.196 -0.086 17967
5224 1 14 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.179 2.151 17967
5225 1 14 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.612 -0.682 17967
5226 1 14 . 1 1 39 39 LEU H H 37 8.870 8.870 7.767 1.103 17967
5227 1 14 . 1 1 40 40 LEU N N 38 126.310 126.310 123.681 2.629 17967
5228 1 14 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.335 -0.025 17967
5229 1 14 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.792 -0.562 17967
5230 1 14 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.072 0.058 17967
5231 1 14 . 1 1 40 40 LEU H H 38 9.850 9.850 8.332 1.518 17967
5232 1 14 . 1 1 41 41 ARG N N 39 127.110 127.110 125.750 1.360 17967
5233 1 14 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.741 -0.221 17967
5234 1 14 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.740 -1.910 17967
5235 1 14 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.729 -2.799 17967
5236 1 14 . 1 1 41 41 ARG H H 39 8.970 8.970 8.931 0.039 17967
5237 1 14 . 1 1 42 42 ARG N N 40 115.810 115.810 117.571 -1.761 17967
5238 1 14 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.296 -0.216 17967
5239 1 14 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.055 0.075 17967
5240 1 14 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.139 0.191 17967
5241 1 14 . 1 1 42 42 ARG H H 40 8.610 8.610 8.627 -0.017 17967
5242 1 14 . 1 1 43 43 GLU N N 41 119.910 119.910 119.202 0.708 17967
5243 1 14 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.627 -0.377 17967
5244 1 14 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.223 0.807 17967
5245 1 14 . 1 1 43 43 GLU CB C 41 30.330 30.330 28.959 1.371 17967
5246 1 14 . 1 1 43 43 GLU H H 41 6.950 6.950 7.917 -0.967 17967
5247 1 14 . 1 1 44 44 VAL N N 42 125.010 125.010 119.813 5.197 17967
5248 1 14 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.640 -0.400 17967
5249 1 14 . 1 1 44 44 VAL CA C 42 67.630 67.630 65.324 2.306 17967
5250 1 14 . 1 1 44 44 VAL CB C 42 31.330 31.330 30.775 0.555 17967
5251 1 14 . 1 1 44 44 VAL H H 42 7.820 7.820 8.026 -0.206 17967
5252 1 14 . 1 1 45 45 TYR N N 43 118.410 118.410 119.300 -0.890 17967
5253 1 14 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.181 0.249 17967
5254 1 14 . 1 1 45 45 TYR CA C 43 58.830 58.830 61.308 -2.478 17967
5255 1 14 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.301 -0.571 17967
5256 1 14 . 1 1 45 45 TYR H H 43 7.820 7.820 8.085 -0.265 17967
5257 1 14 . 1 1 46 46 ASP N N 44 122.410 122.410 120.349 2.061 17967
5258 1 14 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.326 0.274 17967
5259 1 14 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.802 0.028 17967
5260 1 14 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.255 0.775 17967
5261 1 14 . 1 1 46 46 ASP H H 44 8.540 8.540 7.973 0.567 17967
5262 1 14 . 1 1 47 47 PHE N N 45 126.210 126.210 119.703 6.507 17967
5263 1 14 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.031 -0.121 17967
5264 1 14 . 1 1 47 47 PHE CA C 45 62.630 62.630 62.205 0.425 17967
5265 1 14 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.063 0.267 17967
5266 1 14 . 1 1 47 47 PHE H H 45 8.320 8.320 7.770 0.550 17967
5267 1 14 . 1 1 48 48 ALA N N 46 119.110 119.110 119.911 -0.801 17967
5268 1 14 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.368 0.152 17967
5269 1 14 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.835 0.395 17967
5270 1 14 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.799 -0.070 17967
5271 1 14 . 1 1 48 48 ALA H H 46 7.740 7.740 7.702 0.038 17967
5272 1 14 . 1 1 49 49 ARG N N 47 124.010 124.010 117.730 6.280 17967
5273 1 14 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.300 -0.250 17967
5274 1 14 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.324 2.306 17967
5275 1 14 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.392 0.038 17967
5276 1 14 . 1 1 49 49 ARG H H 47 8.500 8.500 8.279 0.221 17967
5277 1 14 . 1 1 50 50 ARG N N 48 119.110 119.110 118.525 0.585 17967
5278 1 14 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.502 -0.492 17967
5279 1 14 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.762 2.368 17967
5280 1 14 . 1 1 50 50 ARG CB C 48 31.130 31.130 31.663 -0.533 17967
5281 1 14 . 1 1 50 50 ARG H H 48 7.940 7.940 7.955 -0.015 17967
5282 1 14 . 1 1 51 51 ASP N N 49 120.910 120.910 120.260 0.650 17967
5283 1 14 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.712 -0.292 17967
5284 1 14 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.787 0.743 17967
5285 1 14 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.891 -0.961 17967
5286 1 14 . 1 1 51 51 ASP H H 49 7.950 7.950 8.488 -0.538 17967
5287 1 14 . 1 1 52 52 LEU N N 50 118.410 118.410 123.127 -4.717 17967
5288 1 14 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.499 -0.349 17967
5289 1 14 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.550 0.680 17967
5290 1 14 . 1 1 52 52 LEU CB C 50 41.130 41.130 43.591 -2.461 17967
5291 1 14 . 1 1 52 52 LEU H H 50 6.640 6.640 7.581 -0.941 17967
5292 1 14 . 1 1 53 53 CYS N N 51 117.410 117.410 117.429 -0.019 17967
5293 1 14 . 1 1 53 53 CYS HA H 51 4.930 4.930 4.937 -0.007 17967
5294 1 14 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.629 2.301 17967
5295 1 14 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.724 -2.094 17967
5296 1 14 . 1 1 53 53 CYS H H 51 8.030 8.030 8.058 -0.028 17967
5297 1 14 . 1 1 54 54 ILE N N 52 125.110 125.110 122.302 2.808 17967
5298 1 14 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.363 -0.353 17967
5299 1 14 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.801 -2.171 17967
5300 1 14 . 1 1 54 54 ILE CB C 52 37.330 37.330 39.217 -1.887 17967
5301 1 14 . 1 1 54 54 ILE H H 52 8.500 8.500 8.827 -0.327 17967
5302 1 14 . 1 1 55 55 VAL N N 53 127.010 127.010 122.276 4.734 17967
5303 1 14 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.622 -0.252 17967
5304 1 14 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.652 -0.022 17967
5305 1 14 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.604 1.626 17967
5306 1 14 . 1 1 55 55 VAL H H 53 8.130 8.130 8.090 0.040 17967
5307 1 14 . 1 1 56 56 TYR N N 54 124.910 124.910 127.819 -2.909 17967
5308 1 14 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.266 0.134 17967
5309 1 14 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.468 -0.138 17967
5310 1 14 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.128 1.902 17967
5311 1 14 . 1 1 56 56 TYR H H 54 8.700 8.700 8.696 0.004 17967
5312 1 14 . 1 1 57 57 ARG N N 55 123.810 123.810 124.721 -0.911 17967
5313 1 14 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.229 0.411 17967
5314 1 14 . 1 1 57 57 ARG CA C 55 55.430 55.430 56.053 -0.623 17967
5315 1 14 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.379 2.451 17967
5316 1 14 . 1 1 57 57 ARG H H 55 8.870 8.870 8.309 0.561 17967
5317 1 14 . 1 1 58 58 ASP N N 56 129.110 129.110 125.592 3.518 17967
5318 1 14 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.206 0.104 17967
5319 1 14 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.722 -0.892 17967
5320 1 14 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.220 -0.090 17967
5321 1 14 . 1 1 58 58 ASP H H 56 9.620 9.620 8.957 0.663 17967
5322 1 14 . 1 1 59 59 GLY N N 57 104.510 104.510 107.321 -2.811 17967
5323 1 14 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.188 0.442 17967
5324 1 14 . 1 1 59 59 GLY H H 57 8.720 8.720 8.444 0.276 17967
5325 1 14 . 1 1 60 60 ASN N N 58 122.210 122.210 118.503 3.707 17967
5326 1 14 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.184 0.216 17967
5327 1 14 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.757 -0.427 17967
5328 1 14 . 1 1 60 60 ASN CB C 58 40.430 40.430 41.223 -0.793 17967
5329 1 14 . 1 1 60 60 ASN H H 58 8.120 8.120 7.871 0.249 17967
5330 1 14 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.694 0.096 17967
5331 1 14 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.529 -0.499 17967
5332 1 14 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.359 2.171 17967
5333 1 14 . 1 1 62 62 TYR N N 60 119.810 119.810 122.973 -3.163 17967
5334 1 14 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.570 -0.210 17967
5335 1 14 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.381 1.849 17967
5336 1 14 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.518 0.912 17967
5337 1 14 . 1 1 62 62 TYR H H 60 8.590 8.590 7.670 0.920 17967
5338 1 14 . 1 1 63 63 ALA N N 61 123.810 123.810 121.725 2.085 17967
5339 1 14 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.230 0.190 17967
5340 1 14 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.323 0.007 17967
5341 1 14 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.844 -0.514 17967
5342 1 14 . 1 1 63 63 ALA H H 61 8.010 8.010 8.824 -0.814 17967
5343 1 14 . 1 1 64 64 VAL N N 62 120.510 120.510 117.760 2.750 17967
5344 1 14 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.240 1.260 17967
5345 1 14 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.604 -0.374 17967
5346 1 14 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.408 2.922 17967
5347 1 14 . 1 1 64 64 VAL H H 62 6.380 6.380 8.383 -2.003 17967
5348 1 14 . 1 1 65 65 CYS N N 63 130.310 130.310 124.875 5.435 17967
5349 1 14 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.501 0.059 17967
5350 1 14 . 1 1 65 65 CYS CA C 63 58.430 58.430 57.861 0.569 17967
5351 1 14 . 1 1 65 65 CYS CB C 63 31.130 31.130 29.860 1.270 17967
5352 1 14 . 1 1 65 65 CYS H H 63 9.430 9.430 8.064 1.366 17967
5353 1 14 . 1 1 66 66 ASP N N 64 121.110 121.110 120.059 1.051 17967
5354 1 14 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.334 0.076 17967
5355 1 14 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.078 0.152 17967
5356 1 14 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.896 1.434 17967
5357 1 14 . 1 1 66 66 ASP H H 64 9.120 9.120 8.875 0.245 17967
5358 1 14 . 1 1 67 67 LYS N N 65 122.110 122.110 118.831 3.279 17967
5359 1 14 . 1 1 67 67 LYS HA H 65 4.010 4.010 4.354 -0.344 17967
5360 1 14 . 1 1 67 67 LYS CA C 65 60.130 60.130 57.889 2.241 17967
5361 1 14 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.043 0.787 17967
5362 1 14 . 1 1 67 67 LYS H H 65 8.330 8.330 7.702 0.628 17967
5363 1 14 . 1 1 68 68 CYS N N 66 125.610 125.610 119.925 5.685 17967
5364 1 14 . 1 1 68 68 CYS HA H 66 4.110 4.110 3.663 0.447 17967
5365 1 14 . 1 1 68 68 CYS CA C 66 63.530 63.530 63.102 0.428 17967
5366 1 14 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.163 4.567 17967
5367 1 14 . 1 1 68 68 CYS H H 66 8.700 8.700 7.862 0.838 17967
5368 1 14 . 1 1 69 69 LEU N N 67 125.310 125.310 119.435 5.875 17967
5369 1 14 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.092 -0.092 17967
5370 1 14 . 1 1 69 69 LEU CA C 67 58.530 58.530 57.906 0.624 17967
5371 1 14 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.662 0.468 17967
5372 1 14 . 1 1 69 69 LEU H H 67 8.470 8.470 8.604 -0.134 17967
5373 1 14 . 1 1 70 70 LYS N N 68 119.010 119.010 118.259 0.751 17967
5374 1 14 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.238 -0.258 17967
5375 1 14 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.405 0.425 17967
5376 1 14 . 1 1 70 70 LYS CB C 68 32.130 32.130 32.066 0.064 17967
5377 1 14 . 1 1 70 70 LYS H H 68 7.810 7.810 7.337 0.473 17967
5378 1 14 . 1 1 71 71 PHE N N 69 121.710 121.710 119.134 2.576 17967
5379 1 14 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.011 0.269 17967
5380 1 14 . 1 1 71 71 PHE CA C 69 59.930 59.930 60.927 -0.997 17967
5381 1 14 . 1 1 71 71 PHE CB C 69 39.430 39.430 39.426 0.004 17967
5382 1 14 . 1 1 71 71 PHE H H 69 7.810 7.810 7.655 0.155 17967
5383 1 14 . 1 1 72 72 TYR N N 70 120.110 120.110 116.214 3.896 17967
5384 1 14 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.789 -0.469 17967
5385 1 14 . 1 1 72 72 TYR CA C 70 60.330 60.330 57.245 3.085 17967
5386 1 14 . 1 1 72 72 TYR CB C 70 40.430 40.430 39.300 1.130 17967
5387 1 14 . 1 1 72 72 TYR H H 70 8.280 8.280 8.155 0.125 17967
5388 1 14 . 1 1 73 73 SER N N 71 117.210 117.210 120.068 -2.858 17967
5389 1 14 . 1 1 73 73 SER HA H 71 4.320 4.320 4.616 -0.296 17967
5390 1 14 . 1 1 73 73 SER CA C 71 60.130 60.130 60.210 -0.080 17967
5391 1 14 . 1 1 73 73 SER CB C 71 63.630 63.630 63.748 -0.118 17967
5392 1 14 . 1 1 73 73 SER H H 71 7.870 7.870 8.815 -0.945 17967
5393 1 14 . 1 1 74 74 LYS N N 72 122.810 122.810 122.570 0.240 17967
5394 1 14 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.379 -0.109 17967
5395 1 14 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.451 -0.521 17967
5396 1 14 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.781 -0.151 17967
5397 1 14 . 1 1 74 74 LYS H H 72 7.800 7.800 8.320 -0.520 17967
5398 1 14 . 1 1 75 75 ILE N N 73 121.610 121.610 121.618 -0.008 17967
5399 1 14 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.203 -0.093 17967
5400 1 14 . 1 1 75 75 ILE CA C 73 61.830 61.830 60.976 0.854 17967
5401 1 14 . 1 1 75 75 ILE CB C 73 38.630 38.630 36.578 2.052 17967
5402 1 14 . 1 1 75 75 ILE H H 73 7.750 7.750 8.176 -0.426 17967
5403 1 14 . 1 1 76 76 SER N N 74 120.410 120.410 116.270 4.140 17967
5404 1 14 . 1 1 76 76 SER HA H 74 4.300 4.300 4.517 -0.217 17967
5405 1 14 . 1 1 76 76 SER CA C 74 59.330 59.330 61.479 -2.149 17967
5406 1 14 . 1 1 76 76 SER CB C 74 63.830 63.830 63.782 0.048 17967
5407 1 14 . 1 1 76 76 SER H H 74 8.130 8.130 7.929 0.201 17967
5408 1 14 . 1 1 77 77 GLU N N 75 123.810 123.810 121.407 2.403 17967
5409 1 14 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.404 -0.214 17967
5410 1 14 . 1 1 77 77 GLU CA C 75 57.330 57.330 57.009 0.321 17967
5411 1 14 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.466 -0.336 17967
5412 1 14 . 1 1 77 77 GLU H H 75 8.270 8.270 8.239 0.031 17967
5413 1 14 . 1 1 78 78 TYR N N 76 122.410 122.410 119.282 3.128 17967
5414 1 14 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.355 0.105 17967
5415 1 14 . 1 1 78 78 TYR CA C 76 58.130 58.130 58.817 -0.687 17967
5416 1 14 . 1 1 78 78 TYR CB C 76 38.630 38.630 37.349 1.281 17967
5417 1 14 . 1 1 78 78 TYR H H 76 7.980 7.980 8.604 -0.624 17967
5418 1 14 . 1 1 79 79 ARG N N 77 124.710 124.710 124.662 0.048 17967
5419 1 14 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.866 -0.666 17967
5420 1 14 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.263 0.767 17967
5421 1 14 . 1 1 79 79 ARG CB C 77 31.030 31.030 30.234 0.796 17967
5422 1 14 . 1 1 79 79 ARG H H 77 7.880 7.880 8.784 -0.904 17967
5423 1 14 . 1 1 80 80 HIS N N 78 122.110 122.110 121.659 0.451 17967
5424 1 14 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.502 0.008 17967
5425 1 14 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.960 0.370 17967
5426 1 14 . 1 1 80 80 HIS CB C 78 30.830 30.830 29.866 0.963 17967
5427 1 14 . 1 1 80 80 HIS H H 78 8.120 8.120 8.421 -0.301 17967
5428 1 14 . 1 1 81 81 TYR N N 79 123.610 123.610 120.503 3.107 17967
5429 1 14 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.090 0.500 17967
5430 1 14 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.361 0.469 17967
5431 1 14 . 1 1 81 81 TYR CB C 79 39.130 39.130 37.287 1.843 17967
5432 1 14 . 1 1 81 81 TYR H H 79 7.970 7.970 7.197 0.773 17967
5433 1 15 . 1 1 2 2 ALA HA H 0 4.290 4.290 3.578 0.712 17967
5434 1 15 . 1 1 2 2 ALA CA C 0 52.530 52.530 53.028 -0.498 17967
5435 1 15 . 1 1 2 2 ALA CB C 0 19.730 19.730 18.012 1.718 17967
5436 1 15 . 1 1 3 3 MET N N 1 122.210 122.210 113.821 8.389 17967
5437 1 15 . 1 1 3 3 MET HA H 1 4.300 4.300 4.634 -0.334 17967
5438 1 15 . 1 1 3 3 MET CA C 1 56.030 56.030 54.545 1.485 17967
5439 1 15 . 1 1 3 3 MET CB C 1 33.430 33.430 31.543 1.887 17967
5440 1 15 . 1 1 3 3 MET H H 1 8.370 8.370 7.618 0.752 17967
5441 1 15 . 1 1 4 4 PHE N N 2 122.310 122.310 122.037 0.273 17967
5442 1 15 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.456 0.174 17967
5443 1 15 . 1 1 4 4 PHE CA C 2 57.330 57.330 56.613 0.717 17967
5444 1 15 . 1 1 4 4 PHE CB C 2 39.430 39.430 39.518 -0.088 17967
5445 1 15 . 1 1 4 4 PHE H H 2 8.370 8.370 7.693 0.677 17967
5446 1 15 . 1 1 5 5 GLN N N 3 123.510 123.510 121.054 2.456 17967
5447 1 15 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.570 -0.390 17967
5448 1 15 . 1 1 5 5 GLN CA C 3 56.130 56.130 54.280 1.850 17967
5449 1 15 . 1 1 5 5 GLN CB C 3 29.930 29.930 30.419 -0.489 17967
5450 1 15 . 1 1 5 5 GLN H H 3 8.260 8.260 8.202 0.058 17967
5451 1 15 . 1 1 6 6 ASP N N 4 125.010 125.010 118.438 6.572 17967
5452 1 15 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.471 0.319 17967
5453 1 15 . 1 1 6 6 ASP CA C 4 51.930 51.930 53.769 -1.839 17967
5454 1 15 . 1 1 6 6 ASP CB C 4 41.730 41.730 40.884 0.846 17967
5455 1 15 . 1 1 6 6 ASP H H 4 8.420 8.420 8.515 -0.095 17967
5456 1 15 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.573 -0.453 17967
5457 1 15 . 1 1 7 7 PRO CA C 5 64.030 64.030 64.143 -0.113 17967
5458 1 15 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.477 -0.147 17967
5459 1 15 . 1 1 8 8 GLN N N 6 119.710 119.710 117.683 2.027 17967
5460 1 15 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.399 -0.239 17967
5461 1 15 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.163 1.467 17967
5462 1 15 . 1 1 8 8 GLN CB C 6 29.330 29.330 28.752 0.578 17967
5463 1 15 . 1 1 8 8 GLN H H 6 8.430 8.430 8.222 0.208 17967
5464 1 15 . 1 1 9 9 GLU N N 7 122.110 122.110 119.217 2.893 17967
5465 1 15 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.086 0.114 17967
5466 1 15 . 1 1 9 9 GLU CA C 7 56.030 56.030 57.468 -1.438 17967
5467 1 15 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.730 0.800 17967
5468 1 15 . 1 1 9 9 GLU H H 7 7.940 7.940 8.376 -0.436 17967
5469 1 15 . 1 1 10 10 ARG N N 8 123.410 123.410 119.981 3.429 17967
5470 1 15 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.486 -0.086 17967
5471 1 15 . 1 1 10 10 ARG CA C 8 54.130 54.130 54.260 -0.130 17967
5472 1 15 . 1 1 10 10 ARG CB C 8 29.330 29.330 29.638 -0.308 17967
5473 1 15 . 1 1 10 10 ARG H H 8 7.660 7.660 7.883 -0.223 17967
5474 1 15 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.553 -0.203 17967
5475 1 15 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.656 0.874 17967
5476 1 15 . 1 1 11 11 PRO CB C 9 32.630 32.630 33.098 -0.468 17967
5477 1 15 . 1 1 12 12 ARG N N 10 123.810 123.810 115.289 8.521 17967
5478 1 15 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.712 -0.042 17967
5479 1 15 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.433 1.397 17967
5480 1 15 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.450 1.080 17967
5481 1 15 . 1 1 12 12 ARG H H 10 8.710 8.710 8.584 0.126 17967
5482 1 15 . 1 1 13 13 LYS N N 11 118.410 118.410 119.248 -0.838 17967
5483 1 15 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.857 0.193 17967
5484 1 15 . 1 1 13 13 LYS CA C 11 53.330 53.330 53.826 -0.496 17967
5485 1 15 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.532 0.898 17967
5486 1 15 . 1 1 13 13 LYS H H 11 7.800 7.800 7.583 0.217 17967
5487 1 15 . 1 1 14 14 LEU N N 12 125.010 125.010 126.090 -1.080 17967
5488 1 15 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.191 -0.021 17967
5489 1 15 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.516 0.214 17967
5490 1 15 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.956 0.573 17967
5491 1 15 . 1 1 14 14 LEU H H 12 10.210 10.210 9.221 0.989 17967
5492 1 15 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.269 -0.049 17967
5493 1 15 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.660 1.570 17967
5494 1 15 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.117 -0.387 17967
5495 1 15 . 1 1 16 16 GLN N N 14 117.810 117.810 116.931 0.879 17967
5496 1 15 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.163 0.027 17967
5497 1 15 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.625 0.405 17967
5498 1 15 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.333 0.297 17967
5499 1 15 . 1 1 16 16 GLN H H 14 7.110 7.110 8.349 -1.239 17967
5500 1 15 . 1 1 17 17 LEU N N 15 124.710 124.710 122.397 2.313 17967
5501 1 15 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.214 -0.204 17967
5502 1 15 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.606 0.724 17967
5503 1 15 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.755 0.275 17967
5504 1 15 . 1 1 17 17 LEU H H 15 8.010 8.010 8.108 -0.098 17967
5505 1 15 . 1 1 18 18 CYS N N 16 117.210 117.210 116.963 0.247 17967
5506 1 15 . 1 1 18 18 CYS HA H 16 3.750 3.750 4.019 -0.269 17967
5507 1 15 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.839 0.891 17967
5508 1 15 . 1 1 18 18 CYS CB C 16 26.230 26.230 25.997 0.233 17967
5509 1 15 . 1 1 18 18 CYS H H 16 8.380 8.380 8.446 -0.066 17967
5510 1 15 . 1 1 19 19 THR N N 17 117.810 117.810 115.208 2.602 17967
5511 1 15 . 1 1 19 19 THR HA H 17 4.000 4.000 4.063 -0.063 17967
5512 1 15 . 1 1 19 19 THR CA C 17 66.830 66.830 67.111 -0.281 17967
5513 1 15 . 1 1 19 19 THR CB C 17 68.830 68.830 68.522 0.308 17967
5514 1 15 . 1 1 19 19 THR H H 17 7.720 7.720 7.698 0.022 17967
5515 1 15 . 1 1 20 20 GLU N N 18 125.410 125.410 120.670 4.740 17967
5516 1 15 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.206 -0.136 17967
5517 1 15 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.588 1.142 17967
5518 1 15 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.662 0.068 17967
5519 1 15 . 1 1 20 20 GLU H H 18 8.010 8.010 7.879 0.131 17967
5520 1 15 . 1 1 21 21 LEU N N 19 118.810 118.810 117.829 0.981 17967
5521 1 15 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.450 -0.150 17967
5522 1 15 . 1 1 21 21 LEU CA C 19 54.830 54.830 56.024 -1.194 17967
5523 1 15 . 1 1 21 21 LEU CB C 19 42.330 42.330 42.381 -0.051 17967
5524 1 15 . 1 1 21 21 LEU H H 19 8.010 8.010 8.142 -0.132 17967
5525 1 15 . 1 1 22 22 GLN N N 20 118.310 118.310 113.376 4.934 17967
5526 1 15 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.055 -0.105 17967
5527 1 15 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.226 -0.496 17967
5528 1 15 . 1 1 22 22 GLN CB C 20 26.130 26.130 25.991 0.139 17967
5529 1 15 . 1 1 22 22 GLN H H 20 7.860 7.860 7.973 -0.113 17967
5530 1 15 . 1 1 23 23 THR N N 21 115.910 115.910 112.612 3.298 17967
5531 1 15 . 1 1 23 23 THR HA H 21 4.950 4.950 4.572 0.378 17967
5532 1 15 . 1 1 23 23 THR CA C 21 58.530 58.530 60.261 -1.731 17967
5533 1 15 . 1 1 23 23 THR CB C 21 70.330 70.330 70.757 -0.427 17967
5534 1 15 . 1 1 23 23 THR H H 21 8.250 8.250 8.279 -0.029 17967
5535 1 15 . 1 1 24 24 THR N N 22 112.810 112.810 113.921 -1.111 17967
5536 1 15 . 1 1 24 24 THR HA H 22 4.880 4.880 4.622 0.258 17967
5537 1 15 . 1 1 24 24 THR CA C 22 59.730 59.730 60.087 -0.357 17967
5538 1 15 . 1 1 24 24 THR CB C 22 74.130 74.130 71.118 3.013 17967
5539 1 15 . 1 1 24 24 THR H H 22 8.660 8.660 7.832 0.828 17967
5540 1 15 . 1 1 25 25 ILE N N 23 123.710 123.710 120.264 3.446 17967
5541 1 15 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.729 0.051 17967
5542 1 15 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.070 -0.640 17967
5543 1 15 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.887 0.743 17967
5544 1 15 . 1 1 25 25 ILE H H 23 9.060 9.060 8.151 0.909 17967
5545 1 15 . 1 1 26 26 HIS N N 24 119.510 119.510 114.275 5.235 17967
5546 1 15 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.827 -0.387 17967
5547 1 15 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.451 1.579 17967
5548 1 15 . 1 1 26 26 HIS CB C 24 30.830 30.830 28.844 1.986 17967
5549 1 15 . 1 1 26 26 HIS H H 24 7.040 7.040 7.571 -0.531 17967
5550 1 15 . 1 1 27 27 ASP N N 25 116.810 116.810 119.321 -2.511 17967
5551 1 15 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.677 0.083 17967
5552 1 15 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.240 0.190 17967
5553 1 15 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.227 1.103 17967
5554 1 15 . 1 1 27 27 ASP H H 25 7.250 7.250 7.642 -0.392 17967
5555 1 15 . 1 1 28 28 ILE N N 26 123.210 123.210 121.468 1.742 17967
5556 1 15 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.855 0.075 17967
5557 1 15 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.497 0.533 17967
5558 1 15 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.672 -0.742 17967
5559 1 15 . 1 1 28 28 ILE H H 26 7.750 7.750 7.738 0.012 17967
5560 1 15 . 1 1 29 29 ILE N N 27 131.110 131.110 129.256 1.854 17967
5561 1 15 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.069 0.311 17967
5562 1 15 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.884 -1.054 17967
5563 1 15 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.703 0.927 17967
5564 1 15 . 1 1 29 29 ILE H H 27 8.270 8.270 8.295 -0.025 17967
5565 1 15 . 1 1 30 30 LEU N N 28 129.410 129.410 127.942 1.468 17967
5566 1 15 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.621 0.039 17967
5567 1 15 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.043 -0.513 17967
5568 1 15 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.727 2.603 17967
5569 1 15 . 1 1 30 30 LEU H H 28 8.500 8.500 8.306 0.194 17967
5570 1 15 . 1 1 31 31 GLU N N 29 121.910 121.910 120.910 1.000 17967
5571 1 15 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.726 -0.046 17967
5572 1 15 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.308 0.622 17967
5573 1 15 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.387 0.643 17967
5574 1 15 . 1 1 31 31 GLU H H 29 8.860 8.860 8.230 0.630 17967
5575 1 15 . 1 1 32 32 CYS N N 30 125.710 125.710 120.488 5.222 17967
5576 1 15 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.808 -0.788 17967
5577 1 15 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.200 -0.970 17967
5578 1 15 . 1 1 32 32 CYS CB C 30 31.730 31.730 26.908 4.822 17967
5579 1 15 . 1 1 32 32 CYS H H 30 8.270 8.270 8.387 -0.117 17967
5580 1 15 . 1 1 33 33 VAL N N 31 132.310 132.310 128.865 3.445 17967
5581 1 15 . 1 1 33 33 VAL HA H 31 3.100 3.100 2.993 0.107 17967
5582 1 15 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.878 -1.648 17967
5583 1 15 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.703 -0.073 17967
5584 1 15 . 1 1 33 33 VAL H H 31 8.860 8.860 7.931 0.929 17967
5585 1 15 . 1 1 34 34 TYR N N 32 124.310 124.310 114.378 9.932 17967
5586 1 15 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.494 -0.054 17967
5587 1 15 . 1 1 34 34 TYR CA C 32 61.030 61.030 59.474 1.556 17967
5588 1 15 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.411 1.719 17967
5589 1 15 . 1 1 34 34 TYR H H 32 8.590 8.590 7.138 1.452 17967
5590 1 15 . 1 1 35 35 CYS N N 33 119.810 119.810 115.796 4.014 17967
5591 1 15 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.689 0.151 17967
5592 1 15 . 1 1 35 35 CYS CA C 33 59.430 59.430 58.120 1.310 17967
5593 1 15 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.313 3.917 17967
5594 1 15 . 1 1 35 35 CYS H H 33 8.070 8.070 7.527 0.543 17967
5595 1 15 . 1 1 36 36 LYS N N 34 119.910 119.910 116.813 3.097 17967
5596 1 15 . 1 1 36 36 LYS HA H 34 4.190 4.190 4.053 0.137 17967
5597 1 15 . 1 1 36 36 LYS CA C 34 57.830 57.830 56.629 1.202 17967
5598 1 15 . 1 1 36 36 LYS CB C 34 29.330 29.330 30.366 -1.036 17967
5599 1 15 . 1 1 36 36 LYS H H 34 7.860 7.860 7.840 0.020 17967
5600 1 15 . 1 1 37 37 GLN N N 35 120.710 120.710 117.644 3.066 17967
5601 1 15 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.341 0.019 17967
5602 1 15 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.538 0.893 17967
5603 1 15 . 1 1 37 37 GLN CB C 35 29.630 29.630 28.647 0.983 17967
5604 1 15 . 1 1 37 37 GLN H H 35 8.270 8.270 7.933 0.337 17967
5605 1 15 . 1 1 38 38 GLN N N 36 123.710 123.710 127.350 -3.640 17967
5606 1 15 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.005 0.295 17967
5607 1 15 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.578 0.152 17967
5608 1 15 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.931 0.399 17967
5609 1 15 . 1 1 38 38 GLN H H 36 8.640 8.640 8.600 0.040 17967
5610 1 15 . 1 1 39 39 LEU N N 37 131.310 131.310 127.895 3.415 17967
5611 1 15 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.127 -0.017 17967
5612 1 15 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.777 1.553 17967
5613 1 15 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.416 -0.486 17967
5614 1 15 . 1 1 39 39 LEU H H 37 8.870 8.870 7.769 1.101 17967
5615 1 15 . 1 1 40 40 LEU N N 38 126.310 126.310 124.842 1.468 17967
5616 1 15 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.299 0.011 17967
5617 1 15 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.911 -0.681 17967
5618 1 15 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.095 0.035 17967
5619 1 15 . 1 1 40 40 LEU H H 38 9.850 9.850 8.545 1.305 17967
5620 1 15 . 1 1 41 41 ARG N N 39 127.110 127.110 126.238 0.872 17967
5621 1 15 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.753 -0.233 17967
5622 1 15 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.994 -2.164 17967
5623 1 15 . 1 1 41 41 ARG CB C 39 26.930 26.930 30.029 -3.099 17967
5624 1 15 . 1 1 41 41 ARG H H 39 8.970 8.970 8.878 0.092 17967
5625 1 15 . 1 1 42 42 ARG N N 40 115.810 115.810 118.303 -2.493 17967
5626 1 15 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.293 -0.213 17967
5627 1 15 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.778 -0.648 17967
5628 1 15 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.820 -0.490 17967
5629 1 15 . 1 1 42 42 ARG H H 40 8.610 8.610 8.721 -0.111 17967
5630 1 15 . 1 1 43 43 GLU N N 41 119.910 119.910 119.056 0.854 17967
5631 1 15 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.534 -0.284 17967
5632 1 15 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.533 0.497 17967
5633 1 15 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.054 1.276 17967
5634 1 15 . 1 1 43 43 GLU H H 41 6.950 6.950 7.884 -0.934 17967
5635 1 15 . 1 1 44 44 VAL N N 42 125.010 125.010 120.119 4.891 17967
5636 1 15 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.606 -0.366 17967
5637 1 15 . 1 1 44 44 VAL CA C 42 67.630 67.630 65.589 2.041 17967
5638 1 15 . 1 1 44 44 VAL CB C 42 31.330 31.330 30.878 0.452 17967
5639 1 15 . 1 1 44 44 VAL H H 42 7.820 7.820 8.171 -0.351 17967
5640 1 15 . 1 1 45 45 TYR N N 43 118.410 118.410 118.489 -0.079 17967
5641 1 15 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.156 0.274 17967
5642 1 15 . 1 1 45 45 TYR CA C 43 58.830 58.830 61.359 -2.529 17967
5643 1 15 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.444 -0.715 17967
5644 1 15 . 1 1 45 45 TYR H H 43 7.820 7.820 8.164 -0.344 17967
5645 1 15 . 1 1 46 46 ASP N N 44 122.410 122.410 119.786 2.624 17967
5646 1 15 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.346 0.254 17967
5647 1 15 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.839 -0.009 17967
5648 1 15 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.288 0.742 17967
5649 1 15 . 1 1 46 46 ASP H H 44 8.540 8.540 8.001 0.539 17967
5650 1 15 . 1 1 47 47 PHE N N 45 126.210 126.210 119.662 6.548 17967
5651 1 15 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.149 -0.239 17967
5652 1 15 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.836 0.794 17967
5653 1 15 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.107 0.223 17967
5654 1 15 . 1 1 47 47 PHE H H 45 8.320 8.320 7.810 0.510 17967
5655 1 15 . 1 1 48 48 ALA N N 46 119.110 119.110 119.643 -0.533 17967
5656 1 15 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.325 0.195 17967
5657 1 15 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.980 0.250 17967
5658 1 15 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.671 0.059 17967
5659 1 15 . 1 1 48 48 ALA H H 46 7.740 7.740 7.778 -0.038 17967
5660 1 15 . 1 1 49 49 ARG N N 47 124.010 124.010 118.290 5.720 17967
5661 1 15 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.283 -0.233 17967
5662 1 15 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.583 2.047 17967
5663 1 15 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.560 -0.130 17967
5664 1 15 . 1 1 49 49 ARG H H 47 8.500 8.500 8.462 0.038 17967
5665 1 15 . 1 1 50 50 ARG N N 48 119.110 119.110 117.313 1.797 17967
5666 1 15 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.539 -0.529 17967
5667 1 15 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.248 2.882 17967
5668 1 15 . 1 1 50 50 ARG CB C 48 31.130 31.130 32.071 -0.941 17967
5669 1 15 . 1 1 50 50 ARG H H 48 7.940 7.940 7.929 0.011 17967
5670 1 15 . 1 1 51 51 ASP N N 49 120.910 120.910 120.114 0.796 17967
5671 1 15 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.767 -0.347 17967
5672 1 15 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.861 0.669 17967
5673 1 15 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.769 -0.839 17967
5674 1 15 . 1 1 51 51 ASP H H 49 7.950 7.950 8.370 -0.420 17967
5675 1 15 . 1 1 52 52 LEU N N 50 118.410 118.410 122.528 -4.118 17967
5676 1 15 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.602 -0.452 17967
5677 1 15 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.354 0.876 17967
5678 1 15 . 1 1 52 52 LEU CB C 50 41.130 41.130 44.307 -3.177 17967
5679 1 15 . 1 1 52 52 LEU H H 50 6.640 6.640 7.450 -0.810 17967
5680 1 15 . 1 1 53 53 CYS N N 51 117.410 117.410 118.357 -0.947 17967
5681 1 15 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.613 -0.683 17967
5682 1 15 . 1 1 53 53 CYS CA C 51 58.930 58.930 55.603 3.327 17967
5683 1 15 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.305 -1.675 17967
5684 1 15 . 1 1 53 53 CYS H H 51 8.030 8.030 8.107 -0.077 17967
5685 1 15 . 1 1 54 54 ILE N N 52 125.110 125.110 123.138 1.972 17967
5686 1 15 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.345 -0.335 17967
5687 1 15 . 1 1 54 54 ILE CA C 52 59.630 59.630 62.055 -2.425 17967
5688 1 15 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.816 -1.486 17967
5689 1 15 . 1 1 54 54 ILE H H 52 8.500 8.500 8.762 -0.262 17967
5690 1 15 . 1 1 55 55 VAL N N 53 127.010 127.010 123.046 3.964 17967
5691 1 15 . 1 1 55 55 VAL HA H 53 4.370 4.370 5.115 -0.745 17967
5692 1 15 . 1 1 55 55 VAL CA C 53 60.630 60.630 59.679 0.951 17967
5693 1 15 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.528 1.702 17967
5694 1 15 . 1 1 55 55 VAL H H 53 8.130 8.130 8.221 -0.091 17967
5695 1 15 . 1 1 56 56 TYR N N 54 124.910 124.910 127.837 -2.927 17967
5696 1 15 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.343 0.057 17967
5697 1 15 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.623 -0.293 17967
5698 1 15 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.705 1.325 17967
5699 1 15 . 1 1 56 56 TYR H H 54 8.700 8.700 8.759 -0.059 17967
5700 1 15 . 1 1 57 57 ARG N N 55 123.810 123.810 125.636 -1.826 17967
5701 1 15 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.427 0.213 17967
5702 1 15 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.953 -0.523 17967
5703 1 15 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.110 2.720 17967
5704 1 15 . 1 1 57 57 ARG H H 55 8.870 8.870 8.476 0.394 17967
5705 1 15 . 1 1 58 58 ASP N N 56 129.110 129.110 125.788 3.322 17967
5706 1 15 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.421 -0.111 17967
5707 1 15 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.668 -0.838 17967
5708 1 15 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.465 -0.335 17967
5709 1 15 . 1 1 58 58 ASP H H 56 9.620 9.620 9.001 0.619 17967
5710 1 15 . 1 1 59 59 GLY N N 57 104.510 104.510 106.242 -1.732 17967
5711 1 15 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.498 0.132 17967
5712 1 15 . 1 1 59 59 GLY H H 57 8.720 8.720 8.594 0.126 17967
5713 1 15 . 1 1 60 60 ASN N N 58 122.210 122.210 118.252 3.958 17967
5714 1 15 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.205 0.195 17967
5715 1 15 . 1 1 60 60 ASN CA C 58 50.330 50.330 51.121 -0.791 17967
5716 1 15 . 1 1 60 60 ASN CB C 58 40.430 40.430 41.281 -0.851 17967
5717 1 15 . 1 1 60 60 ASN H H 58 8.120 8.120 7.830 0.290 17967
5718 1 15 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.630 0.160 17967
5719 1 15 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.440 -0.410 17967
5720 1 15 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.222 2.308 17967
5721 1 15 . 1 1 62 62 TYR N N 60 119.810 119.810 122.152 -2.342 17967
5722 1 15 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.480 -0.120 17967
5723 1 15 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.478 1.752 17967
5724 1 15 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.511 0.919 17967
5725 1 15 . 1 1 62 62 TYR H H 60 8.590 8.590 7.648 0.942 17967
5726 1 15 . 1 1 63 63 ALA N N 61 123.810 123.810 121.738 2.072 17967
5727 1 15 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.215 0.205 17967
5728 1 15 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.319 0.011 17967
5729 1 15 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.612 -0.282 17967
5730 1 15 . 1 1 63 63 ALA H H 61 8.010 8.010 8.721 -0.711 17967
5731 1 15 . 1 1 64 64 VAL N N 62 120.510 120.510 118.309 2.201 17967
5732 1 15 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.243 1.257 17967
5733 1 15 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.278 -0.048 17967
5734 1 15 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.192 3.138 17967
5735 1 15 . 1 1 64 64 VAL H H 62 6.380 6.380 8.428 -2.048 17967
5736 1 15 . 1 1 65 65 CYS N N 63 130.310 130.310 125.291 5.019 17967
5737 1 15 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.377 0.183 17967
5738 1 15 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.266 0.164 17967
5739 1 15 . 1 1 65 65 CYS CB C 63 31.130 31.130 29.686 1.444 17967
5740 1 15 . 1 1 65 65 CYS H H 63 9.430 9.430 8.159 1.271 17967
5741 1 15 . 1 1 66 66 ASP N N 64 121.110 121.110 121.667 -0.557 17967
5742 1 15 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.269 0.141 17967
5743 1 15 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.271 -0.041 17967
5744 1 15 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.896 1.434 17967
5745 1 15 . 1 1 66 66 ASP H H 64 9.120 9.120 8.917 0.203 17967
5746 1 15 . 1 1 67 67 LYS N N 65 122.110 122.110 118.815 3.295 17967
5747 1 15 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.830 0.180 17967
5748 1 15 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.602 1.528 17967
5749 1 15 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.248 0.582 17967
5750 1 15 . 1 1 67 67 LYS H H 65 8.330 8.330 7.588 0.742 17967
5751 1 15 . 1 1 68 68 CYS N N 66 125.610 125.610 118.798 6.812 17967
5752 1 15 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.008 0.102 17967
5753 1 15 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.253 1.277 17967
5754 1 15 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.319 4.411 17967
5755 1 15 . 1 1 68 68 CYS H H 66 8.700 8.700 7.474 1.226 17967
5756 1 15 . 1 1 69 69 LEU N N 67 125.310 125.310 121.157 4.153 17967
5757 1 15 . 1 1 69 69 LEU HA H 67 4.000 4.000 3.912 0.088 17967
5758 1 15 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.416 0.114 17967
5759 1 15 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.824 0.306 17967
5760 1 15 . 1 1 69 69 LEU H H 67 8.470 8.470 8.798 -0.328 17967
5761 1 15 . 1 1 70 70 LYS N N 68 119.010 119.010 116.074 2.936 17967
5762 1 15 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.159 -0.179 17967
5763 1 15 . 1 1 70 70 LYS CA C 68 58.830 58.830 57.687 1.143 17967
5764 1 15 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.529 0.601 17967
5765 1 15 . 1 1 70 70 LYS H H 68 7.810 7.810 7.384 0.426 17967
5766 1 15 . 1 1 71 71 PHE N N 69 121.710 121.710 117.371 4.339 17967
5767 1 15 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.204 0.076 17967
5768 1 15 . 1 1 71 71 PHE CA C 69 59.930 59.930 59.243 0.687 17967
5769 1 15 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.649 0.781 17967
5770 1 15 . 1 1 71 71 PHE H H 69 7.810 7.810 7.168 0.642 17967
5771 1 15 . 1 1 72 72 TYR N N 70 120.110 120.110 115.708 4.402 17967
5772 1 15 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.827 -0.507 17967
5773 1 15 . 1 1 72 72 TYR CA C 70 60.330 60.330 56.955 3.375 17967
5774 1 15 . 1 1 72 72 TYR CB C 70 40.430 40.430 37.499 2.931 17967
5775 1 15 . 1 1 72 72 TYR H H 70 8.280 8.280 8.612 -0.332 17967
5776 1 15 . 1 1 73 73 SER N N 71 117.210 117.210 117.896 -0.686 17967
5777 1 15 . 1 1 73 73 SER HA H 71 4.320 4.320 4.141 0.179 17967
5778 1 15 . 1 1 73 73 SER CA C 71 60.130 60.130 61.800 -1.670 17967
5779 1 15 . 1 1 73 73 SER CB C 71 63.630 63.630 62.783 0.847 17967
5780 1 15 . 1 1 73 73 SER H H 71 7.870 7.870 8.185 -0.315 17967
5781 1 15 . 1 1 74 74 LYS N N 72 122.810 122.810 122.132 0.678 17967
5782 1 15 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.201 0.069 17967
5783 1 15 . 1 1 74 74 LYS CA C 72 56.930 56.930 58.095 -1.165 17967
5784 1 15 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.148 0.482 17967
5785 1 15 . 1 1 74 74 LYS H H 72 7.800 7.800 8.364 -0.564 17967
5786 1 15 . 1 1 75 75 ILE N N 73 121.610 121.610 117.636 3.974 17967
5787 1 15 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.001 0.109 17967
5788 1 15 . 1 1 75 75 ILE CA C 73 61.830 61.830 63.618 -1.788 17967
5789 1 15 . 1 1 75 75 ILE CB C 73 38.630 38.630 38.500 0.130 17967
5790 1 15 . 1 1 75 75 ILE H H 73 7.750 7.750 8.292 -0.542 17967
5791 1 15 . 1 1 76 76 SER N N 74 120.410 120.410 110.696 9.714 17967
5792 1 15 . 1 1 76 76 SER HA H 74 4.300 4.300 4.099 0.201 17967
5793 1 15 . 1 1 76 76 SER CA C 74 59.330 59.330 61.420 -2.090 17967
5794 1 15 . 1 1 76 76 SER CB C 74 63.830 63.830 62.049 1.781 17967
5795 1 15 . 1 1 76 76 SER H H 74 8.130 8.130 8.880 -0.750 17967
5796 1 15 . 1 1 77 77 GLU N N 75 123.810 123.810 120.787 3.023 17967
5797 1 15 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.794 -0.604 17967
5798 1 15 . 1 1 77 77 GLU CA C 75 57.330 57.330 55.038 2.292 17967
5799 1 15 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.500 -0.371 17967
5800 1 15 . 1 1 77 77 GLU H H 75 8.270 8.270 7.934 0.336 17967
5801 1 15 . 1 1 78 78 TYR N N 76 122.410 122.410 125.872 -3.462 17967
5802 1 15 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.548 -0.088 17967
5803 1 15 . 1 1 78 78 TYR CA C 76 58.130 58.130 58.307 -0.177 17967
5804 1 15 . 1 1 78 78 TYR CB C 76 38.630 38.630 39.819 -1.189 17967
5805 1 15 . 1 1 78 78 TYR H H 76 7.980 7.980 8.158 -0.178 17967
5806 1 15 . 1 1 79 79 ARG N N 77 124.710 124.710 128.364 -3.654 17967
5807 1 15 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.769 -0.569 17967
5808 1 15 . 1 1 79 79 ARG CA C 77 56.030 56.030 54.676 1.354 17967
5809 1 15 . 1 1 79 79 ARG CB C 77 31.030 31.030 28.483 2.547 17967
5810 1 15 . 1 1 79 79 ARG H H 77 7.880 7.880 8.105 -0.225 17967
5811 1 15 . 1 1 80 80 HIS N N 78 122.110 122.110 122.486 -0.376 17967
5812 1 15 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.437 0.073 17967
5813 1 15 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.804 0.526 17967
5814 1 15 . 1 1 80 80 HIS CB C 78 30.830 30.830 29.734 1.096 17967
5815 1 15 . 1 1 80 80 HIS H H 78 8.120 8.120 8.185 -0.065 17967
5816 1 15 . 1 1 81 81 TYR N N 79 123.610 123.610 119.376 4.234 17967
5817 1 15 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.156 0.434 17967
5818 1 15 . 1 1 81 81 TYR CA C 79 57.830 57.830 58.116 -0.286 17967
5819 1 15 . 1 1 81 81 TYR CB C 79 39.130 39.130 36.328 2.802 17967
5820 1 15 . 1 1 81 81 TYR H H 79 7.970 7.970 7.502 0.468 17967
5821 1 16 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.342 -0.052 17967
5822 1 16 . 1 1 2 2 ALA CA C 0 52.530 52.530 52.147 0.383 17967
5823 1 16 . 1 1 2 2 ALA CB C 0 19.730 19.730 20.597 -0.867 17967
5824 1 16 . 1 1 3 3 MET N N 1 122.210 122.210 122.575 -0.365 17967
5825 1 16 . 1 1 3 3 MET HA H 1 4.300 4.300 4.637 -0.337 17967
5826 1 16 . 1 1 3 3 MET CA C 1 56.030 56.030 54.160 1.870 17967
5827 1 16 . 1 1 3 3 MET CB C 1 33.430 33.430 33.859 -0.429 17967
5828 1 16 . 1 1 3 3 MET H H 1 8.370 8.370 8.193 0.177 17967
5829 1 16 . 1 1 4 4 PHE N N 2 122.310 122.310 125.096 -2.786 17967
5830 1 16 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.522 0.108 17967
5831 1 16 . 1 1 4 4 PHE CA C 2 57.330 57.330 58.116 -0.786 17967
5832 1 16 . 1 1 4 4 PHE CB C 2 39.430 39.430 39.129 0.301 17967
5833 1 16 . 1 1 4 4 PHE H H 2 8.370 8.370 8.658 -0.288 17967
5834 1 16 . 1 1 5 5 GLN N N 3 123.510 123.510 125.527 -2.017 17967
5835 1 16 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.471 -0.291 17967
5836 1 16 . 1 1 5 5 GLN CA C 3 56.130 56.130 53.922 2.208 17967
5837 1 16 . 1 1 5 5 GLN CB C 3 29.930 29.930 32.245 -2.314 17967
5838 1 16 . 1 1 5 5 GLN H H 3 8.260 8.260 8.268 -0.008 17967
5839 1 16 . 1 1 6 6 ASP N N 4 125.010 125.010 124.580 0.430 17967
5840 1 16 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.613 0.177 17967
5841 1 16 . 1 1 6 6 ASP CA C 4 51.930 51.930 54.008 -2.078 17967
5842 1 16 . 1 1 6 6 ASP CB C 4 41.730 41.730 41.441 0.289 17967
5843 1 16 . 1 1 6 6 ASP H H 4 8.420 8.420 8.599 -0.179 17967
5844 1 16 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.558 -0.438 17967
5845 1 16 . 1 1 7 7 PRO CA C 5 64.030 64.030 63.254 0.776 17967
5846 1 16 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.219 0.111 17967
5847 1 16 . 1 1 8 8 GLN N N 6 119.710 119.710 120.999 -1.289 17967
5848 1 16 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.394 -0.234 17967
5849 1 16 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.480 1.150 17967
5850 1 16 . 1 1 8 8 GLN CB C 6 29.330 29.330 26.969 2.361 17967
5851 1 16 . 1 1 8 8 GLN H H 6 8.430 8.430 7.585 0.845 17967
5852 1 16 . 1 1 9 9 GLU N N 7 122.110 122.110 122.181 -0.071 17967
5853 1 16 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.055 0.145 17967
5854 1 16 . 1 1 9 9 GLU CA C 7 56.030 56.030 56.659 -0.629 17967
5855 1 16 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.868 0.662 17967
5856 1 16 . 1 1 9 9 GLU H H 7 7.940 7.940 8.199 -0.259 17967
5857 1 16 . 1 1 10 10 ARG N N 8 123.410 123.410 114.777 8.633 17967
5858 1 16 . 1 1 10 10 ARG HA H 8 4.400 4.400 3.713 0.687 17967
5859 1 16 . 1 1 10 10 ARG CA C 8 54.130 54.130 55.506 -1.376 17967
5860 1 16 . 1 1 10 10 ARG CB C 8 29.330 29.330 27.937 1.393 17967
5861 1 16 . 1 1 10 10 ARG H H 8 7.660 7.660 8.148 -0.488 17967
5862 1 16 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.534 -0.184 17967
5863 1 16 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.257 1.273 17967
5864 1 16 . 1 1 11 11 PRO CB C 9 32.630 32.630 32.854 -0.224 17967
5865 1 16 . 1 1 12 12 ARG N N 10 123.810 123.810 117.193 6.617 17967
5866 1 16 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.727 -0.057 17967
5867 1 16 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.554 1.276 17967
5868 1 16 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.369 1.161 17967
5869 1 16 . 1 1 12 12 ARG H H 10 8.710 8.710 8.792 -0.082 17967
5870 1 16 . 1 1 13 13 LYS N N 11 118.410 118.410 118.998 -0.588 17967
5871 1 16 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.722 0.328 17967
5872 1 16 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.389 -1.058 17967
5873 1 16 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.735 0.695 17967
5874 1 16 . 1 1 13 13 LYS H H 11 7.800 7.800 7.615 0.185 17967
5875 1 16 . 1 1 14 14 LEU N N 12 125.010 125.010 125.775 -0.765 17967
5876 1 16 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.179 -0.009 17967
5877 1 16 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.278 0.452 17967
5878 1 16 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.959 0.571 17967
5879 1 16 . 1 1 14 14 LEU H H 12 10.210 10.210 9.154 1.056 17967
5880 1 16 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.268 -0.048 17967
5881 1 16 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.493 1.737 17967
5882 1 16 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.120 -0.390 17967
5883 1 16 . 1 1 16 16 GLN N N 14 117.810 117.810 118.225 -0.415 17967
5884 1 16 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.130 0.060 17967
5885 1 16 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.942 0.088 17967
5886 1 16 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.350 0.280 17967
5887 1 16 . 1 1 16 16 GLN H H 14 7.110 7.110 8.340 -1.230 17967
5888 1 16 . 1 1 17 17 LEU N N 15 124.710 124.710 121.909 2.801 17967
5889 1 16 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.110 -0.100 17967
5890 1 16 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.843 0.487 17967
5891 1 16 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.709 0.320 17967
5892 1 16 . 1 1 17 17 LEU H H 15 8.010 8.010 8.287 -0.277 17967
5893 1 16 . 1 1 18 18 CYS N N 16 117.210 117.210 117.003 0.207 17967
5894 1 16 . 1 1 18 18 CYS HA H 16 3.750 3.750 4.036 -0.286 17967
5895 1 16 . 1 1 18 18 CYS CA C 16 64.730 64.730 64.053 0.677 17967
5896 1 16 . 1 1 18 18 CYS CB C 16 26.230 26.230 26.097 0.133 17967
5897 1 16 . 1 1 18 18 CYS H H 16 8.380 8.380 8.540 -0.160 17967
5898 1 16 . 1 1 19 19 THR N N 17 117.810 117.810 115.161 2.649 17967
5899 1 16 . 1 1 19 19 THR HA H 17 4.000 4.000 4.045 -0.045 17967
5900 1 16 . 1 1 19 19 THR CA C 17 66.830 66.830 67.100 -0.270 17967
5901 1 16 . 1 1 19 19 THR CB C 17 68.830 68.830 68.508 0.322 17967
5902 1 16 . 1 1 19 19 THR H H 17 7.720 7.720 7.786 -0.066 17967
5903 1 16 . 1 1 20 20 GLU N N 18 125.410 125.410 120.634 4.776 17967
5904 1 16 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.250 -0.180 17967
5905 1 16 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.740 0.990 17967
5906 1 16 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.535 0.195 17967
5907 1 16 . 1 1 20 20 GLU H H 18 8.010 8.010 7.676 0.334 17967
5908 1 16 . 1 1 21 21 LEU N N 19 118.810 118.810 117.707 1.103 17967
5909 1 16 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.065 0.235 17967
5910 1 16 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.648 -0.818 17967
5911 1 16 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.955 0.375 17967
5912 1 16 . 1 1 21 21 LEU H H 19 8.010 8.010 8.075 -0.065 17967
5913 1 16 . 1 1 22 22 GLN N N 20 118.310 118.310 114.406 3.904 17967
5914 1 16 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.042 -0.092 17967
5915 1 16 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.042 -0.312 17967
5916 1 16 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.431 -0.301 17967
5917 1 16 . 1 1 22 22 GLN H H 20 7.860 7.860 7.739 0.121 17967
5918 1 16 . 1 1 23 23 THR N N 21 115.910 115.910 111.893 4.017 17967
5919 1 16 . 1 1 23 23 THR HA H 21 4.950 4.950 4.631 0.319 17967
5920 1 16 . 1 1 23 23 THR CA C 21 58.530 58.530 60.004 -1.474 17967
5921 1 16 . 1 1 23 23 THR CB C 21 70.330 70.330 70.653 -0.323 17967
5922 1 16 . 1 1 23 23 THR H H 21 8.250 8.250 8.240 0.010 17967
5923 1 16 . 1 1 24 24 THR N N 22 112.810 112.810 114.006 -1.196 17967
5924 1 16 . 1 1 24 24 THR HA H 22 4.880 4.880 4.650 0.230 17967
5925 1 16 . 1 1 24 24 THR CA C 22 59.730 59.730 60.319 -0.589 17967
5926 1 16 . 1 1 24 24 THR CB C 22 74.130 74.130 71.067 3.063 17967
5927 1 16 . 1 1 24 24 THR H H 22 8.660 8.660 7.889 0.771 17967
5928 1 16 . 1 1 25 25 ILE N N 23 123.710 123.710 120.214 3.496 17967
5929 1 16 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.742 0.038 17967
5930 1 16 . 1 1 25 25 ILE CA C 23 63.430 63.430 63.865 -0.436 17967
5931 1 16 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.989 0.641 17967
5932 1 16 . 1 1 25 25 ILE H H 23 9.060 9.060 8.169 0.891 17967
5933 1 16 . 1 1 26 26 HIS N N 24 119.510 119.510 113.816 5.694 17967
5934 1 16 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.742 -0.302 17967
5935 1 16 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.653 1.377 17967
5936 1 16 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.006 1.824 17967
5937 1 16 . 1 1 26 26 HIS H H 24 7.040 7.040 7.521 -0.481 17967
5938 1 16 . 1 1 27 27 ASP N N 25 116.810 116.810 118.317 -1.507 17967
5939 1 16 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.662 0.098 17967
5940 1 16 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.309 0.121 17967
5941 1 16 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.119 1.211 17967
5942 1 16 . 1 1 27 27 ASP H H 25 7.250 7.250 7.563 -0.313 17967
5943 1 16 . 1 1 28 28 ILE N N 26 123.210 123.210 122.472 0.738 17967
5944 1 16 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.927 0.003 17967
5945 1 16 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.347 0.683 17967
5946 1 16 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.736 -0.806 17967
5947 1 16 . 1 1 28 28 ILE H H 26 7.750 7.750 7.681 0.069 17967
5948 1 16 . 1 1 29 29 ILE N N 27 131.110 131.110 128.487 2.623 17967
5949 1 16 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.136 0.244 17967
5950 1 16 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.928 -1.098 17967
5951 1 16 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.509 1.121 17967
5952 1 16 . 1 1 29 29 ILE H H 27 8.270 8.270 8.324 -0.054 17967
5953 1 16 . 1 1 30 30 LEU N N 28 129.410 129.410 129.618 -0.208 17967
5954 1 16 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.696 -0.036 17967
5955 1 16 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.335 -0.805 17967
5956 1 16 . 1 1 30 30 LEU CB C 28 48.330 48.330 44.941 3.389 17967
5957 1 16 . 1 1 30 30 LEU H H 28 8.500 8.500 8.270 0.230 17967
5958 1 16 . 1 1 31 31 GLU N N 29 121.910 121.910 121.598 0.312 17967
5959 1 16 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.905 -0.225 17967
5960 1 16 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.462 0.468 17967
5961 1 16 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.420 0.610 17967
5962 1 16 . 1 1 31 31 GLU H H 29 8.860 8.860 8.126 0.734 17967
5963 1 16 . 1 1 32 32 CYS N N 30 125.710 125.710 120.107 5.603 17967
5964 1 16 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.969 -0.949 17967
5965 1 16 . 1 1 32 32 CYS CA C 30 58.230 58.230 58.510 -0.280 17967
5966 1 16 . 1 1 32 32 CYS CB C 30 31.730 31.730 27.080 4.650 17967
5967 1 16 . 1 1 32 32 CYS H H 30 8.270 8.270 8.589 -0.319 17967
5968 1 16 . 1 1 33 33 VAL N N 31 132.310 132.310 128.698 3.612 17967
5969 1 16 . 1 1 33 33 VAL HA H 31 3.100 3.100 2.157 0.943 17967
5970 1 16 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.580 -1.350 17967
5971 1 16 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.716 -0.086 17967
5972 1 16 . 1 1 33 33 VAL H H 31 8.860 8.860 7.933 0.927 17967
5973 1 16 . 1 1 34 34 TYR N N 32 124.310 124.310 116.310 8.000 17967
5974 1 16 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.466 -0.026 17967
5975 1 16 . 1 1 34 34 TYR CA C 32 61.030 61.030 60.173 0.857 17967
5976 1 16 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.061 2.069 17967
5977 1 16 . 1 1 34 34 TYR H H 32 8.590 8.590 7.323 1.267 17967
5978 1 16 . 1 1 35 35 CYS N N 33 119.810 119.810 116.101 3.709 17967
5979 1 16 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.638 0.202 17967
5980 1 16 . 1 1 35 35 CYS CA C 33 59.430 59.430 59.439 -0.009 17967
5981 1 16 . 1 1 35 35 CYS CB C 33 32.230 32.230 29.061 3.168 17967
5982 1 16 . 1 1 35 35 CYS H H 33 8.070 8.070 7.629 0.441 17967
5983 1 16 . 1 1 36 36 LYS N N 34 119.910 119.910 114.705 5.205 17967
5984 1 16 . 1 1 36 36 LYS HA H 34 4.190 4.190 4.067 0.123 17967
5985 1 16 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.377 0.453 17967
5986 1 16 . 1 1 36 36 LYS CB C 34 29.330 29.330 30.029 -0.699 17967
5987 1 16 . 1 1 36 36 LYS H H 34 7.860 7.860 8.045 -0.185 17967
5988 1 16 . 1 1 37 37 GLN N N 35 120.710 120.710 117.521 3.189 17967
5989 1 16 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.415 -0.055 17967
5990 1 16 . 1 1 37 37 GLN CA C 35 55.430 55.430 55.074 0.356 17967
5991 1 16 . 1 1 37 37 GLN CB C 35 29.630 29.630 29.563 0.067 17967
5992 1 16 . 1 1 37 37 GLN H H 35 8.270 8.270 7.967 0.303 17967
5993 1 16 . 1 1 38 38 GLN N N 36 123.710 123.710 122.024 1.686 17967
5994 1 16 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.197 0.103 17967
5995 1 16 . 1 1 38 38 GLN CA C 36 56.730 56.730 55.793 0.937 17967
5996 1 16 . 1 1 38 38 GLN CB C 36 29.330 29.330 29.066 0.264 17967
5997 1 16 . 1 1 38 38 GLN H H 36 8.640 8.640 8.529 0.111 17967
5998 1 16 . 1 1 39 39 LEU N N 37 131.310 131.310 125.622 5.688 17967
5999 1 16 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.111 -0.001 17967
6000 1 16 . 1 1 39 39 LEU CA C 37 57.330 57.330 56.115 1.215 17967
6001 1 16 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.332 -0.402 17967
6002 1 16 . 1 1 39 39 LEU H H 37 8.870 8.870 8.049 0.821 17967
6003 1 16 . 1 1 40 40 LEU N N 38 126.310 126.310 125.126 1.184 17967
6004 1 16 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.303 0.007 17967
6005 1 16 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.669 -0.438 17967
6006 1 16 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.072 0.058 17967
6007 1 16 . 1 1 40 40 LEU H H 38 9.850 9.850 8.267 1.583 17967
6008 1 16 . 1 1 41 41 ARG N N 39 127.110 127.110 125.492 1.618 17967
6009 1 16 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.704 -0.184 17967
6010 1 16 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.673 -1.843 17967
6011 1 16 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.661 -2.731 17967
6012 1 16 . 1 1 41 41 ARG H H 39 8.970 8.970 8.881 0.089 17967
6013 1 16 . 1 1 42 42 ARG N N 40 115.810 115.810 117.201 -1.391 17967
6014 1 16 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.257 -0.177 17967
6015 1 16 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.011 0.119 17967
6016 1 16 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.176 0.154 17967
6017 1 16 . 1 1 42 42 ARG H H 40 8.610 8.610 8.516 0.094 17967
6018 1 16 . 1 1 43 43 GLU N N 41 119.910 119.910 118.354 1.556 17967
6019 1 16 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.572 -0.322 17967
6020 1 16 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.022 1.008 17967
6021 1 16 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.135 1.195 17967
6022 1 16 . 1 1 43 43 GLU H H 41 6.950 6.950 8.068 -1.118 17967
6023 1 16 . 1 1 44 44 VAL N N 42 125.010 125.010 120.339 4.671 17967
6024 1 16 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.622 -0.382 17967
6025 1 16 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.171 1.459 17967
6026 1 16 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.174 0.156 17967
6027 1 16 . 1 1 44 44 VAL H H 42 7.820 7.820 7.783 0.037 17967
6028 1 16 . 1 1 45 45 TYR N N 43 118.410 118.410 118.937 -0.527 17967
6029 1 16 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.172 0.258 17967
6030 1 16 . 1 1 45 45 TYR CA C 43 58.830 58.830 60.796 -1.966 17967
6031 1 16 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.240 -0.510 17967
6032 1 16 . 1 1 45 45 TYR H H 43 7.820 7.820 8.072 -0.252 17967
6033 1 16 . 1 1 46 46 ASP N N 44 122.410 122.410 119.685 2.725 17967
6034 1 16 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.367 0.233 17967
6035 1 16 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.594 0.236 17967
6036 1 16 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.170 0.860 17967
6037 1 16 . 1 1 46 46 ASP H H 44 8.540 8.540 7.930 0.610 17967
6038 1 16 . 1 1 47 47 PHE N N 45 126.210 126.210 119.229 6.981 17967
6039 1 16 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.079 -0.169 17967
6040 1 16 . 1 1 47 47 PHE CA C 45 62.630 62.630 62.001 0.629 17967
6041 1 16 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.042 0.288 17967
6042 1 16 . 1 1 47 47 PHE H H 45 8.320 8.320 7.526 0.794 17967
6043 1 16 . 1 1 48 48 ALA N N 46 119.110 119.110 119.509 -0.399 17967
6044 1 16 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.348 0.172 17967
6045 1 16 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.713 0.517 17967
6046 1 16 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.827 -0.097 17967
6047 1 16 . 1 1 48 48 ALA H H 46 7.740 7.740 7.747 -0.007 17967
6048 1 16 . 1 1 49 49 ARG N N 47 124.010 124.010 117.534 6.476 17967
6049 1 16 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.320 -0.270 17967
6050 1 16 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.021 2.609 17967
6051 1 16 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.377 0.053 17967
6052 1 16 . 1 1 49 49 ARG H H 47 8.500 8.500 8.187 0.313 17967
6053 1 16 . 1 1 50 50 ARG N N 48 119.110 119.110 118.723 0.387 17967
6054 1 16 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.534 -0.524 17967
6055 1 16 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.669 2.461 17967
6056 1 16 . 1 1 50 50 ARG CB C 48 31.130 31.130 31.986 -0.856 17967
6057 1 16 . 1 1 50 50 ARG H H 48 7.940 7.940 7.749 0.191 17967
6058 1 16 . 1 1 51 51 ASP N N 49 120.910 120.910 120.763 0.147 17967
6059 1 16 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.766 -0.346 17967
6060 1 16 . 1 1 51 51 ASP CA C 49 54.530 54.530 54.224 0.306 17967
6061 1 16 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.304 -0.374 17967
6062 1 16 . 1 1 51 51 ASP H H 49 7.950 7.950 8.548 -0.598 17967
6063 1 16 . 1 1 52 52 LEU N N 50 118.410 118.410 121.191 -2.781 17967
6064 1 16 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.737 -0.587 17967
6065 1 16 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.121 1.109 17967
6066 1 16 . 1 1 52 52 LEU CB C 50 41.130 41.130 45.111 -3.981 17967
6067 1 16 . 1 1 52 52 LEU H H 50 6.640 6.640 7.475 -0.835 17967
6068 1 16 . 1 1 53 53 CYS N N 51 117.410 117.410 117.392 0.018 17967
6069 1 16 . 1 1 53 53 CYS HA H 51 4.930 4.930 4.840 0.090 17967
6070 1 16 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.251 2.679 17967
6071 1 16 . 1 1 53 53 CYS CB C 51 28.630 28.630 31.067 -2.437 17967
6072 1 16 . 1 1 53 53 CYS H H 51 8.030 8.030 8.256 -0.226 17967
6073 1 16 . 1 1 54 54 ILE N N 52 125.110 125.110 122.388 2.722 17967
6074 1 16 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.420 -0.410 17967
6075 1 16 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.855 -2.225 17967
6076 1 16 . 1 1 54 54 ILE CB C 52 37.330 37.330 39.265 -1.935 17967
6077 1 16 . 1 1 54 54 ILE H H 52 8.500 8.500 8.927 -0.427 17967
6078 1 16 . 1 1 55 55 VAL N N 53 127.010 127.010 121.297 5.713 17967
6079 1 16 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.617 -0.247 17967
6080 1 16 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.119 0.511 17967
6081 1 16 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.620 1.609 17967
6082 1 16 . 1 1 55 55 VAL H H 53 8.130 8.130 8.113 0.017 17967
6083 1 16 . 1 1 56 56 TYR N N 54 124.910 124.910 126.376 -1.466 17967
6084 1 16 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.274 0.126 17967
6085 1 16 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.777 -0.447 17967
6086 1 16 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.491 1.539 17967
6087 1 16 . 1 1 56 56 TYR H H 54 8.700 8.700 8.694 0.006 17967
6088 1 16 . 1 1 57 57 ARG N N 55 123.810 123.810 124.959 -1.149 17967
6089 1 16 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.333 0.307 17967
6090 1 16 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.552 -0.122 17967
6091 1 16 . 1 1 57 57 ARG CB C 55 32.830 32.830 29.515 3.315 17967
6092 1 16 . 1 1 57 57 ARG H H 55 8.870 8.870 8.455 0.415 17967
6093 1 16 . 1 1 58 58 ASP N N 56 129.110 129.110 124.299 4.811 17967
6094 1 16 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.267 0.043 17967
6095 1 16 . 1 1 58 58 ASP CA C 56 55.830 55.830 57.264 -1.435 17967
6096 1 16 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.057 0.073 17967
6097 1 16 . 1 1 58 58 ASP H H 56 9.620 9.620 8.763 0.857 17967
6098 1 16 . 1 1 59 59 GLY N N 57 104.510 104.510 105.431 -0.921 17967
6099 1 16 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.161 0.469 17967
6100 1 16 . 1 1 59 59 GLY H H 57 8.720 8.720 8.303 0.417 17967
6101 1 16 . 1 1 60 60 ASN N N 58 122.210 122.210 119.873 2.337 17967
6102 1 16 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.269 0.131 17967
6103 1 16 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.839 -0.509 17967
6104 1 16 . 1 1 60 60 ASN CB C 58 40.430 40.430 41.037 -0.607 17967
6105 1 16 . 1 1 60 60 ASN H H 58 8.120 8.120 8.038 0.082 17967
6106 1 16 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.547 0.243 17967
6107 1 16 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.660 -0.630 17967
6108 1 16 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.297 2.233 17967
6109 1 16 . 1 1 62 62 TYR N N 60 119.810 119.810 122.649 -2.839 17967
6110 1 16 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.524 -0.164 17967
6111 1 16 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.599 1.631 17967
6112 1 16 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.713 0.717 17967
6113 1 16 . 1 1 62 62 TYR H H 60 8.590 8.590 7.649 0.941 17967
6114 1 16 . 1 1 63 63 ALA N N 61 123.810 123.810 121.898 1.912 17967
6115 1 16 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.066 0.354 17967
6116 1 16 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.466 -0.136 17967
6117 1 16 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.294 0.036 17967
6118 1 16 . 1 1 63 63 ALA H H 61 8.010 8.010 8.769 -0.759 17967
6119 1 16 . 1 1 64 64 VAL N N 62 120.510 120.510 117.101 3.409 17967
6120 1 16 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.313 1.187 17967
6121 1 16 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.276 -0.046 17967
6122 1 16 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.837 2.493 17967
6123 1 16 . 1 1 64 64 VAL H H 62 6.380 6.380 8.326 -1.946 17967
6124 1 16 . 1 1 65 65 CYS N N 63 130.310 130.310 125.821 4.489 17967
6125 1 16 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.421 0.139 17967
6126 1 16 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.668 -0.238 17967
6127 1 16 . 1 1 65 65 CYS CB C 63 31.130 31.130 28.836 2.294 17967
6128 1 16 . 1 1 65 65 CYS H H 63 9.430 9.430 8.182 1.248 17967
6129 1 16 . 1 1 66 66 ASP N N 64 121.110 121.110 120.708 0.402 17967
6130 1 16 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.218 0.192 17967
6131 1 16 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.226 0.004 17967
6132 1 16 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.949 1.381 17967
6133 1 16 . 1 1 66 66 ASP H H 64 9.120 9.120 8.789 0.331 17967
6134 1 16 . 1 1 67 67 LYS N N 65 122.110 122.110 118.749 3.361 17967
6135 1 16 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.834 0.176 17967
6136 1 16 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.499 1.631 17967
6137 1 16 . 1 1 67 67 LYS CB C 65 32.830 32.830 31.841 0.989 17967
6138 1 16 . 1 1 67 67 LYS H H 65 8.330 8.330 7.814 0.516 17967
6139 1 16 . 1 1 68 68 CYS N N 66 125.610 125.610 118.619 6.991 17967
6140 1 16 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.384 -0.274 17967
6141 1 16 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.471 1.059 17967
6142 1 16 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.756 3.974 17967
6143 1 16 . 1 1 68 68 CYS H H 66 8.700 8.700 7.487 1.213 17967
6144 1 16 . 1 1 69 69 LEU N N 67 125.310 125.310 120.507 4.803 17967
6145 1 16 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.143 -0.143 17967
6146 1 16 . 1 1 69 69 LEU CA C 67 58.530 58.530 57.609 0.921 17967
6147 1 16 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.463 0.667 17967
6148 1 16 . 1 1 69 69 LEU H H 67 8.470 8.470 8.656 -0.186 17967
6149 1 16 . 1 1 70 70 LYS N N 68 119.010 119.010 118.561 0.449 17967
6150 1 16 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.053 -0.073 17967
6151 1 16 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.237 0.593 17967
6152 1 16 . 1 1 70 70 LYS CB C 68 32.130 32.130 32.441 -0.310 17967
6153 1 16 . 1 1 70 70 LYS H H 68 7.810 7.810 7.326 0.484 17967
6154 1 16 . 1 1 71 71 PHE N N 69 121.710 121.710 117.577 4.133 17967
6155 1 16 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.134 0.146 17967
6156 1 16 . 1 1 71 71 PHE CA C 69 59.930 59.930 58.539 1.391 17967
6157 1 16 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.714 0.716 17967
6158 1 16 . 1 1 71 71 PHE H H 69 7.810 7.810 7.100 0.710 17967
6159 1 16 . 1 1 72 72 TYR N N 70 120.110 120.110 119.168 0.942 17967
6160 1 16 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.706 -0.386 17967
6161 1 16 . 1 1 72 72 TYR CA C 70 60.330 60.330 57.528 2.802 17967
6162 1 16 . 1 1 72 72 TYR CB C 70 40.430 40.430 36.395 4.035 17967
6163 1 16 . 1 1 72 72 TYR H H 70 8.280 8.280 8.742 -0.462 17967
6164 1 16 . 1 1 73 73 SER N N 71 117.210 117.210 118.086 -0.876 17967
6165 1 16 . 1 1 73 73 SER HA H 71 4.320 4.320 4.634 -0.314 17967
6166 1 16 . 1 1 73 73 SER CA C 71 60.130 60.130 59.175 0.955 17967
6167 1 16 . 1 1 73 73 SER CB C 71 63.630 63.630 63.931 -0.301 17967
6168 1 16 . 1 1 73 73 SER H H 71 7.870 7.870 8.301 -0.431 17967
6169 1 16 . 1 1 74 74 LYS N N 72 122.810 122.810 122.412 0.398 17967
6170 1 16 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.255 0.015 17967
6171 1 16 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.659 -0.729 17967
6172 1 16 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.389 0.241 17967
6173 1 16 . 1 1 74 74 LYS H H 72 7.800 7.800 8.163 -0.363 17967
6174 1 16 . 1 1 75 75 ILE N N 73 121.610 121.610 117.697 3.913 17967
6175 1 16 . 1 1 75 75 ILE HA H 73 4.110 4.110 3.861 0.249 17967
6176 1 16 . 1 1 75 75 ILE CA C 73 61.830 61.830 63.005 -1.175 17967
6177 1 16 . 1 1 75 75 ILE CB C 73 38.630 38.630 38.367 0.263 17967
6178 1 16 . 1 1 75 75 ILE H H 73 7.750 7.750 8.296 -0.546 17967
6179 1 16 . 1 1 76 76 SER N N 74 120.410 120.410 116.151 4.259 17967
6180 1 16 . 1 1 76 76 SER HA H 74 4.300 4.300 4.317 -0.017 17967
6181 1 16 . 1 1 76 76 SER CA C 74 59.330 59.330 59.598 -0.268 17967
6182 1 16 . 1 1 76 76 SER CB C 74 63.830 63.830 63.071 0.759 17967
6183 1 16 . 1 1 76 76 SER H H 74 8.130 8.130 7.926 0.204 17967
6184 1 16 . 1 1 77 77 GLU N N 75 123.810 123.810 122.030 1.780 17967
6185 1 16 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.105 0.085 17967
6186 1 16 . 1 1 77 77 GLU CA C 75 57.330 57.330 57.148 0.182 17967
6187 1 16 . 1 1 77 77 GLU CB C 75 30.130 30.130 27.641 2.489 17967
6188 1 16 . 1 1 77 77 GLU H H 75 8.270 8.270 8.881 -0.611 17967
6189 1 16 . 1 1 78 78 TYR N N 76 122.410 122.410 122.169 0.241 17967
6190 1 16 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.578 -0.118 17967
6191 1 16 . 1 1 78 78 TYR CA C 76 58.130 58.130 57.330 0.801 17967
6192 1 16 . 1 1 78 78 TYR CB C 76 38.630 38.630 38.587 0.043 17967
6193 1 16 . 1 1 78 78 TYR H H 76 7.980 7.980 7.898 0.082 17967
6194 1 16 . 1 1 79 79 ARG N N 77 124.710 124.710 126.360 -1.650 17967
6195 1 16 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.553 -0.353 17967
6196 1 16 . 1 1 79 79 ARG CA C 77 56.030 56.030 56.313 -0.283 17967
6197 1 16 . 1 1 79 79 ARG CB C 77 31.030 31.030 30.638 0.392 17967
6198 1 16 . 1 1 79 79 ARG H H 77 7.880 7.880 9.085 -1.205 17967
6199 1 16 . 1 1 80 80 HIS N N 78 122.110 122.110 118.868 3.242 17967
6200 1 16 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.523 -0.013 17967
6201 1 16 . 1 1 80 80 HIS CA C 78 56.330 56.330 56.129 0.201 17967
6202 1 16 . 1 1 80 80 HIS CB C 78 30.830 30.830 29.880 0.950 17967
6203 1 16 . 1 1 80 80 HIS H H 78 8.120 8.120 8.124 -0.004 17967
6204 1 16 . 1 1 81 81 TYR N N 79 123.610 123.610 116.596 7.014 17967
6205 1 16 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.285 0.305 17967
6206 1 16 . 1 1 81 81 TYR CA C 79 57.830 57.830 58.127 -0.297 17967
6207 1 16 . 1 1 81 81 TYR CB C 79 39.130 39.130 37.549 1.581 17967
6208 1 16 . 1 1 81 81 TYR H H 79 7.970 7.970 7.745 0.225 17967
6209 1 17 . 1 1 2 2 ALA HA H 0 4.290 4.290 3.729 0.561 17967
6210 1 17 . 1 1 2 2 ALA CA C 0 52.530 52.530 53.191 -0.661 17967
6211 1 17 . 1 1 2 2 ALA CB C 0 19.730 19.730 18.048 1.682 17967
6212 1 17 . 1 1 3 3 MET N N 1 122.210 122.210 120.273 1.937 17967
6213 1 17 . 1 1 3 3 MET HA H 1 4.300 4.300 4.540 -0.240 17967
6214 1 17 . 1 1 3 3 MET CA C 1 56.030 56.030 54.894 1.136 17967
6215 1 17 . 1 1 3 3 MET CB C 1 33.430 33.430 32.415 1.015 17967
6216 1 17 . 1 1 3 3 MET H H 1 8.370 8.370 7.473 0.897 17967
6217 1 17 . 1 1 4 4 PHE N N 2 122.310 122.310 124.813 -2.503 17967
6218 1 17 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.691 -0.061 17967
6219 1 17 . 1 1 4 4 PHE CA C 2 57.330 57.330 55.553 1.777 17967
6220 1 17 . 1 1 4 4 PHE CB C 2 39.430 39.430 40.567 -1.137 17967
6221 1 17 . 1 1 4 4 PHE H H 2 8.370 8.370 8.199 0.171 17967
6222 1 17 . 1 1 5 5 GLN N N 3 123.510 123.510 118.668 4.842 17967
6223 1 17 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.569 -0.389 17967
6224 1 17 . 1 1 5 5 GLN CA C 3 56.130 56.130 54.224 1.906 17967
6225 1 17 . 1 1 5 5 GLN CB C 3 29.930 29.930 30.301 -0.371 17967
6226 1 17 . 1 1 5 5 GLN H H 3 8.260 8.260 8.324 -0.064 17967
6227 1 17 . 1 1 6 6 ASP N N 4 125.010 125.010 118.272 6.738 17967
6228 1 17 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.801 -0.011 17967
6229 1 17 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.807 0.123 17967
6230 1 17 . 1 1 6 6 ASP CB C 4 41.730 41.730 40.664 1.066 17967
6231 1 17 . 1 1 6 6 ASP H H 4 8.420 8.420 8.438 -0.018 17967
6232 1 17 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.392 -0.272 17967
6233 1 17 . 1 1 7 7 PRO CA C 5 64.030 64.030 64.084 -0.054 17967
6234 1 17 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.254 0.076 17967
6235 1 17 . 1 1 8 8 GLN N N 6 119.710 119.710 117.219 2.491 17967
6236 1 17 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.389 -0.229 17967
6237 1 17 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.195 1.435 17967
6238 1 17 . 1 1 8 8 GLN CB C 6 29.330 29.330 29.288 0.042 17967
6239 1 17 . 1 1 8 8 GLN H H 6 8.430 8.430 7.830 0.600 17967
6240 1 17 . 1 1 9 9 GLU N N 7 122.110 122.110 120.810 1.300 17967
6241 1 17 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.184 0.016 17967
6242 1 17 . 1 1 9 9 GLU CA C 7 56.030 56.030 57.289 -1.259 17967
6243 1 17 . 1 1 9 9 GLU CB C 7 30.530 30.530 30.224 0.306 17967
6244 1 17 . 1 1 9 9 GLU H H 7 7.940 7.940 8.545 -0.605 17967
6245 1 17 . 1 1 10 10 ARG N N 8 123.410 123.410 119.381 4.029 17967
6246 1 17 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.789 -0.389 17967
6247 1 17 . 1 1 10 10 ARG CA C 8 54.130 54.130 54.226 -0.096 17967
6248 1 17 . 1 1 10 10 ARG CB C 8 29.330 29.330 29.649 -0.319 17967
6249 1 17 . 1 1 10 10 ARG H H 8 7.660 7.660 7.952 -0.292 17967
6250 1 17 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.626 -0.276 17967
6251 1 17 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.386 1.143 17967
6252 1 17 . 1 1 11 11 PRO CB C 9 32.630 32.630 33.191 -0.561 17967
6253 1 17 . 1 1 12 12 ARG N N 10 123.810 123.810 117.162 6.648 17967
6254 1 17 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.773 -0.103 17967
6255 1 17 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.931 0.899 17967
6256 1 17 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.784 0.746 17967
6257 1 17 . 1 1 12 12 ARG H H 10 8.710 8.710 8.789 -0.079 17967
6258 1 17 . 1 1 13 13 LYS N N 11 118.410 118.410 119.802 -1.392 17967
6259 1 17 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.728 0.322 17967
6260 1 17 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.660 -1.330 17967
6261 1 17 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.198 1.232 17967
6262 1 17 . 1 1 13 13 LYS H H 11 7.800 7.800 7.712 0.088 17967
6263 1 17 . 1 1 14 14 LEU N N 12 125.010 125.010 127.151 -2.141 17967
6264 1 17 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.240 -0.070 17967
6265 1 17 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.564 0.166 17967
6266 1 17 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.791 0.739 17967
6267 1 17 . 1 1 14 14 LEU H H 12 10.210 10.210 9.189 1.021 17967
6268 1 17 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.278 -0.058 17967
6269 1 17 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.648 1.581 17967
6270 1 17 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.077 -0.347 17967
6271 1 17 . 1 1 16 16 GLN N N 14 117.810 117.810 116.969 0.841 17967
6272 1 17 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.168 0.022 17967
6273 1 17 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.596 0.434 17967
6274 1 17 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.302 0.328 17967
6275 1 17 . 1 1 16 16 GLN H H 14 7.110 7.110 8.363 -1.253 17967
6276 1 17 . 1 1 17 17 LEU N N 15 124.710 124.710 122.591 2.119 17967
6277 1 17 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.232 -0.222 17967
6278 1 17 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.867 0.463 17967
6279 1 17 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.914 0.116 17967
6280 1 17 . 1 1 17 17 LEU H H 15 8.010 8.010 7.980 0.030 17967
6281 1 17 . 1 1 18 18 CYS N N 16 117.210 117.210 116.814 0.396 17967
6282 1 17 . 1 1 18 18 CYS HA H 16 3.750 3.750 3.990 -0.240 17967
6283 1 17 . 1 1 18 18 CYS CA C 16 64.730 64.730 64.035 0.695 17967
6284 1 17 . 1 1 18 18 CYS CB C 16 26.230 26.230 26.148 0.082 17967
6285 1 17 . 1 1 18 18 CYS H H 16 8.380 8.380 8.509 -0.129 17967
6286 1 17 . 1 1 19 19 THR N N 17 117.810 117.810 115.707 2.103 17967
6287 1 17 . 1 1 19 19 THR HA H 17 4.000 4.000 4.059 -0.059 17967
6288 1 17 . 1 1 19 19 THR CA C 17 66.830 66.830 66.903 -0.073 17967
6289 1 17 . 1 1 19 19 THR CB C 17 68.830 68.830 68.545 0.285 17967
6290 1 17 . 1 1 19 19 THR H H 17 7.720 7.720 7.693 0.027 17967
6291 1 17 . 1 1 20 20 GLU N N 18 125.410 125.410 121.027 4.383 17967
6292 1 17 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.121 -0.051 17967
6293 1 17 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.879 0.851 17967
6294 1 17 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.653 0.077 17967
6295 1 17 . 1 1 20 20 GLU H H 18 8.010 8.010 7.649 0.361 17967
6296 1 17 . 1 1 21 21 LEU N N 19 118.810 118.810 116.685 2.125 17967
6297 1 17 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.364 -0.064 17967
6298 1 17 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.294 -0.464 17967
6299 1 17 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.756 0.574 17967
6300 1 17 . 1 1 21 21 LEU H H 19 8.010 8.010 7.900 0.110 17967
6301 1 17 . 1 1 22 22 GLN N N 20 118.310 118.310 113.706 4.604 17967
6302 1 17 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.071 -0.121 17967
6303 1 17 . 1 1 22 22 GLN CA C 20 56.730 56.730 56.978 -0.248 17967
6304 1 17 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.432 -0.302 17967
6305 1 17 . 1 1 22 22 GLN H H 20 7.860 7.860 7.614 0.246 17967
6306 1 17 . 1 1 23 23 THR N N 21 115.910 115.910 112.201 3.709 17967
6307 1 17 . 1 1 23 23 THR HA H 21 4.950 4.950 4.541 0.409 17967
6308 1 17 . 1 1 23 23 THR CA C 21 58.530 58.530 60.117 -1.587 17967
6309 1 17 . 1 1 23 23 THR CB C 21 70.330 70.330 71.240 -0.910 17967
6310 1 17 . 1 1 23 23 THR H H 21 8.250 8.250 8.181 0.069 17967
6311 1 17 . 1 1 24 24 THR N N 22 112.810 112.810 114.242 -1.432 17967
6312 1 17 . 1 1 24 24 THR HA H 22 4.880 4.880 4.595 0.285 17967
6313 1 17 . 1 1 24 24 THR CA C 22 59.730 59.730 60.227 -0.497 17967
6314 1 17 . 1 1 24 24 THR CB C 22 74.130 74.130 71.338 2.792 17967
6315 1 17 . 1 1 24 24 THR H H 22 8.660 8.660 7.783 0.877 17967
6316 1 17 . 1 1 25 25 ILE N N 23 123.710 123.710 120.096 3.614 17967
6317 1 17 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.692 0.088 17967
6318 1 17 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.031 -0.601 17967
6319 1 17 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.891 0.739 17967
6320 1 17 . 1 1 25 25 ILE H H 23 9.060 9.060 8.113 0.947 17967
6321 1 17 . 1 1 26 26 HIS N N 24 119.510 119.510 112.782 6.728 17967
6322 1 17 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.769 -0.329 17967
6323 1 17 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.129 1.901 17967
6324 1 17 . 1 1 26 26 HIS CB C 24 30.830 30.830 28.924 1.906 17967
6325 1 17 . 1 1 26 26 HIS H H 24 7.040 7.040 7.375 -0.335 17967
6326 1 17 . 1 1 27 27 ASP N N 25 116.810 116.810 117.856 -1.046 17967
6327 1 17 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.658 0.102 17967
6328 1 17 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.238 0.192 17967
6329 1 17 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.431 0.899 17967
6330 1 17 . 1 1 27 27 ASP H H 25 7.250 7.250 7.541 -0.291 17967
6331 1 17 . 1 1 28 28 ILE N N 26 123.210 123.210 121.436 1.774 17967
6332 1 17 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.826 0.104 17967
6333 1 17 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.952 0.078 17967
6334 1 17 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.656 -0.726 17967
6335 1 17 . 1 1 28 28 ILE H H 26 7.750 7.750 7.890 -0.140 17967
6336 1 17 . 1 1 29 29 ILE N N 27 131.110 131.110 128.739 2.371 17967
6337 1 17 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.115 0.265 17967
6338 1 17 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.788 -0.957 17967
6339 1 17 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.513 1.117 17967
6340 1 17 . 1 1 29 29 ILE H H 27 8.270 8.270 8.339 -0.069 17967
6341 1 17 . 1 1 30 30 LEU N N 28 129.410 129.410 128.742 0.668 17967
6342 1 17 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.635 0.025 17967
6343 1 17 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.302 -0.772 17967
6344 1 17 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.538 2.792 17967
6345 1 17 . 1 1 30 30 LEU H H 28 8.500 8.500 8.366 0.134 17967
6346 1 17 . 1 1 31 31 GLU N N 29 121.910 121.910 121.148 0.762 17967
6347 1 17 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.776 -0.096 17967
6348 1 17 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.382 0.548 17967
6349 1 17 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.253 0.777 17967
6350 1 17 . 1 1 31 31 GLU H H 29 8.860 8.860 8.285 0.575 17967
6351 1 17 . 1 1 32 32 CYS N N 30 125.710 125.710 120.295 5.415 17967
6352 1 17 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.849 -0.829 17967
6353 1 17 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.379 -1.149 17967
6354 1 17 . 1 1 32 32 CYS CB C 30 31.730 31.730 27.021 4.709 17967
6355 1 17 . 1 1 32 32 CYS H H 30 8.270 8.270 8.479 -0.209 17967
6356 1 17 . 1 1 33 33 VAL N N 31 132.310 132.310 128.092 4.218 17967
6357 1 17 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.123 -0.023 17967
6358 1 17 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.367 -1.137 17967
6359 1 17 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.924 -0.294 17967
6360 1 17 . 1 1 33 33 VAL H H 31 8.860 8.860 8.024 0.836 17967
6361 1 17 . 1 1 34 34 TYR N N 32 124.310 124.310 113.584 10.726 17967
6362 1 17 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.551 -0.111 17967
6363 1 17 . 1 1 34 34 TYR CA C 32 61.030 61.030 58.769 2.261 17967
6364 1 17 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.895 1.235 17967
6365 1 17 . 1 1 34 34 TYR H H 32 8.590 8.590 7.153 1.437 17967
6366 1 17 . 1 1 35 35 CYS N N 33 119.810 119.810 115.693 4.117 17967
6367 1 17 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.595 0.245 17967
6368 1 17 . 1 1 35 35 CYS CA C 33 59.430 59.430 58.599 0.831 17967
6369 1 17 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.260 3.970 17967
6370 1 17 . 1 1 35 35 CYS H H 33 8.070 8.070 7.647 0.423 17967
6371 1 17 . 1 1 36 36 LYS N N 34 119.910 119.910 116.379 3.531 17967
6372 1 17 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.903 0.287 17967
6373 1 17 . 1 1 36 36 LYS CA C 34 57.830 57.830 56.613 1.217 17967
6374 1 17 . 1 1 36 36 LYS CB C 34 29.330 29.330 30.112 -0.782 17967
6375 1 17 . 1 1 36 36 LYS H H 34 7.860 7.860 7.867 -0.007 17967
6376 1 17 . 1 1 37 37 GLN N N 35 120.710 120.710 117.694 3.016 17967
6377 1 17 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.429 -0.069 17967
6378 1 17 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.043 1.387 17967
6379 1 17 . 1 1 37 37 GLN CB C 35 29.630 29.630 29.925 -0.295 17967
6380 1 17 . 1 1 37 37 GLN H H 35 8.270 8.270 7.774 0.496 17967
6381 1 17 . 1 1 38 38 GLN N N 36 123.710 123.710 127.218 -3.508 17967
6382 1 17 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.119 0.181 17967
6383 1 17 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.843 -0.113 17967
6384 1 17 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.822 0.508 17967
6385 1 17 . 1 1 38 38 GLN H H 36 8.640 8.640 8.702 -0.062 17967
6386 1 17 . 1 1 39 39 LEU N N 37 131.310 131.310 127.633 3.677 17967
6387 1 17 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.152 -0.042 17967
6388 1 17 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.863 1.467 17967
6389 1 17 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.335 -0.405 17967
6390 1 17 . 1 1 39 39 LEU H H 37 8.870 8.870 7.891 0.979 17967
6391 1 17 . 1 1 40 40 LEU N N 38 126.310 126.310 124.596 1.714 17967
6392 1 17 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.316 -0.006 17967
6393 1 17 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.635 -0.404 17967
6394 1 17 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.105 0.025 17967
6395 1 17 . 1 1 40 40 LEU H H 38 9.850 9.850 8.250 1.600 17967
6396 1 17 . 1 1 41 41 ARG N N 39 127.110 127.110 125.453 1.657 17967
6397 1 17 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.776 -0.256 17967
6398 1 17 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.455 -1.625 17967
6399 1 17 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.875 -2.945 17967
6400 1 17 . 1 1 41 41 ARG H H 39 8.970 8.970 8.919 0.051 17967
6401 1 17 . 1 1 42 42 ARG N N 40 115.810 115.810 117.362 -1.552 17967
6402 1 17 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.316 -0.236 17967
6403 1 17 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.705 -0.575 17967
6404 1 17 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.718 -0.388 17967
6405 1 17 . 1 1 42 42 ARG H H 40 8.610 8.610 8.485 0.125 17967
6406 1 17 . 1 1 43 43 GLU N N 41 119.910 119.910 119.487 0.423 17967
6407 1 17 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.386 -0.136 17967
6408 1 17 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.756 0.274 17967
6409 1 17 . 1 1 43 43 GLU CB C 41 30.330 30.330 28.726 1.604 17967
6410 1 17 . 1 1 43 43 GLU H H 41 6.950 6.950 7.888 -0.938 17967
6411 1 17 . 1 1 44 44 VAL N N 42 125.010 125.010 119.774 5.236 17967
6412 1 17 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.627 -0.387 17967
6413 1 17 . 1 1 44 44 VAL CA C 42 67.630 67.630 65.439 2.191 17967
6414 1 17 . 1 1 44 44 VAL CB C 42 31.330 31.330 30.953 0.377 17967
6415 1 17 . 1 1 44 44 VAL H H 42 7.820 7.820 7.860 -0.040 17967
6416 1 17 . 1 1 45 45 TYR N N 43 118.410 118.410 118.804 -0.394 17967
6417 1 17 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.160 0.270 17967
6418 1 17 . 1 1 45 45 TYR CA C 43 58.830 58.830 61.278 -2.448 17967
6419 1 17 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.454 -0.724 17967
6420 1 17 . 1 1 45 45 TYR H H 43 7.820 7.820 7.831 -0.011 17967
6421 1 17 . 1 1 46 46 ASP N N 44 122.410 122.410 120.261 2.149 17967
6422 1 17 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.309 0.291 17967
6423 1 17 . 1 1 46 46 ASP CA C 44 57.830 57.830 58.188 -0.358 17967
6424 1 17 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.501 0.529 17967
6425 1 17 . 1 1 46 46 ASP H H 44 8.540 8.540 8.046 0.494 17967
6426 1 17 . 1 1 47 47 PHE N N 45 126.210 126.210 119.385 6.825 17967
6427 1 17 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.100 -0.190 17967
6428 1 17 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.853 0.777 17967
6429 1 17 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.094 0.236 17967
6430 1 17 . 1 1 47 47 PHE H H 45 8.320 8.320 7.753 0.567 17967
6431 1 17 . 1 1 48 48 ALA N N 46 119.110 119.110 118.816 0.294 17967
6432 1 17 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.339 0.181 17967
6433 1 17 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.550 0.680 17967
6434 1 17 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.823 -0.093 17967
6435 1 17 . 1 1 48 48 ALA H H 46 7.740 7.740 7.714 0.026 17967
6436 1 17 . 1 1 49 49 ARG N N 47 124.010 124.010 117.587 6.423 17967
6437 1 17 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.297 -0.247 17967
6438 1 17 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.187 2.443 17967
6439 1 17 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.336 0.094 17967
6440 1 17 . 1 1 49 49 ARG H H 47 8.500 8.500 8.264 0.236 17967
6441 1 17 . 1 1 50 50 ARG N N 48 119.110 119.110 118.879 0.231 17967
6442 1 17 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.512 -0.502 17967
6443 1 17 . 1 1 50 50 ARG CA C 48 57.130 57.130 55.466 1.664 17967
6444 1 17 . 1 1 50 50 ARG CB C 48 31.130 31.130 31.565 -0.435 17967
6445 1 17 . 1 1 50 50 ARG H H 48 7.940 7.940 8.038 -0.098 17967
6446 1 17 . 1 1 51 51 ASP N N 49 120.910 120.910 117.436 3.474 17967
6447 1 17 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.657 -0.237 17967
6448 1 17 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.173 1.357 17967
6449 1 17 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.877 -0.947 17967
6450 1 17 . 1 1 51 51 ASP H H 49 7.950 7.950 8.302 -0.352 17967
6451 1 17 . 1 1 52 52 LEU N N 50 118.410 118.410 121.093 -2.683 17967
6452 1 17 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.273 -0.123 17967
6453 1 17 . 1 1 52 52 LEU CA C 50 54.230 54.230 55.663 -1.433 17967
6454 1 17 . 1 1 52 52 LEU CB C 50 41.130 41.130 41.966 -0.836 17967
6455 1 17 . 1 1 52 52 LEU H H 50 6.640 6.640 7.265 -0.625 17967
6456 1 17 . 1 1 53 53 CYS N N 51 117.410 117.410 117.314 0.096 17967
6457 1 17 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.123 -0.193 17967
6458 1 17 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.025 2.905 17967
6459 1 17 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.469 -1.839 17967
6460 1 17 . 1 1 53 53 CYS H H 51 8.030 8.030 7.835 0.195 17967
6461 1 17 . 1 1 54 54 ILE N N 52 125.110 125.110 121.823 3.287 17967
6462 1 17 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.386 -0.376 17967
6463 1 17 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.744 -2.114 17967
6464 1 17 . 1 1 54 54 ILE CB C 52 37.330 37.330 39.282 -1.952 17967
6465 1 17 . 1 1 54 54 ILE H H 52 8.500 8.500 8.924 -0.424 17967
6466 1 17 . 1 1 55 55 VAL N N 53 127.010 127.010 121.150 5.860 17967
6467 1 17 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.673 -0.303 17967
6468 1 17 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.682 -0.052 17967
6469 1 17 . 1 1 55 55 VAL CB C 53 34.230 34.230 33.151 1.079 17967
6470 1 17 . 1 1 55 55 VAL H H 53 8.130 8.130 8.069 0.061 17967
6471 1 17 . 1 1 56 56 TYR N N 54 124.910 124.910 126.184 -1.274 17967
6472 1 17 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.331 0.069 17967
6473 1 17 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.539 -0.209 17967
6474 1 17 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.371 1.659 17967
6475 1 17 . 1 1 56 56 TYR H H 54 8.700 8.700 8.733 -0.033 17967
6476 1 17 . 1 1 57 57 ARG N N 55 123.810 123.810 125.628 -1.818 17967
6477 1 17 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.421 0.219 17967
6478 1 17 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.799 -0.369 17967
6479 1 17 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.773 2.057 17967
6480 1 17 . 1 1 57 57 ARG H H 55 8.870 8.870 8.383 0.487 17967
6481 1 17 . 1 1 58 58 ASP N N 56 129.110 129.110 125.011 4.099 17967
6482 1 17 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.316 -0.006 17967
6483 1 17 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.546 -0.716 17967
6484 1 17 . 1 1 58 58 ASP CB C 56 40.130 40.130 39.975 0.155 17967
6485 1 17 . 1 1 58 58 ASP H H 56 9.620 9.620 9.140 0.480 17967
6486 1 17 . 1 1 59 59 GLY N N 57 104.510 104.510 107.370 -2.860 17967
6487 1 17 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.149 0.481 17967
6488 1 17 . 1 1 59 59 GLY H H 57 8.720 8.720 8.343 0.377 17967
6489 1 17 . 1 1 60 60 ASN N N 58 122.210 122.210 119.747 2.463 17967
6490 1 17 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.345 0.055 17967
6491 1 17 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.647 -0.317 17967
6492 1 17 . 1 1 60 60 ASN CB C 58 40.430 40.430 40.514 -0.084 17967
6493 1 17 . 1 1 60 60 ASN H H 58 8.120 8.120 8.197 -0.077 17967
6494 1 17 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.723 0.067 17967
6495 1 17 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.423 -0.393 17967
6496 1 17 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.344 2.186 17967
6497 1 17 . 1 1 62 62 TYR N N 60 119.810 119.810 122.619 -2.809 17967
6498 1 17 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.521 -0.161 17967
6499 1 17 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.426 1.804 17967
6500 1 17 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.508 0.922 17967
6501 1 17 . 1 1 62 62 TYR H H 60 8.590 8.590 7.680 0.910 17967
6502 1 17 . 1 1 63 63 ALA N N 61 123.810 123.810 121.612 2.198 17967
6503 1 17 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.148 0.272 17967
6504 1 17 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.282 0.048 17967
6505 1 17 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.653 -0.323 17967
6506 1 17 . 1 1 63 63 ALA H H 61 8.010 8.010 8.813 -0.803 17967
6507 1 17 . 1 1 64 64 VAL N N 62 120.510 120.510 117.748 2.762 17967
6508 1 17 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.313 1.187 17967
6509 1 17 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.361 -0.131 17967
6510 1 17 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.422 2.908 17967
6511 1 17 . 1 1 64 64 VAL H H 62 6.380 6.380 8.354 -1.974 17967
6512 1 17 . 1 1 65 65 CYS N N 63 130.310 130.310 125.997 4.313 17967
6513 1 17 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.397 0.163 17967
6514 1 17 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.636 -0.206 17967
6515 1 17 . 1 1 65 65 CYS CB C 63 31.130 31.130 28.940 2.190 17967
6516 1 17 . 1 1 65 65 CYS H H 63 9.430 9.430 8.298 1.132 17967
6517 1 17 . 1 1 66 66 ASP N N 64 121.110 121.110 121.130 -0.020 17967
6518 1 17 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.227 0.183 17967
6519 1 17 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.510 -0.279 17967
6520 1 17 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.760 1.570 17967
6521 1 17 . 1 1 66 66 ASP H H 64 9.120 9.120 8.765 0.355 17967
6522 1 17 . 1 1 67 67 LYS N N 65 122.110 122.110 119.292 2.818 17967
6523 1 17 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.810 0.200 17967
6524 1 17 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.778 1.353 17967
6525 1 17 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.190 0.640 17967
6526 1 17 . 1 1 67 67 LYS H H 65 8.330 8.330 7.787 0.543 17967
6527 1 17 . 1 1 68 68 CYS N N 66 125.610 125.610 118.932 6.678 17967
6528 1 17 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.360 -0.250 17967
6529 1 17 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.657 0.873 17967
6530 1 17 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.376 4.354 17967
6531 1 17 . 1 1 68 68 CYS H H 66 8.700 8.700 7.547 1.153 17967
6532 1 17 . 1 1 69 69 LEU N N 67 125.310 125.310 122.610 2.700 17967
6533 1 17 . 1 1 69 69 LEU HA H 67 4.000 4.000 3.970 0.030 17967
6534 1 17 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.769 -0.239 17967
6535 1 17 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.953 0.177 17967
6536 1 17 . 1 1 69 69 LEU H H 67 8.470 8.470 9.011 -0.541 17967
6537 1 17 . 1 1 70 70 LYS N N 68 119.010 119.010 119.844 -0.834 17967
6538 1 17 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.070 -0.090 17967
6539 1 17 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.874 -0.044 17967
6540 1 17 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.828 0.301 17967
6541 1 17 . 1 1 70 70 LYS H H 68 7.810 7.810 7.805 0.005 17967
6542 1 17 . 1 1 71 71 PHE N N 69 121.710 121.710 118.795 2.915 17967
6543 1 17 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.197 0.083 17967
6544 1 17 . 1 1 71 71 PHE CA C 69 59.930 59.930 59.614 0.316 17967
6545 1 17 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.610 0.820 17967
6546 1 17 . 1 1 71 71 PHE H H 69 7.810 7.810 7.447 0.363 17967
6547 1 17 . 1 1 72 72 TYR N N 70 120.110 120.110 116.230 3.880 17967
6548 1 17 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.669 -0.349 17967
6549 1 17 . 1 1 72 72 TYR CA C 70 60.330 60.330 57.752 2.578 17967
6550 1 17 . 1 1 72 72 TYR CB C 70 40.430 40.430 36.533 3.897 17967
6551 1 17 . 1 1 72 72 TYR H H 70 8.280 8.280 8.932 -0.652 17967
6552 1 17 . 1 1 73 73 SER N N 71 117.210 117.210 116.400 0.810 17967
6553 1 17 . 1 1 73 73 SER HA H 71 4.320 4.320 4.249 0.071 17967
6554 1 17 . 1 1 73 73 SER CA C 71 60.130 60.130 61.111 -0.981 17967
6555 1 17 . 1 1 73 73 SER CB C 71 63.630 63.630 63.060 0.570 17967
6556 1 17 . 1 1 73 73 SER H H 71 7.870 7.870 8.110 -0.240 17967
6557 1 17 . 1 1 74 74 LYS N N 72 122.810 122.810 121.898 0.912 17967
6558 1 17 . 1 1 74 74 LYS HA H 72 4.270 4.270 3.983 0.287 17967
6559 1 17 . 1 1 74 74 LYS CA C 72 56.930 56.930 58.313 -1.383 17967
6560 1 17 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.179 0.451 17967
6561 1 17 . 1 1 74 74 LYS H H 72 7.800 7.800 7.984 -0.184 17967
6562 1 17 . 1 1 75 75 ILE N N 73 121.610 121.610 116.584 5.026 17967
6563 1 17 . 1 1 75 75 ILE HA H 73 4.110 4.110 3.829 0.281 17967
6564 1 17 . 1 1 75 75 ILE CA C 73 61.830 61.830 63.811 -1.981 17967
6565 1 17 . 1 1 75 75 ILE CB C 73 38.630 38.630 38.458 0.173 17967
6566 1 17 . 1 1 75 75 ILE H H 73 7.750 7.750 7.451 0.299 17967
6567 1 17 . 1 1 76 76 SER N N 74 120.410 120.410 111.374 9.036 17967
6568 1 17 . 1 1 76 76 SER HA H 74 4.300 4.300 3.935 0.365 17967
6569 1 17 . 1 1 76 76 SER CA C 74 59.330 59.330 61.611 -2.281 17967
6570 1 17 . 1 1 76 76 SER CB C 74 63.830 63.830 62.597 1.233 17967
6571 1 17 . 1 1 76 76 SER H H 74 8.130 8.130 8.140 -0.010 17967
6572 1 17 . 1 1 77 77 GLU N N 75 123.810 123.810 121.942 1.868 17967
6573 1 17 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.669 -0.479 17967
6574 1 17 . 1 1 77 77 GLU CA C 75 57.330 57.330 54.973 2.357 17967
6575 1 17 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.880 -0.750 17967
6576 1 17 . 1 1 77 77 GLU H H 75 8.270 8.270 7.893 0.377 17967
6577 1 17 . 1 1 78 78 TYR N N 76 122.410 122.410 124.922 -2.512 17967
6578 1 17 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.811 -0.351 17967
6579 1 17 . 1 1 78 78 TYR CA C 76 58.130 58.130 57.422 0.708 17967
6580 1 17 . 1 1 78 78 TYR CB C 76 38.630 38.630 40.084 -1.454 17967
6581 1 17 . 1 1 78 78 TYR H H 76 7.980 7.980 8.588 -0.608 17967
6582 1 17 . 1 1 79 79 ARG N N 77 124.710 124.710 126.346 -1.636 17967
6583 1 17 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.490 -0.290 17967
6584 1 17 . 1 1 79 79 ARG CA C 77 56.030 56.030 56.250 -0.220 17967
6585 1 17 . 1 1 79 79 ARG CB C 77 31.030 31.030 30.223 0.807 17967
6586 1 17 . 1 1 79 79 ARG H H 77 7.880 7.880 9.059 -1.179 17967
6587 1 17 . 1 1 80 80 HIS N N 78 122.110 122.110 113.258 8.852 17967
6588 1 17 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.387 0.123 17967
6589 1 17 . 1 1 80 80 HIS CA C 78 56.330 56.330 56.381 -0.051 17967
6590 1 17 . 1 1 80 80 HIS CB C 78 30.830 30.830 27.305 3.525 17967
6591 1 17 . 1 1 80 80 HIS H H 78 8.120 8.120 8.304 -0.184 17967
6592 1 17 . 1 1 81 81 TYR N N 79 123.610 123.610 121.926 1.684 17967
6593 1 17 . 1 1 81 81 TYR HA H 79 4.590 4.590 5.090 -0.500 17967
6594 1 17 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.787 0.043 17967
6595 1 17 . 1 1 81 81 TYR CB C 79 39.130 39.130 39.657 -0.527 17967
6596 1 17 . 1 1 81 81 TYR H H 79 7.970 7.970 9.200 -1.230 17967
6597 1 18 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.494 -0.204 17967
6598 1 18 . 1 1 2 2 ALA CA C 0 52.530 52.530 52.033 0.497 17967
6599 1 18 . 1 1 2 2 ALA CB C 0 19.730 19.730 19.228 0.502 17967
6600 1 18 . 1 1 3 3 MET N N 1 122.210 122.210 120.293 1.917 17967
6601 1 18 . 1 1 3 3 MET HA H 1 4.300 4.300 4.336 -0.036 17967
6602 1 18 . 1 1 3 3 MET CA C 1 56.030 56.030 56.135 -0.105 17967
6603 1 18 . 1 1 3 3 MET CB C 1 33.430 33.430 33.156 0.274 17967
6604 1 18 . 1 1 3 3 MET H H 1 8.370 8.370 8.467 -0.097 17967
6605 1 18 . 1 1 4 4 PHE N N 2 122.310 122.310 121.110 1.200 17967
6606 1 18 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.701 -0.071 17967
6607 1 18 . 1 1 4 4 PHE CA C 2 57.330 57.330 56.736 0.594 17967
6608 1 18 . 1 1 4 4 PHE CB C 2 39.430 39.430 38.231 1.199 17967
6609 1 18 . 1 1 4 4 PHE H H 2 8.370 8.370 8.835 -0.465 17967
6610 1 18 . 1 1 5 5 GLN N N 3 123.510 123.510 121.566 1.944 17967
6611 1 18 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.674 -0.494 17967
6612 1 18 . 1 1 5 5 GLN CA C 3 56.130 56.130 53.569 2.561 17967
6613 1 18 . 1 1 5 5 GLN CB C 3 29.930 29.930 30.986 -1.056 17967
6614 1 18 . 1 1 5 5 GLN H H 3 8.260 8.260 7.583 0.677 17967
6615 1 18 . 1 1 6 6 ASP N N 4 125.010 125.010 118.830 6.180 17967
6616 1 18 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.700 0.090 17967
6617 1 18 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.020 0.910 17967
6618 1 18 . 1 1 6 6 ASP CB C 4 41.730 41.730 42.136 -0.406 17967
6619 1 18 . 1 1 6 6 ASP H H 4 8.420 8.420 8.459 -0.039 17967
6620 1 18 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.324 -0.204 17967
6621 1 18 . 1 1 7 7 PRO CA C 5 64.030 64.030 64.292 -0.262 17967
6622 1 18 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.047 0.283 17967
6623 1 18 . 1 1 8 8 GLN N N 6 119.710 119.710 119.205 0.505 17967
6624 1 18 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.253 -0.093 17967
6625 1 18 . 1 1 8 8 GLN CA C 6 56.630 56.630 54.413 2.217 17967
6626 1 18 . 1 1 8 8 GLN CB C 6 29.330 29.330 25.608 3.722 17967
6627 1 18 . 1 1 8 8 GLN H H 6 8.430 8.430 8.563 -0.133 17967
6628 1 18 . 1 1 9 9 GLU N N 7 122.110 122.110 122.013 0.097 17967
6629 1 18 . 1 1 9 9 GLU HA H 7 4.200 4.200 3.779 0.421 17967
6630 1 18 . 1 1 9 9 GLU CA C 7 56.030 56.030 57.073 -1.043 17967
6631 1 18 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.530 1.000 17967
6632 1 18 . 1 1 9 9 GLU H H 7 7.940 7.940 8.018 -0.078 17967
6633 1 18 . 1 1 10 10 ARG N N 8 123.410 123.410 125.917 -2.507 17967
6634 1 18 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.124 0.276 17967
6635 1 18 . 1 1 10 10 ARG CA C 8 54.130 54.130 54.411 -0.281 17967
6636 1 18 . 1 1 10 10 ARG CB C 8 29.330 29.330 28.619 0.711 17967
6637 1 18 . 1 1 10 10 ARG H H 8 7.660 7.660 7.694 -0.035 17967
6638 1 18 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.519 -0.169 17967
6639 1 18 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.495 1.035 17967
6640 1 18 . 1 1 11 11 PRO CB C 9 32.630 32.630 32.491 0.139 17967
6641 1 18 . 1 1 12 12 ARG N N 10 123.810 123.810 120.597 3.213 17967
6642 1 18 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.530 0.140 17967
6643 1 18 . 1 1 12 12 ARG CA C 10 56.830 56.830 56.929 -0.099 17967
6644 1 18 . 1 1 12 12 ARG CB C 10 32.530 32.530 30.554 1.976 17967
6645 1 18 . 1 1 12 12 ARG H H 10 8.710 8.710 8.785 -0.075 17967
6646 1 18 . 1 1 13 13 LYS N N 11 118.410 118.410 119.612 -1.202 17967
6647 1 18 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.728 0.322 17967
6648 1 18 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.700 -1.370 17967
6649 1 18 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.020 1.410 17967
6650 1 18 . 1 1 13 13 LYS H H 11 7.800 7.800 8.051 -0.251 17967
6651 1 18 . 1 1 14 14 LEU N N 12 125.010 125.010 127.663 -2.653 17967
6652 1 18 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.198 -0.028 17967
6653 1 18 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.650 0.080 17967
6654 1 18 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.809 0.722 17967
6655 1 18 . 1 1 14 14 LEU H H 12 10.210 10.210 9.251 0.959 17967
6656 1 18 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.243 -0.023 17967
6657 1 18 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.708 1.522 17967
6658 1 18 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.046 -0.316 17967
6659 1 18 . 1 1 16 16 GLN N N 14 117.810 117.810 117.568 0.242 17967
6660 1 18 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.148 0.042 17967
6661 1 18 . 1 1 16 16 GLN CA C 14 59.030 59.030 59.136 -0.106 17967
6662 1 18 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.287 0.343 17967
6663 1 18 . 1 1 16 16 GLN H H 14 7.110 7.110 8.341 -1.231 17967
6664 1 18 . 1 1 17 17 LEU N N 15 124.710 124.710 122.538 2.172 17967
6665 1 18 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.169 -0.159 17967
6666 1 18 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.991 0.339 17967
6667 1 18 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.729 0.301 17967
6668 1 18 . 1 1 17 17 LEU H H 15 8.010 8.010 8.275 -0.265 17967
6669 1 18 . 1 1 18 18 CYS N N 16 117.210 117.210 117.183 0.027 17967
6670 1 18 . 1 1 18 18 CYS HA H 16 3.750 3.750 3.958 -0.208 17967
6671 1 18 . 1 1 18 18 CYS CA C 16 64.730 64.730 64.018 0.712 17967
6672 1 18 . 1 1 18 18 CYS CB C 16 26.230 26.230 26.027 0.203 17967
6673 1 18 . 1 1 18 18 CYS H H 16 8.380 8.380 8.736 -0.356 17967
6674 1 18 . 1 1 19 19 THR N N 17 117.810 117.810 116.182 1.628 17967
6675 1 18 . 1 1 19 19 THR HA H 17 4.000 4.000 4.018 -0.018 17967
6676 1 18 . 1 1 19 19 THR CA C 17 66.830 66.830 66.958 -0.128 17967
6677 1 18 . 1 1 19 19 THR CB C 17 68.830 68.830 68.467 0.363 17967
6678 1 18 . 1 1 19 19 THR H H 17 7.720 7.720 7.777 -0.057 17967
6679 1 18 . 1 1 20 20 GLU N N 18 125.410 125.410 121.037 4.373 17967
6680 1 18 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.160 -0.090 17967
6681 1 18 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.825 0.905 17967
6682 1 18 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.438 0.292 17967
6683 1 18 . 1 1 20 20 GLU H H 18 8.010 8.010 7.589 0.421 17967
6684 1 18 . 1 1 21 21 LEU N N 19 118.810 118.810 118.487 0.323 17967
6685 1 18 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.357 -0.057 17967
6686 1 18 . 1 1 21 21 LEU CA C 19 54.830 54.830 56.048 -1.218 17967
6687 1 18 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.871 0.459 17967
6688 1 18 . 1 1 21 21 LEU H H 19 8.010 8.010 8.141 -0.131 17967
6689 1 18 . 1 1 22 22 GLN N N 20 118.310 118.310 113.824 4.486 17967
6690 1 18 . 1 1 22 22 GLN HA H 20 3.950 3.950 3.995 -0.045 17967
6691 1 18 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.148 -0.417 17967
6692 1 18 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.440 -0.310 17967
6693 1 18 . 1 1 22 22 GLN H H 20 7.860 7.860 7.697 0.163 17967
6694 1 18 . 1 1 23 23 THR N N 21 115.910 115.910 111.775 4.135 17967
6695 1 18 . 1 1 23 23 THR HA H 21 4.950 4.950 4.613 0.337 17967
6696 1 18 . 1 1 23 23 THR CA C 21 58.530 58.530 59.488 -0.958 17967
6697 1 18 . 1 1 23 23 THR CB C 21 70.330 70.330 70.189 0.141 17967
6698 1 18 . 1 1 23 23 THR H H 21 8.250 8.250 8.078 0.172 17967
6699 1 18 . 1 1 24 24 THR N N 22 112.810 112.810 113.644 -0.834 17967
6700 1 18 . 1 1 24 24 THR HA H 22 4.880 4.880 4.553 0.327 17967
6701 1 18 . 1 1 24 24 THR CA C 22 59.730 59.730 60.432 -0.702 17967
6702 1 18 . 1 1 24 24 THR CB C 22 74.130 74.130 71.107 3.023 17967
6703 1 18 . 1 1 24 24 THR H H 22 8.660 8.660 7.853 0.807 17967
6704 1 18 . 1 1 25 25 ILE N N 23 123.710 123.710 120.091 3.619 17967
6705 1 18 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.694 0.086 17967
6706 1 18 . 1 1 25 25 ILE CA C 23 63.430 63.430 63.618 -0.188 17967
6707 1 18 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.844 0.786 17967
6708 1 18 . 1 1 25 25 ILE H H 23 9.060 9.060 8.133 0.927 17967
6709 1 18 . 1 1 26 26 HIS N N 24 119.510 119.510 113.700 5.810 17967
6710 1 18 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.742 -0.302 17967
6711 1 18 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.633 1.397 17967
6712 1 18 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.162 1.668 17967
6713 1 18 . 1 1 26 26 HIS H H 24 7.040 7.040 7.459 -0.419 17967
6714 1 18 . 1 1 27 27 ASP N N 25 116.810 116.810 118.275 -1.465 17967
6715 1 18 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.626 0.134 17967
6716 1 18 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.283 0.147 17967
6717 1 18 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.074 1.256 17967
6718 1 18 . 1 1 27 27 ASP H H 25 7.250 7.250 7.502 -0.252 17967
6719 1 18 . 1 1 28 28 ILE N N 26 123.210 123.210 121.951 1.259 17967
6720 1 18 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.831 0.099 17967
6721 1 18 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.568 0.462 17967
6722 1 18 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.719 -0.789 17967
6723 1 18 . 1 1 28 28 ILE H H 26 7.750 7.750 7.868 -0.118 17967
6724 1 18 . 1 1 29 29 ILE N N 27 131.110 131.110 129.574 1.536 17967
6725 1 18 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.076 0.304 17967
6726 1 18 . 1 1 29 29 ILE CA C 27 58.830 58.830 60.063 -1.233 17967
6727 1 18 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.997 0.633 17967
6728 1 18 . 1 1 29 29 ILE H H 27 8.270 8.270 8.258 0.012 17967
6729 1 18 . 1 1 30 30 LEU N N 28 129.410 129.410 130.479 -1.069 17967
6730 1 18 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.592 0.068 17967
6731 1 18 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.257 -0.727 17967
6732 1 18 . 1 1 30 30 LEU CB C 28 48.330 48.330 46.002 2.328 17967
6733 1 18 . 1 1 30 30 LEU H H 28 8.500 8.500 8.475 0.025 17967
6734 1 18 . 1 1 31 31 GLU N N 29 121.910 121.910 120.262 1.648 17967
6735 1 18 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.940 -0.260 17967
6736 1 18 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.230 0.701 17967
6737 1 18 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.667 0.363 17967
6738 1 18 . 1 1 31 31 GLU H H 29 8.860 8.860 8.207 0.653 17967
6739 1 18 . 1 1 32 32 CYS N N 30 125.710 125.710 118.609 7.101 17967
6740 1 18 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.754 -0.734 17967
6741 1 18 . 1 1 32 32 CYS CA C 30 58.230 58.230 60.697 -2.467 17967
6742 1 18 . 1 1 32 32 CYS CB C 30 31.730 31.730 26.442 5.288 17967
6743 1 18 . 1 1 32 32 CYS H H 30 8.270 8.270 8.640 -0.370 17967
6744 1 18 . 1 1 33 33 VAL N N 31 132.310 132.310 124.552 7.758 17967
6745 1 18 . 1 1 33 33 VAL HA H 31 3.100 3.100 2.865 0.235 17967
6746 1 18 . 1 1 33 33 VAL CA C 31 64.230 64.230 64.907 -0.677 17967
6747 1 18 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.756 -0.126 17967
6748 1 18 . 1 1 33 33 VAL H H 31 8.860 8.860 7.591 1.269 17967
6749 1 18 . 1 1 34 34 TYR N N 32 124.310 124.310 116.546 7.764 17967
6750 1 18 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.463 -0.023 17967
6751 1 18 . 1 1 34 34 TYR CA C 32 61.030 61.030 58.828 2.202 17967
6752 1 18 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.702 1.428 17967
6753 1 18 . 1 1 34 34 TYR H H 32 8.590 8.590 7.329 1.261 17967
6754 1 18 . 1 1 35 35 CYS N N 33 119.810 119.810 115.035 4.775 17967
6755 1 18 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.696 0.144 17967
6756 1 18 . 1 1 35 35 CYS CA C 33 59.430 59.430 59.446 -0.015 17967
6757 1 18 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.393 3.837 17967
6758 1 18 . 1 1 35 35 CYS H H 33 8.070 8.070 8.378 -0.308 17967
6759 1 18 . 1 1 36 36 LYS N N 34 119.910 119.910 116.053 3.857 17967
6760 1 18 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.910 0.280 17967
6761 1 18 . 1 1 36 36 LYS CA C 34 57.830 57.830 56.923 0.907 17967
6762 1 18 . 1 1 36 36 LYS CB C 34 29.330 29.330 29.746 -0.416 17967
6763 1 18 . 1 1 36 36 LYS H H 34 7.860 7.860 7.712 0.148 17967
6764 1 18 . 1 1 37 37 GLN N N 35 120.710 120.710 117.707 3.003 17967
6765 1 18 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.475 -0.115 17967
6766 1 18 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.110 1.320 17967
6767 1 18 . 1 1 37 37 GLN CB C 35 29.630 29.630 29.509 0.120 17967
6768 1 18 . 1 1 37 37 GLN H H 35 8.270 8.270 7.959 0.311 17967
6769 1 18 . 1 1 38 38 GLN N N 36 123.710 123.710 127.412 -3.702 17967
6770 1 18 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.244 0.057 17967
6771 1 18 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.246 0.484 17967
6772 1 18 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.383 0.947 17967
6773 1 18 . 1 1 38 38 GLN H H 36 8.640 8.640 8.673 -0.033 17967
6774 1 18 . 1 1 39 39 LEU N N 37 131.310 131.310 125.959 5.351 17967
6775 1 18 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.057 0.053 17967
6776 1 18 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.787 1.543 17967
6777 1 18 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.342 -0.412 17967
6778 1 18 . 1 1 39 39 LEU H H 37 8.870 8.870 7.723 1.147 17967
6779 1 18 . 1 1 40 40 LEU N N 38 126.310 126.310 124.940 1.370 17967
6780 1 18 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.255 0.055 17967
6781 1 18 . 1 1 40 40 LEU CA C 38 54.230 54.230 55.139 -0.909 17967
6782 1 18 . 1 1 40 40 LEU CB C 38 43.130 43.130 42.939 0.191 17967
6783 1 18 . 1 1 40 40 LEU H H 38 9.850 9.850 8.548 1.302 17967
6784 1 18 . 1 1 41 41 ARG N N 39 127.110 127.110 125.605 1.505 17967
6785 1 18 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.783 -0.263 17967
6786 1 18 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.717 -1.887 17967
6787 1 18 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.786 -2.856 17967
6788 1 18 . 1 1 41 41 ARG H H 39 8.970 8.970 8.895 0.075 17967
6789 1 18 . 1 1 42 42 ARG N N 40 115.810 115.810 117.537 -1.727 17967
6790 1 18 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.364 -0.284 17967
6791 1 18 . 1 1 42 42 ARG CA C 40 59.130 59.130 58.905 0.225 17967
6792 1 18 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.067 0.263 17967
6793 1 18 . 1 1 42 42 ARG H H 40 8.610 8.610 8.594 0.016 17967
6794 1 18 . 1 1 43 43 GLU N N 41 119.910 119.910 119.505 0.405 17967
6795 1 18 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.517 -0.267 17967
6796 1 18 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.553 0.477 17967
6797 1 18 . 1 1 43 43 GLU CB C 41 30.330 30.330 28.965 1.365 17967
6798 1 18 . 1 1 43 43 GLU H H 41 6.950 6.950 7.846 -0.896 17967
6799 1 18 . 1 1 44 44 VAL N N 42 125.010 125.010 120.220 4.790 17967
6800 1 18 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.608 -0.368 17967
6801 1 18 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.296 1.334 17967
6802 1 18 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.302 0.028 17967
6803 1 18 . 1 1 44 44 VAL H H 42 7.820 7.820 8.022 -0.202 17967
6804 1 18 . 1 1 45 45 TYR N N 43 118.410 118.410 118.858 -0.448 17967
6805 1 18 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.116 0.314 17967
6806 1 18 . 1 1 45 45 TYR CA C 43 58.830 58.830 61.735 -2.905 17967
6807 1 18 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.637 -0.907 17967
6808 1 18 . 1 1 45 45 TYR H H 43 7.820 7.820 8.149 -0.329 17967
6809 1 18 . 1 1 46 46 ASP N N 44 122.410 122.410 119.713 2.697 17967
6810 1 18 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.330 0.270 17967
6811 1 18 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.733 0.097 17967
6812 1 18 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.152 0.878 17967
6813 1 18 . 1 1 46 46 ASP H H 44 8.540 8.540 8.164 0.376 17967
6814 1 18 . 1 1 47 47 PHE N N 45 126.210 126.210 119.689 6.521 17967
6815 1 18 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.042 -0.132 17967
6816 1 18 . 1 1 47 47 PHE CA C 45 62.630 62.630 62.093 0.537 17967
6817 1 18 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.038 0.292 17967
6818 1 18 . 1 1 47 47 PHE H H 45 8.320 8.320 7.579 0.741 17967
6819 1 18 . 1 1 48 48 ALA N N 46 119.110 119.110 119.286 -0.176 17967
6820 1 18 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.366 0.154 17967
6821 1 18 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.603 0.627 17967
6822 1 18 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.734 -0.004 17967
6823 1 18 . 1 1 48 48 ALA H H 46 7.740 7.740 7.759 -0.019 17967
6824 1 18 . 1 1 49 49 ARG N N 47 124.010 124.010 118.035 5.975 17967
6825 1 18 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.306 -0.256 17967
6826 1 18 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.559 2.071 17967
6827 1 18 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.446 -0.016 17967
6828 1 18 . 1 1 49 49 ARG H H 47 8.500 8.500 8.219 0.281 17967
6829 1 18 . 1 1 50 50 ARG N N 48 119.110 119.110 118.382 0.728 17967
6830 1 18 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.492 -0.482 17967
6831 1 18 . 1 1 50 50 ARG CA C 48 57.130 57.130 55.030 2.100 17967
6832 1 18 . 1 1 50 50 ARG CB C 48 31.130 31.130 31.530 -0.400 17967
6833 1 18 . 1 1 50 50 ARG H H 48 7.940 7.940 7.932 0.008 17967
6834 1 18 . 1 1 51 51 ASP N N 49 120.910 120.910 119.688 1.222 17967
6835 1 18 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.722 -0.302 17967
6836 1 18 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.654 0.876 17967
6837 1 18 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.583 -0.653 17967
6838 1 18 . 1 1 51 51 ASP H H 49 7.950 7.950 8.307 -0.357 17967
6839 1 18 . 1 1 52 52 LEU N N 50 118.410 118.410 122.870 -4.460 17967
6840 1 18 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.507 -0.357 17967
6841 1 18 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.575 0.655 17967
6842 1 18 . 1 1 52 52 LEU CB C 50 41.130 41.130 43.118 -1.988 17967
6843 1 18 . 1 1 52 52 LEU H H 50 6.640 6.640 7.662 -1.022 17967
6844 1 18 . 1 1 53 53 CYS N N 51 117.410 117.410 116.699 0.711 17967
6845 1 18 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.341 -0.411 17967
6846 1 18 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.306 2.624 17967
6847 1 18 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.422 -1.792 17967
6848 1 18 . 1 1 53 53 CYS H H 51 8.030 8.030 8.038 -0.008 17967
6849 1 18 . 1 1 54 54 ILE N N 52 125.110 125.110 123.820 1.290 17967
6850 1 18 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.327 -0.317 17967
6851 1 18 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.788 -2.158 17967
6852 1 18 . 1 1 54 54 ILE CB C 52 37.330 37.330 39.100 -1.770 17967
6853 1 18 . 1 1 54 54 ILE H H 52 8.500 8.500 8.984 -0.484 17967
6854 1 18 . 1 1 55 55 VAL N N 53 127.010 127.010 122.374 4.636 17967
6855 1 18 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.554 -0.184 17967
6856 1 18 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.102 0.528 17967
6857 1 18 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.587 1.643 17967
6858 1 18 . 1 1 55 55 VAL H H 53 8.130 8.130 8.199 -0.069 17967
6859 1 18 . 1 1 56 56 TYR N N 54 124.910 124.910 127.184 -2.274 17967
6860 1 18 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.290 0.110 17967
6861 1 18 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.740 -0.410 17967
6862 1 18 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.377 1.653 17967
6863 1 18 . 1 1 56 56 TYR H H 54 8.700 8.700 8.641 0.059 17967
6864 1 18 . 1 1 57 57 ARG N N 55 123.810 123.810 124.983 -1.173 17967
6865 1 18 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.414 0.226 17967
6866 1 18 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.868 -0.438 17967
6867 1 18 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.354 2.476 17967
6868 1 18 . 1 1 57 57 ARG H H 55 8.870 8.870 8.370 0.500 17967
6869 1 18 . 1 1 58 58 ASP N N 56 129.110 129.110 124.027 5.083 17967
6870 1 18 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.321 -0.011 17967
6871 1 18 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.819 -0.989 17967
6872 1 18 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.239 -0.109 17967
6873 1 18 . 1 1 58 58 ASP H H 56 9.620 9.620 8.916 0.704 17967
6874 1 18 . 1 1 59 59 GLY N N 57 104.510 104.510 105.530 -1.020 17967
6875 1 18 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.301 0.329 17967
6876 1 18 . 1 1 59 59 GLY H H 57 8.720 8.720 8.446 0.274 17967
6877 1 18 . 1 1 60 60 ASN N N 58 122.210 122.210 120.174 2.036 17967
6878 1 18 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.591 -0.191 17967
6879 1 18 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.713 -0.383 17967
6880 1 18 . 1 1 60 60 ASN CB C 58 40.430 40.430 40.232 0.198 17967
6881 1 18 . 1 1 60 60 ASN H H 58 8.120 8.120 8.134 -0.014 17967
6882 1 18 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.532 0.258 17967
6883 1 18 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.273 -0.243 17967
6884 1 18 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.356 2.174 17967
6885 1 18 . 1 1 62 62 TYR N N 60 119.810 119.810 122.809 -2.999 17967
6886 1 18 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.592 -0.232 17967
6887 1 18 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.318 1.912 17967
6888 1 18 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.447 0.983 17967
6889 1 18 . 1 1 62 62 TYR H H 60 8.590 8.590 7.624 0.966 17967
6890 1 18 . 1 1 63 63 ALA N N 61 123.810 123.810 122.305 1.505 17967
6891 1 18 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.287 0.133 17967
6892 1 18 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.346 -0.016 17967
6893 1 18 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.762 -0.432 17967
6894 1 18 . 1 1 63 63 ALA H H 61 8.010 8.010 8.889 -0.879 17967
6895 1 18 . 1 1 64 64 VAL N N 62 120.510 120.510 117.846 2.664 17967
6896 1 18 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.273 1.227 17967
6897 1 18 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.044 0.186 17967
6898 1 18 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.442 2.888 17967
6899 1 18 . 1 1 64 64 VAL H H 62 6.380 6.380 8.456 -2.076 17967
6900 1 18 . 1 1 65 65 CYS N N 63 130.310 130.310 124.493 5.817 17967
6901 1 18 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.478 0.082 17967
6902 1 18 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.066 0.364 17967
6903 1 18 . 1 1 65 65 CYS CB C 63 31.130 31.130 29.654 1.476 17967
6904 1 18 . 1 1 65 65 CYS H H 63 9.430 9.430 8.241 1.189 17967
6905 1 18 . 1 1 66 66 ASP N N 64 121.110 121.110 120.244 0.866 17967
6906 1 18 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.290 0.120 17967
6907 1 18 . 1 1 66 66 ASP CA C 64 58.230 58.230 57.951 0.279 17967
6908 1 18 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.969 1.361 17967
6909 1 18 . 1 1 66 66 ASP H H 64 9.120 9.120 8.804 0.316 17967
6910 1 18 . 1 1 67 67 LYS N N 65 122.110 122.110 119.301 2.809 17967
6911 1 18 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.962 0.048 17967
6912 1 18 . 1 1 67 67 LYS CA C 65 60.130 60.130 57.916 2.214 17967
6913 1 18 . 1 1 67 67 LYS CB C 65 32.830 32.830 31.551 1.279 17967
6914 1 18 . 1 1 67 67 LYS H H 65 8.330 8.330 7.545 0.785 17967
6915 1 18 . 1 1 68 68 CYS N N 66 125.610 125.610 119.753 5.857 17967
6916 1 18 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.065 0.045 17967
6917 1 18 . 1 1 68 68 CYS CA C 66 63.530 63.530 63.573 -0.043 17967
6918 1 18 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.173 4.557 17967
6919 1 18 . 1 1 68 68 CYS H H 66 8.700 8.700 7.797 0.903 17967
6920 1 18 . 1 1 69 69 LEU N N 67 125.310 125.310 120.160 5.150 17967
6921 1 18 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.026 -0.026 17967
6922 1 18 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.624 -0.094 17967
6923 1 18 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.909 0.221 17967
6924 1 18 . 1 1 69 69 LEU H H 67 8.470 8.470 8.551 -0.081 17967
6925 1 18 . 1 1 70 70 LYS N N 68 119.010 119.010 118.798 0.212 17967
6926 1 18 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.340 -0.360 17967
6927 1 18 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.401 0.429 17967
6928 1 18 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.985 0.145 17967
6929 1 18 . 1 1 70 70 LYS H H 68 7.810 7.810 7.458 0.352 17967
6930 1 18 . 1 1 71 71 PHE N N 69 121.710 121.710 120.621 1.089 17967
6931 1 18 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.198 0.082 17967
6932 1 18 . 1 1 71 71 PHE CA C 69 59.930 59.930 59.174 0.756 17967
6933 1 18 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.741 0.689 17967
6934 1 18 . 1 1 71 71 PHE H H 69 7.810 7.810 7.678 0.132 17967
6935 1 18 . 1 1 72 72 TYR N N 70 120.110 120.110 114.916 5.194 17967
6936 1 18 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.680 -0.360 17967
6937 1 18 . 1 1 72 72 TYR CA C 70 60.330 60.330 57.465 2.865 17967
6938 1 18 . 1 1 72 72 TYR CB C 70 40.430 40.430 37.140 3.290 17967
6939 1 18 . 1 1 72 72 TYR H H 70 8.280 8.280 8.583 -0.303 17967
6940 1 18 . 1 1 73 73 SER N N 71 117.210 117.210 116.805 0.405 17967
6941 1 18 . 1 1 73 73 SER HA H 71 4.320 4.320 4.283 0.037 17967
6942 1 18 . 1 1 73 73 SER CA C 71 60.130 60.130 61.629 -1.499 17967
6943 1 18 . 1 1 73 73 SER CB C 71 63.630 63.630 63.238 0.392 17967
6944 1 18 . 1 1 73 73 SER H H 71 7.870 7.870 7.771 0.099 17967
6945 1 18 . 1 1 74 74 LYS N N 72 122.810 122.810 120.416 2.394 17967
6946 1 18 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.388 -0.118 17967
6947 1 18 . 1 1 74 74 LYS CA C 72 56.930 56.930 56.955 -0.025 17967
6948 1 18 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.958 -0.328 17967
6949 1 18 . 1 1 74 74 LYS H H 72 7.800 7.800 8.457 -0.657 17967
6950 1 18 . 1 1 75 75 ILE N N 73 121.610 121.610 117.730 3.880 17967
6951 1 18 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.312 -0.202 17967
6952 1 18 . 1 1 75 75 ILE CA C 73 61.830 61.830 62.148 -0.318 17967
6953 1 18 . 1 1 75 75 ILE CB C 73 38.630 38.630 35.676 2.954 17967
6954 1 18 . 1 1 75 75 ILE H H 73 7.750 7.750 8.107 -0.357 17967
6955 1 18 . 1 1 76 76 SER N N 74 120.410 120.410 120.572 -0.162 17967
6956 1 18 . 1 1 76 76 SER HA H 74 4.300 4.300 4.685 -0.385 17967
6957 1 18 . 1 1 76 76 SER CA C 74 59.330 59.330 59.178 0.152 17967
6958 1 18 . 1 1 76 76 SER CB C 74 63.830 63.830 64.372 -0.542 17967
6959 1 18 . 1 1 76 76 SER H H 74 8.130 8.130 8.826 -0.696 17967
6960 1 18 . 1 1 77 77 GLU N N 75 123.810 123.810 123.763 0.047 17967
6961 1 18 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.211 -0.021 17967
6962 1 18 . 1 1 77 77 GLU CA C 75 57.330 57.330 57.621 -0.291 17967
6963 1 18 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.590 -0.460 17967
6964 1 18 . 1 1 77 77 GLU H H 75 8.270 8.270 7.858 0.412 17967
6965 1 18 . 1 1 78 78 TYR N N 76 122.410 122.410 121.961 0.449 17967
6966 1 18 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.248 0.212 17967
6967 1 18 . 1 1 78 78 TYR CA C 76 58.130 58.130 60.219 -2.089 17967
6968 1 18 . 1 1 78 78 TYR CB C 76 38.630 38.630 38.097 0.533 17967
6969 1 18 . 1 1 78 78 TYR H H 76 7.980 7.980 7.888 0.092 17967
6970 1 18 . 1 1 79 79 ARG N N 77 124.710 124.710 124.082 0.628 17967
6971 1 18 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.331 -0.131 17967
6972 1 18 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.514 0.515 17967
6973 1 18 . 1 1 79 79 ARG CB C 77 31.030 31.030 31.184 -0.154 17967
6974 1 18 . 1 1 79 79 ARG H H 77 7.880 7.880 8.330 -0.450 17967
6975 1 18 . 1 1 80 80 HIS N N 78 122.110 122.110 119.484 2.626 17967
6976 1 18 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.734 -0.224 17967
6977 1 18 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.630 0.700 17967
6978 1 18 . 1 1 80 80 HIS CB C 78 30.830 30.830 30.651 0.179 17967
6979 1 18 . 1 1 80 80 HIS H H 78 8.120 8.120 7.357 0.763 17967
6980 1 18 . 1 1 81 81 TYR N N 79 123.610 123.610 123.323 0.287 17967
6981 1 18 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.496 0.094 17967
6982 1 18 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.084 0.746 17967
6983 1 18 . 1 1 81 81 TYR CB C 79 39.130 39.130 40.275 -1.145 17967
6984 1 18 . 1 1 81 81 TYR H H 79 7.970 7.970 8.317 -0.347 17967
6985 1 19 . 1 1 2 2 ALA HA H 0 4.290 4.290 3.904 0.386 17967
6986 1 19 . 1 1 2 2 ALA CA C 0 52.530 52.530 53.895 -1.365 17967
6987 1 19 . 1 1 2 2 ALA CB C 0 19.730 19.730 18.055 1.675 17967
6988 1 19 . 1 1 3 3 MET N N 1 122.210 122.210 119.474 2.736 17967
6989 1 19 . 1 1 3 3 MET HA H 1 4.300 4.300 5.025 -0.725 17967
6990 1 19 . 1 1 3 3 MET CA C 1 56.030 56.030 54.517 1.513 17967
6991 1 19 . 1 1 3 3 MET CB C 1 33.430 33.430 33.673 -0.243 17967
6992 1 19 . 1 1 3 3 MET H H 1 8.370 8.370 7.700 0.670 17967
6993 1 19 . 1 1 4 4 PHE N N 2 122.310 122.310 127.907 -5.597 17967
6994 1 19 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.816 -0.186 17967
6995 1 19 . 1 1 4 4 PHE CA C 2 57.330 57.330 55.194 2.135 17967
6996 1 19 . 1 1 4 4 PHE CB C 2 39.430 39.430 40.674 -1.244 17967
6997 1 19 . 1 1 4 4 PHE H H 2 8.370 8.370 8.569 -0.199 17967
6998 1 19 . 1 1 5 5 GLN N N 3 123.510 123.510 125.526 -2.016 17967
6999 1 19 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.522 -0.342 17967
7000 1 19 . 1 1 5 5 GLN CA C 3 56.130 56.130 53.601 2.529 17967
7001 1 19 . 1 1 5 5 GLN CB C 3 29.930 29.930 30.846 -0.916 17967
7002 1 19 . 1 1 5 5 GLN H H 3 8.260 8.260 8.542 -0.282 17967
7003 1 19 . 1 1 6 6 ASP N N 4 125.010 125.010 120.984 4.026 17967
7004 1 19 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.577 0.213 17967
7005 1 19 . 1 1 6 6 ASP CA C 4 51.930 51.930 51.560 0.370 17967
7006 1 19 . 1 1 6 6 ASP CB C 4 41.730 41.730 40.482 1.248 17967
7007 1 19 . 1 1 6 6 ASP H H 4 8.420 8.420 8.154 0.266 17967
7008 1 19 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.218 -0.098 17967
7009 1 19 . 1 1 7 7 PRO CA C 5 64.030 64.030 64.218 -0.188 17967
7010 1 19 . 1 1 7 7 PRO CB C 5 32.330 32.330 31.854 0.476 17967
7011 1 19 . 1 1 8 8 GLN N N 6 119.710 119.710 118.182 1.528 17967
7012 1 19 . 1 1 8 8 GLN HA H 6 4.160 4.160 3.975 0.185 17967
7013 1 19 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.422 1.208 17967
7014 1 19 . 1 1 8 8 GLN CB C 6 29.330 29.330 25.943 3.387 17967
7015 1 19 . 1 1 8 8 GLN H H 6 8.430 8.430 7.994 0.436 17967
7016 1 19 . 1 1 9 9 GLU N N 7 122.110 122.110 120.247 1.863 17967
7017 1 19 . 1 1 9 9 GLU HA H 7 4.200 4.200 3.726 0.474 17967
7018 1 19 . 1 1 9 9 GLU CA C 7 56.030 56.030 58.069 -2.039 17967
7019 1 19 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.890 0.641 17967
7020 1 19 . 1 1 9 9 GLU H H 7 7.940 7.940 8.351 -0.411 17967
7021 1 19 . 1 1 10 10 ARG N N 8 123.410 123.410 114.635 8.775 17967
7022 1 19 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.130 0.270 17967
7023 1 19 . 1 1 10 10 ARG CA C 8 54.130 54.130 55.805 -1.675 17967
7024 1 19 . 1 1 10 10 ARG CB C 8 29.330 29.330 28.332 0.998 17967
7025 1 19 . 1 1 10 10 ARG H H 8 7.660 7.660 7.457 0.203 17967
7026 1 19 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.564 -0.214 17967
7027 1 19 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.711 0.819 17967
7028 1 19 . 1 1 11 11 PRO CB C 9 32.630 32.630 32.801 -0.171 17967
7029 1 19 . 1 1 12 12 ARG N N 10 123.810 123.810 116.156 7.654 17967
7030 1 19 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.804 -0.134 17967
7031 1 19 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.771 1.059 17967
7032 1 19 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.647 0.883 17967
7033 1 19 . 1 1 12 12 ARG H H 10 8.710 8.710 8.656 0.054 17967
7034 1 19 . 1 1 13 13 LYS N N 11 118.410 118.410 119.173 -0.763 17967
7035 1 19 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.842 0.208 17967
7036 1 19 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.643 -1.313 17967
7037 1 19 . 1 1 13 13 LYS CB C 11 35.430 35.430 35.296 0.134 17967
7038 1 19 . 1 1 13 13 LYS H H 11 7.800 7.800 7.591 0.209 17967
7039 1 19 . 1 1 14 14 LEU N N 12 125.010 125.010 125.819 -0.809 17967
7040 1 19 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.213 -0.043 17967
7041 1 19 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.609 0.121 17967
7042 1 19 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.854 0.676 17967
7043 1 19 . 1 1 14 14 LEU H H 12 10.210 10.210 9.373 0.837 17967
7044 1 19 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.254 -0.034 17967
7045 1 19 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.785 1.445 17967
7046 1 19 . 1 1 15 15 PRO CB C 13 30.730 30.730 30.971 -0.241 17967
7047 1 19 . 1 1 16 16 GLN N N 14 117.810 117.810 117.429 0.381 17967
7048 1 19 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.134 0.056 17967
7049 1 19 . 1 1 16 16 GLN CA C 14 59.030 59.030 59.035 -0.005 17967
7050 1 19 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.238 0.392 17967
7051 1 19 . 1 1 16 16 GLN H H 14 7.110 7.110 8.424 -1.313 17967
7052 1 19 . 1 1 17 17 LEU N N 15 124.710 124.710 122.322 2.388 17967
7053 1 19 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.192 -0.182 17967
7054 1 19 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.883 0.447 17967
7055 1 19 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.726 0.304 17967
7056 1 19 . 1 1 17 17 LEU H H 15 8.010 8.010 8.239 -0.229 17967
7057 1 19 . 1 1 18 18 CYS N N 16 117.210 117.210 117.412 -0.202 17967
7058 1 19 . 1 1 18 18 CYS HA H 16 3.750 3.750 3.958 -0.208 17967
7059 1 19 . 1 1 18 18 CYS CA C 16 64.730 64.730 64.081 0.649 17967
7060 1 19 . 1 1 18 18 CYS CB C 16 26.230 26.230 26.065 0.165 17967
7061 1 19 . 1 1 18 18 CYS H H 16 8.380 8.380 8.304 0.076 17967
7062 1 19 . 1 1 19 19 THR N N 17 117.810 117.810 116.613 1.197 17967
7063 1 19 . 1 1 19 19 THR HA H 17 4.000 4.000 3.954 0.046 17967
7064 1 19 . 1 1 19 19 THR CA C 17 66.830 66.830 67.148 -0.318 17967
7065 1 19 . 1 1 19 19 THR CB C 17 68.830 68.830 68.608 0.222 17967
7066 1 19 . 1 1 19 19 THR H H 17 7.720 7.720 7.799 -0.079 17967
7067 1 19 . 1 1 20 20 GLU N N 18 125.410 125.410 121.038 4.372 17967
7068 1 19 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.191 -0.121 17967
7069 1 19 . 1 1 20 20 GLU CA C 18 59.730 59.730 59.008 0.722 17967
7070 1 19 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.679 0.051 17967
7071 1 19 . 1 1 20 20 GLU H H 18 8.010 8.010 7.576 0.434 17967
7072 1 19 . 1 1 21 21 LEU N N 19 118.810 118.810 116.349 2.461 17967
7073 1 19 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.174 0.126 17967
7074 1 19 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.196 -0.366 17967
7075 1 19 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.674 0.656 17967
7076 1 19 . 1 1 21 21 LEU H H 19 8.010 8.010 8.018 -0.008 17967
7077 1 19 . 1 1 22 22 GLN N N 20 118.310 118.310 115.541 2.769 17967
7078 1 19 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.025 -0.075 17967
7079 1 19 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.127 -0.397 17967
7080 1 19 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.282 -0.152 17967
7081 1 19 . 1 1 22 22 GLN H H 20 7.860 7.860 7.852 0.008 17967
7082 1 19 . 1 1 23 23 THR N N 21 115.910 115.910 111.695 4.215 17967
7083 1 19 . 1 1 23 23 THR HA H 21 4.950 4.950 4.614 0.336 17967
7084 1 19 . 1 1 23 23 THR CA C 21 58.530 58.530 59.679 -1.149 17967
7085 1 19 . 1 1 23 23 THR CB C 21 70.330 70.330 70.309 0.021 17967
7086 1 19 . 1 1 23 23 THR H H 21 8.250 8.250 8.225 0.025 17967
7087 1 19 . 1 1 24 24 THR N N 22 112.810 112.810 114.157 -1.347 17967
7088 1 19 . 1 1 24 24 THR HA H 22 4.880 4.880 4.614 0.266 17967
7089 1 19 . 1 1 24 24 THR CA C 22 59.730 59.730 59.905 -0.175 17967
7090 1 19 . 1 1 24 24 THR CB C 22 74.130 74.130 71.642 2.488 17967
7091 1 19 . 1 1 24 24 THR H H 22 8.660 8.660 7.844 0.816 17967
7092 1 19 . 1 1 25 25 ILE N N 23 123.710 123.710 121.409 2.301 17967
7093 1 19 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.622 0.158 17967
7094 1 19 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.495 -1.065 17967
7095 1 19 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.607 1.023 17967
7096 1 19 . 1 1 25 25 ILE H H 23 9.060 9.060 8.439 0.621 17967
7097 1 19 . 1 1 26 26 HIS N N 24 119.510 119.510 114.999 4.511 17967
7098 1 19 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.829 -0.389 17967
7099 1 19 . 1 1 26 26 HIS CA C 24 57.030 57.030 56.203 0.827 17967
7100 1 19 . 1 1 26 26 HIS CB C 24 30.830 30.830 28.981 1.849 17967
7101 1 19 . 1 1 26 26 HIS H H 24 7.040 7.040 7.546 -0.506 17967
7102 1 19 . 1 1 27 27 ASP N N 25 116.810 116.810 117.700 -0.890 17967
7103 1 19 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.616 0.144 17967
7104 1 19 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.355 0.075 17967
7105 1 19 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.296 1.034 17967
7106 1 19 . 1 1 27 27 ASP H H 25 7.250 7.250 7.556 -0.306 17967
7107 1 19 . 1 1 28 28 ILE N N 26 123.210 123.210 122.344 0.866 17967
7108 1 19 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.863 0.067 17967
7109 1 19 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.432 0.598 17967
7110 1 19 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.722 -0.792 17967
7111 1 19 . 1 1 28 28 ILE H H 26 7.750 7.750 7.911 -0.161 17967
7112 1 19 . 1 1 29 29 ILE N N 27 131.110 131.110 128.690 2.420 17967
7113 1 19 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.176 0.204 17967
7114 1 19 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.872 -1.042 17967
7115 1 19 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.558 1.072 17967
7116 1 19 . 1 1 29 29 ILE H H 27 8.270 8.270 8.408 -0.138 17967
7117 1 19 . 1 1 30 30 LEU N N 28 129.410 129.410 129.471 -0.061 17967
7118 1 19 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.672 -0.012 17967
7119 1 19 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.390 -0.860 17967
7120 1 19 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.185 3.145 17967
7121 1 19 . 1 1 30 30 LEU H H 28 8.500 8.500 8.483 0.017 17967
7122 1 19 . 1 1 31 31 GLU N N 29 121.910 121.910 121.494 0.416 17967
7123 1 19 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.781 -0.101 17967
7124 1 19 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.389 0.541 17967
7125 1 19 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.337 0.694 17967
7126 1 19 . 1 1 31 31 GLU H H 29 8.860 8.860 8.273 0.587 17967
7127 1 19 . 1 1 32 32 CYS N N 30 125.710 125.710 120.050 5.660 17967
7128 1 19 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.921 -0.901 17967
7129 1 19 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.431 -1.201 17967
7130 1 19 . 1 1 32 32 CYS CB C 30 31.730 31.730 27.199 4.531 17967
7131 1 19 . 1 1 32 32 CYS H H 30 8.270 8.270 8.491 -0.221 17967
7132 1 19 . 1 1 33 33 VAL N N 31 132.310 132.310 127.959 4.351 17967
7133 1 19 . 1 1 33 33 VAL HA H 31 3.100 3.100 3.182 -0.082 17967
7134 1 19 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.521 -1.291 17967
7135 1 19 . 1 1 33 33 VAL CB C 31 31.630 31.630 32.022 -0.392 17967
7136 1 19 . 1 1 33 33 VAL H H 31 8.860 8.860 7.899 0.961 17967
7137 1 19 . 1 1 34 34 TYR N N 32 124.310 124.310 115.280 9.030 17967
7138 1 19 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.650 -0.210 17967
7139 1 19 . 1 1 34 34 TYR CA C 32 61.030 61.030 59.353 1.677 17967
7140 1 19 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.447 1.683 17967
7141 1 19 . 1 1 34 34 TYR H H 32 8.590 8.590 7.252 1.338 17967
7142 1 19 . 1 1 35 35 CYS N N 33 119.810 119.810 114.795 5.015 17967
7143 1 19 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.647 0.193 17967
7144 1 19 . 1 1 35 35 CYS CA C 33 59.430 59.430 58.352 1.078 17967
7145 1 19 . 1 1 35 35 CYS CB C 33 32.230 32.230 27.813 4.417 17967
7146 1 19 . 1 1 35 35 CYS H H 33 8.070 8.070 7.702 0.368 17967
7147 1 19 . 1 1 36 36 LYS N N 34 119.910 119.910 115.614 4.296 17967
7148 1 19 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.960 0.230 17967
7149 1 19 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.301 0.529 17967
7150 1 19 . 1 1 36 36 LYS CB C 34 29.330 29.330 30.405 -1.075 17967
7151 1 19 . 1 1 36 36 LYS H H 34 7.860 7.860 7.878 -0.018 17967
7152 1 19 . 1 1 37 37 GLN N N 35 120.710 120.710 115.770 4.940 17967
7153 1 19 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.359 0.001 17967
7154 1 19 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.300 1.130 17967
7155 1 19 . 1 1 37 37 GLN CB C 35 29.630 29.630 29.564 0.065 17967
7156 1 19 . 1 1 37 37 GLN H H 35 8.270 8.270 7.674 0.596 17967
7157 1 19 . 1 1 38 38 GLN N N 36 123.710 123.710 122.002 1.708 17967
7158 1 19 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.153 0.147 17967
7159 1 19 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.500 0.230 17967
7160 1 19 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.857 0.473 17967
7161 1 19 . 1 1 38 38 GLN H H 36 8.640 8.640 8.546 0.094 17967
7162 1 19 . 1 1 39 39 LEU N N 37 131.310 131.310 127.392 3.918 17967
7163 1 19 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.139 -0.029 17967
7164 1 19 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.844 1.486 17967
7165 1 19 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.372 -0.442 17967
7166 1 19 . 1 1 39 39 LEU H H 37 8.870 8.870 7.938 0.932 17967
7167 1 19 . 1 1 40 40 LEU N N 38 126.310 126.310 123.522 2.788 17967
7168 1 19 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.273 0.037 17967
7169 1 19 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.805 -0.575 17967
7170 1 19 . 1 1 40 40 LEU CB C 38 43.130 43.130 42.985 0.145 17967
7171 1 19 . 1 1 40 40 LEU H H 38 9.850 9.850 8.198 1.652 17967
7172 1 19 . 1 1 41 41 ARG N N 39 127.110 127.110 125.824 1.286 17967
7173 1 19 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.757 -0.237 17967
7174 1 19 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.186 -1.356 17967
7175 1 19 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.121 -2.191 17967
7176 1 19 . 1 1 41 41 ARG H H 39 8.970 8.970 8.924 0.046 17967
7177 1 19 . 1 1 42 42 ARG N N 40 115.810 115.810 117.236 -1.426 17967
7178 1 19 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.332 -0.252 17967
7179 1 19 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.086 0.044 17967
7180 1 19 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.209 0.121 17967
7181 1 19 . 1 1 42 42 ARG H H 40 8.610 8.610 8.533 0.077 17967
7182 1 19 . 1 1 43 43 GLU N N 41 119.910 119.910 119.818 0.092 17967
7183 1 19 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.503 -0.253 17967
7184 1 19 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.630 0.400 17967
7185 1 19 . 1 1 43 43 GLU CB C 41 30.330 30.330 28.782 1.548 17967
7186 1 19 . 1 1 43 43 GLU H H 41 6.950 6.950 7.834 -0.884 17967
7187 1 19 . 1 1 44 44 VAL N N 42 125.010 125.010 120.161 4.849 17967
7188 1 19 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.601 -0.361 17967
7189 1 19 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.482 1.148 17967
7190 1 19 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.343 -0.013 17967
7191 1 19 . 1 1 44 44 VAL H H 42 7.820 7.820 7.982 -0.162 17967
7192 1 19 . 1 1 45 45 TYR N N 43 118.410 118.410 118.457 -0.047 17967
7193 1 19 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.159 0.271 17967
7194 1 19 . 1 1 45 45 TYR CA C 43 58.830 58.830 60.566 -1.736 17967
7195 1 19 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.483 -0.753 17967
7196 1 19 . 1 1 45 45 TYR H H 43 7.820 7.820 7.766 0.054 17967
7197 1 19 . 1 1 46 46 ASP N N 44 122.410 122.410 119.851 2.559 17967
7198 1 19 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.354 0.246 17967
7199 1 19 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.816 0.014 17967
7200 1 19 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.227 0.803 17967
7201 1 19 . 1 1 46 46 ASP H H 44 8.540 8.540 8.004 0.536 17967
7202 1 19 . 1 1 47 47 PHE N N 45 126.210 126.210 119.479 6.731 17967
7203 1 19 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.057 -0.147 17967
7204 1 19 . 1 1 47 47 PHE CA C 45 62.630 62.630 62.208 0.422 17967
7205 1 19 . 1 1 47 47 PHE CB C 45 39.330 39.330 38.992 0.338 17967
7206 1 19 . 1 1 47 47 PHE H H 45 8.320 8.320 7.699 0.621 17967
7207 1 19 . 1 1 48 48 ALA N N 46 119.110 119.110 119.103 0.007 17967
7208 1 19 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.399 0.121 17967
7209 1 19 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.542 0.688 17967
7210 1 19 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.780 -0.050 17967
7211 1 19 . 1 1 48 48 ALA H H 46 7.740 7.740 7.712 0.028 17967
7212 1 19 . 1 1 49 49 ARG N N 47 124.010 124.010 117.976 6.034 17967
7213 1 19 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.308 -0.258 17967
7214 1 19 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.490 2.140 17967
7215 1 19 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.402 0.028 17967
7216 1 19 . 1 1 49 49 ARG H H 47 8.500 8.500 8.321 0.179 17967
7217 1 19 . 1 1 50 50 ARG N N 48 119.110 119.110 117.515 1.595 17967
7218 1 19 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.566 -0.556 17967
7219 1 19 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.575 2.555 17967
7220 1 19 . 1 1 50 50 ARG CB C 48 31.130 31.130 32.258 -1.128 17967
7221 1 19 . 1 1 50 50 ARG H H 48 7.940 7.940 7.914 0.026 17967
7222 1 19 . 1 1 51 51 ASP N N 49 120.910 120.910 119.835 1.075 17967
7223 1 19 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.808 -0.388 17967
7224 1 19 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.657 0.873 17967
7225 1 19 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.778 -0.848 17967
7226 1 19 . 1 1 51 51 ASP H H 49 7.950 7.950 8.412 -0.462 17967
7227 1 19 . 1 1 52 52 LEU N N 50 118.410 118.410 120.676 -2.266 17967
7228 1 19 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.235 -0.085 17967
7229 1 19 . 1 1 52 52 LEU CA C 50 54.230 54.230 55.372 -1.142 17967
7230 1 19 . 1 1 52 52 LEU CB C 50 41.130 41.130 42.271 -1.141 17967
7231 1 19 . 1 1 52 52 LEU H H 50 6.640 6.640 7.410 -0.770 17967
7232 1 19 . 1 1 53 53 CYS N N 51 117.410 117.410 117.601 -0.191 17967
7233 1 19 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.282 -0.352 17967
7234 1 19 . 1 1 53 53 CYS CA C 51 58.930 58.930 55.272 3.658 17967
7235 1 19 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.455 -1.825 17967
7236 1 19 . 1 1 53 53 CYS H H 51 8.030 8.030 8.122 -0.092 17967
7237 1 19 . 1 1 54 54 ILE N N 52 125.110 125.110 123.193 1.917 17967
7238 1 19 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.445 -0.435 17967
7239 1 19 . 1 1 54 54 ILE CA C 52 59.630 59.630 62.174 -2.544 17967
7240 1 19 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.851 -1.521 17967
7241 1 19 . 1 1 54 54 ILE H H 52 8.500 8.500 9.024 -0.524 17967
7242 1 19 . 1 1 55 55 VAL N N 53 127.010 127.010 122.117 4.893 17967
7243 1 19 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.670 -0.300 17967
7244 1 19 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.721 -0.091 17967
7245 1 19 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.827 1.403 17967
7246 1 19 . 1 1 55 55 VAL H H 53 8.130 8.130 8.210 -0.080 17967
7247 1 19 . 1 1 56 56 TYR N N 54 124.910 124.910 126.827 -1.917 17967
7248 1 19 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.342 0.058 17967
7249 1 19 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.447 -0.117 17967
7250 1 19 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.295 1.735 17967
7251 1 19 . 1 1 56 56 TYR H H 54 8.700 8.700 8.764 -0.064 17967
7252 1 19 . 1 1 57 57 ARG N N 55 123.810 123.810 125.568 -1.758 17967
7253 1 19 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.434 0.206 17967
7254 1 19 . 1 1 57 57 ARG CA C 55 55.430 55.430 56.116 -0.686 17967
7255 1 19 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.433 2.397 17967
7256 1 19 . 1 1 57 57 ARG H H 55 8.870 8.870 8.528 0.342 17967
7257 1 19 . 1 1 58 58 ASP N N 56 129.110 129.110 125.251 3.859 17967
7258 1 19 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.365 -0.055 17967
7259 1 19 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.545 -0.715 17967
7260 1 19 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.606 -0.476 17967
7261 1 19 . 1 1 58 58 ASP H H 56 9.620 9.620 9.006 0.614 17967
7262 1 19 . 1 1 59 59 GLY N N 57 104.510 104.510 107.659 -3.149 17967
7263 1 19 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.387 0.243 17967
7264 1 19 . 1 1 59 59 GLY H H 57 8.720 8.720 8.581 0.139 17967
7265 1 19 . 1 1 60 60 ASN N N 58 122.210 122.210 118.484 3.726 17967
7266 1 19 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.276 0.124 17967
7267 1 19 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.717 -0.387 17967
7268 1 19 . 1 1 60 60 ASN CB C 58 40.430 40.430 41.540 -1.110 17967
7269 1 19 . 1 1 60 60 ASN H H 58 8.120 8.120 7.936 0.184 17967
7270 1 19 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.698 0.092 17967
7271 1 19 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.379 -0.349 17967
7272 1 19 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.318 2.212 17967
7273 1 19 . 1 1 62 62 TYR N N 60 119.810 119.810 122.828 -3.018 17967
7274 1 19 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.559 -0.199 17967
7275 1 19 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.393 1.837 17967
7276 1 19 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.458 0.972 17967
7277 1 19 . 1 1 62 62 TYR H H 60 8.590 8.590 7.706 0.884 17967
7278 1 19 . 1 1 63 63 ALA N N 61 123.810 123.810 121.750 2.060 17967
7279 1 19 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.206 0.214 17967
7280 1 19 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.350 -0.020 17967
7281 1 19 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.699 -0.369 17967
7282 1 19 . 1 1 63 63 ALA H H 61 8.010 8.010 8.892 -0.882 17967
7283 1 19 . 1 1 64 64 VAL N N 62 120.510 120.510 117.994 2.516 17967
7284 1 19 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.303 1.197 17967
7285 1 19 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.304 -0.074 17967
7286 1 19 . 1 1 64 64 VAL CB C 62 36.330 36.330 32.387 3.943 17967
7287 1 19 . 1 1 64 64 VAL H H 62 6.380 6.380 8.480 -2.100 17967
7288 1 19 . 1 1 65 65 CYS N N 63 130.310 130.310 125.782 4.528 17967
7289 1 19 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.399 0.161 17967
7290 1 19 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.438 -0.008 17967
7291 1 19 . 1 1 65 65 CYS CB C 63 31.130 31.130 28.743 2.387 17967
7292 1 19 . 1 1 65 65 CYS H H 63 9.430 9.430 8.117 1.313 17967
7293 1 19 . 1 1 66 66 ASP N N 64 121.110 121.110 121.024 0.086 17967
7294 1 19 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.207 0.203 17967
7295 1 19 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.435 -0.206 17967
7296 1 19 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.971 1.359 17967
7297 1 19 . 1 1 66 66 ASP H H 64 9.120 9.120 8.712 0.408 17967
7298 1 19 . 1 1 67 67 LYS N N 65 122.110 122.110 118.990 3.120 17967
7299 1 19 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.814 0.196 17967
7300 1 19 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.872 1.258 17967
7301 1 19 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.301 0.529 17967
7302 1 19 . 1 1 67 67 LYS H H 65 8.330 8.330 7.569 0.761 17967
7303 1 19 . 1 1 68 68 CYS N N 66 125.610 125.610 118.557 7.053 17967
7304 1 19 . 1 1 68 68 CYS HA H 66 4.110 4.110 3.981 0.129 17967
7305 1 19 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.171 1.359 17967
7306 1 19 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.319 4.411 17967
7307 1 19 . 1 1 68 68 CYS H H 66 8.700 8.700 7.459 1.241 17967
7308 1 19 . 1 1 69 69 LEU N N 67 125.310 125.310 121.690 3.620 17967
7309 1 19 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.001 -0.001 17967
7310 1 19 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.205 0.325 17967
7311 1 19 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.516 0.614 17967
7312 1 19 . 1 1 69 69 LEU H H 67 8.470 8.470 8.834 -0.364 17967
7313 1 19 . 1 1 70 70 LYS N N 68 119.010 119.010 117.647 1.363 17967
7314 1 19 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.165 -0.185 17967
7315 1 19 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.608 0.223 17967
7316 1 19 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.962 0.169 17967
7317 1 19 . 1 1 70 70 LYS H H 68 7.810 7.810 7.626 0.184 17967
7318 1 19 . 1 1 71 71 PHE N N 69 121.710 121.710 118.764 2.946 17967
7319 1 19 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.154 0.126 17967
7320 1 19 . 1 1 71 71 PHE CA C 69 59.930 59.930 58.705 1.225 17967
7321 1 19 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.781 0.650 17967
7322 1 19 . 1 1 71 71 PHE H H 69 7.810 7.810 7.224 0.586 17967
7323 1 19 . 1 1 72 72 TYR N N 70 120.110 120.110 117.859 2.251 17967
7324 1 19 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.747 -0.427 17967
7325 1 19 . 1 1 72 72 TYR CA C 70 60.330 60.330 56.660 3.670 17967
7326 1 19 . 1 1 72 72 TYR CB C 70 40.430 40.430 36.394 4.036 17967
7327 1 19 . 1 1 72 72 TYR H H 70 8.280 8.280 8.429 -0.149 17967
7328 1 19 . 1 1 73 73 SER N N 71 117.210 117.210 117.472 -0.262 17967
7329 1 19 . 1 1 73 73 SER HA H 71 4.320 4.320 4.406 -0.086 17967
7330 1 19 . 1 1 73 73 SER CA C 71 60.130 60.130 59.392 0.738 17967
7331 1 19 . 1 1 73 73 SER CB C 71 63.630 63.630 63.770 -0.140 17967
7332 1 19 . 1 1 73 73 SER H H 71 7.870 7.870 8.113 -0.243 17967
7333 1 19 . 1 1 74 74 LYS N N 72 122.810 122.810 121.385 1.425 17967
7334 1 19 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.163 0.107 17967
7335 1 19 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.557 -0.627 17967
7336 1 19 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.685 -0.055 17967
7337 1 19 . 1 1 74 74 LYS H H 72 7.800 7.800 8.287 -0.487 17967
7338 1 19 . 1 1 75 75 ILE N N 73 121.610 121.610 119.864 1.746 17967
7339 1 19 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.131 -0.021 17967
7340 1 19 . 1 1 75 75 ILE CA C 73 61.830 61.830 61.791 0.039 17967
7341 1 19 . 1 1 75 75 ILE CB C 73 38.630 38.630 37.386 1.244 17967
7342 1 19 . 1 1 75 75 ILE H H 73 7.750 7.750 7.977 -0.227 17967
7343 1 19 . 1 1 76 76 SER N N 74 120.410 120.410 123.326 -2.916 17967
7344 1 19 . 1 1 76 76 SER HA H 74 4.300 4.300 4.627 -0.327 17967
7345 1 19 . 1 1 76 76 SER CA C 74 59.330 59.330 57.185 2.145 17967
7346 1 19 . 1 1 76 76 SER CB C 74 63.830 63.830 65.352 -1.522 17967
7347 1 19 . 1 1 76 76 SER H H 74 8.130 8.130 8.269 -0.139 17967
7348 1 19 . 1 1 77 77 GLU N N 75 123.810 123.810 124.301 -0.491 17967
7349 1 19 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.073 0.117 17967
7350 1 19 . 1 1 77 77 GLU CA C 75 57.330 57.330 57.493 -0.163 17967
7351 1 19 . 1 1 77 77 GLU CB C 75 30.130 30.130 28.947 1.183 17967
7352 1 19 . 1 1 77 77 GLU H H 75 8.270 8.270 8.711 -0.441 17967
7353 1 19 . 1 1 78 78 TYR N N 76 122.410 122.410 125.843 -3.433 17967
7354 1 19 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.766 -0.306 17967
7355 1 19 . 1 1 78 78 TYR CA C 76 58.130 58.130 58.123 0.007 17967
7356 1 19 . 1 1 78 78 TYR CB C 76 38.630 38.630 39.334 -0.704 17967
7357 1 19 . 1 1 78 78 TYR H H 76 7.980 7.980 7.971 0.009 17967
7358 1 19 . 1 1 79 79 ARG N N 77 124.710 124.710 125.284 -0.574 17967
7359 1 19 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.529 -0.329 17967
7360 1 19 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.787 0.243 17967
7361 1 19 . 1 1 79 79 ARG CB C 77 31.030 31.030 30.746 0.284 17967
7362 1 19 . 1 1 79 79 ARG H H 77 7.880 7.880 8.486 -0.606 17967
7363 1 19 . 1 1 80 80 HIS N N 78 122.110 122.110 120.671 1.439 17967
7364 1 19 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.616 -0.106 17967
7365 1 19 . 1 1 80 80 HIS CA C 78 56.330 56.330 56.216 0.114 17967
7366 1 19 . 1 1 80 80 HIS CB C 78 30.830 30.830 28.498 2.332 17967
7367 1 19 . 1 1 80 80 HIS H H 78 8.120 8.120 7.892 0.228 17967
7368 1 19 . 1 1 81 81 TYR N N 79 123.610 123.610 125.336 -1.726 17967
7369 1 19 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.483 0.107 17967
7370 1 19 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.387 0.443 17967
7371 1 19 . 1 1 81 81 TYR CB C 79 39.130 39.130 40.875 -1.745 17967
7372 1 19 . 1 1 81 81 TYR H H 79 7.970 7.970 7.972 -0.002 17967
7373 1 20 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.445 -0.155 17967
7374 1 20 . 1 1 2 2 ALA CA C 0 52.530 52.530 51.732 0.798 17967
7375 1 20 . 1 1 2 2 ALA CB C 0 19.730 19.730 18.437 1.293 17967
7376 1 20 . 1 1 3 3 MET N N 1 122.210 122.210 124.258 -2.048 17967
7377 1 20 . 1 1 3 3 MET HA H 1 4.300 4.300 4.650 -0.350 17967
7378 1 20 . 1 1 3 3 MET CA C 1 56.030 56.030 53.583 2.447 17967
7379 1 20 . 1 1 3 3 MET CB C 1 33.430 33.430 31.032 2.398 17967
7380 1 20 . 1 1 3 3 MET H H 1 8.370 8.370 8.552 -0.182 17967
7381 1 20 . 1 1 4 4 PHE N N 2 122.310 122.310 124.861 -2.551 17967
7382 1 20 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.763 -0.133 17967
7383 1 20 . 1 1 4 4 PHE CA C 2 57.330 57.330 55.638 1.692 17967
7384 1 20 . 1 1 4 4 PHE CB C 2 39.430 39.430 41.125 -1.695 17967
7385 1 20 . 1 1 4 4 PHE H H 2 8.370 8.370 7.939 0.431 17967
7386 1 20 . 1 1 5 5 GLN N N 3 123.510 123.510 117.964 5.546 17967
7387 1 20 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.600 -0.420 17967
7388 1 20 . 1 1 5 5 GLN CA C 3 56.130 56.130 53.892 2.238 17967
7389 1 20 . 1 1 5 5 GLN CB C 3 29.930 29.930 30.615 -0.685 17967
7390 1 20 . 1 1 5 5 GLN H H 3 8.260 8.260 8.187 0.073 17967
7391 1 20 . 1 1 6 6 ASP N N 4 125.010 125.010 118.963 6.047 17967
7392 1 20 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.673 0.117 17967
7393 1 20 . 1 1 6 6 ASP CA C 4 51.930 51.930 52.669 -0.739 17967
7394 1 20 . 1 1 6 6 ASP CB C 4 41.730 41.730 41.005 0.725 17967
7395 1 20 . 1 1 6 6 ASP H H 4 8.420 8.420 8.592 -0.172 17967
7396 1 20 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.600 -0.480 17967
7397 1 20 . 1 1 7 7 PRO CA C 5 64.030 64.030 63.689 0.341 17967
7398 1 20 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.955 -0.625 17967
7399 1 20 . 1 1 8 8 GLN N N 6 119.710 119.710 117.803 1.907 17967
7400 1 20 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.194 -0.034 17967
7401 1 20 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.622 1.008 17967
7402 1 20 . 1 1 8 8 GLN CB C 6 29.330 29.330 28.443 0.887 17967
7403 1 20 . 1 1 8 8 GLN H H 6 8.430 8.430 8.309 0.121 17967
7404 1 20 . 1 1 9 9 GLU N N 7 122.110 122.110 120.271 1.839 17967
7405 1 20 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.096 0.104 17967
7406 1 20 . 1 1 9 9 GLU CA C 7 56.030 56.030 56.998 -0.968 17967
7407 1 20 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.863 0.667 17967
7408 1 20 . 1 1 9 9 GLU H H 7 7.940 7.940 8.514 -0.574 17967
7409 1 20 . 1 1 10 10 ARG N N 8 123.410 123.410 118.906 4.504 17967
7410 1 20 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.810 -0.410 17967
7411 1 20 . 1 1 10 10 ARG CA C 8 54.130 54.130 52.357 1.773 17967
7412 1 20 . 1 1 10 10 ARG CB C 8 29.330 29.330 29.040 0.291 17967
7413 1 20 . 1 1 10 10 ARG H H 8 7.660 7.660 7.708 -0.048 17967
7414 1 20 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.617 -0.267 17967
7415 1 20 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.275 1.255 17967
7416 1 20 . 1 1 11 11 PRO CB C 9 32.630 32.630 33.168 -0.538 17967
7417 1 20 . 1 1 12 12 ARG N N 10 123.810 123.810 119.819 3.991 17967
7418 1 20 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.593 0.077 17967
7419 1 20 . 1 1 12 12 ARG CA C 10 56.830 56.830 56.110 0.720 17967
7420 1 20 . 1 1 12 12 ARG CB C 10 32.530 32.530 30.611 1.919 17967
7421 1 20 . 1 1 12 12 ARG H H 10 8.710 8.710 8.793 -0.083 17967
7422 1 20 . 1 1 13 13 LYS N N 11 118.410 118.410 119.232 -0.822 17967
7423 1 20 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.720 0.330 17967
7424 1 20 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.337 -1.008 17967
7425 1 20 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.623 0.807 17967
7426 1 20 . 1 1 13 13 LYS H H 11 7.800 7.800 7.536 0.264 17967
7427 1 20 . 1 1 14 14 LEU N N 12 125.010 125.010 127.452 -2.442 17967
7428 1 20 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.204 -0.034 17967
7429 1 20 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.609 0.121 17967
7430 1 20 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.784 0.746 17967
7431 1 20 . 1 1 14 14 LEU H H 12 10.210 10.210 9.231 0.979 17967
7432 1 20 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.236 -0.016 17967
7433 1 20 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.521 1.709 17967
7434 1 20 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.118 -0.388 17967
7435 1 20 . 1 1 16 16 GLN N N 14 117.810 117.810 117.875 -0.065 17967
7436 1 20 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.124 0.066 17967
7437 1 20 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.915 0.115 17967
7438 1 20 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.347 0.283 17967
7439 1 20 . 1 1 16 16 GLN H H 14 7.110 7.110 8.322 -1.212 17967
7440 1 20 . 1 1 17 17 LEU N N 15 124.710 124.710 122.063 2.647 17967
7441 1 20 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.152 -0.142 17967
7442 1 20 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.711 0.619 17967
7443 1 20 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.684 0.346 17967
7444 1 20 . 1 1 17 17 LEU H H 15 8.010 8.010 8.091 -0.081 17967
7445 1 20 . 1 1 18 18 CYS N N 16 117.210 117.210 117.131 0.079 17967
7446 1 20 . 1 1 18 18 CYS HA H 16 3.750 3.750 3.953 -0.203 17967
7447 1 20 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.864 0.866 17967
7448 1 20 . 1 1 18 18 CYS CB C 16 26.230 26.230 26.114 0.116 17967
7449 1 20 . 1 1 18 18 CYS H H 16 8.380 8.380 8.554 -0.174 17967
7450 1 20 . 1 1 19 19 THR N N 17 117.810 117.810 115.655 2.155 17967
7451 1 20 . 1 1 19 19 THR HA H 17 4.000 4.000 4.060 -0.060 17967
7452 1 20 . 1 1 19 19 THR CA C 17 66.830 66.830 66.700 0.130 17967
7453 1 20 . 1 1 19 19 THR CB C 17 68.830 68.830 68.360 0.470 17967
7454 1 20 . 1 1 19 19 THR H H 17 7.720 7.720 7.763 -0.043 17967
7455 1 20 . 1 1 20 20 GLU N N 18 125.410 125.410 121.315 4.095 17967
7456 1 20 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.176 -0.106 17967
7457 1 20 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.731 0.999 17967
7458 1 20 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.685 0.045 17967
7459 1 20 . 1 1 20 20 GLU H H 18 8.010 8.010 7.680 0.330 17967
7460 1 20 . 1 1 21 21 LEU N N 19 118.810 118.810 117.415 1.395 17967
7461 1 20 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.336 -0.036 17967
7462 1 20 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.600 -0.770 17967
7463 1 20 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.696 0.635 17967
7464 1 20 . 1 1 21 21 LEU H H 19 8.010 8.010 7.864 0.146 17967
7465 1 20 . 1 1 22 22 GLN N N 20 118.310 118.310 114.061 4.249 17967
7466 1 20 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.093 -0.143 17967
7467 1 20 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.159 -0.429 17967
7468 1 20 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.174 -0.045 17967
7469 1 20 . 1 1 22 22 GLN H H 20 7.860 7.860 7.467 0.393 17967
7470 1 20 . 1 1 23 23 THR N N 21 115.910 115.910 112.636 3.274 17967
7471 1 20 . 1 1 23 23 THR HA H 21 4.950 4.950 4.519 0.431 17967
7472 1 20 . 1 1 23 23 THR CA C 21 58.530 58.530 60.373 -1.843 17967
7473 1 20 . 1 1 23 23 THR CB C 21 70.330 70.330 70.960 -0.630 17967
7474 1 20 . 1 1 23 23 THR H H 21 8.250 8.250 8.198 0.052 17967
7475 1 20 . 1 1 24 24 THR N N 22 112.810 112.810 114.283 -1.473 17967
7476 1 20 . 1 1 24 24 THR HA H 22 4.880 4.880 4.633 0.247 17967
7477 1 20 . 1 1 24 24 THR CA C 22 59.730 59.730 60.177 -0.447 17967
7478 1 20 . 1 1 24 24 THR CB C 22 74.130 74.130 71.135 2.995 17967
7479 1 20 . 1 1 24 24 THR H H 22 8.660 8.660 7.853 0.807 17967
7480 1 20 . 1 1 25 25 ILE N N 23 123.710 123.710 119.993 3.717 17967
7481 1 20 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.700 0.080 17967
7482 1 20 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.122 -0.692 17967
7483 1 20 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.911 0.719 17967
7484 1 20 . 1 1 25 25 ILE H H 23 9.060 9.060 8.119 0.941 17967
7485 1 20 . 1 1 26 26 HIS N N 24 119.510 119.510 112.562 6.948 17967
7486 1 20 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.713 -0.273 17967
7487 1 20 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.411 1.619 17967
7488 1 20 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.241 1.589 17967
7489 1 20 . 1 1 26 26 HIS H H 24 7.040 7.040 7.400 -0.360 17967
7490 1 20 . 1 1 27 27 ASP N N 25 116.810 116.810 118.239 -1.429 17967
7491 1 20 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.675 0.085 17967
7492 1 20 . 1 1 27 27 ASP CA C 25 54.430 54.430 53.812 0.618 17967
7493 1 20 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.374 0.956 17967
7494 1 20 . 1 1 27 27 ASP H H 25 7.250 7.250 7.597 -0.347 17967
7495 1 20 . 1 1 28 28 ILE N N 26 123.210 123.210 121.153 2.057 17967
7496 1 20 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.874 0.056 17967
7497 1 20 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.355 0.675 17967
7498 1 20 . 1 1 28 28 ILE CB C 26 37.930 37.930 39.049 -1.119 17967
7499 1 20 . 1 1 28 28 ILE H H 26 7.750 7.750 7.772 -0.022 17967
7500 1 20 . 1 1 29 29 ILE N N 27 131.110 131.110 128.067 3.043 17967
7501 1 20 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.093 0.287 17967
7502 1 20 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.730 -0.900 17967
7503 1 20 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.486 1.144 17967
7504 1 20 . 1 1 29 29 ILE H H 27 8.270 8.270 8.262 0.008 17967
7505 1 20 . 1 1 30 30 LEU N N 28 129.410 129.410 129.241 0.169 17967
7506 1 20 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.522 0.138 17967
7507 1 20 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.486 -0.957 17967
7508 1 20 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.654 2.676 17967
7509 1 20 . 1 1 30 30 LEU H H 28 8.500 8.500 8.348 0.152 17967
7510 1 20 . 1 1 31 31 GLU N N 29 121.910 121.910 121.450 0.460 17967
7511 1 20 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.786 -0.106 17967
7512 1 20 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.298 0.632 17967
7513 1 20 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.462 0.567 17967
7514 1 20 . 1 1 31 31 GLU H H 29 8.860 8.860 8.207 0.653 17967
7515 1 20 . 1 1 32 32 CYS N N 30 125.710 125.710 120.103 5.607 17967
7516 1 20 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.898 -0.878 17967
7517 1 20 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.422 -1.192 17967
7518 1 20 . 1 1 32 32 CYS CB C 30 31.730 31.730 27.139 4.591 17967
7519 1 20 . 1 1 32 32 CYS H H 30 8.270 8.270 8.366 -0.096 17967
7520 1 20 . 1 1 33 33 VAL N N 31 132.310 132.310 127.725 4.585 17967
7521 1 20 . 1 1 33 33 VAL HA H 31 3.100 3.100 2.728 0.372 17967
7522 1 20 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.323 -1.093 17967
7523 1 20 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.892 -0.262 17967
7524 1 20 . 1 1 33 33 VAL H H 31 8.860 8.860 7.702 1.158 17967
7525 1 20 . 1 1 34 34 TYR N N 32 124.310 124.310 114.252 10.058 17967
7526 1 20 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.475 -0.035 17967
7527 1 20 . 1 1 34 34 TYR CA C 32 61.030 61.030 58.985 2.045 17967
7528 1 20 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.545 1.585 17967
7529 1 20 . 1 1 34 34 TYR H H 32 8.590 8.590 7.032 1.558 17967
7530 1 20 . 1 1 35 35 CYS N N 33 119.810 119.810 115.771 4.039 17967
7531 1 20 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.662 0.178 17967
7532 1 20 . 1 1 35 35 CYS CA C 33 59.430 59.430 58.120 1.310 17967
7533 1 20 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.044 4.186 17967
7534 1 20 . 1 1 35 35 CYS H H 33 8.070 8.070 7.561 0.509 17967
7535 1 20 . 1 1 36 36 LYS N N 34 119.910 119.910 115.834 4.076 17967
7536 1 20 . 1 1 36 36 LYS HA H 34 4.190 4.190 4.003 0.187 17967
7537 1 20 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.126 0.704 17967
7538 1 20 . 1 1 36 36 LYS CB C 34 29.330 29.330 30.616 -1.286 17967
7539 1 20 . 1 1 36 36 LYS H H 34 7.860 7.860 7.930 -0.070 17967
7540 1 20 . 1 1 37 37 GLN N N 35 120.710 120.710 117.489 3.221 17967
7541 1 20 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.285 0.075 17967
7542 1 20 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.921 0.509 17967
7543 1 20 . 1 1 37 37 GLN CB C 35 29.630 29.630 29.088 0.542 17967
7544 1 20 . 1 1 37 37 GLN H H 35 8.270 8.270 7.708 0.562 17967
7545 1 20 . 1 1 38 38 GLN N N 36 123.710 123.710 123.895 -0.185 17967
7546 1 20 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.128 0.172 17967
7547 1 20 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.519 0.211 17967
7548 1 20 . 1 1 38 38 GLN CB C 36 29.330 29.330 29.084 0.246 17967
7549 1 20 . 1 1 38 38 GLN H H 36 8.640 8.640 8.592 0.048 17967
7550 1 20 . 1 1 39 39 LEU N N 37 131.310 131.310 127.527 3.783 17967
7551 1 20 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.209 -0.099 17967
7552 1 20 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.245 2.085 17967
7553 1 20 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.422 -0.492 17967
7554 1 20 . 1 1 39 39 LEU H H 37 8.870 8.870 8.050 0.820 17967
7555 1 20 . 1 1 40 40 LEU N N 38 126.310 126.310 124.653 1.657 17967
7556 1 20 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.304 0.006 17967
7557 1 20 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.725 -0.495 17967
7558 1 20 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.342 -0.212 17967
7559 1 20 . 1 1 40 40 LEU H H 38 9.850 9.850 8.388 1.462 17967
7560 1 20 . 1 1 41 41 ARG N N 39 127.110 127.110 125.335 1.775 17967
7561 1 20 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.760 -0.240 17967
7562 1 20 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.178 -1.348 17967
7563 1 20 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.063 -2.133 17967
7564 1 20 . 1 1 41 41 ARG H H 39 8.970 8.970 8.840 0.130 17967
7565 1 20 . 1 1 42 42 ARG N N 40 115.810 115.810 118.824 -3.014 17967
7566 1 20 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.369 -0.289 17967
7567 1 20 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.880 -0.750 17967
7568 1 20 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.721 -0.391 17967
7569 1 20 . 1 1 42 42 ARG H H 40 8.610 8.610 8.549 0.061 17967
7570 1 20 . 1 1 43 43 GLU N N 41 119.910 119.910 120.041 -0.131 17967
7571 1 20 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.439 -0.189 17967
7572 1 20 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.947 0.083 17967
7573 1 20 . 1 1 43 43 GLU CB C 41 30.330 30.330 28.810 1.520 17967
7574 1 20 . 1 1 43 43 GLU H H 41 6.950 6.950 7.917 -0.967 17967
7575 1 20 . 1 1 44 44 VAL N N 42 125.010 125.010 120.251 4.759 17967
7576 1 20 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.628 -0.388 17967
7577 1 20 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.454 1.176 17967
7578 1 20 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.185 0.145 17967
7579 1 20 . 1 1 44 44 VAL H H 42 7.820 7.820 7.935 -0.115 17967
7580 1 20 . 1 1 45 45 TYR N N 43 118.410 118.410 119.044 -0.634 17967
7581 1 20 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.128 0.302 17967
7582 1 20 . 1 1 45 45 TYR CA C 43 58.830 58.830 60.496 -1.666 17967
7583 1 20 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.196 -0.466 17967
7584 1 20 . 1 1 45 45 TYR H H 43 7.820 7.820 7.989 -0.169 17967
7585 1 20 . 1 1 46 46 ASP N N 44 122.410 122.410 120.018 2.392 17967
7586 1 20 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.319 0.281 17967
7587 1 20 . 1 1 46 46 ASP CA C 44 57.830 57.830 58.123 -0.293 17967
7588 1 20 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.481 0.549 17967
7589 1 20 . 1 1 46 46 ASP H H 44 8.540 8.540 8.391 0.149 17967
7590 1 20 . 1 1 47 47 PHE N N 45 126.210 126.210 119.381 6.829 17967
7591 1 20 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.132 -0.222 17967
7592 1 20 . 1 1 47 47 PHE CA C 45 62.630 62.630 62.005 0.625 17967
7593 1 20 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.101 0.229 17967
7594 1 20 . 1 1 47 47 PHE H H 45 8.320 8.320 7.770 0.550 17967
7595 1 20 . 1 1 48 48 ALA N N 46 119.110 119.110 119.093 0.017 17967
7596 1 20 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.378 0.142 17967
7597 1 20 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.651 0.579 17967
7598 1 20 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.776 -0.047 17967
7599 1 20 . 1 1 48 48 ALA H H 46 7.740 7.740 7.676 0.064 17967
7600 1 20 . 1 1 49 49 ARG N N 47 124.010 124.010 117.506 6.504 17967
7601 1 20 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.327 -0.277 17967
7602 1 20 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.108 2.522 17967
7603 1 20 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.346 0.084 17967
7604 1 20 . 1 1 49 49 ARG H H 47 8.500 8.500 8.285 0.215 17967
7605 1 20 . 1 1 50 50 ARG N N 48 119.110 119.110 118.281 0.829 17967
7606 1 20 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.544 -0.534 17967
7607 1 20 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.778 2.352 17967
7608 1 20 . 1 1 50 50 ARG CB C 48 31.130 31.130 32.143 -1.013 17967
7609 1 20 . 1 1 50 50 ARG H H 48 7.940 7.940 7.769 0.171 17967
7610 1 20 . 1 1 51 51 ASP N N 49 120.910 120.910 119.956 0.954 17967
7611 1 20 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.734 -0.314 17967
7612 1 20 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.587 0.942 17967
7613 1 20 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.715 -0.785 17967
7614 1 20 . 1 1 51 51 ASP H H 49 7.950 7.950 8.327 -0.377 17967
7615 1 20 . 1 1 52 52 LEU N N 50 118.410 118.410 123.137 -4.727 17967
7616 1 20 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.580 -0.430 17967
7617 1 20 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.112 1.118 17967
7618 1 20 . 1 1 52 52 LEU CB C 50 41.130 41.130 45.016 -3.886 17967
7619 1 20 . 1 1 52 52 LEU H H 50 6.640 6.640 7.505 -0.865 17967
7620 1 20 . 1 1 53 53 CYS N N 51 117.410 117.410 117.098 0.312 17967
7621 1 20 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.466 -0.536 17967
7622 1 20 . 1 1 53 53 CYS CA C 51 58.930 58.930 55.912 3.018 17967
7623 1 20 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.719 -2.089 17967
7624 1 20 . 1 1 53 53 CYS H H 51 8.030 8.030 8.050 -0.020 17967
7625 1 20 . 1 1 54 54 ILE N N 52 125.110 125.110 122.886 2.224 17967
7626 1 20 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.361 -0.351 17967
7627 1 20 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.727 -2.096 17967
7628 1 20 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.876 -1.546 17967
7629 1 20 . 1 1 54 54 ILE H H 52 8.500 8.500 8.648 -0.147 17967
7630 1 20 . 1 1 55 55 VAL N N 53 127.010 127.010 122.605 4.405 17967
7631 1 20 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.577 -0.207 17967
7632 1 20 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.499 0.131 17967
7633 1 20 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.595 1.635 17967
7634 1 20 . 1 1 55 55 VAL H H 53 8.130 8.130 8.208 -0.078 17967
7635 1 20 . 1 1 56 56 TYR N N 54 124.910 124.910 126.879 -1.969 17967
7636 1 20 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.304 0.096 17967
7637 1 20 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.607 -0.277 17967
7638 1 20 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.581 1.449 17967
7639 1 20 . 1 1 56 56 TYR H H 54 8.700 8.700 8.639 0.061 17967
7640 1 20 . 1 1 57 57 ARG N N 55 123.810 123.810 125.704 -1.894 17967
7641 1 20 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.432 0.208 17967
7642 1 20 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.551 -0.121 17967
7643 1 20 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.286 2.544 17967
7644 1 20 . 1 1 57 57 ARG H H 55 8.870 8.870 8.426 0.444 17967
7645 1 20 . 1 1 58 58 ASP N N 56 129.110 129.110 125.376 3.734 17967
7646 1 20 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.299 0.011 17967
7647 1 20 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.982 -1.152 17967
7648 1 20 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.236 -0.106 17967
7649 1 20 . 1 1 58 58 ASP H H 56 9.620 9.620 9.115 0.505 17967
7650 1 20 . 1 1 59 59 GLY N N 57 104.510 104.510 105.290 -0.780 17967
7651 1 20 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.165 0.465 17967
7652 1 20 . 1 1 59 59 GLY H H 57 8.720 8.720 8.292 0.428 17967
7653 1 20 . 1 1 60 60 ASN N N 58 122.210 122.210 119.094 3.116 17967
7654 1 20 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.285 0.115 17967
7655 1 20 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.747 -0.417 17967
7656 1 20 . 1 1 60 60 ASN CB C 58 40.430 40.430 40.962 -0.532 17967
7657 1 20 . 1 1 60 60 ASN H H 58 8.120 8.120 7.959 0.161 17967
7658 1 20 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.492 0.298 17967
7659 1 20 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.241 -0.211 17967
7660 1 20 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.288 2.241 17967
7661 1 20 . 1 1 62 62 TYR N N 60 119.810 119.810 122.328 -2.518 17967
7662 1 20 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.507 -0.147 17967
7663 1 20 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.378 1.852 17967
7664 1 20 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.556 0.874 17967
7665 1 20 . 1 1 62 62 TYR H H 60 8.590 8.590 7.603 0.987 17967
7666 1 20 . 1 1 63 63 ALA N N 61 123.810 123.810 121.554 2.256 17967
7667 1 20 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.178 0.242 17967
7668 1 20 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.237 0.093 17967
7669 1 20 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.772 -0.442 17967
7670 1 20 . 1 1 63 63 ALA H H 61 8.010 8.010 8.862 -0.852 17967
7671 1 20 . 1 1 64 64 VAL N N 62 120.510 120.510 118.127 2.383 17967
7672 1 20 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.243 1.257 17967
7673 1 20 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.307 -0.077 17967
7674 1 20 . 1 1 64 64 VAL CB C 62 36.330 36.330 32.157 4.173 17967
7675 1 20 . 1 1 64 64 VAL H H 62 6.380 6.380 8.436 -2.056 17967
7676 1 20 . 1 1 65 65 CYS N N 63 130.310 130.310 125.757 4.553 17967
7677 1 20 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.387 0.173 17967
7678 1 20 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.509 -0.079 17967
7679 1 20 . 1 1 65 65 CYS CB C 63 31.130 31.130 28.744 2.386 17967
7680 1 20 . 1 1 65 65 CYS H H 63 9.430 9.430 8.134 1.296 17967
7681 1 20 . 1 1 66 66 ASP N N 64 121.110 121.110 120.977 0.133 17967
7682 1 20 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.264 0.146 17967
7683 1 20 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.391 -0.161 17967
7684 1 20 . 1 1 66 66 ASP CB C 64 42.330 42.330 41.073 1.257 17967
7685 1 20 . 1 1 66 66 ASP H H 64 9.120 9.120 8.788 0.332 17967
7686 1 20 . 1 1 67 67 LYS N N 65 122.110 122.110 119.330 2.780 17967
7687 1 20 . 1 1 67 67 LYS HA H 65 4.010 4.010 4.112 -0.102 17967
7688 1 20 . 1 1 67 67 LYS CA C 65 60.130 60.130 59.063 1.067 17967
7689 1 20 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.396 0.434 17967
7690 1 20 . 1 1 67 67 LYS H H 65 8.330 8.330 7.858 0.472 17967
7691 1 20 . 1 1 68 68 CYS N N 66 125.610 125.610 118.890 6.720 17967
7692 1 20 . 1 1 68 68 CYS HA H 66 4.110 4.110 3.838 0.272 17967
7693 1 20 . 1 1 68 68 CYS CA C 66 63.530 63.530 61.682 1.848 17967
7694 1 20 . 1 1 68 68 CYS CB C 66 30.730 30.730 25.933 4.798 17967
7695 1 20 . 1 1 68 68 CYS H H 66 8.700 8.700 7.592 1.108 17967
7696 1 20 . 1 1 69 69 LEU N N 67 125.310 125.310 120.372 4.938 17967
7697 1 20 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.106 -0.106 17967
7698 1 20 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.114 0.416 17967
7699 1 20 . 1 1 69 69 LEU CB C 67 42.130 42.130 42.000 0.130 17967
7700 1 20 . 1 1 69 69 LEU H H 67 8.470 8.470 8.543 -0.073 17967
7701 1 20 . 1 1 70 70 LYS N N 68 119.010 119.010 116.758 2.252 17967
7702 1 20 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.245 -0.265 17967
7703 1 20 . 1 1 70 70 LYS CA C 68 58.830 58.830 57.688 1.142 17967
7704 1 20 . 1 1 70 70 LYS CB C 68 32.130 32.130 32.130 -0.000 17967
7705 1 20 . 1 1 70 70 LYS H H 68 7.810 7.810 7.659 0.151 17967
7706 1 20 . 1 1 71 71 PHE N N 69 121.710 121.710 118.369 3.341 17967
7707 1 20 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.207 0.073 17967
7708 1 20 . 1 1 71 71 PHE CA C 69 59.930 59.930 60.495 -0.565 17967
7709 1 20 . 1 1 71 71 PHE CB C 69 39.430 39.430 39.460 -0.030 17967
7710 1 20 . 1 1 71 71 PHE H H 69 7.810 7.810 7.441 0.369 17967
7711 1 20 . 1 1 72 72 TYR N N 70 120.110 120.110 118.089 2.021 17967
7712 1 20 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.675 -0.355 17967
7713 1 20 . 1 1 72 72 TYR CA C 70 60.330 60.330 57.596 2.735 17967
7714 1 20 . 1 1 72 72 TYR CB C 70 40.430 40.430 37.904 2.526 17967
7715 1 20 . 1 1 72 72 TYR H H 70 8.280 8.280 8.206 0.074 17967
7716 1 20 . 1 1 73 73 SER N N 71 117.210 117.210 118.179 -0.969 17967
7717 1 20 . 1 1 73 73 SER HA H 71 4.320 4.320 4.565 -0.245 17967
7718 1 20 . 1 1 73 73 SER CA C 71 60.130 60.130 57.803 2.327 17967
7719 1 20 . 1 1 73 73 SER CB C 71 63.630 63.630 63.961 -0.331 17967
7720 1 20 . 1 1 73 73 SER H H 71 7.870 7.870 8.586 -0.716 17967
7721 1 20 . 1 1 74 74 LYS N N 72 122.810 122.810 122.133 0.677 17967
7722 1 20 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.216 0.054 17967
7723 1 20 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.860 -0.930 17967
7724 1 20 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.735 -0.105 17967
7725 1 20 . 1 1 74 74 LYS H H 72 7.800 7.800 8.472 -0.672 17967
7726 1 20 . 1 1 75 75 ILE N N 73 121.610 121.610 115.574 6.036 17967
7727 1 20 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.416 -0.306 17967
7728 1 20 . 1 1 75 75 ILE CA C 73 61.830 61.830 61.035 0.795 17967
7729 1 20 . 1 1 75 75 ILE CB C 73 38.630 38.630 36.909 1.721 17967
7730 1 20 . 1 1 75 75 ILE H H 73 7.750 7.750 7.904 -0.154 17967
7731 1 20 . 1 1 76 76 SER N N 74 120.410 120.410 122.744 -2.334 17967
7732 1 20 . 1 1 76 76 SER HA H 74 4.300 4.300 4.738 -0.438 17967
7733 1 20 . 1 1 76 76 SER CA C 74 59.330 59.330 59.762 -0.432 17967
7734 1 20 . 1 1 76 76 SER CB C 74 63.830 63.830 65.873 -2.042 17967
7735 1 20 . 1 1 76 76 SER H H 74 8.130 8.130 8.220 -0.090 17967
7736 1 20 . 1 1 77 77 GLU N N 75 123.810 123.810 119.542 4.268 17967
7737 1 20 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.489 -0.299 17967
7738 1 20 . 1 1 77 77 GLU CA C 75 57.330 57.330 55.230 2.100 17967
7739 1 20 . 1 1 77 77 GLU CB C 75 30.130 30.130 29.419 0.711 17967
7740 1 20 . 1 1 77 77 GLU H H 75 8.270 8.270 8.464 -0.194 17967
7741 1 20 . 1 1 78 78 TYR N N 76 122.410 122.410 123.673 -1.263 17967
7742 1 20 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.474 -0.014 17967
7743 1 20 . 1 1 78 78 TYR CA C 76 58.130 58.130 58.668 -0.538 17967
7744 1 20 . 1 1 78 78 TYR CB C 76 38.630 38.630 38.496 0.134 17967
7745 1 20 . 1 1 78 78 TYR H H 76 7.980 7.980 7.915 0.065 17967
7746 1 20 . 1 1 79 79 ARG N N 77 124.710 124.710 127.395 -2.685 17967
7747 1 20 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.725 -0.525 17967
7748 1 20 . 1 1 79 79 ARG CA C 77 56.030 56.030 54.679 1.351 17967
7749 1 20 . 1 1 79 79 ARG CB C 77 31.030 31.030 31.405 -0.375 17967
7750 1 20 . 1 1 79 79 ARG H H 77 7.880 7.880 8.257 -0.377 17967
7751 1 20 . 1 1 80 80 HIS N N 78 122.110 122.110 117.507 4.603 17967
7752 1 20 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.599 -0.089 17967
7753 1 20 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.147 1.183 17967
7754 1 20 . 1 1 80 80 HIS CB C 78 30.830 30.830 29.517 1.313 17967
7755 1 20 . 1 1 80 80 HIS H H 78 8.120 8.120 8.381 -0.261 17967
7756 1 20 . 1 1 81 81 TYR N N 79 123.610 123.610 120.357 3.253 17967
7757 1 20 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.512 0.078 17967
7758 1 20 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.839 -0.009 17967
7759 1 20 . 1 1 81 81 TYR CB C 79 39.130 39.130 38.825 0.305 17967
7760 1 20 . 1 1 81 81 TYR H H 79 7.970 7.970 8.069 -0.099 17967
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 75 3.555 -1.940 2.999 17967
2 1 1 "Average Difference" HA 81 0.292 0.047 0.290 17967
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 17967
4 1 1 "Average Difference" CA 80 1.216 -0.286 1.190 17967
5 1 1 "Average Difference" CB 79 1.605 -0.566 1.512 17967
6 1 1 "Average Difference" HN 75 0.612 -0.099 0.608 17967
7 1 2 "Average Difference" N 75 3.403 -2.053 2.732 17967
8 1 2 "Average Difference" HA 81 0.296 0.051 0.294 17967
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 17967
10 1 2 "Average Difference" CA 80 1.019 -0.298 0.981 17967
11 1 2 "Average Difference" CB 79 1.602 -0.531 1.521 17967
12 1 2 "Average Difference" HN 75 0.615 -0.090 0.612 17967
13 1 3 "Average Difference" N 75 3.497 -1.876 2.971 17967
14 1 3 "Average Difference" HA 81 0.288 0.047 0.286 17967
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 17967
16 1 3 "Average Difference" CA 80 1.170 -0.239 1.152 17967
17 1 3 "Average Difference" CB 79 1.574 -0.541 1.487 17967
18 1 3 "Average Difference" HN 75 0.622 -0.102 0.618 17967
19 1 4 "Average Difference" N 75 3.580 -1.992 2.995 17967
20 1 4 "Average Difference" HA 81 0.297 0.033 0.297 17967
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 17967
22 1 4 "Average Difference" CA 80 1.142 -0.231 1.126 17967
23 1 4 "Average Difference" CB 79 1.520 -0.556 1.424 17967
24 1 4 "Average Difference" HN 75 0.574 -0.066 0.574 17967
25 1 5 "Average Difference" N 75 3.626 -2.152 2.938 17967
26 1 5 "Average Difference" HA 81 0.303 0.030 0.304 17967
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 17967
28 1 5 "Average Difference" CA 80 1.192 -0.125 1.193 17967
29 1 5 "Average Difference" CB 79 1.604 -0.729 1.439 17967
30 1 5 "Average Difference" HN 75 0.627 -0.046 0.630 17967
31 1 6 "Average Difference" N 75 3.418 -1.877 2.876 17967
32 1 6 "Average Difference" HA 81 0.267 0.037 0.266 17967
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 17967
34 1 6 "Average Difference" CA 80 1.110 -0.194 1.100 17967
35 1 6 "Average Difference" CB 79 1.475 -0.595 1.359 17967
36 1 6 "Average Difference" HN 75 0.619 -0.087 0.617 17967
37 1 7 "Average Difference" N 75 3.335 -1.983 2.699 17967
38 1 7 "Average Difference" HA 81 0.330 0.055 0.327 17967
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 17967
40 1 7 "Average Difference" CA 80 1.172 -0.217 1.159 17967
41 1 7 "Average Difference" CB 79 1.586 -0.613 1.472 17967
42 1 7 "Average Difference" HN 75 0.622 -0.045 0.625 17967
43 1 8 "Average Difference" N 75 3.533 -1.980 2.946 17967
44 1 8 "Average Difference" HA 81 0.285 0.040 0.284 17967
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 17967
46 1 8 "Average Difference" CA 80 1.159 -0.288 1.129 17967
47 1 8 "Average Difference" CB 79 1.588 -0.550 1.500 17967
48 1 8 "Average Difference" HN 75 0.554 -0.104 0.548 17967
49 1 9 "Average Difference" N 75 3.627 -1.922 3.096 17967
50 1 9 "Average Difference" HA 81 0.300 0.057 0.297 17967
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 17967
52 1 9 "Average Difference" CA 80 1.176 -0.348 1.131 17967
53 1 9 "Average Difference" CB 79 1.561 -0.514 1.483 17967
54 1 9 "Average Difference" HN 75 0.633 -0.089 0.631 17967
55 1 10 "Average Difference" N 75 3.425 -2.051 2.762 17967
56 1 10 "Average Difference" HA 81 0.286 0.054 0.283 17967
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 17967
58 1 10 "Average Difference" CA 80 1.096 -0.361 1.041 17967
59 1 10 "Average Difference" CB 79 1.588 -0.497 1.518 17967
60 1 10 "Average Difference" HN 75 0.594 -0.116 0.586 17967
61 1 11 "Average Difference" N 75 3.444 -1.972 2.843 17967
62 1 11 "Average Difference" HA 81 0.295 0.046 0.293 17967
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 17967
64 1 11 "Average Difference" CA 80 1.245 -0.239 1.229 17967
65 1 11 "Average Difference" CB 79 1.516 -0.600 1.401 17967
66 1 11 "Average Difference" HN 75 0.620 -0.100 0.616 17967
67 1 12 "Average Difference" N 75 3.786 -2.117 3.161 17967
68 1 12 "Average Difference" HA 81 0.299 0.051 0.297 17967
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 17967
70 1 12 "Average Difference" CA 80 1.256 -0.332 1.219 17967
71 1 12 "Average Difference" CB 79 1.535 -0.505 1.459 17967
72 1 12 "Average Difference" HN 75 0.636 -0.092 0.633 17967
73 1 13 "Average Difference" N 75 3.692 -2.099 3.058 17967
74 1 13 "Average Difference" HA 81 0.282 0.046 0.280 17967
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 17967
76 1 13 "Average Difference" CA 80 1.247 -0.181 1.241 17967
77 1 13 "Average Difference" CB 79 1.543 -0.548 1.452 17967
78 1 13 "Average Difference" HN 75 0.570 -0.087 0.567 17967
79 1 14 "Average Difference" N 75 3.609 -2.160 2.910 17967
80 1 14 "Average Difference" HA 81 0.295 0.044 0.294 17967
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 17967
82 1 14 "Average Difference" CA 80 1.205 -0.230 1.190 17967
83 1 14 "Average Difference" CB 79 1.561 -0.531 1.477 17967
84 1 14 "Average Difference" HN 75 0.637 -0.072 0.638 17967
85 1 15 "Average Difference" N 75 3.775 -2.163 3.115 17967
86 1 15 "Average Difference" HA 81 0.326 0.043 0.325 17967
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 17967
88 1 15 "Average Difference" CA 80 1.297 -0.238 1.283 17967
89 1 15 "Average Difference" CB 79 1.561 -0.625 1.439 17967
90 1 15 "Average Difference" HN 75 0.608 -0.097 0.604 17967
91 1 16 "Average Difference" N 75 3.481 -2.034 2.844 17967
92 1 16 "Average Difference" HA 81 0.314 0.019 0.315 17967
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 17967
94 1 16 "Average Difference" CA 80 1.132 -0.250 1.112 17967
95 1 16 "Average Difference" CB 79 1.586 -0.580 1.486 17967
96 1 16 "Average Difference" HN 75 0.627 -0.084 0.626 17967
97 1 17 "Average Difference" N 75 3.784 -2.255 3.059 17967
98 1 17 "Average Difference" HA 81 0.291 0.041 0.290 17967
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 17967
100 1 17 "Average Difference" CA 80 1.204 -0.194 1.195 17967
101 1 17 "Average Difference" CB 79 1.506 -0.565 1.405 17967
102 1 17 "Average Difference" HN 75 0.625 -0.085 0.623 17967
103 1 18 "Average Difference" N 75 3.329 -1.852 2.785 17967
104 1 18 "Average Difference" HA 81 0.278 0.038 0.277 17967
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 17967
106 1 18 "Average Difference" CA 80 1.173 -0.218 1.160 17967
107 1 18 "Average Difference" CB 79 1.551 -0.638 1.422 17967
108 1 18 "Average Difference" HN 75 0.608 -0.071 0.608 17967
109 1 19 "Average Difference" N 75 3.422 -1.793 2.934 17967
110 1 19 "Average Difference" HA 81 0.290 0.033 0.290 17967
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 17967
112 1 19 "Average Difference" CA 80 1.209 -0.272 1.185 17967
113 1 19 "Average Difference" CB 79 1.593 -0.607 1.482 17967
114 1 19 "Average Difference" HN 75 0.601 -0.095 0.597 17967
115 1 20 "Average Difference" N 75 3.519 -1.990 2.921 17967
116 1 20 "Average Difference" HA 81 0.303 0.063 0.298 17967
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 17967
118 1 20 "Average Difference" CA 80 1.234 -0.431 1.164 17967
119 1 20 "Average Difference" CB 79 1.586 -0.510 1.511 17967
120 1 20 "Average Difference" HN 75 0.593 -0.100 0.589 17967
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 17967
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 ALA HA H 0 4.290 4.290 4.239 0.051 17967
2 1 . 1 1 2 2 ALA CA C 0 52.530 52.530 52.553 -0.023 17967
3 1 . 1 1 2 2 ALA CB C 0 19.730 19.730 19.194 0.536 17967
4 1 . 1 1 3 3 MET N N 1 122.210 122.210 120.069 2.141 17967
5 1 . 1 1 3 3 MET HA H 1 4.300 4.300 4.644 -0.343 17967
6 1 . 1 1 3 3 MET CA C 1 56.030 56.030 54.736 1.294 17967
7 1 . 1 1 3 3 MET CB C 1 33.430 33.430 32.699 0.731 17967
8 1 . 1 1 3 3 MET H H 1 8.370 8.370 7.898 0.472 17967
9 1 . 1 1 4 4 PHE N N 2 122.310 122.310 125.046 -2.736 17967
10 1 . 1 1 4 4 PHE HA H 2 4.630 4.630 4.718 -0.087 17967
11 1 . 1 1 4 4 PHE CA C 2 57.330 57.330 56.278 1.052 17967
12 1 . 1 1 4 4 PHE CB C 2 39.430 39.430 40.368 -0.938 17967
13 1 . 1 1 4 4 PHE H H 2 8.370 8.370 8.386 -0.016 17967
14 1 . 1 1 5 5 GLN N N 3 123.510 123.510 122.559 0.951 17967
15 1 . 1 1 5 5 GLN HA H 3 4.180 4.180 4.445 -0.265 17967
16 1 . 1 1 5 5 GLN CA C 3 56.130 56.130 54.493 1.637 17967
17 1 . 1 1 5 5 GLN CB C 3 29.930 29.930 30.496 -0.566 17967
18 1 . 1 1 5 5 GLN H H 3 8.260 8.260 8.374 -0.114 17967
19 1 . 1 1 6 6 ASP N N 4 125.010 125.010 120.395 4.615 17967
20 1 . 1 1 6 6 ASP HA H 4 4.790 4.790 4.664 0.126 17967
21 1 . 1 1 6 6 ASP CA C 4 51.930 51.930 52.180 -0.250 17967
22 1 . 1 1 6 6 ASP CB C 4 41.730 41.730 41.247 0.483 17967
23 1 . 1 1 6 6 ASP H H 4 8.420 8.420 8.426 -0.006 17967
24 1 . 1 1 7 7 PRO HA H 5 4.120 4.120 4.426 -0.306 17967
25 1 . 1 1 7 7 PRO CA C 5 64.030 64.030 63.844 0.186 17967
26 1 . 1 1 7 7 PRO CB C 5 32.330 32.330 32.279 0.051 17967
27 1 . 1 1 8 8 GLN N N 6 119.710 119.710 118.186 1.524 17967
28 1 . 1 1 8 8 GLN HA H 6 4.160 4.160 4.223 -0.063 17967
29 1 . 1 1 8 8 GLN CA C 6 56.630 56.630 55.264 1.366 17967
30 1 . 1 1 8 8 GLN CB C 6 29.330 29.330 27.328 2.002 17967
31 1 . 1 1 8 8 GLN H H 6 8.430 8.430 8.013 0.417 17967
32 1 . 1 1 9 9 GLU N N 7 122.110 122.110 121.115 0.995 17967
33 1 . 1 1 9 9 GLU HA H 7 4.200 4.200 4.007 0.193 17967
34 1 . 1 1 9 9 GLU CA C 7 56.030 56.030 57.247 -1.217 17967
35 1 . 1 1 9 9 GLU CB C 7 30.530 30.530 29.796 0.734 17967
36 1 . 1 1 9 9 GLU H H 7 7.940 7.940 8.262 -0.322 17967
37 1 . 1 1 10 10 ARG N N 8 123.410 123.410 117.620 5.790 17967
38 1 . 1 1 10 10 ARG HA H 8 4.400 4.400 4.405 -0.005 17967
39 1 . 1 1 10 10 ARG CA C 8 54.130 54.130 54.500 -0.370 17967
40 1 . 1 1 10 10 ARG CB C 8 29.330 29.330 29.074 0.257 17967
41 1 . 1 1 10 10 ARG H H 8 7.660 7.660 7.848 -0.189 17967
42 1 . 1 1 11 11 PRO HA H 9 4.350 4.350 4.616 -0.266 17967
43 1 . 1 1 11 11 PRO CA C 9 63.530 63.530 62.522 1.008 17967
44 1 . 1 1 11 11 PRO CB C 9 32.630 32.630 33.036 -0.406 17967
45 1 . 1 1 12 12 ARG N N 10 123.810 123.810 116.990 6.820 17967
46 1 . 1 1 12 12 ARG HA H 10 4.670 4.670 4.727 -0.057 17967
47 1 . 1 1 12 12 ARG CA C 10 56.830 56.830 55.940 0.890 17967
48 1 . 1 1 12 12 ARG CB C 10 32.530 32.530 31.497 1.033 17967
49 1 . 1 1 12 12 ARG H H 10 8.710 8.710 8.695 0.015 17967
50 1 . 1 1 13 13 LYS N N 11 118.410 118.410 119.401 -0.991 17967
51 1 . 1 1 13 13 LYS HA H 11 5.050 5.050 4.774 0.276 17967
52 1 . 1 1 13 13 LYS CA C 11 53.330 53.330 54.456 -1.126 17967
53 1 . 1 1 13 13 LYS CB C 11 35.430 35.430 34.282 1.148 17967
54 1 . 1 1 13 13 LYS H H 11 7.800 7.800 7.697 0.103 17967
55 1 . 1 1 14 14 LEU N N 12 125.010 125.010 126.422 -1.412 17967
56 1 . 1 1 14 14 LEU HA H 12 4.170 4.170 4.206 -0.036 17967
57 1 . 1 1 14 14 LEU CA C 12 59.730 59.730 59.459 0.271 17967
58 1 . 1 1 14 14 LEU CB C 12 40.530 40.530 39.908 0.622 17967
59 1 . 1 1 14 14 LEU H H 12 10.210 10.210 9.212 0.998 17967
60 1 . 1 1 15 15 PRO HA H 13 4.220 4.220 4.259 -0.039 17967
61 1 . 1 1 15 15 PRO CA C 13 67.230 67.230 65.615 1.615 17967
62 1 . 1 1 15 15 PRO CB C 13 30.730 30.730 31.081 -0.351 17967
63 1 . 1 1 16 16 GLN N N 14 117.810 117.810 117.561 0.249 17967
64 1 . 1 1 16 16 GLN HA H 14 4.190 4.190 4.142 0.048 17967
65 1 . 1 1 16 16 GLN CA C 14 59.030 59.030 58.902 0.128 17967
66 1 . 1 1 16 16 GLN CB C 14 28.630 28.630 28.300 0.330 17967
67 1 . 1 1 16 16 GLN H H 14 7.110 7.110 8.363 -1.253 17967
68 1 . 1 1 17 17 LEU N N 15 124.710 124.710 122.187 2.523 17967
69 1 . 1 1 17 17 LEU HA H 15 4.010 4.010 4.176 -0.166 17967
70 1 . 1 1 17 17 LEU CA C 15 58.330 58.330 57.771 0.559 17967
71 1 . 1 1 17 17 LEU CB C 15 42.030 42.030 41.737 0.293 17967
72 1 . 1 1 17 17 LEU H H 15 8.010 8.010 8.091 -0.081 17967
73 1 . 1 1 18 18 CYS N N 16 117.210 117.210 117.125 0.085 17967
74 1 . 1 1 18 18 CYS HA H 16 3.750 3.750 3.998 -0.248 17967
75 1 . 1 1 18 18 CYS CA C 16 64.730 64.730 63.919 0.811 17967
76 1 . 1 1 18 18 CYS CB C 16 26.230 26.230 26.005 0.225 17967
77 1 . 1 1 18 18 CYS H H 16 8.380 8.380 8.471 -0.091 17967
78 1 . 1 1 19 19 THR N N 17 117.810 117.810 115.972 1.838 17967
79 1 . 1 1 19 19 THR HA H 17 4.000 4.000 4.018 -0.018 17967
80 1 . 1 1 19 19 THR CA C 17 66.830 66.830 67.057 -0.227 17967
81 1 . 1 1 19 19 THR CB C 17 68.830 68.830 68.555 0.275 17967
82 1 . 1 1 19 19 THR H H 17 7.720 7.720 7.746 -0.026 17967
83 1 . 1 1 20 20 GLU N N 18 125.410 125.410 120.894 4.516 17967
84 1 . 1 1 20 20 GLU HA H 18 4.070 4.070 4.178 -0.108 17967
85 1 . 1 1 20 20 GLU CA C 18 59.730 59.730 58.883 0.847 17967
86 1 . 1 1 20 20 GLU CB C 18 29.730 29.730 29.517 0.213 17967
87 1 . 1 1 20 20 GLU H H 18 8.010 8.010 7.647 0.363 17967
88 1 . 1 1 21 21 LEU N N 19 118.810 118.810 117.120 1.690 17967
89 1 . 1 1 21 21 LEU HA H 19 4.300 4.300 4.310 -0.010 17967
90 1 . 1 1 21 21 LEU CA C 19 54.830 54.830 55.457 -0.627 17967
91 1 . 1 1 21 21 LEU CB C 19 42.330 42.330 41.879 0.451 17967
92 1 . 1 1 21 21 LEU H H 19 8.010 8.010 8.009 0.001 17967
93 1 . 1 1 22 22 GLN N N 20 118.310 118.310 114.966 3.344 17967
94 1 . 1 1 22 22 GLN HA H 20 3.950 3.950 4.041 -0.091 17967
95 1 . 1 1 22 22 GLN CA C 20 56.730 56.730 57.107 -0.377 17967
96 1 . 1 1 22 22 GLN CB C 20 26.130 26.130 26.280 -0.150 17967
97 1 . 1 1 22 22 GLN H H 20 7.860 7.860 7.739 0.121 17967
98 1 . 1 1 23 23 THR N N 21 115.910 115.910 111.903 4.007 17967
99 1 . 1 1 23 23 THR HA H 21 4.950 4.950 4.587 0.363 17967
100 1 . 1 1 23 23 THR CA C 21 58.530 58.530 59.968 -1.438 17967
101 1 . 1 1 23 23 THR CB C 21 70.330 70.330 70.617 -0.287 17967
102 1 . 1 1 23 23 THR H H 21 8.250 8.250 8.284 -0.034 17967
103 1 . 1 1 24 24 THR N N 22 112.810 112.810 114.213 -1.403 17967
104 1 . 1 1 24 24 THR HA H 22 4.880 4.880 4.614 0.266 17967
105 1 . 1 1 24 24 THR CA C 22 59.730 59.730 60.190 -0.460 17967
106 1 . 1 1 24 24 THR CB C 22 74.130 74.130 71.239 2.891 17967
107 1 . 1 1 24 24 THR H H 22 8.660 8.660 7.874 0.786 17967
108 1 . 1 1 25 25 ILE N N 23 123.710 123.710 120.372 3.338 17967
109 1 . 1 1 25 25 ILE HA H 23 3.780 3.780 3.707 0.073 17967
110 1 . 1 1 25 25 ILE CA C 23 63.430 63.430 64.120 -0.690 17967
111 1 . 1 1 25 25 ILE CB C 23 38.630 38.630 37.870 0.760 17967
112 1 . 1 1 25 25 ILE H H 23 9.060 9.060 8.231 0.829 17967
113 1 . 1 1 26 26 HIS N N 24 119.510 119.510 113.533 5.977 17967
114 1 . 1 1 26 26 HIS HA H 24 4.440 4.440 4.739 -0.299 17967
115 1 . 1 1 26 26 HIS CA C 24 57.030 57.030 55.517 1.513 17967
116 1 . 1 1 26 26 HIS CB C 24 30.830 30.830 29.034 1.795 17967
117 1 . 1 1 26 26 HIS H H 24 7.040 7.040 7.506 -0.466 17967
118 1 . 1 1 27 27 ASP N N 25 116.810 116.810 118.326 -1.516 17967
119 1 . 1 1 27 27 ASP HA H 25 4.760 4.760 4.650 0.110 17967
120 1 . 1 1 27 27 ASP CA C 25 54.430 54.430 54.247 0.183 17967
121 1 . 1 1 27 27 ASP CB C 25 44.330 44.330 43.182 1.149 17967
122 1 . 1 1 27 27 ASP H H 25 7.250 7.250 7.585 -0.335 17967
123 1 . 1 1 28 28 ILE N N 26 123.210 123.210 121.698 1.512 17967
124 1 . 1 1 28 28 ILE HA H 26 3.930 3.930 3.885 0.045 17967
125 1 . 1 1 28 28 ILE CA C 26 63.030 63.030 62.586 0.444 17967
126 1 . 1 1 28 28 ILE CB C 26 37.930 37.930 38.720 -0.790 17967
127 1 . 1 1 28 28 ILE H H 26 7.750 7.750 7.821 -0.071 17967
128 1 . 1 1 29 29 ILE N N 27 131.110 131.110 129.008 2.102 17967
129 1 . 1 1 29 29 ILE HA H 27 4.380 4.380 4.112 0.268 17967
130 1 . 1 1 29 29 ILE CA C 27 58.830 58.830 59.928 -1.098 17967
131 1 . 1 1 29 29 ILE CB C 27 37.630 37.630 36.556 1.074 17967
132 1 . 1 1 29 29 ILE H H 27 8.270 8.270 8.336 -0.066 17967
133 1 . 1 1 30 30 LEU N N 28 129.410 129.410 129.095 0.315 17967
134 1 . 1 1 30 30 LEU HA H 28 4.660 4.660 4.639 0.020 17967
135 1 . 1 1 30 30 LEU CA C 28 52.530 52.530 53.282 -0.753 17967
136 1 . 1 1 30 30 LEU CB C 28 48.330 48.330 45.469 2.861 17967
137 1 . 1 1 30 30 LEU H H 28 8.500 8.500 8.327 0.173 17967
138 1 . 1 1 31 31 GLU N N 29 121.910 121.910 121.126 0.784 17967
139 1 . 1 1 31 31 GLU HA H 29 4.680 4.680 4.768 -0.088 17967
140 1 . 1 1 31 31 GLU CA C 29 53.930 53.930 53.345 0.585 17967
141 1 . 1 1 31 31 GLU CB C 29 33.030 33.030 32.390 0.640 17967
142 1 . 1 1 31 31 GLU H H 29 8.860 8.860 8.234 0.626 17967
143 1 . 1 1 32 32 CYS N N 30 125.710 125.710 119.826 5.884 17967
144 1 . 1 1 32 32 CYS HA H 30 4.020 4.020 4.860 -0.840 17967
145 1 . 1 1 32 32 CYS CA C 30 58.230 58.230 59.783 -1.553 17967
146 1 . 1 1 32 32 CYS CB C 30 31.730 31.730 26.899 4.831 17967
147 1 . 1 1 32 32 CYS H H 30 8.270 8.270 8.528 -0.258 17967
148 1 . 1 1 33 33 VAL N N 31 132.310 132.310 127.415 4.895 17967
149 1 . 1 1 33 33 VAL HA H 31 3.100 3.100 2.985 0.115 17967
150 1 . 1 1 33 33 VAL CA C 31 64.230 64.230 65.142 -0.912 17967
151 1 . 1 1 33 33 VAL CB C 31 31.630 31.630 31.848 -0.218 17967
152 1 . 1 1 33 33 VAL H H 31 8.860 8.860 7.915 0.945 17967
153 1 . 1 1 34 34 TYR N N 32 124.310 124.310 115.913 8.397 17967
154 1 . 1 1 34 34 TYR HA H 32 4.440 4.440 4.538 -0.098 17967
155 1 . 1 1 34 34 TYR CA C 32 61.030 61.030 59.604 1.426 17967
156 1 . 1 1 34 34 TYR CB C 32 40.130 40.130 38.425 1.705 17967
157 1 . 1 1 34 34 TYR H H 32 8.590 8.590 7.249 1.341 17967
158 1 . 1 1 35 35 CYS N N 33 119.810 119.810 115.600 4.210 17967
159 1 . 1 1 35 35 CYS HA H 33 4.840 4.840 4.611 0.229 17967
160 1 . 1 1 35 35 CYS CA C 33 59.430 59.430 58.901 0.529 17967
161 1 . 1 1 35 35 CYS CB C 33 32.230 32.230 28.135 4.094 17967
162 1 . 1 1 35 35 CYS H H 33 8.070 8.070 7.813 0.257 17967
163 1 . 1 1 36 36 LYS N N 34 119.910 119.910 115.957 3.953 17967
164 1 . 1 1 36 36 LYS HA H 34 4.190 4.190 3.958 0.232 17967
165 1 . 1 1 36 36 LYS CA C 34 57.830 57.830 57.087 0.743 17967
166 1 . 1 1 36 36 LYS CB C 34 29.330 29.330 29.979 -0.649 17967
167 1 . 1 1 36 36 LYS H H 34 7.860 7.860 7.970 -0.110 17967
168 1 . 1 1 37 37 GLN N N 35 120.710 120.710 116.321 4.389 17967
169 1 . 1 1 37 37 GLN HA H 35 4.360 4.360 4.452 -0.092 17967
170 1 . 1 1 37 37 GLN CA C 35 55.430 55.430 54.257 1.173 17967
171 1 . 1 1 37 37 GLN CB C 35 29.630 29.630 29.902 -0.272 17967
172 1 . 1 1 37 37 GLN H H 35 8.270 8.270 7.830 0.440 17967
173 1 . 1 1 38 38 GLN N N 36 123.710 123.710 124.004 -0.294 17967
174 1 . 1 1 38 38 GLN HA H 36 4.300 4.300 4.176 0.124 17967
175 1 . 1 1 38 38 GLN CA C 36 56.730 56.730 56.494 0.236 17967
176 1 . 1 1 38 38 GLN CB C 36 29.330 29.330 28.954 0.376 17967
177 1 . 1 1 38 38 GLN H H 36 8.640 8.640 8.589 0.051 17967
178 1 . 1 1 39 39 LEU N N 37 131.310 131.310 126.733 4.577 17967
179 1 . 1 1 39 39 LEU HA H 37 4.110 4.110 4.168 -0.057 17967
180 1 . 1 1 39 39 LEU CA C 37 57.330 57.330 55.505 1.825 17967
181 1 . 1 1 39 39 LEU CB C 37 41.930 41.930 42.467 -0.536 17967
182 1 . 1 1 39 39 LEU H H 37 8.870 8.870 7.897 0.973 17967
183 1 . 1 1 40 40 LEU N N 38 126.310 126.310 124.226 2.084 17967
184 1 . 1 1 40 40 LEU HA H 38 4.310 4.310 4.300 0.010 17967
185 1 . 1 1 40 40 LEU CA C 38 54.230 54.230 54.751 -0.521 17967
186 1 . 1 1 40 40 LEU CB C 38 43.130 43.130 43.079 0.051 17967
187 1 . 1 1 40 40 LEU H H 38 9.850 9.850 8.407 1.443 17967
188 1 . 1 1 41 41 ARG N N 39 127.110 127.110 125.768 1.342 17967
189 1 . 1 1 41 41 ARG HA H 39 3.520 3.520 3.735 -0.215 17967
190 1 . 1 1 41 41 ARG CA C 39 57.830 57.830 59.523 -1.693 17967
191 1 . 1 1 41 41 ARG CB C 39 26.930 26.930 29.588 -2.658 17967
192 1 . 1 1 41 41 ARG H H 39 8.970 8.970 8.876 0.094 17967
193 1 . 1 1 42 42 ARG N N 40 115.810 115.810 118.098 -2.288 17967
194 1 . 1 1 42 42 ARG HA H 40 4.080 4.080 4.261 -0.181 17967
195 1 . 1 1 42 42 ARG CA C 40 59.130 59.130 59.473 -0.343 17967
196 1 . 1 1 42 42 ARG CB C 40 29.330 29.330 29.495 -0.165 17967
197 1 . 1 1 42 42 ARG H H 40 8.610 8.610 8.599 0.011 17967
198 1 . 1 1 43 43 GLU N N 41 119.910 119.910 119.028 0.882 17967
199 1 . 1 1 43 43 GLU HA H 41 4.250 4.250 4.463 -0.213 17967
200 1 . 1 1 43 43 GLU CA C 41 59.030 59.030 58.515 0.515 17967
201 1 . 1 1 43 43 GLU CB C 41 30.330 30.330 29.069 1.261 17967
202 1 . 1 1 43 43 GLU H H 41 6.950 6.950 7.909 -0.959 17967
203 1 . 1 1 44 44 VAL N N 42 125.010 125.010 120.176 4.834 17967
204 1 . 1 1 44 44 VAL HA H 42 3.240 3.240 3.603 -0.363 17967
205 1 . 1 1 44 44 VAL CA C 42 67.630 67.630 66.067 1.563 17967
206 1 . 1 1 44 44 VAL CB C 42 31.330 31.330 31.223 0.107 17967
207 1 . 1 1 44 44 VAL H H 42 7.820 7.820 7.952 -0.132 17967
208 1 . 1 1 45 45 TYR N N 43 118.410 118.410 118.874 -0.464 17967
209 1 . 1 1 45 45 TYR HA H 43 4.430 4.430 4.164 0.266 17967
210 1 . 1 1 45 45 TYR CA C 43 58.830 58.830 60.703 -1.873 17967
211 1 . 1 1 45 45 TYR CB C 43 36.730 36.730 37.326 -0.596 17967
212 1 . 1 1 45 45 TYR H H 43 7.820 7.820 8.056 -0.236 17967
213 1 . 1 1 46 46 ASP N N 44 122.410 122.410 120.041 2.369 17967
214 1 . 1 1 46 46 ASP HA H 44 4.600 4.600 4.338 0.262 17967
215 1 . 1 1 46 46 ASP CA C 44 57.830 57.830 57.949 -0.119 17967
216 1 . 1 1 46 46 ASP CB C 44 41.030 41.030 40.341 0.689 17967
217 1 . 1 1 46 46 ASP H H 44 8.540 8.540 8.064 0.476 17967
218 1 . 1 1 47 47 PHE N N 45 126.210 126.210 119.401 6.809 17967
219 1 . 1 1 47 47 PHE HA H 45 3.910 3.910 4.116 -0.206 17967
220 1 . 1 1 47 47 PHE CA C 45 62.630 62.630 61.925 0.705 17967
221 1 . 1 1 47 47 PHE CB C 45 39.330 39.330 39.118 0.212 17967
222 1 . 1 1 47 47 PHE H H 45 8.320 8.320 7.725 0.595 17967
223 1 . 1 1 48 48 ALA N N 46 119.110 119.110 119.361 -0.251 17967
224 1 . 1 1 48 48 ALA HA H 46 4.520 4.520 4.354 0.166 17967
225 1 . 1 1 48 48 ALA CA C 46 54.230 54.230 53.704 0.526 17967
226 1 . 1 1 48 48 ALA CB C 46 18.730 18.730 18.753 -0.023 17967
227 1 . 1 1 48 48 ALA H H 46 7.740 7.740 7.761 -0.021 17967
228 1 . 1 1 49 49 ARG N N 47 124.010 124.010 117.855 6.155 17967
229 1 . 1 1 49 49 ARG HA H 47 4.050 4.050 4.299 -0.249 17967
230 1 . 1 1 49 49 ARG CA C 47 59.630 59.630 57.283 2.347 17967
231 1 . 1 1 49 49 ARG CB C 47 30.430 30.430 30.454 -0.024 17967
232 1 . 1 1 49 49 ARG H H 47 8.500 8.500 8.285 0.214 17967
233 1 . 1 1 50 50 ARG N N 48 119.110 119.110 118.092 1.018 17967
234 1 . 1 1 50 50 ARG HA H 48 4.010 4.010 4.528 -0.518 17967
235 1 . 1 1 50 50 ARG CA C 48 57.130 57.130 54.799 2.331 17967
236 1 . 1 1 50 50 ARG CB C 48 31.130 31.130 32.011 -0.881 17967
237 1 . 1 1 50 50 ARG H H 48 7.940 7.940 7.819 0.120 17967
238 1 . 1 1 51 51 ASP N N 49 120.910 120.910 119.593 1.317 17967
239 1 . 1 1 51 51 ASP HA H 49 4.420 4.420 4.747 -0.327 17967
240 1 . 1 1 51 51 ASP CA C 49 54.530 54.530 53.703 0.827 17967
241 1 . 1 1 51 51 ASP CB C 49 39.930 39.930 40.615 -0.685 17967
242 1 . 1 1 51 51 ASP H H 49 7.950 7.950 8.404 -0.454 17967
243 1 . 1 1 52 52 LEU N N 50 118.410 118.410 122.132 -3.722 17967
244 1 . 1 1 52 52 LEU HA H 50 4.150 4.150 4.464 -0.315 17967
245 1 . 1 1 52 52 LEU CA C 50 54.230 54.230 53.933 0.297 17967
246 1 . 1 1 52 52 LEU CB C 50 41.130 41.130 43.279 -2.149 17967
247 1 . 1 1 52 52 LEU H H 50 6.640 6.640 7.478 -0.838 17967
248 1 . 1 1 53 53 CYS N N 51 117.410 117.410 117.309 0.101 17967
249 1 . 1 1 53 53 CYS HA H 51 4.930 4.930 5.157 -0.228 17967
250 1 . 1 1 53 53 CYS CA C 51 58.930 58.930 56.196 2.734 17967
251 1 . 1 1 53 53 CYS CB C 51 28.630 28.630 30.325 -1.695 17967
252 1 . 1 1 53 53 CYS H H 51 8.030 8.030 8.102 -0.072 17967
253 1 . 1 1 54 54 ILE N N 52 125.110 125.110 123.054 2.057 17967
254 1 . 1 1 54 54 ILE HA H 52 4.010 4.010 4.345 -0.335 17967
255 1 . 1 1 54 54 ILE CA C 52 59.630 59.630 61.923 -2.293 17967
256 1 . 1 1 54 54 ILE CB C 52 37.330 37.330 38.994 -1.664 17967
257 1 . 1 1 54 54 ILE H H 52 8.500 8.500 8.818 -0.318 17967
258 1 . 1 1 55 55 VAL N N 53 127.010 127.010 122.849 4.161 17967
259 1 . 1 1 55 55 VAL HA H 53 4.370 4.370 4.638 -0.268 17967
260 1 . 1 1 55 55 VAL CA C 53 60.630 60.630 60.267 0.363 17967
261 1 . 1 1 55 55 VAL CB C 53 34.230 34.230 32.540 1.690 17967
262 1 . 1 1 55 55 VAL H H 53 8.130 8.130 8.168 -0.038 17967
263 1 . 1 1 56 56 TYR N N 54 124.910 124.910 126.799 -1.889 17967
264 1 . 1 1 56 56 TYR HA H 54 5.400 5.400 5.271 0.129 17967
265 1 . 1 1 56 56 TYR CA C 54 57.330 57.330 57.562 -0.233 17967
266 1 . 1 1 56 56 TYR CB C 54 41.030 41.030 39.444 1.586 17967
267 1 . 1 1 56 56 TYR H H 54 8.700 8.700 8.657 0.043 17967
268 1 . 1 1 57 57 ARG N N 55 123.810 123.810 125.397 -1.587 17967
269 1 . 1 1 57 57 ARG HA H 55 4.640 4.640 4.396 0.244 17967
270 1 . 1 1 57 57 ARG CA C 55 55.430 55.430 55.767 -0.337 17967
271 1 . 1 1 57 57 ARG CB C 55 32.830 32.830 30.379 2.451 17967
272 1 . 1 1 57 57 ARG H H 55 8.870 8.870 8.418 0.452 17967
273 1 . 1 1 58 58 ASP N N 56 129.110 129.110 125.202 3.908 17967
274 1 . 1 1 58 58 ASP HA H 56 4.310 4.310 4.309 0.001 17967
275 1 . 1 1 58 58 ASP CA C 56 55.830 55.830 56.699 -0.869 17967
276 1 . 1 1 58 58 ASP CB C 56 40.130 40.130 40.211 -0.081 17967
277 1 . 1 1 58 58 ASP H H 56 9.620 9.620 8.986 0.635 17967
278 1 . 1 1 59 59 GLY N N 57 104.510 104.510 107.122 -2.612 17967
279 1 . 1 1 59 59 GLY CA C 57 45.630 45.630 45.217 0.413 17967
280 1 . 1 1 59 59 GLY H H 57 8.720 8.720 8.384 0.336 17967
281 1 . 1 1 60 60 ASN N N 58 122.210 122.210 119.133 3.077 17967
282 1 . 1 1 60 60 ASN HA H 58 5.400 5.400 5.249 0.151 17967
283 1 . 1 1 60 60 ASN CA C 58 50.330 50.330 50.815 -0.485 17967
284 1 . 1 1 60 60 ASN CB C 58 40.430 40.430 40.995 -0.565 17967
285 1 . 1 1 60 60 ASN H H 58 8.120 8.120 7.956 0.164 17967
286 1 . 1 1 61 61 PRO HA H 59 3.790 3.790 3.613 0.177 17967
287 1 . 1 1 61 61 PRO CA C 59 62.030 62.030 62.394 -0.364 17967
288 1 . 1 1 61 61 PRO CB C 59 33.530 33.530 31.236 2.294 17967
289 1 . 1 1 62 62 TYR N N 60 119.810 119.810 122.570 -2.760 17967
290 1 . 1 1 62 62 TYR HA H 60 4.360 4.360 4.528 -0.168 17967
291 1 . 1 1 62 62 TYR CA C 60 58.230 58.230 56.388 1.842 17967
292 1 . 1 1 62 62 TYR CB C 60 43.430 43.430 42.481 0.949 17967
293 1 . 1 1 62 62 TYR H H 60 8.590 8.590 7.643 0.947 17967
294 1 . 1 1 63 63 ALA N N 61 123.810 123.810 121.766 2.044 17967
295 1 . 1 1 63 63 ALA HA H 61 4.420 4.420 4.176 0.244 17967
296 1 . 1 1 63 63 ALA CA C 61 49.330 49.330 49.343 -0.013 17967
297 1 . 1 1 63 63 ALA CB C 61 20.330 20.330 20.707 -0.377 17967
298 1 . 1 1 63 63 ALA H H 61 8.010 8.010 8.808 -0.798 17967
299 1 . 1 1 64 64 VAL N N 62 120.510 120.510 118.016 2.494 17967
300 1 . 1 1 64 64 VAL HA H 62 5.500 5.500 4.287 1.213 17967
301 1 . 1 1 64 64 VAL CA C 62 61.230 61.230 61.373 -0.143 17967
302 1 . 1 1 64 64 VAL CB C 62 36.330 36.330 33.052 3.278 17967
303 1 . 1 1 64 64 VAL H H 62 6.380 6.380 8.407 -2.027 17967
304 1 . 1 1 65 65 CYS N N 63 130.310 130.310 125.462 4.848 17967
305 1 . 1 1 65 65 CYS HA H 63 4.560 4.560 4.428 0.132 17967
306 1 . 1 1 65 65 CYS CA C 63 58.430 58.430 58.355 0.075 17967
307 1 . 1 1 65 65 CYS CB C 63 31.130 31.130 29.145 1.985 17967
308 1 . 1 1 65 65 CYS H H 63 9.430 9.430 8.255 1.175 17967
309 1 . 1 1 66 66 ASP N N 64 121.110 121.110 120.959 0.151 17967
310 1 . 1 1 66 66 ASP HA H 64 4.410 4.410 4.274 0.136 17967
311 1 . 1 1 66 66 ASP CA C 64 58.230 58.230 58.214 0.016 17967
312 1 . 1 1 66 66 ASP CB C 64 42.330 42.330 40.941 1.389 17967
313 1 . 1 1 66 66 ASP H H 64 9.120 9.120 8.808 0.313 17967
314 1 . 1 1 67 67 LYS N N 65 122.110 122.110 119.044 3.066 17967
315 1 . 1 1 67 67 LYS HA H 65 4.010 4.010 3.940 0.070 17967
316 1 . 1 1 67 67 LYS CA C 65 60.130 60.130 58.636 1.494 17967
317 1 . 1 1 67 67 LYS CB C 65 32.830 32.830 32.214 0.617 17967
318 1 . 1 1 67 67 LYS H H 65 8.330 8.330 7.709 0.621 17967
319 1 . 1 1 68 68 CYS N N 66 125.610 125.610 118.967 6.643 17967
320 1 . 1 1 68 68 CYS HA H 66 4.110 4.110 4.213 -0.103 17967
321 1 . 1 1 68 68 CYS CA C 66 63.530 63.530 62.374 1.156 17967
322 1 . 1 1 68 68 CYS CB C 66 30.730 30.730 26.277 4.453 17967
323 1 . 1 1 68 68 CYS H H 66 8.700 8.700 7.634 1.066 17967
324 1 . 1 1 69 69 LEU N N 67 125.310 125.310 121.172 4.138 17967
325 1 . 1 1 69 69 LEU HA H 67 4.000 4.000 4.024 -0.024 17967
326 1 . 1 1 69 69 LEU CA C 67 58.530 58.530 58.372 0.158 17967
327 1 . 1 1 69 69 LEU CB C 67 42.130 42.130 41.802 0.328 17967
328 1 . 1 1 69 69 LEU H H 67 8.470 8.470 8.687 -0.217 17967
329 1 . 1 1 70 70 LYS N N 68 119.010 119.010 117.950 1.060 17967
330 1 . 1 1 70 70 LYS HA H 68 3.980 3.980 4.138 -0.158 17967
331 1 . 1 1 70 70 LYS CA C 68 58.830 58.830 58.401 0.429 17967
332 1 . 1 1 70 70 LYS CB C 68 32.130 32.130 31.824 0.306 17967
333 1 . 1 1 70 70 LYS H H 68 7.810 7.810 7.468 0.342 17967
334 1 . 1 1 71 71 PHE N N 69 121.710 121.710 118.619 3.091 17967
335 1 . 1 1 71 71 PHE HA H 69 4.280 4.280 4.145 0.135 17967
336 1 . 1 1 71 71 PHE CA C 69 59.930 59.930 59.640 0.290 17967
337 1 . 1 1 71 71 PHE CB C 69 39.430 39.430 38.816 0.614 17967
338 1 . 1 1 71 71 PHE H H 69 7.810 7.810 7.357 0.454 17967
339 1 . 1 1 72 72 TYR N N 70 120.110 120.110 116.835 3.275 17967
340 1 . 1 1 72 72 TYR HA H 70 4.320 4.320 4.664 -0.344 17967
341 1 . 1 1 72 72 TYR CA C 70 60.330 60.330 57.883 2.447 17967
342 1 . 1 1 72 72 TYR CB C 70 40.430 40.430 37.594 2.836 17967
343 1 . 1 1 72 72 TYR H H 70 8.280 8.280 8.601 -0.322 17967
344 1 . 1 1 73 73 SER N N 71 117.210 117.210 117.025 0.185 17967
345 1 . 1 1 73 73 SER HA H 71 4.320 4.320 4.383 -0.063 17967
346 1 . 1 1 73 73 SER CA C 71 60.130 60.130 60.334 -0.204 17967
347 1 . 1 1 73 73 SER CB C 71 63.630 63.630 63.422 0.208 17967
348 1 . 1 1 73 73 SER H H 71 7.870 7.870 8.277 -0.407 17967
349 1 . 1 1 74 74 LYS N N 72 122.810 122.810 122.138 0.672 17967
350 1 . 1 1 74 74 LYS HA H 72 4.270 4.270 4.202 0.068 17967
351 1 . 1 1 74 74 LYS CA C 72 56.930 56.930 57.596 -0.666 17967
352 1 . 1 1 74 74 LYS CB C 72 32.630 32.630 32.594 0.036 17967
353 1 . 1 1 74 74 LYS H H 72 7.800 7.800 8.123 -0.323 17967
354 1 . 1 1 75 75 ILE N N 73 121.610 121.610 118.717 2.893 17967
355 1 . 1 1 75 75 ILE HA H 73 4.110 4.110 4.136 -0.026 17967
356 1 . 1 1 75 75 ILE CA C 73 61.830 61.830 62.445 -0.615 17967
357 1 . 1 1 75 75 ILE CB C 73 38.630 38.630 37.460 1.170 17967
358 1 . 1 1 75 75 ILE H H 73 7.750 7.750 7.918 -0.168 17967
359 1 . 1 1 76 76 SER N N 74 120.410 120.410 118.052 2.358 17967
360 1 . 1 1 76 76 SER HA H 74 4.300 4.300 4.528 -0.228 17967
361 1 . 1 1 76 76 SER CA C 74 59.330 59.330 59.681 -0.351 17967
362 1 . 1 1 76 76 SER CB C 74 63.830 63.830 63.999 -0.169 17967
363 1 . 1 1 76 76 SER H H 74 8.130 8.130 8.311 -0.181 17967
364 1 . 1 1 77 77 GLU N N 75 123.810 123.810 121.731 2.079 17967
365 1 . 1 1 77 77 GLU HA H 75 4.190 4.190 4.439 -0.249 17967
366 1 . 1 1 77 77 GLU CA C 75 57.330 57.330 56.309 1.021 17967
367 1 . 1 1 77 77 GLU CB C 75 30.130 30.130 30.150 -0.020 17967
368 1 . 1 1 77 77 GLU H H 75 8.270 8.270 8.200 0.070 17967
369 1 . 1 1 78 78 TYR N N 76 122.410 122.410 122.809 -0.399 17967
370 1 . 1 1 78 78 TYR HA H 76 4.460 4.460 4.543 -0.083 17967
371 1 . 1 1 78 78 TYR CA C 76 58.130 58.130 58.438 -0.308 17967
372 1 . 1 1 78 78 TYR CB C 76 38.630 38.630 39.219 -0.589 17967
373 1 . 1 1 78 78 TYR H H 76 7.980 7.980 8.184 -0.204 17967
374 1 . 1 1 79 79 ARG N N 77 124.710 124.710 125.394 -0.684 17967
375 1 . 1 1 79 79 ARG HA H 77 4.200 4.200 4.676 -0.476 17967
376 1 . 1 1 79 79 ARG CA C 77 56.030 56.030 55.427 0.603 17967
377 1 . 1 1 79 79 ARG CB C 77 31.030 31.030 30.369 0.661 17967
378 1 . 1 1 79 79 ARG H H 77 7.880 7.880 8.526 -0.646 17967
379 1 . 1 1 80 80 HIS N N 78 122.110 122.110 118.843 3.267 17967
380 1 . 1 1 80 80 HIS HA H 78 4.510 4.510 4.611 -0.101 17967
381 1 . 1 1 80 80 HIS CA C 78 56.330 56.330 55.660 0.670 17967
382 1 . 1 1 80 80 HIS CB C 78 30.830 30.830 29.026 1.804 17967
383 1 . 1 1 80 80 HIS H H 78 8.120 8.120 8.305 -0.185 17967
384 1 . 1 1 81 81 TYR N N 79 123.610 123.610 121.414 2.196 17967
385 1 . 1 1 81 81 TYR HA H 79 4.590 4.590 4.466 0.124 17967
386 1 . 1 1 81 81 TYR CA C 79 57.830 57.830 57.735 0.095 17967
387 1 . 1 1 81 81 TYR CB C 79 39.130 39.130 39.125 0.005 17967
388 1 . 1 1 81 81 TYR H H 79 7.970 7.970 7.989 -0.019 17967
stop_
save_